NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
633133 |
6e5k   |
30499 | cing | 3-converted-DOCR | STAR | entry | full | 468 |
data_DOCR_restraints_with_modified_coordinates_PDB_code_6e5k
# This DOCR archive file contains, for PDB entry <6e5k>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process, minor modifications could
# have occurred to the NMR restraints information, or data could have been lost
# because of parsing or conversion errors. The PDB file remains the
# authoritative reference for the atomic coordinates and the originally deposited
# restraints files remain the primary reference for these data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID rr_6e5k
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 6e5k"
_Entry.Version_type original
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Details "Contains the remediated restraint lists and coordinates for PDB entry 6e5k"
_Entry.PDB_coordinate_file_version 3.20
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 6e5k "Master copy" rr_6e5k
stop_
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_6e5k
_Assembly.ID 1
_Assembly.Name 6e5k
_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 3150.6711
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 "Designed peptide NC HEE D1 Aib turn Aib helix N methyl hairpin" 1 $Designed_peptide_NC_HEE_D1__Aib_turn__Aib_helix__N_methyl_hairpin A . no . . . . . . rr_6e5k 1
stop_
save_
save_Designed_peptide_NC_HEE_D1__Aib_turn__Aib_helix__N_methyl_hairpin
_Entity.Sf_category entity
_Entity.Sf_framecode Designed_peptide_NC_HEE_D1__Aib_turn__Aib_helix__N_methyl_hairpin
_Entity.Entry_ID rr_6e5k
_Entity.ID 1
_Entity.Name Designed_peptide_NC_HEE_D1__Aib_turn__Aib_helix__N_methyl_hairpin
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code
;NDACKALKARYAGCEVRCDP
PRYEVHCX
;
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer yes
_Entity.Nstd_chirality yes
_Entity.Nstd_linkage yes
_Entity.Number_of_monomers 28
_Entity.Paramagnetic no
_Entity.Thiol_state "all free"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 3150.6711
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 . ASN . rr_6e5k 1
2 . ASP . rr_6e5k 1
3 . ABA . rr_6e5k 1
4 . CYS . rr_6e5k 1
5 . LYS . rr_6e5k 1
6 . ABA . rr_6e5k 1
7 . LEU . rr_6e5k 1
8 . LYS . rr_6e5k 1
9 . ABA . rr_6e5k 1
10 . ARG . rr_6e5k 1
11 . TYR . rr_6e5k 1
12 . ABA . rr_6e5k 1
13 . GLY . rr_6e5k 1
14 . CYS . rr_6e5k 1
15 . GLU . rr_6e5k 1
16 . MVA . rr_6e5k 1
17 . ARG . rr_6e5k 1
18 . CYS . rr_6e5k 1
19 . ASP . rr_6e5k 1
20 . DPR . rr_6e5k 1
21 . PRO . rr_6e5k 1
22 . ARG . rr_6e5k 1
23 . TYR . rr_6e5k 1
24 . GLU . rr_6e5k 1
25 . MVA . rr_6e5k 1
26 . HIS . rr_6e5k 1
27 . CYS . rr_6e5k 1
28 . NH2 . rr_6e5k 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
. ASN 1 1 rr_6e5k 1
. ASP 2 2 rr_6e5k 1
. ABA 3 3 rr_6e5k 1
. CYS 4 4 rr_6e5k 1
. LYS 5 5 rr_6e5k 1
. ABA 6 6 rr_6e5k 1
. LEU 7 7 rr_6e5k 1
. LYS 8 8 rr_6e5k 1
. ABA 9 9 rr_6e5k 1
. ARG 10 10 rr_6e5k 1
. TYR 11 11 rr_6e5k 1
. ABA 12 12 rr_6e5k 1
. GLY 13 13 rr_6e5k 1
. CYS 14 14 rr_6e5k 1
. GLU 15 15 rr_6e5k 1
. MVA 16 16 rr_6e5k 1
. ARG 17 17 rr_6e5k 1
. CYS 18 18 rr_6e5k 1
. ASP 19 19 rr_6e5k 1
. DPR 20 20 rr_6e5k 1
. PRO 21 21 rr_6e5k 1
. ARG 22 22 rr_6e5k 1
. TYR 23 23 rr_6e5k 1
. GLU 24 24 rr_6e5k 1
. MVA 25 25 rr_6e5k 1
. HIS 26 26 rr_6e5k 1
. CYS 27 27 rr_6e5k 1
. NH2 28 28 rr_6e5k 1
stop_
save_
save_chem_comp_ABA
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_ABA
_Chem_comp.Entry_ID rr_6e5k
_Chem_comp.ID ABA
_Chem_comp.Name "ALPHA-AMINOBUTYRIC ACID"
_Chem_comp.Type "L-peptide linking"
_Chem_comp.PDB_code ABA
_Chem_comp.Std_deriv_one_letter_code A
_Chem_comp.Std_deriv_three_letter_code Ala
_Chem_comp.Std_deriv_PDB_code ALA
_Chem_comp.Std_deriv_chem_comp_name ALANINE
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "C4 H7 N O"
_Chem_comp.Formula_weight 85.1054
loop_
_Chem_comp_common_name.Name
_Chem_comp_common_name.Type
_Chem_comp_common_name.Entry_ID
_Chem_comp_common_name.Comp_ID
"(2R)-2-aminobutanoic acid" name rr_6e5k ABA
stop_
save_
save_chem_comp_MVA
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_MVA
_Chem_comp.Entry_ID rr_6e5k
_Chem_comp.ID MVA
_Chem_comp.Name N-METHYLVALINE
_Chem_comp.Type "L-peptide linking"
_Chem_comp.PDB_code MVA
_Chem_comp.Std_deriv_one_letter_code V
_Chem_comp.Std_deriv_three_letter_code Val
_Chem_comp.Std_deriv_PDB_code VAL
_Chem_comp.Std_deriv_chem_comp_name VALINE
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "C6 H11 N O"
_Chem_comp.Formula_weight 113.159
loop_
_Chem_comp_common_name.Name
_Chem_comp_common_name.Type
_Chem_comp_common_name.Entry_ID
_Chem_comp_common_name.Comp_ID
N-methyl-L-valine name rr_6e5k MVA
stop_
save_
save_chem_comp_DPR
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_DPR
_Chem_comp.Entry_ID rr_6e5k
_Chem_comp.ID DPR
_Chem_comp.Name D-proline
_Chem_comp.Type "L-peptide linking"
_Chem_comp.PDB_code DPR
_Chem_comp.Std_deriv_one_letter_code P
_Chem_comp.Std_deriv_three_letter_code Pro
_Chem_comp.Std_deriv_PDB_code PRO
_Chem_comp.Std_deriv_chem_comp_name PROLINE
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "C5 H7 N O"
_Chem_comp.Formula_weight 97.1164
loop_
_Chem_comp_common_name.Name
_Chem_comp_common_name.Type
_Chem_comp_common_name.Entry_ID
_Chem_comp_common_name.Comp_ID
L-proline name rr_6e5k DPR
stop_
save_
save_chem_comp_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_NH2
_Chem_comp.Entry_ID rr_6e5k
_Chem_comp.ID NH2
_Chem_comp.Name "AMINO GROUP"
_Chem_comp.Type non-polymer
_Chem_comp.PDB_code NH2
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "H2 N"
_Chem_comp.Formula_weight 16.0225
save_
save_conformer_statistics
_Conformer_stat_list.Sf_category conformer_statistics
_Conformer_stat_list.Sf_framecode conformer_statistics
_Conformer_stat_list.Entry_ID rr_6e5k
_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 10
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_6e5k
_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_6e5k 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_6e5k 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 ASN C C 8.993 -9.200 -2.084 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . rr_6e5k 1
. 1 . 2 . 1 1 1 ASN CA C 8.770 -10.660 -1.720 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . rr_6e5k 1
. 1 . 3 . 1 1 1 ASN CB C 8.906 -10.851 -0.202 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . rr_6e5k 1
. 1 . 4 . 1 1 1 ASN CG C 10.271 -10.452 0.327 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . rr_6e5k 1
. 1 . 5 . 1 1 1 ASN H1 H 9.622 -11.387 -3.471 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . rr_6e5k 1
. 1 . 6 . 1 1 1 ASN H2 H 9.574 -12.514 -2.213 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . rr_6e5k 1
. 1 . 7 . 1 1 1 ASN H3 H 10.707 -11.259 -2.183 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . rr_6e5k 1
. 1 . 8 . 1 1 1 ASN HA H 7.774 -10.943 -2.024 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . rr_6e5k 1
. 1 . 9 . 1 1 1 ASN HB2 H 8.160 -10.255 0.297 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . rr_6e5k 1
. 1 . 10 . 1 1 1 ASN HB3 H 8.740 -11.893 0.036 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . rr_6e5k 1
. 1 . 11 . 1 1 1 ASN HD21 H 9.455 -9.825 2.028 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . rr_6e5k 1
. 1 . 12 . 1 1 1 ASN HD22 H 11.174 -9.664 1.911 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . rr_6e5k 1
. 1 . 13 . 1 1 1 ASN N N 9.734 -11.516 -2.445 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . rr_6e5k 1
. 1 . 14 . 1 1 1 ASN ND2 N 10.305 -9.928 1.543 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . rr_6e5k 1
. 1 . 15 . 1 1 1 ASN O O 9.986 -8.861 -2.729 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . rr_6e5k 1
. 1 . 16 . 1 1 1 ASN OD1 O 11.286 -10.607 -0.352 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . rr_6e5k 1
. 1 . 17 . 1 1 2 ASP C C 7.221 -6.162 -1.020 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . rr_6e5k 1
. 1 . 18 . 1 1 2 ASP CA C 8.138 -6.920 -1.969 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . rr_6e5k 1
. 1 . 19 . 1 1 2 ASP CB C 7.729 -6.650 -3.420 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . rr_6e5k 1
. 1 . 20 . 1 1 2 ASP CG C 7.876 -5.194 -3.813 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . rr_6e5k 1
. 1 . 21 . 1 1 2 ASP H H 7.307 -8.675 -1.151 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . rr_6e5k 1
. 1 . 22 . 1 1 2 ASP HA H 9.155 -6.592 -1.816 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . rr_6e5k 1
. 1 . 23 . 1 1 2 ASP HB2 H 8.347 -7.244 -4.077 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . rr_6e5k 1
. 1 . 24 . 1 1 2 ASP HB3 H 6.697 -6.936 -3.553 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . rr_6e5k 1
. 1 . 25 . 1 1 2 ASP N N 8.065 -8.343 -1.676 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . rr_6e5k 1
. 1 . 26 . 1 1 2 ASP O O 6.093 -6.595 -0.776 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . rr_6e5k 1
. 1 . 27 . 1 1 2 ASP OD1 O 6.978 -4.391 -3.490 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . rr_6e5k 1
. 1 . 28 . 1 1 2 ASP OD2 O 8.888 -4.846 -4.455 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . rr_6e5k 1
. 1 . 29 . 1 1 3 ABA C C 5.583 -3.873 -0.061 . . . 1.0 . . . . . . . . . . . . A . 3 AIB C . . . . . . . . . rr_6e5k 1
. 1 . 30 . 1 1 3 ABA CA C 6.968 -4.235 0.491 . . . 1.0 . . . . . . . . . . . . A . 3 AIB CA . . . . . . . . . rr_6e5k 1
. 1 . 31 . 1 1 3 ABA H H 8.615 -4.759 -0.743 . . . 1.0 . . . . . . . . . . . . A . 3 AIB H . . . . . . . . . rr_6e5k 1
. 1 . 32 . 1 1 3 ABA N N 7.715 -5.046 -0.484 . . . 1.0 . . . . . . . . . . . . A . 3 AIB N . . . . . . . . . rr_6e5k 1
. 1 . 33 . 1 1 3 ABA O O 4.557 -4.109 0.587 . . . 1.0 . . . . . . . . . . . . A . 3 AIB O . . . . . . . . . rr_6e5k 1
. 1 . 34 . 1 1 4 CYS C C 3.400 -4.052 -2.173 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . rr_6e5k 1
. 1 . 35 . 1 1 4 CYS CA C 4.308 -2.869 -1.866 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . rr_6e5k 1
. 1 . 36 . 1 1 4 CYS CB C 4.572 -2.055 -3.135 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . rr_6e5k 1
. 1 . 37 . 1 1 4 CYS H H 6.390 -3.240 -1.780 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . rr_6e5k 1
. 1 . 38 . 1 1 4 CYS HA H 3.815 -2.237 -1.145 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . rr_6e5k 1
. 1 . 39 . 1 1 4 CYS HB2 H 5.168 -1.192 -2.881 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . rr_6e5k 1
. 1 . 40 . 1 1 4 CYS HB3 H 5.116 -2.664 -3.837 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . rr_6e5k 1
. 1 . 41 . 1 1 4 CYS N N 5.555 -3.324 -1.269 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . rr_6e5k 1
. 1 . 42 . 1 1 4 CYS O O 2.180 -3.937 -2.108 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . rr_6e5k 1
. 1 . 43 . 1 1 4 CYS SG S 3.060 -1.460 -3.965 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . rr_6e5k 1
. 1 . 44 . 1 1 5 LYS C C 2.536 -6.858 -1.463 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_6e5k 1
. 1 . 45 . 1 1 5 LYS CA C 3.241 -6.410 -2.738 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_6e5k 1
. 1 . 46 . 1 1 5 LYS CB C 4.167 -7.518 -3.251 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_6e5k 1
. 1 . 47 . 1 1 5 LYS CD C 2.430 -8.865 -4.505 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_6e5k 1
. 1 . 48 . 1 1 5 LYS CE C 1.821 -10.248 -4.701 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_6e5k 1
. 1 . 49 . 1 1 5 LYS CG C 3.492 -8.876 -3.415 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_6e5k 1
. 1 . 50 . 1 1 5 LYS H H 4.982 -5.213 -2.555 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_6e5k 1
. 1 . 51 . 1 1 5 LYS HA H 2.500 -6.189 -3.487 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_6e5k 1
. 1 . 52 . 1 1 5 LYS HB2 H 4.561 -7.221 -4.211 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_6e5k 1
. 1 . 53 . 1 1 5 LYS HB3 H 4.987 -7.632 -2.557 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_6e5k 1
. 1 . 54 . 1 1 5 LYS HD2 H 1.647 -8.177 -4.226 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_6e5k 1
. 1 . 55 . 1 1 5 LYS HD3 H 2.882 -8.544 -5.432 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_6e5k 1
. 1 . 56 . 1 1 5 LYS HE2 H 1.120 -10.205 -5.522 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_6e5k 1
. 1 . 57 . 1 1 5 LYS HE3 H 2.612 -10.944 -4.942 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_6e5k 1
. 1 . 58 . 1 1 5 LYS HG2 H 4.240 -9.610 -3.670 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_6e5k 1
. 1 . 59 . 1 1 5 LYS HG3 H 3.027 -9.146 -2.478 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_6e5k 1
. 1 . 60 . 1 1 5 LYS HZ1 H 0.373 -10.047 -3.211 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 1 . 61 . 1 1 5 LYS HZ2 H 1.779 -10.835 -2.696 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 1 . 62 . 1 1 5 LYS HZ3 H 0.664 -11.647 -3.670 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 1 . 63 . 1 1 5 LYS N N 4.001 -5.191 -2.489 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_6e5k 1
. 1 . 64 . 1 1 5 LYS NZ N 1.111 -10.726 -3.484 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_6e5k 1
. 1 . 65 . 1 1 5 LYS O O 1.344 -7.178 -1.483 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_6e5k 1
. 1 . 66 . 1 1 6 ABA C C 1.579 -6.342 1.312 . . . 1.0 . . . . . . . . . . . . A . 6 AIB C . . . . . . . . . rr_6e5k 1
. 1 . 67 . 1 1 6 ABA CA C 2.758 -7.251 0.950 . . . 1.0 . . . . . . . . . . . . A . 6 AIB CA . . . . . . . . . rr_6e5k 1
. 1 . 68 . 1 1 6 ABA H H 4.224 -6.577 -0.427 . . . 1.0 . . . . . . . . . . . . A . 6 AIB H . . . . . . . . . rr_6e5k 1
. 1 . 69 . 1 1 6 ABA N N 3.283 -6.858 -0.360 . . . 1.0 . . . . . . . . . . . . A . 6 AIB N . . . . . . . . . rr_6e5k 1
. 1 . 70 . 1 1 6 ABA O O 0.507 -6.815 1.711 . . . 1.0 . . . . . . . . . . . . A . 6 AIB O . . . . . . . . . rr_6e5k 1
. 1 . 71 . 1 1 7 LEU C C -0.448 -4.230 0.559 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . rr_6e5k 1
. 1 . 72 . 1 1 7 LEU CA C 0.758 -4.055 1.467 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . rr_6e5k 1
. 1 . 73 . 1 1 7 LEU CB C 1.303 -2.632 1.325 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . rr_6e5k 1
. 1 . 74 . 1 1 7 LEU CD1 C 2.981 -0.879 1.932 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . rr_6e5k 1
. 1 . 75 . 1 1 7 LEU CD2 C 2.145 -2.441 3.684 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . rr_6e5k 1
. 1 . 76 . 1 1 7 LEU CG C 2.503 -2.293 2.213 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . rr_6e5k 1
. 1 . 77 . 1 1 7 LEU H H 2.655 -4.729 0.807 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . rr_6e5k 1
. 1 . 78 . 1 1 7 LEU HA H 0.448 -4.216 2.489 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . rr_6e5k 1
. 1 . 79 . 1 1 7 LEU HB2 H 1.591 -2.485 0.295 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . rr_6e5k 1
. 1 . 80 . 1 1 7 LEU HB3 H 0.508 -1.943 1.556 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . rr_6e5k 1
. 1 . 81 . 1 1 7 LEU HD11 H 3.829 -0.655 2.561 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . rr_6e5k 1
. 1 . 82 . 1 1 7 LEU HD12 H 2.182 -0.184 2.141 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . rr_6e5k 1
. 1 . 83 . 1 1 7 LEU HD13 H 3.268 -0.795 0.894 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . rr_6e5k 1
. 1 . 84 . 1 1 7 LEU HD21 H 1.847 -3.458 3.884 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . rr_6e5k 1
. 1 . 85 . 1 1 7 LEU HD22 H 1.331 -1.773 3.923 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . rr_6e5k 1
. 1 . 86 . 1 1 7 LEU HD23 H 3.004 -2.190 4.289 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . rr_6e5k 1
. 1 . 87 . 1 1 7 LEU HG H 3.314 -2.973 1.991 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . rr_6e5k 1
. 1 . 88 . 1 1 7 LEU N N 1.785 -5.038 1.150 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . rr_6e5k 1
. 1 . 89 . 1 1 7 LEU O O -1.585 -4.177 1.013 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . rr_6e5k 1
. 1 . 90 . 1 1 8 LYS C C -2.140 -5.797 -1.307 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . rr_6e5k 1
. 1 . 91 . 1 1 8 LYS CA C -1.244 -4.634 -1.702 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . rr_6e5k 1
. 1 . 92 . 1 1 8 LYS CB C -0.632 -4.875 -3.084 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . rr_6e5k 1
. 1 . 93 . 1 1 8 LYS CD C -0.979 -5.421 -5.515 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . rr_6e5k 1
. 1 . 94 . 1 1 8 LYS CE C -0.174 -4.253 -6.075 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . rr_6e5k 1
. 1 . 95 . 1 1 8 LYS CG C -1.654 -5.069 -4.195 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . rr_6e5k 1
. 1 . 96 . 1 1 8 LYS H H 0.749 -4.493 -1.013 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . rr_6e5k 1
. 1 . 97 . 1 1 8 LYS HA H -1.833 -3.733 -1.728 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . rr_6e5k 1
. 1 . 98 . 1 1 8 LYS HB2 H -0.013 -4.028 -3.338 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . rr_6e5k 1
. 1 . 99 . 1 1 8 LYS HB3 H -0.010 -5.758 -3.039 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . rr_6e5k 1
. 1 . 100 . 1 1 8 LYS HD2 H -0.314 -6.255 -5.353 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . rr_6e5k 1
. 1 . 101 . 1 1 8 LYS HD3 H -1.739 -5.699 -6.231 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . rr_6e5k 1
. 1 . 102 . 1 1 8 LYS HE2 H 0.476 -3.874 -5.302 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . rr_6e5k 1
. 1 . 103 . 1 1 8 LYS HE3 H 0.423 -4.608 -6.903 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . rr_6e5k 1
. 1 . 104 . 1 1 8 LYS HG2 H -2.324 -5.869 -3.919 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . rr_6e5k 1
. 1 . 105 . 1 1 8 LYS HG3 H -2.215 -4.153 -4.319 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . rr_6e5k 1
. 1 . 106 . 1 1 8 LYS HZ1 H -1.641 -3.479 -7.342 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 1 . 107 . 1 1 8 LYS HZ2 H -0.475 -2.347 -6.875 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 1 . 108 . 1 1 8 LYS HZ3 H -1.671 -2.827 -5.784 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 1 . 109 . 1 1 8 LYS N N -0.187 -4.451 -0.719 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . rr_6e5k 1
. 1 . 110 . 1 1 8 LYS NZ N -1.050 -3.150 -6.551 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . rr_6e5k 1
. 1 . 111 . 1 1 8 LYS O O -3.357 -5.645 -1.227 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . rr_6e5k 1
. 1 . 112 . 1 1 9 ABA C C -2.995 -7.903 0.676 . . . 1.0 . . . . . . . . . . . . A . 9 AIB C . . . . . . . . . rr_6e5k 1
. 1 . 113 . 1 1 9 ABA CA C -2.233 -8.154 -0.629 . . . 1.0 . . . . . . . . . . . . A . 9 AIB CA . . . . . . . . . rr_6e5k 1
. 1 . 114 . 1 1 9 ABA H H -0.536 -6.966 -1.089 . . . 1.0 . . . . . . . . . . . . A . 9 AIB H . . . . . . . . . rr_6e5k 1
. 1 . 115 . 1 1 9 ABA N N -1.516 -6.938 -1.027 . . . 1.0 . . . . . . . . . . . . A . 9 AIB N . . . . . . . . . rr_6e5k 1
. 1 . 116 . 1 1 9 ABA O O -4.111 -8.394 0.859 . . . 1.0 . . . . . . . . . . . . A . 9 AIB O . . . . . . . . . rr_6e5k 1
. 1 . 117 . 1 1 10 ARG C C -4.244 -5.982 2.692 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . rr_6e5k 1
. 1 . 118 . 1 1 10 ARG CA C -3.002 -6.848 2.867 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . rr_6e5k 1
. 1 . 119 . 1 1 10 ARG CB C -2.010 -6.133 3.787 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . rr_6e5k 1
. 1 . 120 . 1 1 10 ARG CD C -1.587 -5.072 6.031 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . rr_6e5k 1
. 1 . 121 . 1 1 10 ARG CG C -2.539 -5.915 5.194 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . rr_6e5k 1
. 1 . 122 . 1 1 10 ARG CZ C 0.833 -4.968 6.496 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . rr_6e5k 1
. 1 . 123 . 1 1 10 ARG H H -1.499 -6.766 1.376 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . rr_6e5k 1
. 1 . 124 . 1 1 10 ARG HA H -3.290 -7.784 3.317 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . rr_6e5k 1
. 1 . 125 . 1 1 10 ARG HB2 H -1.107 -6.723 3.852 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . rr_6e5k 1
. 1 . 126 . 1 1 10 ARG HB3 H -1.770 -5.169 3.362 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . rr_6e5k 1
. 1 . 127 . 1 1 10 ARG HD2 H -1.521 -4.087 5.592 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . rr_6e5k 1
. 1 . 128 . 1 1 10 ARG HD3 H -1.987 -4.990 7.031 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . rr_6e5k 1
. 1 . 129 . 1 1 10 ARG HE H -0.137 -6.591 5.828 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . rr_6e5k 1
. 1 . 130 . 1 1 10 ARG HG2 H -3.490 -5.407 5.131 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . rr_6e5k 1
. 1 . 131 . 1 1 10 ARG HG3 H -2.674 -6.874 5.671 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . rr_6e5k 1
. 1 . 132 . 1 1 10 ARG HH11 H 1.518 -3.204 7.229 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . rr_6e5k 1
. 1 . 133 . 1 1 10 ARG HH12 H -0.196 -3.287 6.976 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . rr_6e5k 1
. 1 . 134 . 1 1 10 ARG HH21 H 2.122 -6.498 6.174 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . rr_6e5k 1
. 1 . 135 . 1 1 10 ARG HH22 H 2.842 -5.039 6.778 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . rr_6e5k 1
. 1 . 136 . 1 1 10 ARG N N -2.387 -7.140 1.579 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . rr_6e5k 1
. 1 . 137 . 1 1 10 ARG NE N -0.243 -5.648 6.100 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . rr_6e5k 1
. 1 . 138 . 1 1 10 ARG NH1 N 0.710 -3.718 6.932 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . rr_6e5k 1
. 1 . 139 . 1 1 10 ARG NH2 N 2.027 -5.548 6.482 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . rr_6e5k 1
. 1 . 140 . 1 1 10 ARG O O -5.286 -6.240 3.291 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . rr_6e5k 1
. 1 . 141 . 1 1 11 TYR C C -6.016 -4.305 0.433 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . rr_6e5k 1
. 1 . 142 . 1 1 11 TYR CA C -5.190 -3.993 1.671 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . rr_6e5k 1
. 1 . 143 . 1 1 11 TYR CB C -4.593 -2.590 1.558 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . rr_6e5k 1
. 1 . 144 . 1 1 11 TYR CD1 C -4.513 -1.918 3.988 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . rr_6e5k 1
. 1 . 145 . 1 1 11 TYR CD2 C -2.475 -1.940 2.760 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . rr_6e5k 1
. 1 . 146 . 1 1 11 TYR CE1 C -3.833 -1.500 5.115 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . rr_6e5k 1
. 1 . 147 . 1 1 11 TYR CE2 C -1.788 -1.525 3.880 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . rr_6e5k 1
. 1 . 148 . 1 1 11 TYR CG C -3.845 -2.145 2.793 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . rr_6e5k 1
. 1 . 149 . 1 1 11 TYR CZ C -2.471 -1.305 5.055 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . rr_6e5k 1
. 1 . 150 . 1 1 11 TYR H H -3.299 -4.872 1.332 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . rr_6e5k 1
. 1 . 151 . 1 1 11 TYR HA H -5.829 -4.032 2.539 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . rr_6e5k 1
. 1 . 152 . 1 1 11 TYR HB2 H -3.903 -2.568 0.728 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . rr_6e5k 1
. 1 . 153 . 1 1 11 TYR HB3 H -5.387 -1.885 1.377 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . rr_6e5k 1
. 1 . 154 . 1 1 11 TYR HD1 H -5.580 -2.074 4.032 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . rr_6e5k 1
. 1 . 155 . 1 1 11 TYR HD2 H -1.940 -2.116 1.836 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . rr_6e5k 1
. 1 . 156 . 1 1 11 TYR HE1 H -4.369 -1.330 6.034 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . rr_6e5k 1
. 1 . 157 . 1 1 11 TYR HE2 H -0.723 -1.374 3.832 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . rr_6e5k 1
. 1 . 158 . 1 1 11 TYR HH H -2.033 -1.441 6.924 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . rr_6e5k 1
. 1 . 159 . 1 1 11 TYR N N -4.128 -4.968 1.854 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . rr_6e5k 1
. 1 . 160 . 1 1 11 TYR O O -6.482 -3.396 -0.247 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . rr_6e5k 1
. 1 . 161 . 1 1 11 TYR OH O -1.790 -0.885 6.173 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . rr_6e5k 1
. 1 . 162 . 1 1 12 ABA C C -8.411 -5.480 -0.947 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . rr_6e5k 1
. 1 . 163 . 1 1 12 ABA CA C -6.991 -6.064 -0.991 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . rr_6e5k 1
. 1 . 164 . 1 1 12 ABA H H -5.786 -6.259 0.753 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . rr_6e5k 1
. 1 . 165 . 1 1 12 ABA N N -6.203 -5.594 0.164 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . rr_6e5k 1
. 1 . 166 . 1 1 12 ABA O O -9.008 -5.186 -1.986 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . rr_6e5k 1
. 1 . 167 . 1 1 13 GLY C C -10.322 -3.266 0.281 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_6e5k 1
. 1 . 168 . 1 1 13 GLY CA C -10.286 -4.776 0.410 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_6e5k 1
. 1 . 169 . 1 1 13 GLY H H -8.418 -5.540 1.051 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_6e5k 1
. 1 . 170 . 1 1 13 GLY HA2 H -10.920 -5.206 -0.349 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_6e5k 1
. 1 . 171 . 1 1 13 GLY HA3 H -10.665 -5.052 1.382 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_6e5k 1
. 1 . 172 . 1 1 13 GLY N N -8.943 -5.308 0.257 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_6e5k 1
. 1 . 173 . 1 1 13 GLY O O -11.383 -2.647 0.349 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_6e5k 1
. 1 . 174 . 1 1 14 CYS C C -8.126 -0.947 -1.260 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_6e5k 1
. 1 . 175 . 1 1 14 CYS CA C -9.011 -1.243 -0.055 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_6e5k 1
. 1 . 176 . 1 1 14 CYS CB C -8.382 -0.664 1.214 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_6e5k 1
. 1 . 177 . 1 1 14 CYS H H -8.348 -3.239 0.018 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_6e5k 1
. 1 . 178 . 1 1 14 CYS HA H -9.987 -0.811 -0.207 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_6e5k 1
. 1 . 179 . 1 1 14 CYS HB2 H -7.381 -1.049 1.315 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_6e5k 1
. 1 . 180 . 1 1 14 CYS HB3 H -8.339 0.412 1.126 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_6e5k 1
. 1 . 181 . 1 1 14 CYS N N -9.154 -2.680 0.085 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_6e5k 1
. 1 . 182 . 1 1 14 CYS O O -7.886 -1.825 -2.088 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_6e5k 1
. 1 . 183 . 1 1 14 CYS SG S -9.283 -1.055 2.748 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_6e5k 1
. 1 . 184 . 1 1 15 GLU C C -5.435 1.186 -1.743 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_6e5k 1
. 1 . 185 . 1 1 15 GLU CA C -6.697 0.640 -2.400 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_6e5k 1
. 1 . 186 . 1 1 15 GLU CB C -7.273 1.686 -3.352 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_6e5k 1
. 1 . 187 . 1 1 15 GLU CD C -9.065 2.303 -4.997 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_6e5k 1
. 1 . 188 . 1 1 15 GLU CG C -8.531 1.236 -4.074 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_6e5k 1
. 1 . 189 . 1 1 15 GLU H H -8.000 0.983 -0.769 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_6e5k 1
. 1 . 190 . 1 1 15 GLU HA H -6.452 -0.253 -2.953 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_6e5k 1
. 1 . 191 . 1 1 15 GLU HB2 H -7.512 2.574 -2.786 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_6e5k 1
. 1 . 192 . 1 1 15 GLU HB3 H -6.526 1.932 -4.093 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_6e5k 1
. 1 . 193 . 1 1 15 GLU HG2 H -8.303 0.356 -4.657 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_6e5k 1
. 1 . 194 . 1 1 15 GLU HG3 H -9.288 1.000 -3.342 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_6e5k 1
. 1 . 195 . 1 1 15 GLU N N -7.668 0.286 -1.378 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_6e5k 1
. 1 . 196 . 1 1 15 GLU O O -5.520 2.096 -0.919 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_6e5k 1
. 1 . 197 . 1 1 15 GLU OE1 O -9.561 3.331 -4.493 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_6e5k 1
. 1 . 198 . 1 1 15 GLU OE2 O -8.989 2.125 -6.231 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_6e5k 1
. 1 . 199 . 1 1 16 MVA C C -1.978 1.611 -2.519 . . . 1.0 . . . . . . . . . . . . A . 16 MVA C . . . . . . . . . rr_6e5k 1
. 1 . 200 . 1 1 16 MVA CA C -3.003 1.151 -1.476 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CA . . . . . . . . . rr_6e5k 1
. 1 . 201 . 1 1 16 MVA CB C -2.343 0.127 -0.493 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CB . . . . . . . . . rr_6e5k 1
. 1 . 202 . 1 1 16 MVA CG1 C -1.808 -1.114 -1.188 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG1 . . . . . . . . . rr_6e5k 1
. 1 . 203 . 1 1 16 MVA CG2 C -1.229 0.801 0.299 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG2 . . . . . . . . . rr_6e5k 1
. 1 . 204 . 1 1 16 MVA CN C -4.207 -0.395 -3.135 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CN . . . . . . . . . rr_6e5k 1
. 1 . 205 . 1 1 16 MVA HA H -3.244 2.027 -0.884 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HA . . . . . . . . . rr_6e5k 1
. 1 . 206 . 1 1 16 MVA HB H -3.096 -0.192 0.212 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HB . . . . . . . . . rr_6e5k 1
. 1 . 207 . 1 1 16 MVA HG11 H -1.121 -0.819 -1.969 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG11 . . . . . . . . . rr_6e5k 1
. 1 . 208 . 1 1 16 MVA HG12 H -2.628 -1.669 -1.616 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG12 . . . . . . . . . rr_6e5k 1
. 1 . 209 . 1 1 16 MVA HG13 H -1.289 -1.731 -0.468 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG13 . . . . . . . . . rr_6e5k 1
. 1 . 210 . 1 1 16 MVA HG21 H -0.504 1.219 -0.385 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG21 . . . . . . . . . rr_6e5k 1
. 1 . 211 . 1 1 16 MVA HG22 H -0.744 0.071 0.931 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG22 . . . . . . . . . rr_6e5k 1
. 1 . 212 . 1 1 16 MVA HG23 H -1.644 1.589 0.910 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG23 . . . . . . . . . rr_6e5k 1
. 1 . 213 . 1 1 16 MVA HN1 H -3.180 -0.589 -3.407 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN1 . . . . . . . . . rr_6e5k 1
. 1 . 214 . 1 1 16 MVA HN2 H -4.751 -0.061 -4.006 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN2 . . . . . . . . . rr_6e5k 1
. 1 . 215 . 1 1 16 MVA HN3 H -4.654 -1.300 -2.754 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN3 . . . . . . . . . rr_6e5k 1
. 1 . 216 . 1 1 16 MVA N N -4.250 0.656 -2.094 . . . 1.0 . . . . . . . . . . . . A . 16 MVA N . . . . . . . . . rr_6e5k 1
. 1 . 217 . 1 1 16 MVA O O -1.457 0.833 -3.325 . . . 1.0 . . . . . . . . . . . . A . 16 MVA O . . . . . . . . . rr_6e5k 1
. 1 . 218 . 1 1 17 ARG C C 0.607 3.572 -2.660 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_6e5k 1
. 1 . 219 . 1 1 17 ARG CA C -0.741 3.515 -3.366 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_6e5k 1
. 1 . 220 . 1 1 17 ARG CB C -1.208 4.922 -3.735 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_6e5k 1
. 1 . 221 . 1 1 17 ARG CD C -0.693 7.114 -4.833 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_6e5k 1
. 1 . 222 . 1 1 17 ARG CG C -0.256 5.670 -4.646 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_6e5k 1
. 1 . 223 . 1 1 17 ARG CZ C 0.803 9.017 -5.325 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_6e5k 1
. 1 . 224 . 1 1 17 ARG H H -2.189 3.466 -1.849 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_6e5k 1
. 1 . 225 . 1 1 17 ARG HA H -0.652 2.917 -4.259 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_6e5k 1
. 1 . 226 . 1 1 17 ARG HB2 H -2.163 4.852 -4.231 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_6e5k 1
. 1 . 227 . 1 1 17 ARG HB3 H -1.326 5.495 -2.829 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_6e5k 1
. 1 . 228 . 1 1 17 ARG HD2 H -1.671 7.128 -5.293 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_6e5k 1
. 1 . 229 . 1 1 17 ARG HD3 H -0.747 7.588 -3.864 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_6e5k 1
. 1 . 230 . 1 1 17 ARG HE H 0.445 7.486 -6.562 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_6e5k 1
. 1 . 231 . 1 1 17 ARG HG2 H 0.731 5.650 -4.209 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_6e5k 1
. 1 . 232 . 1 1 17 ARG HG3 H -0.235 5.178 -5.608 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_6e5k 1
. 1 . 233 . 1 1 17 ARG HH11 H 0.978 10.427 -3.877 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_6e5k 1
. 1 . 234 . 1 1 17 ARG HH12 H -0.078 9.103 -3.487 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_6e5k 1
. 1 . 235 . 1 1 17 ARG HH21 H 1.821 9.226 -7.065 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_6e5k 1
. 1 . 236 . 1 1 17 ARG HH22 H 2.066 10.493 -5.905 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_6e5k 1
. 1 . 237 . 1 1 17 ARG N N -1.713 2.900 -2.496 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_6e5k 1
. 1 . 238 . 1 1 17 ARG NE N 0.236 7.863 -5.677 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_6e5k 1
. 1 . 239 . 1 1 17 ARG NH1 N 0.550 9.560 -4.137 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_6e5k 1
. 1 . 240 . 1 1 17 ARG NH2 N 1.628 9.629 -6.166 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_6e5k 1
. 1 . 241 . 1 1 17 ARG O O 0.824 4.406 -1.780 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_6e5k 1
. 1 . 242 . 1 1 18 CYS C C 3.737 3.621 -3.109 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . rr_6e5k 1
. 1 . 243 . 1 1 18 CYS CA C 2.817 2.619 -2.423 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . rr_6e5k 1
. 1 . 244 . 1 1 18 CYS CB C 3.390 1.203 -2.529 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . rr_6e5k 1
. 1 . 245 . 1 1 18 CYS H H 1.255 2.008 -3.705 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . rr_6e5k 1
. 1 . 246 . 1 1 18 CYS HA H 2.723 2.886 -1.380 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . rr_6e5k 1
. 1 . 247 . 1 1 18 CYS HB2 H 4.413 1.209 -2.182 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . rr_6e5k 1
. 1 . 248 . 1 1 18 CYS HB3 H 2.808 0.539 -1.907 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . rr_6e5k 1
. 1 . 249 . 1 1 18 CYS N N 1.493 2.664 -3.018 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . rr_6e5k 1
. 1 . 250 . 1 1 18 CYS O O 3.823 3.657 -4.339 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . rr_6e5k 1
. 1 . 251 . 1 1 18 CYS SG S 3.383 0.527 -4.222 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . rr_6e5k 1
. 1 . 252 . 1 1 19 ASP C C 6.601 5.480 -2.057 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . rr_6e5k 1
. 1 . 253 . 1 1 19 ASP CA C 5.311 5.449 -2.863 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . rr_6e5k 1
. 1 . 254 . 1 1 19 ASP CB C 4.660 6.832 -2.856 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . rr_6e5k 1
. 1 . 255 . 1 1 19 ASP CG C 5.543 7.881 -3.503 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . rr_6e5k 1
. 1 . 256 . 1 1 19 ASP H H 4.301 4.375 -1.345 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . rr_6e5k 1
. 1 . 257 . 1 1 19 ASP HA H 5.540 5.172 -3.879 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . rr_6e5k 1
. 1 . 258 . 1 1 19 ASP HB2 H 3.726 6.788 -3.396 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . rr_6e5k 1
. 1 . 259 . 1 1 19 ASP HB3 H 4.470 7.126 -1.835 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . rr_6e5k 1
. 1 . 260 . 1 1 19 ASP N N 4.406 4.446 -2.321 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . rr_6e5k 1
. 1 . 261 . 1 1 19 ASP O O 6.684 6.165 -1.036 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . rr_6e5k 1
. 1 . 262 . 1 1 19 ASP OD1 O 6.026 8.789 -2.789 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . rr_6e5k 1
. 1 . 263 . 1 1 19 ASP OD2 O 5.768 7.801 -4.728 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . rr_6e5k 1
. 1 . 264 . 1 1 20 DPR C C 8.696 4.132 -0.354 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . rr_6e5k 1
. 1 . 265 . 1 1 20 DPR CA C 8.892 4.614 -1.790 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . rr_6e5k 1
. 1 . 266 . 1 1 20 DPR CB C 9.675 3.583 -2.601 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . rr_6e5k 1
. 1 . 267 . 1 1 20 DPR CD C 7.613 3.942 -3.746 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . rr_6e5k 1
. 1 . 268 . 1 1 20 DPR CG C 9.063 3.616 -3.956 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . rr_6e5k 1
. 1 . 269 . 1 1 20 DPR HA H 9.432 5.547 -1.788 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . rr_6e5k 1
. 1 . 270 . 1 1 20 DPR HB2 H 10.717 3.860 -2.630 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . rr_6e5k 1
. 1 . 271 . 1 1 20 DPR HB3 H 9.567 2.611 -2.147 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . rr_6e5k 1
. 1 . 272 . 1 1 20 DPR HD2 H 7.239 4.527 -4.572 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . rr_6e5k 1
. 1 . 273 . 1 1 20 DPR HD3 H 7.037 3.040 -3.626 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . rr_6e5k 1
. 1 . 274 . 1 1 20 DPR HG2 H 9.538 4.379 -4.558 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . rr_6e5k 1
. 1 . 275 . 1 1 20 DPR HG3 H 9.165 2.650 -4.428 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . rr_6e5k 1
. 1 . 276 . 1 1 20 DPR N N 7.619 4.730 -2.503 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . rr_6e5k 1
. 1 . 277 . 1 1 20 DPR O O 8.210 3.024 -0.120 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . rr_6e5k 1
. 1 . 278 . 1 1 21 PRO C C 7.504 4.881 2.566 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . rr_6e5k 1
. 1 . 279 . 1 1 21 PRO CA C 8.922 4.645 2.042 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . rr_6e5k 1
. 1 . 280 . 1 1 21 PRO CB C 9.899 5.615 2.699 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . rr_6e5k 1
. 1 . 281 . 1 1 21 PRO CD C 9.657 6.305 0.421 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . rr_6e5k 1
. 1 . 282 . 1 1 21 PRO CG C 9.864 6.817 1.822 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . rr_6e5k 1
. 1 . 283 . 1 1 21 PRO HA H 9.221 3.629 2.250 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . rr_6e5k 1
. 1 . 284 . 1 1 21 PRO HB2 H 9.567 5.842 3.701 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . rr_6e5k 1
. 1 . 285 . 1 1 21 PRO HB3 H 10.884 5.176 2.728 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . rr_6e5k 1
. 1 . 286 . 1 1 21 PRO HD2 H 8.981 6.948 -0.121 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . rr_6e5k 1
. 1 . 287 . 1 1 21 PRO HD3 H 10.601 6.227 -0.097 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . rr_6e5k 1
. 1 . 288 . 1 1 21 PRO HG2 H 9.046 7.456 2.113 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . rr_6e5k 1
. 1 . 289 . 1 1 21 PRO HG3 H 10.800 7.351 1.891 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . rr_6e5k 1
. 1 . 290 . 1 1 21 PRO N N 9.060 4.970 0.623 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . rr_6e5k 1
. 1 . 291 . 1 1 21 PRO O O 7.187 4.547 3.709 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . rr_6e5k 1
. 1 . 292 . 1 1 22 ARG C C 4.292 4.870 1.468 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . rr_6e5k 1
. 1 . 293 . 1 1 22 ARG CA C 5.299 5.794 2.131 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . rr_6e5k 1
. 1 . 294 . 1 1 22 ARG CB C 4.966 7.234 1.742 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . rr_6e5k 1
. 1 . 295 . 1 1 22 ARG CD C 5.567 9.664 1.773 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . rr_6e5k 1
. 1 . 296 . 1 1 22 ARG CG C 5.962 8.268 2.234 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . rr_6e5k 1
. 1 . 297 . 1 1 22 ARG CZ C 4.241 10.216 -0.244 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . rr_6e5k 1
. 1 . 298 . 1 1 22 ARG H H 6.941 5.644 0.805 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . rr_6e5k 1
. 1 . 299 . 1 1 22 ARG HA H 5.226 5.686 3.202 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . rr_6e5k 1
. 1 . 300 . 1 1 22 ARG HB2 H 4.923 7.297 0.665 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . rr_6e5k 1
. 1 . 301 . 1 1 22 ARG HB3 H 3.994 7.484 2.144 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . rr_6e5k 1
. 1 . 302 . 1 1 22 ARG HD2 H 4.660 9.953 2.282 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . rr_6e5k 1
. 1 . 303 . 1 1 22 ARG HD3 H 6.358 10.354 2.030 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . rr_6e5k 1
. 1 . 304 . 1 1 22 ARG HE H 6.044 9.339 -0.255 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . rr_6e5k 1
. 1 . 305 . 1 1 22 ARG HG2 H 5.987 8.247 3.314 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . rr_6e5k 1
. 1 . 306 . 1 1 22 ARG HG3 H 6.940 8.030 1.843 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . rr_6e5k 1
. 1 . 307 . 1 1 22 ARG HH11 H 3.374 10.793 1.495 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . rr_6e5k 1
. 1 . 308 . 1 1 22 ARG HH12 H 2.462 11.132 0.060 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . rr_6e5k 1
. 1 . 309 . 1 1 22 ARG HH21 H 3.275 10.553 -1.991 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . rr_6e5k 1
. 1 . 310 . 1 1 22 ARG HH22 H 4.819 9.754 -2.134 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . rr_6e5k 1
. 1 . 311 . 1 1 22 ARG N N 6.655 5.455 1.727 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . rr_6e5k 1
. 1 . 312 . 1 1 22 ARG NE N 5.340 9.714 0.325 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . rr_6e5k 1
. 1 . 313 . 1 1 22 ARG NH1 N 3.283 10.756 0.496 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . rr_6e5k 1
. 1 . 314 . 1 1 22 ARG NH2 N 4.100 10.175 -1.560 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . rr_6e5k 1
. 1 . 315 . 1 1 22 ARG O O 4.605 4.183 0.496 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . rr_6e5k 1
. 1 . 316 . 1 1 23 TYR C C 0.679 4.868 1.753 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . rr_6e5k 1
. 1 . 317 . 1 1 23 TYR CA C 1.975 4.172 1.381 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . rr_6e5k 1
. 1 . 318 . 1 1 23 TYR CB C 1.928 2.697 1.793 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . rr_6e5k 1
. 1 . 319 . 1 1 23 TYR CD1 C 0.323 2.168 3.666 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . rr_6e5k 1
. 1 . 320 . 1 1 23 TYR CD2 C 2.611 2.544 4.218 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . rr_6e5k 1
. 1 . 321 . 1 1 23 TYR CE1 C 0.031 1.958 4.998 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . rr_6e5k 1
. 1 . 322 . 1 1 23 TYR CE2 C 2.327 2.334 5.553 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . rr_6e5k 1
. 1 . 323 . 1 1 23 TYR CG C 1.616 2.466 3.254 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . rr_6e5k 1
. 1 . 324 . 1 1 23 TYR CZ C 1.035 2.042 5.939 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . rr_6e5k 1
. 1 . 325 . 1 1 23 TYR H H 2.936 5.331 2.850 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . rr_6e5k 1
. 1 . 326 . 1 1 23 TYR HA H 2.105 4.233 0.311 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . rr_6e5k 1
. 1 . 327 . 1 1 23 TYR HB2 H 1.169 2.197 1.214 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . rr_6e5k 1
. 1 . 328 . 1 1 23 TYR HB3 H 2.886 2.248 1.582 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . rr_6e5k 1
. 1 . 329 . 1 1 23 TYR HD1 H -0.461 2.106 2.926 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . rr_6e5k 1
. 1 . 330 . 1 1 23 TYR HD2 H 3.622 2.775 3.911 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . rr_6e5k 1
. 1 . 331 . 1 1 23 TYR HE1 H -0.981 1.726 5.296 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . rr_6e5k 1
. 1 . 332 . 1 1 23 TYR HE2 H 3.115 2.402 6.287 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . rr_6e5k 1
. 1 . 333 . 1 1 23 TYR HH H 1.149 2.540 7.797 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . rr_6e5k 1
. 1 . 334 . 1 1 23 TYR N N 3.086 4.860 2.003 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . rr_6e5k 1
. 1 . 335 . 1 1 23 TYR O O 0.518 5.346 2.877 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . rr_6e5k 1
. 1 . 336 . 1 1 23 TYR OH O 0.746 1.836 7.269 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . rr_6e5k 1
. 1 . 337 . 1 1 24 GLU C C -2.602 4.544 0.849 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . rr_6e5k 1
. 1 . 338 . 1 1 24 GLU CA C -1.507 5.580 1.032 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . rr_6e5k 1
. 1 . 339 . 1 1 24 GLU CB C -1.705 6.741 0.060 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . rr_6e5k 1
. 1 . 340 . 1 1 24 GLU CD C -0.791 8.909 -0.847 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . rr_6e5k 1
. 1 . 341 . 1 1 24 GLU CG C -0.540 7.716 0.044 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . rr_6e5k 1
. 1 . 342 . 1 1 24 GLU H H -0.024 4.581 -0.084 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . rr_6e5k 1
. 1 . 343 . 1 1 24 GLU HA H -1.528 5.950 2.045 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . rr_6e5k 1
. 1 . 344 . 1 1 24 GLU HB2 H -1.831 6.342 -0.935 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . rr_6e5k 1
. 1 . 345 . 1 1 24 GLU HB3 H -2.597 7.281 0.337 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . rr_6e5k 1
. 1 . 346 . 1 1 24 GLU HG2 H -0.369 8.068 1.051 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . rr_6e5k 1
. 1 . 347 . 1 1 24 GLU HG3 H 0.341 7.200 -0.310 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . rr_6e5k 1
. 1 . 348 . 1 1 24 GLU N N -0.223 4.955 0.803 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . rr_6e5k 1
. 1 . 349 . 1 1 24 GLU O O -2.567 3.785 -0.106 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . rr_6e5k 1
. 1 . 350 . 1 1 24 GLU OE1 O -0.845 10.043 -0.324 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . rr_6e5k 1
. 1 . 351 . 1 1 24 GLU OE2 O -0.949 8.724 -2.070 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . rr_6e5k 1
. 1 . 352 . 1 1 25 MVA C C -6.023 3.924 1.891 . . . 1.0 . . . . . . . . . . . . A . 25 MVA C . . . . . . . . . rr_6e5k 1
. 1 . 353 . 1 1 25 MVA CA C -4.605 3.424 1.628 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CA . . . . . . . . . rr_6e5k 1
. 1 . 354 . 1 1 25 MVA CB C -4.290 2.188 2.525 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CB . . . . . . . . . rr_6e5k 1
. 1 . 355 . 1 1 25 MVA CG1 C -4.012 2.566 3.970 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG1 . . . . . . . . . rr_6e5k 1
. 1 . 356 . 1 1 25 MVA CG2 C -5.427 1.180 2.450 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG2 . . . . . . . . . rr_6e5k 1
. 1 . 357 . 1 1 25 MVA CN C -3.682 5.518 2.796 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CN . . . . . . . . . rr_6e5k 1
. 1 . 358 . 1 1 25 MVA HA H -4.599 3.062 0.608 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HA . . . . . . . . . rr_6e5k 1
. 1 . 359 . 1 1 25 MVA HB H -3.404 1.712 2.134 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HB . . . . . . . . . rr_6e5k 1
. 1 . 360 . 1 1 25 MVA HG11 H -3.094 3.134 4.020 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG11 . . . . . . . . . rr_6e5k 1
. 1 . 361 . 1 1 25 MVA HG12 H -3.915 1.670 4.563 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG12 . . . . . . . . . rr_6e5k 1
. 1 . 362 . 1 1 25 MVA HG13 H -4.826 3.164 4.349 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG13 . . . . . . . . . rr_6e5k 1
. 1 . 363 . 1 1 25 MVA HG21 H -6.348 1.652 2.763 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG21 . . . . . . . . . rr_6e5k 1
. 1 . 364 . 1 1 25 MVA HG22 H -5.211 0.346 3.101 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG22 . . . . . . . . . rr_6e5k 1
. 1 . 365 . 1 1 25 MVA HG23 H -5.531 0.828 1.435 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG23 . . . . . . . . . rr_6e5k 1
. 1 . 366 . 1 1 25 MVA HN1 H -4.662 5.482 3.250 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN1 . . . . . . . . . rr_6e5k 1
. 1 . 367 . 1 1 25 MVA HN2 H -3.524 6.493 2.359 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN2 . . . . . . . . . rr_6e5k 1
. 1 . 368 . 1 1 25 MVA HN3 H -2.931 5.332 3.547 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN3 . . . . . . . . . rr_6e5k 1
. 1 . 369 . 1 1 25 MVA N N -3.590 4.485 1.740 . . . 1.0 . . . . . . . . . . . . A . 25 MVA N . . . . . . . . . rr_6e5k 1
. 1 . 370 . 1 1 25 MVA O O -6.381 4.348 2.994 . . . 1.0 . . . . . . . . . . . . A . 25 MVA O . . . . . . . . . rr_6e5k 1
. 1 . 371 . 1 1 26 HIS C C -9.140 3.129 1.008 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_6e5k 1
. 1 . 372 . 1 1 26 HIS CA C -8.202 4.317 0.903 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_6e5k 1
. 1 . 373 . 1 1 26 HIS CB C -8.551 5.140 -0.339 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_6e5k 1
. 1 . 374 . 1 1 26 HIS CD2 C -6.514 6.660 -0.871 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_6e5k 1
. 1 . 375 . 1 1 26 HIS CE1 C -7.427 8.591 -0.393 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_6e5k 1
. 1 . 376 . 1 1 26 HIS CG C -7.784 6.422 -0.464 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_6e5k 1
. 1 . 377 . 1 1 26 HIS H H -6.490 3.466 0.008 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_6e5k 1
. 1 . 378 . 1 1 26 HIS HA H -8.312 4.933 1.780 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_6e5k 1
. 1 . 379 . 1 1 26 HIS HB2 H -8.350 4.548 -1.216 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_6e5k 1
. 1 . 380 . 1 1 26 HIS HB3 H -9.602 5.382 -0.313 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_6e5k 1
. 1 . 381 . 1 1 26 HIS HD1 H -9.241 7.815 0.157 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_6e5k 1
. 1 . 382 . 1 1 26 HIS HD2 H -5.788 5.918 -1.176 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_6e5k 1
. 1 . 383 . 1 1 26 HIS HE1 H -7.574 9.651 -0.251 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_6e5k 1
. 1 . 384 . 1 1 26 HIS HE2 H -5.445 8.466 -0.893 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_6e5k 1
. 1 . 385 . 1 1 26 HIS N N -6.829 3.860 0.845 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_6e5k 1
. 1 . 386 . 1 1 26 HIS ND1 N -8.327 7.653 -0.172 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_6e5k 1
. 1 . 387 . 1 1 26 HIS NE2 N -6.317 8.017 -0.817 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_6e5k 1
. 1 . 388 . 1 1 26 HIS O O -9.080 2.210 0.195 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_6e5k 1
. 1 . 389 . 1 1 27 CYS C C -12.367 2.655 2.077 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . rr_6e5k 1
. 1 . 390 . 1 1 27 CYS CA C -10.960 2.093 2.213 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . rr_6e5k 1
. 1 . 391 . 1 1 27 CYS CB C -10.780 1.452 3.587 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . rr_6e5k 1
. 1 . 392 . 1 1 27 CYS H H -9.962 3.896 2.648 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . rr_6e5k 1
. 1 . 393 . 1 1 27 CYS HA H -10.802 1.345 1.450 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . rr_6e5k 1
. 1 . 394 . 1 1 27 CYS HB2 H -10.892 2.213 4.345 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . rr_6e5k 1
. 1 . 395 . 1 1 27 CYS HB3 H -11.542 0.701 3.724 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . rr_6e5k 1
. 1 . 396 . 1 1 27 CYS N N -9.988 3.147 2.016 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . rr_6e5k 1
. 1 . 397 . 1 1 27 CYS O O -13.023 2.978 3.068 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . rr_6e5k 1
. 1 . 398 . 1 1 27 CYS SG S -9.157 0.657 3.835 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . rr_6e5k 1
. 1 . 399 . 1 1 28 NH2 HN1 H -12.250 2.511 0.101 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . rr_6e5k 1
. 1 . 400 . 1 1 28 NH2 HN2 H -13.723 3.159 0.727 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . rr_6e5k 1
. 1 . 401 . 1 1 28 NH2 N N -12.827 2.789 0.846 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . rr_6e5k 1
. 2 . 402 . 1 1 1 ASN C C 8.475 -9.046 -1.425 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . rr_6e5k 1
. 2 . 403 . 1 1 1 ASN CA C 8.199 -10.542 -1.425 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . rr_6e5k 1
. 2 . 404 . 1 1 1 ASN CB C 7.433 -10.934 -0.155 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . rr_6e5k 1
. 2 . 405 . 1 1 1 ASN CG C 6.096 -10.225 -0.033 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . rr_6e5k 1
. 2 . 406 . 1 1 1 ASN H1 H 9.972 -11.049 -2.385 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . rr_6e5k 1
. 2 . 407 . 1 1 1 ASN H2 H 9.292 -12.311 -1.486 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . rr_6e5k 1
. 2 . 408 . 1 1 1 ASN H3 H 10.081 -11.042 -0.697 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . rr_6e5k 1
. 2 . 409 . 1 1 1 ASN HA H 7.603 -10.789 -2.292 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . rr_6e5k 1
. 2 . 410 . 1 1 1 ASN HB2 H 7.253 -11.997 -0.164 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . rr_6e5k 1
. 2 . 411 . 1 1 1 ASN HB3 H 8.032 -10.682 0.708 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . rr_6e5k 1
. 2 . 412 . 1 1 1 ASN HD21 H 5.195 -11.690 -1.030 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . rr_6e5k 1
. 2 . 413 . 1 1 1 ASN HD22 H 4.175 -10.393 -0.509 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . rr_6e5k 1
. 2 . 414 . 1 1 1 ASN N N 9.473 -11.289 -1.505 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . rr_6e5k 1
. 2 . 415 . 1 1 1 ASN ND2 N 5.051 -10.827 -0.580 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . rr_6e5k 1
. 2 . 416 . 1 1 1 ASN O O 9.309 -8.563 -0.661 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . rr_6e5k 1
. 2 . 417 . 1 1 1 ASN OD1 O 6.002 -9.148 0.554 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . rr_6e5k 1
. 2 . 418 . 1 1 2 ASP C C 7.102 -6.148 -1.387 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . rr_6e5k 1
. 2 . 419 . 1 1 2 ASP CA C 7.983 -6.877 -2.393 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . rr_6e5k 1
. 2 . 420 . 1 1 2 ASP CB C 7.670 -6.389 -3.808 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . rr_6e5k 1
. 2 . 421 . 1 1 2 ASP CG C 7.971 -4.917 -3.989 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . rr_6e5k 1
. 2 . 422 . 1 1 2 ASP H H 7.141 -8.755 -2.879 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . rr_6e5k 1
. 2 . 423 . 1 1 2 ASP HA H 9.016 -6.664 -2.168 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . rr_6e5k 1
. 2 . 424 . 1 1 2 ASP HB2 H 8.263 -6.948 -4.516 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . rr_6e5k 1
. 2 . 425 . 1 1 2 ASP HB3 H 6.623 -6.550 -4.013 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . rr_6e5k 1
. 2 . 426 . 1 1 2 ASP N N 7.791 -8.317 -2.292 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . rr_6e5k 1
. 2 . 427 . 1 1 2 ASP O O 5.994 -6.598 -1.094 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . rr_6e5k 1
. 2 . 428 . 1 1 2 ASP OD1 O 7.023 -4.109 -3.972 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . rr_6e5k 1
. 2 . 429 . 1 1 2 ASP OD2 O 9.155 -4.560 -4.152 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . rr_6e5k 1
. 2 . 430 . 1 1 3 ABA C C 5.483 -3.880 -0.400 . . . 1.0 . . . . . . . . . . . . A . 3 AIB C . . . . . . . . . rr_6e5k 1
. 2 . 431 . 1 1 3 ABA CA C 6.886 -4.213 0.123 . . . 1.0 . . . . . . . . . . . . A . 3 AIB CA . . . . . . . . . rr_6e5k 1
. 2 . 432 . 1 1 3 ABA H H 8.493 -4.729 -1.162 . . . 1.0 . . . . . . . . . . . . A . 3 AIB H . . . . . . . . . rr_6e5k 1
. 2 . 433 . 1 1 3 ABA N N 7.606 -5.026 -0.869 . . . 1.0 . . . . . . . . . . . . A . 3 AIB N . . . . . . . . . rr_6e5k 1
. 2 . 434 . 1 1 3 ABA O O 4.484 -4.023 0.313 . . . 1.0 . . . . . . . . . . . . A . 3 AIB O . . . . . . . . . rr_6e5k 1
. 2 . 435 . 1 1 4 CYS C C 3.222 -4.248 -2.420 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . rr_6e5k 1
. 2 . 436 . 1 1 4 CYS CA C 4.156 -3.058 -2.262 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . rr_6e5k 1
. 2 . 437 . 1 1 4 CYS CB C 4.402 -2.404 -3.617 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . rr_6e5k 1
. 2 . 438 . 1 1 4 CYS H H 6.235 -3.426 -2.199 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . rr_6e5k 1
. 2 . 439 . 1 1 4 CYS HA H 3.691 -2.339 -1.607 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . rr_6e5k 1
. 2 . 440 . 1 1 4 CYS HB2 H 4.929 -3.095 -4.252 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . rr_6e5k 1
. 2 . 441 . 1 1 4 CYS HB3 H 3.453 -2.160 -4.068 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . rr_6e5k 1
. 2 . 442 . 1 1 4 CYS N N 5.415 -3.459 -1.658 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . rr_6e5k 1
. 2 . 443 . 1 1 4 CYS O O 2.002 -4.107 -2.331 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . rr_6e5k 1
. 2 . 444 . 1 1 4 CYS SG S 5.384 -0.873 -3.529 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . rr_6e5k 1
. 2 . 445 . 1 1 5 LYS C C 2.413 -7.012 -1.430 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_6e5k 1
. 2 . 446 . 1 1 5 LYS CA C 3.000 -6.630 -2.780 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_6e5k 1
. 2 . 447 . 1 1 5 LYS CB C 3.839 -7.784 -3.339 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_6e5k 1
. 2 . 448 . 1 1 5 LYS CD C 3.874 -10.142 -4.228 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_6e5k 1
. 2 . 449 . 1 1 5 LYS CE C 3.024 -11.342 -4.625 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_6e5k 1
. 2 . 450 . 1 1 5 LYS CG C 3.019 -9.025 -3.656 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_6e5k 1
. 2 . 451 . 1 1 5 LYS H H 4.772 -5.476 -2.718 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_6e5k 1
. 2 . 452 . 1 1 5 LYS HA H 2.191 -6.416 -3.461 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_6e5k 1
. 2 . 453 . 1 1 5 LYS HB2 H 4.323 -7.454 -4.246 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_6e5k 1
. 2 . 454 . 1 1 5 LYS HB3 H 4.593 -8.050 -2.613 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_6e5k 1
. 2 . 455 . 1 1 5 LYS HD2 H 4.393 -9.774 -5.101 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_6e5k 1
. 2 . 456 . 1 1 5 LYS HD3 H 4.593 -10.451 -3.482 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_6e5k 1
. 2 . 457 . 1 1 5 LYS HE2 H 3.672 -12.110 -5.023 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_6e5k 1
. 2 . 458 . 1 1 5 LYS HE3 H 2.521 -11.717 -3.746 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_6e5k 1
. 2 . 459 . 1 1 5 LYS HG2 H 2.549 -9.377 -2.748 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_6e5k 1
. 2 . 460 . 1 1 5 LYS HG3 H 2.257 -8.765 -4.377 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_6e5k 1
. 2 . 461 . 1 1 5 LYS HZ1 H 1.384 -10.232 -5.297 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 2 . 462 . 1 1 5 LYS HZ2 H 1.425 -11.815 -5.883 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 2 . 463 . 1 1 5 LYS HZ3 H 2.472 -10.653 -6.520 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 2 . 464 . 1 1 5 LYS N N 3.795 -5.422 -2.646 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_6e5k 1
. 2 . 465 . 1 1 5 LYS NZ N 2.006 -10.986 -5.652 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_6e5k 1
. 2 . 466 . 1 1 5 LYS O O 1.239 -7.369 -1.334 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_6e5k 1
. 2 . 467 . 1 1 6 ABA C C 1.630 -6.287 1.329 . . . 1.0 . . . . . . . . . . . . A . 6 AIB C . . . . . . . . . rr_6e5k 1
. 2 . 468 . 1 1 6 ABA CA C 2.816 -7.189 0.983 . . . 1.0 . . . . . . . . . . . . A . 6 AIB CA . . . . . . . . . rr_6e5k 1
. 2 . 469 . 1 1 6 ABA H H 4.174 -6.646 -0.554 . . . 1.0 . . . . . . . . . . . . A . 6 AIB H . . . . . . . . . rr_6e5k 1
. 2 . 470 . 1 1 6 ABA N N 3.242 -6.914 -0.391 . . . 1.0 . . . . . . . . . . . . A . 6 AIB N . . . . . . . . . rr_6e5k 1
. 2 . 471 . 1 1 6 ABA O O 0.595 -6.757 1.818 . . . 1.0 . . . . . . . . . . . . A . 6 AIB O . . . . . . . . . rr_6e5k 1
. 2 . 472 . 1 1 7 LEU C C -0.514 -4.320 0.540 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . rr_6e5k 1
. 2 . 473 . 1 1 7 LEU CA C 0.744 -4.015 1.336 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . rr_6e5k 1
. 2 . 474 . 1 1 7 LEU CB C 1.212 -2.597 1.003 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . rr_6e5k 1
. 2 . 475 . 1 1 7 LEU CD1 C 2.811 -0.703 1.316 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . rr_6e5k 1
. 2 . 476 . 1 1 7 LEU CD2 C 2.063 -2.023 3.293 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . rr_6e5k 1
. 2 . 477 . 1 1 7 LEU CG C 2.404 -2.080 1.811 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . rr_6e5k 1
. 2 . 478 . 1 1 7 LEU H H 2.630 -4.688 0.643 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . rr_6e5k 1
. 2 . 479 . 1 1 7 LEU HA H 0.512 -4.074 2.387 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . rr_6e5k 1
. 2 . 480 . 1 1 7 LEU HB2 H 1.475 -2.567 -0.042 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . rr_6e5k 1
. 2 . 481 . 1 1 7 LEU HB3 H 0.382 -1.924 1.163 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . rr_6e5k 1
. 2 . 482 . 1 1 7 LEU HD11 H 3.646 -0.345 1.898 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . rr_6e5k 1
. 2 . 483 . 1 1 7 LEU HD12 H 1.978 -0.023 1.423 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . rr_6e5k 1
. 2 . 484 . 1 1 7 LEU HD13 H 3.096 -0.763 0.277 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . rr_6e5k 1
. 2 . 485 . 1 1 7 LEU HD21 H 1.221 -1.366 3.441 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . rr_6e5k 1
. 2 . 486 . 1 1 7 LEU HD22 H 2.913 -1.648 3.843 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . rr_6e5k 1
. 2 . 487 . 1 1 7 LEU HD23 H 1.816 -3.014 3.646 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . rr_6e5k 1
. 2 . 488 . 1 1 7 LEU HG H 3.242 -2.750 1.680 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . rr_6e5k 1
. 2 . 489 . 1 1 7 LEU N N 1.787 -4.993 1.052 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . rr_6e5k 1
. 2 . 490 . 1 1 7 LEU O O -1.610 -4.326 1.088 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . rr_6e5k 1
. 2 . 491 . 1 1 8 LYS C C -2.268 -6.042 -1.166 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . rr_6e5k 1
. 2 . 492 . 1 1 8 LYS CA C -1.480 -4.820 -1.625 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . rr_6e5k 1
. 2 . 493 . 1 1 8 LYS CB C -1.005 -4.997 -3.068 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . rr_6e5k 1
. 2 . 494 . 1 1 8 LYS CD C -1.597 -5.129 -5.502 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . rr_6e5k 1
. 2 . 495 . 1 1 8 LYS CE C -2.717 -5.064 -6.528 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . rr_6e5k 1
. 2 . 496 . 1 1 8 LYS CG C -2.133 -5.021 -4.085 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . rr_6e5k 1
. 2 . 497 . 1 1 8 LYS H H 0.564 -4.611 -1.116 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . rr_6e5k 1
. 2 . 498 . 1 1 8 LYS HA H -2.123 -3.955 -1.571 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . rr_6e5k 1
. 2 . 499 . 1 1 8 LYS HB2 H -0.341 -4.184 -3.319 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . rr_6e5k 1
. 2 . 500 . 1 1 8 LYS HB3 H -0.463 -5.929 -3.142 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . rr_6e5k 1
. 2 . 501 . 1 1 8 LYS HD2 H -0.911 -4.315 -5.679 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . rr_6e5k 1
. 2 . 502 . 1 1 8 LYS HD3 H -1.076 -6.070 -5.608 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . rr_6e5k 1
. 2 . 503 . 1 1 8 LYS HE2 H -2.291 -5.167 -7.515 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . rr_6e5k 1
. 2 . 504 . 1 1 8 LYS HE3 H -3.400 -5.880 -6.347 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . rr_6e5k 1
. 2 . 505 . 1 1 8 LYS HG2 H -2.767 -5.871 -3.883 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . rr_6e5k 1
. 2 . 506 . 1 1 8 LYS HG3 H -2.707 -4.111 -3.994 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . rr_6e5k 1
. 2 . 507 . 1 1 8 LYS HZ1 H -3.919 -3.679 -5.529 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 2 . 508 . 1 1 8 LYS HZ2 H -4.201 -3.754 -7.192 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 2 . 509 . 1 1 8 LYS HZ3 H -2.820 -2.980 -6.607 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 2 . 510 . 1 1 8 LYS N N -0.347 -4.581 -0.746 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . rr_6e5k 1
. 2 . 511 . 1 1 8 LYS NZ N -3.466 -3.780 -6.458 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . rr_6e5k 1
. 2 . 512 . 1 1 8 LYS O O -3.490 -5.995 -1.076 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . rr_6e5k 1
. 2 . 513 . 1 1 9 ABA C C -2.889 -8.073 0.954 . . . 1.0 . . . . . . . . . . . . A . 9 AIB C . . . . . . . . . rr_6e5k 1
. 2 . 514 . 1 1 9 ABA CA C -2.155 -8.360 -0.360 . . . 1.0 . . . . . . . . . . . . A . 9 AIB CA . . . . . . . . . rr_6e5k 1
. 2 . 515 . 1 1 9 ABA H H -0.572 -7.084 -0.967 . . . 1.0 . . . . . . . . . . . . A . 9 AIB H . . . . . . . . . rr_6e5k 1
. 2 . 516 . 1 1 9 ABA N N -1.548 -7.120 -0.857 . . . 1.0 . . . . . . . . . . . . A . 9 AIB N . . . . . . . . . rr_6e5k 1
. 2 . 517 . 1 1 9 ABA O O -3.985 -8.581 1.199 . . . 1.0 . . . . . . . . . . . . A . 9 AIB O . . . . . . . . . rr_6e5k 1
. 2 . 518 . 1 1 10 ARG C C -4.092 -6.094 2.971 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . rr_6e5k 1
. 2 . 519 . 1 1 10 ARG CA C -2.813 -6.916 3.100 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . rr_6e5k 1
. 2 . 520 . 1 1 10 ARG CB C -1.763 -6.155 3.914 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . rr_6e5k 1
. 2 . 521 . 1 1 10 ARG CD C -1.069 -5.173 6.114 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . rr_6e5k 1
. 2 . 522 . 1 1 10 ARG CG C -2.216 -5.762 5.308 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . rr_6e5k 1
. 2 . 523 . 1 1 10 ARG CZ C 1.217 -5.834 6.799 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . rr_6e5k 1
. 2 . 524 . 1 1 10 ARG H H -1.407 -6.854 1.521 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . rr_6e5k 1
. 2 . 525 . 1 1 10 ARG HA H -3.045 -7.839 3.604 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . rr_6e5k 1
. 2 . 526 . 1 1 10 ARG HB2 H -0.883 -6.772 4.009 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . rr_6e5k 1
. 2 . 527 . 1 1 10 ARG HB3 H -1.498 -5.252 3.380 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . rr_6e5k 1
. 2 . 528 . 1 1 10 ARG HD2 H -0.683 -4.310 5.591 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . rr_6e5k 1
. 2 . 529 . 1 1 10 ARG HD3 H -1.444 -4.868 7.080 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . rr_6e5k 1
. 2 . 530 . 1 1 10 ARG HE H -0.164 -7.073 6.057 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . rr_6e5k 1
. 2 . 531 . 1 1 10 ARG HG2 H -3.001 -5.025 5.223 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . rr_6e5k 1
. 2 . 532 . 1 1 10 ARG HG3 H -2.593 -6.637 5.815 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . rr_6e5k 1
. 2 . 533 . 1 1 10 ARG HH11 H 2.417 -4.370 7.517 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . rr_6e5k 1
. 2 . 534 . 1 1 10 ARG HH12 H 0.825 -3.861 7.045 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . rr_6e5k 1
. 2 . 535 . 1 1 10 ARG HH21 H 1.916 -7.731 6.682 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . rr_6e5k 1
. 2 . 536 . 1 1 10 ARG HH22 H 3.034 -6.563 7.317 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . rr_6e5k 1
. 2 . 537 . 1 1 10 ARG N N -2.266 -7.252 1.792 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . rr_6e5k 1
. 2 . 538 . 1 1 10 ARG NE N 0.017 -6.138 6.305 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . rr_6e5k 1
. 2 . 539 . 1 1 10 ARG NH1 N 1.510 -4.589 7.145 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . rr_6e5k 1
. 2 . 540 . 1 1 10 ARG NH2 N 2.129 -6.786 6.943 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . rr_6e5k 1
. 2 . 541 . 1 1 10 ARG O O -5.065 -6.317 3.689 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . rr_6e5k 1
. 2 . 542 . 1 1 11 TYR C C -6.068 -4.696 0.659 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . rr_6e5k 1
. 2 . 543 . 1 1 11 TYR CA C -5.209 -4.257 1.842 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . rr_6e5k 1
. 2 . 544 . 1 1 11 TYR CB C -4.688 -2.835 1.625 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . rr_6e5k 1
. 2 . 545 . 1 1 11 TYR CD1 C -4.721 -1.798 3.923 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . rr_6e5k 1
. 2 . 546 . 1 1 11 TYR CD2 C -2.609 -2.168 2.890 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . rr_6e5k 1
. 2 . 547 . 1 1 11 TYR CE1 C -4.091 -1.265 5.031 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . rr_6e5k 1
. 2 . 548 . 1 1 11 TYR CE2 C -1.969 -1.639 3.994 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . rr_6e5k 1
. 2 . 549 . 1 1 11 TYR CG C -3.992 -2.257 2.835 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . rr_6e5k 1
. 2 . 550 . 1 1 11 TYR CZ C -2.714 -1.186 5.062 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . rr_6e5k 1
. 2 . 551 . 1 1 11 TYR H H -3.307 -5.082 1.444 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . rr_6e5k 1
. 2 . 552 . 1 1 11 TYR HA H -5.810 -4.276 2.738 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . rr_6e5k 1
. 2 . 553 . 1 1 11 TYR HB2 H -3.980 -2.839 0.809 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . rr_6e5k 1
. 2 . 554 . 1 1 11 TYR HB3 H -5.512 -2.191 1.374 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . rr_6e5k 1
. 2 . 555 . 1 1 11 TYR HD1 H -5.799 -1.861 3.896 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . rr_6e5k 1
. 2 . 556 . 1 1 11 TYR HD2 H -2.026 -2.524 2.051 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . rr_6e5k 1
. 2 . 557 . 1 1 11 TYR HE1 H -4.677 -0.913 5.865 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . rr_6e5k 1
. 2 . 558 . 1 1 11 TYR HE2 H -0.892 -1.582 4.015 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . rr_6e5k 1
. 2 . 559 . 1 1 11 TYR HH H -2.564 -0.913 6.965 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . rr_6e5k 1
. 2 . 560 . 1 1 11 TYR N N -4.089 -5.162 2.034 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . rr_6e5k 1
. 2 . 561 . 1 1 11 TYR O O -6.425 -3.889 -0.194 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . rr_6e5k 1
. 2 . 562 . 1 1 11 TYR OH O -2.080 -0.658 6.167 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . rr_6e5k 1
. 2 . 563 . 1 1 12 ABA C C -8.507 -5.811 -0.687 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . rr_6e5k 1
. 2 . 564 . 1 1 12 ABA CA C -7.210 -6.592 -0.438 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . rr_6e5k 1
. 2 . 565 . 1 1 12 ABA H H -6.108 -6.552 1.380 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . rr_6e5k 1
. 2 . 566 . 1 1 12 ABA N N -6.412 -5.982 0.644 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . rr_6e5k 1
. 2 . 567 . 1 1 12 ABA O O -8.965 -5.701 -1.827 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . rr_6e5k 1
. 2 . 568 . 1 1 13 GLY C C -10.199 -3.075 0.157 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_6e5k 1
. 2 . 569 . 1 1 13 GLY CA C -10.362 -4.580 0.227 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_6e5k 1
. 2 . 570 . 1 1 13 GLY H H -8.678 -5.359 1.251 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_6e5k 1
. 2 . 571 . 1 1 13 GLY HA2 H -10.843 -4.920 -0.676 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_6e5k 1
. 2 . 572 . 1 1 13 GLY HA3 H -10.991 -4.825 1.069 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_6e5k 1
. 2 . 573 . 1 1 13 GLY N N -9.100 -5.279 0.370 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_6e5k 1
. 2 . 574 . 1 1 13 GLY O O -11.178 -2.331 0.257 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_6e5k 1
. 2 . 575 . 1 1 14 CYS C C -7.723 -0.879 -1.199 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_6e5k 1
. 2 . 576 . 1 1 14 CYS CA C -8.690 -1.193 -0.064 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_6e5k 1
. 2 . 577 . 1 1 14 CYS CB C -8.093 -0.738 1.270 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_6e5k 1
. 2 . 578 . 1 1 14 CYS H H -8.229 -3.255 -0.141 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_6e5k 1
. 2 . 579 . 1 1 14 CYS HA H -9.618 -0.671 -0.233 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_6e5k 1
. 2 . 580 . 1 1 14 CYS HB2 H -7.087 -1.108 1.346 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_6e5k 1
. 2 . 581 . 1 1 14 CYS HB3 H -8.074 0.343 1.296 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_6e5k 1
. 2 . 582 . 1 1 14 CYS N N -8.971 -2.617 -0.022 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_6e5k 1
. 2 . 583 . 1 1 14 CYS O O -7.127 -1.779 -1.788 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_6e5k 1
. 2 . 584 . 1 1 14 CYS SG S -9.005 -1.311 2.744 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_6e5k 1
. 2 . 585 . 1 1 15 GLU C C -5.373 1.343 -1.835 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_6e5k 1
. 2 . 586 . 1 1 15 GLU CA C -6.636 0.831 -2.520 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_6e5k 1
. 2 . 587 . 1 1 15 GLU CB C -7.252 1.927 -3.391 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_6e5k 1
. 2 . 588 . 1 1 15 GLU CD C -8.104 0.387 -5.206 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_6e5k 1
. 2 . 589 . 1 1 15 GLU CG C -8.456 1.459 -4.193 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_6e5k 1
. 2 . 590 . 1 1 15 GLU H H -8.150 1.062 -1.065 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_6e5k 1
. 2 . 591 . 1 1 15 GLU HA H -6.386 -0.016 -3.138 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_6e5k 1
. 2 . 592 . 1 1 15 GLU HB2 H -7.564 2.743 -2.756 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_6e5k 1
. 2 . 593 . 1 1 15 GLU HB3 H -6.504 2.285 -4.081 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_6e5k 1
. 2 . 594 . 1 1 15 GLU HG2 H -9.191 1.059 -3.511 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_6e5k 1
. 2 . 595 . 1 1 15 GLU HG3 H -8.874 2.304 -4.716 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_6e5k 1
. 2 . 596 . 1 1 15 GLU N N -7.590 0.393 -1.517 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_6e5k 1
. 2 . 597 . 1 1 15 GLU O O -5.463 2.178 -0.932 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_6e5k 1
. 2 . 598 . 1 1 15 GLU OE1 O -8.419 -0.793 -4.957 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_6e5k 1
. 2 . 599 . 1 1 15 GLU OE2 O -7.497 0.716 -6.248 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_6e5k 1
. 2 . 600 . 1 1 16 MVA C C -1.812 1.657 -2.534 . . . 1.0 . . . . . . . . . . . . A . 16 MVA C . . . . . . . . . rr_6e5k 1
. 2 . 601 . 1 1 16 MVA CA C -2.937 1.266 -1.560 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CA . . . . . . . . . rr_6e5k 1
. 2 . 602 . 1 1 16 MVA CB C -2.415 0.191 -0.554 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CB . . . . . . . . . rr_6e5k 1
. 2 . 603 . 1 1 16 MVA CG1 C -1.973 -1.095 -1.237 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG1 . . . . . . . . . rr_6e5k 1
. 2 . 604 . 1 1 16 MVA CG2 C -1.276 0.760 0.279 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG2 . . . . . . . . . rr_6e5k 1
. 2 . 605 . 1 1 16 MVA CN C -4.134 -0.065 -3.395 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CN . . . . . . . . . rr_6e5k 1
. 2 . 606 . 1 1 16 MVA HA H -3.147 2.150 -0.973 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HA . . . . . . . . . rr_6e5k 1
. 2 . 607 . 1 1 16 MVA HB H -3.222 -0.057 0.118 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HB . . . . . . . . . rr_6e5k 1
. 2 . 608 . 1 1 16 MVA HG11 H -1.196 -0.871 -1.955 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG11 . . . . . . . . . rr_6e5k 1
. 2 . 609 . 1 1 16 MVA HG12 H -2.815 -1.543 -1.742 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG12 . . . . . . . . . rr_6e5k 1
. 2 . 610 . 1 1 16 MVA HG13 H -1.589 -1.781 -0.496 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG13 . . . . . . . . . rr_6e5k 1
. 2 . 611 . 1 1 16 MVA HG21 H -1.631 1.612 0.839 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG21 . . . . . . . . . rr_6e5k 1
. 2 . 612 . 1 1 16 MVA HG22 H -0.472 1.068 -0.374 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG22 . . . . . . . . . rr_6e5k 1
. 2 . 613 . 1 1 16 MVA HG23 H -0.916 0.005 0.961 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG23 . . . . . . . . . rr_6e5k 1
. 2 . 614 . 1 1 16 MVA HN1 H -4.541 -1.024 -3.111 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN1 . . . . . . . . . rr_6e5k 1
. 2 . 615 . 1 1 16 MVA HN2 H -3.108 -0.189 -3.711 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN2 . . . . . . . . . rr_6e5k 1
. 2 . 616 . 1 1 16 MVA HN3 H -4.712 0.345 -4.208 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN3 . . . . . . . . . rr_6e5k 1
. 2 . 617 . 1 1 16 MVA N N -4.183 0.856 -2.238 . . . 1.0 . . . . . . . . . . . . A . 16 MVA N . . . . . . . . . rr_6e5k 1
. 2 . 618 . 1 1 16 MVA O O -1.345 0.867 -3.362 . . . 1.0 . . . . . . . . . . . . A . 16 MVA O . . . . . . . . . rr_6e5k 1
. 2 . 619 . 1 1 17 ARG C C 0.970 3.502 -2.363 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_6e5k 1
. 2 . 620 . 1 1 17 ARG CA C -0.304 3.452 -3.198 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_6e5k 1
. 2 . 621 . 1 1 17 ARG CB C -0.702 4.851 -3.670 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_6e5k 1
. 2 . 622 . 1 1 17 ARG CD C -0.005 7.144 -4.387 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_6e5k 1
. 2 . 623 . 1 1 17 ARG CG C 0.460 5.729 -4.084 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_6e5k 1
. 2 . 624 . 1 1 17 ARG CZ C 0.952 9.399 -4.649 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_6e5k 1
. 2 . 625 . 1 1 17 ARG H H -1.811 3.472 -1.736 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_6e5k 1
. 2 . 626 . 1 1 17 ARG HA H -0.147 2.814 -4.053 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_6e5k 1
. 2 . 627 . 1 1 17 ARG HB2 H -1.365 4.752 -4.513 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_6e5k 1
. 2 . 628 . 1 1 17 ARG HB3 H -1.229 5.344 -2.871 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_6e5k 1
. 2 . 629 . 1 1 17 ARG HD2 H -0.471 7.156 -5.363 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_6e5k 1
. 2 . 630 . 1 1 17 ARG HD3 H -0.730 7.439 -3.642 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_6e5k 1
. 2 . 631 . 1 1 17 ARG HE H 1.998 7.761 -4.139 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_6e5k 1
. 2 . 632 . 1 1 17 ARG HG2 H 1.181 5.756 -3.281 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_6e5k 1
. 2 . 633 . 1 1 17 ARG HG3 H 0.916 5.310 -4.969 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_6e5k 1
. 2 . 634 . 1 1 17 ARG HH11 H -0.354 10.857 -5.181 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_6e5k 1
. 2 . 635 . 1 1 17 ARG HH12 H -1.039 9.269 -5.025 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_6e5k 1
. 2 . 636 . 1 1 17 ARG HH21 H 2.902 9.854 -4.340 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_6e5k 1
. 2 . 637 . 1 1 17 ARG HH22 H 1.894 11.190 -4.792 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_6e5k 1
. 2 . 638 . 1 1 17 ARG N N -1.384 2.899 -2.407 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_6e5k 1
. 2 . 639 . 1 1 17 ARG NE N 1.097 8.104 -4.379 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_6e5k 1
. 2 . 640 . 1 1 17 ARG NH1 N -0.243 9.882 -4.978 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_6e5k 1
. 2 . 641 . 1 1 17 ARG NH2 N 1.999 10.213 -4.589 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_6e5k 1
. 2 . 642 . 1 1 17 ARG O O 1.035 4.205 -1.360 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_6e5k 1
. 2 . 643 . 1 1 18 CYS C C 4.269 3.600 -2.475 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . rr_6e5k 1
. 2 . 644 . 1 1 18 CYS CA C 3.196 2.629 -1.986 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . rr_6e5k 1
. 2 . 645 . 1 1 18 CYS CB C 3.721 1.195 -2.053 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . rr_6e5k 1
. 2 . 646 . 1 1 18 CYS H H 1.890 2.243 -3.605 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . rr_6e5k 1
. 2 . 647 . 1 1 18 CYS HA H 2.958 2.866 -0.960 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . rr_6e5k 1
. 2 . 648 . 1 1 18 CYS HB2 H 4.662 1.137 -1.526 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . rr_6e5k 1
. 2 . 649 . 1 1 18 CYS HB3 H 3.007 0.536 -1.580 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . rr_6e5k 1
. 2 . 650 . 1 1 18 CYS N N 1.972 2.741 -2.764 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . rr_6e5k 1
. 2 . 651 . 1 1 18 CYS O O 4.652 3.582 -3.647 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . rr_6e5k 1
. 2 . 652 . 1 1 18 CYS SG S 3.997 0.589 -3.752 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . rr_6e5k 1
. 2 . 653 . 1 1 19 ASP C C 6.914 5.277 -0.805 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . rr_6e5k 1
. 2 . 654 . 1 1 19 ASP CA C 5.840 5.362 -1.882 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . rr_6e5k 1
. 2 . 655 . 1 1 19 ASP CB C 5.336 6.805 -2.004 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . rr_6e5k 1
. 2 . 656 . 1 1 19 ASP CG C 4.557 7.059 -3.281 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . rr_6e5k 1
. 2 . 657 . 1 1 19 ASP H H 4.368 4.449 -0.669 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . rr_6e5k 1
. 2 . 658 . 1 1 19 ASP HA H 6.270 5.058 -2.824 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . rr_6e5k 1
. 2 . 659 . 1 1 19 ASP HB2 H 4.694 7.023 -1.166 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . rr_6e5k 1
. 2 . 660 . 1 1 19 ASP HB3 H 6.184 7.475 -1.983 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . rr_6e5k 1
. 2 . 661 . 1 1 19 ASP N N 4.750 4.444 -1.574 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . rr_6e5k 1
. 2 . 662 . 1 1 19 ASP O O 6.925 6.068 0.144 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . rr_6e5k 1
. 2 . 663 . 1 1 19 ASP OD1 O 3.310 7.012 -3.249 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . rr_6e5k 1
. 2 . 664 . 1 1 19 ASP OD2 O 5.188 7.318 -4.329 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . rr_6e5k 1
. 2 . 665 . 1 1 20 DPR C C 8.464 3.880 1.444 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . rr_6e5k 1
. 2 . 666 . 1 1 20 DPR CA C 8.935 4.123 0.011 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . rr_6e5k 1
. 2 . 667 . 1 1 20 DPR CB C 9.686 2.904 -0.527 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . rr_6e5k 1
. 2 . 668 . 1 1 20 DPR CD C 7.807 3.241 -1.951 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . rr_6e5k 1
. 2 . 669 . 1 1 20 DPR CG C 8.690 2.179 -1.361 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . rr_6e5k 1
. 2 . 670 . 1 1 20 DPR HA H 9.591 4.977 -0.010 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . rr_6e5k 1
. 2 . 671 . 1 1 20 DPR HB2 H 10.531 3.231 -1.115 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . rr_6e5k 1
. 2 . 672 . 1 1 20 DPR HB3 H 10.026 2.300 0.299 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . rr_6e5k 1
. 2 . 673 . 1 1 20 DPR HD2 H 8.225 3.610 -2.876 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . rr_6e5k 1
. 2 . 674 . 1 1 20 DPR HD3 H 6.811 2.859 -2.108 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . rr_6e5k 1
. 2 . 675 . 1 1 20 DPR HG2 H 9.195 1.631 -2.141 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . rr_6e5k 1
. 2 . 676 . 1 1 20 DPR HG3 H 8.110 1.509 -0.744 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . rr_6e5k 1
. 2 . 677 . 1 1 20 DPR N N 7.813 4.287 -0.918 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . rr_6e5k 1
. 2 . 678 . 1 1 20 DPR O O 7.821 2.870 1.737 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . rr_6e5k 1
. 2 . 679 . 1 1 21 PRO C C 6.927 5.011 4.023 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . rr_6e5k 1
. 2 . 680 . 1 1 21 PRO CA C 8.403 4.709 3.762 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . rr_6e5k 1
. 2 . 681 . 1 1 21 PRO CB C 9.283 5.762 4.431 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . rr_6e5k 1
. 2 . 682 . 1 1 21 PRO CD C 9.544 6.042 2.074 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . rr_6e5k 1
. 2 . 683 . 1 1 21 PRO CG C 9.492 6.791 3.378 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . rr_6e5k 1
. 2 . 684 . 1 1 21 PRO HA H 8.642 3.736 4.161 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . rr_6e5k 1
. 2 . 685 . 1 1 21 PRO HB2 H 8.772 6.171 5.290 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . rr_6e5k 1
. 2 . 686 . 1 1 21 PRO HB3 H 10.216 5.316 4.735 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . rr_6e5k 1
. 2 . 687 . 1 1 21 PRO HD2 H 9.079 6.620 1.290 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . rr_6e5k 1
. 2 . 688 . 1 1 21 PRO HD3 H 10.566 5.805 1.814 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . rr_6e5k 1
. 2 . 689 . 1 1 21 PRO HG2 H 8.666 7.484 3.378 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . rr_6e5k 1
. 2 . 690 . 1 1 21 PRO HG3 H 10.421 7.311 3.549 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . rr_6e5k 1
. 2 . 691 . 1 1 21 PRO N N 8.776 4.814 2.352 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . rr_6e5k 1
. 2 . 692 . 1 1 21 PRO O O 6.427 4.774 5.124 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . rr_6e5k 1
. 2 . 693 . 1 1 22 ARG C C 3.937 5.173 2.201 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . rr_6e5k 1
. 2 . 694 . 1 1 22 ARG CA C 4.826 5.893 3.204 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . rr_6e5k 1
. 2 . 695 . 1 1 22 ARG CB C 4.635 7.409 3.076 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . rr_6e5k 1
. 2 . 696 . 1 1 22 ARG CD C 4.700 9.449 1.603 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . rr_6e5k 1
. 2 . 697 . 1 1 22 ARG CG C 5.031 7.968 1.719 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . rr_6e5k 1
. 2 . 698 . 1 1 22 ARG CZ C 2.711 10.860 2.002 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . rr_6e5k 1
. 2 . 699 . 1 1 22 ARG H H 6.652 5.665 2.144 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . rr_6e5k 1
. 2 . 700 . 1 1 22 ARG HA H 4.536 5.590 4.197 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . rr_6e5k 1
. 2 . 701 . 1 1 22 ARG HB2 H 3.596 7.645 3.247 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . rr_6e5k 1
. 2 . 702 . 1 1 22 ARG HB3 H 5.235 7.898 3.829 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . rr_6e5k 1
. 2 . 703 . 1 1 22 ARG HD2 H 5.161 9.973 2.427 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . rr_6e5k 1
. 2 . 704 . 1 1 22 ARG HD3 H 5.105 9.823 0.673 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . rr_6e5k 1
. 2 . 705 . 1 1 22 ARG HE H 2.664 8.966 1.347 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . rr_6e5k 1
. 2 . 706 . 1 1 22 ARG HG2 H 6.094 7.835 1.584 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . rr_6e5k 1
. 2 . 707 . 1 1 22 ARG HG3 H 4.499 7.426 0.952 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . rr_6e5k 1
. 2 . 708 . 1 1 22 ARG HH11 H 4.480 11.783 2.367 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . rr_6e5k 1
. 2 . 709 . 1 1 22 ARG HH12 H 3.068 12.753 2.638 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . rr_6e5k 1
. 2 . 710 . 1 1 22 ARG HH21 H 0.977 11.869 2.284 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . rr_6e5k 1
. 2 . 711 . 1 1 22 ARG HH22 H 0.798 10.227 1.723 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . rr_6e5k 1
. 2 . 712 . 1 1 22 ARG N N 6.226 5.532 3.023 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . rr_6e5k 1
. 2 . 713 . 1 1 22 ARG NE N 3.259 9.702 1.630 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . rr_6e5k 1
. 2 . 714 . 1 1 22 ARG NH1 N 3.482 11.878 2.368 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . rr_6e5k 1
. 2 . 715 . 1 1 22 ARG NH2 N 1.393 11.000 2.004 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . rr_6e5k 1
. 2 . 716 . 1 1 22 ARG O O 4.420 4.622 1.213 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . rr_6e5k 1
. 2 . 717 . 1 1 23 TYR C C 0.303 5.216 1.781 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . rr_6e5k 1
. 2 . 718 . 1 1 23 TYR CA C 1.671 4.585 1.568 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . rr_6e5k 1
. 2 . 719 . 1 1 23 TYR CB C 1.589 3.062 1.734 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . rr_6e5k 1
. 2 . 720 . 1 1 23 TYR CD1 C -0.165 2.413 3.428 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . rr_6e5k 1
. 2 . 721 . 1 1 23 TYR CD2 C 2.120 2.360 4.098 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . rr_6e5k 1
. 2 . 722 . 1 1 23 TYR CE1 C -0.548 2.002 4.687 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . rr_6e5k 1
. 2 . 723 . 1 1 23 TYR CE2 C 1.746 1.946 5.358 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . rr_6e5k 1
. 2 . 724 . 1 1 23 TYR CG C 1.173 2.599 3.112 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . rr_6e5k 1
. 2 . 725 . 1 1 23 TYR CZ C 0.405 1.728 5.634 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . rr_6e5k 1
. 2 . 726 . 1 1 23 TYR H H 2.330 5.550 3.321 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . rr_6e5k 1
. 2 . 727 . 1 1 23 TYR HA H 1.994 4.804 0.561 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . rr_6e5k 1
. 2 . 728 . 1 1 23 TYR HB2 H 0.871 2.673 1.030 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . rr_6e5k 1
. 2 . 729 . 1 1 23 TYR HB3 H 2.557 2.637 1.521 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . rr_6e5k 1
. 2 . 730 . 1 1 23 TYR HD1 H -0.913 2.595 2.669 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . rr_6e5k 1
. 2 . 731 . 1 1 23 TYR HD2 H 3.165 2.497 3.866 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . rr_6e5k 1
. 2 . 732 . 1 1 23 TYR HE1 H -1.593 1.863 4.915 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . rr_6e5k 1
. 2 . 733 . 1 1 23 TYR HE2 H 2.497 1.766 6.111 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . rr_6e5k 1
. 2 . 734 . 1 1 23 TYR HH H 0.576 1.826 7.569 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . rr_6e5k 1
. 2 . 735 . 1 1 23 TYR N N 2.644 5.162 2.476 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . rr_6e5k 1
. 2 . 736 . 1 1 23 TYR O O -0.064 5.571 2.902 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . rr_6e5k 1
. 2 . 737 . 1 1 23 TYR OH O 0.039 1.360 6.911 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . rr_6e5k 1
. 2 . 738 . 1 1 24 GLU C C -2.778 4.779 0.671 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . rr_6e5k 1
. 2 . 739 . 1 1 24 GLU CA C -1.770 5.916 0.732 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . rr_6e5k 1
. 2 . 740 . 1 1 24 GLU CB C -1.990 6.851 -0.457 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . rr_6e5k 1
. 2 . 741 . 1 1 24 GLU CD C -1.112 9.008 0.513 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . rr_6e5k 1
. 2 . 742 . 1 1 24 GLU CG C -0.962 7.964 -0.568 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . rr_6e5k 1
. 2 . 743 . 1 1 24 GLU H H -0.057 5.077 -0.166 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . rr_6e5k 1
. 2 . 744 . 1 1 24 GLU HA H -1.891 6.463 1.653 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . rr_6e5k 1
. 2 . 745 . 1 1 24 GLU HB2 H -1.961 6.270 -1.364 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . rr_6e5k 1
. 2 . 746 . 1 1 24 GLU HB3 H -2.966 7.302 -0.364 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . rr_6e5k 1
. 2 . 747 . 1 1 24 GLU HG2 H 0.022 7.531 -0.492 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . rr_6e5k 1
. 2 . 748 . 1 1 24 GLU HG3 H -1.070 8.442 -1.530 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . rr_6e5k 1
. 2 . 749 . 1 1 24 GLU N N -0.429 5.363 0.696 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . rr_6e5k 1
. 2 . 750 . 1 1 24 GLU O O -2.700 3.940 -0.219 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . rr_6e5k 1
. 2 . 751 . 1 1 24 GLU OE1 O -0.285 9.018 1.448 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . rr_6e5k 1
. 2 . 752 . 1 1 24 GLU OE2 O -2.062 9.812 0.452 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . rr_6e5k 1
. 2 . 753 . 1 1 25 MVA C C -6.144 4.045 1.842 . . . 1.0 . . . . . . . . . . . . A . 25 MVA C . . . . . . . . . rr_6e5k 1
. 2 . 754 . 1 1 25 MVA CA C -4.703 3.606 1.572 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CA . . . . . . . . . rr_6e5k 1
. 2 . 755 . 1 1 25 MVA CB C -4.299 2.458 2.544 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CB . . . . . . . . . rr_6e5k 1
. 2 . 756 . 1 1 25 MVA CG1 C -4.183 2.923 3.987 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG1 . . . . . . . . . rr_6e5k 1
. 2 . 757 . 1 1 25 MVA CG2 C -5.287 1.307 2.435 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG2 . . . . . . . . . rr_6e5k 1
. 2 . 758 . 1 1 25 MVA CN C -3.866 5.816 2.579 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CN . . . . . . . . . rr_6e5k 1
. 2 . 759 . 1 1 25 MVA HA H -4.698 3.176 0.579 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HA . . . . . . . . . rr_6e5k 1
. 2 . 760 . 1 1 25 MVA HB H -3.332 2.089 2.238 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HB . . . . . . . . . rr_6e5k 1
. 2 . 761 . 1 1 25 MVA HG11 H -5.105 3.395 4.287 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG11 . . . . . . . . . rr_6e5k 1
. 2 . 762 . 1 1 25 MVA HG12 H -3.370 3.629 4.071 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG12 . . . . . . . . . rr_6e5k 1
. 2 . 763 . 1 1 25 MVA HG13 H -3.989 2.072 4.623 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG13 . . . . . . . . . rr_6e5k 1
. 2 . 764 . 1 1 25 MVA HG21 H -5.270 0.911 1.431 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG21 . . . . . . . . . rr_6e5k 1
. 2 . 765 . 1 1 25 MVA HG22 H -6.281 1.663 2.662 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG22 . . . . . . . . . rr_6e5k 1
. 2 . 766 . 1 1 25 MVA HG23 H -5.016 0.530 3.134 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG23 . . . . . . . . . rr_6e5k 1
. 2 . 767 . 1 1 25 MVA HN1 H -3.912 6.764 2.066 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN1 . . . . . . . . . rr_6e5k 1
. 2 . 768 . 1 1 25 MVA HN2 H -3.009 5.802 3.236 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN2 . . . . . . . . . rr_6e5k 1
. 2 . 769 . 1 1 25 MVA HN3 H -4.768 5.679 3.158 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN3 . . . . . . . . . rr_6e5k 1
. 2 . 770 . 1 1 25 MVA N N -3.746 4.725 1.588 . . . 1.0 . . . . . . . . . . . . A . 25 MVA N . . . . . . . . . rr_6e5k 1
. 2 . 771 . 1 1 25 MVA O O -6.496 4.521 2.925 . . . 1.0 . . . . . . . . . . . . A . 25 MVA O . . . . . . . . . rr_6e5k 1
. 2 . 772 . 1 1 26 HIS C C -9.246 2.973 0.891 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_6e5k 1
. 2 . 773 . 1 1 26 HIS CA C -8.387 4.225 0.919 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_6e5k 1
. 2 . 774 . 1 1 26 HIS CB C -8.797 5.152 -0.227 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_6e5k 1
. 2 . 775 . 1 1 26 HIS CD2 C -7.031 7.045 -0.115 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_6e5k 1
. 2 . 776 . 1 1 26 HIS CE1 C -8.393 8.739 0.129 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_6e5k 1
. 2 . 777 . 1 1 26 HIS CG C -8.289 6.554 -0.093 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_6e5k 1
. 2 . 778 . 1 1 26 HIS H H -6.636 3.477 -0.008 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_6e5k 1
. 2 . 779 . 1 1 26 HIS HA H -8.542 4.735 1.858 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_6e5k 1
. 2 . 780 . 1 1 26 HIS HB2 H -8.421 4.751 -1.154 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_6e5k 1
. 2 . 781 . 1 1 26 HIS HB3 H -9.873 5.194 -0.272 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_6e5k 1
. 2 . 782 . 1 1 26 HIS HD1 H -10.100 7.613 0.109 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_6e5k 1
. 2 . 783 . 1 1 26 HIS HD2 H -6.120 6.471 -0.222 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_6e5k 1
. 2 . 784 . 1 1 26 HIS HE1 H -8.776 9.741 0.251 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_6e5k 1
. 2 . 785 . 1 1 26 HIS HE2 H -6.368 9.003 0.229 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_6e5k 1
. 2 . 786 . 1 1 26 HIS N N -6.978 3.873 0.828 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_6e5k 1
. 2 . 787 . 1 1 26 HIS ND1 N -9.119 7.642 0.061 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_6e5k 1
. 2 . 788 . 1 1 26 HIS NE2 N -7.122 8.406 0.026 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_6e5k 1
. 2 . 789 . 1 1 26 HIS O O -9.216 2.209 -0.075 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_6e5k 1
. 2 . 790 . 1 1 27 CYS C C -12.307 2.049 1.695 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . rr_6e5k 1
. 2 . 791 . 1 1 27 CYS CA C -10.888 1.620 2.036 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . rr_6e5k 1
. 2 . 792 . 1 1 27 CYS CB C -10.841 1.004 3.431 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . rr_6e5k 1
. 2 . 793 . 1 1 27 CYS H H -9.928 3.370 2.717 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . rr_6e5k 1
. 2 . 794 . 1 1 27 CYS HA H -10.562 0.884 1.316 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . rr_6e5k 1
. 2 . 795 . 1 1 27 CYS HB2 H -11.113 1.754 4.157 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . rr_6e5k 1
. 2 . 796 . 1 1 27 CYS HB3 H -11.545 0.188 3.480 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . rr_6e5k 1
. 2 . 797 . 1 1 27 CYS N N -9.988 2.754 1.956 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . rr_6e5k 1
. 2 . 798 . 1 1 27 CYS O O -13.068 2.472 2.563 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . rr_6e5k 1
. 2 . 799 . 1 1 27 CYS SG S -9.200 0.355 3.888 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . rr_6e5k 1
. 2 . 800 . 1 1 28 NH2 HN1 H -11.995 1.620 -0.217 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . rr_6e5k 1
. 2 . 801 . 1 1 28 NH2 HN2 H -13.551 2.261 0.172 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . rr_6e5k 1
. 2 . 802 . 1 1 28 NH2 N N -12.653 1.967 0.424 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . rr_6e5k 1
. 3 . 803 . 1 1 1 ASN C C 8.658 -9.195 -1.506 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . rr_6e5k 1
. 3 . 804 . 1 1 1 ASN CA C 8.159 -10.603 -1.250 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . rr_6e5k 1
. 3 . 805 . 1 1 1 ASN CB C 7.829 -10.767 0.238 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . rr_6e5k 1
. 3 . 806 . 1 1 1 ASN CG C 6.983 -11.992 0.513 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . rr_6e5k 1
. 3 . 807 . 1 1 1 ASN H1 H 10.051 -11.461 -1.150 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . rr_6e5k 1
. 3 . 808 . 1 1 1 ASN H2 H 9.362 -11.493 -2.693 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . rr_6e5k 1
. 3 . 809 . 1 1 1 ASN H3 H 8.817 -12.560 -1.501 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . rr_6e5k 1
. 3 . 810 . 1 1 1 ASN HA H 7.261 -10.764 -1.830 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . rr_6e5k 1
. 3 . 811 . 1 1 1 ASN HB2 H 8.748 -10.856 0.796 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . rr_6e5k 1
. 3 . 812 . 1 1 1 ASN HB3 H 7.290 -9.896 0.579 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . rr_6e5k 1
. 3 . 813 . 1 1 1 ASN HD21 H 6.187 -11.112 2.111 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . rr_6e5k 1
. 3 . 814 . 1 1 1 ASN HD22 H 5.625 -12.715 1.772 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . rr_6e5k 1
. 3 . 815 . 1 1 1 ASN N N 9.167 -11.599 -1.678 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . rr_6e5k 1
. 3 . 816 . 1 1 1 ASN ND2 N 6.185 -11.934 1.569 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . rr_6e5k 1
. 3 . 817 . 1 1 1 ASN O O 9.860 -8.968 -1.637 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . rr_6e5k 1
. 3 . 818 . 1 1 1 ASN OD1 O 7.046 -12.980 -0.214 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . rr_6e5k 1
. 3 . 819 . 1 1 2 ASP C C 7.121 -5.986 -0.972 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . rr_6e5k 1
. 3 . 820 . 1 1 2 ASP CA C 8.062 -6.856 -1.784 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . rr_6e5k 1
. 3 . 821 . 1 1 2 ASP CB C 7.974 -6.482 -3.263 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . rr_6e5k 1
. 3 . 822 . 1 1 2 ASP CG C 8.297 -5.023 -3.504 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . rr_6e5k 1
. 3 . 823 . 1 1 2 ASP H H 6.786 -8.505 -1.490 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . rr_6e5k 1
. 3 . 824 . 1 1 2 ASP HA H 9.072 -6.701 -1.437 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . rr_6e5k 1
. 3 . 825 . 1 1 2 ASP HB2 H 8.671 -7.084 -3.824 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . rr_6e5k 1
. 3 . 826 . 1 1 2 ASP HB3 H 6.973 -6.674 -3.617 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . rr_6e5k 1
. 3 . 827 . 1 1 2 ASP N N 7.728 -8.255 -1.583 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . rr_6e5k 1
. 3 . 828 . 1 1 2 ASP O O 6.007 -6.408 -0.669 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . rr_6e5k 1
. 3 . 829 . 1 1 2 ASP OD1 O 7.359 -4.236 -3.742 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . rr_6e5k 1
. 3 . 830 . 1 1 2 ASP OD2 O 9.492 -4.662 -3.474 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . rr_6e5k 1
. 3 . 831 . 1 1 3 ABA C C 5.411 -3.628 -0.482 . . . 1.0 . . . . . . . . . . . . A . 3 AIB C . . . . . . . . . rr_6e5k 1
. 3 . 832 . 1 1 3 ABA CA C 6.789 -3.833 0.162 . . . 1.0 . . . . . . . . . . . . A . 3 AIB CA . . . . . . . . . rr_6e5k 1
. 3 . 833 . 1 1 3 ABA H H 8.477 -4.524 -0.915 . . . 1.0 . . . . . . . . . . . . A . 3 AIB H . . . . . . . . . rr_6e5k 1
. 3 . 834 . 1 1 3 ABA N N 7.577 -4.784 -0.628 . . . 1.0 . . . . . . . . . . . . A . 3 AIB N . . . . . . . . . rr_6e5k 1
. 3 . 835 . 1 1 3 ABA O O 4.378 -3.786 0.172 . . . 1.0 . . . . . . . . . . . . A . 3 AIB O . . . . . . . . . rr_6e5k 1
. 3 . 836 . 1 1 4 CYS C C 3.267 -4.243 -2.518 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . rr_6e5k 1
. 3 . 837 . 1 1 4 CYS CA C 4.159 -3.009 -2.466 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . rr_6e5k 1
. 3 . 838 . 1 1 4 CYS CB C 4.436 -2.489 -3.877 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . rr_6e5k 1
. 3 . 839 . 1 1 4 CYS H H 6.249 -3.278 -2.270 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . rr_6e5k 1
. 3 . 840 . 1 1 4 CYS HA H 3.648 -2.242 -1.907 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . rr_6e5k 1
. 3 . 841 . 1 1 4 CYS HB2 H 4.989 -3.233 -4.423 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . rr_6e5k 1
. 3 . 842 . 1 1 4 CYS HB3 H 3.497 -2.309 -4.375 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . rr_6e5k 1
. 3 . 843 . 1 1 4 CYS N N 5.402 -3.303 -1.770 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . rr_6e5k 1
. 3 . 844 . 1 1 4 CYS O O 2.053 -4.146 -2.352 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . rr_6e5k 1
. 3 . 845 . 1 1 4 CYS SG S 5.397 -0.941 -3.922 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . rr_6e5k 1
. 3 . 846 . 1 1 5 LYS C C 2.463 -6.934 -1.434 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_6e5k 1
. 3 . 847 . 1 1 5 LYS CA C 3.153 -6.664 -2.766 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_6e5k 1
. 3 . 848 . 1 1 5 LYS CB C 4.106 -7.818 -3.103 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_6e5k 1
. 3 . 849 . 1 1 5 LYS CD C 4.445 -10.295 -3.359 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_6e5k 1
. 3 . 850 . 1 1 5 LYS CE C 3.775 -11.652 -3.523 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_6e5k 1
. 3 . 851 . 1 1 5 LYS CG C 3.425 -9.175 -3.216 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_6e5k 1
. 3 . 852 . 1 1 5 LYS H H 4.859 -5.412 -2.822 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_6e5k 1
. 3 . 853 . 1 1 5 LYS HA H 2.404 -6.583 -3.537 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_6e5k 1
. 3 . 854 . 1 1 5 LYS HB2 H 4.589 -7.605 -4.045 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_6e5k 1
. 3 . 855 . 1 1 5 LYS HB3 H 4.860 -7.882 -2.332 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_6e5k 1
. 3 . 856 . 1 1 5 LYS HD2 H 5.056 -10.101 -4.227 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_6e5k 1
. 3 . 857 . 1 1 5 LYS HD3 H 5.068 -10.315 -2.476 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_6e5k 1
. 3 . 858 . 1 1 5 LYS HE2 H 4.538 -12.419 -3.523 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_6e5k 1
. 3 . 859 . 1 1 5 LYS HE3 H 3.107 -11.813 -2.690 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_6e5k 1
. 3 . 860 . 1 1 5 LYS HG2 H 2.836 -9.349 -2.327 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_6e5k 1
. 3 . 861 . 1 1 5 LYS HG3 H 2.780 -9.174 -4.084 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_6e5k 1
. 3 . 862 . 1 1 5 LYS HZ1 H 2.272 -11.002 -4.822 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 3 . 863 . 1 1 5 LYS HZ2 H 2.541 -12.670 -4.862 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 3 . 864 . 1 1 5 LYS HZ3 H 3.637 -11.623 -5.605 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 3 . 865 . 1 1 5 LYS N N 3.884 -5.403 -2.714 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_6e5k 1
. 3 . 866 . 1 1 5 LYS NZ N 3.002 -11.742 -4.790 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_6e5k 1
. 3 . 867 . 1 1 5 LYS O O 1.264 -7.220 -1.392 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_6e5k 1
. 3 . 868 . 1 1 6 ABA C C 1.570 -6.125 1.291 . . . 1.0 . . . . . . . . . . . . A . 6 AIB C . . . . . . . . . rr_6e5k 1
. 3 . 869 . 1 1 6 ABA CA C 2.747 -7.055 1.002 . . . 1.0 . . . . . . . . . . . . A . 6 AIB CA . . . . . . . . . rr_6e5k 1
. 3 . 870 . 1 1 6 ABA H H 4.169 -6.533 -0.476 . . . 1.0 . . . . . . . . . . . . A . 6 AIB H . . . . . . . . . rr_6e5k 1
. 3 . 871 . 1 1 6 ABA N N 3.235 -6.810 -0.356 . . . 1.0 . . . . . . . . . . . . A . 6 AIB N . . . . . . . . . rr_6e5k 1
. 3 . 872 . 1 1 6 ABA O O 0.526 -6.559 1.775 . . . 1.0 . . . . . . . . . . . . A . 6 AIB O . . . . . . . . . rr_6e5k 1
. 3 . 873 . 1 1 7 LEU C C -0.529 -4.114 0.417 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . rr_6e5k 1
. 3 . 874 . 1 1 7 LEU CA C 0.722 -3.849 1.242 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . rr_6e5k 1
. 3 . 875 . 1 1 7 LEU CB C 1.252 -2.444 0.951 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . rr_6e5k 1
. 3 . 876 . 1 1 7 LEU CD1 C 2.959 -0.648 1.304 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . rr_6e5k 1
. 3 . 877 . 1 1 7 LEU CD2 C 2.218 -2.041 3.233 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . rr_6e5k 1
. 3 . 878 . 1 1 7 LEU CG C 2.496 -2.028 1.739 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . rr_6e5k 1
. 3 . 879 . 1 1 7 LEU H H 2.586 -4.571 0.541 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . rr_6e5k 1
. 3 . 880 . 1 1 7 LEU HA H 0.468 -3.918 2.287 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . rr_6e5k 1
. 3 . 881 . 1 1 7 LEU HB2 H 1.481 -2.383 -0.101 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . rr_6e5k 1
. 3 . 882 . 1 1 7 LEU HB3 H 0.465 -1.740 1.170 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . rr_6e5k 1
. 3 . 883 . 1 1 7 LEU HD11 H 3.844 -0.373 1.859 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . rr_6e5k 1
. 3 . 884 . 1 1 7 LEU HD12 H 2.175 0.068 1.499 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . rr_6e5k 1
. 3 . 885 . 1 1 7 LEU HD13 H 3.183 -0.659 0.248 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . rr_6e5k 1
. 3 . 886 . 1 1 7 LEU HD21 H 1.940 -3.038 3.540 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . rr_6e5k 1
. 3 . 887 . 1 1 7 LEU HD22 H 1.411 -1.357 3.452 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . rr_6e5k 1
. 3 . 888 . 1 1 7 LEU HD23 H 3.104 -1.733 3.767 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . rr_6e5k 1
. 3 . 889 . 1 1 7 LEU HG H 3.295 -2.728 1.537 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . rr_6e5k 1
. 3 . 890 . 1 1 7 LEU N N 1.744 -4.847 0.970 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . rr_6e5k 1
. 3 . 891 . 1 1 7 LEU O O -1.648 -3.997 0.915 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . rr_6e5k 1
. 3 . 892 . 1 1 8 LYS C C -2.285 -5.930 -1.200 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . rr_6e5k 1
. 3 . 893 . 1 1 8 LYS CA C -1.464 -4.762 -1.721 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . rr_6e5k 1
. 3 . 894 . 1 1 8 LYS CB C -0.989 -5.040 -3.149 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . rr_6e5k 1
. 3 . 895 . 1 1 8 LYS CD C -0.172 -4.099 -5.343 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . rr_6e5k 1
. 3 . 896 . 1 1 8 LYS CE C -1.305 -4.743 -6.133 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . rr_6e5k 1
. 3 . 897 . 1 1 8 LYS CG C -0.585 -3.785 -3.911 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . rr_6e5k 1
. 3 . 898 . 1 1 8 LYS H H 0.577 -4.576 -1.183 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . rr_6e5k 1
. 3 . 899 . 1 1 8 LYS HA H -2.090 -3.886 -1.728 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . rr_6e5k 1
. 3 . 900 . 1 1 8 LYS HB2 H -0.137 -5.701 -3.109 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . rr_6e5k 1
. 3 . 901 . 1 1 8 LYS HB3 H -1.785 -5.524 -3.692 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . rr_6e5k 1
. 3 . 902 . 1 1 8 LYS HD2 H 0.116 -3.181 -5.832 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . rr_6e5k 1
. 3 . 903 . 1 1 8 LYS HD3 H 0.671 -4.776 -5.320 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . rr_6e5k 1
. 3 . 904 . 1 1 8 LYS HE2 H -0.978 -4.893 -7.151 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . rr_6e5k 1
. 3 . 905 . 1 1 8 LYS HE3 H -1.540 -5.700 -5.689 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . rr_6e5k 1
. 3 . 906 . 1 1 8 LYS HG2 H -1.421 -3.104 -3.933 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . rr_6e5k 1
. 3 . 907 . 1 1 8 LYS HG3 H 0.246 -3.318 -3.402 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . rr_6e5k 1
. 3 . 908 . 1 1 8 LYS HZ1 H -3.283 -4.366 -6.680 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 3 . 909 . 1 1 8 LYS HZ2 H -2.326 -2.978 -6.578 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 3 . 910 . 1 1 8 LYS HZ3 H -2.861 -3.740 -5.169 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 3 . 911 . 1 1 8 LYS N N -0.341 -4.484 -0.841 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . rr_6e5k 1
. 3 . 912 . 1 1 8 LYS NZ N -2.527 -3.899 -6.141 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . rr_6e5k 1
. 3 . 913 . 1 1 8 LYS O O -3.499 -5.815 -1.057 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . rr_6e5k 1
. 3 . 914 . 1 1 9 ABA C C -2.946 -7.888 0.971 . . . 1.0 . . . . . . . . . . . . A . 9 AIB C . . . . . . . . . rr_6e5k 1
. 3 . 915 . 1 1 9 ABA CA C -2.262 -8.234 -0.356 . . . 1.0 . . . . . . . . . . . . A . 9 AIB CA . . . . . . . . . rr_6e5k 1
. 3 . 916 . 1 1 9 ABA H H -0.633 -7.044 -1.028 . . . 1.0 . . . . . . . . . . . . A . 9 AIB H . . . . . . . . . rr_6e5k 1
. 3 . 917 . 1 1 9 ABA N N -1.609 -7.034 -0.894 . . . 1.0 . . . . . . . . . . . . A . 9 AIB N . . . . . . . . . rr_6e5k 1
. 3 . 918 . 1 1 9 ABA O O -4.061 -8.335 1.253 . . . 1.0 . . . . . . . . . . . . A . 9 AIB O . . . . . . . . . rr_6e5k 1
. 3 . 919 . 1 1 10 ARG C C -4.012 -5.879 3.018 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . rr_6e5k 1
. 3 . 920 . 1 1 10 ARG CA C -2.732 -6.704 3.097 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . rr_6e5k 1
. 3 . 921 . 1 1 10 ARG CB C -1.631 -5.914 3.805 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . rr_6e5k 1
. 3 . 922 . 1 1 10 ARG CD C -0.749 -4.842 5.868 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . rr_6e5k 1
. 3 . 923 . 1 1 10 ARG CG C -1.966 -5.475 5.215 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . rr_6e5k 1
. 3 . 924 . 1 1 10 ARG CZ C -0.106 -4.074 8.111 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . rr_6e5k 1
. 3 . 925 . 1 1 10 ARG H H -1.396 -6.732 1.462 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . rr_6e5k 1
. 3 . 926 . 1 1 10 ARG HA H -2.928 -7.606 3.653 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . rr_6e5k 1
. 3 . 927 . 1 1 10 ARG HB2 H -0.742 -6.523 3.849 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . rr_6e5k 1
. 3 . 928 . 1 1 10 ARG HB3 H -1.415 -5.029 3.223 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . rr_6e5k 1
. 3 . 929 . 1 1 10 ARG HD2 H 0.019 -5.595 5.965 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . rr_6e5k 1
. 3 . 930 . 1 1 10 ARG HD3 H -0.392 -4.046 5.232 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . rr_6e5k 1
. 3 . 931 . 1 1 10 ARG HE H -1.974 -4.075 7.393 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . rr_6e5k 1
. 3 . 932 . 1 1 10 ARG HG2 H -2.767 -4.753 5.178 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . rr_6e5k 1
. 3 . 933 . 1 1 10 ARG HG3 H -2.270 -6.335 5.790 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . rr_6e5k 1
. 3 . 934 . 1 1 10 ARG HH11 H 1.868 -4.212 8.561 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . rr_6e5k 1
. 3 . 935 . 1 1 10 ARG HH12 H 1.427 -4.787 6.985 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . rr_6e5k 1
. 3 . 936 . 1 1 10 ARG HH21 H -1.395 -3.309 9.474 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . rr_6e5k 1
. 3 . 937 . 1 1 10 ARG HH22 H 0.266 -3.371 9.973 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . rr_6e5k 1
. 3 . 938 . 1 1 10 ARG N N -2.261 -7.084 1.772 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . rr_6e5k 1
. 3 . 939 . 1 1 10 ARG NE N -1.039 -4.298 7.190 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . rr_6e5k 1
. 3 . 940 . 1 1 10 ARG NH1 N 1.164 -4.381 7.865 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . rr_6e5k 1
. 3 . 941 . 1 1 10 ARG NH2 N -0.440 -3.544 9.279 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . rr_6e5k 1
. 3 . 942 . 1 1 10 ARG O O -4.936 -6.066 3.811 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . rr_6e5k 1
. 3 . 943 . 1 1 11 TYR C C -6.045 -4.404 0.708 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . rr_6e5k 1
. 3 . 944 . 1 1 11 TYR CA C -5.191 -4.067 1.929 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . rr_6e5k 1
. 3 . 945 . 1 1 11 TYR CB C -4.675 -2.632 1.846 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . rr_6e5k 1
. 3 . 946 . 1 1 11 TYR CD1 C -4.537 -1.956 4.271 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . rr_6e5k 1
. 3 . 947 . 1 1 11 TYR CD2 C -2.513 -2.055 3.019 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . rr_6e5k 1
. 3 . 948 . 1 1 11 TYR CE1 C -3.830 -1.568 5.392 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . rr_6e5k 1
. 3 . 949 . 1 1 11 TYR CE2 C -1.797 -1.667 4.136 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . rr_6e5k 1
. 3 . 950 . 1 1 11 TYR CG C -3.893 -2.206 3.068 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . rr_6e5k 1
. 3 . 951 . 1 1 11 TYR CZ C -2.460 -1.424 5.320 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . rr_6e5k 1
. 3 . 952 . 1 1 11 TYR H H -3.328 -4.921 1.404 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . rr_6e5k 1
. 3 . 953 . 1 1 11 TYR HA H -5.798 -4.168 2.816 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . rr_6e5k 1
. 3 . 954 . 1 1 11 TYR HB2 H -4.028 -2.538 0.986 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . rr_6e5k 1
. 3 . 955 . 1 1 11 TYR HB3 H -5.513 -1.963 1.736 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . rr_6e5k 1
. 3 . 956 . 1 1 11 TYR HD1 H -5.609 -2.071 4.325 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . rr_6e5k 1
. 3 . 957 . 1 1 11 TYR HD2 H -1.996 -2.248 2.088 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . rr_6e5k 1
. 3 . 958 . 1 1 11 TYR HE1 H -4.351 -1.379 6.317 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . rr_6e5k 1
. 3 . 959 . 1 1 11 TYR HE2 H -0.727 -1.556 4.076 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . rr_6e5k 1
. 3 . 960 . 1 1 11 TYR HH H -1.080 -0.387 6.195 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . rr_6e5k 1
. 3 . 961 . 1 1 11 TYR N N -4.067 -4.979 2.054 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . rr_6e5k 1
. 3 . 962 . 1 1 11 TYR O O -6.441 -3.516 -0.044 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . rr_6e5k 1
. 3 . 963 . 1 1 11 TYR OH O -1.751 -1.041 6.440 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . rr_6e5k 1
. 3 . 964 . 1 1 12 ABA C C -8.505 -5.476 -0.651 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . rr_6e5k 1
. 3 . 965 . 1 1 12 ABA CA C -7.153 -6.201 -0.580 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . rr_6e5k 1
. 3 . 966 . 1 1 12 ABA H H -5.984 -6.335 1.194 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . rr_6e5k 1
. 3 . 967 . 1 1 12 ABA N N -6.338 -5.693 0.543 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . rr_6e5k 1
. 3 . 968 . 1 1 12 ABA O O -9.022 -5.212 -1.737 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . rr_6e5k 1
. 3 . 969 . 1 1 13 GLY C C -10.276 -3.000 0.362 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_6e5k 1
. 3 . 970 . 1 1 13 GLY CA C -10.368 -4.504 0.531 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_6e5k 1
. 3 . 971 . 1 1 13 GLY H H -8.610 -5.365 1.342 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_6e5k 1
. 3 . 972 . 1 1 13 GLY HA2 H -10.976 -4.906 -0.264 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_6e5k 1
. 3 . 973 . 1 1 13 GLY HA3 H -10.845 -4.718 1.476 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_6e5k 1
. 3 . 974 . 1 1 13 GLY N N -9.073 -5.156 0.503 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_6e5k 1
. 3 . 975 . 1 1 13 GLY O O -11.268 -2.287 0.517 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_6e5k 1
. 3 . 976 . 1 1 14 CYS C C -7.949 -0.836 -1.314 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_6e5k 1
. 3 . 977 . 1 1 14 CYS CA C -8.857 -1.090 -0.113 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_6e5k 1
. 3 . 978 . 1 1 14 CYS CB C -8.208 -0.535 1.156 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_6e5k 1
. 3 . 979 . 1 1 14 CYS H H -8.337 -3.135 -0.100 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_6e5k 1
. 3 . 980 . 1 1 14 CYS HA H -9.806 -0.605 -0.274 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_6e5k 1
. 3 . 981 . 1 1 14 CYS HB2 H -7.199 -0.903 1.219 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_6e5k 1
. 3 . 982 . 1 1 14 CYS HB3 H -8.187 0.544 1.098 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_6e5k 1
. 3 . 983 . 1 1 14 CYS N N -9.088 -2.515 0.041 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_6e5k 1
. 3 . 984 . 1 1 14 CYS O O -7.573 -1.769 -2.029 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_6e5k 1
. 3 . 985 . 1 1 14 CYS SG S -9.059 -0.992 2.705 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_6e5k 1
. 3 . 986 . 1 1 15 GLU C C -5.387 1.335 -1.972 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_6e5k 1
. 3 . 987 . 1 1 15 GLU CA C -6.672 0.789 -2.590 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_6e5k 1
. 3 . 988 . 1 1 15 GLU CB C -7.285 1.825 -3.534 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_6e5k 1
. 3 . 989 . 1 1 15 GLU CD C -9.052 2.338 -5.260 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_6e5k 1
. 3 . 990 . 1 1 15 GLU CG C -8.488 1.309 -4.305 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_6e5k 1
. 3 . 991 . 1 1 15 GLU H H -8.027 1.135 -1.005 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_6e5k 1
. 3 . 992 . 1 1 15 GLU HA H -6.439 -0.102 -3.152 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_6e5k 1
. 3 . 993 . 1 1 15 GLU HB2 H -7.598 2.681 -2.954 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_6e5k 1
. 3 . 994 . 1 1 15 GLU HB3 H -6.534 2.136 -4.244 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_6e5k 1
. 3 . 995 . 1 1 15 GLU HG2 H -8.191 0.440 -4.873 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_6e5k 1
. 3 . 996 . 1 1 15 GLU HG3 H -9.259 1.032 -3.601 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_6e5k 1
. 3 . 997 . 1 1 15 GLU N N -7.617 0.425 -1.545 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_6e5k 1
. 3 . 998 . 1 1 15 GLU O O -5.369 2.462 -1.463 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_6e5k 1
. 3 . 999 . 1 1 15 GLU OE1 O -10.001 3.051 -4.881 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_6e5k 1
. 3 . 1000 . 1 1 15 GLU OE2 O -8.557 2.428 -6.402 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_6e5k 1
. 3 . 1001 . 1 1 16 MVA C C -2.159 1.630 -2.554 . . . 1.0 . . . . . . . . . . . . A . 16 MVA C . . . . . . . . . rr_6e5k 1
. 3 . 1002 . 1 1 16 MVA CA C -3.011 1.004 -1.444 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CA . . . . . . . . . rr_6e5k 1
. 3 . 1003 . 1 1 16 MVA CB C -2.187 -0.130 -0.751 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CB . . . . . . . . . rr_6e5k 1
. 3 . 1004 . 1 1 16 MVA CG1 C -1.252 -0.851 -1.722 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG1 . . . . . . . . . rr_6e5k 1
. 3 . 1005 . 1 1 16 MVA CG2 C -1.384 0.430 0.411 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG2 . . . . . . . . . rr_6e5k 1
. 3 . 1006 . 1 1 16 MVA CN C -4.446 -0.860 -2.445 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CN . . . . . . . . . rr_6e5k 1
. 3 . 1007 . 1 1 16 MVA HA H -3.181 1.773 -0.700 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HA . . . . . . . . . rr_6e5k 1
. 3 . 1008 . 1 1 16 MVA HB H -2.881 -0.856 -0.355 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HB . . . . . . . . . rr_6e5k 1
. 3 . 1009 . 1 1 16 MVA HG11 H -0.814 -1.704 -1.229 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG11 . . . . . . . . . rr_6e5k 1
. 3 . 1010 . 1 1 16 MVA HG12 H -0.470 -0.175 -2.032 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG12 . . . . . . . . . rr_6e5k 1
. 3 . 1011 . 1 1 16 MVA HG13 H -1.807 -1.178 -2.588 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG13 . . . . . . . . . rr_6e5k 1
. 3 . 1012 . 1 1 16 MVA HG21 H -0.823 -0.363 0.877 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG21 . . . . . . . . . rr_6e5k 1
. 3 . 1013 . 1 1 16 MVA HG22 H -2.053 0.872 1.133 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG22 . . . . . . . . . rr_6e5k 1
. 3 . 1014 . 1 1 16 MVA HG23 H -0.699 1.183 0.045 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG23 . . . . . . . . . rr_6e5k 1
. 3 . 1015 . 1 1 16 MVA HN1 H -5.370 -1.279 -2.076 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN1 . . . . . . . . . rr_6e5k 1
. 3 . 1016 . 1 1 16 MVA HN2 H -3.619 -1.451 -2.088 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN2 . . . . . . . . . rr_6e5k 1
. 3 . 1017 . 1 1 16 MVA HN3 H -4.457 -0.867 -3.524 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN3 . . . . . . . . . rr_6e5k 1
. 3 . 1018 . 1 1 16 MVA N N -4.308 0.529 -1.959 . . . 1.0 . . . . . . . . . . . . A . 16 MVA N . . . . . . . . . rr_6e5k 1
. 3 . 1019 . 1 1 16 MVA O O -2.217 1.221 -3.719 . . . 1.0 . . . . . . . . . . . . A . 16 MVA O . . . . . . . . . rr_6e5k 1
. 3 . 1020 . 1 1 17 ARG C C 0.917 3.313 -2.362 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_6e5k 1
. 3 . 1021 . 1 1 17 ARG CA C -0.427 3.267 -3.064 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_6e5k 1
. 3 . 1022 . 1 1 17 ARG CB C -0.841 4.695 -3.412 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_6e5k 1
. 3 . 1023 . 1 1 17 ARG CD C -2.589 6.288 -4.216 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_6e5k 1
. 3 . 1024 . 1 1 17 ARG CG C -2.242 4.827 -3.976 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_6e5k 1
. 3 . 1025 . 1 1 17 ARG CZ C -4.661 7.608 -4.343 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_6e5k 1
. 3 . 1026 . 1 1 17 ARG H H -1.487 2.986 -1.262 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_6e5k 1
. 3 . 1027 . 1 1 17 ARG HA H -0.349 2.678 -3.963 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_6e5k 1
. 3 . 1028 . 1 1 17 ARG HB2 H -0.781 5.297 -2.521 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_6e5k 1
. 3 . 1029 . 1 1 17 ARG HB3 H -0.146 5.086 -4.140 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_6e5k 1
. 3 . 1030 . 1 1 17 ARG HD2 H -2.381 6.844 -3.314 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_6e5k 1
. 3 . 1031 . 1 1 17 ARG HD3 H -1.969 6.664 -5.017 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_6e5k 1
. 3 . 1032 . 1 1 17 ARG HE H -4.456 5.732 -5.014 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_6e5k 1
. 3 . 1033 . 1 1 17 ARG HG2 H -2.295 4.290 -4.913 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_6e5k 1
. 3 . 1034 . 1 1 17 ARG HG3 H -2.945 4.405 -3.273 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_6e5k 1
. 3 . 1035 . 1 1 17 ARG HH11 H -4.562 9.488 -3.590 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_6e5k 1
. 3 . 1036 . 1 1 17 ARG HH12 H -3.085 8.576 -3.495 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_6e5k 1
. 3 . 1037 . 1 1 17 ARG HH21 H -6.398 6.936 -5.135 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_6e5k 1
. 3 . 1038 . 1 1 17 ARG HH22 H -6.439 8.559 -4.517 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_6e5k 1
. 3 . 1039 . 1 1 17 ARG N N -1.395 2.643 -2.178 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_6e5k 1
. 3 . 1040 . 1 1 17 ARG NE N -3.991 6.482 -4.573 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_6e5k 1
. 3 . 1041 . 1 1 17 ARG NH1 N -4.055 8.638 -3.764 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_6e5k 1
. 3 . 1042 . 1 1 17 ARG NH2 N -5.934 7.708 -4.694 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_6e5k 1
. 3 . 1043 . 1 1 17 ARG O O 1.083 4.057 -1.395 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_6e5k 1
. 3 . 1044 . 1 1 18 CYS C C 4.078 3.572 -2.728 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . rr_6e5k 1
. 3 . 1045 . 1 1 18 CYS CA C 3.168 2.478 -2.177 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . rr_6e5k 1
. 3 . 1046 . 1 1 18 CYS CB C 3.812 1.095 -2.325 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . rr_6e5k 1
. 3 . 1047 . 1 1 18 CYS H H 1.695 1.960 -3.610 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . rr_6e5k 1
. 3 . 1048 . 1 1 18 CYS HA H 3.007 2.673 -1.125 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . rr_6e5k 1
. 3 . 1049 . 1 1 18 CYS HB2 H 4.801 1.122 -1.894 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . rr_6e5k 1
. 3 . 1050 . 1 1 18 CYS HB3 H 3.213 0.372 -1.790 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . rr_6e5k 1
. 3 . 1051 . 1 1 18 CYS N N 1.866 2.519 -2.819 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . rr_6e5k 1
. 3 . 1052 . 1 1 18 CYS O O 4.326 3.650 -3.932 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . rr_6e5k 1
. 3 . 1053 . 1 1 18 CYS SG S 3.981 0.510 -4.042 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . rr_6e5k 1
. 3 . 1054 . 1 1 19 ASP C C 6.648 5.542 -1.299 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . rr_6e5k 1
. 3 . 1055 . 1 1 19 ASP CA C 5.415 5.535 -2.200 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . rr_6e5k 1
. 3 . 1056 . 1 1 19 ASP CB C 4.655 6.859 -2.063 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . rr_6e5k 1
. 3 . 1057 . 1 1 19 ASP CG C 5.376 8.019 -2.719 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . rr_6e5k 1
. 3 . 1058 . 1 1 19 ASP H H 4.325 4.299 -0.887 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . rr_6e5k 1
. 3 . 1059 . 1 1 19 ASP HA H 5.722 5.402 -3.225 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . rr_6e5k 1
. 3 . 1060 . 1 1 19 ASP HB2 H 3.684 6.756 -2.523 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . rr_6e5k 1
. 3 . 1061 . 1 1 19 ASP HB3 H 4.528 7.084 -1.014 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . rr_6e5k 1
. 3 . 1062 . 1 1 19 ASP N N 4.554 4.423 -1.834 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . rr_6e5k 1
. 3 . 1063 . 1 1 19 ASP O O 6.661 6.188 -0.247 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . rr_6e5k 1
. 3 . 1064 . 1 1 19 ASP OD1 O 6.201 8.671 -2.037 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . rr_6e5k 1
. 3 . 1065 . 1 1 19 ASP OD2 O 5.139 8.282 -3.918 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . rr_6e5k 1
. 3 . 1066 . 1 1 20 DPR C C 8.569 4.048 0.499 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . rr_6e5k 1
. 3 . 1067 . 1 1 20 DPR CA C 8.898 4.646 -0.868 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . rr_6e5k 1
. 3 . 1068 . 1 1 20 DPR CB C 9.778 3.692 -1.677 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . rr_6e5k 1
. 3 . 1069 . 1 1 20 DPR CD C 7.804 4.070 -2.962 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . rr_6e5k 1
. 3 . 1070 . 1 1 20 DPR CG C 9.278 3.801 -3.075 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . rr_6e5k 1
. 3 . 1071 . 1 1 20 DPR HA H 9.416 5.582 -0.739 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . rr_6e5k 1
. 3 . 1072 . 1 1 20 DPR HB2 H 10.810 3.998 -1.599 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . rr_6e5k 1
. 3 . 1073 . 1 1 20 DPR HB3 H 9.665 2.688 -1.297 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . rr_6e5k 1
. 3 . 1074 . 1 1 20 DPR HD2 H 7.470 4.679 -3.787 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . rr_6e5k 1
. 3 . 1075 . 1 1 20 DPR HD3 H 7.250 3.145 -2.922 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . rr_6e5k 1
. 3 . 1076 . 1 1 20 DPR HG2 H 9.770 4.618 -3.581 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . rr_6e5k 1
. 3 . 1077 . 1 1 20 DPR HG3 H 9.450 2.873 -3.601 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . rr_6e5k 1
. 3 . 1078 . 1 1 20 DPR N N 7.697 4.803 -1.690 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . rr_6e5k 1
. 3 . 1079 . 1 1 20 DPR O O 7.992 2.962 0.591 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . rr_6e5k 1
. 3 . 1080 . 1 1 21 PRO C C 7.226 4.603 3.399 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . rr_6e5k 1
. 3 . 1081 . 1 1 21 PRO CA C 8.656 4.312 2.947 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . rr_6e5k 1
. 3 . 1082 . 1 1 21 PRO CB C 9.647 5.139 3.760 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . rr_6e5k 1
. 3 . 1083 . 1 1 21 PRO CD C 9.632 6.053 1.551 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . rr_6e5k 1
. 3 . 1084 . 1 1 21 PRO CG C 9.756 6.418 3.007 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . rr_6e5k 1
. 3 . 1085 . 1 1 21 PRO HA H 8.870 3.262 3.072 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . rr_6e5k 1
. 3 . 1086 . 1 1 21 PRO HB2 H 9.261 5.293 4.756 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . rr_6e5k 1
. 3 . 1087 . 1 1 21 PRO HB3 H 10.596 4.630 3.807 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . rr_6e5k 1
. 3 . 1088 . 1 1 21 PRO HD2 H 9.056 6.798 1.022 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . rr_6e5k 1
. 3 . 1089 . 1 1 21 PRO HD3 H 10.609 5.944 1.105 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . rr_6e5k 1
. 3 . 1090 . 1 1 21 PRO HG2 H 8.955 7.081 3.297 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . rr_6e5k 1
. 3 . 1091 . 1 1 21 PRO HG3 H 10.714 6.879 3.199 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . rr_6e5k 1
. 3 . 1092 . 1 1 21 PRO N N 8.922 4.759 1.577 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . rr_6e5k 1
. 3 . 1093 . 1 1 21 PRO O O 6.799 4.163 4.469 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . rr_6e5k 1
. 3 . 1094 . 1 1 22 ARG C C 4.142 5.113 1.978 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . rr_6e5k 1
. 3 . 1095 . 1 1 22 ARG CA C 5.142 5.760 2.925 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . rr_6e5k 1
. 3 . 1096 . 1 1 22 ARG CB C 5.064 7.291 2.845 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . rr_6e5k 1
. 3 . 1097 . 1 1 22 ARG CD C 3.734 9.403 3.155 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . rr_6e5k 1
. 3 . 1098 . 1 1 22 ARG CG C 3.705 7.881 3.186 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . rr_6e5k 1
. 3 . 1099 . 1 1 22 ARG CZ C 5.003 11.221 4.263 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . rr_6e5k 1
. 3 . 1100 . 1 1 22 ARG H H 6.852 5.583 1.696 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . rr_6e5k 1
. 3 . 1101 . 1 1 22 ARG HA H 4.933 5.439 3.936 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . rr_6e5k 1
. 3 . 1102 . 1 1 22 ARG HB2 H 5.791 7.707 3.526 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . rr_6e5k 1
. 3 . 1103 . 1 1 22 ARG HB3 H 5.318 7.593 1.841 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . rr_6e5k 1
. 3 . 1104 . 1 1 22 ARG HD2 H 4.145 9.719 2.210 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . rr_6e5k 1
. 3 . 1105 . 1 1 22 ARG HD3 H 2.721 9.771 3.247 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . rr_6e5k 1
. 3 . 1106 . 1 1 22 ARG HE H 4.743 9.383 5.003 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . rr_6e5k 1
. 3 . 1107 . 1 1 22 ARG HG2 H 2.981 7.531 2.464 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . rr_6e5k 1
. 3 . 1108 . 1 1 22 ARG HG3 H 3.417 7.554 4.175 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . rr_6e5k 1
. 3 . 1109 . 1 1 22 ARG HH11 H 4.272 11.726 2.440 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . rr_6e5k 1
. 3 . 1110 . 1 1 22 ARG HH12 H 5.131 12.983 3.271 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . rr_6e5k 1
. 3 . 1111 . 1 1 22 ARG HH21 H 6.031 12.593 5.342 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . rr_6e5k 1
. 3 . 1112 . 1 1 22 ARG HH22 H 5.854 11.036 6.093 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . rr_6e5k 1
. 3 . 1113 . 1 1 22 ARG N N 6.488 5.335 2.578 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . rr_6e5k 1
. 3 . 1114 . 1 1 22 ARG NE N 4.545 9.968 4.237 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . rr_6e5k 1
. 3 . 1115 . 1 1 22 ARG NH1 N 4.784 12.041 3.242 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . rr_6e5k 1
. 3 . 1116 . 1 1 22 ARG NH2 N 5.685 11.651 5.316 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . rr_6e5k 1
. 3 . 1117 . 1 1 22 ARG O O 4.506 4.699 0.885 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . rr_6e5k 1
. 3 . 1118 . 1 1 23 TYR C C 0.510 5.046 1.865 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . rr_6e5k 1
. 3 . 1119 . 1 1 23 TYR CA C 1.868 4.456 1.529 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . rr_6e5k 1
. 3 . 1120 . 1 1 23 TYR CB C 1.813 2.928 1.606 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . rr_6e5k 1
. 3 . 1121 . 1 1 23 TYR CD1 C 0.087 2.124 3.264 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . rr_6e5k 1
. 3 . 1122 . 1 1 23 TYR CD2 C 2.379 2.086 3.917 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . rr_6e5k 1
. 3 . 1123 . 1 1 23 TYR CE1 C -0.276 1.604 4.488 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . rr_6e5k 1
. 3 . 1124 . 1 1 23 TYR CE2 C 2.023 1.567 5.147 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . rr_6e5k 1
. 3 . 1125 . 1 1 23 TYR CG C 1.419 2.374 2.957 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . rr_6e5k 1
. 3 . 1126 . 1 1 23 TYR CZ C 0.693 1.328 5.426 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . rr_6e5k 1
. 3 . 1127 . 1 1 23 TYR H H 2.673 5.224 3.326 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . rr_6e5k 1
. 3 . 1128 . 1 1 23 TYR HA H 2.122 4.741 0.521 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . rr_6e5k 1
. 3 . 1129 . 1 1 23 TYR HB2 H 1.097 2.568 0.885 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . rr_6e5k 1
. 3 . 1130 . 1 1 23 TYR HB3 H 2.786 2.533 1.359 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . rr_6e5k 1
. 3 . 1131 . 1 1 23 TYR HD1 H -0.672 2.348 2.527 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . rr_6e5k 1
. 3 . 1132 . 1 1 23 TYR HD2 H 3.417 2.278 3.694 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . rr_6e5k 1
. 3 . 1133 . 1 1 23 TYR HE1 H -1.317 1.417 4.706 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . rr_6e5k 1
. 3 . 1134 . 1 1 23 TYR HE2 H 2.784 1.352 5.882 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . rr_6e5k 1
. 3 . 1135 . 1 1 23 TYR HH H 0.850 1.230 7.338 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . rr_6e5k 1
. 3 . 1136 . 1 1 23 TYR N N 2.899 4.980 2.404 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . rr_6e5k 1
. 3 . 1137 . 1 1 23 TYR O O 0.253 5.449 3.001 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . rr_6e5k 1
. 3 . 1138 . 1 1 23 TYR OH O 0.331 0.806 6.645 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . rr_6e5k 1
. 3 . 1139 . 1 1 24 GLU C C -2.610 4.277 1.042 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . rr_6e5k 1
. 3 . 1140 . 1 1 24 GLU CA C -1.722 5.507 1.039 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . rr_6e5k 1
. 3 . 1141 . 1 1 24 GLU CB C -2.182 6.434 -0.085 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . rr_6e5k 1
. 3 . 1142 . 1 1 24 GLU CD C -2.241 8.743 -1.046 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . rr_6e5k 1
. 3 . 1143 . 1 1 24 GLU CG C -1.561 7.815 -0.064 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . rr_6e5k 1
. 3 . 1144 . 1 1 24 GLU H H -0.026 4.859 -0.039 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . rr_6e5k 1
. 3 . 1145 . 1 1 24 GLU HA H -1.810 6.014 1.986 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . rr_6e5k 1
. 3 . 1146 . 1 1 24 GLU HB2 H -1.943 5.973 -1.029 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . rr_6e5k 1
. 3 . 1147 . 1 1 24 GLU HB3 H -3.253 6.549 -0.018 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . rr_6e5k 1
. 3 . 1148 . 1 1 24 GLU HG2 H -1.654 8.228 0.929 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . rr_6e5k 1
. 3 . 1149 . 1 1 24 GLU HG3 H -0.516 7.734 -0.328 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . rr_6e5k 1
. 3 . 1150 . 1 1 24 GLU N N -0.339 5.105 0.858 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . rr_6e5k 1
. 3 . 1151 . 1 1 24 GLU O O -2.311 3.308 0.359 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . rr_6e5k 1
. 3 . 1152 . 1 1 24 GLU OE1 O -3.381 9.175 -0.764 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . rr_6e5k 1
. 3 . 1153 . 1 1 24 GLU OE2 O -1.656 9.036 -2.105 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . rr_6e5k 1
. 3 . 1154 . 1 1 25 MVA C C -6.109 3.664 1.872 . . . 1.0 . . . . . . . . . . . . A . 25 MVA C . . . . . . . . . rr_6e5k 1
. 3 . 1155 . 1 1 25 MVA CA C -4.667 3.176 1.735 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CA . . . . . . . . . rr_6e5k 1
. 3 . 1156 . 1 1 25 MVA CB C -4.361 2.065 2.783 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CB . . . . . . . . . rr_6e5k 1
. 3 . 1157 . 1 1 25 MVA CG1 C -4.200 2.613 4.192 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG1 . . . . . . . . . rr_6e5k 1
. 3 . 1158 . 1 1 25 MVA CG2 C -5.446 1.003 2.746 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG2 . . . . . . . . . rr_6e5k 1
. 3 . 1159 . 1 1 25 MVA CN C -3.984 5.450 2.675 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CN . . . . . . . . . rr_6e5k 1
. 3 . 1160 . 1 1 25 MVA HA H -4.592 2.710 0.760 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HA . . . . . . . . . rr_6e5k 1
. 3 . 1161 . 1 1 25 MVA HB H -3.430 1.593 2.506 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HB . . . . . . . . . rr_6e5k 1
. 3 . 1162 . 1 1 25 MVA HG11 H -4.043 1.794 4.879 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG11 . . . . . . . . . rr_6e5k 1
. 3 . 1163 . 1 1 25 MVA HG12 H -5.090 3.153 4.472 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG12 . . . . . . . . . rr_6e5k 1
. 3 . 1164 . 1 1 25 MVA HG13 H -3.348 3.277 4.222 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG13 . . . . . . . . . rr_6e5k 1
. 3 . 1165 . 1 1 25 MVA HG21 H -6.403 1.462 2.948 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG21 . . . . . . . . . rr_6e5k 1
. 3 . 1166 . 1 1 25 MVA HG22 H -5.240 0.253 3.494 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG22 . . . . . . . . . rr_6e5k 1
. 3 . 1167 . 1 1 25 MVA HG23 H -5.466 0.544 1.768 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG23 . . . . . . . . . rr_6e5k 1
. 3 . 1168 . 1 1 25 MVA HN1 H -3.935 6.361 2.098 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN1 . . . . . . . . . rr_6e5k 1
. 3 . 1169 . 1 1 25 MVA HN2 H -3.244 5.483 3.462 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN2 . . . . . . . . . rr_6e5k 1
. 3 . 1170 . 1 1 25 MVA HN3 H -4.967 5.353 3.107 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN3 . . . . . . . . . rr_6e5k 1
. 3 . 1171 . 1 1 25 MVA N N -3.714 4.291 1.793 . . . 1.0 . . . . . . . . . . . . A . 25 MVA N . . . . . . . . . rr_6e5k 1
. 3 . 1172 . 1 1 25 MVA O O -6.604 3.946 2.965 . . . 1.0 . . . . . . . . . . . . A . 25 MVA O . . . . . . . . . rr_6e5k 1
. 3 . 1173 . 1 1 26 HIS C C -9.139 3.178 0.622 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_6e5k 1
. 3 . 1174 . 1 1 26 HIS CA C -8.124 4.305 0.688 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_6e5k 1
. 3 . 1175 . 1 1 26 HIS CB C -8.300 5.238 -0.513 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_6e5k 1
. 3 . 1176 . 1 1 26 HIS CD2 C -6.121 6.575 -0.974 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_6e5k 1
. 3 . 1177 . 1 1 26 HIS CE1 C -6.723 8.488 -0.094 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_6e5k 1
. 3 . 1178 . 1 1 26 HIS CG C -7.383 6.426 -0.502 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_6e5k 1
. 3 . 1179 . 1 1 26 HIS H H -6.351 3.459 -0.100 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_6e5k 1
. 3 . 1180 . 1 1 26 HIS HA H -8.286 4.866 1.594 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_6e5k 1
. 3 . 1181 . 1 1 26 HIS HB2 H -8.111 4.681 -1.417 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_6e5k 1
. 3 . 1182 . 1 1 26 HIS HB3 H -9.316 5.602 -0.528 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_6e5k 1
. 3 . 1183 . 1 1 26 HIS HD1 H -8.590 7.862 0.472 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_6e5k 1
. 3 . 1184 . 1 1 26 HIS HD2 H -5.528 5.817 -1.469 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_6e5k 1
. 3 . 1185 . 1 1 26 HIS HE1 H -6.712 9.515 0.238 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_6e5k 1
. 3 . 1186 . 1 1 26 HIS HE2 H -4.856 8.266 -0.921 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_6e5k 1
. 3 . 1187 . 1 1 26 HIS N N -6.774 3.770 0.733 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_6e5k 1
. 3 . 1188 . 1 1 26 HIS ND1 N -7.730 7.644 0.044 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_6e5k 1
. 3 . 1189 . 1 1 26 HIS NE2 N -5.736 7.864 -0.705 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_6e5k 1
. 3 . 1190 . 1 1 26 HIS O O -9.215 2.453 -0.371 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_6e5k 1
. 3 . 1191 . 1 1 27 CYS C C -12.283 2.567 1.460 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . rr_6e5k 1
. 3 . 1192 . 1 1 27 CYS CA C -10.908 1.991 1.773 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . rr_6e5k 1
. 3 . 1193 . 1 1 27 CYS CB C -10.898 1.379 3.172 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . rr_6e5k 1
. 3 . 1194 . 1 1 27 CYS H H -9.778 3.634 2.445 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . rr_6e5k 1
. 3 . 1195 . 1 1 27 CYS HA H -10.668 1.226 1.049 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . rr_6e5k 1
. 3 . 1196 . 1 1 27 CYS HB2 H -11.214 2.127 3.884 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . rr_6e5k 1
. 3 . 1197 . 1 1 27 CYS HB3 H -11.588 0.550 3.198 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . rr_6e5k 1
. 3 . 1198 . 1 1 27 CYS N N -9.900 3.027 1.686 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . rr_6e5k 1
. 3 . 1199 . 1 1 27 CYS O O -13.027 2.958 2.358 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . rr_6e5k 1
. 3 . 1200 . 1 1 27 CYS SG S -9.263 0.766 3.699 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . rr_6e5k 1
. 3 . 1201 . 1 1 28 NH2 HN1 H -11.974 2.305 -0.483 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . rr_6e5k 1
. 3 . 1202 . 1 1 28 NH2 HN2 H -13.487 3.012 -0.046 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . rr_6e5k 1
. 3 . 1203 . 1 1 28 NH2 N N -12.615 2.635 0.183 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . rr_6e5k 1
. 4 . 1204 . 1 1 1 ASN C C 8.223 -8.857 -1.841 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . rr_6e5k 1
. 4 . 1205 . 1 1 1 ASN CA C 7.752 -10.306 -1.943 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . rr_6e5k 1
. 4 . 1206 . 1 1 1 ASN CB C 7.274 -10.805 -0.573 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . rr_6e5k 1
. 4 . 1207 . 1 1 1 ASN CG C 5.932 -10.230 -0.154 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . rr_6e5k 1
. 4 . 1208 . 1 1 1 ASN H1 H 9.187 -10.830 -3.358 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . rr_6e5k 1
. 4 . 1209 . 1 1 1 ASN H2 H 8.554 -12.144 -2.508 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . rr_6e5k 1
. 4 . 1210 . 1 1 1 ASN H3 H 9.663 -11.110 -1.762 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . rr_6e5k 1
. 4 . 1211 . 1 1 1 ASN HA H 6.939 -10.366 -2.654 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . rr_6e5k 1
. 4 . 1212 . 1 1 1 ASN HB2 H 7.186 -11.880 -0.602 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1213 . 1 1 1 ASN HB3 H 8.007 -10.531 0.172 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1214 . 1 1 1 ASN HD21 H 5.557 -11.854 0.926 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . rr_6e5k 1
. 4 . 1215 . 1 1 1 ASN HD22 H 4.325 -10.641 0.935 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . rr_6e5k 1
. 4 . 1216 . 1 1 1 ASN N N 8.865 -11.158 -2.427 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . rr_6e5k 1
. 4 . 1217 . 1 1 1 ASN ND2 N 5.198 -10.982 0.649 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . rr_6e5k 1
. 4 . 1218 . 1 1 1 ASN O O 9.293 -8.584 -1.301 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . rr_6e5k 1
. 4 . 1219 . 1 1 1 ASN OD1 O 5.559 -9.125 -0.538 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . rr_6e5k 1
. 4 . 1220 . 1 1 2 ASP C C 6.891 -5.760 -1.396 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . rr_6e5k 1
. 4 . 1221 . 1 1 2 ASP CA C 7.790 -6.518 -2.354 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . rr_6e5k 1
. 4 . 1222 . 1 1 2 ASP CB C 7.664 -5.906 -3.752 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . rr_6e5k 1
. 4 . 1223 . 1 1 2 ASP CG C 8.453 -6.653 -4.804 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . rr_6e5k 1
. 4 . 1224 . 1 1 2 ASP H H 6.567 -8.200 -2.743 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . rr_6e5k 1
. 4 . 1225 . 1 1 2 ASP HA H 8.812 -6.435 -2.020 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . rr_6e5k 1
. 4 . 1226 . 1 1 2 ASP HB2 H 6.628 -5.903 -4.043 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1227 . 1 1 2 ASP HB3 H 8.022 -4.888 -3.721 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1228 . 1 1 2 ASP N N 7.428 -7.932 -2.364 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . rr_6e5k 1
. 4 . 1229 . 1 1 2 ASP O O 5.825 -6.252 -1.033 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . rr_6e5k 1
. 4 . 1230 . 1 1 2 ASP OD1 O 7.862 -7.509 -5.497 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . rr_6e5k 1
. 4 . 1231 . 1 1 2 ASP OD2 O 9.664 -6.388 -4.949 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . rr_6e5k 1
. 4 . 1232 . 1 1 3 ABA C C 5.121 -3.533 -0.659 . . . 1.0 . . . . . . . . . . . . A . 3 AIB C . . . . . . . . . rr_6e5k 1
. 4 . 1233 . 1 1 3 ABA CA C 6.536 -3.703 -0.102 . . . 1.0 . . . . . . . . . . . . A . 3 AIB CA . . . . . . . . . rr_6e5k 1
. 4 . 1234 . 1 1 3 ABA H H 8.178 -4.231 -1.343 . . . 1.0 . . . . . . . . . . . . A . 3 AIB H . . . . . . . . . rr_6e5k 1
. 4 . 1235 . 1 1 3 ABA N N 7.315 -4.556 -1.010 . . . 1.0 . . . . . . . . . . . . A . 3 AIB N . . . . . . . . . rr_6e5k 1
. 4 . 1236 . 1 1 3 ABA O O 4.134 -3.745 0.043 . . . 1.0 . . . . . . . . . . . . A . 3 AIB O . . . . . . . . . rr_6e5k 1
. 4 . 1237 . 1 1 4 CYS C C 2.903 -4.219 -2.573 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . rr_6e5k 1
. 4 . 1238 . 1 1 4 CYS CA C 3.754 -2.955 -2.591 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . rr_6e5k 1
. 4 . 1239 . 1 1 4 CYS CB C 3.968 -2.484 -4.028 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . rr_6e5k 1
. 4 . 1240 . 1 1 4 CYS H H 5.862 -3.049 -2.453 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . rr_6e5k 1
. 4 . 1241 . 1 1 4 CYS HA H 3.235 -2.183 -2.045 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . rr_6e5k 1
. 4 . 1242 . 1 1 4 CYS HB2 H 4.527 -3.232 -4.567 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1243 . 1 1 4 CYS HB3 H 3.008 -2.351 -4.501 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1244 . 1 1 4 CYS N N 5.038 -3.174 -1.937 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . rr_6e5k 1
. 4 . 1245 . 1 1 4 CYS O O 1.699 -4.160 -2.332 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . rr_6e5k 1
. 4 . 1246 . 1 1 4 CYS SG S 4.876 -0.911 -4.163 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . rr_6e5k 1
. 4 . 1247 . 1 1 5 LYS C C 2.248 -6.932 -1.457 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_6e5k 1
. 4 . 1248 . 1 1 5 LYS CA C 2.851 -6.641 -2.823 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_6e5k 1
. 4 . 1249 . 1 1 5 LYS CB C 3.824 -7.762 -3.208 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_6e5k 1
. 4 . 1250 . 1 1 5 LYS CD C 3.720 -7.842 -5.731 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_6e5k 1
. 4 . 1251 . 1 1 5 LYS CE C 4.439 -7.473 -7.020 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_6e5k 1
. 4 . 1252 . 1 1 5 LYS CG C 4.569 -7.518 -4.513 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_6e5k 1
. 4 . 1253 . 1 1 5 LYS H H 4.512 -5.340 -2.937 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_6e5k 1
. 4 . 1254 . 1 1 5 LYS HA H 2.059 -6.583 -3.552 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_6e5k 1
. 4 . 1255 . 1 1 5 LYS HB2 H 4.553 -7.871 -2.419 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1256 . 1 1 5 LYS HB3 H 3.270 -8.686 -3.302 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1257 . 1 1 5 LYS HD2 H 3.507 -8.901 -5.738 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_6e5k 1
. 4 . 1258 . 1 1 5 LYS HD3 H 2.796 -7.288 -5.672 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_6e5k 1
. 4 . 1259 . 1 1 5 LYS HE2 H 3.833 -7.786 -7.856 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_6e5k 1
. 4 . 1260 . 1 1 5 LYS HE3 H 4.569 -6.401 -7.052 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_6e5k 1
. 4 . 1261 . 1 1 5 LYS HG2 H 4.855 -6.478 -4.561 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_6e5k 1
. 4 . 1262 . 1 1 5 LYS HG3 H 5.455 -8.136 -4.531 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_6e5k 1
. 4 . 1263 . 1 1 5 LYS HZ1 H 5.678 -9.156 -7.031 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 4 . 1264 . 1 1 5 LYS HZ2 H 6.411 -7.776 -6.376 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 4 . 1265 . 1 1 5 LYS HZ3 H 6.201 -7.913 -8.050 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 4 . 1266 . 1 1 5 LYS N N 3.544 -5.359 -2.798 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_6e5k 1
. 4 . 1267 . 1 1 5 LYS NZ N 5.773 -8.125 -7.124 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_6e5k 1
. 4 . 1268 . 1 1 5 LYS O O 1.058 -7.240 -1.341 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_6e5k 1
. 4 . 1269 . 1 1 6 ABA C C 1.536 -6.139 1.342 . . . 1.0 . . . . . . . . . . . . A . 6 AIB C . . . . . . . . . rr_6e5k 1
. 4 . 1270 . 1 1 6 ABA CA C 2.689 -7.065 0.953 . . . 1.0 . . . . . . . . . . . . A . 6 AIB CA . . . . . . . . . rr_6e5k 1
. 4 . 1271 . 1 1 6 ABA H H 4.009 -6.521 -0.610 . . . 1.0 . . . . . . . . . . . . A . 6 AIB H . . . . . . . . . rr_6e5k 1
. 4 . 1272 . 1 1 6 ABA N N 3.085 -6.804 -0.430 . . . 1.0 . . . . . . . . . . . . A . 6 AIB N . . . . . . . . . rr_6e5k 1
. 4 . 1273 . 1 1 6 ABA O O 0.563 -6.568 1.963 . . . 1.0 . . . . . . . . . . . . A . 6 AIB O . . . . . . . . . rr_6e5k 1
. 4 . 1274 . 1 1 7 LEU C C -0.671 -4.163 0.639 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . rr_6e5k 1
. 4 . 1275 . 1 1 7 LEU CA C 0.656 -3.870 1.316 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . rr_6e5k 1
. 4 . 1276 . 1 1 7 LEU CB C 1.127 -2.466 0.934 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . rr_6e5k 1
. 4 . 1277 . 1 1 7 LEU CD1 C 2.820 -0.630 1.116 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . rr_6e5k 1
. 4 . 1278 . 1 1 7 LEU CD2 C 2.016 -1.779 3.175 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . rr_6e5k 1
. 4 . 1279 . 1 1 7 LEU CG C 2.347 -1.949 1.701 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . rr_6e5k 1
. 4 . 1280 . 1 1 7 LEU H H 2.441 -4.595 0.441 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . rr_6e5k 1
. 4 . 1281 . 1 1 7 LEU HA H 0.512 -3.911 2.383 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . rr_6e5k 1
. 4 . 1282 . 1 1 7 LEU HB2 H 1.363 -2.465 -0.118 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1283 . 1 1 7 LEU HB3 H 0.311 -1.780 1.101 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1284 . 1 1 7 LEU HD11 H 3.134 -0.779 0.095 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . rr_6e5k 1
. 4 . 1285 . 1 1 7 LEU HD12 H 3.650 -0.256 1.696 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . rr_6e5k 1
. 4 . 1286 . 1 1 7 LEU HD13 H 2.012 0.085 1.143 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . rr_6e5k 1
. 4 . 1287 . 1 1 7 LEU HD21 H 2.881 -1.401 3.697 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . rr_6e5k 1
. 4 . 1288 . 1 1 7 LEU HD22 H 1.731 -2.733 3.593 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . rr_6e5k 1
. 4 . 1289 . 1 1 7 LEU HD23 H 1.198 -1.082 3.280 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . rr_6e5k 1
. 4 . 1290 . 1 1 7 LEU HG H 3.151 -2.665 1.615 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . rr_6e5k 1
. 4 . 1291 . 1 1 7 LEU N N 1.657 -4.868 0.968 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . rr_6e5k 1
. 4 . 1292 . 1 1 7 LEU O O -1.715 -4.143 1.282 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . rr_6e5k 1
. 4 . 1293 . 1 1 8 LYS C C -2.554 -5.948 -0.919 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . rr_6e5k 1
. 4 . 1294 . 1 1 8 LYS CA C -1.855 -4.689 -1.406 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . rr_6e5k 1
. 4 . 1295 . 1 1 8 LYS CB C -1.575 -4.775 -2.907 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . rr_6e5k 1
. 4 . 1296 . 1 1 8 LYS CD C -1.050 -3.534 -5.030 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . rr_6e5k 1
. 4 . 1297 . 1 1 8 LYS CE C -0.616 -2.205 -5.627 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . rr_6e5k 1
. 4 . 1298 . 1 1 8 LYS CG C -1.150 -3.450 -3.519 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . rr_6e5k 1
. 4 . 1299 . 1 1 8 LYS H H 0.237 -4.500 -1.114 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . rr_6e5k 1
. 4 . 1300 . 1 1 8 LYS HA H -2.509 -3.850 -1.226 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . rr_6e5k 1
. 4 . 1301 . 1 1 8 LYS HB2 H -0.787 -5.495 -3.073 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1302 . 1 1 8 LYS HB3 H -2.470 -5.111 -3.411 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1303 . 1 1 8 LYS HD2 H -0.325 -4.290 -5.290 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . rr_6e5k 1
. 4 . 1304 . 1 1 8 LYS HD3 H -2.015 -3.803 -5.432 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . rr_6e5k 1
. 4 . 1305 . 1 1 8 LYS HE2 H -1.298 -1.436 -5.297 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . rr_6e5k 1
. 4 . 1306 . 1 1 8 LYS HE3 H 0.380 -1.976 -5.277 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . rr_6e5k 1
. 4 . 1307 . 1 1 8 LYS HG2 H -1.877 -2.695 -3.260 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . rr_6e5k 1
. 4 . 1308 . 1 1 8 LYS HG3 H -0.186 -3.173 -3.118 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . rr_6e5k 1
. 4 . 1309 . 1 1 8 LYS HZ1 H -0.312 -1.319 -7.490 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 4 . 1310 . 1 1 8 LYS HZ2 H -1.563 -2.454 -7.468 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 4 . 1311 . 1 1 8 LYS HZ3 H 0.046 -2.972 -7.452 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 4 . 1312 . 1 1 8 LYS N N -0.632 -4.447 -0.656 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . rr_6e5k 1
. 4 . 1313 . 1 1 8 LYS NZ N -0.611 -2.239 -7.111 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . rr_6e5k 1
. 4 . 1314 . 1 1 8 LYS O O -3.774 -5.951 -0.751 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . rr_6e5k 1
. 4 . 1315 . 1 1 9 ABA C C -2.918 -8.028 1.228 . . . 1.0 . . . . . . . . . . . . A . 9 AIB C . . . . . . . . . rr_6e5k 1
. 4 . 1316 . 1 1 9 ABA CA C -2.299 -8.269 -0.155 . . . 1.0 . . . . . . . . . . . . A . 9 AIB CA . . . . . . . . . rr_6e5k 1
. 4 . 1317 . 1 1 9 ABA H H -0.807 -6.928 -0.861 . . . 1.0 . . . . . . . . . . . . A . 9 AIB H . . . . . . . . . rr_6e5k 1
. 4 . 1318 . 1 1 9 ABA N N -1.773 -7.002 -0.679 . . . 1.0 . . . . . . . . . . . . A . 9 AIB N . . . . . . . . . rr_6e5k 1
. 4 . 1319 . 1 1 9 ABA O O -4.008 -8.514 1.532 . . . 1.0 . . . . . . . . . . . . A . 9 AIB O . . . . . . . . . rr_6e5k 1
. 4 . 1320 . 1 1 10 ARG C C -3.931 -6.159 3.409 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . rr_6e5k 1
. 4 . 1321 . 1 1 10 ARG CA C -2.640 -6.967 3.413 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . rr_6e5k 1
. 4 . 1322 . 1 1 10 ARG CB C -1.544 -6.189 4.145 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . rr_6e5k 1
. 4 . 1323 . 1 1 10 ARG CD C -0.843 -4.861 6.142 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . rr_6e5k 1
. 4 . 1324 . 1 1 10 ARG CG C -1.940 -5.710 5.524 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . rr_6e5k 1
. 4 . 1325 . 1 1 10 ARG CZ C -0.568 -3.271 8.007 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . rr_6e5k 1
. 4 . 1326 . 1 1 10 ARG H H -1.351 -6.893 1.738 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . rr_6e5k 1
. 4 . 1327 . 1 1 10 ARG HA H -2.812 -7.900 3.923 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . rr_6e5k 1
. 4 . 1328 . 1 1 10 ARG HB2 H -0.677 -6.824 4.245 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1329 . 1 1 10 ARG HB3 H -1.277 -5.325 3.553 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1330 . 1 1 10 ARG HD2 H 0.002 -5.496 6.364 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . rr_6e5k 1
. 4 . 1331 . 1 1 10 ARG HD3 H -0.546 -4.107 5.428 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . rr_6e5k 1
. 4 . 1332 . 1 1 10 ARG HE H -2.150 -4.478 7.745 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . rr_6e5k 1
. 4 . 1333 . 1 1 10 ARG HG2 H -2.840 -5.119 5.444 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . rr_6e5k 1
. 4 . 1334 . 1 1 10 ARG HG3 H -2.122 -6.568 6.154 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . rr_6e5k 1
. 4 . 1335 . 1 1 10 ARG HH11 H 1.153 -2.196 8.013 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . rr_6e5k 1
. 4 . 1336 . 1 1 10 ARG HH12 H 0.990 -3.329 6.709 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . rr_6e5k 1
. 4 . 1337 . 1 1 10 ARG HH21 H -1.936 -2.991 9.479 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . rr_6e5k 1
. 4 . 1338 . 1 1 10 ARG HH22 H -0.508 -2.011 9.595 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . rr_6e5k 1
. 4 . 1339 . 1 1 10 ARG N N -2.204 -7.267 2.054 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . rr_6e5k 1
. 4 . 1340 . 1 1 10 ARG NE N -1.278 -4.206 7.374 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . rr_6e5k 1
. 4 . 1341 . 1 1 10 ARG NH1 N 0.617 -2.901 7.537 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . rr_6e5k 1
. 4 . 1342 . 1 1 10 ARG NH2 N -1.043 -2.714 9.114 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . rr_6e5k 1
. 4 . 1343 . 1 1 10 ARG O O -4.863 -6.442 4.162 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . rr_6e5k 1
. 4 . 1344 . 1 1 11 TYR C C -6.105 -4.775 1.412 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . rr_6e5k 1
. 4 . 1345 . 1 1 11 TYR CA C -5.128 -4.278 2.465 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . rr_6e5k 1
. 4 . 1346 . 1 1 11 TYR CB C -4.671 -2.854 2.164 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . rr_6e5k 1
. 4 . 1347 . 1 1 11 TYR CD1 C -4.651 -1.705 4.412 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . rr_6e5k 1
. 4 . 1348 . 1 1 11 TYR CD2 C -2.570 -2.095 3.322 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . rr_6e5k 1
. 4 . 1349 . 1 1 11 TYR CE1 C -3.991 -1.103 5.464 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . rr_6e5k 1
. 4 . 1350 . 1 1 11 TYR CE2 C -1.902 -1.499 4.371 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . rr_6e5k 1
. 4 . 1351 . 1 1 11 TYR CG C -3.953 -2.210 3.325 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . rr_6e5k 1
. 4 . 1352 . 1 1 11 TYR CZ C -2.650 -1.046 5.484 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . rr_6e5k 1
. 4 . 1353 . 1 1 11 TYR H H -3.222 -5.014 1.942 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . rr_6e5k 1
. 4 . 1354 . 1 1 11 TYR HA H -5.620 -4.290 3.426 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . rr_6e5k 1
. 4 . 1355 . 1 1 11 TYR HB2 H -3.996 -2.867 1.321 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1356 . 1 1 11 TYR HB3 H -5.529 -2.251 1.926 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1357 . 1 1 11 TYR HD1 H -5.730 -1.787 4.429 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . rr_6e5k 1
. 4 . 1358 . 1 1 11 TYR HD2 H -2.015 -2.483 2.482 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . rr_6e5k 1
. 4 . 1359 . 1 1 11 TYR HE1 H -4.552 -0.716 6.300 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . rr_6e5k 1
. 4 . 1360 . 1 1 11 TYR HE2 H -0.826 -1.421 4.350 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . rr_6e5k 1
. 4 . 1361 . 1 1 11 TYR HH H -1.202 0.098 6.140 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . rr_6e5k 1
. 4 . 1362 . 1 1 11 TYR N N -3.981 -5.160 2.550 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . rr_6e5k 1
. 4 . 1363 . 1 1 11 TYR O O -6.477 -4.043 0.491 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . rr_6e5k 1
. 4 . 1364 . 1 1 11 TYR OH O -1.950 -0.407 6.484 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . rr_6e5k 1
. 4 . 1365 . 1 1 12 ABA C C -8.714 -5.802 0.535 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . rr_6e5k 1
. 4 . 1366 . 1 1 12 ABA CA C -7.467 -6.685 0.680 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . rr_6e5k 1
. 4 . 1367 . 1 1 12 ABA H H -6.122 -6.554 2.308 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . rr_6e5k 1
. 4 . 1368 . 1 1 12 ABA N N -6.502 -6.035 1.567 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . rr_6e5k 1
. 4 . 1369 . 1 1 12 ABA O O -9.327 -5.412 1.531 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . rr_6e5k 1
. 4 . 1370 . 1 1 13 GLY C C -10.004 -3.199 -0.968 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_6e5k 1
. 4 . 1371 . 1 1 13 GLY CA C -10.258 -4.692 -0.950 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_6e5k 1
. 4 . 1372 . 1 1 13 GLY H H -8.496 -5.747 -1.451 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_6e5k 1
. 4 . 1373 . 1 1 13 GLY HA2 H -10.667 -4.987 -1.904 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_6e5k 1
. 4 . 1374 . 1 1 13 GLY HA3 H -10.980 -4.914 -0.178 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_6e5k 1
. 4 . 1375 . 1 1 13 GLY N N -9.060 -5.466 -0.700 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_6e5k 1
. 4 . 1376 . 1 1 13 GLY O O -10.866 -2.423 -1.381 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_6e5k 1
. 4 . 1377 . 1 1 14 CYS C C -7.341 -1.067 -1.409 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_6e5k 1
. 4 . 1378 . 1 1 14 CYS CA C -8.487 -1.383 -0.461 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_6e5k 1
. 4 . 1379 . 1 1 14 CYS CB C -8.093 -1.006 0.965 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_6e5k 1
. 4 . 1380 . 1 1 14 CYS H H -8.159 -3.457 -0.242 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_6e5k 1
. 4 . 1381 . 1 1 14 CYS HA H -9.356 -0.813 -0.752 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_6e5k 1
. 4 . 1382 . 1 1 14 CYS HB2 H -7.129 -1.430 1.184 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1383 . 1 1 14 CYS HB3 H -8.034 0.070 1.040 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1384 . 1 1 14 CYS N N -8.826 -2.792 -0.528 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_6e5k 1
. 4 . 1385 . 1 1 14 CYS O O -6.504 -1.923 -1.694 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_6e5k 1
. 4 . 1386 . 1 1 14 CYS SG S -9.260 -1.586 2.238 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_6e5k 1
. 4 . 1387 . 1 1 15 GLU C C -5.119 1.178 -1.958 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_6e5k 1
. 4 . 1388 . 1 1 15 GLU CA C -6.264 0.612 -2.784 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_6e5k 1
. 4 . 1389 . 1 1 15 GLU CB C -6.803 1.686 -3.728 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_6e5k 1
. 4 . 1390 . 1 1 15 GLU CD C -8.604 2.387 -5.335 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_6e5k 1
. 4 . 1391 . 1 1 15 GLU CG C -8.020 1.255 -4.521 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_6e5k 1
. 4 . 1392 . 1 1 15 GLU H H -8.017 0.792 -1.626 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_6e5k 1
. 4 . 1393 . 1 1 15 GLU HA H -5.913 -0.232 -3.356 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_6e5k 1
. 4 . 1394 . 1 1 15 GLU HB2 H -7.071 2.555 -3.144 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1395 . 1 1 15 GLU HB3 H -6.024 1.959 -4.425 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1396 . 1 1 15 GLU HG2 H -7.734 0.459 -5.192 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_6e5k 1
. 4 . 1397 . 1 1 15 GLU HG3 H -8.773 0.894 -3.837 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_6e5k 1
. 4 . 1398 . 1 1 15 GLU N N -7.316 0.160 -1.893 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_6e5k 1
. 4 . 1399 . 1 1 15 GLU O O -5.362 1.836 -0.947 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_6e5k 1
. 4 . 1400 . 1 1 15 GLU OE1 O -9.113 3.355 -4.735 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_6e5k 1
. 4 . 1401 . 1 1 15 GLU OE2 O -8.552 2.313 -6.581 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_6e5k 1
. 4 . 1402 . 1 1 16 MVA C C -1.556 1.921 -2.414 . . . 1.0 . . . . . . . . . . . . A . 16 MVA C . . . . . . . . . rr_6e5k 1
. 4 . 1403 . 1 1 16 MVA CA C -2.734 1.444 -1.557 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CA . . . . . . . . . rr_6e5k 1
. 4 . 1404 . 1 1 16 MVA CB C -2.256 0.402 -0.503 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CB . . . . . . . . . rr_6e5k 1
. 4 . 1405 . 1 1 16 MVA CG1 C -1.870 -0.927 -1.126 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG1 . . . . . . . . . rr_6e5k 1
. 4 . 1406 . 1 1 16 MVA CG2 C -1.097 0.958 0.304 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG2 . . . . . . . . . rr_6e5k 1
. 4 . 1407 . 1 1 16 MVA CN C -3.617 0.222 -3.625 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CN . . . . . . . . . rr_6e5k 1
. 4 . 1408 . 1 1 16 MVA HA H -3.070 2.309 -0.997 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HA . . . . . . . . . rr_6e5k 1
. 4 . 1409 . 1 1 16 MVA HB H -3.072 0.217 0.179 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HB . . . . . . . . . rr_6e5k 1
. 4 . 1410 . 1 1 16 MVA HG11 H -2.731 -1.357 -1.615 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG11 . . . . . . . . . rr_6e5k 1
. 4 . 1411 . 1 1 16 MVA HG12 H -1.521 -1.597 -0.354 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG12 . . . . . . . . . rr_6e5k 1
. 4 . 1412 . 1 1 16 MVA HG13 H -1.084 -0.769 -1.851 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG13 . . . . . . . . . rr_6e5k 1
. 4 . 1413 . 1 1 16 MVA HG21 H -0.255 1.131 -0.351 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG21 . . . . . . . . . rr_6e5k 1
. 4 . 1414 . 1 1 16 MVA HG22 H -0.818 0.250 1.071 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG22 . . . . . . . . . rr_6e5k 1
. 4 . 1415 . 1 1 16 MVA HG23 H -1.393 1.889 0.762 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG23 . . . . . . . . . rr_6e5k 1
. 4 . 1416 . 1 1 16 MVA HN1 H -4.267 0.610 -4.393 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN1 . . . . . . . . . rr_6e5k 1
. 4 . 1417 . 1 1 16 MVA HN2 H -3.814 -0.830 -3.482 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN2 . . . . . . . . . rr_6e5k 1
. 4 . 1418 . 1 1 16 MVA HN3 H -2.587 0.358 -3.924 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN3 . . . . . . . . . rr_6e5k 1
. 4 . 1419 . 1 1 16 MVA N N -3.862 0.948 -2.357 . . . 1.0 . . . . . . . . . . . . A . 16 MVA N . . . . . . . . . rr_6e5k 1
. 4 . 1420 . 1 1 16 MVA O O -0.841 1.136 -3.048 . . . 1.0 . . . . . . . . . . . . A . 16 MVA O . . . . . . . . . rr_6e5k 1
. 4 . 1421 . 1 1 17 ARG C C 1.004 3.682 -2.334 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_6e5k 1
. 4 . 1422 . 1 1 17 ARG CA C -0.274 3.861 -3.129 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_6e5k 1
. 4 . 1423 . 1 1 17 ARG CB C -0.558 5.349 -3.325 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_6e5k 1
. 4 . 1424 . 1 1 17 ARG CD C -2.211 7.125 -3.982 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_6e5k 1
. 4 . 1425 . 1 1 17 ARG CG C -1.920 5.633 -3.930 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_6e5k 1
. 4 . 1426 . 1 1 17 ARG CZ C -4.379 8.309 -3.999 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_6e5k 1
. 4 . 1427 . 1 1 17 ARG H H -1.982 3.794 -1.896 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_6e5k 1
. 4 . 1428 . 1 1 17 ARG HA H -0.172 3.380 -4.089 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_6e5k 1
. 4 . 1429 . 1 1 17 ARG HB2 H -0.501 5.843 -2.369 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1430 . 1 1 17 ARG HB3 H 0.194 5.760 -3.978 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1431 . 1 1 17 ARG HD2 H -2.138 7.528 -2.981 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_6e5k 1
. 4 . 1432 . 1 1 17 ARG HD3 H -1.476 7.602 -4.615 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_6e5k 1
. 4 . 1433 . 1 1 17 ARG HE H -3.837 6.884 -5.299 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_6e5k 1
. 4 . 1434 . 1 1 17 ARG HG2 H -1.945 5.235 -4.933 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_6e5k 1
. 4 . 1435 . 1 1 17 ARG HG3 H -2.675 5.147 -3.330 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_6e5k 1
. 4 . 1436 . 1 1 17 ARG HH11 H -4.649 9.705 -2.557 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_6e5k 1
. 4 . 1437 . 1 1 17 ARG HH12 H -3.114 8.889 -2.512 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_6e5k 1
. 4 . 1438 . 1 1 17 ARG HH21 H -5.856 7.955 -5.344 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_6e5k 1
. 4 . 1439 . 1 1 17 ARG HH22 H -6.206 9.180 -4.163 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_6e5k 1
. 4 . 1440 . 1 1 17 ARG N N -1.368 3.231 -2.414 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_6e5k 1
. 4 . 1441 . 1 1 17 ARG NE N -3.548 7.404 -4.510 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_6e5k 1
. 4 . 1442 . 1 1 17 ARG NH1 N -4.020 9.024 -2.939 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_6e5k 1
. 4 . 1443 . 1 1 17 ARG NH2 N -5.575 8.496 -4.545 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_6e5k 1
. 4 . 1444 . 1 1 17 ARG O O 1.204 4.335 -1.311 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_6e5k 1
. 4 . 1445 . 1 1 18 CYS C C 4.231 3.328 -2.458 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . rr_6e5k 1
. 4 . 1446 . 1 1 18 CYS CA C 3.057 2.441 -2.060 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . rr_6e5k 1
. 4 . 1447 . 1 1 18 CYS CB C 3.399 0.972 -2.297 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . rr_6e5k 1
. 4 . 1448 . 1 1 18 CYS H H 1.655 2.325 -3.632 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . rr_6e5k 1
. 4 . 1449 . 1 1 18 CYS HA H 2.856 2.585 -1.009 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . rr_6e5k 1
. 4 . 1450 . 1 1 18 CYS HB2 H 4.378 0.767 -1.890 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1451 . 1 1 18 CYS HB3 H 2.669 0.354 -1.797 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1452 . 1 1 18 CYS N N 1.849 2.781 -2.788 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . rr_6e5k 1
. 4 . 1453 . 1 1 18 CYS O O 4.495 3.544 -3.643 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . rr_6e5k 1
. 4 . 1454 . 1 1 18 CYS SG S 3.419 0.495 -4.056 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . rr_6e5k 1
. 4 . 1455 . 1 1 19 ASP C C 7.188 4.127 -0.645 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . rr_6e5k 1
. 4 . 1456 . 1 1 19 ASP CA C 6.144 4.610 -1.644 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . rr_6e5k 1
. 4 . 1457 . 1 1 19 ASP CB C 5.913 6.116 -1.460 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . rr_6e5k 1
. 4 . 1458 . 1 1 19 ASP CG C 5.136 6.744 -2.597 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . rr_6e5k 1
. 4 . 1459 . 1 1 19 ASP H H 4.584 3.719 -0.538 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . rr_6e5k 1
. 4 . 1460 . 1 1 19 ASP HA H 6.500 4.423 -2.646 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . rr_6e5k 1
. 4 . 1461 . 1 1 19 ASP HB2 H 5.365 6.278 -0.545 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1462 . 1 1 19 ASP HB3 H 6.872 6.610 -1.389 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1463 . 1 1 19 ASP N N 4.914 3.852 -1.454 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . rr_6e5k 1
. 4 . 1464 . 1 1 19 ASP O O 7.456 4.793 0.361 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . rr_6e5k 1
. 4 . 1465 . 1 1 19 ASP OD1 O 3.918 6.981 -2.433 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . rr_6e5k 1
. 4 . 1466 . 1 1 19 ASP OD2 O 5.731 6.986 -3.669 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . rr_6e5k 1
. 4 . 1467 . 1 1 20 DPR C C 8.110 2.070 1.391 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . rr_6e5k 1
. 4 . 1468 . 1 1 20 DPR CA C 8.736 2.322 0.017 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . rr_6e5k 1
. 4 . 1469 . 1 1 20 DPR CB C 9.092 1.001 -0.664 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . rr_6e5k 1
. 4 . 1470 . 1 1 20 DPR CD C 7.602 2.153 -2.128 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . rr_6e5k 1
. 4 . 1471 . 1 1 20 DPR CG C 8.774 1.214 -2.104 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . rr_6e5k 1
. 4 . 1472 . 1 1 20 DPR HA H 9.630 2.912 0.131 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . rr_6e5k 1
. 4 . 1473 . 1 1 20 DPR HB2 H 10.141 0.790 -0.516 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1474 . 1 1 20 DPR HB3 H 8.496 0.205 -0.243 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1475 . 1 1 20 DPR HD2 H 7.639 2.778 -3.007 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . rr_6e5k 1
. 4 . 1476 . 1 1 20 DPR HD3 H 6.674 1.604 -2.091 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . rr_6e5k 1
. 4 . 1477 . 1 1 20 DPR HG2 H 9.622 1.656 -2.607 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . rr_6e5k 1
. 4 . 1478 . 1 1 20 DPR HG3 H 8.511 0.273 -2.566 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . rr_6e5k 1
. 4 . 1479 . 1 1 20 DPR N N 7.787 2.954 -0.906 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . rr_6e5k 1
. 4 . 1480 . 1 1 20 DPR O O 7.156 1.299 1.519 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . rr_6e5k 1
. 4 . 1481 . 1 1 21 PRO C C 6.807 3.342 3.998 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . rr_6e5k 1
. 4 . 1482 . 1 1 21 PRO CA C 8.127 2.600 3.799 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . rr_6e5k 1
. 4 . 1483 . 1 1 21 PRO CB C 9.227 3.241 4.644 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . rr_6e5k 1
. 4 . 1484 . 1 1 21 PRO CD C 9.814 3.621 2.365 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . rr_6e5k 1
. 4 . 1485 . 1 1 21 PRO CG C 9.859 4.234 3.736 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . rr_6e5k 1
. 4 . 1486 . 1 1 21 PRO HA H 8.006 1.567 4.086 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . rr_6e5k 1
. 4 . 1487 . 1 1 21 PRO HB2 H 8.790 3.716 5.510 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1488 . 1 1 21 PRO HB3 H 9.934 2.489 4.956 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1489 . 1 1 21 PRO HD2 H 9.671 4.382 1.614 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . rr_6e5k 1
. 4 . 1490 . 1 1 21 PRO HD3 H 10.716 3.061 2.170 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . rr_6e5k 1
. 4 . 1491 . 1 1 21 PRO HG2 H 9.297 5.155 3.755 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . rr_6e5k 1
. 4 . 1492 . 1 1 21 PRO HG3 H 10.880 4.410 4.034 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . rr_6e5k 1
. 4 . 1493 . 1 1 21 PRO N N 8.645 2.723 2.432 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . rr_6e5k 1
. 4 . 1494 . 1 1 21 PRO O O 6.103 3.125 4.985 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . rr_6e5k 1
. 4 . 1495 . 1 1 22 ARG C C 4.204 4.428 2.218 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . rr_6e5k 1
. 4 . 1496 . 1 1 22 ARG CA C 5.256 4.999 3.147 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . rr_6e5k 1
. 4 . 1497 . 1 1 22 ARG CB C 5.527 6.457 2.784 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . rr_6e5k 1
. 4 . 1498 . 1 1 22 ARG CD C 6.766 8.582 3.278 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . rr_6e5k 1
. 4 . 1499 . 1 1 22 ARG CG C 6.460 7.168 3.749 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . rr_6e5k 1
. 4 . 1500 . 1 1 22 ARG CZ C 7.068 9.293 0.928 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . rr_6e5k 1
. 4 . 1501 . 1 1 22 ARG H H 7.058 4.321 2.270 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . rr_6e5k 1
. 4 . 1502 . 1 1 22 ARG HA H 4.894 4.946 4.163 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . rr_6e5k 1
. 4 . 1503 . 1 1 22 ARG HB2 H 5.972 6.492 1.799 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1504 . 1 1 22 ARG HB3 H 4.589 6.990 2.764 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1505 . 1 1 22 ARG HD2 H 5.837 9.122 3.178 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . rr_6e5k 1
. 4 . 1506 . 1 1 22 ARG HD3 H 7.386 9.069 4.018 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . rr_6e5k 1
. 4 . 1507 . 1 1 22 ARG HE H 8.291 8.056 1.920 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . rr_6e5k 1
. 4 . 1508 . 1 1 22 ARG HG2 H 5.990 7.215 4.719 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . rr_6e5k 1
. 4 . 1509 . 1 1 22 ARG HG3 H 7.383 6.610 3.818 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . rr_6e5k 1
. 4 . 1510 . 1 1 22 ARG HH11 H 5.406 10.044 1.814 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . rr_6e5k 1
. 4 . 1511 . 1 1 22 ARG HH12 H 5.660 10.538 0.173 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . rr_6e5k 1
. 4 . 1512 . 1 1 22 ARG HH21 H 7.492 9.782 -0.994 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . rr_6e5k 1
. 4 . 1513 . 1 1 22 ARG HH22 H 8.620 8.703 -0.234 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . rr_6e5k 1
. 4 . 1514 . 1 1 22 ARG N N 6.476 4.216 3.059 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . rr_6e5k 1
. 4 . 1515 . 1 1 22 ARG NE N 7.465 8.594 1.990 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . rr_6e5k 1
. 4 . 1516 . 1 1 22 ARG NH1 N 5.957 10.018 0.976 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . rr_6e5k 1
. 4 . 1517 . 1 1 22 ARG NH2 N 7.782 9.258 -0.188 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . rr_6e5k 1
. 4 . 1518 . 1 1 22 ARG O O 4.531 3.745 1.251 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . rr_6e5k 1
. 4 . 1519 . 1 1 23 TYR C C 0.579 5.009 1.982 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . rr_6e5k 1
. 4 . 1520 . 1 1 23 TYR CA C 1.854 4.241 1.675 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . rr_6e5k 1
. 4 . 1521 . 1 1 23 TYR CB C 1.617 2.740 1.831 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . rr_6e5k 1
. 4 . 1522 . 1 1 23 TYR CD1 C -0.102 2.166 3.586 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . rr_6e5k 1
. 4 . 1523 . 1 1 23 TYR CD2 C 2.202 2.071 4.191 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . rr_6e5k 1
. 4 . 1524 . 1 1 23 TYR CE1 C -0.456 1.786 4.863 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . rr_6e5k 1
. 4 . 1525 . 1 1 23 TYR CE2 C 1.855 1.689 5.468 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . rr_6e5k 1
. 4 . 1526 . 1 1 23 TYR CG C 1.232 2.316 3.228 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . rr_6e5k 1
. 4 . 1527 . 1 1 23 TYR CZ C 0.522 1.524 5.792 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . rr_6e5k 1
. 4 . 1528 . 1 1 23 TYR H H 2.740 5.167 3.351 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . rr_6e5k 1
. 4 . 1529 . 1 1 23 TYR HA H 2.136 4.443 0.652 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . rr_6e5k 1
. 4 . 1530 . 1 1 23 TYR HB2 H 0.822 2.440 1.166 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1531 . 1 1 23 TYR HB3 H 2.518 2.214 1.561 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1532 . 1 1 23 TYR HD1 H -0.867 2.352 2.847 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . rr_6e5k 1
. 4 . 1533 . 1 1 23 TYR HD2 H 3.244 2.181 3.927 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . rr_6e5k 1
. 4 . 1534 . 1 1 23 TYR HE1 H -1.498 1.673 5.121 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . rr_6e5k 1
. 4 . 1535 . 1 1 23 TYR HE2 H 2.625 1.502 6.203 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . rr_6e5k 1
. 4 . 1536 . 1 1 23 TYR HH H 0.741 1.652 7.714 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . rr_6e5k 1
. 4 . 1537 . 1 1 23 TYR N N 2.944 4.678 2.528 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . rr_6e5k 1
. 4 . 1538 . 1 1 23 TYR O O 0.395 5.516 3.091 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . rr_6e5k 1
. 4 . 1539 . 1 1 23 TYR OH O 0.180 1.173 7.078 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . rr_6e5k 1
. 4 . 1540 . 1 1 24 GLU C C -2.680 4.682 0.883 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . rr_6e5k 1
. 4 . 1541 . 1 1 24 GLU CA C -1.592 5.711 1.161 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . rr_6e5k 1
. 4 . 1542 . 1 1 24 GLU CB C -1.753 6.896 0.213 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . rr_6e5k 1
. 4 . 1543 . 1 1 24 GLU CD C -0.885 9.129 -0.564 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . rr_6e5k 1
. 4 . 1544 . 1 1 24 GLU CG C -0.726 7.993 0.422 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . rr_6e5k 1
. 4 . 1545 . 1 1 24 GLU H H -0.042 4.730 0.114 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . rr_6e5k 1
. 4 . 1546 . 1 1 24 GLU HA H -1.674 6.051 2.180 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . rr_6e5k 1
. 4 . 1547 . 1 1 24 GLU HB2 H -1.669 6.542 -0.802 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1548 . 1 1 24 GLU HB3 H -2.734 7.320 0.354 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1549 . 1 1 24 GLU HG2 H -0.835 8.386 1.422 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . rr_6e5k 1
. 4 . 1550 . 1 1 24 GLU HG3 H 0.263 7.571 0.309 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . rr_6e5k 1
. 4 . 1551 . 1 1 24 GLU N N -0.288 5.095 0.992 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . rr_6e5k 1
. 4 . 1552 . 1 1 24 GLU O O -2.733 4.127 -0.209 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . rr_6e5k 1
. 4 . 1553 . 1 1 24 GLU OE1 O 0.019 9.983 -0.648 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . rr_6e5k 1
. 4 . 1554 . 1 1 24 GLU OE2 O -1.921 9.174 -1.264 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . rr_6e5k 1
. 4 . 1555 . 1 1 25 MVA C C -6.014 3.843 1.754 . . . 1.0 . . . . . . . . . . . . A . 25 MVA C . . . . . . . . . rr_6e5k 1
. 4 . 1556 . 1 1 25 MVA CA C -4.570 3.344 1.641 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CA . . . . . . . . . rr_6e5k 1
. 4 . 1557 . 1 1 25 MVA CB C -4.351 2.119 2.586 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CB . . . . . . . . . rr_6e5k 1
. 4 . 1558 . 1 1 25 MVA CG1 C -4.593 2.442 4.053 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG1 . . . . . . . . . rr_6e5k 1
. 4 . 1559 . 1 1 25 MVA CG2 C -5.238 0.962 2.154 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG2 . . . . . . . . . rr_6e5k 1
. 4 . 1560 . 1 1 25 MVA CN C -3.577 5.245 3.069 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CN . . . . . . . . . rr_6e5k 1
. 4 . 1561 . 1 1 25 MVA HA H -4.461 2.969 0.631 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HA . . . . . . . . . rr_6e5k 1
. 4 . 1562 . 1 1 25 MVA HB H -3.325 1.800 2.483 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HB . . . . . . . . . rr_6e5k 1
. 4 . 1563 . 1 1 25 MVA HG11 H -3.855 3.156 4.390 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG11 . . . . . . . . . rr_6e5k 1
. 4 . 1564 . 1 1 25 MVA HG12 H -4.513 1.538 4.640 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG12 . . . . . . . . . rr_6e5k 1
. 4 . 1565 . 1 1 25 MVA HG13 H -5.581 2.862 4.170 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG13 . . . . . . . . . rr_6e5k 1
. 4 . 1566 . 1 1 25 MVA HG21 H -6.275 1.258 2.228 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG21 . . . . . . . . . rr_6e5k 1
. 4 . 1567 . 1 1 25 MVA HG22 H -5.060 0.111 2.795 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG22 . . . . . . . . . rr_6e5k 1
. 4 . 1568 . 1 1 25 MVA HG23 H -5.013 0.696 1.133 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG23 . . . . . . . . . rr_6e5k 1
. 4 . 1569 . 1 1 25 MVA HN1 H -2.737 4.976 3.688 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN1 . . . . . . . . . rr_6e5k 1
. 4 . 1570 . 1 1 25 MVA HN2 H -4.496 5.076 3.611 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN2 . . . . . . . . . rr_6e5k 1
. 4 . 1571 . 1 1 25 MVA HN3 H -3.506 6.287 2.799 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN3 . . . . . . . . . rr_6e5k 1
. 4 . 1572 . 1 1 25 MVA N N -3.573 4.418 1.842 . . . 1.0 . . . . . . . . . . . . A . 25 MVA N . . . . . . . . . rr_6e5k 1
. 4 . 1573 . 1 1 25 MVA O O -6.415 4.475 2.734 . . . 1.0 . . . . . . . . . . . . A . 25 MVA O . . . . . . . . . rr_6e5k 1
. 4 . 1574 . 1 1 26 HIS C C -9.076 2.754 0.455 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_6e5k 1
. 4 . 1575 . 1 1 26 HIS CA C -8.183 3.967 0.662 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_6e5k 1
. 4 . 1576 . 1 1 26 HIS CB C -8.414 4.968 -0.472 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_6e5k 1
. 4 . 1577 . 1 1 26 HIS CD2 C -6.487 6.706 -0.527 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_6e5k 1
. 4 . 1578 . 1 1 26 HIS CE1 C -7.575 8.413 0.311 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_6e5k 1
. 4 . 1579 . 1 1 26 HIS CG C -7.751 6.295 -0.268 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_6e5k 1
. 4 . 1580 . 1 1 26 HIS H H -6.412 3.053 -0.036 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_6e5k 1
. 4 . 1581 . 1 1 26 HIS HA H -8.434 4.432 1.601 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_6e5k 1
. 4 . 1582 . 1 1 26 HIS HB2 H -8.034 4.547 -1.388 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1583 . 1 1 26 HIS HB3 H -9.473 5.136 -0.576 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1584 . 1 1 26 HIS HD1 H -9.348 7.416 0.541 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_6e5k 1
. 4 . 1585 . 1 1 26 HIS HD2 H -5.690 6.106 -0.945 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_6e5k 1
. 4 . 1586 . 1 1 26 HIS HE1 H -7.813 9.400 0.680 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_6e5k 1
. 4 . 1587 . 1 1 26 HIS HE2 H -5.651 8.626 -0.350 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_6e5k 1
. 4 . 1588 . 1 1 26 HIS N N -6.790 3.563 0.718 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_6e5k 1
. 4 . 1589 . 1 1 26 HIS ND1 N -8.406 7.389 0.258 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_6e5k 1
. 4 . 1590 . 1 1 26 HIS NE2 N -6.405 8.026 -0.158 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_6e5k 1
. 4 . 1591 . 1 1 26 HIS O O -8.953 2.042 -0.543 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_6e5k 1
. 4 . 1592 . 1 1 27 CYS C C -12.221 1.867 0.747 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . rr_6e5k 1
. 4 . 1593 . 1 1 27 CYS CA C -10.889 1.404 1.317 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . rr_6e5k 1
. 4 . 1594 . 1 1 27 CYS CB C -11.093 0.776 2.693 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . rr_6e5k 1
. 4 . 1595 . 1 1 27 CYS H H -9.993 3.105 2.187 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . rr_6e5k 1
. 4 . 1596 . 1 1 27 CYS HA H -10.461 0.666 0.655 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . rr_6e5k 1
. 4 . 1597 . 1 1 27 CYS HB2 H -11.445 1.532 3.377 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . rr_6e5k 1
. 4 . 1598 . 1 1 27 CYS HB3 H -11.834 -0.004 2.615 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . rr_6e5k 1
. 4 . 1599 . 1 1 27 CYS N N -9.961 2.516 1.404 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . rr_6e5k 1
. 4 . 1600 . 1 1 27 CYS O O -13.186 2.091 1.476 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . rr_6e5k 1
. 4 . 1601 . 1 1 27 CYS SG S -9.582 0.044 3.400 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . rr_6e5k 1
. 4 . 1602 . 1 1 28 NH2 HN1 H -11.466 1.808 -1.085 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . rr_6e5k 1
. 4 . 1603 . 1 1 28 NH2 HN2 H -13.119 2.288 -0.964 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . rr_6e5k 1
. 4 . 1604 . 1 1 28 NH2 N N -12.274 2.003 -0.564 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . rr_6e5k 1
. 5 . 1605 . 1 1 1 ASN C C 9.309 -7.904 -2.623 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . rr_6e5k 1
. 5 . 1606 . 1 1 1 ASN CA C 9.603 -9.345 -2.219 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . rr_6e5k 1
. 5 . 1607 . 1 1 1 ASN CB C 9.499 -9.502 -0.695 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . rr_6e5k 1
. 5 . 1608 . 1 1 1 ASN CG C 8.095 -9.262 -0.171 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . rr_6e5k 1
. 5 . 1609 . 1 1 1 ASN H1 H 11.001 -9.680 -3.717 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . rr_6e5k 1
. 5 . 1610 . 1 1 1 ASN H2 H 11.168 -10.704 -2.385 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . rr_6e5k 1
. 5 . 1611 . 1 1 1 ASN H3 H 11.663 -9.092 -2.280 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . rr_6e5k 1
. 5 . 1612 . 1 1 1 ASN HA H 8.881 -9.994 -2.695 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . rr_6e5k 1
. 5 . 1613 . 1 1 1 ASN HB2 H 9.796 -10.503 -0.420 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1614 . 1 1 1 ASN HB3 H 10.165 -8.794 -0.223 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1615 . 1 1 1 ASN HD21 H 8.827 -8.681 1.580 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . rr_6e5k 1
. 5 . 1616 . 1 1 1 ASN HD22 H 7.100 -8.678 1.446 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . rr_6e5k 1
. 5 . 1617 . 1 1 1 ASN N N 10.953 -9.733 -2.681 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . rr_6e5k 1
. 5 . 1618 . 1 1 1 ASN ND2 N 7.997 -8.826 1.073 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . rr_6e5k 1
. 5 . 1619 . 1 1 1 ASN O O 10.224 -7.134 -2.914 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . rr_6e5k 1
. 5 . 1620 . 1 1 1 ASN OD1 O 7.108 -9.472 -0.877 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . rr_6e5k 1
. 5 . 1621 . 1 1 2 ASP C C 6.797 -5.616 -1.859 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . rr_6e5k 1
. 5 . 1622 . 1 1 2 ASP CA C 7.615 -6.203 -2.997 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . rr_6e5k 1
. 5 . 1623 . 1 1 2 ASP CB C 6.782 -6.198 -4.284 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . rr_6e5k 1
. 5 . 1624 . 1 1 2 ASP CG C 7.586 -6.545 -5.520 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . rr_6e5k 1
. 5 . 1625 . 1 1 2 ASP H H 7.348 -8.213 -2.411 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . rr_6e5k 1
. 5 . 1626 . 1 1 2 ASP HA H 8.499 -5.603 -3.142 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . rr_6e5k 1
. 5 . 1627 . 1 1 2 ASP HB2 H 5.987 -6.919 -4.190 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1628 . 1 1 2 ASP HB3 H 6.352 -5.217 -4.421 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1629 . 1 1 2 ASP N N 8.033 -7.551 -2.651 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . rr_6e5k 1
. 5 . 1630 . 1 1 2 ASP O O 5.766 -6.178 -1.482 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . rr_6e5k 1
. 5 . 1631 . 1 1 2 ASP OD1 O 7.555 -7.721 -5.941 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . rr_6e5k 1
. 5 . 1632 . 1 1 2 ASP OD2 O 8.262 -5.651 -6.069 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . rr_6e5k 1
. 5 . 1633 . 1 1 3 ABA C C 5.124 -3.519 -0.633 . . . 1.0 . . . . . . . . . . . . A . 3 AIB C . . . . . . . . . rr_6e5k 1
. 5 . 1634 . 1 1 3 ABA CA C 6.572 -3.805 -0.216 . . . 1.0 . . . . . . . . . . . . A . 3 AIB CA . . . . . . . . . rr_6e5k 1
. 5 . 1635 . 1 1 3 ABA H H 8.108 -4.123 -1.647 . . . 1.0 . . . . . . . . . . . . A . 3 AIB H . . . . . . . . . rr_6e5k 1
. 5 . 1636 . 1 1 3 ABA N N 7.266 -4.498 -1.309 . . . 1.0 . . . . . . . . . . . . A . 3 AIB N . . . . . . . . . rr_6e5k 1
. 5 . 1637 . 1 1 3 ABA O O 4.182 -3.764 0.127 . . . 1.0 . . . . . . . . . . . . A . 3 AIB O . . . . . . . . . rr_6e5k 1
. 5 . 1638 . 1 1 4 CYS C C 2.761 -3.927 -2.451 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . rr_6e5k 1
. 5 . 1639 . 1 1 4 CYS CA C 3.645 -2.684 -2.388 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . rr_6e5k 1
. 5 . 1640 . 1 1 4 CYS CB C 3.783 -2.073 -3.784 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . rr_6e5k 1
. 5 . 1641 . 1 1 4 CYS H H 5.755 -2.855 -2.413 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . rr_6e5k 1
. 5 . 1642 . 1 1 4 CYS HA H 3.191 -1.964 -1.728 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . rr_6e5k 1
. 5 . 1643 . 1 1 4 CYS HB2 H 3.973 -2.860 -4.495 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1644 . 1 1 4 CYS HB3 H 2.860 -1.577 -4.043 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1645 . 1 1 4 CYS N N 4.962 -3.017 -1.855 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . rr_6e5k 1
. 5 . 1646 . 1 1 4 CYS O O 1.572 -3.873 -2.142 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . rr_6e5k 1
. 5 . 1647 . 1 1 4 CYS SG S 5.130 -0.854 -3.929 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . rr_6e5k 1
. 5 . 1648 . 1 1 5 LYS C C 2.164 -6.779 -1.585 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_6e5k 1
. 5 . 1649 . 1 1 5 LYS CA C 2.654 -6.312 -2.947 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_6e5k 1
. 5 . 1650 . 1 1 5 LYS CB C 3.568 -7.374 -3.565 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_6e5k 1
. 5 . 1651 . 1 1 5 LYS CD C 3.948 -9.792 -4.145 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_6e5k 1
. 5 . 1652 . 1 1 5 LYS CE C 4.497 -9.524 -5.540 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_6e5k 1
. 5 . 1653 . 1 1 5 LYS CG C 2.926 -8.746 -3.720 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_6e5k 1
. 5 . 1654 . 1 1 5 LYS H H 4.325 -5.020 -3.024 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_6e5k 1
. 5 . 1655 . 1 1 5 LYS HA H 1.803 -6.156 -3.592 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_6e5k 1
. 5 . 1656 . 1 1 5 LYS HB2 H 3.878 -7.036 -4.542 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1657 . 1 1 5 LYS HB3 H 4.443 -7.482 -2.941 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1658 . 1 1 5 LYS HD2 H 4.768 -9.783 -3.443 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_6e5k 1
. 5 . 1659 . 1 1 5 LYS HD3 H 3.476 -10.764 -4.135 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_6e5k 1
. 5 . 1660 . 1 1 5 LYS HE2 H 4.835 -8.500 -5.592 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_6e5k 1
. 5 . 1661 . 1 1 5 LYS HE3 H 5.333 -10.185 -5.716 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_6e5k 1
. 5 . 1662 . 1 1 5 LYS HG2 H 2.494 -9.042 -2.775 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_6e5k 1
. 5 . 1663 . 1 1 5 LYS HG3 H 2.150 -8.689 -4.470 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_6e5k 1
. 5 . 1664 . 1 1 5 LYS HZ1 H 2.627 -9.178 -6.399 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 5 . 1665 . 1 1 5 LYS HZ2 H 3.203 -10.752 -6.621 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 5 . 1666 . 1 1 5 LYS HZ3 H 3.854 -9.480 -7.524 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 5 . 1667 . 1 1 5 LYS N N 3.366 -5.046 -2.828 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_6e5k 1
. 5 . 1668 . 1 1 5 LYS NZ N 3.474 -9.749 -6.593 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_6e5k 1
. 5 . 1669 . 1 1 5 LYS O O 1.005 -7.160 -1.434 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_6e5k 1
. 5 . 1670 . 1 1 6 ABA C C 1.565 -6.319 1.295 . . . 1.0 . . . . . . . . . . . . A . 6 AIB C . . . . . . . . . rr_6e5k 1
. 5 . 1671 . 1 1 6 ABA CA C 2.744 -7.151 0.770 . . . 1.0 . . . . . . . . . . . . A . 6 AIB CA . . . . . . . . . rr_6e5k 1
. 5 . 1672 . 1 1 6 ABA H H 3.967 -6.405 -0.799 . . . 1.0 . . . . . . . . . . . . A . 6 AIB H . . . . . . . . . rr_6e5k 1
. 5 . 1673 . 1 1 6 ABA N N 3.061 -6.732 -0.599 . . . 1.0 . . . . . . . . . . . . A . 6 AIB N . . . . . . . . . rr_6e5k 1
. 5 . 1674 . 1 1 6 ABA O O 0.596 -6.857 1.849 . . . 1.0 . . . . . . . . . . . . A . 6 AIB O . . . . . . . . . rr_6e5k 1
. 5 . 1675 . 1 1 7 LEU C C -0.695 -4.381 0.838 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . rr_6e5k 1
. 5 . 1676 . 1 1 7 LEU CA C 0.616 -4.090 1.550 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . rr_6e5k 1
. 5 . 1677 . 1 1 7 LEU CB C 1.031 -2.638 1.307 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . rr_6e5k 1
. 5 . 1678 . 1 1 7 LEU CD1 C 2.648 -0.756 1.647 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . rr_6e5k 1
. 5 . 1679 . 1 1 7 LEU CD2 C 2.080 -2.256 3.557 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . rr_6e5k 1
. 5 . 1680 . 1 1 7 LEU CG C 2.287 -2.176 2.051 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . rr_6e5k 1
. 5 . 1681 . 1 1 7 LEU H H 2.445 -4.640 0.633 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . rr_6e5k 1
. 5 . 1682 . 1 1 7 LEU HA H 0.475 -4.246 2.608 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . rr_6e5k 1
. 5 . 1683 . 1 1 7 LEU HB2 H 1.198 -2.510 0.249 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1684 . 1 1 7 LEU HB3 H 0.212 -2.000 1.601 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1685 . 1 1 7 LEU HD11 H 1.833 -0.095 1.902 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . rr_6e5k 1
. 5 . 1686 . 1 1 7 LEU HD12 H 2.824 -0.718 0.584 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . rr_6e5k 1
. 5 . 1687 . 1 1 7 LEU HD13 H 3.539 -0.448 2.174 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . rr_6e5k 1
. 5 . 1688 . 1 1 7 LEU HD21 H 1.235 -1.644 3.834 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . rr_6e5k 1
. 5 . 1689 . 1 1 7 LEU HD22 H 2.965 -1.898 4.061 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . rr_6e5k 1
. 5 . 1690 . 1 1 7 LEU HD23 H 1.893 -3.281 3.842 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . rr_6e5k 1
. 5 . 1691 . 1 1 7 LEU HG H 3.114 -2.820 1.788 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . rr_6e5k 1
. 5 . 1692 . 1 1 7 LEU N N 1.657 -5.004 1.099 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . rr_6e5k 1
. 5 . 1693 . 1 1 7 LEU O O -1.751 -4.436 1.465 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . rr_6e5k 1
. 5 . 1694 . 1 1 8 LYS C C -2.475 -6.147 -0.749 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . rr_6e5k 1
. 5 . 1695 . 1 1 8 LYS CA C -1.793 -4.888 -1.266 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . rr_6e5k 1
. 5 . 1696 . 1 1 8 LYS CB C -1.403 -5.062 -2.735 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . rr_6e5k 1
. 5 . 1697 . 1 1 8 LYS CD C -2.138 -5.405 -5.107 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . rr_6e5k 1
. 5 . 1698 . 1 1 8 LYS CE C -3.323 -5.483 -6.055 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . rr_6e5k 1
. 5 . 1699 . 1 1 8 LYS CG C -2.587 -5.247 -3.665 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . rr_6e5k 1
. 5 . 1700 . 1 1 8 LYS H H 0.260 -4.530 -0.909 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . rr_6e5k 1
. 5 . 1701 . 1 1 8 LYS HA H -2.476 -4.058 -1.177 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . rr_6e5k 1
. 5 . 1702 . 1 1 8 LYS HB2 H -0.855 -4.187 -3.054 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1703 . 1 1 8 LYS HB3 H -0.763 -5.927 -2.824 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1704 . 1 1 8 LYS HD2 H -1.528 -4.555 -5.379 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . rr_6e5k 1
. 5 . 1705 . 1 1 8 LYS HD3 H -1.556 -6.310 -5.196 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . rr_6e5k 1
. 5 . 1706 . 1 1 8 LYS HE2 H -2.955 -5.569 -7.066 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . rr_6e5k 1
. 5 . 1707 . 1 1 8 LYS HE3 H -3.907 -6.360 -5.811 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . rr_6e5k 1
. 5 . 1708 . 1 1 8 LYS HG2 H -3.129 -6.133 -3.369 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . rr_6e5k 1
. 5 . 1709 . 1 1 8 LYS HG3 H -3.232 -4.385 -3.589 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . rr_6e5k 1
. 5 . 1710 . 1 1 8 LYS HZ1 H -4.647 -4.241 -5.024 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 5 . 1711 . 1 1 8 LYS HZ2 H -4.930 -4.307 -6.688 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 5 . 1712 . 1 1 8 LYS HZ3 H -3.624 -3.418 -6.087 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 5 . 1713 . 1 1 8 LYS N N -0.617 -4.586 -0.467 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . rr_6e5k 1
. 5 . 1714 . 1 1 8 LYS NZ N -4.192 -4.279 -5.958 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . rr_6e5k 1
. 5 . 1715 . 1 1 8 LYS O O -3.682 -6.153 -0.512 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . rr_6e5k 1
. 5 . 1716 . 1 1 9 ABA C C -2.833 -8.277 1.333 . . . 1.0 . . . . . . . . . . . . A . 9 AIB C . . . . . . . . . rr_6e5k 1
. 5 . 1717 . 1 1 9 ABA CA C -2.172 -8.478 -0.036 . . . 1.0 . . . . . . . . . . . . A . 9 AIB CA . . . . . . . . . rr_6e5k 1
. 5 . 1718 . 1 1 9 ABA H H -0.717 -7.098 -0.728 . . . 1.0 . . . . . . . . . . . . A . 9 AIB H . . . . . . . . . rr_6e5k 1
. 5 . 1719 . 1 1 9 ABA N N -1.677 -7.192 -0.538 . . . 1.0 . . . . . . . . . . . . A . 9 AIB N . . . . . . . . . rr_6e5k 1
. 5 . 1720 . 1 1 9 ABA O O -3.795 -8.961 1.684 . . . 1.0 . . . . . . . . . . . . A . 9 AIB O . . . . . . . . . rr_6e5k 1
. 5 . 1721 . 1 1 10 ARG C C -4.185 -6.337 3.331 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . rr_6e5k 1
. 5 . 1722 . 1 1 10 ARG CA C -2.839 -7.052 3.431 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . rr_6e5k 1
. 5 . 1723 . 1 1 10 ARG CB C -1.873 -6.184 4.241 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . rr_6e5k 1
. 5 . 1724 . 1 1 10 ARG CD C -1.747 -4.643 6.238 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . rr_6e5k 1
. 5 . 1725 . 1 1 10 ARG CG C -2.389 -5.881 5.638 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . rr_6e5k 1
. 5 . 1726 . 1 1 10 ARG CZ C 0.307 -4.209 7.523 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . rr_6e5k 1
. 5 . 1727 . 1 1 10 ARG H H -1.506 -6.844 1.793 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . rr_6e5k 1
. 5 . 1728 . 1 1 10 ARG HA H -2.981 -7.990 3.944 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . rr_6e5k 1
. 5 . 1729 . 1 1 10 ARG HB2 H -0.926 -6.697 4.328 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1730 . 1 1 10 ARG HB3 H -1.723 -5.247 3.722 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1731 . 1 1 10 ARG HD2 H -1.872 -3.821 5.548 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . rr_6e5k 1
. 5 . 1732 . 1 1 10 ARG HD3 H -2.253 -4.409 7.162 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . rr_6e5k 1
. 5 . 1733 . 1 1 10 ARG HE H 0.201 -5.384 5.903 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . rr_6e5k 1
. 5 . 1734 . 1 1 10 ARG HG2 H -3.455 -5.725 5.583 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . rr_6e5k 1
. 5 . 1735 . 1 1 10 ARG HG3 H -2.184 -6.729 6.277 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . rr_6e5k 1
. 5 . 1736 . 1 1 10 ARG HH11 H 0.095 -2.989 9.128 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . rr_6e5k 1
. 5 . 1737 . 1 1 10 ARG HH12 H -1.363 -3.312 8.244 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . rr_6e5k 1
. 5 . 1738 . 1 1 10 ARG HH21 H 2.136 -4.951 7.060 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . rr_6e5k 1
. 5 . 1739 . 1 1 10 ARG HH22 H 2.079 -3.926 8.458 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . rr_6e5k 1
. 5 . 1740 . 1 1 10 ARG N N -2.295 -7.344 2.112 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . rr_6e5k 1
. 5 . 1741 . 1 1 10 ARG NE N -0.320 -4.808 6.512 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . rr_6e5k 1
. 5 . 1742 . 1 1 10 ARG NH1 N -0.375 -3.443 8.365 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . rr_6e5k 1
. 5 . 1743 . 1 1 10 ARG NH2 N 1.611 -4.373 7.693 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . rr_6e5k 1
. 5 . 1744 . 1 1 10 ARG O O -5.158 -6.730 3.972 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . rr_6e5k 1
. 5 . 1745 . 1 1 11 TYR C C -6.488 -4.917 1.549 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . rr_6e5k 1
. 5 . 1746 . 1 1 11 TYR CA C -5.395 -4.404 2.486 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . rr_6e5k 1
. 5 . 1747 . 1 1 11 TYR CB C -4.959 -2.988 2.107 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . rr_6e5k 1
. 5 . 1748 . 1 1 11 TYR CD1 C -4.736 -1.795 4.322 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . rr_6e5k 1
. 5 . 1749 . 1 1 11 TYR CD2 C -2.761 -2.197 3.055 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . rr_6e5k 1
. 5 . 1750 . 1 1 11 TYR CE1 C -3.988 -1.170 5.299 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . rr_6e5k 1
. 5 . 1751 . 1 1 11 TYR CE2 C -2.005 -1.577 4.029 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . rr_6e5k 1
. 5 . 1752 . 1 1 11 TYR CG C -4.138 -2.318 3.184 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . rr_6e5k 1
. 5 . 1753 . 1 1 11 TYR CZ C -2.632 -1.108 5.185 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . rr_6e5k 1
. 5 . 1754 . 1 1 11 TYR H H -3.468 -5.099 1.934 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . rr_6e5k 1
. 5 . 1755 . 1 1 11 TYR HA H -5.801 -4.374 3.485 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . rr_6e5k 1
. 5 . 1756 . 1 1 11 TYR HB2 H -4.362 -3.026 1.207 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1757 . 1 1 11 TYR HB3 H -5.832 -2.387 1.931 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1758 . 1 1 11 TYR HD1 H -5.808 -1.880 4.438 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . rr_6e5k 1
. 5 . 1759 . 1 1 11 TYR HD2 H -2.281 -2.600 2.176 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . rr_6e5k 1
. 5 . 1760 . 1 1 11 TYR HE1 H -4.474 -0.771 6.173 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . rr_6e5k 1
. 5 . 1761 . 1 1 11 TYR HE2 H -0.936 -1.495 3.909 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . rr_6e5k 1
. 5 . 1762 . 1 1 11 TYR HH H -1.179 0.086 5.698 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . rr_6e5k 1
. 5 . 1763 . 1 1 11 TYR N N -4.234 -5.287 2.523 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . rr_6e5k 1
. 5 . 1764 . 1 1 11 TYR O O -7.595 -4.369 1.522 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . rr_6e5k 1
. 5 . 1765 . 1 1 11 TYR OH O -1.874 -0.436 6.119 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . rr_6e5k 1
. 5 . 1766 . 1 1 12 ABA C C -7.856 -5.739 -1.009 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . rr_6e5k 1
. 5 . 1767 . 1 1 12 ABA CA C -7.145 -6.685 -0.029 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . rr_6e5k 1
. 5 . 1768 . 1 1 12 ABA H H -5.229 -6.249 0.765 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . rr_6e5k 1
. 5 . 1769 . 1 1 12 ABA N N -6.165 -5.959 0.790 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . rr_6e5k 1
. 5 . 1770 . 1 1 12 ABA O O -7.279 -5.326 -2.016 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . rr_6e5k 1
. 5 . 1771 . 1 1 13 GLY C C -9.631 -3.133 -1.541 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_6e5k 1
. 5 . 1772 . 1 1 13 GLY CA C -9.910 -4.619 -1.617 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_6e5k 1
. 5 . 1773 . 1 1 13 GLY H H -9.475 -5.674 0.159 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_6e5k 1
. 5 . 1774 . 1 1 13 GLY HA2 H -9.716 -4.957 -2.624 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_6e5k 1
. 5 . 1775 . 1 1 13 GLY HA3 H -10.951 -4.789 -1.389 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_6e5k 1
. 5 . 1776 . 1 1 13 GLY N N -9.102 -5.400 -0.703 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_6e5k 1
. 5 . 1777 . 1 1 13 GLY O O -10.134 -2.362 -2.361 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_6e5k 1
. 5 . 1778 . 1 1 14 CYS C C -7.279 -0.986 -1.256 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_6e5k 1
. 5 . 1779 . 1 1 14 CYS CA C -8.505 -1.312 -0.418 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_6e5k 1
. 5 . 1780 . 1 1 14 CYS CB C -8.244 -0.964 1.045 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_6e5k 1
. 5 . 1781 . 1 1 14 CYS H H -8.464 -3.373 0.067 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_6e5k 1
. 5 . 1782 . 1 1 14 CYS HA H -9.340 -0.730 -0.778 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_6e5k 1
. 5 . 1783 . 1 1 14 CYS HB2 H -7.364 -1.482 1.376 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1784 . 1 1 14 CYS HB3 H -8.080 0.102 1.127 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1785 . 1 1 14 CYS N N -8.842 -2.719 -0.562 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_6e5k 1
. 5 . 1786 . 1 1 14 CYS O O -6.337 -1.778 -1.331 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_6e5k 1
. 5 . 1787 . 1 1 14 CYS SG S -9.603 -1.404 2.178 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_6e5k 1
. 5 . 1788 . 1 1 15 GLU C C -5.053 1.123 -1.925 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_6e5k 1
. 5 . 1789 . 1 1 15 GLU CA C -6.212 0.596 -2.755 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_6e5k 1
. 5 . 1790 . 1 1 15 GLU CB C -6.689 1.683 -3.718 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_6e5k 1
. 5 . 1791 . 1 1 15 GLU CD C -8.238 2.343 -5.582 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_6e5k 1
. 5 . 1792 . 1 1 15 GLU CG C -7.796 1.237 -4.653 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_6e5k 1
. 5 . 1793 . 1 1 15 GLU H H -8.052 0.790 -1.734 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_6e5k 1
. 5 . 1794 . 1 1 15 GLU HA H -5.884 -0.263 -3.318 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_6e5k 1
. 5 . 1795 . 1 1 15 GLU HB2 H -7.055 2.519 -3.141 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1796 . 1 1 15 GLU HB3 H -5.852 2.009 -4.317 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1797 . 1 1 15 GLU HG2 H -7.438 0.410 -5.248 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_6e5k 1
. 5 . 1798 . 1 1 15 GLU HG3 H -8.643 0.918 -4.064 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_6e5k 1
. 5 . 1799 . 1 1 15 GLU N N -7.297 0.179 -1.884 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_6e5k 1
. 5 . 1800 . 1 1 15 GLU O O -5.272 1.850 -0.958 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_6e5k 1
. 5 . 1801 . 1 1 15 GLU OE1 O -9.162 3.097 -5.218 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_6e5k 1
. 5 . 1802 . 1 1 15 GLU OE2 O -7.659 2.471 -6.680 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_6e5k 1
. 5 . 1803 . 1 1 16 MVA C C -1.472 1.674 -2.384 . . . 1.0 . . . . . . . . . . . . A . 16 MVA C . . . . . . . . . rr_6e5k 1
. 5 . 1804 . 1 1 16 MVA CA C -2.653 1.251 -1.503 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CA . . . . . . . . . rr_6e5k 1
. 5 . 1805 . 1 1 16 MVA CB C -2.187 0.199 -0.448 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CB . . . . . . . . . rr_6e5k 1
. 5 . 1806 . 1 1 16 MVA CG1 C -1.782 -1.127 -1.074 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG1 . . . . . . . . . rr_6e5k 1
. 5 . 1807 . 1 1 16 MVA CG2 C -1.045 0.761 0.383 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG2 . . . . . . . . . rr_6e5k 1
. 5 . 1808 . 1 1 16 MVA CN C -3.599 -0.019 -3.513 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CN . . . . . . . . . rr_6e5k 1
. 5 . 1809 . 1 1 16 MVA HA H -2.949 2.131 -0.947 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HA . . . . . . . . . rr_6e5k 1
. 5 . 1810 . 1 1 16 MVA HB H -3.015 0.006 0.218 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HB . . . . . . . . . rr_6e5k 1
. 5 . 1811 . 1 1 16 MVA HG11 H -2.628 -1.553 -1.592 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG11 . . . . . . . . . rr_6e5k 1
. 5 . 1812 . 1 1 16 MVA HG12 H -1.454 -1.802 -0.299 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG12 . . . . . . . . . rr_6e5k 1
. 5 . 1813 . 1 1 16 MVA HG13 H -0.975 -0.960 -1.774 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG13 . . . . . . . . . rr_6e5k 1
. 5 . 1814 . 1 1 16 MVA HG21 H -1.367 1.669 0.869 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG21 . . . . . . . . . rr_6e5k 1
. 5 . 1815 . 1 1 16 MVA HG22 H -0.203 0.975 -0.260 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG22 . . . . . . . . . rr_6e5k 1
. 5 . 1816 . 1 1 16 MVA HG23 H -0.752 0.037 1.129 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG23 . . . . . . . . . rr_6e5k 1
. 5 . 1817 . 1 1 16 MVA HN1 H -3.932 -1.030 -3.339 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN1 . . . . . . . . . rr_6e5k 1
. 5 . 1818 . 1 1 16 MVA HN2 H -2.548 -0.024 -3.765 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN2 . . . . . . . . . rr_6e5k 1
. 5 . 1819 . 1 1 16 MVA HN3 H -4.162 0.411 -4.328 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN3 . . . . . . . . . rr_6e5k 1
. 5 . 1820 . 1 1 16 MVA N N -3.807 0.787 -2.288 . . . 1.0 . . . . . . . . . . . . A . 16 MVA N . . . . . . . . . rr_6e5k 1
. 5 . 1821 . 1 1 16 MVA O O -0.779 0.857 -2.998 . . . 1.0 . . . . . . . . . . . . A . 16 MVA O . . . . . . . . . rr_6e5k 1
. 5 . 1822 . 1 1 17 ARG C C 1.092 3.551 -2.313 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_6e5k 1
. 5 . 1823 . 1 1 17 ARG CA C -0.157 3.550 -3.175 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_6e5k 1
. 5 . 1824 . 1 1 17 ARG CB C -0.489 4.980 -3.603 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_6e5k 1
. 5 . 1825 . 1 1 17 ARG CD C 0.372 7.209 -4.395 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_6e5k 1
. 5 . 1826 . 1 1 17 ARG CG C 0.705 5.743 -4.154 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_6e5k 1
. 5 . 1827 . 1 1 17 ARG CZ C -1.547 8.332 -5.470 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_6e5k 1
. 5 . 1828 . 1 1 17 ARG H H -1.862 3.575 -1.940 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_6e5k 1
. 5 . 1829 . 1 1 17 ARG HA H 0.016 2.945 -4.051 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_6e5k 1
. 5 . 1830 . 1 1 17 ARG HB2 H -1.250 4.946 -4.367 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1831 . 1 1 17 ARG HB3 H -0.870 5.518 -2.750 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1832 . 1 1 17 ARG HD2 H -0.030 7.627 -3.486 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_6e5k 1
. 5 . 1833 . 1 1 17 ARG HD3 H 1.280 7.733 -4.657 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_6e5k 1
. 5 . 1834 . 1 1 17 ARG HE H -0.537 6.786 -6.246 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_6e5k 1
. 5 . 1835 . 1 1 17 ARG HG2 H 1.514 5.679 -3.443 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_6e5k 1
. 5 . 1836 . 1 1 17 ARG HG3 H 1.007 5.290 -5.086 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_6e5k 1
. 5 . 1837 . 1 1 17 ARG HH11 H -2.412 9.833 -4.422 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_6e5k 1
. 5 . 1838 . 1 1 17 ARG HH12 H -1.118 9.016 -3.601 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_6e5k 1
. 5 . 1839 . 1 1 17 ARG HH21 H -2.253 7.865 -7.314 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_6e5k 1
. 5 . 1840 . 1 1 17 ARG HH22 H -3.060 9.180 -6.519 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_6e5k 1
. 5 . 1841 . 1 1 17 ARG N N -1.261 2.977 -2.436 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_6e5k 1
. 5 . 1842 . 1 1 17 ARG NE N -0.604 7.390 -5.469 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_6e5k 1
. 5 . 1843 . 1 1 17 ARG NH1 N -1.703 9.125 -4.418 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_6e5k 1
. 5 . 1844 . 1 1 17 ARG NH2 N -2.351 8.469 -6.517 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_6e5k 1
. 5 . 1845 . 1 1 17 ARG O O 1.161 4.260 -1.312 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_6e5k 1
. 5 . 1846 . 1 1 18 CYS C C 4.187 3.903 -2.421 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . rr_6e5k 1
. 5 . 1847 . 1 1 18 CYS CA C 3.327 2.726 -1.978 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . rr_6e5k 1
. 5 . 1848 . 1 1 18 CYS CB C 4.046 1.400 -2.216 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . rr_6e5k 1
. 5 . 1849 . 1 1 18 CYS H H 1.931 2.157 -3.460 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . rr_6e5k 1
. 5 . 1850 . 1 1 18 CYS HA H 3.113 2.831 -0.923 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . rr_6e5k 1
. 5 . 1851 . 1 1 18 CYS HB2 H 5.046 1.462 -1.816 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1852 . 1 1 18 CYS HB3 H 3.508 0.612 -1.708 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1853 . 1 1 18 CYS N N 2.063 2.749 -2.687 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . rr_6e5k 1
. 5 . 1854 . 1 1 18 CYS O O 4.473 4.066 -3.608 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . rr_6e5k 1
. 5 . 1855 . 1 1 18 CYS SG S 4.180 0.935 -3.973 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . rr_6e5k 1
. 5 . 1856 . 1 1 19 ASP C C 6.627 5.926 -0.918 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . rr_6e5k 1
. 5 . 1857 . 1 1 19 ASP CA C 5.352 5.926 -1.753 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . rr_6e5k 1
. 5 . 1858 . 1 1 19 ASP CB C 4.519 7.179 -1.463 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . rr_6e5k 1
. 5 . 1859 . 1 1 19 ASP CG C 5.221 8.458 -1.872 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . rr_6e5k 1
. 5 . 1860 . 1 1 19 ASP H H 4.355 4.522 -0.532 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . rr_6e5k 1
. 5 . 1861 . 1 1 19 ASP HA H 5.615 5.911 -2.800 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . rr_6e5k 1
. 5 . 1862 . 1 1 19 ASP HB2 H 3.586 7.116 -2.001 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1863 . 1 1 19 ASP HB3 H 4.316 7.226 -0.403 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1864 . 1 1 19 ASP N N 4.578 4.730 -1.466 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . rr_6e5k 1
. 5 . 1865 . 1 1 19 ASP O O 6.678 6.524 0.160 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . rr_6e5k 1
. 5 . 1866 . 1 1 19 ASP OD1 O 5.472 9.312 -0.999 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . rr_6e5k 1
. 5 . 1867 . 1 1 19 ASP OD2 O 5.556 8.607 -3.066 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . rr_6e5k 1
. 5 . 1868 . 1 1 20 DPR C C 8.698 4.417 0.698 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . rr_6e5k 1
. 5 . 1869 . 1 1 20 DPR CA C 8.925 5.070 -0.664 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . rr_6e5k 1
. 5 . 1870 . 1 1 20 DPR CB C 9.766 4.161 -1.559 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . rr_6e5k 1
. 5 . 1871 . 1 1 20 DPR CD C 7.719 4.567 -2.715 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . rr_6e5k 1
. 5 . 1872 . 1 1 20 DPR CG C 9.186 4.318 -2.921 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . rr_6e5k 1
. 5 . 1873 . 1 1 20 DPR HA H 9.436 6.008 -0.535 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . rr_6e5k 1
. 5 . 1874 . 1 1 20 DPR HB2 H 10.797 4.477 -1.527 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1875 . 1 1 20 DPR HB3 H 9.686 3.141 -1.215 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1876 . 1 1 20 DPR HD2 H 7.335 5.211 -3.490 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . rr_6e5k 1
. 5 . 1877 . 1 1 20 DPR HD3 H 7.176 3.634 -2.691 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . rr_6e5k 1
. 5 . 1878 . 1 1 20 DPR HG2 H 9.642 5.160 -3.422 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . rr_6e5k 1
. 5 . 1879 . 1 1 20 DPR HG3 H 9.336 3.413 -3.492 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . rr_6e5k 1
. 5 . 1880 . 1 1 20 DPR N N 7.671 5.234 -1.403 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . rr_6e5k 1
. 5 . 1881 . 1 1 20 DPR O O 8.217 3.284 0.781 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . rr_6e5k 1
. 5 . 1882 . 1 1 21 PRO C C 7.418 4.780 3.639 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . rr_6e5k 1
. 5 . 1883 . 1 1 21 PRO CA C 8.856 4.627 3.143 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . rr_6e5k 1
. 5 . 1884 . 1 1 21 PRO CB C 9.793 5.518 3.950 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . rr_6e5k 1
. 5 . 1885 . 1 1 21 PRO CD C 9.658 6.465 1.762 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . rr_6e5k 1
. 5 . 1886 . 1 1 21 PRO CG C 9.786 6.815 3.221 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . rr_6e5k 1
. 5 . 1887 . 1 1 21 PRO HA H 9.163 3.597 3.237 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . rr_6e5k 1
. 5 . 1888 . 1 1 21 PRO HB2 H 9.416 5.625 4.957 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1889 . 1 1 21 PRO HB3 H 10.779 5.084 3.971 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1890 . 1 1 21 PRO HD2 H 9.023 7.175 1.258 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . rr_6e5k 1
. 5 . 1891 . 1 1 21 PRO HD3 H 10.632 6.432 1.297 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . rr_6e5k 1
. 5 . 1892 . 1 1 21 PRO HG2 H 8.945 7.409 3.541 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . rr_6e5k 1
. 5 . 1893 . 1 1 21 PRO HG3 H 10.710 7.344 3.400 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . rr_6e5k 1
. 5 . 1894 . 1 1 21 PRO N N 9.040 5.125 1.781 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . rr_6e5k 1
. 5 . 1895 . 1 1 21 PRO O O 7.073 4.314 4.724 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . rr_6e5k 1
. 5 . 1896 . 1 1 22 ARG C C 4.255 4.986 2.273 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . rr_6e5k 1
. 5 . 1897 . 1 1 22 ARG CA C 5.205 5.692 3.228 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . rr_6e5k 1
. 5 . 1898 . 1 1 22 ARG CB C 4.923 7.197 3.218 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . rr_6e5k 1
. 5 . 1899 . 1 1 22 ARG CD C 5.822 7.621 5.539 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . rr_6e5k 1
. 5 . 1900 . 1 1 22 ARG CG C 5.885 8.013 4.068 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . rr_6e5k 1
. 5 . 1901 . 1 1 22 ARG CZ C 4.312 8.066 7.442 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . rr_6e5k 1
. 5 . 1902 . 1 1 22 ARG H H 6.900 5.743 1.961 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . rr_6e5k 1
. 5 . 1903 . 1 1 22 ARG HA H 5.053 5.305 4.225 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . rr_6e5k 1
. 5 . 1904 . 1 1 22 ARG HB2 H 4.988 7.553 2.200 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1905 . 1 1 22 ARG HB3 H 3.922 7.366 3.584 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1906 . 1 1 22 ARG HD2 H 6.022 6.564 5.626 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . rr_6e5k 1
. 5 . 1907 . 1 1 22 ARG HD3 H 6.578 8.174 6.076 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . rr_6e5k 1
. 5 . 1908 . 1 1 22 ARG HE H 3.747 7.981 5.524 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . rr_6e5k 1
. 5 . 1909 . 1 1 22 ARG HG2 H 6.889 7.851 3.708 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . rr_6e5k 1
. 5 . 1910 . 1 1 22 ARG HG3 H 5.634 9.060 3.972 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . rr_6e5k 1
. 5 . 1911 . 1 1 22 ARG HH11 H 6.252 7.762 7.956 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . rr_6e5k 1
. 5 . 1912 . 1 1 22 ARG HH12 H 5.173 8.075 9.279 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . rr_6e5k 1
. 5 . 1913 . 1 1 22 ARG HH21 H 2.934 8.455 8.878 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . rr_6e5k 1
. 5 . 1914 . 1 1 22 ARG HH22 H 2.324 8.411 7.256 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . rr_6e5k 1
. 5 . 1915 . 1 1 22 ARG N N 6.584 5.435 2.843 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . rr_6e5k 1
. 5 . 1916 . 1 1 22 ARG NE N 4.515 7.905 6.135 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . rr_6e5k 1
. 5 . 1917 . 1 1 22 ARG NH1 N 5.327 7.962 8.293 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . rr_6e5k 1
. 5 . 1918 . 1 1 22 ARG NH2 N 3.093 8.332 7.894 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . rr_6e5k 1
. 5 . 1919 . 1 1 22 ARG O O 4.688 4.388 1.289 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . rr_6e5k 1
. 5 . 1920 . 1 1 23 TYR C C 0.607 5.133 1.967 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . rr_6e5k 1
. 5 . 1921 . 1 1 23 TYR CA C 1.958 4.500 1.685 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . rr_6e5k 1
. 5 . 1922 . 1 1 23 TYR CB C 1.869 2.977 1.818 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . rr_6e5k 1
. 5 . 1923 . 1 1 23 TYR CD1 C 0.122 2.280 3.500 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . rr_6e5k 1
. 5 . 1924 . 1 1 23 TYR CD2 C 2.407 2.246 4.171 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . rr_6e5k 1
. 5 . 1925 . 1 1 23 TYR CE1 C -0.257 1.848 4.755 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . rr_6e5k 1
. 5 . 1926 . 1 1 23 TYR CE2 C 2.037 1.811 5.425 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . rr_6e5k 1
. 5 . 1927 . 1 1 23 TYR CG C 1.458 2.487 3.187 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . rr_6e5k 1
. 5 . 1928 . 1 1 23 TYR CZ C 0.697 1.557 5.692 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . rr_6e5k 1
. 5 . 1929 . 1 1 23 TYR H H 2.689 5.460 3.414 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . rr_6e5k 1
. 5 . 1930 . 1 1 23 TYR HA H 2.244 4.743 0.674 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . rr_6e5k 1
. 5 . 1931 . 1 1 23 TYR HB2 H 1.147 2.608 1.109 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1932 . 1 1 23 TYR HB3 H 2.834 2.552 1.591 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1933 . 1 1 23 TYR HD1 H -0.628 2.463 2.745 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . rr_6e5k 1
. 5 . 1934 . 1 1 23 TYR HD2 H 3.451 2.399 3.942 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . rr_6e5k 1
. 5 . 1935 . 1 1 23 TYR HE1 H -1.302 1.693 4.979 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . rr_6e5k 1
. 5 . 1936 . 1 1 23 TYR HE2 H 2.791 1.629 6.176 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . rr_6e5k 1
. 5 . 1937 . 1 1 23 TYR HH H 0.878 1.643 7.630 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . rr_6e5k 1
. 5 . 1938 . 1 1 23 TYR N N 2.970 5.045 2.571 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . rr_6e5k 1
. 5 . 1939 . 1 1 23 TYR O O 0.339 5.588 3.080 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . rr_6e5k 1
. 5 . 1940 . 1 1 23 TYR OH O 0.335 1.187 6.968 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . rr_6e5k 1
. 5 . 1941 . 1 1 24 GLU C C -2.601 4.639 0.808 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . rr_6e5k 1
. 5 . 1942 . 1 1 24 GLU CA C -1.564 5.721 1.078 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . rr_6e5k 1
. 5 . 1943 . 1 1 24 GLU CB C -1.747 6.884 0.103 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . rr_6e5k 1
. 5 . 1944 . 1 1 24 GLU CD C -0.968 9.176 -0.623 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . rr_6e5k 1
. 5 . 1945 . 1 1 24 GLU CG C -0.685 7.964 0.238 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . rr_6e5k 1
. 5 . 1946 . 1 1 24 GLU H H 0.051 4.793 0.088 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . rr_6e5k 1
. 5 . 1947 . 1 1 24 GLU HA H -1.682 6.080 2.087 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . rr_6e5k 1
. 5 . 1948 . 1 1 24 GLU HB2 H -1.716 6.500 -0.905 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1949 . 1 1 24 GLU HB3 H -2.712 7.334 0.277 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1950 . 1 1 24 GLU HG2 H -0.641 8.278 1.270 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . rr_6e5k 1
. 5 . 1951 . 1 1 24 GLU HG3 H 0.269 7.549 -0.052 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . rr_6e5k 1
. 5 . 1952 . 1 1 24 GLU N N -0.233 5.164 0.953 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . rr_6e5k 1
. 5 . 1953 . 1 1 24 GLU O O -2.559 3.990 -0.232 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . rr_6e5k 1
. 5 . 1954 . 1 1 24 GLU OE1 O -1.290 10.248 -0.069 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . rr_6e5k 1
. 5 . 1955 . 1 1 24 GLU OE2 O -0.875 9.059 -1.865 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . rr_6e5k 1
. 5 . 1956 . 1 1 25 MVA C C -5.975 3.793 1.722 . . . 1.0 . . . . . . . . . . . . A . 25 MVA C . . . . . . . . . rr_6e5k 1
. 5 . 1957 . 1 1 25 MVA CA C -4.527 3.331 1.544 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CA . . . . . . . . . rr_6e5k 1
. 5 . 1958 . 1 1 25 MVA CB C -4.239 2.101 2.461 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CB . . . . . . . . . rr_6e5k 1
. 5 . 1959 . 1 1 25 MVA CG1 C -4.281 2.443 3.944 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG1 . . . . . . . . . rr_6e5k 1
. 5 . 1960 . 1 1 25 MVA CG2 C -5.220 0.978 2.157 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG2 . . . . . . . . . rr_6e5k 1
. 5 . 1961 . 1 1 25 MVA CN C -3.649 5.348 2.885 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CN . . . . . . . . . rr_6e5k 1
. 5 . 1962 . 1 1 25 MVA HA H -4.446 2.974 0.526 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HA . . . . . . . . . rr_6e5k 1
. 5 . 1963 . 1 1 25 MVA HB H -3.247 1.740 2.235 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HB . . . . . . . . . rr_6e5k 1
. 5 . 1964 . 1 1 25 MVA HG11 H -5.235 2.887 4.183 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG11 . . . . . . . . . rr_6e5k 1
. 5 . 1965 . 1 1 25 MVA HG12 H -3.488 3.140 4.172 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG12 . . . . . . . . . rr_6e5k 1
. 5 . 1966 . 1 1 25 MVA HG13 H -4.146 1.542 4.523 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG13 . . . . . . . . . rr_6e5k 1
. 5 . 1967 . 1 1 25 MVA HG21 H -5.105 0.666 1.130 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG21 . . . . . . . . . rr_6e5k 1
. 5 . 1968 . 1 1 25 MVA HG22 H -6.229 1.329 2.315 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG22 . . . . . . . . . rr_6e5k 1
. 5 . 1969 . 1 1 25 MVA HG23 H -5.024 0.140 2.811 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG23 . . . . . . . . . rr_6e5k 1
. 5 . 1970 . 1 1 25 MVA HN1 H -4.571 5.163 3.414 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN1 . . . . . . . . . rr_6e5k 1
. 5 . 1971 . 1 1 25 MVA HN2 H -3.633 6.371 2.536 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN2 . . . . . . . . . rr_6e5k 1
. 5 . 1972 . 1 1 25 MVA HN3 H -2.815 5.179 3.550 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN3 . . . . . . . . . rr_6e5k 1
. 5 . 1973 . 1 1 25 MVA N N -3.554 4.430 1.726 . . . 1.0 . . . . . . . . . . . . A . 25 MVA N . . . . . . . . . rr_6e5k 1
. 5 . 1974 . 1 1 25 MVA O O -6.373 4.312 2.765 . . . 1.0 . . . . . . . . . . . . A . 25 MVA O . . . . . . . . . rr_6e5k 1
. 5 . 1975 . 1 1 26 HIS C C -9.073 2.897 0.326 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_6e5k 1
. 5 . 1976 . 1 1 26 HIS CA C -8.140 4.053 0.654 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_6e5k 1
. 5 . 1977 . 1 1 26 HIS CB C -8.319 5.173 -0.372 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_6e5k 1
. 5 . 1978 . 1 1 26 HIS CD2 C -6.174 6.632 -0.395 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_6e5k 1
. 5 . 1979 . 1 1 26 HIS CE1 C -6.965 8.388 0.644 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_6e5k 1
. 5 . 1980 . 1 1 26 HIS CG C -7.471 6.381 -0.103 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_6e5k 1
. 5 . 1981 . 1 1 26 HIS H H -6.406 3.112 -0.106 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_6e5k 1
. 5 . 1982 . 1 1 26 HIS HA H -8.381 4.430 1.634 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_6e5k 1
. 5 . 1983 . 1 1 26 HIS HB2 H -8.062 4.798 -1.350 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1984 . 1 1 26 HIS HB3 H -9.351 5.486 -0.373 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_6e5k 1
. 5 . 1985 . 1 1 26 HIS HD1 H -8.853 7.631 0.885 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_6e5k 1
. 5 . 1986 . 1 1 26 HIS HD2 H -5.491 5.966 -0.904 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_6e5k 1
. 5 . 1987 . 1 1 26 HIS HE1 H -7.041 9.359 1.110 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_6e5k 1
. 5 . 1988 . 1 1 26 HIS HE2 H -5.057 8.386 -0.101 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_6e5k 1
. 5 . 1989 . 1 1 26 HIS N N -6.761 3.598 0.675 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_6e5k 1
. 5 . 1990 . 1 1 26 HIS ND1 N -7.937 7.501 0.547 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_6e5k 1
. 5 . 1991 . 1 1 26 HIS NE2 N -5.885 7.885 0.080 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_6e5k 1
. 5 . 1992 . 1 1 26 HIS O O -8.854 2.166 -0.641 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_6e5k 1
. 5 . 1993 . 1 1 27 CYS C C -12.320 2.176 0.254 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . rr_6e5k 1
. 5 . 1994 . 1 1 27 CYS CA C -11.062 1.657 0.938 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . rr_6e5k 1
. 5 . 1995 . 1 1 27 CYS CB C -11.419 1.024 2.282 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . rr_6e5k 1
. 5 . 1996 . 1 1 27 CYS H H -10.219 3.341 1.893 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . rr_6e5k 1
. 5 . 1997 . 1 1 27 CYS HA H -10.603 0.909 0.310 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . rr_6e5k 1
. 5 . 1998 . 1 1 27 CYS HB2 H -11.866 1.774 2.916 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . rr_6e5k 1
. 5 . 1999 . 1 1 27 CYS HB3 H -12.129 0.229 2.117 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . rr_6e5k 1
. 5 . 2000 . 1 1 27 CYS N N -10.102 2.729 1.135 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . rr_6e5k 1
. 5 . 2001 . 1 1 27 CYS O O -13.392 2.237 0.854 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . rr_6e5k 1
. 5 . 2002 . 1 1 27 CYS SG S -9.991 0.324 3.168 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . rr_6e5k 1
. 5 . 2003 . 1 1 28 NH2 HN1 H -11.306 2.462 -1.426 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . rr_6e5k 1
. 5 . 2004 . 1 1 28 NH2 HN2 H -12.985 2.862 -1.478 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . rr_6e5k 1
. 5 . 2005 . 1 1 28 NH2 N N -12.192 2.535 -1.009 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . rr_6e5k 1
. 6 . 2006 . 1 1 1 ASN C C 8.208 -8.843 -3.157 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . rr_6e5k 1
. 6 . 2007 . 1 1 1 ASN CA C 7.817 -10.310 -3.115 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . rr_6e5k 1
. 6 . 2008 . 1 1 1 ASN CB C 8.534 -11.003 -1.950 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . rr_6e5k 1
. 6 . 2009 . 1 1 1 ASN CG C 8.080 -12.435 -1.759 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . rr_6e5k 1
. 6 . 2010 . 1 1 1 ASN H1 H 9.183 -10.883 -4.576 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . rr_6e5k 1
. 6 . 2011 . 1 1 1 ASN H2 H 7.650 -10.506 -5.180 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . rr_6e5k 1
. 6 . 2012 . 1 1 1 ASN H3 H 7.902 -11.969 -4.371 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . rr_6e5k 1
. 6 . 2013 . 1 1 1 ASN HA H 6.748 -10.386 -2.975 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . rr_6e5k 1
. 6 . 2014 . 1 1 1 ASN HB2 H 9.597 -11.006 -2.140 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2015 . 1 1 1 ASN HB3 H 8.339 -10.458 -1.037 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2016 . 1 1 1 ASN HD21 H 6.774 -11.870 -0.374 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . rr_6e5k 1
. 6 . 2017 . 1 1 1 ASN HD22 H 6.821 -13.565 -0.720 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . rr_6e5k 1
. 6 . 2018 . 1 1 1 ASN N N 8.161 -10.963 -4.399 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . rr_6e5k 1
. 6 . 2019 . 1 1 1 ASN ND2 N 7.129 -12.644 -0.863 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . rr_6e5k 1
. 6 . 2020 . 1 1 1 ASN O O 9.258 -8.492 -3.697 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . rr_6e5k 1
. 6 . 2021 . 1 1 1 ASN OD1 O 8.590 -13.348 -2.405 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . rr_6e5k 1
. 6 . 2022 . 1 1 2 ASP C C 6.796 -5.869 -1.518 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . rr_6e5k 1
. 6 . 2023 . 1 1 2 ASP CA C 7.620 -6.551 -2.599 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . rr_6e5k 1
. 6 . 2024 . 1 1 2 ASP CB C 7.277 -5.955 -3.968 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . rr_6e5k 1
. 6 . 2025 . 1 1 2 ASP CG C 7.583 -4.474 -4.052 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . rr_6e5k 1
. 6 . 2026 . 1 1 2 ASP H H 6.556 -8.323 -2.150 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . rr_6e5k 1
. 6 . 2027 . 1 1 2 ASP HA H 8.666 -6.393 -2.395 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . rr_6e5k 1
. 6 . 2028 . 1 1 2 ASP HB2 H 7.847 -6.464 -4.729 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2029 . 1 1 2 ASP HB3 H 6.224 -6.096 -4.160 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2030 . 1 1 2 ASP N N 7.367 -7.986 -2.593 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . rr_6e5k 1
. 6 . 2031 . 1 1 2 ASP O O 5.705 -6.334 -1.191 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . rr_6e5k 1
. 6 . 2032 . 1 1 2 ASP OD1 O 6.655 -3.658 -3.868 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . rr_6e5k 1
. 6 . 2033 . 1 1 2 ASP OD2 O 8.750 -4.117 -4.293 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . rr_6e5k 1
. 6 . 2034 . 1 1 3 ABA C C 5.235 -3.633 -0.391 . . . 1.0 . . . . . . . . . . . . A . 3 AIB C . . . . . . . . . rr_6e5k 1
. 6 . 2035 . 1 1 3 ABA CA C 6.649 -4.005 0.076 . . . 1.0 . . . . . . . . . . . . A . 3 AIB CA . . . . . . . . . rr_6e5k 1
. 6 . 2036 . 1 1 3 ABA H H 8.205 -4.473 -1.285 . . . 1.0 . . . . . . . . . . . . A . 3 AIB H . . . . . . . . . rr_6e5k 1
. 6 . 2037 . 1 1 3 ABA N N 7.327 -4.776 -0.972 . . . 1.0 . . . . . . . . . . . . A . 3 AIB N . . . . . . . . . rr_6e5k 1
. 6 . 2038 . 1 1 3 ABA O O 4.248 -3.850 0.321 . . . 1.0 . . . . . . . . . . . . A . 3 AIB O . . . . . . . . . rr_6e5k 1
. 6 . 2039 . 1 1 4 CYS C C 2.909 -3.790 -2.316 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . rr_6e5k 1
. 6 . 2040 . 1 1 4 CYS CA C 3.885 -2.633 -2.150 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . rr_6e5k 1
. 6 . 2041 . 1 1 4 CYS CB C 4.112 -1.946 -3.497 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . rr_6e5k 1
. 6 . 2042 . 1 1 4 CYS H H 5.958 -3.044 -2.165 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . rr_6e5k 1
. 6 . 2043 . 1 1 4 CYS HA H 3.468 -1.920 -1.457 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . rr_6e5k 1
. 6 . 2044 . 1 1 4 CYS HB2 H 4.378 -2.689 -4.232 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2045 . 1 1 4 CYS HB3 H 3.198 -1.462 -3.801 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2046 . 1 1 4 CYS N N 5.148 -3.104 -1.606 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . rr_6e5k 1
. 6 . 2047 . 1 1 4 CYS O O 1.723 -3.668 -2.005 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . rr_6e5k 1
. 6 . 2048 . 1 1 4 CYS SG S 5.429 -0.685 -3.485 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . rr_6e5k 1
. 6 . 2049 . 1 1 5 LYS C C 2.071 -6.650 -1.701 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_6e5k 1
. 6 . 2050 . 1 1 5 LYS CA C 2.594 -6.093 -3.020 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_6e5k 1
. 6 . 2051 . 1 1 5 LYS CB C 3.384 -7.165 -3.780 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_6e5k 1
. 6 . 2052 . 1 1 5 LYS CD C 1.436 -7.948 -5.171 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_6e5k 1
. 6 . 2053 . 1 1 5 LYS CE C 0.625 -9.148 -5.631 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_6e5k 1
. 6 . 2054 . 1 1 5 LYS CG C 2.543 -8.359 -4.211 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_6e5k 1
. 6 . 2055 . 1 1 5 LYS H H 4.388 -4.969 -2.960 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_6e5k 1
. 6 . 2056 . 1 1 5 LYS HA H 1.755 -5.782 -3.621 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_6e5k 1
. 6 . 2057 . 1 1 5 LYS HB2 H 3.815 -6.717 -4.663 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2058 . 1 1 5 LYS HB3 H 4.181 -7.522 -3.145 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2059 . 1 1 5 LYS HD2 H 0.777 -7.255 -4.669 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_6e5k 1
. 6 . 2060 . 1 1 5 LYS HD3 H 1.878 -7.470 -6.031 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_6e5k 1
. 6 . 2061 . 1 1 5 LYS HE2 H 1.281 -9.833 -6.149 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_6e5k 1
. 6 . 2062 . 1 1 5 LYS HE3 H 0.207 -9.637 -4.764 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_6e5k 1
. 6 . 2063 . 1 1 5 LYS HG2 H 3.181 -9.078 -4.703 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_6e5k 1
. 6 . 2064 . 1 1 5 LYS HG3 H 2.099 -8.809 -3.336 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_6e5k 1
. 6 . 2065 . 1 1 5 LYS HZ1 H -1.167 -8.157 -6.040 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 6 . 2066 . 1 1 5 LYS HZ2 H -0.970 -9.598 -6.898 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 6 . 2067 . 1 1 5 LYS HZ3 H -0.106 -8.221 -7.355 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 6 . 2068 . 1 1 5 LYS N N 3.423 -4.921 -2.781 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_6e5k 1
. 6 . 2069 . 1 1 5 LYS NZ N -0.480 -8.754 -6.545 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_6e5k 1
. 6 . 2070 . 1 1 5 LYS O O 0.900 -7.031 -1.600 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_6e5k 1
. 6 . 2071 . 1 1 6 ABA C C 1.448 -6.268 1.182 . . . 1.0 . . . . . . . . . . . . A . 6 AIB C . . . . . . . . . rr_6e5k 1
. 6 . 2072 . 1 1 6 ABA CA C 2.588 -7.134 0.649 . . . 1.0 . . . . . . . . . . . . A . 6 AIB CA . . . . . . . . . rr_6e5k 1
. 6 . 2073 . 1 1 6 ABA H H 3.862 -6.365 -0.860 . . . 1.0 . . . . . . . . . . . . A . 6 AIB H . . . . . . . . . rr_6e5k 1
. 6 . 2074 . 1 1 6 ABA N N 2.944 -6.672 -0.694 . . . 1.0 . . . . . . . . . . . . A . 6 AIB N . . . . . . . . . rr_6e5k 1
. 6 . 2075 . 1 1 6 ABA O O 0.476 -6.777 1.738 . . . 1.0 . . . . . . . . . . . . A . 6 AIB O . . . . . . . . . rr_6e5k 1
. 6 . 2076 . 1 1 7 LEU C C -0.772 -4.286 0.711 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . rr_6e5k 1
. 6 . 2077 . 1 1 7 LEU CA C 0.543 -4.023 1.433 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . rr_6e5k 1
. 6 . 2078 . 1 1 7 LEU CB C 0.985 -2.578 1.196 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . rr_6e5k 1
. 6 . 2079 . 1 1 7 LEU CD1 C 2.635 -0.728 1.546 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . rr_6e5k 1
. 6 . 2080 . 1 1 7 LEU CD2 C 2.070 -2.249 3.436 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . rr_6e5k 1
. 6 . 2081 . 1 1 7 LEU CG C 2.257 -2.147 1.931 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . rr_6e5k 1
. 6 . 2082 . 1 1 7 LEU H H 2.371 -4.608 0.532 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . rr_6e5k 1
. 6 . 2083 . 1 1 7 LEU HA H 0.394 -4.177 2.489 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . rr_6e5k 1
. 6 . 2084 . 1 1 7 LEU HB2 H 1.145 -2.446 0.137 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2085 . 1 1 7 LEU HB3 H 0.181 -1.926 1.503 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2086 . 1 1 7 LEU HD11 H 1.835 -0.058 1.823 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . rr_6e5k 1
. 6 . 2087 . 1 1 7 LEU HD12 H 2.796 -0.674 0.479 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . rr_6e5k 1
. 6 . 2088 . 1 1 7 LEU HD13 H 3.539 -0.444 2.062 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . rr_6e5k 1
. 6 . 2089 . 1 1 7 LEU HD21 H 1.867 -3.274 3.708 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . rr_6e5k 1
. 6 . 2090 . 1 1 7 LEU HD22 H 1.241 -1.626 3.736 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . rr_6e5k 1
. 6 . 2091 . 1 1 7 LEU HD23 H 2.968 -1.915 3.934 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . rr_6e5k 1
. 6 . 2092 . 1 1 7 LEU HG H 3.070 -2.801 1.645 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . rr_6e5k 1
. 6 . 2093 . 1 1 7 LEU N N 1.568 -4.956 0.988 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . rr_6e5k 1
. 6 . 2094 . 1 1 7 LEU O O -1.836 -4.310 1.329 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . rr_6e5k 1
. 6 . 2095 . 1 1 8 LYS C C -2.608 -5.997 -0.854 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . rr_6e5k 1
. 6 . 2096 . 1 1 8 LYS CA C -1.874 -4.781 -1.401 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . rr_6e5k 1
. 6 . 2097 . 1 1 8 LYS CB C -1.500 -5.016 -2.868 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . rr_6e5k 1
. 6 . 2098 . 1 1 8 LYS CD C -0.466 -4.132 -4.979 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . rr_6e5k 1
. 6 . 2099 . 1 1 8 LYS CE C 0.285 -2.975 -5.620 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . rr_6e5k 1
. 6 . 2100 . 1 1 8 LYS CG C -0.903 -3.802 -3.562 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . rr_6e5k 1
. 6 . 2101 . 1 1 8 LYS H H 0.194 -4.476 -1.031 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . rr_6e5k 1
. 6 . 2102 . 1 1 8 LYS HA H -2.527 -3.925 -1.334 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . rr_6e5k 1
. 6 . 2103 . 1 1 8 LYS HB2 H -0.780 -5.820 -2.917 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2104 . 1 1 8 LYS HB3 H -2.389 -5.311 -3.407 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2105 . 1 1 8 LYS HD2 H 0.179 -4.997 -4.956 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . rr_6e5k 1
. 6 . 2106 . 1 1 8 LYS HD3 H -1.343 -4.350 -5.570 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . rr_6e5k 1
. 6 . 2107 . 1 1 8 LYS HE2 H 1.126 -2.717 -4.994 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . rr_6e5k 1
. 6 . 2108 . 1 1 8 LYS HE3 H 0.644 -3.290 -6.590 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . rr_6e5k 1
. 6 . 2109 . 1 1 8 LYS HG2 H -1.646 -3.018 -3.599 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . rr_6e5k 1
. 6 . 2110 . 1 1 8 LYS HG3 H -0.046 -3.460 -3.001 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . rr_6e5k 1
. 6 . 2111 . 1 1 8 LYS HZ1 H -1.347 -1.977 -6.455 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 6 . 2112 . 1 1 8 LYS HZ2 H -0.013 -0.980 -6.164 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 6 . 2113 . 1 1 8 LYS HZ3 H -0.982 -1.489 -4.879 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 6 . 2114 . 1 1 8 LYS N N -0.689 -4.502 -0.598 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . rr_6e5k 1
. 6 . 2115 . 1 1 8 LYS NZ N -0.574 -1.773 -5.790 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . rr_6e5k 1
. 6 . 2116 . 1 1 8 LYS O O -3.810 -5.938 -0.584 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . rr_6e5k 1
. 6 . 2117 . 1 1 9 ABA C C -2.968 -8.103 1.269 . . . 1.0 . . . . . . . . . . . . A . 9 AIB C . . . . . . . . . rr_6e5k 1
. 6 . 2118 . 1 1 9 ABA CA C -2.405 -8.337 -0.140 . . . 1.0 . . . . . . . . . . . . A . 9 AIB CA . . . . . . . . . rr_6e5k 1
. 6 . 2119 . 1 1 9 ABA H H -0.901 -7.039 -0.887 . . . 1.0 . . . . . . . . . . . . A . 9 AIB H . . . . . . . . . rr_6e5k 1
. 6 . 2120 . 1 1 9 ABA N N -1.859 -7.082 -0.666 . . . 1.0 . . . . . . . . . . . . A . 9 AIB N . . . . . . . . . rr_6e5k 1
. 6 . 2121 . 1 1 9 ABA O O -4.007 -8.650 1.638 . . . 1.0 . . . . . . . . . . . . A . 9 AIB O . . . . . . . . . rr_6e5k 1
. 6 . 2122 . 1 1 10 ARG C C -3.952 -6.279 3.545 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . rr_6e5k 1
. 6 . 2123 . 1 1 10 ARG CA C -2.620 -7.014 3.425 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . rr_6e5k 1
. 6 . 2124 . 1 1 10 ARG CB C -1.514 -6.190 4.086 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . rr_6e5k 1
. 6 . 2125 . 1 1 10 ARG CD C -0.619 -5.077 6.148 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . rr_6e5k 1
. 6 . 2126 . 1 1 10 ARG CG C -1.743 -5.917 5.560 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . rr_6e5k 1
. 6 . 2127 . 1 1 10 ARG CZ C 1.848 -5.130 6.291 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . rr_6e5k 1
. 6 . 2128 . 1 1 10 ARG H H -1.481 -6.827 1.656 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . rr_6e5k 1
. 6 . 2129 . 1 1 10 ARG HA H -2.700 -7.962 3.931 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . rr_6e5k 1
. 6 . 2130 . 1 1 10 ARG HB2 H -0.579 -6.720 3.982 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2131 . 1 1 10 ARG HB3 H -1.436 -5.240 3.575 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2132 . 1 1 10 ARG HD2 H -0.596 -4.123 5.639 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . rr_6e5k 1
. 6 . 2133 . 1 1 10 ARG HD3 H -0.819 -4.916 7.197 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . rr_6e5k 1
. 6 . 2134 . 1 1 10 ARG HE H 0.705 -6.646 5.667 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . rr_6e5k 1
. 6 . 2135 . 1 1 10 ARG HG2 H -2.676 -5.384 5.673 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . rr_6e5k 1
. 6 . 2136 . 1 1 10 ARG HG3 H -1.795 -6.857 6.089 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . rr_6e5k 1
. 6 . 2137 . 1 1 10 ARG HH11 H 2.745 -3.457 7.006 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . rr_6e5k 1
. 6 . 2138 . 1 1 10 ARG HH12 H 1.011 -3.415 6.979 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . rr_6e5k 1
. 6 . 2139 . 1 1 10 ARG HH21 H 2.973 -6.716 5.732 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . rr_6e5k 1
. 6 . 2140 . 1 1 10 ARG HH22 H 3.862 -5.341 6.309 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . rr_6e5k 1
. 6 . 2141 . 1 1 10 ARG N N -2.270 -7.276 2.036 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . rr_6e5k 1
. 6 . 2142 . 1 1 10 ARG NE N 0.689 -5.721 6.005 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . rr_6e5k 1
. 6 . 2143 . 1 1 10 ARG NH1 N 1.868 -3.900 6.794 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . rr_6e5k 1
. 6 . 2144 . 1 1 10 ARG NH2 N 2.985 -5.780 6.094 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . rr_6e5k 1
. 6 . 2145 . 1 1 10 ARG O O -4.765 -6.585 4.419 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . rr_6e5k 1
. 6 . 2146 . 1 1 11 TYR C C -6.531 -5.057 1.940 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . rr_6e5k 1
. 6 . 2147 . 1 1 11 TYR CA C -5.369 -4.484 2.750 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . rr_6e5k 1
. 6 . 2148 . 1 1 11 TYR CB C -5.043 -3.053 2.331 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . rr_6e5k 1
. 6 . 2149 . 1 1 11 TYR CD1 C -4.718 -1.785 4.492 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . rr_6e5k 1
. 6 . 2150 . 1 1 11 TYR CD2 C -2.811 -2.217 3.135 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . rr_6e5k 1
. 6 . 2151 . 1 1 11 TYR CE1 C -3.925 -1.118 5.402 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . rr_6e5k 1
. 6 . 2152 . 1 1 11 TYR CE2 C -2.010 -1.557 4.042 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . rr_6e5k 1
. 6 . 2153 . 1 1 11 TYR CG C -4.177 -2.345 3.345 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . rr_6e5k 1
. 6 . 2154 . 1 1 11 TYR CZ C -2.597 -1.081 5.247 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . rr_6e5k 1
. 6 . 2155 . 1 1 11 TYR H H -3.518 -5.147 1.953 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . rr_6e5k 1
. 6 . 2156 . 1 1 11 TYR HA H -5.668 -4.468 3.787 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . rr_6e5k 1
. 6 . 2157 . 1 1 11 TYR HB2 H -4.518 -3.062 1.387 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2158 . 1 1 11 TYR HB3 H -5.959 -2.497 2.231 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2159 . 1 1 11 TYR HD1 H -5.782 -1.875 4.670 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . rr_6e5k 1
. 6 . 2160 . 1 1 11 TYR HD2 H -2.375 -2.647 2.248 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . rr_6e5k 1
. 6 . 2161 . 1 1 11 TYR HE1 H -4.366 -0.689 6.289 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . rr_6e5k 1
. 6 . 2162 . 1 1 11 TYR HE2 H -0.950 -1.469 3.861 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . rr_6e5k 1
. 6 . 2163 . 1 1 11 TYR HH H -1.255 0.333 5.594 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . rr_6e5k 1
. 6 . 2164 . 1 1 11 TYR N N -4.177 -5.314 2.667 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . rr_6e5k 1
. 6 . 2165 . 1 1 11 TYR O O -7.578 -4.418 1.824 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . rr_6e5k 1
. 6 . 2166 . 1 1 11 TYR OH O -1.775 -0.331 6.071 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . rr_6e5k 1
. 6 . 2167 . 1 1 12 ABA C C -8.567 -6.332 0.278 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . rr_6e5k 1
. 6 . 2168 . 1 1 12 ABA CA C -7.346 -7.119 0.777 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . rr_6e5k 1
. 6 . 2169 . 1 1 12 ABA H H -5.384 -6.595 1.402 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . rr_6e5k 1
. 6 . 2170 . 1 1 12 ABA N N -6.305 -6.259 1.392 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . rr_6e5k 1
. 6 . 2171 . 1 1 12 ABA O O -9.646 -6.418 0.864 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . rr_6e5k 1
. 6 . 2172 . 1 1 13 GLY C C -9.364 -3.378 -1.405 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_6e5k 1
. 6 . 2173 . 1 1 13 GLY CA C -9.538 -4.879 -1.369 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_6e5k 1
. 6 . 2174 . 1 1 13 GLY H H -7.511 -5.467 -1.190 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_6e5k 1
. 6 . 2175 . 1 1 13 GLY HA2 H -9.683 -5.235 -2.376 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_6e5k 1
. 6 . 2176 . 1 1 13 GLY HA3 H -10.415 -5.114 -0.788 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_6e5k 1
. 6 . 2177 . 1 1 13 GLY N N -8.402 -5.568 -0.792 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_6e5k 1
. 6 . 2178 . 1 1 13 GLY O O -9.896 -2.707 -2.293 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_6e5k 1
. 6 . 2179 . 1 1 14 CYS C C -7.289 -1.049 -1.404 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_6e5k 1
. 6 . 2180 . 1 1 14 CYS CA C -8.384 -1.409 -0.410 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_6e5k 1
. 6 . 2181 . 1 1 14 CYS CB C -7.969 -0.970 0.992 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_6e5k 1
. 6 . 2182 . 1 1 14 CYS H H -8.241 -3.417 0.249 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_6e5k 1
. 6 . 2183 . 1 1 14 CYS HA H -9.295 -0.902 -0.689 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_6e5k 1
. 6 . 2184 . 1 1 14 CYS HB2 H -6.970 -1.313 1.182 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2185 . 1 1 14 CYS HB3 H -7.985 0.110 1.040 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2186 . 1 1 14 CYS N N -8.629 -2.841 -0.449 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_6e5k 1
. 6 . 2187 . 1 1 14 CYS O O -6.450 -1.887 -1.746 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_6e5k 1
. 6 . 2188 . 1 1 14 CYS SG S -9.038 -1.600 2.328 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_6e5k 1
. 6 . 2189 . 1 1 15 GLU C C -5.118 1.225 -2.039 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_6e5k 1
. 6 . 2190 . 1 1 15 GLU CA C -6.299 0.650 -2.808 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_6e5k 1
. 6 . 2191 . 1 1 15 GLU CB C -6.873 1.707 -3.755 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_6e5k 1
. 6 . 2192 . 1 1 15 GLU CD C -8.343 2.189 -5.745 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_6e5k 1
. 6 . 2193 . 1 1 15 GLU CG C -7.936 1.173 -4.699 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_6e5k 1
. 6 . 2194 . 1 1 15 GLU H H -8.013 0.803 -1.580 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_6e5k 1
. 6 . 2195 . 1 1 15 GLU HA H -5.963 -0.198 -3.384 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_6e5k 1
. 6 . 2196 . 1 1 15 GLU HB2 H -7.312 2.499 -3.166 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2197 . 1 1 15 GLU HB3 H -6.070 2.115 -4.347 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2198 . 1 1 15 GLU HG2 H -7.551 0.298 -5.201 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_6e5k 1
. 6 . 2199 . 1 1 15 GLU HG3 H -8.809 0.901 -4.124 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_6e5k 1
. 6 . 2200 . 1 1 15 GLU N N -7.310 0.183 -1.878 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_6e5k 1
. 6 . 2201 . 1 1 15 GLU O O -5.304 2.074 -1.169 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_6e5k 1
. 6 . 2202 . 1 1 15 GLU OE1 O -9.403 2.831 -5.574 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_6e5k 1
. 6 . 2203 . 1 1 15 GLU OE2 O -7.607 2.354 -6.738 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_6e5k 1
. 6 . 2204 . 1 1 16 MVA C C -1.555 1.659 -2.494 . . . 1.0 . . . . . . . . . . . . A . 16 MVA C . . . . . . . . . rr_6e5k 1
. 6 . 2205 . 1 1 16 MVA CA C -2.721 1.258 -1.585 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CA . . . . . . . . . rr_6e5k 1
. 6 . 2206 . 1 1 16 MVA CB C -2.237 0.236 -0.508 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CB . . . . . . . . . rr_6e5k 1
. 6 . 2207 . 1 1 16 MVA CG1 C -1.825 -1.101 -1.099 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG1 . . . . . . . . . rr_6e5k 1
. 6 . 2208 . 1 1 16 MVA CG2 C -1.091 0.823 0.298 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG2 . . . . . . . . . rr_6e5k 1
. 6 . 2209 . 1 1 16 MVA CN C -3.715 -0.147 -3.482 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CN . . . . . . . . . rr_6e5k 1
. 6 . 2210 . 1 1 16 MVA HA H -3.006 2.153 -1.048 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HA . . . . . . . . . rr_6e5k 1
. 6 . 2211 . 1 1 16 MVA HB H -3.056 0.053 0.172 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HB . . . . . . . . . rr_6e5k 1
. 6 . 2212 . 1 1 16 MVA HG11 H -1.023 -0.948 -1.806 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG11 . . . . . . . . . rr_6e5k 1
. 6 . 2213 . 1 1 16 MVA HG12 H -2.670 -1.547 -1.601 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG12 . . . . . . . . . rr_6e5k 1
. 6 . 2214 . 1 1 16 MVA HG13 H -1.489 -1.754 -0.307 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG13 . . . . . . . . . rr_6e5k 1
. 6 . 2215 . 1 1 16 MVA HG21 H -1.403 1.760 0.737 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG21 . . . . . . . . . rr_6e5k 1
. 6 . 2216 . 1 1 16 MVA HG22 H -0.243 0.993 -0.351 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG22 . . . . . . . . . rr_6e5k 1
. 6 . 2217 . 1 1 16 MVA HG23 H -0.812 0.134 1.081 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG23 . . . . . . . . . rr_6e5k 1
. 6 . 2218 . 1 1 16 MVA HN1 H -2.662 -0.263 -3.694 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN1 . . . . . . . . . rr_6e5k 1
. 6 . 2219 . 1 1 16 MVA HN2 H -4.216 0.253 -4.351 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN2 . . . . . . . . . rr_6e5k 1
. 6 . 2220 . 1 1 16 MVA HN3 H -4.138 -1.109 -3.231 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN3 . . . . . . . . . rr_6e5k 1
. 6 . 2221 . 1 1 16 MVA N N -3.889 0.782 -2.343 . . . 1.0 . . . . . . . . . . . . A . 16 MVA N . . . . . . . . . rr_6e5k 1
. 6 . 2222 . 1 1 16 MVA O O -0.912 0.832 -3.147 . . . 1.0 . . . . . . . . . . . . A . 16 MVA O . . . . . . . . . rr_6e5k 1
. 6 . 2223 . 1 1 17 ARG C C 1.029 3.616 -2.433 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_6e5k 1
. 6 . 2224 . 1 1 17 ARG CA C -0.214 3.519 -3.298 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_6e5k 1
. 6 . 2225 . 1 1 17 ARG CB C -0.596 4.910 -3.797 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_6e5k 1
. 6 . 2226 . 1 1 17 ARG CD C 0.217 7.100 -4.727 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_6e5k 1
. 6 . 2227 . 1 1 17 ARG CG C 0.534 5.627 -4.510 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_6e5k 1
. 6 . 2228 . 1 1 17 ARG CZ C 1.814 8.979 -4.925 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_6e5k 1
. 6 . 2229 . 1 1 17 ARG H H -1.856 3.556 -1.978 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_6e5k 1
. 6 . 2230 . 1 1 17 ARG HA H -0.020 2.872 -4.138 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_6e5k 1
. 6 . 2231 . 1 1 17 ARG HB2 H -1.424 4.817 -4.480 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2232 . 1 1 17 ARG HB3 H -0.900 5.510 -2.954 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2233 . 1 1 17 ARG HD2 H -0.654 7.182 -5.361 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_6e5k 1
. 6 . 2234 . 1 1 17 ARG HD3 H 0.006 7.556 -3.770 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_6e5k 1
. 6 . 2235 . 1 1 17 ARG HE H 1.740 7.392 -6.150 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_6e5k 1
. 6 . 2236 . 1 1 17 ARG HG2 H 1.430 5.544 -3.914 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_6e5k 1
. 6 . 2237 . 1 1 17 ARG HG3 H 0.692 5.155 -5.468 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_6e5k 1
. 6 . 2238 . 1 1 17 ARG HH11 H 1.667 10.452 -3.535 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_6e5k 1
. 6 . 2239 . 1 1 17 ARG HH12 H 0.538 9.142 -3.343 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_6e5k 1
. 6 . 2240 . 1 1 17 ARG HH21 H 3.224 9.113 -6.374 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_6e5k 1
. 6 . 2241 . 1 1 17 ARG HH22 H 3.195 10.427 -5.244 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_6e5k 1
. 6 . 2242 . 1 1 17 ARG N N -1.300 2.955 -2.523 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_6e5k 1
. 6 . 2243 . 1 1 17 ARG NE N 1.331 7.812 -5.357 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_6e5k 1
. 6 . 2244 . 1 1 17 ARG NH1 N 1.297 9.571 -3.853 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_6e5k 1
. 6 . 2245 . 1 1 17 ARG NH2 N 2.822 9.552 -5.566 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_6e5k 1
. 6 . 2246 . 1 1 17 ARG O O 1.030 4.315 -1.426 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_6e5k 1
. 6 . 2247 . 1 1 18 CYS C C 4.211 4.068 -2.514 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . rr_6e5k 1
. 6 . 2248 . 1 1 18 CYS CA C 3.298 2.949 -2.034 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . rr_6e5k 1
. 6 . 2249 . 1 1 18 CYS CB C 4.013 1.599 -2.099 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . rr_6e5k 1
. 6 . 2250 . 1 1 18 CYS H H 2.037 2.391 -3.636 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . rr_6e5k 1
. 6 . 2251 . 1 1 18 CYS HA H 3.023 3.147 -1.008 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . rr_6e5k 1
. 6 . 2252 . 1 1 18 CYS HB2 H 4.933 1.662 -1.539 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2253 . 1 1 18 CYS HB3 H 3.377 0.845 -1.658 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2254 . 1 1 18 CYS N N 2.077 2.922 -2.812 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . rr_6e5k 1
. 6 . 2255 . 1 1 18 CYS O O 4.438 4.235 -3.712 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . rr_6e5k 1
. 6 . 2256 . 1 1 18 CYS SG S 4.431 1.054 -3.785 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . rr_6e5k 1
. 6 . 2257 . 1 1 19 ASP C C 6.893 5.760 -1.065 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . rr_6e5k 1
. 6 . 2258 . 1 1 19 ASP CA C 5.614 5.940 -1.869 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . rr_6e5k 1
. 6 . 2259 . 1 1 19 ASP CB C 4.953 7.276 -1.533 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . rr_6e5k 1
. 6 . 2260 . 1 1 19 ASP CG C 5.767 8.467 -1.996 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . rr_6e5k 1
. 6 . 2261 . 1 1 19 ASP H H 4.481 4.662 -0.634 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . rr_6e5k 1
. 6 . 2262 . 1 1 19 ASP HA H 5.845 5.909 -2.922 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . rr_6e5k 1
. 6 . 2263 . 1 1 19 ASP HB2 H 3.984 7.321 -2.006 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2264 . 1 1 19 ASP HB3 H 4.828 7.345 -0.462 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2265 . 1 1 19 ASP N N 4.713 4.843 -1.571 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . rr_6e5k 1
. 6 . 2266 . 1 1 19 ASP O O 7.021 6.283 0.044 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . rr_6e5k 1
. 6 . 2267 . 1 1 19 ASP OD1 O 6.531 9.031 -1.181 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . rr_6e5k 1
. 6 . 2268 . 1 1 19 ASP OD2 O 5.635 8.859 -3.173 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . rr_6e5k 1
. 6 . 2269 . 1 1 20 DPR C C 8.727 3.873 0.416 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . rr_6e5k 1
. 6 . 2270 . 1 1 20 DPR CA C 9.062 4.618 -0.877 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . rr_6e5k 1
. 6 . 2271 . 1 1 20 DPR CB C 9.806 3.699 -1.846 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . rr_6e5k 1
. 6 . 2272 . 1 1 20 DPR CD C 7.833 4.431 -2.965 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . rr_6e5k 1
. 6 . 2273 . 1 1 20 DPR CG C 9.263 4.035 -3.189 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . rr_6e5k 1
. 6 . 2274 . 1 1 20 DPR HA H 9.675 5.476 -0.657 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . rr_6e5k 1
. 6 . 2275 . 1 1 20 DPR HB2 H 10.866 3.894 -1.784 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2276 . 1 1 20 DPR HB3 H 9.609 2.669 -1.589 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2277 . 1 1 20 DPR HD2 H 7.533 5.176 -3.686 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . rr_6e5k 1
. 6 . 2278 . 1 1 20 DPR HD3 H 7.187 3.568 -3.020 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . rr_6e5k 1
. 6 . 2279 . 1 1 20 DPR HG2 H 9.818 4.859 -3.615 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . rr_6e5k 1
. 6 . 2280 . 1 1 20 DPR HG3 H 9.317 3.171 -3.834 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . rr_6e5k 1
. 6 . 2281 . 1 1 20 DPR N N 7.849 4.990 -1.604 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . rr_6e5k 1
. 6 . 2282 . 1 1 20 DPR O O 8.098 2.814 0.387 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . rr_6e5k 1
. 6 . 2283 . 1 1 21 PRO C C 7.473 4.232 3.406 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . rr_6e5k 1
. 6 . 2284 . 1 1 21 PRO CA C 8.851 3.836 2.872 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . rr_6e5k 1
. 6 . 2285 . 1 1 21 PRO CB C 9.952 4.432 3.741 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . rr_6e5k 1
. 6 . 2286 . 1 1 21 PRO CD C 9.941 5.654 1.685 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . rr_6e5k 1
. 6 . 2287 . 1 1 21 PRO CG C 10.166 5.788 3.169 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . rr_6e5k 1
. 6 . 2288 . 1 1 21 PRO HA H 8.941 2.762 2.856 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . rr_6e5k 1
. 6 . 2289 . 1 1 21 PRO HB2 H 9.621 4.477 4.768 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2290 . 1 1 21 PRO HB3 H 10.843 3.829 3.667 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2291 . 1 1 21 PRO HD2 H 9.396 6.506 1.307 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . rr_6e5k 1
. 6 . 2292 . 1 1 21 PRO HD3 H 10.882 5.549 1.168 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . rr_6e5k 1
. 6 . 2293 . 1 1 21 PRO HG2 H 9.456 6.480 3.596 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . rr_6e5k 1
. 6 . 2294 . 1 1 21 PRO HG3 H 11.175 6.117 3.368 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . rr_6e5k 1
. 6 . 2295 . 1 1 21 PRO N N 9.137 4.424 1.565 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . rr_6e5k 1
. 6 . 2296 . 1 1 21 PRO O O 7.121 3.913 4.543 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . rr_6e5k 1
. 6 . 2297 . 1 1 22 ARG C C 4.327 4.716 2.068 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . rr_6e5k 1
. 6 . 2298 . 1 1 22 ARG CA C 5.358 5.353 2.984 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . rr_6e5k 1
. 6 . 2299 . 1 1 22 ARG CB C 5.216 6.877 2.930 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . rr_6e5k 1
. 6 . 2300 . 1 1 22 ARG CD C 5.912 9.107 3.855 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . rr_6e5k 1
. 6 . 2301 . 1 1 22 ARG CG C 6.229 7.620 3.783 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . rr_6e5k 1
. 6 . 2302 . 1 1 22 ARG CZ C 3.809 10.331 4.304 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . rr_6e5k 1
. 6 . 2303 . 1 1 22 ARG H H 7.040 5.199 1.707 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . rr_6e5k 1
. 6 . 2304 . 1 1 22 ARG HA H 5.186 5.016 3.995 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . rr_6e5k 1
. 6 . 2305 . 1 1 22 ARG HB2 H 5.337 7.198 1.906 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2306 . 1 1 22 ARG HB3 H 4.226 7.147 3.267 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2307 . 1 1 22 ARG HD2 H 6.735 9.616 4.335 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . rr_6e5k 1
. 6 . 2308 . 1 1 22 ARG HD3 H 5.795 9.485 2.851 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . rr_6e5k 1
. 6 . 2309 . 1 1 22 ARG HE H 4.508 8.810 5.399 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . rr_6e5k 1
. 6 . 2310 . 1 1 22 ARG HG2 H 6.217 7.208 4.781 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . rr_6e5k 1
. 6 . 2311 . 1 1 22 ARG HG3 H 7.211 7.491 3.350 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . rr_6e5k 1
. 6 . 2312 . 1 1 22 ARG HH11 H 4.797 10.954 2.650 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . rr_6e5k 1
. 6 . 2313 . 1 1 22 ARG HH12 H 3.334 11.812 3.003 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . rr_6e5k 1
. 6 . 2314 . 1 1 22 ARG HH21 H 2.076 11.238 4.837 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . rr_6e5k 1
. 6 . 2315 . 1 1 22 ARG HH22 H 2.580 9.934 5.863 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . rr_6e5k 1
. 6 . 2316 . 1 1 22 ARG N N 6.701 4.945 2.595 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . rr_6e5k 1
. 6 . 2317 . 1 1 22 ARG NE N 4.683 9.372 4.610 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . rr_6e5k 1
. 6 . 2318 . 1 1 22 ARG NH1 N 3.997 11.094 3.235 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . rr_6e5k 1
. 6 . 2319 . 1 1 22 ARG NH2 N 2.737 10.515 5.064 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . rr_6e5k 1
. 6 . 2320 . 1 1 22 ARG O O 4.681 4.067 1.086 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . rr_6e5k 1
. 6 . 2321 . 1 1 23 TYR C C 0.667 5.093 1.874 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . rr_6e5k 1
. 6 . 2322 . 1 1 23 TYR CA C 1.980 4.393 1.556 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . rr_6e5k 1
. 6 . 2323 . 1 1 23 TYR CB C 1.816 2.881 1.712 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . rr_6e5k 1
. 6 . 2324 . 1 1 23 TYR CD1 C 0.089 2.265 3.449 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . rr_6e5k 1
. 6 . 2325 . 1 1 23 TYR CD2 C 2.388 2.201 4.074 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . rr_6e5k 1
. 6 . 2326 . 1 1 23 TYR CE1 C -0.271 1.869 4.721 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . rr_6e5k 1
. 6 . 2327 . 1 1 23 TYR CE2 C 2.035 1.802 5.345 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . rr_6e5k 1
. 6 . 2328 . 1 1 23 TYR CG C 1.424 2.438 3.104 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . rr_6e5k 1
. 6 . 2329 . 1 1 23 TYR CZ C 0.700 1.614 5.655 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . rr_6e5k 1
. 6 . 2330 . 1 1 23 TYR H H 2.835 5.339 3.240 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . rr_6e5k 1
. 6 . 2331 . 1 1 23 TYR HA H 2.241 4.607 0.532 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . rr_6e5k 1
. 6 . 2332 . 1 1 23 TYR HB2 H 1.053 2.538 1.033 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2333 . 1 1 23 TYR HB3 H 2.750 2.403 1.464 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2334 . 1 1 23 TYR HD1 H -0.672 2.446 2.705 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . rr_6e5k 1
. 6 . 2335 . 1 1 23 TYR HD2 H 3.432 2.328 3.821 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . rr_6e5k 1
. 6 . 2336 . 1 1 23 TYR HE1 H -1.313 1.738 4.969 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . rr_6e5k 1
. 6 . 2337 . 1 1 23 TYR HE2 H 2.801 1.623 6.085 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . rr_6e5k 1
. 6 . 2338 . 1 1 23 TYR HH H 0.897 1.731 7.578 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . rr_6e5k 1
. 6 . 2339 . 1 1 23 TYR N N 3.056 4.884 2.400 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . rr_6e5k 1
. 6 . 2340 . 1 1 23 TYR O O 0.474 5.615 2.975 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . rr_6e5k 1
. 6 . 2341 . 1 1 23 TYR OH O 0.356 1.245 6.936 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . rr_6e5k 1
. 6 . 2342 . 1 1 24 GLU C C -2.572 4.532 0.822 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . rr_6e5k 1
. 6 . 2343 . 1 1 24 GLU CA C -1.559 5.641 1.054 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . rr_6e5k 1
. 6 . 2344 . 1 1 24 GLU CB C -1.797 6.763 0.047 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . rr_6e5k 1
. 6 . 2345 . 1 1 24 GLU CD C -1.105 9.015 -0.829 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . rr_6e5k 1
. 6 . 2346 . 1 1 24 GLU CG C -0.840 7.931 0.189 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . rr_6e5k 1
. 6 . 2347 . 1 1 24 GLU H H 0.031 4.718 0.030 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . rr_6e5k 1
. 6 . 2348 . 1 1 24 GLU HA H -1.660 6.022 2.057 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . rr_6e5k 1
. 6 . 2349 . 1 1 24 GLU HB2 H -1.695 6.362 -0.947 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2350 . 1 1 24 GLU HB3 H -2.802 7.134 0.172 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2351 . 1 1 24 GLU HG2 H -0.947 8.351 1.178 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . rr_6e5k 1
. 6 . 2352 . 1 1 24 GLU HG3 H 0.170 7.570 0.057 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . rr_6e5k 1
. 6 . 2353 . 1 1 24 GLU N N -0.222 5.099 0.899 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . rr_6e5k 1
. 6 . 2354 . 1 1 24 GLU O O -2.467 3.810 -0.163 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . rr_6e5k 1
. 6 . 2355 . 1 1 24 GLU OE1 O -2.020 9.833 -0.605 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . rr_6e5k 1
. 6 . 2356 . 1 1 24 GLU OE2 O -0.400 9.057 -1.859 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . rr_6e5k 1
. 6 . 2357 . 1 1 25 MVA C C -5.977 3.673 1.765 . . . 1.0 . . . . . . . . . . . . A . 25 MVA C . . . . . . . . . rr_6e5k 1
. 6 . 2358 . 1 1 25 MVA CA C -4.521 3.259 1.536 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CA . . . . . . . . . rr_6e5k 1
. 6 . 2359 . 1 1 25 MVA CB C -4.166 2.034 2.428 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CB . . . . . . . . . rr_6e5k 1
. 6 . 2360 . 1 1 25 MVA CG1 C -4.139 2.374 3.910 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG1 . . . . . . . . . rr_6e5k 1
. 6 . 2361 . 1 1 25 MVA CG2 C -5.136 0.895 2.164 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG2 . . . . . . . . . rr_6e5k 1
. 6 . 2362 . 1 1 25 MVA CN C -3.739 5.361 2.792 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CN . . . . . . . . . rr_6e5k 1
. 6 . 2363 . 1 1 25 MVA HA H -4.464 2.914 0.511 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HA . . . . . . . . . rr_6e5k 1
. 6 . 2364 . 1 1 25 MVA HB H -3.178 1.695 2.151 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HB . . . . . . . . . rr_6e5k 1
. 6 . 2365 . 1 1 25 MVA HG11 H -3.955 1.475 4.481 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG11 . . . . . . . . . rr_6e5k 1
. 6 . 2366 . 1 1 25 MVA HG12 H -5.088 2.798 4.198 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG12 . . . . . . . . . rr_6e5k 1
. 6 . 2367 . 1 1 25 MVA HG13 H -3.350 3.088 4.099 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG13 . . . . . . . . . rr_6e5k 1
. 6 . 2368 . 1 1 25 MVA HG21 H -5.059 0.587 1.130 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG21 . . . . . . . . . rr_6e5k 1
. 6 . 2369 . 1 1 25 MVA HG22 H -6.145 1.228 2.366 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG22 . . . . . . . . . rr_6e5k 1
. 6 . 2370 . 1 1 25 MVA HG23 H -4.896 0.060 2.807 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG23 . . . . . . . . . rr_6e5k 1
. 6 . 2371 . 1 1 25 MVA HN1 H -2.937 5.248 3.505 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN1 . . . . . . . . . rr_6e5k 1
. 6 . 2372 . 1 1 25 MVA HN2 H -4.686 5.194 3.283 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN2 . . . . . . . . . rr_6e5k 1
. 6 . 2373 . 1 1 25 MVA HN3 H -3.717 6.360 2.383 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN3 . . . . . . . . . rr_6e5k 1
. 6 . 2374 . 1 1 25 MVA N N -3.571 4.377 1.698 . . . 1.0 . . . . . . . . . . . . A . 25 MVA N . . . . . . . . . rr_6e5k 1
. 6 . 2375 . 1 1 25 MVA O O -6.383 4.066 2.860 . . . 1.0 . . . . . . . . . . . . A . 25 MVA O . . . . . . . . . rr_6e5k 1
. 6 . 2376 . 1 1 26 HIS C C -9.045 2.753 0.503 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_6e5k 1
. 6 . 2377 . 1 1 26 HIS CA C -8.154 3.967 0.726 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_6e5k 1
. 6 . 2378 . 1 1 26 HIS CB C -8.425 5.010 -0.364 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_6e5k 1
. 6 . 2379 . 1 1 26 HIS CD2 C -6.283 6.487 -0.377 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_6e5k 1
. 6 . 2380 . 1 1 26 HIS CE1 C -7.225 8.419 0.046 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_6e5k 1
. 6 . 2381 . 1 1 26 HIS CG C -7.614 6.269 -0.240 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_6e5k 1
. 6 . 2382 . 1 1 26 HIS H H -6.388 3.182 -0.122 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_6e5k 1
. 6 . 2383 . 1 1 26 HIS HA H -8.368 4.394 1.692 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_6e5k 1
. 6 . 2384 . 1 1 26 HIS HB2 H -8.208 4.573 -1.325 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2385 . 1 1 26 HIS HB3 H -9.468 5.283 -0.331 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2386 . 1 1 26 HIS HD1 H -9.128 7.678 0.175 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_6e5k 1
. 6 . 2387 . 1 1 26 HIS HD2 H -5.530 5.741 -0.591 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_6e5k 1
. 6 . 2388 . 1 1 26 HIS HE1 H -7.370 9.474 0.229 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_6e5k 1
. 6 . 2389 . 1 1 26 HIS HE2 H -5.198 8.288 -0.235 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_6e5k 1
. 6 . 2390 . 1 1 26 HIS N N -6.759 3.565 0.705 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_6e5k 1
. 6 . 2391 . 1 1 26 HIS ND1 N -8.172 7.501 0.025 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_6e5k 1
. 6 . 2392 . 1 1 26 HIS NE2 N -6.070 7.831 -0.194 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_6e5k 1
. 6 . 2393 . 1 1 26 HIS O O -8.929 2.069 -0.514 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_6e5k 1
. 6 . 2394 . 1 1 27 CYS C C -12.180 1.828 0.822 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . rr_6e5k 1
. 6 . 2395 . 1 1 27 CYS CA C -10.834 1.356 1.355 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . rr_6e5k 1
. 6 . 2396 . 1 1 27 CYS CB C -11.010 0.666 2.709 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . rr_6e5k 1
. 6 . 2397 . 1 1 27 CYS H H -9.932 3.034 2.267 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . rr_6e5k 1
. 6 . 2398 . 1 1 27 CYS HA H -10.414 0.650 0.655 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . rr_6e5k 1
. 6 . 2399 . 1 1 27 CYS HB2 H -11.444 1.363 3.408 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . rr_6e5k 1
. 6 . 2400 . 1 1 27 CYS HB3 H -11.673 -0.176 2.591 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . rr_6e5k 1
. 6 . 2401 . 1 1 27 CYS N N -9.911 2.474 1.463 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . rr_6e5k 1
. 6 . 2402 . 1 1 27 CYS O O -12.573 1.486 -0.292 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . rr_6e5k 1
. 6 . 2403 . 1 1 27 CYS SG S -9.456 0.049 3.433 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . rr_6e5k 1
. 6 . 2404 . 1 1 28 NH2 HN1 H -12.510 2.853 2.492 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . rr_6e5k 1
. 6 . 2405 . 1 1 28 NH2 HN2 H -13.753 2.942 1.293 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . rr_6e5k 1
. 6 . 2406 . 1 1 28 NH2 N N -12.884 2.619 1.615 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . rr_6e5k 1
. 7 . 2407 . 1 1 1 ASN C C 8.626 -8.294 -3.205 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . rr_6e5k 1
. 7 . 2408 . 1 1 1 ASN CA C 8.125 -9.610 -3.790 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . rr_6e5k 1
. 7 . 2409 . 1 1 1 ASN CB C 7.824 -10.610 -2.666 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . rr_6e5k 1
. 7 . 2410 . 1 1 1 ASN CG C 6.675 -10.167 -1.779 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . rr_6e5k 1
. 7 . 2411 . 1 1 1 ASN H1 H 10.018 -10.359 -4.197 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . rr_6e5k 1
. 7 . 2412 . 1 1 1 ASN H2 H 9.337 -9.491 -5.473 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . rr_6e5k 1
. 7 . 2413 . 1 1 1 ASN H3 H 8.792 -11.054 -5.132 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . rr_6e5k 1
. 7 . 2414 . 1 1 1 ASN HA H 7.220 -9.421 -4.352 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . rr_6e5k 1
. 7 . 2415 . 1 1 1 ASN HB2 H 7.570 -11.566 -3.099 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2416 . 1 1 1 ASN HB3 H 8.706 -10.722 -2.051 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2417 . 1 1 1 ASN HD21 H 7.471 -11.115 -0.225 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . rr_6e5k 1
. 7 . 2418 . 1 1 1 ASN HD22 H 5.979 -10.290 0.077 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . rr_6e5k 1
. 7 . 2419 . 1 1 1 ASN N N 9.139 -10.167 -4.713 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . rr_6e5k 1
. 7 . 2420 . 1 1 1 ASN ND2 N 6.713 -10.563 -0.519 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . rr_6e5k 1
. 7 . 2421 . 1 1 1 ASN O O 9.830 -8.098 -3.045 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . rr_6e5k 1
. 7 . 2422 . 1 1 1 ASN OD1 O 5.756 -9.482 -2.227 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . rr_6e5k 1
. 7 . 2423 . 1 1 2 ASP C C 7.141 -5.720 -1.216 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . rr_6e5k 1
. 7 . 2424 . 1 1 2 ASP CA C 8.059 -6.086 -2.372 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . rr_6e5k 1
. 7 . 2425 . 1 1 2 ASP CB C 7.960 -5.025 -3.475 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . rr_6e5k 1
. 7 . 2426 . 1 1 2 ASP CG C 8.491 -3.673 -3.040 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . rr_6e5k 1
. 7 . 2427 . 1 1 2 ASP H H 6.755 -7.622 -3.007 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . rr_6e5k 1
. 7 . 2428 . 1 1 2 ASP HA H 9.075 -6.130 -2.013 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . rr_6e5k 1
. 7 . 2429 . 1 1 2 ASP HB2 H 8.526 -5.354 -4.333 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2430 . 1 1 2 ASP HB3 H 6.924 -4.910 -3.758 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2431 . 1 1 2 ASP N N 7.703 -7.396 -2.895 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . rr_6e5k 1
. 7 . 2432 . 1 1 2 ASP O O 6.033 -6.257 -1.112 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . rr_6e5k 1
. 7 . 2433 . 1 1 2 ASP OD1 O 7.696 -2.837 -2.561 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . rr_6e5k 1
. 7 . 2434 . 1 1 2 ASP OD2 O 9.708 -3.440 -3.178 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . rr_6e5k 1
. 7 . 2435 . 1 1 3 ABA C C 5.464 -3.824 0.231 . . . 1.0 . . . . . . . . . . . . A . 3 AIB C . . . . . . . . . rr_6e5k 1
. 7 . 2436 . 1 1 3 ABA CA C 6.819 -4.302 0.763 . . . 1.0 . . . . . . . . . . . . A . 3 AIB CA . . . . . . . . . rr_6e5k 1
. 7 . 2437 . 1 1 3 ABA H H 8.532 -4.496 -0.470 . . . 1.0 . . . . . . . . . . . . A . 3 AIB H . . . . . . . . . rr_6e5k 1
. 7 . 2438 . 1 1 3 ABA N N 7.614 -4.820 -0.353 . . . 1.0 . . . . . . . . . . . . A . 3 AIB N . . . . . . . . . rr_6e5k 1
. 7 . 2439 . 1 1 3 ABA O O 4.417 -4.082 0.830 . . . 1.0 . . . . . . . . . . . . A . 3 AIB O . . . . . . . . . rr_6e5k 1
. 7 . 2440 . 1 1 4 CYS C C 3.336 -3.747 -1.900 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . rr_6e5k 1
. 7 . 2441 . 1 1 4 CYS CA C 4.300 -2.625 -1.541 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . rr_6e5k 1
. 7 . 2442 . 1 1 4 CYS CB C 4.660 -1.837 -2.797 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . rr_6e5k 1
. 7 . 2443 . 1 1 4 CYS H H 6.373 -3.002 -1.354 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . rr_6e5k 1
. 7 . 2444 . 1 1 4 CYS HA H 3.819 -1.964 -0.839 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . rr_6e5k 1
. 7 . 2445 . 1 1 4 CYS HB2 H 5.230 -0.966 -2.514 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2446 . 1 1 4 CYS HB3 H 5.262 -2.459 -3.440 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2447 . 1 1 4 CYS N N 5.502 -3.148 -0.912 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . rr_6e5k 1
. 7 . 2448 . 1 1 4 CYS O O 2.134 -3.641 -1.664 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . rr_6e5k 1
. 7 . 2449 . 1 1 4 CYS SG S 3.223 -1.269 -3.760 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . rr_6e5k 1
. 7 . 2450 . 1 1 5 LYS C C 2.387 -6.600 -1.664 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_6e5k 1
. 7 . 2451 . 1 1 5 LYS CA C 3.039 -5.949 -2.875 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_6e5k 1
. 7 . 2452 . 1 1 5 LYS CB C 3.867 -6.980 -3.654 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_6e5k 1
. 7 . 2453 . 1 1 5 LYS CD C 3.892 -9.112 -4.993 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_6e5k 1
. 7 . 2454 . 1 1 5 LYS CE C 3.048 -10.156 -5.707 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_6e5k 1
. 7 . 2455 . 1 1 5 LYS CG C 3.029 -8.089 -4.276 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_6e5k 1
. 7 . 2456 . 1 1 5 LYS H H 4.841 -4.880 -2.570 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_6e5k 1
. 7 . 2457 . 1 1 5 LYS HA H 2.265 -5.559 -3.516 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_6e5k 1
. 7 . 2458 . 1 1 5 LYS HB2 H 4.400 -6.474 -4.445 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2459 . 1 1 5 LYS HB3 H 4.583 -7.433 -2.981 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2460 . 1 1 5 LYS HD2 H 4.504 -8.603 -5.722 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_6e5k 1
. 7 . 2461 . 1 1 5 LYS HD3 H 4.526 -9.605 -4.270 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_6e5k 1
. 7 . 2462 . 1 1 5 LYS HE2 H 2.436 -9.661 -6.445 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_6e5k 1
. 7 . 2463 . 1 1 5 LYS HE3 H 3.707 -10.856 -6.200 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_6e5k 1
. 7 . 2464 . 1 1 5 LYS HG2 H 2.471 -8.588 -3.498 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_6e5k 1
. 7 . 2465 . 1 1 5 LYS HG3 H 2.344 -7.652 -4.987 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_6e5k 1
. 7 . 2466 . 1 1 5 LYS HZ1 H 2.732 -11.370 -4.037 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 7 . 2467 . 1 1 5 LYS HZ2 H 1.624 -11.624 -5.289 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 7 . 2468 . 1 1 5 LYS HZ3 H 1.495 -10.250 -4.314 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 7 . 2469 . 1 1 5 LYS N N 3.869 -4.830 -2.454 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_6e5k 1
. 7 . 2470 . 1 1 5 LYS NZ N 2.164 -10.901 -4.772 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_6e5k 1
. 7 . 2471 . 1 1 5 LYS O O 1.200 -6.926 -1.690 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_6e5k 1
. 7 . 2472 . 1 1 6 ABA C C 1.526 -6.447 1.180 . . . 1.0 . . . . . . . . . . . . A . 6 AIB C . . . . . . . . . rr_6e5k 1
. 7 . 2473 . 1 1 6 ABA CA C 2.679 -7.317 0.662 . . . 1.0 . . . . . . . . . . . . A . 6 AIB CA . . . . . . . . . rr_6e5k 1
. 7 . 2474 . 1 1 6 ABA H H 4.118 -6.489 -0.664 . . . 1.0 . . . . . . . . . . . . A . 6 AIB H . . . . . . . . . rr_6e5k 1
. 7 . 2475 . 1 1 6 ABA N N 3.173 -6.758 -0.599 . . . 1.0 . . . . . . . . . . . . A . 6 AIB N . . . . . . . . . rr_6e5k 1
. 7 . 2476 . 1 1 6 ABA O O 0.491 -6.956 1.620 . . . 1.0 . . . . . . . . . . . . A . 6 AIB O . . . . . . . . . rr_6e5k 1
. 7 . 2477 . 1 1 7 LEU C C -0.553 -4.285 0.716 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . rr_6e5k 1
. 7 . 2478 . 1 1 7 LEU CA C 0.698 -4.193 1.573 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . rr_6e5k 1
. 7 . 2479 . 1 1 7 LEU CB C 1.227 -2.758 1.557 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . rr_6e5k 1
. 7 . 2480 . 1 1 7 LEU CD1 C 2.914 -1.061 2.284 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . rr_6e5k 1
. 7 . 2481 . 1 1 7 LEU CD2 C 2.167 -2.818 3.884 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . rr_6e5k 1
. 7 . 2482 . 1 1 7 LEU CG C 2.459 -2.502 2.426 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . rr_6e5k 1
. 7 . 2483 . 1 1 7 LEU H H 2.553 -4.781 0.733 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . rr_6e5k 1
. 7 . 2484 . 1 1 7 LEU HA H 0.441 -4.461 2.585 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . rr_6e5k 1
. 7 . 2485 . 1 1 7 LEU HB2 H 1.468 -2.500 0.538 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2486 . 1 1 7 LEU HB3 H 0.436 -2.106 1.895 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2487 . 1 1 7 LEU HD11 H 3.181 -0.866 1.256 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . rr_6e5k 1
. 7 . 2488 . 1 1 7 LEU HD12 H 3.771 -0.889 2.917 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . rr_6e5k 1
. 7 . 2489 . 1 1 7 LEU HD13 H 2.110 -0.403 2.579 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . rr_6e5k 1
. 7 . 2490 . 1 1 7 LEU HD21 H 1.927 -3.865 3.986 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . rr_6e5k 1
. 7 . 2491 . 1 1 7 LEU HD22 H 1.333 -2.221 4.219 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . rr_6e5k 1
. 7 . 2492 . 1 1 7 LEU HD23 H 3.037 -2.589 4.482 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . rr_6e5k 1
. 7 . 2493 . 1 1 7 LEU HG H 3.265 -3.141 2.095 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . rr_6e5k 1
. 7 . 2494 . 1 1 7 LEU N N 1.711 -5.130 1.108 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . rr_6e5k 1
. 7 . 2495 . 1 1 7 LEU O O -1.664 -4.265 1.232 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . rr_6e5k 1
. 7 . 2496 . 1 1 8 LYS C C -2.307 -5.761 -1.192 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . rr_6e5k 1
. 7 . 2497 . 1 1 8 LYS CA C -1.498 -4.511 -1.503 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . rr_6e5k 1
. 7 . 2498 . 1 1 8 LYS CB C -1.034 -4.521 -2.963 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . rr_6e5k 1
. 7 . 2499 . 1 1 8 LYS CD C -0.180 -3.224 -4.944 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . rr_6e5k 1
. 7 . 2500 . 1 1 8 LYS CE C 0.254 -1.862 -5.477 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . rr_6e5k 1
. 7 . 2501 . 1 1 8 LYS CG C -0.560 -3.165 -3.473 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . rr_6e5k 1
. 7 . 2502 . 1 1 8 LYS H H 0.545 -4.397 -0.949 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . rr_6e5k 1
. 7 . 2503 . 1 1 8 LYS HA H -2.129 -3.652 -1.344 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . rr_6e5k 1
. 7 . 2504 . 1 1 8 LYS HB2 H -0.219 -5.222 -3.062 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2505 . 1 1 8 LYS HB3 H -1.855 -4.848 -3.586 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2506 . 1 1 8 LYS HD2 H 0.635 -3.922 -5.066 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . rr_6e5k 1
. 7 . 2507 . 1 1 8 LYS HD3 H -1.034 -3.566 -5.511 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . rr_6e5k 1
. 7 . 2508 . 1 1 8 LYS HE2 H 1.082 -1.507 -4.881 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . rr_6e5k 1
. 7 . 2509 . 1 1 8 LYS HE3 H 0.576 -1.979 -6.501 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . rr_6e5k 1
. 7 . 2510 . 1 1 8 LYS HG2 H -1.354 -2.445 -3.346 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . rr_6e5k 1
. 7 . 2511 . 1 1 8 LYS HG3 H 0.301 -2.856 -2.899 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . rr_6e5k 1
. 7 . 2512 . 1 1 8 LYS HZ1 H -0.543 0.025 -5.889 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 7 . 2513 . 1 1 8 LYS HZ2 H -1.093 -0.641 -4.438 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 7 . 2514 . 1 1 8 LYS HZ3 H -1.688 -1.220 -5.912 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 7 . 2515 . 1 1 8 LYS N N -0.369 -4.394 -0.592 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . rr_6e5k 1
. 7 . 2516 . 1 1 8 LYS NZ N -0.843 -0.857 -5.425 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . rr_6e5k 1
. 7 . 2517 . 1 1 8 LYS O O -3.527 -5.699 -1.087 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . rr_6e5k 1
. 7 . 2518 . 1 1 9 ABA C C -2.980 -8.008 0.676 . . . 1.0 . . . . . . . . . . . . A . 9 AIB C . . . . . . . . . rr_6e5k 1
. 7 . 2519 . 1 1 9 ABA CA C -2.246 -8.157 -0.663 . . . 1.0 . . . . . . . . . . . . A . 9 AIB CA . . . . . . . . . rr_6e5k 1
. 7 . 2520 . 1 1 9 ABA H H -0.633 -6.852 -1.123 . . . 1.0 . . . . . . . . . . . . A . 9 AIB H . . . . . . . . . rr_6e5k 1
. 7 . 2521 . 1 1 9 ABA N N -1.609 -6.881 -1.014 . . . 1.0 . . . . . . . . . . . . A . 9 AIB N . . . . . . . . . rr_6e5k 1
. 7 . 2522 . 1 1 9 ABA O O -4.069 -8.555 0.868 . . . 1.0 . . . . . . . . . . . . A . 9 AIB O . . . . . . . . . rr_6e5k 1
. 7 . 2523 . 1 1 10 ARG C C -4.210 -6.199 2.827 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . rr_6e5k 1
. 7 . 2524 . 1 1 10 ARG CA C -2.948 -7.051 2.920 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . rr_6e5k 1
. 7 . 2525 . 1 1 10 ARG CB C -1.926 -6.374 3.841 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . rr_6e5k 1
. 7 . 2526 . 1 1 10 ARG CD C -1.421 -5.402 6.114 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . rr_6e5k 1
. 7 . 2527 . 1 1 10 ARG CG C -2.439 -6.137 5.252 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . rr_6e5k 1
. 7 . 2528 . 1 1 10 ARG CZ C 0.451 -6.240 7.501 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . rr_6e5k 1
. 7 . 2529 . 1 1 10 ARG H H -1.497 -6.861 1.386 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . rr_6e5k 1
. 7 . 2530 . 1 1 10 ARG HA H -3.208 -8.014 3.330 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . rr_6e5k 1
. 7 . 2531 . 1 1 10 ARG HB2 H -1.045 -6.995 3.902 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2532 . 1 1 10 ARG HB3 H -1.654 -5.418 3.416 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2533 . 1 1 10 ARG HD2 H -1.158 -4.476 5.622 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . rr_6e5k 1
. 7 . 2534 . 1 1 10 ARG HD3 H -1.874 -5.181 7.068 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . rr_6e5k 1
. 7 . 2535 . 1 1 10 ARG HE H 0.168 -6.680 5.567 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . rr_6e5k 1
. 7 . 2536 . 1 1 10 ARG HG2 H -3.340 -5.547 5.198 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . rr_6e5k 1
. 7 . 2537 . 1 1 10 ARG HG3 H -2.661 -7.091 5.707 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . rr_6e5k 1
. 7 . 2538 . 1 1 10 ARG HH11 H 0.463 -5.668 9.447 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . rr_6e5k 1
. 7 . 2539 . 1 1 10 ARG HH12 H -0.896 -5.117 8.523 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . rr_6e5k 1
. 7 . 2540 . 1 1 10 ARG HH21 H 2.072 -6.986 8.468 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . rr_6e5k 1
. 7 . 2541 . 1 1 10 ARG HH22 H 1.933 -7.424 6.795 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . rr_6e5k 1
. 7 . 2542 . 1 1 10 ARG N N -2.369 -7.270 1.600 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . rr_6e5k 1
. 7 . 2543 . 1 1 10 ARG NE N -0.200 -6.183 6.336 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . rr_6e5k 1
. 7 . 2544 . 1 1 10 ARG NH1 N -0.031 -5.621 8.575 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . rr_6e5k 1
. 7 . 2545 . 1 1 10 ARG NH2 N 1.575 -6.937 7.595 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . rr_6e5k 1
. 7 . 2546 . 1 1 10 ARG O O -5.210 -6.473 3.489 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . rr_6e5k 1
. 7 . 2547 . 1 1 11 TYR C C -6.082 -4.522 0.607 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . rr_6e5k 1
. 7 . 2548 . 1 1 11 TYR CA C -5.256 -4.234 1.853 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . rr_6e5k 1
. 7 . 2549 . 1 1 11 TYR CB C -4.712 -2.807 1.793 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . rr_6e5k 1
. 7 . 2550 . 1 1 11 TYR CD1 C -4.807 -1.952 4.164 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . rr_6e5k 1
. 7 . 2551 . 1 1 11 TYR CD2 C -2.669 -2.314 3.182 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . rr_6e5k 1
. 7 . 2552 . 1 1 11 TYR CE1 C -4.208 -1.536 5.334 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . rr_6e5k 1
. 7 . 2553 . 1 1 11 TYR CE2 C -2.059 -1.899 4.349 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . rr_6e5k 1
. 7 . 2554 . 1 1 11 TYR CG C -4.050 -2.346 3.070 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . rr_6e5k 1
. 7 . 2555 . 1 1 11 TYR CZ C -2.833 -1.484 5.413 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . rr_6e5k 1
. 7 . 2556 . 1 1 11 TYR H H -3.361 -5.062 1.426 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . rr_6e5k 1
. 7 . 2557 . 1 1 11 TYR HA H -5.888 -4.332 2.723 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . rr_6e5k 1
. 7 . 2558 . 1 1 11 TYR HB2 H -3.979 -2.745 1.003 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2559 . 1 1 11 TYR HB3 H -5.523 -2.132 1.576 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2560 . 1 1 11 TYR HD1 H -5.886 -1.971 4.090 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . rr_6e5k 1
. 7 . 2561 . 1 1 11 TYR HD2 H -2.066 -2.616 2.338 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . rr_6e5k 1
. 7 . 2562 . 1 1 11 TYR HE1 H -4.817 -1.235 6.171 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . rr_6e5k 1
. 7 . 2563 . 1 1 11 TYR HE2 H -0.982 -1.882 4.417 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . rr_6e5k 1
. 7 . 2564 . 1 1 11 TYR HH H -1.420 -0.613 6.375 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . rr_6e5k 1
. 7 . 2565 . 1 1 11 TYR N N -4.161 -5.181 1.985 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . rr_6e5k 1
. 7 . 2566 . 1 1 11 TYR O O -6.519 -3.600 -0.073 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . rr_6e5k 1
. 7 . 2567 . 1 1 11 TYR OH O -2.227 -1.097 6.589 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . rr_6e5k 1
. 7 . 2568 . 1 1 12 ABA C C -8.501 -5.632 -0.796 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . rr_6e5k 1
. 7 . 2569 . 1 1 12 ABA CA C -7.094 -6.247 -0.829 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . rr_6e5k 1
. 7 . 2570 . 1 1 12 ABA H H -5.902 -6.481 0.918 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . rr_6e5k 1
. 7 . 2571 . 1 1 12 ABA N N -6.301 -5.803 0.331 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . rr_6e5k 1
. 7 . 2572 . 1 1 12 ABA O O -9.115 -5.410 -1.840 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . rr_6e5k 1
. 7 . 2573 . 1 1 13 GLY C C -10.333 -3.278 0.367 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_6e5k 1
. 7 . 2574 . 1 1 13 GLY CA C -10.338 -4.786 0.532 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_6e5k 1
. 7 . 2575 . 1 1 13 GLY H H -8.483 -5.567 1.202 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_6e5k 1
. 7 . 2576 . 1 1 13 GLY HA2 H -10.980 -5.216 -0.221 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_6e5k 1
. 7 . 2577 . 1 1 13 GLY HA3 H -10.730 -5.028 1.506 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_6e5k 1
. 7 . 2578 . 1 1 13 GLY N N -9.011 -5.365 0.400 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_6e5k 1
. 7 . 2579 . 1 1 13 GLY O O -11.380 -2.632 0.435 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_6e5k 1
. 7 . 2580 . 1 1 14 CYS C C -8.070 -1.026 -1.205 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_6e5k 1
. 7 . 2581 . 1 1 14 CYS CA C -8.985 -1.293 -0.012 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_6e5k 1
. 7 . 2582 . 1 1 14 CYS CB C -8.373 -0.704 1.263 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_6e5k 1
. 7 . 2583 . 1 1 14 CYS H H -8.363 -3.300 0.085 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_6e5k 1
. 7 . 2584 . 1 1 14 CYS HA H -9.950 -0.847 -0.190 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_6e5k 1
. 7 . 2585 . 1 1 14 CYS HB2 H -7.364 -1.066 1.364 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2586 . 1 1 14 CYS HB3 H -8.353 0.373 1.180 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2587 . 1 1 14 CYS N N -9.155 -2.725 0.149 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_6e5k 1
. 7 . 2588 . 1 1 14 CYS O O -7.701 -1.949 -1.930 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_6e5k 1
. 7 . 2589 . 1 1 14 CYS SG S -9.268 -1.128 2.797 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_6e5k 1
. 7 . 2590 . 1 1 15 GLU C C -5.529 1.188 -1.825 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_6e5k 1
. 7 . 2591 . 1 1 15 GLU CA C -6.772 0.582 -2.461 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_6e5k 1
. 7 . 2592 . 1 1 15 GLU CB C -7.391 1.569 -3.449 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_6e5k 1
. 7 . 2593 . 1 1 15 GLU CD C -9.105 1.987 -5.241 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_6e5k 1
. 7 . 2594 . 1 1 15 GLU CG C -8.547 0.994 -4.248 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_6e5k 1
. 7 . 2595 . 1 1 15 GLU H H -8.120 0.939 -0.875 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_6e5k 1
. 7 . 2596 . 1 1 15 GLU HA H -6.495 -0.322 -2.982 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_6e5k 1
. 7 . 2597 . 1 1 15 GLU HB2 H -7.752 2.427 -2.902 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2598 . 1 1 15 GLU HB3 H -6.628 1.890 -4.142 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2599 . 1 1 15 GLU HG2 H -8.202 0.125 -4.786 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_6e5k 1
. 7 . 2600 . 1 1 15 GLU HG3 H -9.332 0.707 -3.566 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_6e5k 1
. 7 . 2601 . 1 1 15 GLU N N -7.725 0.227 -1.424 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_6e5k 1
. 7 . 2602 . 1 1 15 GLU O O -5.642 2.100 -1.012 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_6e5k 1
. 7 . 2603 . 1 1 15 GLU OE1 O -10.079 2.691 -4.902 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_6e5k 1
. 7 . 2604 . 1 1 15 GLU OE2 O -8.579 2.063 -6.372 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_6e5k 1
. 7 . 2605 . 1 1 16 MVA C C -1.976 1.505 -2.513 . . . 1.0 . . . . . . . . . . . . A . 16 MVA C . . . . . . . . . rr_6e5k 1
. 7 . 2606 . 1 1 16 MVA CA C -3.108 1.216 -1.526 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CA . . . . . . . . . rr_6e5k 1
. 7 . 2607 . 1 1 16 MVA CB C -2.596 0.272 -0.392 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CB . . . . . . . . . rr_6e5k 1
. 7 . 2608 . 1 1 16 MVA CG1 C -2.273 -1.125 -0.888 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG1 . . . . . . . . . rr_6e5k 1
. 7 . 2609 . 1 1 16 MVA CG2 C -1.378 0.874 0.291 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG2 . . . . . . . . . rr_6e5k 1
. 7 . 2610 . 1 1 16 MVA CN C -4.240 -0.285 -3.274 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CN . . . . . . . . . rr_6e5k 1
. 7 . 2611 . 1 1 16 MVA HA H -3.343 2.160 -1.050 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HA . . . . . . . . . rr_6e5k 1
. 7 . 2612 . 1 1 16 MVA HB H -3.378 0.185 0.347 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HB . . . . . . . . . rr_6e5k 1
. 7 . 2613 . 1 1 16 MVA HG11 H -3.169 -1.585 -1.275 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG11 . . . . . . . . . rr_6e5k 1
. 7 . 2614 . 1 1 16 MVA HG12 H -1.886 -1.714 -0.071 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG12 . . . . . . . . . rr_6e5k 1
. 7 . 2615 . 1 1 16 MVA HG13 H -1.531 -1.063 -1.671 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG13 . . . . . . . . . rr_6e5k 1
. 7 . 2616 . 1 1 16 MVA HG21 H -1.051 0.220 1.087 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG21 . . . . . . . . . rr_6e5k 1
. 7 . 2617 . 1 1 16 MVA HG22 H -1.634 1.840 0.700 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG22 . . . . . . . . . rr_6e5k 1
. 7 . 2618 . 1 1 16 MVA HG23 H -0.582 0.988 -0.431 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG23 . . . . . . . . . rr_6e5k 1
. 7 . 2619 . 1 1 16 MVA HN1 H -4.664 -1.222 -2.945 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN1 . . . . . . . . . rr_6e5k 1
. 7 . 2620 . 1 1 16 MVA HN2 H -3.203 -0.433 -3.541 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN2 . . . . . . . . . rr_6e5k 1
. 7 . 2621 . 1 1 16 MVA HN3 H -4.784 0.072 -4.135 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN3 . . . . . . . . . rr_6e5k 1
. 7 . 2622 . 1 1 16 MVA N N -4.329 0.711 -2.183 . . . 1.0 . . . . . . . . . . . . A . 16 MVA N . . . . . . . . . rr_6e5k 1
. 7 . 2623 . 1 1 16 MVA O O -1.415 0.611 -3.156 . . . 1.0 . . . . . . . . . . . . A . 16 MVA O . . . . . . . . . rr_6e5k 1
. 7 . 2624 . 1 1 17 ARG C C 0.726 3.228 -2.656 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_6e5k 1
. 7 . 2625 . 1 1 17 ARG CA C -0.555 3.231 -3.460 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_6e5k 1
. 7 . 2626 . 1 1 17 ARG CB C -0.834 4.633 -3.989 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_6e5k 1
. 7 . 2627 . 1 1 17 ARG CD C -2.309 6.132 -5.359 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_6e5k 1
. 7 . 2628 . 1 1 17 ARG CG C -1.989 4.697 -4.971 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_6e5k 1
. 7 . 2629 . 1 1 17 ARG CZ C -1.188 8.096 -6.339 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_6e5k 1
. 7 . 2630 . 1 1 17 ARG H H -2.128 3.440 -2.067 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_6e5k 1
. 7 . 2631 . 1 1 17 ARG HA H -0.459 2.544 -4.286 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_6e5k 1
. 7 . 2632 . 1 1 17 ARG HB2 H -1.063 5.278 -3.154 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2633 . 1 1 17 ARG HB3 H 0.051 5.001 -4.483 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2634 . 1 1 17 ARG HD2 H -3.109 6.127 -6.084 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_6e5k 1
. 7 . 2635 . 1 1 17 ARG HD3 H -2.632 6.664 -4.476 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_6e5k 1
. 7 . 2636 . 1 1 17 ARG HE H -0.315 6.326 -6.016 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_6e5k 1
. 7 . 2637 . 1 1 17 ARG HG2 H -1.726 4.140 -5.859 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_6e5k 1
. 7 . 2638 . 1 1 17 ARG HG3 H -2.861 4.253 -4.512 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_6e5k 1
. 7 . 2639 . 1 1 17 ARG HH11 H -2.329 9.761 -6.539 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_6e5k 1
. 7 . 2640 . 1 1 17 ARG HH12 H -3.132 8.391 -5.837 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_6e5k 1
. 7 . 2641 . 1 1 17 ARG HH21 H 0.753 8.129 -6.925 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_6e5k 1
. 7 . 2642 . 1 1 17 ARG HH22 H -0.119 9.615 -7.147 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_6e5k 1
. 7 . 2643 . 1 1 17 ARG N N -1.643 2.780 -2.613 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_6e5k 1
. 7 . 2644 . 1 1 17 ARG NE N -1.157 6.829 -5.934 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_6e5k 1
. 7 . 2645 . 1 1 17 ARG NH1 N -2.307 8.805 -6.231 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_6e5k 1
. 7 . 2646 . 1 1 17 ARG NH2 N -0.098 8.658 -6.846 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_6e5k 1
. 7 . 2647 . 1 1 17 ARG O O 0.696 3.432 -1.448 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_6e5k 1
. 7 . 2648 . 1 1 18 CYS C C 4.170 3.789 -3.243 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . rr_6e5k 1
. 7 . 2649 . 1 1 18 CYS CA C 3.103 2.920 -2.598 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . rr_6e5k 1
. 7 . 2650 . 1 1 18 CYS CB C 3.575 1.471 -2.539 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . rr_6e5k 1
. 7 . 2651 . 1 1 18 CYS H H 1.822 2.866 -4.278 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . rr_6e5k 1
. 7 . 2652 . 1 1 18 CYS HA H 2.933 3.268 -1.591 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . rr_6e5k 1
. 7 . 2653 . 1 1 18 CYS HB2 H 4.560 1.436 -2.097 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2654 . 1 1 18 CYS HB3 H 2.890 0.902 -1.928 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2655 . 1 1 18 CYS N N 1.842 2.997 -3.306 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . rr_6e5k 1
. 7 . 2656 . 1 1 18 CYS O O 4.300 3.836 -4.470 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . rr_6e5k 1
. 7 . 2657 . 1 1 18 CYS SG S 3.668 0.664 -4.168 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . rr_6e5k 1
. 7 . 2658 . 1 1 19 ASP C C 7.280 4.771 -2.032 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . rr_6e5k 1
. 7 . 2659 . 1 1 19 ASP CA C 6.076 5.236 -2.838 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . rr_6e5k 1
. 7 . 2660 . 1 1 19 ASP CB C 5.861 6.739 -2.652 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . rr_6e5k 1
. 7 . 2661 . 1 1 19 ASP CG C 6.911 7.560 -3.376 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . rr_6e5k 1
. 7 . 2662 . 1 1 19 ASP H H 4.695 4.466 -1.448 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . rr_6e5k 1
. 7 . 2663 . 1 1 19 ASP HA H 6.242 5.022 -3.882 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . rr_6e5k 1
. 7 . 2664 . 1 1 19 ASP HB2 H 4.889 7.009 -3.034 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2665 . 1 1 19 ASP HB3 H 5.909 6.974 -1.599 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2666 . 1 1 19 ASP N N 4.919 4.480 -2.404 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . rr_6e5k 1
. 7 . 2667 . 1 1 19 ASP O O 7.520 5.255 -0.920 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . rr_6e5k 1
. 7 . 2668 . 1 1 19 ASP OD1 O 7.863 8.024 -2.714 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . rr_6e5k 1
. 7 . 2669 . 1 1 19 ASP OD2 O 6.794 7.752 -4.607 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . rr_6e5k 1
. 7 . 2670 . 1 1 20 DPR C C 8.605 2.467 -0.562 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . rr_6e5k 1
. 7 . 2671 . 1 1 20 DPR CA C 9.124 3.160 -1.823 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . rr_6e5k 1
. 7 . 2672 . 1 1 20 DPR CB C 9.685 2.132 -2.805 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . rr_6e5k 1
. 7 . 2673 . 1 1 20 DPR CD C 7.897 3.250 -3.919 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . rr_6e5k 1
. 7 . 2674 . 1 1 20 DPR CG C 9.218 2.581 -4.146 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . rr_6e5k 1
. 7 . 2675 . 1 1 20 DPR HA H 9.897 3.864 -1.561 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . rr_6e5k 1
. 7 . 2676 . 1 1 20 DPR HB2 H 10.763 2.124 -2.741 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2677 . 1 1 20 DPR HB3 H 9.300 1.155 -2.562 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2678 . 1 1 20 DPR HD2 H 7.746 4.037 -4.641 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . rr_6e5k 1
. 7 . 2679 . 1 1 20 DPR HD3 H 7.093 2.532 -3.964 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . rr_6e5k 1
. 7 . 2680 . 1 1 20 DPR HG2 H 9.925 3.281 -4.568 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . rr_6e5k 1
. 7 . 2681 . 1 1 20 DPR HG3 H 9.100 1.729 -4.798 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . rr_6e5k 1
. 7 . 2682 . 1 1 20 DPR N N 8.035 3.800 -2.562 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . rr_6e5k 1
. 7 . 2683 . 1 1 20 DPR O O 7.794 1.542 -0.643 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . rr_6e5k 1
. 7 . 2684 . 1 1 21 PRO C C 7.282 2.959 2.364 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . rr_6e5k 1
. 7 . 2685 . 1 1 21 PRO CA C 8.609 2.357 1.895 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . rr_6e5k 1
. 7 . 2686 . 1 1 21 PRO CB C 9.733 2.750 2.849 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . rr_6e5k 1
. 7 . 2687 . 1 1 21 PRO CD C 10.103 3.936 0.799 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . rr_6e5k 1
. 7 . 2688 . 1 1 21 PRO CG C 10.254 4.030 2.296 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . rr_6e5k 1
. 7 . 2689 . 1 1 21 PRO HA H 8.523 1.282 1.860 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . rr_6e5k 1
. 7 . 2690 . 1 1 21 PRO HB2 H 9.335 2.878 3.844 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2691 . 1 1 21 PRO HB3 H 10.492 1.984 2.853 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2692 . 1 1 21 PRO HD2 H 9.781 4.881 0.394 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . rr_6e5k 1
. 7 . 2693 . 1 1 21 PRO HD3 H 11.034 3.628 0.345 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . rr_6e5k 1
. 7 . 2694 . 1 1 21 PRO HG2 H 9.672 4.854 2.678 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . rr_6e5k 1
. 7 . 2695 . 1 1 21 PRO HG3 H 11.293 4.149 2.561 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . rr_6e5k 1
. 7 . 2696 . 1 1 21 PRO N N 9.066 2.904 0.616 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . rr_6e5k 1
. 7 . 2697 . 1 1 21 PRO O O 6.676 2.473 3.320 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . rr_6e5k 1
. 7 . 2698 . 1 1 22 ARG C C 4.421 4.232 1.297 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . rr_6e5k 1
. 7 . 2699 . 1 1 22 ARG CA C 5.625 4.720 2.085 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . rr_6e5k 1
. 7 . 2700 . 1 1 22 ARG CB C 5.808 6.222 1.875 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . rr_6e5k 1
. 7 . 2701 . 1 1 22 ARG CD C 7.123 8.293 2.415 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . rr_6e5k 1
. 7 . 2702 . 1 1 22 ARG CG C 6.890 6.829 2.751 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . rr_6e5k 1
. 7 . 2703 . 1 1 22 ARG CZ C 5.874 10.418 2.398 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . rr_6e5k 1
. 7 . 2704 . 1 1 22 ARG H H 7.308 4.292 0.870 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . rr_6e5k 1
. 7 . 2705 . 1 1 22 ARG HA H 5.458 4.526 3.134 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . rr_6e5k 1
. 7 . 2706 . 1 1 22 ARG HB2 H 6.068 6.401 0.843 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2707 . 1 1 22 ARG HB3 H 4.876 6.721 2.094 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2708 . 1 1 22 ARG HD2 H 7.887 8.683 3.072 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . rr_6e5k 1
. 7 . 2709 . 1 1 22 ARG HD3 H 7.463 8.364 1.392 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . rr_6e5k 1
. 7 . 2710 . 1 1 22 ARG HE H 5.083 8.628 2.815 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . rr_6e5k 1
. 7 . 2711 . 1 1 22 ARG HG2 H 6.590 6.749 3.785 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . rr_6e5k 1
. 7 . 2712 . 1 1 22 ARG HG3 H 7.809 6.282 2.597 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . rr_6e5k 1
. 7 . 2713 . 1 1 22 ARG HH11 H 7.844 10.598 1.953 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . rr_6e5k 1
. 7 . 2714 . 1 1 22 ARG HH12 H 6.945 12.080 1.948 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . rr_6e5k 1
. 7 . 2715 . 1 1 22 ARG HH21 H 4.697 12.065 2.429 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . rr_6e5k 1
. 7 . 2716 . 1 1 22 ARG HH22 H 3.898 10.572 2.809 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . rr_6e5k 1
. 7 . 2717 . 1 1 22 ARG N N 6.830 4.005 1.681 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . rr_6e5k 1
. 7 . 2718 . 1 1 22 ARG NE N 5.914 9.099 2.569 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . rr_6e5k 1
. 7 . 2719 . 1 1 22 ARG NH1 N 6.975 11.086 2.073 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . rr_6e5k 1
. 7 . 2720 . 1 1 22 ARG NH2 N 4.735 11.070 2.557 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . rr_6e5k 1
. 7 . 2721 . 1 1 22 ARG O O 4.571 3.658 0.219 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . rr_6e5k 1
. 7 . 2722 . 1 1 23 TYR C C 0.816 4.878 1.603 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . rr_6e5k 1
. 7 . 2723 . 1 1 23 TYR CA C 2.012 4.041 1.167 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . rr_6e5k 1
. 7 . 2724 . 1 1 23 TYR CB C 1.737 2.561 1.443 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . rr_6e5k 1
. 7 . 2725 . 1 1 23 TYR CD1 C 0.178 2.074 3.364 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . rr_6e5k 1
. 7 . 2726 . 1 1 23 TYR CD2 C 2.517 2.112 3.805 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . rr_6e5k 1
. 7 . 2727 . 1 1 23 TYR CE1 C -0.072 1.787 4.690 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . rr_6e5k 1
. 7 . 2728 . 1 1 23 TYR CE2 C 2.277 1.824 5.134 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . rr_6e5k 1
. 7 . 2729 . 1 1 23 TYR CG C 1.473 2.241 2.899 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . rr_6e5k 1
. 7 . 2730 . 1 1 23 TYR CZ C 0.995 1.643 5.569 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . rr_6e5k 1
. 7 . 2731 . 1 1 23 TYR H H 3.171 4.917 2.700 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . rr_6e5k 1
. 7 . 2732 . 1 1 23 TYR HA H 2.154 4.173 0.106 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . rr_6e5k 1
. 7 . 2733 . 1 1 23 TYR HB2 H 0.874 2.253 0.876 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2734 . 1 1 23 TYR HB3 H 2.590 1.984 1.125 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2735 . 1 1 23 TYR HD1 H -0.645 2.170 2.671 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . rr_6e5k 1
. 7 . 2736 . 1 1 23 TYR HD2 H 3.533 2.238 3.458 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . rr_6e5k 1
. 7 . 2737 . 1 1 23 TYR HE1 H -1.088 1.659 5.031 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . rr_6e5k 1
. 7 . 2738 . 1 1 23 TYR HE2 H 3.102 1.727 5.823 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . rr_6e5k 1
. 7 . 2739 . 1 1 23 TYR HH H 1.263 1.967 7.451 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . rr_6e5k 1
. 7 . 2740 . 1 1 23 TYR N N 3.231 4.462 1.833 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . rr_6e5k 1
. 7 . 2741 . 1 1 23 TYR O O 0.813 5.472 2.682 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . rr_6e5k 1
. 7 . 2742 . 1 1 23 TYR OH O 0.735 1.381 6.896 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . rr_6e5k 1
. 7 . 2743 . 1 1 24 GLU C C -2.580 4.557 0.813 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . rr_6e5k 1
. 7 . 2744 . 1 1 24 GLU CA C -1.457 5.558 1.045 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . rr_6e5k 1
. 7 . 2745 . 1 1 24 GLU CB C -1.672 6.789 0.162 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . rr_6e5k 1
. 7 . 2746 . 1 1 24 GLU CD C -0.926 9.117 -0.461 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . rr_6e5k 1
. 7 . 2747 . 1 1 24 GLU CG C -0.675 7.906 0.414 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . rr_6e5k 1
. 7 . 2748 . 1 1 24 GLU H H -0.077 4.483 -0.130 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . rr_6e5k 1
. 7 . 2749 . 1 1 24 GLU HA H -1.449 5.851 2.081 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . rr_6e5k 1
. 7 . 2750 . 1 1 24 GLU HB2 H -1.594 6.492 -0.873 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2751 . 1 1 24 GLU HB3 H -2.664 7.174 0.340 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2752 . 1 1 24 GLU HG2 H -0.744 8.207 1.448 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . rr_6e5k 1
. 7 . 2753 . 1 1 24 GLU HG3 H 0.319 7.534 0.212 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . rr_6e5k 1
. 7 . 2754 . 1 1 24 GLU N N -0.189 4.916 0.744 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . rr_6e5k 1
. 7 . 2755 . 1 1 24 GLU O O -2.654 3.950 -0.256 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . rr_6e5k 1
. 7 . 2756 . 1 1 24 GLU OE1 O -1.732 9.988 -0.065 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . rr_6e5k 1
. 7 . 2757 . 1 1 24 GLU OE2 O -0.317 9.207 -1.547 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . rr_6e5k 1
. 7 . 2758 . 1 1 25 MVA C C -5.930 3.872 1.886 . . . 1.0 . . . . . . . . . . . . A . 25 MVA C . . . . . . . . . rr_6e5k 1
. 7 . 2759 . 1 1 25 MVA CA C -4.519 3.335 1.640 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CA . . . . . . . . . rr_6e5k 1
. 7 . 2760 . 1 1 25 MVA CB C -4.263 2.071 2.520 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CB . . . . . . . . . rr_6e5k 1
. 7 . 2761 . 1 1 25 MVA CG1 C -4.204 2.377 4.011 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG1 . . . . . . . . . rr_6e5k 1
. 7 . 2762 . 1 1 25 MVA CG2 C -5.324 1.017 2.245 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG2 . . . . . . . . . rr_6e5k 1
. 7 . 2763 . 1 1 25 MVA CN C -3.451 5.254 2.975 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CN . . . . . . . . . rr_6e5k 1
. 7 . 2764 . 1 1 25 MVA HA H -4.506 2.993 0.613 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HA . . . . . . . . . rr_6e5k 1
. 7 . 2765 . 1 1 25 MVA HB H -3.308 1.655 2.234 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HB . . . . . . . . . rr_6e5k 1
. 7 . 2766 . 1 1 25 MVA HG11 H -3.353 3.008 4.214 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG11 . . . . . . . . . rr_6e5k 1
. 7 . 2767 . 1 1 25 MVA HG12 H -4.110 1.454 4.565 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG12 . . . . . . . . . rr_6e5k 1
. 7 . 2768 . 1 1 25 MVA HG13 H -5.109 2.885 4.308 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG13 . . . . . . . . . rr_6e5k 1
. 7 . 2769 . 1 1 25 MVA HG21 H -5.140 0.151 2.862 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG21 . . . . . . . . . rr_6e5k 1
. 7 . 2770 . 1 1 25 MVA HG22 H -5.289 0.732 1.205 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG22 . . . . . . . . . rr_6e5k 1
. 7 . 2771 . 1 1 25 MVA HG23 H -6.300 1.422 2.474 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG23 . . . . . . . . . rr_6e5k 1
. 7 . 2772 . 1 1 25 MVA HN1 H -2.604 5.000 3.594 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN1 . . . . . . . . . rr_6e5k 1
. 7 . 2773 . 1 1 25 MVA HN2 H -4.362 5.125 3.540 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN2 . . . . . . . . . rr_6e5k 1
. 7 . 2774 . 1 1 25 MVA HN3 H -3.368 6.281 2.657 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN3 . . . . . . . . . rr_6e5k 1
. 7 . 2775 . 1 1 25 MVA N N -3.480 4.370 1.788 . . . 1.0 . . . . . . . . . . . . A . 25 MVA N . . . . . . . . . rr_6e5k 1
. 7 . 2776 . 1 1 25 MVA O O -6.282 4.321 2.978 . . . 1.0 . . . . . . . . . . . . A . 25 MVA O . . . . . . . . . rr_6e5k 1
. 7 . 2777 . 1 1 26 HIS C C -9.052 3.092 0.948 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_6e5k 1
. 7 . 2778 . 1 1 26 HIS CA C -8.105 4.278 0.882 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_6e5k 1
. 7 . 2779 . 1 1 26 HIS CB C -8.423 5.114 -0.357 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_6e5k 1
. 7 . 2780 . 1 1 26 HIS CD2 C -6.339 6.565 -0.875 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_6e5k 1
. 7 . 2781 . 1 1 26 HIS CE1 C -7.188 8.525 -0.398 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_6e5k 1
. 7 . 2782 . 1 1 26 HIS CG C -7.616 6.369 -0.476 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_6e5k 1
. 7 . 2783 . 1 1 26 HIS H H -6.398 3.407 0.009 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_6e5k 1
. 7 . 2784 . 1 1 26 HIS HA H -8.229 4.882 1.765 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_6e5k 1
. 7 . 2785 . 1 1 26 HIS HB2 H -8.238 4.519 -1.237 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2786 . 1 1 26 HIS HB3 H -9.464 5.390 -0.331 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2787 . 1 1 26 HIS HD1 H -9.027 7.807 0.144 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_6e5k 1
. 7 . 2788 . 1 1 26 HIS HD2 H -5.636 5.800 -1.177 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_6e5k 1
. 7 . 2789 . 1 1 26 HIS HE1 H -7.298 9.590 -0.253 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_6e5k 1
. 7 . 2790 . 1 1 26 HIS HE2 H -5.221 8.343 -0.945 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_6e5k 1
. 7 . 2791 . 1 1 26 HIS N N -6.735 3.809 0.839 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_6e5k 1
. 7 . 2792 . 1 1 26 HIS ND1 N -8.120 7.617 -0.183 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_6e5k 1
. 7 . 2793 . 1 1 26 HIS NE2 N -6.099 7.913 -0.818 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_6e5k 1
. 7 . 2794 . 1 1 26 HIS O O -9.022 2.220 0.083 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_6e5k 1
. 7 . 2795 . 1 1 27 CYS C C -12.241 2.466 1.842 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . rr_6e5k 1
. 7 . 2796 . 1 1 27 CYS CA C -10.831 1.979 2.140 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . rr_6e5k 1
. 7 . 2797 . 1 1 27 CYS CB C -10.747 1.411 3.554 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . rr_6e5k 1
. 7 . 2798 . 1 1 27 CYS H H -9.851 3.778 2.635 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . rr_6e5k 1
. 7 . 2799 . 1 1 27 CYS HA H -10.576 1.203 1.436 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . rr_6e5k 1
. 7 . 2800 . 1 1 27 CYS HB2 H -10.858 2.217 4.262 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . rr_6e5k 1
. 7 . 2801 . 1 1 27 CYS HB3 H -11.546 0.701 3.696 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . rr_6e5k 1
. 7 . 2802 . 1 1 27 CYS N N -9.876 3.057 1.973 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . rr_6e5k 1
. 7 . 2803 . 1 1 27 CYS O O -12.943 2.962 2.722 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . rr_6e5k 1
. 7 . 2804 . 1 1 27 CYS SG S -9.173 0.565 3.914 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . rr_6e5k 1
. 7 . 2805 . 1 1 28 NH2 HN1 H -12.034 1.930 -0.056 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . rr_6e5k 1
. 7 . 2806 . 1 1 28 NH2 HN2 H -13.547 2.647 0.365 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . rr_6e5k 1
. 7 . 2807 . 1 1 28 NH2 N N -12.649 2.335 0.594 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . rr_6e5k 1
. 8 . 2808 . 1 1 1 ASN C C 8.497 -9.318 -2.545 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . rr_6e5k 1
. 8 . 2809 . 1 1 1 ASN CA C 8.134 -10.777 -2.314 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . rr_6e5k 1
. 8 . 2810 . 1 1 1 ASN CB C 8.526 -11.195 -0.893 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . rr_6e5k 1
. 8 . 2811 . 1 1 1 ASN CG C 7.969 -12.552 -0.512 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . rr_6e5k 1
. 8 . 2812 . 1 1 1 ASN H1 H 9.846 -11.531 -3.221 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . rr_6e5k 1
. 8 . 2813 . 1 1 1 ASN H2 H 8.535 -11.356 -4.269 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . rr_6e5k 1
. 8 . 2814 . 1 1 1 ASN H3 H 8.562 -12.631 -3.160 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . rr_6e5k 1
. 8 . 2815 . 1 1 1 ASN HA H 7.068 -10.897 -2.441 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . rr_6e5k 1
. 8 . 2816 . 1 1 1 ASN HB2 H 9.602 -11.240 -0.823 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . rr_6e5k 1
. 8 . 2817 . 1 1 1 ASN HB3 H 8.156 -10.462 -0.191 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . rr_6e5k 1
. 8 . 2818 . 1 1 1 ASN HD21 H 7.805 -11.976 1.382 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . rr_6e5k 1
. 8 . 2819 . 1 1 1 ASN HD22 H 7.283 -13.589 1.035 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . rr_6e5k 1
. 8 . 2820 . 1 1 1 ASN N N 8.817 -11.632 -3.309 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . rr_6e5k 1
. 8 . 2821 . 1 1 1 ASN ND2 N 7.658 -12.725 0.762 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . rr_6e5k 1
. 8 . 2822 . 1 1 1 ASN O O 9.556 -9.020 -3.095 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . rr_6e5k 1
. 8 . 2823 . 1 1 1 ASN OD1 O 7.811 -13.434 -1.358 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . rr_6e5k 1
. 8 . 2824 . 1 1 2 ASP C C 7.046 -6.215 -1.271 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . rr_6e5k 1
. 8 . 2825 . 1 1 2 ASP CA C 7.848 -6.988 -2.305 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . rr_6e5k 1
. 8 . 2826 . 1 1 2 ASP CB C 7.451 -6.543 -3.716 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . rr_6e5k 1
. 8 . 2827 . 1 1 2 ASP CG C 7.770 -5.086 -3.979 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . rr_6e5k 1
. 8 . 2828 . 1 1 2 ASP H H 6.788 -8.713 -1.700 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . rr_6e5k 1
. 8 . 2829 . 1 1 2 ASP HA H 8.899 -6.796 -2.152 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . rr_6e5k 1
. 8 . 2830 . 1 1 2 ASP HB2 H 7.980 -7.143 -4.439 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . rr_6e5k 1
. 8 . 2831 . 1 1 2 ASP HB3 H 6.390 -6.688 -3.844 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . rr_6e5k 1
. 8 . 2832 . 1 1 2 ASP N N 7.617 -8.416 -2.138 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . rr_6e5k 1
. 8 . 2833 . 1 1 2 ASP O O 5.937 -6.620 -0.929 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . rr_6e5k 1
. 8 . 2834 . 1 1 2 ASP OD1 O 6.865 -4.240 -3.826 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . rr_6e5k 1
. 8 . 2835 . 1 1 2 ASP OD2 O 8.927 -4.780 -4.337 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . rr_6e5k 1
. 8 . 2836 . 1 1 3 ABA C C 5.558 -3.875 -0.231 . . . 1.0 . . . . . . . . . . . . A . 3 AIB C . . . . . . . . . rr_6e5k 1
. 8 . 2837 . 1 1 3 ABA CA C 6.961 -4.279 0.244 . . . 1.0 . . . . . . . . . . . . A . 3 AIB CA . . . . . . . . . rr_6e5k 1
. 8 . 2838 . 1 1 3 ABA H H 8.501 -4.857 -1.099 . . . 1.0 . . . . . . . . . . . . A . 3 AIB H . . . . . . . . . rr_6e5k 1
. 8 . 2839 . 1 1 3 ABA N N 7.614 -5.116 -0.774 . . . 1.0 . . . . . . . . . . . . A . 3 AIB N . . . . . . . . . rr_6e5k 1
. 8 . 2840 . 1 1 3 ABA O O 4.567 -4.007 0.498 . . . 1.0 . . . . . . . . . . . . A . 3 AIB O . . . . . . . . . rr_6e5k 1
. 8 . 2841 . 1 1 4 CYS C C 3.266 -4.095 -2.241 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . rr_6e5k 1
. 8 . 2842 . 1 1 4 CYS CA C 4.225 -2.935 -2.025 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . rr_6e5k 1
. 8 . 2843 . 1 1 4 CYS CB C 4.463 -2.200 -3.341 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . rr_6e5k 1
. 8 . 2844 . 1 1 4 CYS H H 6.290 -3.389 -2.027 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . rr_6e5k 1
. 8 . 2845 . 1 1 4 CYS HA H 3.787 -2.252 -1.317 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . rr_6e5k 1
. 8 . 2846 . 1 1 4 CYS HB2 H 5.139 -1.379 -3.166 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . rr_6e5k 1
. 8 . 2847 . 1 1 4 CYS HB3 H 4.907 -2.881 -4.049 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . rr_6e5k 1
. 8 . 2848 . 1 1 4 CYS N N 5.481 -3.406 -1.468 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . rr_6e5k 1
. 8 . 2849 . 1 1 4 CYS O O 2.056 -3.942 -2.099 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . rr_6e5k 1
. 8 . 2850 . 1 1 4 CYS SG S 2.953 -1.516 -4.099 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . rr_6e5k 1
. 8 . 2851 . 1 1 5 LYS C C 2.386 -6.893 -1.455 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_6e5k 1
. 8 . 2852 . 1 1 5 LYS CA C 2.995 -6.443 -2.776 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_6e5k 1
. 8 . 2853 . 1 1 5 LYS CB C 3.819 -7.575 -3.392 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_6e5k 1
. 8 . 2854 . 1 1 5 LYS CD C 3.858 -9.914 -4.314 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_6e5k 1
. 8 . 2855 . 1 1 5 LYS CE C 3.020 -11.074 -4.829 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_6e5k 1
. 8 . 2856 . 1 1 5 LYS CG C 2.987 -8.788 -3.788 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_6e5k 1
. 8 . 2857 . 1 1 5 LYS H H 4.787 -5.320 -2.666 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_6e5k 1
. 8 . 2858 . 1 1 5 LYS HA H 2.197 -6.175 -3.451 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_6e5k 1
. 8 . 2859 . 1 1 5 LYS HB2 H 4.319 -7.203 -4.274 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_6e5k 1
. 8 . 2860 . 1 1 5 LYS HB3 H 4.562 -7.894 -2.676 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_6e5k 1
. 8 . 2861 . 1 1 5 LYS HD2 H 4.468 -9.536 -5.121 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_6e5k 1
. 8 . 2862 . 1 1 5 LYS HD3 H 4.494 -10.266 -3.515 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_6e5k 1
. 8 . 2863 . 1 1 5 LYS HE2 H 2.400 -10.720 -5.640 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_6e5k 1
. 8 . 2864 . 1 1 5 LYS HE3 H 3.683 -11.843 -5.192 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_6e5k 1
. 8 . 2865 . 1 1 5 LYS HG2 H 2.445 -9.142 -2.923 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_6e5k 1
. 8 . 2866 . 1 1 5 LYS HG3 H 2.286 -8.497 -4.559 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_6e5k 1
. 8 . 2867 . 1 1 5 LYS HZ1 H 2.719 -11.967 -2.965 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 8 . 2868 . 1 1 5 LYS HZ2 H 1.617 -12.460 -4.146 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 8 . 2869 . 1 1 5 LYS HZ3 H 1.468 -10.932 -3.439 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 8 . 2870 . 1 1 5 LYS N N 3.813 -5.259 -2.568 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_6e5k 1
. 8 . 2871 . 1 1 5 LYS NZ N 2.145 -11.647 -3.772 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_6e5k 1
. 8 . 2872 . 1 1 5 LYS O O 1.219 -7.272 -1.404 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_6e5k 1
. 8 . 2873 . 1 1 6 ABA C C 1.563 -6.248 1.323 . . . 1.0 . . . . . . . . . . . . A . 6 AIB C . . . . . . . . . rr_6e5k 1
. 8 . 2874 . 1 1 6 ABA CA C 2.737 -7.159 0.961 . . . 1.0 . . . . . . . . . . . . A . 6 AIB CA . . . . . . . . . rr_6e5k 1
. 8 . 2875 . 1 1 6 ABA H H 4.124 -6.557 -0.523 . . . 1.0 . . . . . . . . . . . . A . 6 AIB H . . . . . . . . . rr_6e5k 1
. 8 . 2876 . 1 1 6 ABA N N 3.190 -6.831 -0.393 . . . 1.0 . . . . . . . . . . . . A . 6 AIB N . . . . . . . . . rr_6e5k 1
. 8 . 2877 . 1 1 6 ABA O O 0.525 -6.709 1.798 . . . 1.0 . . . . . . . . . . . . A . 6 AIB O . . . . . . . . . rr_6e5k 1
. 8 . 2878 . 1 1 7 LEU C C -0.545 -4.233 0.525 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . rr_6e5k 1
. 8 . 2879 . 1 1 7 LEU CA C 0.689 -3.979 1.379 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . rr_6e5k 1
. 8 . 2880 . 1 1 7 LEU CB C 1.190 -2.553 1.143 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . rr_6e5k 1
. 8 . 2881 . 1 1 7 LEU CD1 C 2.826 -0.719 1.614 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . rr_6e5k 1
. 8 . 2882 . 1 1 7 LEU CD2 C 2.054 -2.192 3.470 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . rr_6e5k 1
. 8 . 2883 . 1 1 7 LEU CG C 2.391 -2.125 1.989 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . rr_6e5k 1
. 8 . 2884 . 1 1 7 LEU H H 2.586 -4.640 0.692 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . rr_6e5k 1
. 8 . 2885 . 1 1 7 LEU HA H 0.420 -4.091 2.417 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . rr_6e5k 1
. 8 . 2886 . 1 1 7 LEU HB2 H 1.457 -2.460 0.103 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . rr_6e5k 1
. 8 . 2887 . 1 1 7 LEU HB3 H 0.377 -1.874 1.347 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . rr_6e5k 1
. 8 . 2888 . 1 1 7 LEU HD11 H 3.689 -0.440 2.201 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . rr_6e5k 1
. 8 . 2889 . 1 1 7 LEU HD12 H 2.019 -0.031 1.812 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . rr_6e5k 1
. 8 . 2890 . 1 1 7 LEU HD13 H 3.079 -0.686 0.565 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . rr_6e5k 1
. 8 . 2891 . 1 1 7 LEU HD21 H 1.207 -1.555 3.671 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . rr_6e5k 1
. 8 . 2892 . 1 1 7 LEU HD22 H 2.903 -1.856 4.047 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . rr_6e5k 1
. 8 . 2893 . 1 1 7 LEU HD23 H 1.813 -3.209 3.742 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . rr_6e5k 1
. 8 . 2894 . 1 1 7 LEU HG H 3.218 -2.795 1.798 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . rr_6e5k 1
. 8 . 2895 . 1 1 7 LEU N N 1.734 -4.950 1.080 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . rr_6e5k 1
. 8 . 2896 . 1 1 7 LEU O O -1.672 -4.165 1.007 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . rr_6e5k 1
. 8 . 2897 . 1 1 8 LYS C C -2.231 -5.978 -1.242 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . rr_6e5k 1
. 8 . 2898 . 1 1 8 LYS CA C -1.401 -4.777 -1.682 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . rr_6e5k 1
. 8 . 2899 . 1 1 8 LYS CB C -0.830 -4.997 -3.084 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . rr_6e5k 1
. 8 . 2900 . 1 1 8 LYS CD C -1.215 -5.156 -5.552 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . rr_6e5k 1
. 8 . 2901 . 1 1 8 LYS CE C -2.227 -5.048 -6.682 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . rr_6e5k 1
. 8 . 2902 . 1 1 8 LYS CG C -1.874 -5.029 -4.188 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . rr_6e5k 1
. 8 . 2903 . 1 1 8 LYS H H 0.609 -4.602 -1.056 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . rr_6e5k 1
. 8 . 2904 . 1 1 8 LYS HA H -2.032 -3.904 -1.689 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . rr_6e5k 1
. 8 . 2905 . 1 1 8 LYS HB2 H -0.136 -4.200 -3.303 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . rr_6e5k 1
. 8 . 2906 . 1 1 8 LYS HB3 H -0.297 -5.936 -3.097 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . rr_6e5k 1
. 8 . 2907 . 1 1 8 LYS HD2 H -0.485 -4.368 -5.662 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . rr_6e5k 1
. 8 . 2908 . 1 1 8 LYS HD3 H -0.721 -6.115 -5.613 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . rr_6e5k 1
. 8 . 2909 . 1 1 8 LYS HE2 H -2.765 -4.119 -6.576 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . rr_6e5k 1
. 8 . 2910 . 1 1 8 LYS HE3 H -1.697 -5.049 -7.623 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . rr_6e5k 1
. 8 . 2911 . 1 1 8 LYS HG2 H -2.527 -5.875 -4.031 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . rr_6e5k 1
. 8 . 2912 . 1 1 8 LYS HG3 H -2.447 -4.115 -4.157 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . rr_6e5k 1
. 8 . 2913 . 1 1 8 LYS HZ1 H -3.869 -6.069 -7.468 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 8 . 2914 . 1 1 8 LYS HZ2 H -3.740 -6.174 -5.787 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 8 . 2915 . 1 1 8 LYS HZ3 H -2.706 -7.078 -6.771 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 8 . 2916 . 1 1 8 LYS N N -0.318 -4.539 -0.742 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . rr_6e5k 1
. 8 . 2917 . 1 1 8 LYS NZ N -3.202 -6.170 -6.676 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . rr_6e5k 1
. 8 . 2918 . 1 1 8 LYS O O -3.455 -5.896 -1.171 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . rr_6e5k 1
. 8 . 2919 . 1 1 9 ABA C C -2.922 -8.013 0.866 . . . 1.0 . . . . . . . . . . . . A . 9 AIB C . . . . . . . . . rr_6e5k 1
. 8 . 2920 . 1 1 9 ABA CA C -2.179 -8.308 -0.443 . . . 1.0 . . . . . . . . . . . . A . 9 AIB CA . . . . . . . . . rr_6e5k 1
. 8 . 2921 . 1 1 9 ABA H H -0.562 -7.054 -1.005 . . . 1.0 . . . . . . . . . . . . A . 9 AIB H . . . . . . . . . rr_6e5k 1
. 8 . 2922 . 1 1 9 ABA N N -1.541 -7.075 -0.922 . . . 1.0 . . . . . . . . . . . . A . 9 AIB N . . . . . . . . . rr_6e5k 1
. 8 . 2923 . 1 1 9 ABA O O -4.024 -8.515 1.103 . . . 1.0 . . . . . . . . . . . . A . 9 AIB O . . . . . . . . . rr_6e5k 1
. 8 . 2924 . 1 1 10 ARG C C -4.162 -6.089 2.848 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . rr_6e5k 1
. 8 . 2925 . 1 1 10 ARG CA C -2.844 -6.838 3.006 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . rr_6e5k 1
. 8 . 2926 . 1 1 10 ARG CB C -1.835 -5.972 3.767 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . rr_6e5k 1
. 8 . 2927 . 1 1 10 ARG CD C -1.217 -4.735 5.863 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . rr_6e5k 1
. 8 . 2928 . 1 1 10 ARG CG C -2.287 -5.556 5.156 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . rr_6e5k 1
. 8 . 2929 . 1 1 10 ARG CZ C 1.183 -4.945 6.442 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . rr_6e5k 1
. 8 . 2930 . 1 1 10 ARG H H -1.419 -6.830 1.446 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . rr_6e5k 1
. 8 . 2931 . 1 1 10 ARG HA H -3.019 -7.745 3.559 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . rr_6e5k 1
. 8 . 2932 . 1 1 10 ARG HB2 H -0.912 -6.522 3.865 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . rr_6e5k 1
. 8 . 2933 . 1 1 10 ARG HB3 H -1.647 -5.074 3.193 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . rr_6e5k 1
. 8 . 2934 . 1 1 10 ARG HD2 H -1.062 -3.818 5.312 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . rr_6e5k 1
. 8 . 2935 . 1 1 10 ARG HD3 H -1.560 -4.500 6.861 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . rr_6e5k 1
. 8 . 2936 . 1 1 10 ARG HE H 0.067 -6.384 5.617 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . rr_6e5k 1
. 8 . 2937 . 1 1 10 ARG HG2 H -3.183 -4.961 5.067 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . rr_6e5k 1
. 8 . 2938 . 1 1 10 ARG HG3 H -2.496 -6.442 5.738 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . rr_6e5k 1
. 8 . 2939 . 1 1 10 ARG HH11 H 2.066 -3.336 7.301 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . rr_6e5k 1
. 8 . 2940 . 1 1 10 ARG HH12 H 0.377 -3.152 6.952 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . rr_6e5k 1
. 8 . 2941 . 1 1 10 ARG HH21 H 2.267 -6.621 6.089 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . rr_6e5k 1
. 8 . 2942 . 1 1 10 ARG HH22 H 3.145 -5.306 6.807 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . rr_6e5k 1
. 8 . 2943 . 1 1 10 ARG N N -2.293 -7.200 1.708 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . rr_6e5k 1
. 8 . 2944 . 1 1 10 ARG NE N 0.054 -5.457 5.954 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . rr_6e5k 1
. 8 . 2945 . 1 1 10 ARG NH1 N 1.210 -3.712 6.936 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . rr_6e5k 1
. 8 . 2946 . 1 1 10 ARG NH2 N 2.286 -5.683 6.448 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . rr_6e5k 1
. 8 . 2947 . 1 1 10 ARG O O -5.152 -6.393 3.512 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . rr_6e5k 1
. 8 . 2948 . 1 1 11 TYR C C -6.149 -4.772 0.549 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . rr_6e5k 1
. 8 . 2949 . 1 1 11 TYR CA C -5.328 -4.276 1.735 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . rr_6e5k 1
. 8 . 2950 . 1 1 11 TYR CB C -4.871 -2.833 1.516 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . rr_6e5k 1
. 8 . 2951 . 1 1 11 TYR CD1 C -4.885 -1.891 3.856 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . rr_6e5k 1
. 8 . 2952 . 1 1 11 TYR CD2 C -2.798 -2.035 2.717 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . rr_6e5k 1
. 8 . 2953 . 1 1 11 TYR CE1 C -4.250 -1.353 4.958 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . rr_6e5k 1
. 8 . 2954 . 1 1 11 TYR CE2 C -2.157 -1.497 3.814 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . rr_6e5k 1
. 8 . 2955 . 1 1 11 TYR CG C -4.171 -2.241 2.718 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . rr_6e5k 1
. 8 . 2956 . 1 1 11 TYR CZ C -2.886 -1.156 4.933 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . rr_6e5k 1
. 8 . 2957 . 1 1 11 TYR H H -3.364 -4.979 1.396 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . rr_6e5k 1
. 8 . 2958 . 1 1 11 TYR HA H -5.938 -4.319 2.624 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . rr_6e5k 1
. 8 . 2959 . 1 1 11 TYR HB2 H -4.183 -2.803 0.684 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . rr_6e5k 1
. 8 . 2960 . 1 1 11 TYR HB3 H -5.726 -2.222 1.293 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . rr_6e5k 1
. 8 . 2961 . 1 1 11 TYR HD1 H -5.953 -2.045 3.873 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . rr_6e5k 1
. 8 . 2962 . 1 1 11 TYR HD2 H -2.227 -2.305 1.839 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . rr_6e5k 1
. 8 . 2963 . 1 1 11 TYR HE1 H -4.824 -1.087 5.833 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . rr_6e5k 1
. 8 . 2964 . 1 1 11 TYR HE2 H -1.088 -1.346 3.792 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . rr_6e5k 1
. 8 . 2965 . 1 1 11 TYR HH H -1.646 0.072 5.748 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . rr_6e5k 1
. 8 . 2966 . 1 1 11 TYR N N -4.168 -5.123 1.947 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . rr_6e5k 1
. 8 . 2967 . 1 1 11 TYR O O -6.495 -4.003 -0.344 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . rr_6e5k 1
. 8 . 2968 . 1 1 11 TYR OH O -2.251 -0.622 6.031 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . rr_6e5k 1
. 8 . 2969 . 1 1 12 ABA C C -8.528 -6.029 -0.808 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . rr_6e5k 1
. 8 . 2970 . 1 1 12 ABA CA C -7.201 -6.738 -0.506 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . rr_6e5k 1
. 8 . 2971 . 1 1 12 ABA H H -6.190 -6.590 1.357 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . rr_6e5k 1
. 8 . 2972 . 1 1 12 ABA N N -6.468 -6.062 0.578 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . rr_6e5k 1
. 8 . 2973 . 1 1 12 ABA O O -8.957 -5.962 -1.963 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . rr_6e5k 1
. 8 . 2974 . 1 1 13 GLY C C -10.341 -3.350 0.009 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_6e5k 1
. 8 . 2975 . 1 1 13 GLY CA C -10.452 -4.860 0.036 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_6e5k 1
. 8 . 2976 . 1 1 13 GLY H H -8.777 -5.569 1.117 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_6e5k 1
. 8 . 2977 . 1 1 13 GLY HA2 H -10.879 -5.195 -0.896 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_6e5k 1
. 8 . 2978 . 1 1 13 GLY HA3 H -11.109 -5.147 0.843 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_6e5k 1
. 8 . 2979 . 1 1 13 GLY N N -9.171 -5.510 0.223 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_6e5k 1
. 8 . 2980 . 1 1 13 GLY O O -11.346 -2.648 0.104 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_6e5k 1
. 8 . 2981 . 1 1 14 CYS C C -7.885 -1.086 -1.250 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_6e5k 1
. 8 . 2982 . 1 1 14 CYS CA C -8.885 -1.415 -0.141 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_6e5k 1
. 8 . 2983 . 1 1 14 CYS CB C -8.343 -0.947 1.216 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_6e5k 1
. 8 . 2984 . 1 1 14 CYS H H -8.356 -3.459 -0.201 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_6e5k 1
. 8 . 2985 . 1 1 14 CYS HA H -9.821 -0.918 -0.346 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_6e5k 1
. 8 . 2986 . 1 1 14 CYS HB2 H -7.285 -1.129 1.248 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_6e5k 1
. 8 . 2987 . 1 1 14 CYS HB3 H -8.518 0.115 1.316 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_6e5k 1
. 8 . 2988 . 1 1 14 CYS N N -9.122 -2.849 -0.114 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_6e5k 1
. 8 . 2989 . 1 1 14 CYS O O -7.467 -1.969 -1.998 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_6e5k 1
. 8 . 2990 . 1 1 14 CYS SG S -9.091 -1.770 2.667 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_6e5k 1
. 8 . 2991 . 1 1 15 GLU C C -5.292 1.150 -1.639 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_6e5k 1
. 8 . 2992 . 1 1 15 GLU CA C -6.530 0.612 -2.344 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_6e5k 1
. 8 . 2993 . 1 1 15 GLU CB C -7.110 1.700 -3.245 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_6e5k 1
. 8 . 2994 . 1 1 15 GLU CD C -8.778 2.305 -5.015 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_6e5k 1
. 8 . 2995 . 1 1 15 GLU CG C -8.340 1.267 -4.012 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_6e5k 1
. 8 . 2996 . 1 1 15 GLU H H -7.920 0.849 -0.771 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_6e5k 1
. 8 . 2997 . 1 1 15 GLU HA H -6.253 -0.240 -2.943 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_6e5k 1
. 8 . 2998 . 1 1 15 GLU HB2 H -7.375 2.550 -2.636 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_6e5k 1
. 8 . 2999 . 1 1 15 GLU HB3 H -6.355 2.001 -3.956 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3000 . 1 1 15 GLU HG2 H -8.120 0.351 -4.537 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_6e5k 1
. 8 . 3001 . 1 1 15 GLU HG3 H -9.145 1.099 -3.313 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_6e5k 1
. 8 . 3002 . 1 1 15 GLU N N -7.517 0.180 -1.363 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_6e5k 1
. 8 . 3003 . 1 1 15 GLU O O -5.417 1.859 -0.639 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_6e5k 1
. 8 . 3004 . 1 1 15 GLU OE1 O -9.555 3.209 -4.642 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_6e5k 1
. 8 . 3005 . 1 1 15 GLU OE2 O -8.347 2.222 -6.182 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_6e5k 1
. 8 . 3006 . 1 1 16 MVA C C -1.763 1.760 -2.465 . . . 1.0 . . . . . . . . . . . . A . 16 MVA C . . . . . . . . . rr_6e5k 1
. 8 . 3007 . 1 1 16 MVA CA C -2.850 1.298 -1.483 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CA . . . . . . . . . rr_6e5k 1
. 8 . 3008 . 1 1 16 MVA CB C -2.271 0.210 -0.526 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CB . . . . . . . . . rr_6e5k 1
. 8 . 3009 . 1 1 16 MVA CG1 C -1.967 -1.098 -1.238 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG1 . . . . . . . . . rr_6e5k 1
. 8 . 3010 . 1 1 16 MVA CG2 C -1.023 0.731 0.167 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG2 . . . . . . . . . rr_6e5k 1
. 8 . 3011 . 1 1 16 MVA CN C -4.006 0.107 -3.433 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CN . . . . . . . . . rr_6e5k 1
. 8 . 3012 . 1 1 16 MVA HA H -3.087 2.154 -0.863 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HA . . . . . . . . . rr_6e5k 1
. 8 . 3013 . 1 1 16 MVA HB H -3.009 0.005 0.235 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HB . . . . . . . . . rr_6e5k 1
. 8 . 3014 . 1 1 16 MVA HG11 H -1.505 -1.784 -0.544 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG11 . . . . . . . . . rr_6e5k 1
. 8 . 3015 . 1 1 16 MVA HG12 H -1.295 -0.911 -2.063 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG12 . . . . . . . . . rr_6e5k 1
. 8 . 3016 . 1 1 16 MVA HG13 H -2.887 -1.526 -1.609 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG13 . . . . . . . . . rr_6e5k 1
. 8 . 3017 . 1 1 16 MVA HG21 H -0.265 0.946 -0.572 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG21 . . . . . . . . . rr_6e5k 1
. 8 . 3018 . 1 1 16 MVA HG22 H -0.653 -0.017 0.853 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG22 . . . . . . . . . rr_6e5k 1
. 8 . 3019 . 1 1 16 MVA HG23 H -1.264 1.632 0.708 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG23 . . . . . . . . . rr_6e5k 1
. 8 . 3020 . 1 1 16 MVA HN1 H -4.294 -0.920 -3.271 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN1 . . . . . . . . . rr_6e5k 1
. 8 . 3021 . 1 1 16 MVA HN2 H -2.991 0.142 -3.806 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN2 . . . . . . . . . rr_6e5k 1
. 8 . 3022 . 1 1 16 MVA HN3 H -4.670 0.557 -4.154 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN3 . . . . . . . . . rr_6e5k 1
. 8 . 3023 . 1 1 16 MVA N N -4.085 0.853 -2.155 . . . 1.0 . . . . . . . . . . . . A . 16 MVA N . . . . . . . . . rr_6e5k 1
. 8 . 3024 . 1 1 16 MVA O O -1.197 0.980 -3.237 . . . 1.0 . . . . . . . . . . . . A . 16 MVA O . . . . . . . . . rr_6e5k 1
. 8 . 3025 . 1 1 17 ARG C C 0.893 3.565 -2.502 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_6e5k 1
. 8 . 3026 . 1 1 17 ARG CA C -0.435 3.649 -3.233 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_6e5k 1
. 8 . 3027 . 1 1 17 ARG CB C -0.753 5.113 -3.528 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_6e5k 1
. 8 . 3028 . 1 1 17 ARG CD C -2.421 6.832 -4.258 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_6e5k 1
. 8 . 3029 . 1 1 17 ARG CG C -2.121 5.344 -4.142 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_6e5k 1
. 8 . 3030 . 1 1 17 ARG CZ C -4.492 8.168 -4.333 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_6e5k 1
. 8 . 3031 . 1 1 17 ARG H H -1.961 3.619 -1.774 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_6e5k 1
. 8 . 3032 . 1 1 17 ARG HA H -0.373 3.097 -4.158 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_6e5k 1
. 8 . 3033 . 1 1 17 ARG HB2 H -0.699 5.668 -2.607 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_6e5k 1
. 8 . 3034 . 1 1 17 ARG HB3 H -0.008 5.495 -4.210 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3035 . 1 1 17 ARG HD2 H -2.264 7.294 -3.294 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_6e5k 1
. 8 . 3036 . 1 1 17 ARG HD3 H -1.741 7.268 -4.976 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_6e5k 1
. 8 . 3037 . 1 1 17 ARG HE H -4.214 6.424 -5.282 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_6e5k 1
. 8 . 3038 . 1 1 17 ARG HG2 H -2.142 4.900 -5.127 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_6e5k 1
. 8 . 3039 . 1 1 17 ARG HG3 H -2.870 4.880 -3.518 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_6e5k 1
. 8 . 3040 . 1 1 17 ARG HH11 H -4.478 9.900 -3.273 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_6e5k 1
. 8 . 3041 . 1 1 17 ARG HH12 H -3.005 8.982 -3.201 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_6e5k 1
. 8 . 3042 . 1 1 17 ARG HH21 H -6.141 7.633 -5.382 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_6e5k 1
. 8 . 3043 . 1 1 17 ARG HH22 H -6.266 9.129 -4.517 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_6e5k 1
. 8 . 3044 . 1 1 17 ARG N N -1.472 3.052 -2.410 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_6e5k 1
. 8 . 3045 . 1 1 17 ARG NE N -3.792 7.091 -4.687 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_6e5k 1
. 8 . 3046 . 1 1 17 ARG NH1 N -3.952 9.090 -3.538 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_6e5k 1
. 8 . 3047 . 1 1 17 ARG NH2 N -5.731 8.323 -4.778 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_6e5k 1
. 8 . 3048 . 1 1 17 ARG O O 1.120 4.292 -1.534 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_6e5k 1
. 8 . 3049 . 1 1 18 CYS C C 4.093 3.425 -2.797 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . rr_6e5k 1
. 8 . 3050 . 1 1 18 CYS CA C 3.030 2.453 -2.294 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . rr_6e5k 1
. 8 . 3051 . 1 1 18 CYS CB C 3.478 1.012 -2.518 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . rr_6e5k 1
. 8 . 3052 . 1 1 18 CYS H H 1.527 2.149 -3.747 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . rr_6e5k 1
. 8 . 3053 . 1 1 18 CYS HA H 2.887 2.615 -1.235 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . rr_6e5k 1
. 8 . 3054 . 1 1 18 CYS HB2 H 4.507 0.911 -2.211 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . rr_6e5k 1
. 8 . 3055 . 1 1 18 CYS HB3 H 2.864 0.354 -1.921 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3056 . 1 1 18 CYS N N 1.752 2.675 -2.949 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . rr_6e5k 1
. 8 . 3057 . 1 1 18 CYS O O 4.250 3.624 -4.000 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . rr_6e5k 1
. 8 . 3058 . 1 1 18 CYS SG S 3.358 0.464 -4.252 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . rr_6e5k 1
. 8 . 3059 . 1 1 19 ASP C C 7.028 4.762 -1.188 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . rr_6e5k 1
. 8 . 3060 . 1 1 19 ASP CA C 5.896 4.943 -2.195 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . rr_6e5k 1
. 8 . 3061 . 1 1 19 ASP CB C 5.394 6.389 -2.180 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . rr_6e5k 1
. 8 . 3062 . 1 1 19 ASP CG C 6.384 7.365 -2.785 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . rr_6e5k 1
. 8 . 3063 . 1 1 19 ASP H H 4.610 3.860 -0.918 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . rr_6e5k 1
. 8 . 3064 . 1 1 19 ASP HA H 6.255 4.697 -3.182 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . rr_6e5k 1
. 8 . 3065 . 1 1 19 ASP HB2 H 4.474 6.447 -2.739 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . rr_6e5k 1
. 8 . 3066 . 1 1 19 ASP HB3 H 5.206 6.683 -1.157 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3067 . 1 1 19 ASP N N 4.813 4.029 -1.866 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . rr_6e5k 1
. 8 . 3068 . 1 1 19 ASP O O 7.094 5.466 -0.176 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . rr_6e5k 1
. 8 . 3069 . 1 1 19 ASP OD1 O 7.023 8.126 -2.027 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . rr_6e5k 1
. 8 . 3070 . 1 1 19 ASP OD2 O 6.508 7.394 -4.028 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . rr_6e5k 1
. 8 . 3071 . 1 1 20 DPR C C 8.402 3.023 0.857 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . rr_6e5k 1
. 8 . 3072 . 1 1 20 DPR CA C 8.986 3.437 -0.495 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . rr_6e5k 1
. 8 . 3073 . 1 1 20 DPR CB C 9.688 2.257 -1.164 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . rr_6e5k 1
. 8 . 3074 . 1 1 20 DPR CD C 8.012 3.012 -2.684 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . rr_6e5k 1
. 8 . 3075 . 1 1 20 DPR CG C 9.384 2.405 -2.615 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . rr_6e5k 1
. 8 . 3076 . 1 1 20 DPR HA H 9.692 4.239 -0.355 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . rr_6e5k 1
. 8 . 3077 . 1 1 20 DPR HB2 H 10.750 2.312 -0.972 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . rr_6e5k 1
. 8 . 3078 . 1 1 20 DPR HB3 H 9.294 1.332 -0.773 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3079 . 1 1 20 DPR HD2 H 7.926 3.646 -3.552 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . rr_6e5k 1
. 8 . 3080 . 1 1 20 DPR HD3 H 7.256 2.241 -2.697 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . rr_6e5k 1
. 8 . 3081 . 1 1 20 DPR HG2 H 10.106 3.061 -3.079 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . rr_6e5k 1
. 8 . 3082 . 1 1 20 DPR HG3 H 9.391 1.437 -3.093 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . rr_6e5k 1
. 8 . 3083 . 1 1 20 DPR N N 7.931 3.804 -1.445 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . rr_6e5k 1
. 8 . 3084 . 1 1 20 DPR O O 7.575 2.111 0.931 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . rr_6e5k 1
. 8 . 3085 . 1 1 21 PRO C C 6.907 4.013 3.502 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . rr_6e5k 1
. 8 . 3086 . 1 1 21 PRO CA C 8.299 3.425 3.282 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . rr_6e5k 1
. 8 . 3087 . 1 1 21 PRO CB C 9.317 4.111 4.191 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . rr_6e5k 1
. 8 . 3088 . 1 1 21 PRO CD C 9.838 4.761 1.947 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . rr_6e5k 1
. 8 . 3089 . 1 1 21 PRO CG C 9.840 5.240 3.375 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . rr_6e5k 1
. 8 . 3090 . 1 1 21 PRO HA H 8.280 2.369 3.493 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . rr_6e5k 1
. 8 . 3091 . 1 1 21 PRO HB2 H 8.826 4.461 5.086 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . rr_6e5k 1
. 8 . 3092 . 1 1 21 PRO HB3 H 10.101 3.417 4.449 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3093 . 1 1 21 PRO HD2 H 9.562 5.563 1.281 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . rr_6e5k 1
. 8 . 3094 . 1 1 21 PRO HD3 H 10.804 4.364 1.682 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . rr_6e5k 1
. 8 . 3095 . 1 1 21 PRO HG2 H 9.194 6.098 3.484 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . rr_6e5k 1
. 8 . 3096 . 1 1 21 PRO HG3 H 10.845 5.485 3.687 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . rr_6e5k 1
. 8 . 3097 . 1 1 21 PRO N N 8.816 3.697 1.940 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . rr_6e5k 1
. 8 . 3098 . 1 1 21 PRO O O 6.226 3.674 4.469 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . rr_6e5k 1
. 8 . 3099 . 1 1 22 ARG C C 4.160 4.889 1.852 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . rr_6e5k 1
. 8 . 3100 . 1 1 22 ARG CA C 5.204 5.557 2.729 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . rr_6e5k 1
. 8 . 3101 . 1 1 22 ARG CB C 5.337 7.029 2.330 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . rr_6e5k 1
. 8 . 3102 . 1 1 22 ARG CD C 6.472 9.247 2.687 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . rr_6e5k 1
. 8 . 3103 . 1 1 22 ARG CG C 6.356 7.801 3.154 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . rr_6e5k 1
. 8 . 3104 . 1 1 22 ARG CZ C 4.829 10.991 2.063 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . rr_6e5k 1
. 8 . 3105 . 1 1 22 ARG H H 7.025 5.038 1.789 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . rr_6e5k 1
. 8 . 3106 . 1 1 22 ARG HA H 4.893 5.490 3.760 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . rr_6e5k 1
. 8 . 3107 . 1 1 22 ARG HB2 H 5.633 7.080 1.293 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . rr_6e5k 1
. 8 . 3108 . 1 1 22 ARG HB3 H 4.376 7.507 2.443 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3109 . 1 1 22 ARG HD2 H 7.250 9.735 3.257 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . rr_6e5k 1
. 8 . 3110 . 1 1 22 ARG HD3 H 6.740 9.252 1.640 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . rr_6e5k 1
. 8 . 3111 . 1 1 22 ARG HE H 4.647 9.740 3.615 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . rr_6e5k 1
. 8 . 3112 . 1 1 22 ARG HG2 H 6.050 7.790 4.190 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . rr_6e5k 1
. 8 . 3113 . 1 1 22 ARG HG3 H 7.318 7.322 3.056 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . rr_6e5k 1
. 8 . 3114 . 1 1 22 ARG HH11 H 6.444 10.891 0.838 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . rr_6e5k 1
. 8 . 3115 . 1 1 22 ARG HH12 H 5.277 12.112 0.435 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . rr_6e5k 1
. 8 . 3116 . 1 1 22 ARG HH21 H 3.387 12.368 1.705 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . rr_6e5k 1
. 8 . 3117 . 1 1 22 ARG HH22 H 3.109 11.340 3.075 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . rr_6e5k 1
. 8 . 3118 . 1 1 22 ARG N N 6.481 4.876 2.592 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . rr_6e5k 1
. 8 . 3119 . 1 1 22 ARG NE N 5.221 9.993 2.859 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . rr_6e5k 1
. 8 . 3120 . 1 1 22 ARG NH1 N 5.577 11.361 1.030 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . rr_6e5k 1
. 8 . 3121 . 1 1 22 ARG NH2 N 3.684 11.616 2.301 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . rr_6e5k 1
. 8 . 3122 . 1 1 22 ARG O O 4.499 4.226 0.874 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . rr_6e5k 1
. 8 . 3123 . 1 1 23 TYR C C 0.508 5.245 1.720 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . rr_6e5k 1
. 8 . 3124 . 1 1 23 TYR CA C 1.816 4.552 1.382 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . rr_6e5k 1
. 8 . 3125 . 1 1 23 TYR CB C 1.664 3.033 1.520 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . rr_6e5k 1
. 8 . 3126 . 1 1 23 TYR CD1 C -0.039 2.354 3.254 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . rr_6e5k 1
. 8 . 3127 . 1 1 23 TYR CD2 C 2.263 2.321 3.866 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . rr_6e5k 1
. 8 . 3128 . 1 1 23 TYR CE1 C -0.386 1.942 4.525 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . rr_6e5k 1
. 8 . 3129 . 1 1 23 TYR CE2 C 1.924 1.902 5.136 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . rr_6e5k 1
. 8 . 3130 . 1 1 23 TYR CG C 1.289 2.551 2.904 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . rr_6e5k 1
. 8 . 3131 . 1 1 23 TYR CZ C 0.599 1.616 5.427 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . rr_6e5k 1
. 8 . 3132 . 1 1 23 TYR H H 2.688 5.496 3.056 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . rr_6e5k 1
. 8 . 3133 . 1 1 23 TYR HA H 2.064 4.779 0.356 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . rr_6e5k 1
. 8 . 3134 . 1 1 23 TYR HB2 H 0.899 2.698 0.839 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . rr_6e5k 1
. 8 . 3135 . 1 1 23 TYR HB3 H 2.599 2.567 1.250 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3136 . 1 1 23 TYR HD1 H -0.808 2.529 2.515 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . rr_6e5k 1
. 8 . 3137 . 1 1 23 TYR HD2 H 3.301 2.464 3.608 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . rr_6e5k 1
. 8 . 3138 . 1 1 23 TYR HE1 H -1.424 1.791 4.777 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . rr_6e5k 1
. 8 . 3139 . 1 1 23 TYR HE2 H 2.697 1.727 5.869 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . rr_6e5k 1
. 8 . 3140 . 1 1 23 TYR HH H -0.375 0.591 6.681 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . rr_6e5k 1
. 8 . 3141 . 1 1 23 TYR N N 2.898 5.047 2.210 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . rr_6e5k 1
. 8 . 3142 . 1 1 23 TYR O O 0.306 5.719 2.838 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . rr_6e5k 1
. 8 . 3143 . 1 1 23 TYR OH O 0.262 1.314 6.735 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . rr_6e5k 1
. 8 . 3144 . 1 1 24 GLU C C -2.709 4.726 0.844 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . rr_6e5k 1
. 8 . 3145 . 1 1 24 GLU CA C -1.699 5.854 0.934 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . rr_6e5k 1
. 8 . 3146 . 1 1 24 GLU CB C -2.032 6.913 -0.118 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . rr_6e5k 1
. 8 . 3147 . 1 1 24 GLU CD C -1.651 9.258 -0.931 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . rr_6e5k 1
. 8 . 3148 . 1 1 24 GLU CG C -1.103 8.111 -0.112 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . rr_6e5k 1
. 8 . 3149 . 1 1 24 GLU H H -0.109 4.986 -0.153 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . rr_6e5k 1
. 8 . 3150 . 1 1 24 GLU HA H -1.743 6.296 1.917 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . rr_6e5k 1
. 8 . 3151 . 1 1 24 GLU HB2 H -1.987 6.457 -1.094 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . rr_6e5k 1
. 8 . 3152 . 1 1 24 GLU HB3 H -3.037 7.265 0.054 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3153 . 1 1 24 GLU HG2 H -0.971 8.445 0.907 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . rr_6e5k 1
. 8 . 3154 . 1 1 24 GLU HG3 H -0.149 7.816 -0.522 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . rr_6e5k 1
. 8 . 3155 . 1 1 24 GLU N N -0.366 5.317 0.735 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . rr_6e5k 1
. 8 . 3156 . 1 1 24 GLU O O -2.635 3.911 -0.069 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . rr_6e5k 1
. 8 . 3157 . 1 1 24 GLU OE1 O -2.276 10.163 -0.341 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . rr_6e5k 1
. 8 . 3158 . 1 1 24 GLU OE2 O -1.472 9.256 -2.168 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . rr_6e5k 1
. 8 . 3159 . 1 1 25 MVA C C -6.090 4.045 1.891 . . . 1.0 . . . . . . . . . . . . A . 25 MVA C . . . . . . . . . rr_6e5k 1
. 8 . 3160 . 1 1 25 MVA CA C -4.652 3.560 1.706 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CA . . . . . . . . . rr_6e5k 1
. 8 . 3161 . 1 1 25 MVA CB C -4.342 2.400 2.703 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CB . . . . . . . . . rr_6e5k 1
. 8 . 3162 . 1 1 25 MVA CG1 C -4.290 2.861 4.152 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG1 . . . . . . . . . rr_6e5k 1
. 8 . 3163 . 1 1 25 MVA CG2 C -5.363 1.283 2.541 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG2 . . . . . . . . . rr_6e5k 1
. 8 . 3164 . 1 1 25 MVA CN C -3.759 5.701 2.809 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CN . . . . . . . . . rr_6e5k 1
. 8 . 3165 . 1 1 25 MVA HA H -4.608 3.124 0.716 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HA . . . . . . . . . rr_6e5k 1
. 8 . 3166 . 1 1 25 MVA HB H -3.372 1.996 2.452 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HB . . . . . . . . . rr_6e5k 1
. 8 . 3167 . 1 1 25 MVA HG11 H -5.220 3.344 4.408 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG11 . . . . . . . . . rr_6e5k 1
. 8 . 3168 . 1 1 25 MVA HG12 H -3.474 3.555 4.279 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG12 . . . . . . . . . rr_6e5k 1
. 8 . 3169 . 1 1 25 MVA HG13 H -4.140 2.005 4.795 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG13 . . . . . . . . . rr_6e5k 1
. 8 . 3170 . 1 1 25 MVA HG21 H -6.356 1.677 2.705 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG21 . . . . . . . . . rr_6e5k 1
. 8 . 3171 . 1 1 25 MVA HG22 H -5.162 0.503 3.261 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG22 . . . . . . . . . rr_6e5k 1
. 8 . 3172 . 1 1 25 MVA HG23 H -5.297 0.875 1.543 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG23 . . . . . . . . . rr_6e5k 1
. 8 . 3173 . 1 1 25 MVA HN1 H -3.741 6.676 2.344 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN1 . . . . . . . . . rr_6e5k 1
. 8 . 3174 . 1 1 25 MVA HN2 H -2.921 5.610 3.485 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN2 . . . . . . . . . rr_6e5k 1
. 8 . 3175 . 1 1 25 MVA HN3 H -4.681 5.584 3.358 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN3 . . . . . . . . . rr_6e5k 1
. 8 . 3176 . 1 1 25 MVA N N -3.670 4.654 1.765 . . . 1.0 . . . . . . . . . . . . A . 25 MVA N . . . . . . . . . rr_6e5k 1
. 8 . 3177 . 1 1 25 MVA O O -6.477 4.577 2.934 . . . 1.0 . . . . . . . . . . . . A . 25 MVA O . . . . . . . . . rr_6e5k 1
. 8 . 3178 . 1 1 26 HIS C C -9.130 2.974 0.941 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_6e5k 1
. 8 . 3179 . 1 1 26 HIS CA C -8.283 4.225 0.861 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_6e5k 1
. 8 . 3180 . 1 1 26 HIS CB C -8.653 5.007 -0.399 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_6e5k 1
. 8 . 3181 . 1 1 26 HIS CD2 C -6.859 6.873 -0.612 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_6e5k 1
. 8 . 3182 . 1 1 26 HIS CE1 C -8.186 8.604 -0.425 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_6e5k 1
. 8 . 3183 . 1 1 26 HIS CG C -8.119 6.406 -0.444 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_6e5k 1
. 8 . 3184 . 1 1 26 HIS H H -6.509 3.407 0.051 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_6e5k 1
. 8 . 3185 . 1 1 26 HIS HA H -8.465 4.835 1.731 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_6e5k 1
. 8 . 3186 . 1 1 26 HIS HB2 H -8.271 4.481 -1.257 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_6e5k 1
. 8 . 3187 . 1 1 26 HIS HB3 H -9.728 5.061 -0.472 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3188 . 1 1 26 HIS HD1 H -9.896 7.507 -0.196 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_6e5k 1
. 8 . 3189 . 1 1 26 HIS HD2 H -5.966 6.277 -0.737 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_6e5k 1
. 8 . 3190 . 1 1 26 HIS HE1 H -8.551 9.619 -0.372 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_6e5k 1
. 8 . 3191 . 1 1 26 HIS HE2 H -6.158 8.846 -0.483 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_6e5k 1
. 8 . 3192 . 1 1 26 HIS N N -6.880 3.851 0.849 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_6e5k 1
. 8 . 3193 . 1 1 26 HIS ND1 N -8.922 7.516 -0.329 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_6e5k 1
. 8 . 3194 . 1 1 26 HIS NE2 N -6.929 8.245 -0.596 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_6e5k 1
. 8 . 3195 . 1 1 26 HIS O O -8.878 2.009 0.225 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_6e5k 1
. 8 . 3196 . 1 1 27 CYS C C -12.394 2.242 2.270 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . rr_6e5k 1
. 8 . 3197 . 1 1 27 CYS CA C -10.963 1.813 1.969 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . rr_6e5k 1
. 8 . 3198 . 1 1 27 CYS CB C -10.419 0.927 3.086 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . rr_6e5k 1
. 8 . 3199 . 1 1 27 CYS H H -10.281 3.770 2.361 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . rr_6e5k 1
. 8 . 3200 . 1 1 27 CYS HA H -10.949 1.259 1.043 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . rr_6e5k 1
. 8 . 3201 . 1 1 27 CYS HB2 H -9.343 0.990 3.090 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . rr_6e5k 1
. 8 . 3202 . 1 1 27 CYS HB3 H -10.799 1.284 4.030 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . rr_6e5k 1
. 8 . 3203 . 1 1 27 CYS N N -10.117 2.973 1.810 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . rr_6e5k 1
. 8 . 3204 . 1 1 27 CYS O O -12.837 2.228 3.422 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . rr_6e5k 1
. 8 . 3205 . 1 1 27 CYS SG S -10.873 -0.830 2.934 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . rr_6e5k 1
. 8 . 3206 . 1 1 28 NH2 HN1 H -12.692 2.626 0.346 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . rr_6e5k 1
. 8 . 3207 . 1 1 28 NH2 HN2 H -14.030 2.931 1.395 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . rr_6e5k 1
. 8 . 3208 . 1 1 28 NH2 N N -13.111 2.639 1.236 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . rr_6e5k 1
. 9 . 3209 . 1 1 1 ASN C C 9.390 -8.677 -0.684 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . rr_6e5k 1
. 9 . 3210 . 1 1 1 ASN CA C 9.446 -10.119 -0.193 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . rr_6e5k 1
. 9 . 3211 . 1 1 1 ASN CB C 8.960 -10.209 1.260 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . rr_6e5k 1
. 9 . 3212 . 1 1 1 ASN CG C 9.669 -9.230 2.176 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . rr_6e5k 1
. 9 . 3213 . 1 1 1 ASN H1 H 11.156 -10.585 -1.282 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . rr_6e5k 1
. 9 . 3214 . 1 1 1 ASN H2 H 10.881 -11.612 0.033 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . rr_6e5k 1
. 9 . 3215 . 1 1 1 ASN H3 H 11.469 -10.046 0.289 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . rr_6e5k 1
. 9 . 3216 . 1 1 1 ASN HA H 8.814 -10.729 -0.820 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . rr_6e5k 1
. 9 . 3217 . 1 1 1 ASN HB2 H 7.903 -10.002 1.294 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3218 . 1 1 1 ASN HB3 H 9.137 -11.209 1.629 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3219 . 1 1 1 ASN HD21 H 8.119 -7.990 2.102 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . rr_6e5k 1
. 9 . 3220 . 1 1 1 ASN HD22 H 9.461 -7.460 3.057 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . rr_6e5k 1
. 9 . 3221 . 1 1 1 ASN N N 10.834 -10.626 -0.296 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . rr_6e5k 1
. 9 . 3222 . 1 1 1 ASN ND2 N 9.016 -8.117 2.477 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . rr_6e5k 1
. 9 . 3223 . 1 1 1 ASN O O 10.373 -7.945 -0.578 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . rr_6e5k 1
. 9 . 3224 . 1 1 1 ASN OD1 O 10.780 -9.488 2.634 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . rr_6e5k 1
. 9 . 3225 . 1 1 2 ASP C C 7.156 -6.086 -0.946 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . rr_6e5k 1
. 9 . 3226 . 1 1 2 ASP CA C 8.103 -6.932 -1.785 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . rr_6e5k 1
. 9 . 3227 . 1 1 2 ASP CB C 7.595 -7.001 -3.225 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . rr_6e5k 1
. 9 . 3228 . 1 1 2 ASP CG C 7.445 -5.630 -3.847 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . rr_6e5k 1
. 9 . 3229 . 1 1 2 ASP H H 7.484 -8.889 -1.255 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . rr_6e5k 1
. 9 . 3230 . 1 1 2 ASP HA H 9.075 -6.467 -1.781 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . rr_6e5k 1
. 9 . 3231 . 1 1 2 ASP HB2 H 8.293 -7.571 -3.820 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3232 . 1 1 2 ASP HB3 H 6.634 -7.491 -3.238 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3233 . 1 1 2 ASP N N 8.249 -8.273 -1.228 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . rr_6e5k 1
. 9 . 3234 . 1 1 2 ASP O O 6.074 -6.545 -0.565 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . rr_6e5k 1
. 9 . 3235 . 1 1 2 ASP OD1 O 6.307 -5.126 -3.918 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . rr_6e5k 1
. 9 . 3236 . 1 1 2 ASP OD2 O 8.467 -5.048 -4.264 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . rr_6e5k 1
. 9 . 3237 . 1 1 3 ABA C C 5.414 -3.685 -0.454 . . . 1.0 . . . . . . . . . . . . A . 3 AIB C . . . . . . . . . rr_6e5k 1
. 9 . 3238 . 1 1 3 ABA CA C 6.809 -3.903 0.149 . . . 1.0 . . . . . . . . . . . . A . 3 AIB CA . . . . . . . . . rr_6e5k 1
. 9 . 3239 . 1 1 3 ABA H H 8.441 -4.559 -1.036 . . . 1.0 . . . . . . . . . . . . A . 3 AIB H . . . . . . . . . rr_6e5k 1
. 9 . 3240 . 1 1 3 ABA N N 7.576 -4.850 -0.671 . . . 1.0 . . . . . . . . . . . . A . 3 AIB N . . . . . . . . . rr_6e5k 1
. 9 . 3241 . 1 1 3 ABA O O 4.398 -3.895 0.213 . . . 1.0 . . . . . . . . . . . . A . 3 AIB O . . . . . . . . . rr_6e5k 1
. 9 . 3242 . 1 1 4 CYS C C 3.183 -4.143 -2.462 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . rr_6e5k 1
. 9 . 3243 . 1 1 4 CYS CA C 4.110 -2.937 -2.368 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . rr_6e5k 1
. 9 . 3244 . 1 1 4 CYS CB C 4.357 -2.353 -3.758 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . rr_6e5k 1
. 9 . 3245 . 1 1 4 CYS H H 6.203 -3.239 -2.242 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . rr_6e5k 1
. 9 . 3246 . 1 1 4 CYS HA H 3.632 -2.187 -1.758 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . rr_6e5k 1
. 9 . 3247 . 1 1 4 CYS HB2 H 4.912 -3.065 -4.344 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3248 . 1 1 4 CYS HB3 H 3.407 -2.168 -4.234 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3249 . 1 1 4 CYS N N 5.370 -3.286 -1.722 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . rr_6e5k 1
. 9 . 3250 . 1 1 4 CYS O O 1.978 -4.025 -2.232 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . rr_6e5k 1
. 9 . 3251 . 1 1 4 CYS SG S 5.294 -0.788 -3.758 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . rr_6e5k 1
. 9 . 3252 . 1 1 5 LYS C C 2.383 -6.890 -1.512 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_6e5k 1
. 9 . 3253 . 1 1 5 LYS CA C 2.960 -6.521 -2.875 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_6e5k 1
. 9 . 3254 . 1 1 5 LYS CB C 3.810 -7.669 -3.423 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_6e5k 1
. 9 . 3255 . 1 1 5 LYS CD C 3.897 -10.037 -4.265 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_6e5k 1
. 9 . 3256 . 1 1 5 LYS CE C 3.120 -11.328 -4.468 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_6e5k 1
. 9 . 3257 . 1 1 5 LYS CG C 3.029 -8.959 -3.637 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_6e5k 1
. 9 . 3258 . 1 1 5 LYS H H 4.714 -5.331 -2.974 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_6e5k 1
. 9 . 3259 . 1 1 5 LYS HA H 2.143 -6.332 -3.554 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_6e5k 1
. 9 . 3260 . 1 1 5 LYS HB2 H 4.235 -7.367 -4.370 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3261 . 1 1 5 LYS HB3 H 4.611 -7.872 -2.728 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3262 . 1 1 5 LYS HD2 H 4.253 -9.687 -5.223 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_6e5k 1
. 9 . 3263 . 1 1 5 LYS HD3 H 4.737 -10.229 -3.615 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_6e5k 1
. 9 . 3264 . 1 1 5 LYS HE2 H 2.259 -11.123 -5.084 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_6e5k 1
. 9 . 3265 . 1 1 5 LYS HE3 H 3.757 -12.043 -4.969 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_6e5k 1
. 9 . 3266 . 1 1 5 LYS HG2 H 2.666 -9.312 -2.684 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_6e5k 1
. 9 . 3267 . 1 1 5 LYS HG3 H 2.192 -8.758 -4.291 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_6e5k 1
. 9 . 3268 . 1 1 5 LYS HZ1 H 2.156 -12.802 -3.351 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 9 . 3269 . 1 1 5 LYS HZ2 H 2.024 -11.252 -2.694 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 9 . 3270 . 1 1 5 LYS HZ3 H 3.479 -12.102 -2.562 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 9 . 3271 . 1 1 5 LYS N N 3.746 -5.301 -2.783 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_6e5k 1
. 9 . 3272 . 1 1 5 LYS NZ N 2.664 -11.911 -3.180 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_6e5k 1
. 9 . 3273 . 1 1 5 LYS O O 1.215 -7.266 -1.409 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_6e5k 1
. 9 . 3274 . 1 1 6 ABA C C 1.620 -6.136 1.273 . . . 1.0 . . . . . . . . . . . . A . 6 AIB C . . . . . . . . . rr_6e5k 1
. 9 . 3275 . 1 1 6 ABA CA C 2.794 -7.039 0.907 . . . 1.0 . . . . . . . . . . . . A . 6 AIB CA . . . . . . . . . rr_6e5k 1
. 9 . 3276 . 1 1 6 ABA H H 4.130 -6.449 -0.635 . . . 1.0 . . . . . . . . . . . . A . 6 AIB H . . . . . . . . . rr_6e5k 1
. 9 . 3277 . 1 1 6 ABA N N 3.210 -6.757 -0.472 . . . 1.0 . . . . . . . . . . . . A . 6 AIB N . . . . . . . . . rr_6e5k 1
. 9 . 3278 . 1 1 6 ABA O O 0.619 -6.587 1.832 . . . 1.0 . . . . . . . . . . . . A . 6 AIB O . . . . . . . . . rr_6e5k 1
. 9 . 3279 . 1 1 7 LEU C C -0.551 -4.177 0.500 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . rr_6e5k 1
. 9 . 3280 . 1 1 7 LEU CA C 0.728 -3.877 1.260 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . rr_6e5k 1
. 9 . 3281 . 1 1 7 LEU CB C 1.213 -2.468 0.927 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . rr_6e5k 1
. 9 . 3282 . 1 1 7 LEU CD1 C 2.923 -0.661 1.174 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . rr_6e5k 1
. 9 . 3283 . 1 1 7 LEU CD2 C 2.242 -1.998 3.165 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . rr_6e5k 1
. 9 . 3284 . 1 1 7 LEU CG C 2.478 -2.026 1.664 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . rr_6e5k 1
. 9 . 3285 . 1 1 7 LEU H H 2.564 -4.566 0.466 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . rr_6e5k 1
. 9 . 3286 . 1 1 7 LEU HA H 0.526 -3.939 2.317 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . rr_6e5k 1
. 9 . 3287 . 1 1 7 LEU HB2 H 1.399 -2.416 -0.134 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3288 . 1 1 7 LEU HB3 H 0.422 -1.774 1.169 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3289 . 1 1 7 LEU HD11 H 3.797 -0.348 1.725 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . rr_6e5k 1
. 9 . 3290 . 1 1 7 LEU HD12 H 2.126 0.048 1.329 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . rr_6e5k 1
. 9 . 3291 . 1 1 7 LEU HD13 H 3.159 -0.714 0.122 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . rr_6e5k 1
. 9 . 3292 . 1 1 7 LEU HD21 H 3.128 -1.630 3.662 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . rr_6e5k 1
. 9 . 3293 . 1 1 7 LEU HD22 H 2.021 -2.994 3.515 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . rr_6e5k 1
. 9 . 3294 . 1 1 7 LEU HD23 H 1.410 -1.346 3.385 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . rr_6e5k 1
. 9 . 3295 . 1 1 7 LEU HG H 3.272 -2.730 1.460 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . rr_6e5k 1
. 9 . 3296 . 1 1 7 LEU N N 1.753 -4.857 0.942 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . rr_6e5k 1
. 9 . 3297 . 1 1 7 LEU O O -1.645 -4.084 1.048 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . rr_6e5k 1
. 9 . 3298 . 1 1 8 LYS C C -2.293 -6.083 -0.975 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . rr_6e5k 1
. 9 . 3299 . 1 1 8 LYS CA C -1.555 -4.896 -1.577 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . rr_6e5k 1
. 9 . 3300 . 1 1 8 LYS CB C -1.125 -5.205 -3.010 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . rr_6e5k 1
. 9 . 3301 . 1 1 8 LYS CD C -1.824 -5.770 -5.360 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . rr_6e5k 1
. 9 . 3302 . 1 1 8 LYS CE C -0.999 -7.044 -5.422 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . rr_6e5k 1
. 9 . 3303 . 1 1 8 LYS CG C -2.294 -5.473 -3.946 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . rr_6e5k 1
. 9 . 3304 . 1 1 8 LYS H H 0.496 -4.603 -1.147 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . rr_6e5k 1
. 9 . 3305 . 1 1 8 LYS HA H -2.216 -4.046 -1.582 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . rr_6e5k 1
. 9 . 3306 . 1 1 8 LYS HB2 H -0.568 -4.364 -3.394 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3307 . 1 1 8 LYS HB3 H -0.489 -6.077 -3.003 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3308 . 1 1 8 LYS HD2 H -2.688 -5.882 -5.997 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . rr_6e5k 1
. 9 . 3309 . 1 1 8 LYS HD3 H -1.223 -4.942 -5.709 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . rr_6e5k 1
. 9 . 3310 . 1 1 8 LYS HE2 H -0.154 -6.946 -4.758 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . rr_6e5k 1
. 9 . 3311 . 1 1 8 LYS HE3 H -1.614 -7.872 -5.103 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . rr_6e5k 1
. 9 . 3312 . 1 1 8 LYS HG2 H -2.850 -6.323 -3.578 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . rr_6e5k 1
. 9 . 3313 . 1 1 8 LYS HG3 H -2.934 -4.604 -3.964 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . rr_6e5k 1
. 9 . 3314 . 1 1 8 LYS HZ1 H 0.138 -6.550 -7.103 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 9 . 3315 . 1 1 8 LYS HZ2 H -1.299 -7.371 -7.461 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 9 . 3316 . 1 1 8 LYS HZ3 H 0.018 -8.212 -6.818 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 9 . 3317 . 1 1 8 LYS N N -0.406 -4.556 -0.758 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . rr_6e5k 1
. 9 . 3318 . 1 1 8 LYS NZ N -0.501 -7.314 -6.796 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . rr_6e5k 1
. 9 . 3319 . 1 1 8 LYS O O -3.494 -6.015 -0.754 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . rr_6e5k 1
. 9 . 3320 . 1 1 9 ABA C C -2.789 -7.988 1.265 . . . 1.0 . . . . . . . . . . . . A . 9 AIB C . . . . . . . . . rr_6e5k 1
. 9 . 3321 . 1 1 9 ABA CA C -2.130 -8.358 -0.069 . . . 1.0 . . . . . . . . . . . . A . 9 AIB CA . . . . . . . . . rr_6e5k 1
. 9 . 3322 . 1 1 9 ABA H H -0.589 -7.127 -0.865 . . . 1.0 . . . . . . . . . . . . A . 9 AIB H . . . . . . . . . rr_6e5k 1
. 9 . 3323 . 1 1 9 ABA N N -1.554 -7.151 -0.676 . . . 1.0 . . . . . . . . . . . . A . 9 AIB N . . . . . . . . . rr_6e5k 1
. 9 . 3324 . 1 1 9 ABA O O -3.818 -8.548 1.648 . . . 1.0 . . . . . . . . . . . . A . 9 AIB O . . . . . . . . . rr_6e5k 1
. 9 . 3325 . 1 1 10 ARG C C -3.967 -5.784 3.095 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . rr_6e5k 1
. 9 . 3326 . 1 1 10 ARG CA C -2.677 -6.589 3.254 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . rr_6e5k 1
. 9 . 3327 . 1 1 10 ARG CB C -1.608 -5.734 3.943 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . rr_6e5k 1
. 9 . 3328 . 1 1 10 ARG CD C -0.784 -4.593 6.024 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . rr_6e5k 1
. 9 . 3329 . 1 1 10 ARG CG C -1.888 -5.445 5.407 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . rr_6e5k 1
. 9 . 3330 . 1 1 10 ARG CZ C 1.691 -4.524 6.018 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . rr_6e5k 1
. 9 . 3331 . 1 1 10 ARG H H -1.360 -6.633 1.601 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . rr_6e5k 1
. 9 . 3332 . 1 1 10 ARG HA H -2.877 -7.459 3.857 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . rr_6e5k 1
. 9 . 3333 . 1 1 10 ARG HB2 H -0.661 -6.244 3.876 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3334 . 1 1 10 ARG HB3 H -1.534 -4.791 3.422 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3335 . 1 1 10 ARG HD2 H -0.798 -3.619 5.557 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . rr_6e5k 1
. 9 . 3336 . 1 1 10 ARG HD3 H -0.980 -4.486 7.080 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . rr_6e5k 1
. 9 . 3337 . 1 1 10 ARG HE H 0.583 -6.130 5.562 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . rr_6e5k 1
. 9 . 3338 . 1 1 10 ARG HG2 H -2.826 -4.915 5.484 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . rr_6e5k 1
. 9 . 3339 . 1 1 10 ARG HG3 H -1.955 -6.379 5.944 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . rr_6e5k 1
. 9 . 3340 . 1 1 10 ARG HH11 H 2.552 -2.769 6.556 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . rr_6e5k 1
. 9 . 3341 . 1 1 10 ARG HH12 H 0.818 -2.795 6.621 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . rr_6e5k 1
. 9 . 3342 . 1 1 10 ARG HH21 H 2.868 -6.091 5.501 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . rr_6e5k 1
. 9 . 3343 . 1 1 10 ARG HH22 H 3.713 -4.638 5.939 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . rr_6e5k 1
. 9 . 3344 . 1 1 10 ARG N N -2.181 -7.038 1.963 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . rr_6e5k 1
. 9 . 3345 . 1 1 10 ARG NE N 0.544 -5.185 5.841 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . rr_6e5k 1
. 9 . 3346 . 1 1 10 ARG NH1 N 1.685 -3.261 6.427 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . rr_6e5k 1
. 9 . 3347 . 1 1 10 ARG NH2 N 2.849 -5.132 5.800 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . rr_6e5k 1
. 9 . 3348 . 1 1 10 ARG O O -4.847 -5.823 3.956 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . rr_6e5k 1
. 9 . 3349 . 1 1 11 TYR C C -5.949 -4.503 0.470 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . rr_6e5k 1
. 9 . 3350 . 1 1 11 TYR CA C -5.206 -4.168 1.763 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . rr_6e5k 1
. 9 . 3351 . 1 1 11 TYR CB C -4.713 -2.723 1.707 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . rr_6e5k 1
. 9 . 3352 . 1 1 11 TYR CD1 C -4.729 -2.088 4.146 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . rr_6e5k 1
. 9 . 3353 . 1 1 11 TYR CD2 C -2.651 -2.023 2.980 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . rr_6e5k 1
. 9 . 3354 . 1 1 11 TYR CE1 C -4.100 -1.672 5.301 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . rr_6e5k 1
. 9 . 3355 . 1 1 11 TYR CE2 C -2.014 -1.606 4.132 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . rr_6e5k 1
. 9 . 3356 . 1 1 11 TYR CG C -4.017 -2.271 2.968 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . rr_6e5k 1
. 9 . 3357 . 1 1 11 TYR CZ C -2.731 -1.445 5.289 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . rr_6e5k 1
. 9 . 3358 . 1 1 11 TYR H H -3.370 -5.122 1.303 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . rr_6e5k 1
. 9 . 3359 . 1 1 11 TYR HA H -5.885 -4.273 2.594 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . rr_6e5k 1
. 9 . 3360 . 1 1 11 TYR HB2 H -4.013 -2.621 0.890 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3361 . 1 1 11 TYR HB3 H -5.553 -2.071 1.538 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3362 . 1 1 11 TYR HD1 H -5.794 -2.275 4.151 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . rr_6e5k 1
. 9 . 3363 . 1 1 11 TYR HD2 H -2.086 -2.159 2.071 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . rr_6e5k 1
. 9 . 3364 . 1 1 11 TYR HE1 H -4.674 -1.537 6.206 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . rr_6e5k 1
. 9 . 3365 . 1 1 11 TYR HE2 H -0.950 -1.419 4.122 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . rr_6e5k 1
. 9 . 3366 . 1 1 11 TYR HH H -1.586 -0.225 6.250 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . rr_6e5k 1
. 9 . 3367 . 1 1 11 TYR N N -4.077 -5.062 1.987 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . rr_6e5k 1
. 9 . 3368 . 1 1 11 TYR O O -6.356 -3.607 -0.260 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . rr_6e5k 1
. 9 . 3369 . 1 1 11 TYR OH O -2.112 -1.015 6.442 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . rr_6e5k 1
. 9 . 3370 . 1 1 12 ABA C C -8.256 -5.669 -1.069 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . rr_6e5k 1
. 9 . 3371 . 1 1 12 ABA CA C -6.849 -6.275 -0.988 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . rr_6e5k 1
. 9 . 3372 . 1 1 12 ABA H H -5.788 -6.455 0.848 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . rr_6e5k 1
. 9 . 3373 . 1 1 12 ABA N N -6.142 -5.796 0.216 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . rr_6e5k 1
. 9 . 3374 . 1 1 12 ABA O O -8.795 -5.467 -2.161 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . rr_6e5k 1
. 9 . 3375 . 1 1 13 GLY C C -10.169 -3.301 0.098 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_6e5k 1
. 9 . 3376 . 1 1 13 GLY CA C -10.178 -4.818 0.120 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_6e5k 1
. 9 . 3377 . 1 1 13 GLY H H -8.369 -5.569 0.923 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_6e5k 1
. 9 . 3378 . 1 1 13 GLY HA2 H -10.728 -5.175 -0.736 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_6e5k 1
. 9 . 3379 . 1 1 13 GLY HA3 H -10.676 -5.151 1.018 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_6e5k 1
. 9 . 3380 . 1 1 13 GLY N N -8.844 -5.387 0.085 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_6e5k 1
. 9 . 3381 . 1 1 13 GLY O O -11.183 -2.663 0.376 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_6e5k 1
. 9 . 3382 . 1 1 14 CYS C C -7.895 -0.911 -1.402 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_6e5k 1
. 9 . 3383 . 1 1 14 CYS CA C -8.868 -1.279 -0.282 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_6e5k 1
. 9 . 3384 . 1 1 14 CYS CB C -8.346 -0.754 1.062 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_6e5k 1
. 9 . 3385 . 1 1 14 CYS H H -8.240 -3.289 -0.425 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_6e5k 1
. 9 . 3386 . 1 1 14 CYS HA H -9.832 -0.842 -0.488 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_6e5k 1
. 9 . 3387 . 1 1 14 CYS HB2 H -7.348 -1.127 1.217 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3388 . 1 1 14 CYS HB3 H -8.317 0.326 1.031 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3389 . 1 1 14 CYS N N -9.020 -2.724 -0.223 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_6e5k 1
. 9 . 3390 . 1 1 14 CYS O O -7.356 -1.788 -2.077 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_6e5k 1
. 9 . 3391 . 1 1 14 CYS SG S -9.350 -1.242 2.509 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_6e5k 1
. 9 . 3392 . 1 1 15 GLU C C -5.444 1.286 -1.849 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_6e5k 1
. 9 . 3393 . 1 1 15 GLU CA C -6.710 0.853 -2.579 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_6e5k 1
. 9 . 3394 . 1 1 15 GLU CB C -7.267 2.026 -3.388 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_6e5k 1
. 9 . 3395 . 1 1 15 GLU CD C -7.821 0.742 -5.479 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_6e5k 1
. 9 . 3396 . 1 1 15 GLU CG C -8.348 1.630 -4.374 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_6e5k 1
. 9 . 3397 . 1 1 15 GLU H H -8.232 1.039 -1.125 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_6e5k 1
. 9 . 3398 . 1 1 15 GLU HA H -6.476 0.040 -3.245 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_6e5k 1
. 9 . 3399 . 1 1 15 GLU HB2 H -7.681 2.754 -2.706 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3400 . 1 1 15 GLU HB3 H -6.457 2.481 -3.938 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3401 . 1 1 15 GLU HG2 H -9.124 1.098 -3.845 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_6e5k 1
. 9 . 3402 . 1 1 15 GLU HG3 H -8.761 2.524 -4.815 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_6e5k 1
. 9 . 3403 . 1 1 15 GLU N N -7.697 0.381 -1.619 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_6e5k 1
. 9 . 3404 . 1 1 15 GLU O O -5.527 1.979 -0.837 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_6e5k 1
. 9 . 3405 . 1 1 15 GLU OE1 O -8.030 -0.486 -5.417 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_6e5k 1
. 9 . 3406 . 1 1 15 GLU OE2 O -7.187 1.260 -6.419 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_6e5k 1
. 9 . 3407 . 1 1 16 MVA C C -1.904 1.735 -2.613 . . . 1.0 . . . . . . . . . . . . A . 16 MVA C . . . . . . . . . rr_6e5k 1
. 9 . 3408 . 1 1 16 MVA CA C -3.006 1.266 -1.652 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CA . . . . . . . . . rr_6e5k 1
. 9 . 3409 . 1 1 16 MVA CB C -2.470 0.115 -0.741 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CB . . . . . . . . . rr_6e5k 1
. 9 . 3410 . 1 1 16 MVA CG1 C -2.104 -1.138 -1.522 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG1 . . . . . . . . . rr_6e5k 1
. 9 . 3411 . 1 1 16 MVA CG2 C -1.277 0.595 0.069 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG2 . . . . . . . . . rr_6e5k 1
. 9 . 3412 . 1 1 16 MVA CN C -4.214 0.137 -3.614 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CN . . . . . . . . . rr_6e5k 1
. 9 . 3413 . 1 1 16 MVA HA H -3.213 2.102 -0.995 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HA . . . . . . . . . rr_6e5k 1
. 9 . 3414 . 1 1 16 MVA HB H -3.253 -0.151 -0.046 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HB . . . . . . . . . rr_6e5k 1
. 9 . 3415 . 1 1 16 MVA HG11 H -2.986 -1.532 -2.004 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG11 . . . . . . . . . rr_6e5k 1
. 9 . 3416 . 1 1 16 MVA HG12 H -1.702 -1.876 -0.843 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG12 . . . . . . . . . rr_6e5k 1
. 9 . 3417 . 1 1 16 MVA HG13 H -1.362 -0.891 -2.267 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG13 . . . . . . . . . rr_6e5k 1
. 9 . 3418 . 1 1 16 MVA HG21 H -0.494 0.920 -0.602 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG21 . . . . . . . . . rr_6e5k 1
. 9 . 3419 . 1 1 16 MVA HG22 H -0.910 -0.212 0.685 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG22 . . . . . . . . . rr_6e5k 1
. 9 . 3420 . 1 1 16 MVA HG23 H -1.577 1.421 0.696 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG23 . . . . . . . . . rr_6e5k 1
. 9 . 3421 . 1 1 16 MVA HN1 H -3.193 0.071 -3.960 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN1 . . . . . . . . . rr_6e5k 1
. 9 . 3422 . 1 1 16 MVA HN2 H -4.814 0.640 -4.358 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN2 . . . . . . . . . rr_6e5k 1
. 9 . 3423 . 1 1 16 MVA HN3 H -4.601 -0.858 -3.449 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN3 . . . . . . . . . rr_6e5k 1
. 9 . 3424 . 1 1 16 MVA N N -4.257 0.900 -2.346 . . . 1.0 . . . . . . . . . . . . A . 16 MVA N . . . . . . . . . rr_6e5k 1
. 9 . 3425 . 1 1 16 MVA O O -1.405 0.988 -3.457 . . . 1.0 . . . . . . . . . . . . A . 16 MVA O . . . . . . . . . rr_6e5k 1
. 9 . 3426 . 1 1 17 ARG C C 0.816 3.597 -2.484 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_6e5k 1
. 9 . 3427 . 1 1 17 ARG CA C -0.482 3.594 -3.271 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_6e5k 1
. 9 . 3428 . 1 1 17 ARG CB C -0.844 5.031 -3.653 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_6e5k 1
. 9 . 3429 . 1 1 17 ARG CD C -2.512 6.636 -4.628 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_6e5k 1
. 9 . 3430 . 1 1 17 ARG CG C -2.183 5.171 -4.360 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_6e5k 1
. 9 . 3431 . 1 1 17 ARG CZ C -4.377 8.001 -5.498 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_6e5k 1
. 9 . 3432 . 1 1 17 ARG H H -1.963 3.537 -1.768 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_6e5k 1
. 9 . 3433 . 1 1 17 ARG HA H -0.358 3.002 -4.164 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_6e5k 1
. 9 . 3434 . 1 1 17 ARG HB2 H -0.873 5.628 -2.755 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3435 . 1 1 17 ARG HB3 H -0.076 5.418 -4.305 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3436 . 1 1 17 ARG HD2 H -2.472 7.176 -3.694 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_6e5k 1
. 9 . 3437 . 1 1 17 ARG HD3 H -1.773 7.039 -5.305 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_6e5k 1
. 9 . 3438 . 1 1 17 ARG HE H -4.364 6.001 -5.407 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_6e5k 1
. 9 . 3439 . 1 1 17 ARG HG2 H -2.139 4.641 -5.299 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_6e5k 1
. 9 . 3440 . 1 1 17 ARG HG3 H -2.955 4.744 -3.738 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_6e5k 1
. 9 . 3441 . 1 1 17 ARG HH11 H -4.104 10.010 -5.445 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_6e5k 1
. 9 . 3442 . 1 1 17 ARG HH12 H -2.791 9.068 -4.816 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_6e5k 1
. 9 . 3443 . 1 1 17 ARG HH21 H -6.111 7.232 -6.221 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_6e5k 1
. 9 . 3444 . 1 1 17 ARG HH22 H -5.999 8.963 -6.248 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_6e5k 1
. 9 . 3445 . 1 1 17 ARG N N -1.531 2.995 -2.464 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_6e5k 1
. 9 . 3446 . 1 1 17 ARG NE N -3.841 6.813 -5.217 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_6e5k 1
. 9 . 3447 . 1 1 17 ARG NH1 N -3.703 9.116 -5.233 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_6e5k 1
. 9 . 3448 . 1 1 17 ARG NH2 N -5.593 8.071 -6.031 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_6e5k 1
. 9 . 3449 . 1 1 17 ARG O O 0.991 4.402 -1.569 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_6e5k 1
. 9 . 3450 . 1 1 18 CYS C C 3.962 3.643 -2.572 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . rr_6e5k 1
. 9 . 3451 . 1 1 18 CYS CA C 2.971 2.586 -2.096 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . rr_6e5k 1
. 9 . 3452 . 1 1 18 CYS CB C 3.566 1.181 -2.233 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . rr_6e5k 1
. 9 . 3453 . 1 1 18 CYS H H 1.531 2.080 -3.561 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . rr_6e5k 1
. 9 . 3454 . 1 1 18 CYS HA H 2.757 2.769 -1.054 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . rr_6e5k 1
. 9 . 3455 . 1 1 18 CYS HB2 H 4.513 1.149 -1.714 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3456 . 1 1 18 CYS HB3 H 2.892 0.469 -1.777 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3457 . 1 1 18 CYS N N 1.714 2.689 -2.818 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . rr_6e5k 1
. 9 . 3458 . 1 1 18 CYS O O 4.216 3.788 -3.770 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . rr_6e5k 1
. 9 . 3459 . 1 1 18 CYS SG S 3.863 0.640 -3.948 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . rr_6e5k 1
. 9 . 3460 . 1 1 19 ASP C C 6.721 5.164 -1.055 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . rr_6e5k 1
. 9 . 3461 . 1 1 19 ASP CA C 5.472 5.429 -1.887 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . rr_6e5k 1
. 9 . 3462 . 1 1 19 ASP CB C 4.888 6.806 -1.554 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . rr_6e5k 1
. 9 . 3463 . 1 1 19 ASP CG C 5.818 7.946 -1.923 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . rr_6e5k 1
. 9 . 3464 . 1 1 19 ASP H H 4.248 4.210 -0.685 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . rr_6e5k 1
. 9 . 3465 . 1 1 19 ASP HA H 5.726 5.390 -2.934 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . rr_6e5k 1
. 9 . 3466 . 1 1 19 ASP HB2 H 3.961 6.936 -2.093 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3467 . 1 1 19 ASP HB3 H 4.692 6.855 -0.495 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3468 . 1 1 19 ASP N N 4.499 4.385 -1.617 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . rr_6e5k 1
. 9 . 3469 . 1 1 19 ASP O O 6.783 5.518 0.129 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . rr_6e5k 1
. 9 . 3470 . 1 1 19 ASP OD1 O 6.442 8.538 -1.014 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . rr_6e5k 1
. 9 . 3471 . 1 1 19 ASP OD2 O 5.928 8.264 -3.125 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . rr_6e5k 1
. 9 . 3472 . 1 1 20 DPR C C 8.481 3.034 0.149 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . rr_6e5k 1
. 9 . 3473 . 1 1 20 DPR CA C 8.897 4.049 -0.912 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . rr_6e5k 1
. 9 . 3474 . 1 1 20 DPR CB C 9.780 3.395 -1.975 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . rr_6e5k 1
. 9 . 3475 . 1 1 20 DPR CD C 7.812 4.185 -3.080 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . rr_6e5k 1
. 9 . 3476 . 1 1 20 DPR CG C 9.275 3.911 -3.279 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . rr_6e5k 1
. 9 . 3477 . 1 1 20 DPR HA H 9.429 4.864 -0.452 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . rr_6e5k 1
. 9 . 3478 . 1 1 20 DPR HB2 H 10.809 3.677 -1.809 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3479 . 1 1 20 DPR HB3 H 9.683 2.324 -1.912 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3480 . 1 1 20 DPR HD2 H 7.500 5.019 -3.688 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . rr_6e5k 1
. 9 . 3481 . 1 1 20 DPR HD3 H 7.227 3.307 -3.308 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . rr_6e5k 1
. 9 . 3482 . 1 1 20 DPR HG2 H 9.793 4.823 -3.541 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . rr_6e5k 1
. 9 . 3483 . 1 1 20 DPR HG3 H 9.416 3.166 -4.049 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . rr_6e5k 1
. 9 . 3484 . 1 1 20 DPR N N 7.727 4.514 -1.650 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . rr_6e5k 1
. 9 . 3485 . 1 1 20 DPR O O 7.768 2.073 -0.150 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . rr_6e5k 1
. 9 . 3486 . 1 1 21 PRO C C 7.131 2.789 3.074 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . rr_6e5k 1
. 9 . 3487 . 1 1 21 PRO CA C 8.496 2.388 2.517 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . rr_6e5k 1
. 9 . 3488 . 1 1 21 PRO CB C 9.588 2.640 3.549 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . rr_6e5k 1
. 9 . 3489 . 1 1 21 PRO CD C 9.854 4.286 1.826 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . rr_6e5k 1
. 9 . 3490 . 1 1 21 PRO CG C 10.002 4.050 3.309 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . rr_6e5k 1
. 9 . 3491 . 1 1 21 PRO HA H 8.485 1.344 2.244 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . rr_6e5k 1
. 9 . 3492 . 1 1 21 PRO HB2 H 9.187 2.505 4.542 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3493 . 1 1 21 PRO HB3 H 10.407 1.956 3.387 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3494 . 1 1 21 PRO HD2 H 9.450 5.267 1.637 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . rr_6e5k 1
. 9 . 3495 . 1 1 21 PRO HD3 H 10.806 4.168 1.329 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . rr_6e5k 1
. 9 . 3496 . 1 1 21 PRO HG2 H 9.357 4.718 3.860 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . rr_6e5k 1
. 9 . 3497 . 1 1 21 PRO HG3 H 11.029 4.187 3.609 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . rr_6e5k 1
. 9 . 3498 . 1 1 21 PRO N N 8.908 3.235 1.401 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . rr_6e5k 1
. 9 . 3499 . 1 1 21 PRO O O 6.585 2.126 3.956 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . rr_6e5k 1
. 9 . 3500 . 1 1 22 ARG C C 4.202 4.038 2.047 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . rr_6e5k 1
. 9 . 3501 . 1 1 22 ARG CA C 5.306 4.392 3.025 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . rr_6e5k 1
. 9 . 3502 . 1 1 22 ARG CB C 5.387 5.906 3.219 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . rr_6e5k 1
. 9 . 3503 . 1 1 22 ARG CD C 6.407 7.822 4.491 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . rr_6e5k 1
. 9 . 3504 . 1 1 22 ARG CG C 6.378 6.315 4.295 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . rr_6e5k 1
. 9 . 3505 . 1 1 22 ARG CZ C 7.315 9.406 6.154 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . rr_6e5k 1
. 9 . 3506 . 1 1 22 ARG H H 7.029 4.332 1.800 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . rr_6e5k 1
. 9 . 3507 . 1 1 22 ARG HA H 5.093 3.925 3.974 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . rr_6e5k 1
. 9 . 3508 . 1 1 22 ARG HB2 H 5.687 6.361 2.287 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3509 . 1 1 22 ARG HB3 H 4.412 6.277 3.496 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3510 . 1 1 22 ARG HD2 H 6.717 8.287 3.566 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . rr_6e5k 1
. 9 . 3511 . 1 1 22 ARG HD3 H 5.414 8.160 4.748 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . rr_6e5k 1
. 9 . 3512 . 1 1 22 ARG HE H 8.003 7.551 5.841 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . rr_6e5k 1
. 9 . 3513 . 1 1 22 ARG HG2 H 6.094 5.848 5.226 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . rr_6e5k 1
. 9 . 3514 . 1 1 22 ARG HG3 H 7.363 5.978 4.007 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . rr_6e5k 1
. 9 . 3515 . 1 1 22 ARG HH11 H 5.783 10.141 5.049 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . rr_6e5k 1
. 9 . 3516 . 1 1 22 ARG HH12 H 6.424 11.225 6.238 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . rr_6e5k 1
. 9 . 3517 . 1 1 22 ARG HH21 H 8.171 10.568 7.576 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . rr_6e5k 1
. 9 . 3518 . 1 1 22 ARG HH22 H 8.853 8.983 7.406 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . rr_6e5k 1
. 9 . 3519 . 1 1 22 ARG N N 6.579 3.878 2.550 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . rr_6e5k 1
. 9 . 3520 . 1 1 22 ARG NE N 7.332 8.217 5.554 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . rr_6e5k 1
. 9 . 3521 . 1 1 22 ARG NH1 N 6.438 10.330 5.783 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . rr_6e5k 1
. 9 . 3522 . 1 1 22 ARG NH2 N 8.182 9.672 7.122 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . rr_6e5k 1
. 9 . 3523 . 1 1 22 ARG O O 4.471 3.486 0.983 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . rr_6e5k 1
. 9 . 3524 . 1 1 23 TYR C C 0.607 4.826 1.897 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . rr_6e5k 1
. 9 . 3525 . 1 1 23 TYR CA C 1.840 4.018 1.540 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . rr_6e5k 1
. 9 . 3526 . 1 1 23 TYR CB C 1.511 2.529 1.613 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . rr_6e5k 1
. 9 . 3527 . 1 1 23 TYR CD1 C -0.212 1.948 3.363 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . rr_6e5k 1
. 9 . 3528 . 1 1 23 TYR CD2 C 2.089 1.696 3.924 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . rr_6e5k 1
. 9 . 3529 . 1 1 23 TYR CE1 C -0.571 1.515 4.622 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . rr_6e5k 1
. 9 . 3530 . 1 1 23 TYR CE2 C 1.738 1.260 5.184 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . rr_6e5k 1
. 9 . 3531 . 1 1 23 TYR CG C 1.123 2.047 2.993 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . rr_6e5k 1
. 9 . 3532 . 1 1 23 TYR CZ C 0.409 1.155 5.525 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . rr_6e5k 1
. 9 . 3533 . 1 1 23 TYR H H 2.796 4.749 3.277 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . rr_6e5k 1
. 9 . 3534 . 1 1 23 TYR HA H 2.126 4.258 0.529 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . rr_6e5k 1
. 9 . 3535 . 1 1 23 TYR HB2 H 0.689 2.316 0.947 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3536 . 1 1 23 TYR HB3 H 2.376 1.967 1.297 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3537 . 1 1 23 TYR HD1 H -0.976 2.216 2.647 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . rr_6e5k 1
. 9 . 3538 . 1 1 23 TYR HD2 H 3.131 1.766 3.649 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . rr_6e5k 1
. 9 . 3539 . 1 1 23 TYR HE1 H -1.615 1.444 4.891 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . rr_6e5k 1
. 9 . 3540 . 1 1 23 TYR HE2 H 2.505 0.993 5.894 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . rr_6e5k 1
. 9 . 3541 . 1 1 23 TYR HH H 0.597 1.206 7.451 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . rr_6e5k 1
. 9 . 3542 . 1 1 23 TYR N N 2.962 4.329 2.408 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . rr_6e5k 1
. 9 . 3543 . 1 1 23 TYR O O 0.455 5.296 3.025 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . rr_6e5k 1
. 9 . 3544 . 1 1 23 TYR OH O 0.059 0.741 6.791 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . rr_6e5k 1
. 9 . 3545 . 1 1 24 GLU C C -2.600 4.444 0.955 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . rr_6e5k 1
. 9 . 3546 . 1 1 24 GLU CA C -1.571 5.551 1.101 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . rr_6e5k 1
. 9 . 3547 . 1 1 24 GLU CB C -1.841 6.642 0.067 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . rr_6e5k 1
. 9 . 3548 . 1 1 24 GLU CD C -2.031 8.670 1.538 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . rr_6e5k 1
. 9 . 3549 . 1 1 24 GLU CG C -1.257 7.992 0.430 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . rr_6e5k 1
. 9 . 3550 . 1 1 24 GLU H H 0.018 4.714 0.006 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . rr_6e5k 1
. 9 . 3551 . 1 1 24 GLU HA H -1.625 5.969 2.094 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . rr_6e5k 1
. 9 . 3552 . 1 1 24 GLU HB2 H -1.421 6.336 -0.879 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3553 . 1 1 24 GLU HB3 H -2.907 6.755 -0.045 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3554 . 1 1 24 GLU HG2 H -0.238 7.853 0.758 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . rr_6e5k 1
. 9 . 3555 . 1 1 24 GLU HG3 H -1.272 8.628 -0.442 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . rr_6e5k 1
. 9 . 3556 . 1 1 24 GLU N N -0.249 4.990 0.910 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . rr_6e5k 1
. 9 . 3557 . 1 1 24 GLU O O -2.519 3.658 0.020 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . rr_6e5k 1
. 9 . 3558 . 1 1 24 GLU OE1 O -1.482 8.808 2.655 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . rr_6e5k 1
. 9 . 3559 . 1 1 24 GLU OE2 O -3.193 9.053 1.308 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . rr_6e5k 1
. 9 . 3560 . 1 1 25 MVA C C -6.006 3.783 1.977 . . . 1.0 . . . . . . . . . . . . A . 25 MVA C . . . . . . . . . rr_6e5k 1
. 9 . 3561 . 1 1 25 MVA CA C -4.584 3.278 1.742 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CA . . . . . . . . . rr_6e5k 1
. 9 . 3562 . 1 1 25 MVA CB C -4.287 2.055 2.661 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CB . . . . . . . . . rr_6e5k 1
. 9 . 3563 . 1 1 25 MVA CG1 C -4.169 2.433 4.128 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG1 . . . . . . . . . rr_6e5k 1
. 9 . 3564 . 1 1 25 MVA CG2 C -5.358 0.990 2.475 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG2 . . . . . . . . . rr_6e5k 1
. 9 . 3565 . 1 1 25 MVA CN C -3.666 5.359 2.940 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CN . . . . . . . . . rr_6e5k 1
. 9 . 3566 . 1 1 25 MVA HA H -4.561 2.906 0.726 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HA . . . . . . . . . rr_6e5k 1
. 9 . 3567 . 1 1 25 MVA HB H -3.343 1.629 2.354 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HB . . . . . . . . . rr_6e5k 1
. 9 . 3568 . 1 1 25 MVA HG11 H -5.071 2.933 4.445 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG11 . . . . . . . . . rr_6e5k 1
. 9 . 3569 . 1 1 25 MVA HG12 H -3.324 3.092 4.262 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG12 . . . . . . . . . rr_6e5k 1
. 9 . 3570 . 1 1 25 MVA HG13 H -4.026 1.539 4.718 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG13 . . . . . . . . . rr_6e5k 1
. 9 . 3571 . 1 1 25 MVA HG21 H -5.365 0.664 1.445 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG21 . . . . . . . . . rr_6e5k 1
. 9 . 3572 . 1 1 25 MVA HG22 H -6.324 1.404 2.728 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG22 . . . . . . . . . rr_6e5k 1
. 9 . 3573 . 1 1 25 MVA HG23 H -5.145 0.150 3.118 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG23 . . . . . . . . . rr_6e5k 1
. 9 . 3574 . 1 1 25 MVA HN1 H -2.848 5.219 3.629 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN1 . . . . . . . . . rr_6e5k 1
. 9 . 3575 . 1 1 25 MVA HN2 H -4.603 5.241 3.465 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN2 . . . . . . . . . rr_6e5k 1
. 9 . 3576 . 1 1 25 MVA HN3 H -3.613 6.351 2.515 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN3 . . . . . . . . . rr_6e5k 1
. 9 . 3577 . 1 1 25 MVA N N -3.580 4.351 1.858 . . . 1.0 . . . . . . . . . . . . A . 25 MVA N . . . . . . . . . rr_6e5k 1
. 9 . 3578 . 1 1 25 MVA O O -6.400 4.149 3.089 . . . 1.0 . . . . . . . . . . . . A . 25 MVA O . . . . . . . . . rr_6e5k 1
. 9 . 3579 . 1 1 26 HIS C C -9.099 3.204 0.509 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_6e5k 1
. 9 . 3580 . 1 1 26 HIS CA C -8.132 4.301 0.926 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_6e5k 1
. 9 . 3581 . 1 1 26 HIS CB C -8.271 5.510 -0.004 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_6e5k 1
. 9 . 3582 . 1 1 26 HIS CD2 C -6.112 6.876 0.468 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_6e5k 1
. 9 . 3583 . 1 1 26 HIS CE1 C -7.045 8.740 1.135 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_6e5k 1
. 9 . 3584 . 1 1 26 HIS CG C -7.454 6.698 0.416 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_6e5k 1
. 9 . 3585 . 1 1 26 HIS H H -6.420 3.419 0.062 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_6e5k 1
. 9 . 3586 . 1 1 26 HIS HA H -8.357 4.603 1.936 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_6e5k 1
. 9 . 3587 . 1 1 26 HIS HB2 H -7.955 5.225 -0.995 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3588 . 1 1 26 HIS HB3 H -9.305 5.810 -0.037 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3589 . 1 1 26 HIS HD1 H -8.971 8.077 0.913 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_6e5k 1
. 9 . 3590 . 1 1 26 HIS HD2 H -5.361 6.143 0.211 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_6e5k 1
. 9 . 3591 . 1 1 26 HIS HE1 H -7.182 9.747 1.494 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_6e5k 1
. 9 . 3592 . 1 1 26 HIS HE2 H -5.000 8.535 1.126 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_6e5k 1
. 9 . 3593 . 1 1 26 HIS N N -6.774 3.792 0.903 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_6e5k 1
. 9 . 3594 . 1 1 26 HIS ND1 N -8.010 7.886 0.841 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_6e5k 1
. 9 . 3595 . 1 1 26 HIS NE2 N -5.885 8.150 0.917 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_6e5k 1
. 9 . 3596 . 1 1 26 HIS O O -9.005 2.670 -0.594 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_6e5k 1
. 9 . 3597 . 1 1 27 CYS C C -12.204 2.337 0.465 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . rr_6e5k 1
. 9 . 3598 . 1 1 27 CYS CA C -10.954 1.789 1.140 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . rr_6e5k 1
. 9 . 3599 . 1 1 27 CYS CB C -11.313 1.086 2.447 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . rr_6e5k 1
. 9 . 3600 . 1 1 27 CYS H H -10.037 3.323 2.260 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . rr_6e5k 1
. 9 . 3601 . 1 1 27 CYS HA H -10.484 1.078 0.480 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . rr_6e5k 1
. 9 . 3602 . 1 1 27 CYS HB2 H -11.867 1.768 3.071 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . rr_6e5k 1
. 9 . 3603 . 1 1 27 CYS HB3 H -11.925 0.226 2.227 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . rr_6e5k 1
. 9 . 3604 . 1 1 27 CYS N N -10.004 2.854 1.400 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . rr_6e5k 1
. 9 . 3605 . 1 1 27 CYS O O -13.188 2.680 1.120 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . rr_6e5k 1
. 9 . 3606 . 1 1 27 CYS SG S -9.861 0.514 3.393 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . rr_6e5k 1
. 9 . 3607 . 1 1 28 NH2 HN1 H -11.341 2.144 -1.313 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . rr_6e5k 1
. 9 . 3608 . 1 1 28 NH2 HN2 H -12.943 2.793 -1.316 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . rr_6e5k 1
. 9 . 3609 . 1 1 28 NH2 N N -12.159 2.435 -0.851 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . rr_6e5k 1
. 10 . 3610 . 1 1 1 ASN C C 9.960 -7.580 -1.245 . . . 1.0 . . . . . . . . . . . . A . 1 ASN C . . . . . . . . . rr_6e5k 1
. 10 . 3611 . 1 1 1 ASN CA C 10.506 -8.797 -0.511 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CA . . . . . . . . . rr_6e5k 1
. 10 . 3612 . 1 1 1 ASN CB C 11.091 -8.376 0.845 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CB . . . . . . . . . rr_6e5k 1
. 10 . 3613 . 1 1 1 ASN CG C 10.038 -7.905 1.841 . . . 1.0 . . . . . . . . . . . . A . 1 ASN CG . . . . . . . . . rr_6e5k 1
. 10 . 3614 . 1 1 1 ASN H1 H 11.928 -10.285 -0.841 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H1 . . . . . . . . . rr_6e5k 1
. 10 . 3615 . 1 1 1 ASN H2 H 12.325 -8.788 -1.518 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H2 . . . . . . . . . rr_6e5k 1
. 10 . 3616 . 1 1 1 ASN H3 H 11.149 -9.753 -2.246 . . . 1.0 . . . . . . . . . . . . A . 1 ASN H3 . . . . . . . . . rr_6e5k 1
. 10 . 3617 . 1 1 1 ASN HA H 9.703 -9.501 -0.352 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HA . . . . . . . . . rr_6e5k 1
. 10 . 3618 . 1 1 1 ASN HB2 H 11.612 -9.215 1.280 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3619 . 1 1 1 ASN HB3 H 11.791 -7.568 0.688 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3620 . 1 1 1 ASN HD21 H 11.145 -8.564 3.353 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD21 . . . . . . . . . rr_6e5k 1
. 10 . 3621 . 1 1 1 ASN HD22 H 9.641 -7.832 3.786 . . . 1.0 . . . . . . . . . . . . A . 1 ASN HD22 . . . . . . . . . rr_6e5k 1
. 10 . 3622 . 1 1 1 ASN N N 11.548 -9.452 -1.334 . . . 1.0 . . . . . . . . . . . . A . 1 ASN N . . . . . . . . . rr_6e5k 1
. 10 . 3623 . 1 1 1 ASN ND2 N 10.300 -8.123 3.121 . . . 1.0 . . . . . . . . . . . . A . 1 ASN ND2 . . . . . . . . . rr_6e5k 1
. 10 . 3624 . 1 1 1 ASN O O 10.687 -6.621 -1.502 . . . 1.0 . . . . . . . . . . . . A . 1 ASN O . . . . . . . . . rr_6e5k 1
. 10 . 3625 . 1 1 1 ASN OD1 O 9.002 -7.354 1.472 . . . 1.0 . . . . . . . . . . . . A . 1 ASN OD1 . . . . . . . . . rr_6e5k 1
. 10 . 3626 . 1 1 2 ASP C C 7.079 -5.816 -1.347 . . . 1.0 . . . . . . . . . . . . A . 2 ASP C . . . . . . . . . rr_6e5k 1
. 10 . 3627 . 1 1 2 ASP CA C 8.037 -6.526 -2.286 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CA . . . . . . . . . rr_6e5k 1
. 10 . 3628 . 1 1 2 ASP CB C 7.283 -7.022 -3.524 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CB . . . . . . . . . rr_6e5k 1
. 10 . 3629 . 1 1 2 ASP CG C 8.193 -7.635 -4.568 . . . 1.0 . . . . . . . . . . . . A . 2 ASP CG . . . . . . . . . rr_6e5k 1
. 10 . 3630 . 1 1 2 ASP H H 8.148 -8.414 -1.346 . . . 1.0 . . . . . . . . . . . . A . 2 ASP H . . . . . . . . . rr_6e5k 1
. 10 . 3631 . 1 1 2 ASP HA H 8.804 -5.832 -2.595 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HA . . . . . . . . . rr_6e5k 1
. 10 . 3632 . 1 1 2 ASP HB2 H 6.566 -7.769 -3.222 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3633 . 1 1 2 ASP HB3 H 6.759 -6.192 -3.972 . . . 1.0 . . . . . . . . . . . . A . 2 ASP HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3634 . 1 1 2 ASP N N 8.680 -7.627 -1.588 . . . 1.0 . . . . . . . . . . . . A . 2 ASP N . . . . . . . . . rr_6e5k 1
. 10 . 3635 . 1 1 2 ASP O O 5.974 -6.304 -1.095 . . . 1.0 . . . . . . . . . . . . A . 2 ASP O . . . . . . . . . rr_6e5k 1
. 10 . 3636 . 1 1 2 ASP OD1 O 8.366 -8.871 -4.554 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD1 . . . . . . . . . rr_6e5k 1
. 10 . 3637 . 1 1 2 ASP OD2 O 8.731 -6.888 -5.410 . . . 1.0 . . . . . . . . . . . . A . 2 ASP OD2 . . . . . . . . . rr_6e5k 1
. 10 . 3638 . 1 1 3 ABA C C 5.338 -3.623 -0.415 . . . 1.0 . . . . . . . . . . . . A . 3 AIB C . . . . . . . . . rr_6e5k 1
. 10 . 3639 . 1 1 3 ABA CA C 6.741 -3.887 0.139 . . . 1.0 . . . . . . . . . . . . A . 3 AIB CA . . . . . . . . . rr_6e5k 1
. 10 . 3640 . 1 1 3 ABA H H 8.402 -4.344 -1.097 . . . 1.0 . . . . . . . . . . . . A . 3 AIB H . . . . . . . . . rr_6e5k 1
. 10 . 3641 . 1 1 3 ABA N N 7.519 -4.674 -0.825 . . . 1.0 . . . . . . . . . . . . A . 3 AIB N . . . . . . . . . rr_6e5k 1
. 10 . 3642 . 1 1 3 ABA O O 4.332 -3.841 0.264 . . . 1.0 . . . . . . . . . . . . A . 3 AIB O . . . . . . . . . rr_6e5k 1
. 10 . 3643 . 1 1 4 CYS C C 3.122 -4.044 -2.447 . . . 1.0 . . . . . . . . . . . . A . 4 CYS C . . . . . . . . . rr_6e5k 1
. 10 . 3644 . 1 1 4 CYS CA C 4.027 -2.827 -2.303 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CA . . . . . . . . . rr_6e5k 1
. 10 . 3645 . 1 1 4 CYS CB C 4.284 -2.201 -3.673 . . . 1.0 . . . . . . . . . . . . A . 4 CYS CB . . . . . . . . . rr_6e5k 1
. 10 . 3646 . 1 1 4 CYS H H 6.122 -3.088 -2.173 . . . 1.0 . . . . . . . . . . . . A . 4 CYS H . . . . . . . . . rr_6e5k 1
. 10 . 3647 . 1 1 4 CYS HA H 3.533 -2.103 -1.677 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HA . . . . . . . . . rr_6e5k 1
. 10 . 3648 . 1 1 4 CYS HB2 H 5.025 -1.424 -3.574 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3649 . 1 1 4 CYS HB3 H 4.653 -2.960 -4.345 . . . 1.0 . . . . . . . . . . . . A . 4 CYS HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3650 . 1 1 4 CYS N N 5.286 -3.181 -1.665 . . . 1.0 . . . . . . . . . . . . A . 4 CYS N . . . . . . . . . rr_6e5k 1
. 10 . 3651 . 1 1 4 CYS O O 1.902 -3.940 -2.309 . . . 1.0 . . . . . . . . . . . . A . 4 CYS O . . . . . . . . . rr_6e5k 1
. 10 . 3652 . 1 1 4 CYS SG S 2.809 -1.461 -4.437 . . . 1.0 . . . . . . . . . . . . A . 4 CYS SG . . . . . . . . . rr_6e5k 1
. 10 . 3653 . 1 1 5 LYS C C 2.353 -6.835 -1.526 . . . 1.0 . . . . . . . . . . . . A . 5 LYS C . . . . . . . . . rr_6e5k 1
. 10 . 3654 . 1 1 5 LYS CA C 2.953 -6.427 -2.864 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CA . . . . . . . . . rr_6e5k 1
. 10 . 3655 . 1 1 5 LYS CB C 3.832 -7.557 -3.404 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CB . . . . . . . . . rr_6e5k 1
. 10 . 3656 . 1 1 5 LYS CD C 3.999 -10.001 -4.008 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CD . . . . . . . . . rr_6e5k 1
. 10 . 3657 . 1 1 5 LYS CE C 4.799 -10.403 -2.778 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CE . . . . . . . . . rr_6e5k 1
. 10 . 3658 . 1 1 5 LYS CG C 3.065 -8.838 -3.710 . . . 1.0 . . . . . . . . . . . . A . 5 LYS CG . . . . . . . . . rr_6e5k 1
. 10 . 3659 . 1 1 5 LYS H H 4.695 -5.226 -2.786 . . . 1.0 . . . . . . . . . . . . A . 5 LYS H . . . . . . . . . rr_6e5k 1
. 10 . 3660 . 1 1 5 LYS HA H 2.153 -6.232 -3.560 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HA . . . . . . . . . rr_6e5k 1
. 10 . 3661 . 1 1 5 LYS HB2 H 4.311 -7.223 -4.312 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3662 . 1 1 5 LYS HB3 H 4.591 -7.786 -2.671 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3663 . 1 1 5 LYS HD2 H 3.412 -10.847 -4.335 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD2 . . . . . . . . . rr_6e5k 1
. 10 . 3664 . 1 1 5 LYS HD3 H 4.681 -9.709 -4.792 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HD3 . . . . . . . . . rr_6e5k 1
. 10 . 3665 . 1 1 5 LYS HE2 H 5.457 -9.590 -2.509 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE2 . . . . . . . . . rr_6e5k 1
. 10 . 3666 . 1 1 5 LYS HE3 H 4.113 -10.592 -1.965 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HE3 . . . . . . . . . rr_6e5k 1
. 10 . 3667 . 1 1 5 LYS HG2 H 2.454 -9.092 -2.856 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG2 . . . . . . . . . rr_6e5k 1
. 10 . 3668 . 1 1 5 LYS HG3 H 2.430 -8.670 -4.569 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HG3 . . . . . . . . . rr_6e5k 1
. 10 . 3669 . 1 1 5 LYS HZ1 H 6.334 -11.436 -3.743 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 10 . 3670 . 1 1 5 LYS HZ2 H 5.011 -12.403 -3.335 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 10 . 3671 . 1 1 5 LYS HZ3 H 6.094 -11.909 -2.139 . . . 1.0 . . . . . . . . . . . . A . 5 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 10 . 3672 . 1 1 5 LYS N N 3.720 -5.199 -2.708 . . . 1.0 . . . . . . . . . . . . A . 5 LYS N . . . . . . . . . rr_6e5k 1
. 10 . 3673 . 1 1 5 LYS NZ N 5.616 -11.622 -3.016 . . . 1.0 . . . . . . . . . . . . A . 5 LYS NZ . . . . . . . . . rr_6e5k 1
. 10 . 3674 . 1 1 5 LYS O O 1.170 -7.158 -1.445 . . . 1.0 . . . . . . . . . . . . A . 5 LYS O . . . . . . . . . rr_6e5k 1
. 10 . 3675 . 1 1 6 ABA C C 1.590 -6.255 1.284 . . . 1.0 . . . . . . . . . . . . A . 6 AIB C . . . . . . . . . rr_6e5k 1
. 10 . 3676 . 1 1 6 ABA CA C 2.763 -7.148 0.875 . . . 1.0 . . . . . . . . . . . . A . 6 AIB CA . . . . . . . . . rr_6e5k 1
. 10 . 3677 . 1 1 6 ABA H H 4.115 -6.510 -0.633 . . . 1.0 . . . . . . . . . . . . A . 6 AIB H . . . . . . . . . rr_6e5k 1
. 10 . 3678 . 1 1 6 ABA N N 3.185 -6.794 -0.485 . . . 1.0 . . . . . . . . . . . . A . 6 AIB N . . . . . . . . . rr_6e5k 1
. 10 . 3679 . 1 1 6 ABA O O 0.577 -6.732 1.797 . . . 1.0 . . . . . . . . . . . . A . 6 AIB O . . . . . . . . . rr_6e5k 1
. 10 . 3680 . 1 1 7 LEU C C -0.567 -4.223 0.597 . . . 1.0 . . . . . . . . . . . . A . 7 LEU C . . . . . . . . . rr_6e5k 1
. 10 . 3681 . 1 1 7 LEU CA C 0.704 -3.991 1.398 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CA . . . . . . . . . rr_6e5k 1
. 10 . 3682 . 1 1 7 LEU CB C 1.200 -2.564 1.167 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CB . . . . . . . . . rr_6e5k 1
. 10 . 3683 . 1 1 7 LEU CD1 C 2.927 -0.794 1.545 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD1 . . . . . . . . . rr_6e5k 1
. 10 . 3684 . 1 1 7 LEU CD2 C 2.080 -2.130 3.471 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CD2 . . . . . . . . . rr_6e5k 1
. 10 . 3685 . 1 1 7 LEU CG C 2.422 -2.155 1.991 . . . 1.0 . . . . . . . . . . . . A . 7 LEU CG . . . . . . . . . rr_6e5k 1
. 10 . 3686 . 1 1 7 LEU H H 2.556 -4.638 0.599 . . . 1.0 . . . . . . . . . . . . A . 7 LEU H . . . . . . . . . rr_6e5k 1
. 10 . 3687 . 1 1 7 LEU HA H 0.483 -4.121 2.445 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HA . . . . . . . . . rr_6e5k 1
. 10 . 3688 . 1 1 7 LEU HB2 H 1.442 -2.458 0.121 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3689 . 1 1 7 LEU HB3 H 0.394 -1.885 1.402 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3690 . 1 1 7 LEU HD11 H 3.775 -0.509 2.150 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD11 . . . . . . . . . rr_6e5k 1
. 10 . 3691 . 1 1 7 LEU HD12 H 2.138 -0.065 1.663 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD12 . . . . . . . . . rr_6e5k 1
. 10 . 3692 . 1 1 7 LEU HD13 H 3.224 -0.839 0.508 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD13 . . . . . . . . . rr_6e5k 1
. 10 . 3693 . 1 1 7 LEU HD21 H 1.807 -3.123 3.795 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD21 . . . . . . . . . rr_6e5k 1
. 10 . 3694 . 1 1 7 LEU HD22 H 1.251 -1.459 3.634 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD22 . . . . . . . . . rr_6e5k 1
. 10 . 3695 . 1 1 7 LEU HD23 H 2.935 -1.789 4.033 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HD23 . . . . . . . . . rr_6e5k 1
. 10 . 3696 . 1 1 7 LEU HG H 3.213 -2.876 1.837 . . . 1.0 . . . . . . . . . . . . A . 7 LEU HG . . . . . . . . . rr_6e5k 1
. 10 . 3697 . 1 1 7 LEU N N 1.732 -4.955 1.037 . . . 1.0 . . . . . . . . . . . . A . 7 LEU N . . . . . . . . . rr_6e5k 1
. 10 . 3698 . 1 1 7 LEU O O -1.667 -4.186 1.142 . . . 1.0 . . . . . . . . . . . . A . 7 LEU O . . . . . . . . . rr_6e5k 1
. 10 . 3699 . 1 1 8 LYS C C -2.336 -5.922 -1.104 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . rr_6e5k 1
. 10 . 3700 . 1 1 8 LYS CA C -1.544 -4.709 -1.572 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . rr_6e5k 1
. 10 . 3701 . 1 1 8 LYS CB C -1.068 -4.912 -3.012 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . rr_6e5k 1
. 10 . 3702 . 1 1 8 LYS CD C -1.653 -5.409 -5.402 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . rr_6e5k 1
. 10 . 3703 . 1 1 8 LYS CE C -2.767 -5.740 -6.384 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . rr_6e5k 1
. 10 . 3704 . 1 1 8 LYS CG C -2.187 -5.223 -3.992 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . rr_6e5k 1
. 10 . 3705 . 1 1 8 LYS H H 0.503 -4.489 -1.070 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . rr_6e5k 1
. 10 . 3706 . 1 1 8 LYS HA H -2.181 -3.840 -1.530 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . rr_6e5k 1
. 10 . 3707 . 1 1 8 LYS HB2 H -0.570 -4.014 -3.344 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3708 . 1 1 8 LYS HB3 H -0.363 -5.731 -3.034 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3709 . 1 1 8 LYS HD2 H -1.169 -4.497 -5.716 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . rr_6e5k 1
. 10 . 3710 . 1 1 8 LYS HD3 H -0.935 -6.217 -5.400 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . rr_6e5k 1
. 10 . 3711 . 1 1 8 LYS HE2 H -3.519 -4.968 -6.330 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . rr_6e5k 1
. 10 . 3712 . 1 1 8 LYS HE3 H -2.353 -5.769 -7.380 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . rr_6e5k 1
. 10 . 3713 . 1 1 8 LYS HG2 H -2.680 -6.132 -3.683 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . rr_6e5k 1
. 10 . 3714 . 1 1 8 LYS HG3 H -2.895 -4.407 -3.989 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . rr_6e5k 1
. 10 . 3715 . 1 1 8 LYS HZ1 H -4.146 -7.253 -6.782 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . rr_6e5k 1
. 10 . 3716 . 1 1 8 LYS HZ2 H -3.825 -7.041 -5.137 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . rr_6e5k 1
. 10 . 3717 . 1 1 8 LYS HZ3 H -2.692 -7.810 -6.128 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . rr_6e5k 1
. 10 . 3718 . 1 1 8 LYS N N -0.407 -4.470 -0.695 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . rr_6e5k 1
. 10 . 3719 . 1 1 8 LYS NZ N -3.402 -7.051 -6.087 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . rr_6e5k 1
. 10 . 3720 . 1 1 8 LYS O O -3.560 -5.858 -0.972 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . rr_6e5k 1
. 10 . 3721 . 1 1 9 ABA C C -2.868 -8.045 0.995 . . . 1.0 . . . . . . . . . . . . A . 9 AIB C . . . . . . . . . rr_6e5k 1
. 10 . 3722 . 1 1 9 ABA CA C -2.211 -8.265 -0.373 . . . 1.0 . . . . . . . . . . . . A . 9 AIB CA . . . . . . . . . rr_6e5k 1
. 10 . 3723 . 1 1 9 ABA H H -0.641 -6.965 -0.957 . . . 1.0 . . . . . . . . . . . . A . 9 AIB H . . . . . . . . . rr_6e5k 1
. 10 . 3724 . 1 1 9 ABA N N -1.617 -7.008 -0.838 . . . 1.0 . . . . . . . . . . . . A . 9 AIB N . . . . . . . . . rr_6e5k 1
. 10 . 3725 . 1 1 9 ABA O O -3.926 -8.603 1.293 . . . 1.0 . . . . . . . . . . . . A . 9 AIB O . . . . . . . . . rr_6e5k 1
. 10 . 3726 . 1 1 10 ARG C C -4.011 -6.188 3.135 . . . 1.0 . . . . . . . . . . . . A . 10 ARG C . . . . . . . . . rr_6e5k 1
. 10 . 3727 . 1 1 10 ARG CA C -2.693 -6.953 3.171 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CA . . . . . . . . . rr_6e5k 1
. 10 . 3728 . 1 1 10 ARG CB C -1.633 -6.151 3.928 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CB . . . . . . . . . rr_6e5k 1
. 10 . 3729 . 1 1 10 ARG CD C -0.811 -5.190 6.088 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CD . . . . . . . . . rr_6e5k 1
. 10 . 3730 . 1 1 10 ARG CG C -1.958 -5.904 5.390 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CG . . . . . . . . . rr_6e5k 1
. 10 . 3731 . 1 1 10 ARG CZ C 1.654 -5.402 6.154 . . . 1.0 . . . . . . . . . . . . A . 10 ARG CZ . . . . . . . . . rr_6e5k 1
. 10 . 3732 . 1 1 10 ARG H H -1.383 -6.810 1.518 . . . 1.0 . . . . . . . . . . . . A . 10 ARG H . . . . . . . . . rr_6e5k 1
. 10 . 3733 . 1 1 10 ARG HA H -2.849 -7.893 3.671 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HA . . . . . . . . . rr_6e5k 1
. 10 . 3734 . 1 1 10 ARG HB2 H -0.696 -6.684 3.878 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3735 . 1 1 10 ARG HB3 H -1.512 -5.192 3.444 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3736 . 1 1 10 ARG HD2 H -0.678 -4.220 5.632 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD2 . . . . . . . . . rr_6e5k 1
. 10 . 3737 . 1 1 10 ARG HD3 H -1.061 -5.065 7.131 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HD3 . . . . . . . . . rr_6e5k 1
. 10 . 3738 . 1 1 10 ARG HE H 0.383 -6.899 5.772 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HE . . . . . . . . . rr_6e5k 1
. 10 . 3739 . 1 1 10 ARG HG2 H -2.845 -5.292 5.451 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG2 . . . . . . . . . rr_6e5k 1
. 10 . 3740 . 1 1 10 ARG HG3 H -2.135 -6.851 5.877 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HG3 . . . . . . . . . rr_6e5k 1
. 10 . 3741 . 1 1 10 ARG HH11 H 2.698 -3.714 6.576 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH11 . . . . . . . . . rr_6e5k 1
. 10 . 3742 . 1 1 10 ARG HH12 H 0.971 -3.538 6.555 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH12 . . . . . . . . . rr_6e5k 1
. 10 . 3743 . 1 1 10 ARG HH21 H 2.645 -7.137 5.808 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH21 . . . . . . . . . rr_6e5k 1
. 10 . 3744 . 1 1 10 ARG HH22 H 3.648 -5.764 6.157 . . . 1.0 . . . . . . . . . . . . A . 10 ARG HH22 . . . . . . . . . rr_6e5k 1
. 10 . 3745 . 1 1 10 ARG N N -2.218 -7.233 1.823 . . . 1.0 . . . . . . . . . . . . A . 10 ARG N . . . . . . . . . rr_6e5k 1
. 10 . 3746 . 1 1 10 ARG NE N 0.446 -5.938 5.983 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NE . . . . . . . . . rr_6e5k 1
. 10 . 3747 . 1 1 10 ARG NH1 N 1.782 -4.115 6.449 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH1 . . . . . . . . . rr_6e5k 1
. 10 . 3748 . 1 1 10 ARG NH2 N 2.734 -6.161 6.028 . . . 1.0 . . . . . . . . . . . . A . 10 ARG NH2 . . . . . . . . . rr_6e5k 1
. 10 . 3749 . 1 1 10 ARG O O -4.971 -6.548 3.816 . . . 1.0 . . . . . . . . . . . . A . 10 ARG O . . . . . . . . . rr_6e5k 1
. 10 . 3750 . 1 1 11 TYR C C -6.165 -4.874 1.123 . . . 1.0 . . . . . . . . . . . . A . 11 TYR C . . . . . . . . . rr_6e5k 1
. 10 . 3751 . 1 1 11 TYR CA C -5.241 -4.317 2.198 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CA . . . . . . . . . rr_6e5k 1
. 10 . 3752 . 1 1 11 TYR CB C -4.835 -2.875 1.896 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CB . . . . . . . . . rr_6e5k 1
. 10 . 3753 . 1 1 11 TYR CD1 C -4.867 -1.609 4.074 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD1 . . . . . . . . . rr_6e5k 1
. 10 . 3754 . 1 1 11 TYR CD2 C -2.751 -2.218 3.166 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CD2 . . . . . . . . . rr_6e5k 1
. 10 . 3755 . 1 1 11 TYR CE1 C -4.241 -1.026 5.156 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE1 . . . . . . . . . rr_6e5k 1
. 10 . 3756 . 1 1 11 TYR CE2 C -2.116 -1.633 4.244 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CE2 . . . . . . . . . rr_6e5k 1
. 10 . 3757 . 1 1 11 TYR CG C -4.137 -2.214 3.062 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CG . . . . . . . . . rr_6e5k 1
. 10 . 3758 . 1 1 11 TYR CZ C -2.866 -1.040 5.238 . . . 1.0 . . . . . . . . . . . . A . 11 TYR CZ . . . . . . . . . rr_6e5k 1
. 10 . 3759 . 1 1 11 TYR H H -3.268 -4.937 1.771 . . . 1.0 . . . . . . . . . . . . A . 11 TYR H . . . . . . . . . rr_6e5k 1
. 10 . 3760 . 1 1 11 TYR HA H -5.758 -4.342 3.145 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HA . . . . . . . . . rr_6e5k 1
. 10 . 3761 . 1 1 11 TYR HB2 H -4.161 -2.863 1.052 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3762 . 1 1 11 TYR HB3 H -5.713 -2.299 1.661 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3763 . 1 1 11 TYR HD1 H -5.944 -1.598 4.008 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD1 . . . . . . . . . rr_6e5k 1
. 10 . 3764 . 1 1 11 TYR HD2 H -2.167 -2.682 2.384 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HD2 . . . . . . . . . rr_6e5k 1
. 10 . 3765 . 1 1 11 TYR HE1 H -4.828 -0.561 5.930 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE1 . . . . . . . . . rr_6e5k 1
. 10 . 3766 . 1 1 11 TYR HE2 H -1.038 -1.646 4.304 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HE2 . . . . . . . . . rr_6e5k 1
. 10 . 3767 . 1 1 11 TYR HH H -2.730 -0.694 7.128 . . . 1.0 . . . . . . . . . . . . A . 11 TYR HH . . . . . . . . . rr_6e5k 1
. 10 . 3768 . 1 1 11 TYR N N -4.056 -5.148 2.320 . . . 1.0 . . . . . . . . . . . . A . 11 TYR N . . . . . . . . . rr_6e5k 1
. 10 . 3769 . 1 1 11 TYR O O -6.471 -4.209 0.135 . . . 1.0 . . . . . . . . . . . . A . 11 TYR O . . . . . . . . . rr_6e5k 1
. 10 . 3770 . 1 1 11 TYR OH O -2.244 -0.465 6.325 . . . 1.0 . . . . . . . . . . . . A . 11 TYR OH . . . . . . . . . rr_6e5k 1
. 10 . 3771 . 1 1 12 ABA C C -8.657 -6.084 -0.046 . . . 1.0 . . . . . . . . . . . . A . 12 AIB C . . . . . . . . . rr_6e5k 1
. 10 . 3772 . 1 1 12 ABA CA C -7.418 -6.872 0.396 . . . 1.0 . . . . . . . . . . . . A . 12 AIB CA . . . . . . . . . rr_6e5k 1
. 10 . 3773 . 1 1 12 ABA H H -6.367 -6.527 2.208 . . . 1.0 . . . . . . . . . . . . A . 12 AIB H . . . . . . . . . rr_6e5k 1
. 10 . 3774 . 1 1 12 ABA N N -6.606 -6.106 1.354 . . . 1.0 . . . . . . . . . . . . A . 12 AIB N . . . . . . . . . rr_6e5k 1
. 10 . 3775 . 1 1 12 ABA O O -9.123 -6.232 -1.177 . . . 1.0 . . . . . . . . . . . . A . 12 AIB O . . . . . . . . . rr_6e5k 1
. 10 . 3776 . 1 1 13 GLY C C -10.199 -3.052 0.389 . . . 1.0 . . . . . . . . . . . . A . 13 GLY C . . . . . . . . . rr_6e5k 1
. 10 . 3777 . 1 1 13 GLY CA C -10.408 -4.544 0.535 . . . 1.0 . . . . . . . . . . . . A . 13 GLY CA . . . . . . . . . rr_6e5k 1
. 10 . 3778 . 1 1 13 GLY H H -8.760 -5.148 1.716 . . . 1.0 . . . . . . . . . . . . A . 13 GLY H . . . . . . . . . rr_6e5k 1
. 10 . 3779 . 1 1 13 GLY HA2 H -10.815 -4.928 -0.388 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA2 . . . . . . . . . rr_6e5k 1
. 10 . 3780 . 1 1 13 GLY HA3 H -11.121 -4.718 1.326 . . . 1.0 . . . . . . . . . . . . A . 13 GLY HA3 . . . . . . . . . rr_6e5k 1
. 10 . 3781 . 1 1 13 GLY N N -9.192 -5.264 0.842 . . . 1.0 . . . . . . . . . . . . A . 13 GLY N . . . . . . . . . rr_6e5k 1
. 10 . 3782 . 1 1 13 GLY O O -11.157 -2.281 0.444 . . . 1.0 . . . . . . . . . . . . A . 13 GLY O . . . . . . . . . rr_6e5k 1
. 10 . 3783 . 1 1 14 CYS C C -7.551 -0.994 -0.952 . . . 1.0 . . . . . . . . . . . . A . 14 CYS C . . . . . . . . . rr_6e5k 1
. 10 . 3784 . 1 1 14 CYS CA C -8.651 -1.217 0.078 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CA . . . . . . . . . rr_6e5k 1
. 10 . 3785 . 1 1 14 CYS CB C -8.214 -0.645 1.431 . . . 1.0 . . . . . . . . . . . . A . 14 CYS CB . . . . . . . . . rr_6e5k 1
. 10 . 3786 . 1 1 14 CYS H H -8.224 -3.291 0.147 . . . 1.0 . . . . . . . . . . . . A . 14 CYS H . . . . . . . . . rr_6e5k 1
. 10 . 3787 . 1 1 14 CYS HA H -9.546 -0.711 -0.247 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HA . . . . . . . . . rr_6e5k 1
. 10 . 3788 . 1 1 14 CYS HB2 H -7.259 -1.062 1.693 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3789 . 1 1 14 CYS HB3 H -8.116 0.428 1.339 . . . 1.0 . . . . . . . . . . . . A . 14 CYS HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3790 . 1 1 14 CYS N N -8.956 -2.634 0.206 . . . 1.0 . . . . . . . . . . . . A . 14 CYS N . . . . . . . . . rr_6e5k 1
. 10 . 3791 . 1 1 14 CYS O O -6.724 -1.871 -1.197 . . . 1.0 . . . . . . . . . . . . A . 14 CYS O . . . . . . . . . rr_6e5k 1
. 10 . 3792 . 1 1 14 CYS SG S -9.361 -0.982 2.811 . . . 1.0 . . . . . . . . . . . . A . 14 CYS SG . . . . . . . . . rr_6e5k 1
. 10 . 3793 . 1 1 15 GLU C C -5.303 1.075 -1.712 . . . 1.0 . . . . . . . . . . . . A . 15 GLU C . . . . . . . . . rr_6e5k 1
. 10 . 3794 . 1 1 15 GLU CA C -6.501 0.555 -2.491 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CA . . . . . . . . . rr_6e5k 1
. 10 . 3795 . 1 1 15 GLU CB C -6.998 1.632 -3.458 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CB . . . . . . . . . rr_6e5k 1
. 10 . 3796 . 1 1 15 GLU CD C -8.607 2.277 -5.276 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CD . . . . . . . . . rr_6e5k 1
. 10 . 3797 . 1 1 15 GLU CG C -8.124 1.174 -4.364 . . . 1.0 . . . . . . . . . . . . A . 15 GLU CG . . . . . . . . . rr_6e5k 1
. 10 . 3798 . 1 1 15 GLU H H -8.275 0.820 -1.372 . . . 1.0 . . . . . . . . . . . . A . 15 GLU H . . . . . . . . . rr_6e5k 1
. 10 . 3799 . 1 1 15 GLU HA H -6.210 -0.322 -3.046 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HA . . . . . . . . . rr_6e5k 1
. 10 . 3800 . 1 1 15 GLU HB2 H -7.350 2.477 -2.885 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3801 . 1 1 15 GLU HB3 H -6.173 1.950 -4.079 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3802 . 1 1 15 GLU HG2 H -7.771 0.354 -4.970 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG2 . . . . . . . . . rr_6e5k 1
. 10 . 3803 . 1 1 15 GLU HG3 H -8.949 0.841 -3.754 . . . 1.0 . . . . . . . . . . . . A . 15 GLU HG3 . . . . . . . . . rr_6e5k 1
. 10 . 3804 . 1 1 15 GLU N N -7.552 0.182 -1.561 . . . 1.0 . . . . . . . . . . . . A . 15 GLU N . . . . . . . . . rr_6e5k 1
. 10 . 3805 . 1 1 15 GLU O O -5.478 1.690 -0.662 . . . 1.0 . . . . . . . . . . . . A . 15 GLU O . . . . . . . . . rr_6e5k 1
. 10 . 3806 . 1 1 15 GLU OE1 O -9.497 3.051 -4.865 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE1 . . . . . . . . . rr_6e5k 1
. 10 . 3807 . 1 1 15 GLU OE2 O -8.112 2.366 -6.421 . . . 1.0 . . . . . . . . . . . . A . 15 GLU OE2 . . . . . . . . . rr_6e5k 1
. 10 . 3808 . 1 1 16 MVA C C -1.752 1.770 -2.372 . . . 1.0 . . . . . . . . . . . . A . 16 MVA C . . . . . . . . . rr_6e5k 1
. 10 . 3809 . 1 1 16 MVA CA C -2.889 1.314 -1.453 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CA . . . . . . . . . rr_6e5k 1
. 10 . 3810 . 1 1 16 MVA CB C -2.368 0.241 -0.447 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CB . . . . . . . . . rr_6e5k 1
. 10 . 3811 . 1 1 16 MVA CG1 C -2.120 -1.105 -1.105 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG1 . . . . . . . . . rr_6e5k 1
. 10 . 3812 . 1 1 16 MVA CG2 C -1.103 0.729 0.238 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CG2 . . . . . . . . . rr_6e5k 1
. 10 . 3813 . 1 1 16 MVA CN C -3.916 0.165 -3.499 . . . 1.0 . . . . . . . . . . . . A . 16 MVA CN . . . . . . . . . rr_6e5k 1
. 10 . 3814 . 1 1 16 MVA HA H -3.170 2.178 -0.861 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HA . . . . . . . . . rr_6e5k 1
. 10 . 3815 . 1 1 16 MVA HB H -3.122 0.101 0.313 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HB . . . . . . . . . rr_6e5k 1
. 10 . 3816 . 1 1 16 MVA HG11 H -1.716 -1.790 -0.375 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG11 . . . . . . . . . rr_6e5k 1
. 10 . 3817 . 1 1 16 MVA HG12 H -1.417 -0.984 -1.915 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG12 . . . . . . . . . rr_6e5k 1
. 10 . 3818 . 1 1 16 MVA HG13 H -3.051 -1.493 -1.488 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG13 . . . . . . . . . rr_6e5k 1
. 10 . 3819 . 1 1 16 MVA HG21 H -1.295 1.680 0.712 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG21 . . . . . . . . . rr_6e5k 1
. 10 . 3820 . 1 1 16 MVA HG22 H -0.319 0.846 -0.498 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG22 . . . . . . . . . rr_6e5k 1
. 10 . 3821 . 1 1 16 MVA HG23 H -0.795 0.010 0.983 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HG23 . . . . . . . . . rr_6e5k 1
. 10 . 3822 . 1 1 16 MVA HN1 H -4.575 0.614 -4.226 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN1 . . . . . . . . . rr_6e5k 1
. 10 . 3823 . 1 1 16 MVA HN2 H -4.161 -0.881 -3.387 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN2 . . . . . . . . . rr_6e5k 1
. 10 . 3824 . 1 1 16 MVA HN3 H -2.894 0.261 -3.835 . . . 1.0 . . . . . . . . . . . . A . 16 MVA HN3 . . . . . . . . . rr_6e5k 1
. 10 . 3825 . 1 1 16 MVA N N -4.074 0.853 -2.196 . . . 1.0 . . . . . . . . . . . . A . 16 MVA N . . . . . . . . . rr_6e5k 1
. 10 . 3826 . 1 1 16 MVA O O -1.103 0.973 -3.055 . . . 1.0 . . . . . . . . . . . . A . 16 MVA O . . . . . . . . . rr_6e5k 1
. 10 . 3827 . 1 1 17 ARG C C 0.851 3.495 -2.416 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . rr_6e5k 1
. 10 . 3828 . 1 1 17 ARG CA C -0.456 3.662 -3.162 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . rr_6e5k 1
. 10 . 3829 . 1 1 17 ARG CB C -0.725 5.144 -3.417 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . rr_6e5k 1
. 10 . 3830 . 1 1 17 ARG CD C -2.574 4.622 -5.046 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . rr_6e5k 1
. 10 . 3831 . 1 1 17 ARG CG C -2.153 5.440 -3.834 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . rr_6e5k 1
. 10 . 3832 . 1 1 17 ARG CZ C -4.735 3.887 -5.983 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . rr_6e5k 1
. 10 . 3833 . 1 1 17 ARG H H -2.069 3.655 -1.802 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . rr_6e5k 1
. 10 . 3834 . 1 1 17 ARG HA H -0.402 3.136 -4.102 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . rr_6e5k 1
. 10 . 3835 . 1 1 17 ARG HB2 H -0.516 5.695 -2.514 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3836 . 1 1 17 ARG HB3 H -0.064 5.488 -4.198 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3837 . 1 1 17 ARG HD2 H -1.998 4.939 -5.903 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . rr_6e5k 1
. 10 . 3838 . 1 1 17 ARG HD3 H -2.374 3.579 -4.847 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . rr_6e5k 1
. 10 . 3839 . 1 1 17 ARG HE H -4.427 5.614 -5.026 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . rr_6e5k 1
. 10 . 3840 . 1 1 17 ARG HG2 H -2.809 5.206 -3.010 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . rr_6e5k 1
. 10 . 3841 . 1 1 17 ARG HG3 H -2.233 6.491 -4.072 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . rr_6e5k 1
. 10 . 3842 . 1 1 17 ARG HH11 H -4.753 2.090 -6.926 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . rr_6e5k 1
. 10 . 3843 . 1 1 17 ARG HH12 H -3.207 2.595 -6.315 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . rr_6e5k 1
. 10 . 3844 . 1 1 17 ARG HH21 H -6.441 4.966 -5.829 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . rr_6e5k 1
. 10 . 3845 . 1 1 17 ARG HH22 H -6.603 3.438 -6.641 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . rr_6e5k 1
. 10 . 3846 . 1 1 17 ARG N N -1.519 3.074 -2.372 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . rr_6e5k 1
. 10 . 3847 . 1 1 17 ARG NE N -3.996 4.784 -5.340 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . rr_6e5k 1
. 10 . 3848 . 1 1 17 ARG NH1 N -4.188 2.766 -6.441 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . rr_6e5k 1
. 10 . 3849 . 1 1 17 ARG NH2 N -6.026 4.117 -6.171 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . rr_6e5k 1
. 10 . 3850 . 1 1 17 ARG O O 1.028 4.046 -1.327 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . rr_6e5k 1
. 10 . 3851 . 1 1 18 CYS C C 4.127 3.296 -2.725 . . . 1.0 . . . . . . . . . . . . A . 18 CYS C . . . . . . . . . rr_6e5k 1
. 10 . 3852 . 1 1 18 CYS CA C 2.984 2.377 -2.317 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CA . . . . . . . . . rr_6e5k 1
. 10 . 3853 . 1 1 18 CYS CB C 3.334 0.928 -2.632 . . . 1.0 . . . . . . . . . . . . A . 18 CYS CB . . . . . . . . . rr_6e5k 1
. 10 . 3854 . 1 1 18 CYS H H 1.584 2.388 -3.892 . . . 1.0 . . . . . . . . . . . . A . 18 CYS H . . . . . . . . . rr_6e5k 1
. 10 . 3855 . 1 1 18 CYS HA H 2.821 2.475 -1.254 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HA . . . . . . . . . rr_6e5k 1
. 10 . 3856 . 1 1 18 CYS HB2 H 4.347 0.732 -2.316 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3857 . 1 1 18 CYS HB3 H 2.659 0.275 -2.098 . . . 1.0 . . . . . . . . . . . . A . 18 CYS HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3858 . 1 1 18 CYS N N 1.749 2.727 -2.987 . . . 1.0 . . . . . . . . . . . . A . 18 CYS N . . . . . . . . . rr_6e5k 1
. 10 . 3859 . 1 1 18 CYS O O 4.314 3.599 -3.904 . . . 1.0 . . . . . . . . . . . . A . 18 CYS O . . . . . . . . . rr_6e5k 1
. 10 . 3860 . 1 1 18 CYS SG S 3.216 0.524 -4.404 . . . 1.0 . . . . . . . . . . . . A . 18 CYS SG . . . . . . . . . rr_6e5k 1
. 10 . 3861 . 1 1 19 ASP C C 7.167 4.014 -1.025 . . . 1.0 . . . . . . . . . . . . A . 19 ASP C . . . . . . . . . rr_6e5k 1
. 10 . 3862 . 1 1 19 ASP CA C 6.076 4.526 -1.956 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CA . . . . . . . . . rr_6e5k 1
. 10 . 3863 . 1 1 19 ASP CB C 5.809 6.012 -1.713 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CB . . . . . . . . . rr_6e5k 1
. 10 . 3864 . 1 1 19 ASP CG C 6.968 6.890 -2.142 . . . 1.0 . . . . . . . . . . . . A . 19 ASP CG . . . . . . . . . rr_6e5k 1
. 10 . 3865 . 1 1 19 ASP H H 4.613 3.535 -0.809 . . . 1.0 . . . . . . . . . . . . A . 19 ASP H . . . . . . . . . rr_6e5k 1
. 10 . 3866 . 1 1 19 ASP HA H 6.386 4.380 -2.980 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HA . . . . . . . . . rr_6e5k 1
. 10 . 3867 . 1 1 19 ASP HB2 H 4.933 6.310 -2.267 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3868 . 1 1 19 ASP HB3 H 5.634 6.171 -0.659 . . . 1.0 . . . . . . . . . . . . A . 19 ASP HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3869 . 1 1 19 ASP N N 4.874 3.744 -1.734 . . . 1.0 . . . . . . . . . . . . A . 19 ASP N . . . . . . . . . rr_6e5k 1
. 10 . 3870 . 1 1 19 ASP O O 7.409 4.581 0.047 . . . 1.0 . . . . . . . . . . . . A . 19 ASP O . . . . . . . . . rr_6e5k 1
. 10 . 3871 . 1 1 19 ASP OD1 O 7.531 7.602 -1.284 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD1 . . . . . . . . . rr_6e5k 1
. 10 . 3872 . 1 1 19 ASP OD2 O 7.342 6.856 -3.333 . . . 1.0 . . . . . . . . . . . . A . 19 ASP OD2 . . . . . . . . . rr_6e5k 1
. 10 . 3873 . 1 1 20 DPR C C 8.166 1.754 0.750 . . . 1.0 . . . . . . . . . . . . A . 20 DPR C . . . . . . . . . rr_6e5k 1
. 10 . 3874 . 1 1 20 DPR CA C 8.793 2.221 -0.561 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CA . . . . . . . . . rr_6e5k 1
. 10 . 3875 . 1 1 20 DPR CB C 9.240 1.019 -1.396 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CB . . . . . . . . . rr_6e5k 1
. 10 . 3876 . 1 1 20 DPR CD C 7.643 2.218 -2.701 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CD . . . . . . . . . rr_6e5k 1
. 10 . 3877 . 1 1 20 DPR CG C 8.865 1.354 -2.797 . . . 1.0 . . . . . . . . . . . . A . 20 DPR CG . . . . . . . . . rr_6e5k 1
. 10 . 3878 . 1 1 20 DPR HA H 9.645 2.848 -0.354 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HA . . . . . . . . . rr_6e5k 1
. 10 . 3879 . 1 1 20 DPR HB2 H 10.307 0.885 -1.293 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3880 . 1 1 20 DPR HB3 H 8.727 0.133 -1.054 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3881 . 1 1 20 DPR HD2 H 7.621 2.928 -3.512 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD2 . . . . . . . . . rr_6e5k 1
. 10 . 3882 . 1 1 20 DPR HD3 H 6.749 1.613 -2.701 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HD3 . . . . . . . . . rr_6e5k 1
. 10 . 3883 . 1 1 20 DPR HG2 H 9.668 1.895 -3.276 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG2 . . . . . . . . . rr_6e5k 1
. 10 . 3884 . 1 1 20 DPR HG3 H 8.643 0.450 -3.344 . . . 1.0 . . . . . . . . . . . . A . 20 DPR HG3 . . . . . . . . . rr_6e5k 1
. 10 . 3885 . 1 1 20 DPR N N 7.812 2.900 -1.408 . . . 1.0 . . . . . . . . . . . . A . 20 DPR N . . . . . . . . . rr_6e5k 1
. 10 . 3886 . 1 1 20 DPR O O 7.215 0.970 0.747 . . . 1.0 . . . . . . . . . . . . A . 20 DPR O . . . . . . . . . rr_6e5k 1
. 10 . 3887 . 1 1 21 PRO C C 6.895 2.665 3.556 . . . 1.0 . . . . . . . . . . . . A . 21 PRO C . . . . . . . . . rr_6e5k 1
. 10 . 3888 . 1 1 21 PRO CA C 8.163 1.890 3.205 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CA . . . . . . . . . rr_6e5k 1
. 10 . 3889 . 1 1 21 PRO CB C 9.302 2.290 4.137 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CB . . . . . . . . . rr_6e5k 1
. 10 . 3890 . 1 1 21 PRO CD C 9.846 3.143 1.969 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CD . . . . . . . . . rr_6e5k 1
. 10 . 3891 . 1 1 21 PRO CG C 9.970 3.423 3.442 . . . 1.0 . . . . . . . . . . . . A . 21 PRO CG . . . . . . . . . rr_6e5k 1
. 10 . 3892 . 1 1 21 PRO HA H 7.975 0.832 3.293 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HA . . . . . . . . . rr_6e5k 1
. 10 . 3893 . 1 1 21 PRO HB2 H 8.898 2.592 5.092 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3894 . 1 1 21 PRO HB3 H 9.974 1.458 4.269 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3895 . 1 1 21 PRO HD2 H 9.659 4.056 1.424 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD2 . . . . . . . . . rr_6e5k 1
. 10 . 3896 . 1 1 21 PRO HD3 H 10.737 2.659 1.600 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HD3 . . . . . . . . . rr_6e5k 1
. 10 . 3897 . 1 1 21 PRO HG2 H 9.472 4.348 3.690 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG2 . . . . . . . . . rr_6e5k 1
. 10 . 3898 . 1 1 21 PRO HG3 H 11.009 3.468 3.727 . . . 1.0 . . . . . . . . . . . . A . 21 PRO HG3 . . . . . . . . . rr_6e5k 1
. 10 . 3899 . 1 1 21 PRO N N 8.686 2.236 1.884 . . . 1.0 . . . . . . . . . . . . A . 21 PRO N . . . . . . . . . rr_6e5k 1
. 10 . 3900 . 1 1 21 PRO O O 6.249 2.391 4.569 . . . 1.0 . . . . . . . . . . . . A . 21 PRO O . . . . . . . . . rr_6e5k 1
. 10 . 3901 . 1 1 22 ARG C C 4.242 4.055 2.041 . . . 1.0 . . . . . . . . . . . . A . 22 ARG C . . . . . . . . . rr_6e5k 1
. 10 . 3902 . 1 1 22 ARG CA C 5.375 4.466 2.967 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CA . . . . . . . . . rr_6e5k 1
. 10 . 3903 . 1 1 22 ARG CB C 5.719 5.941 2.760 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CB . . . . . . . . . rr_6e5k 1
. 10 . 3904 . 1 1 22 ARG CD C 6.678 6.225 5.074 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CD . . . . . . . . . rr_6e5k 1
. 10 . 3905 . 1 1 22 ARG CG C 6.909 6.410 3.580 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CG . . . . . . . . . rr_6e5k 1
. 10 . 3906 . 1 1 22 ARG CZ C 7.911 6.549 7.191 . . . 1.0 . . . . . . . . . . . . A . 22 ARG CZ . . . . . . . . . rr_6e5k 1
. 10 . 3907 . 1 1 22 ARG H H 7.072 3.782 1.900 . . . 1.0 . . . . . . . . . . . . A . 22 ARG H . . . . . . . . . rr_6e5k 1
. 10 . 3908 . 1 1 22 ARG HA H 5.065 4.312 3.991 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HA . . . . . . . . . rr_6e5k 1
. 10 . 3909 . 1 1 22 ARG HB2 H 5.944 6.101 1.715 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3910 . 1 1 22 ARG HB3 H 4.863 6.541 3.029 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3911 . 1 1 22 ARG HD2 H 5.858 6.857 5.382 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD2 . . . . . . . . . rr_6e5k 1
. 10 . 3912 . 1 1 22 ARG HD3 H 6.426 5.192 5.262 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HD3 . . . . . . . . . rr_6e5k 1
. 10 . 3913 . 1 1 22 ARG HE H 8.671 6.845 5.363 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HE . . . . . . . . . rr_6e5k 1
. 10 . 3914 . 1 1 22 ARG HG2 H 7.778 5.841 3.288 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG2 . . . . . . . . . rr_6e5k 1
. 10 . 3915 . 1 1 22 ARG HG3 H 7.080 7.458 3.378 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HG3 . . . . . . . . . rr_6e5k 1
. 10 . 3916 . 1 1 22 ARG HH11 H 5.990 5.945 7.432 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH11 . . . . . . . . . rr_6e5k 1
. 10 . 3917 . 1 1 22 ARG HH12 H 6.884 6.183 8.899 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH12 . . . . . . . . . rr_6e5k 1
. 10 . 3918 . 1 1 22 ARG HH21 H 9.070 6.860 8.822 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH21 . . . . . . . . . rr_6e5k 1
. 10 . 3919 . 1 1 22 ARG HH22 H 9.843 7.152 7.294 . . . 1.0 . . . . . . . . . . . . A . 22 ARG HH22 . . . . . . . . . rr_6e5k 1
. 10 . 3920 . 1 1 22 ARG N N 6.543 3.635 2.720 . . . 1.0 . . . . . . . . . . . . A . 22 ARG N . . . . . . . . . rr_6e5k 1
. 10 . 3921 . 1 1 22 ARG NE N 7.864 6.575 5.859 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NE . . . . . . . . . rr_6e5k 1
. 10 . 3922 . 1 1 22 ARG NH1 N 6.844 6.195 7.897 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH1 . . . . . . . . . rr_6e5k 1
. 10 . 3923 . 1 1 22 ARG NH2 N 9.031 6.880 7.818 . . . 1.0 . . . . . . . . . . . . A . 22 ARG NH2 . . . . . . . . . rr_6e5k 1
. 10 . 3924 . 1 1 22 ARG O O 4.484 3.474 0.985 . . . 1.0 . . . . . . . . . . . . A . 22 ARG O . . . . . . . . . rr_6e5k 1
. 10 . 3925 . 1 1 23 TYR C C 0.626 4.746 2.023 . . . 1.0 . . . . . . . . . . . . A . 23 TYR C . . . . . . . . . rr_6e5k 1
. 10 . 3926 . 1 1 23 TYR CA C 1.863 3.943 1.643 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CA . . . . . . . . . rr_6e5k 1
. 10 . 3927 . 1 1 23 TYR CB C 1.595 2.451 1.822 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CB . . . . . . . . . rr_6e5k 1
. 10 . 3928 . 1 1 23 TYR CD1 C -0.109 1.977 3.611 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD1 . . . . . . . . . rr_6e5k 1
. 10 . 3929 . 1 1 23 TYR CD2 C 2.192 1.788 4.185 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CD2 . . . . . . . . . rr_6e5k 1
. 10 . 3930 . 1 1 23 TYR CE1 C -0.464 1.627 4.893 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE1 . . . . . . . . . rr_6e5k 1
. 10 . 3931 . 1 1 23 TYR CE2 C 1.846 1.436 5.476 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CE2 . . . . . . . . . rr_6e5k 1
. 10 . 3932 . 1 1 23 TYR CG C 1.220 2.063 3.234 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CG . . . . . . . . . rr_6e5k 1
. 10 . 3933 . 1 1 23 TYR CZ C 0.514 1.358 5.824 . . . 1.0 . . . . . . . . . . . . A . 23 TYR CZ . . . . . . . . . rr_6e5k 1
. 10 . 3934 . 1 1 23 TYR H H 2.874 4.829 3.273 . . . 1.0 . . . . . . . . . . . . A . 23 TYR H . . . . . . . . . rr_6e5k 1
. 10 . 3935 . 1 1 23 TYR HA H 2.094 4.132 0.606 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HA . . . . . . . . . rr_6e5k 1
. 10 . 3936 . 1 1 23 TYR HB2 H 0.787 2.158 1.172 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3937 . 1 1 23 TYR HB3 H 2.484 1.903 1.552 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3938 . 1 1 23 TYR HD1 H -0.875 2.189 2.879 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD1 . . . . . . . . . rr_6e5k 1
. 10 . 3939 . 1 1 23 TYR HD2 H 3.234 1.854 3.906 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HD2 . . . . . . . . . rr_6e5k 1
. 10 . 3940 . 1 1 23 TYR HE1 H -1.508 1.566 5.166 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE1 . . . . . . . . . rr_6e5k 1
. 10 . 3941 . 1 1 23 TYR HE2 H 2.615 1.226 6.202 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HE2 . . . . . . . . . rr_6e5k 1
. 10 . 3942 . 1 1 23 TYR HH H -0.581 0.370 7.056 . . . 1.0 . . . . . . . . . . . . A . 23 TYR HH . . . . . . . . . rr_6e5k 1
. 10 . 3943 . 1 1 23 TYR N N 3.013 4.339 2.435 . . . 1.0 . . . . . . . . . . . . A . 23 TYR N . . . . . . . . . rr_6e5k 1
. 10 . 3944 . 1 1 23 TYR O O 0.472 5.176 3.165 . . . 1.0 . . . . . . . . . . . . A . 23 TYR O . . . . . . . . . rr_6e5k 1
. 10 . 3945 . 1 1 23 TYR OH O 0.151 1.004 7.102 . . . 1.0 . . . . . . . . . . . . A . 23 TYR OH . . . . . . . . . rr_6e5k 1
. 10 . 3946 . 1 1 24 GLU C C -2.687 4.731 0.935 . . . 1.0 . . . . . . . . . . . . A . 24 GLU C . . . . . . . . . rr_6e5k 1
. 10 . 3947 . 1 1 24 GLU CA C -1.509 5.638 1.285 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CA . . . . . . . . . rr_6e5k 1
. 10 . 3948 . 1 1 24 GLU CB C -1.560 6.906 0.431 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CB . . . . . . . . . rr_6e5k 1
. 10 . 3949 . 1 1 24 GLU CD C -0.490 8.432 2.145 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CD . . . . . . . . . rr_6e5k 1
. 10 . 3950 . 1 1 24 GLU CG C -0.444 7.895 0.728 . . . 1.0 . . . . . . . . . . . . A . 24 GLU CG . . . . . . . . . rr_6e5k 1
. 10 . 3951 . 1 1 24 GLU H H -0.065 4.575 0.164 . . . 1.0 . . . . . . . . . . . . A . 24 GLU H . . . . . . . . . rr_6e5k 1
. 10 . 3952 . 1 1 24 GLU HA H -1.559 5.904 2.328 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HA . . . . . . . . . rr_6e5k 1
. 10 . 3953 . 1 1 24 GLU HB2 H -1.493 6.623 -0.609 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3954 . 1 1 24 GLU HB3 H -2.504 7.399 0.597 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3955 . 1 1 24 GLU HG2 H 0.503 7.398 0.583 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG2 . . . . . . . . . rr_6e5k 1
. 10 . 3956 . 1 1 24 GLU HG3 H -0.523 8.724 0.041 . . . 1.0 . . . . . . . . . . . . A . 24 GLU HG3 . . . . . . . . . rr_6e5k 1
. 10 . 3957 . 1 1 24 GLU N N -0.257 4.930 1.059 . . . 1.0 . . . . . . . . . . . . A . 24 GLU N . . . . . . . . . rr_6e5k 1
. 10 . 3958 . 1 1 24 GLU O O -2.743 4.199 -0.173 . . . 1.0 . . . . . . . . . . . . A . 24 GLU O . . . . . . . . . rr_6e5k 1
. 10 . 3959 . 1 1 24 GLU OE1 O -1.479 9.107 2.501 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE1 . . . . . . . . . rr_6e5k 1
. 10 . 3960 . 1 1 24 GLU OE2 O 0.463 8.178 2.915 . . . 1.0 . . . . . . . . . . . . A . 24 GLU OE2 . . . . . . . . . rr_6e5k 1
. 10 . 3961 . 1 1 25 MVA C C -6.104 4.309 1.412 . . . 1.0 . . . . . . . . . . . . A . 25 MVA C . . . . . . . . . rr_6e5k 1
. 10 . 3962 . 1 1 25 MVA CA C -4.759 3.600 1.561 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CA . . . . . . . . . rr_6e5k 1
. 10 . 3963 . 1 1 25 MVA CB C -4.916 2.454 2.610 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CB . . . . . . . . . rr_6e5k 1
. 10 . 3964 . 1 1 25 MVA CG1 C -3.573 1.828 2.933 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG1 . . . . . . . . . rr_6e5k 1
. 10 . 3965 . 1 1 25 MVA CG2 C -5.627 2.906 3.881 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CG2 . . . . . . . . . rr_6e5k 1
. 10 . 3966 . 1 1 25 MVA CN C -3.601 5.297 3.123 . . . 1.0 . . . . . . . . . . . . A . 25 MVA CN . . . . . . . . . rr_6e5k 1
. 10 . 3967 . 1 1 25 MVA HA H -4.559 3.120 0.612 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HA . . . . . . . . . rr_6e5k 1
. 10 . 3968 . 1 1 25 MVA HB H -5.524 1.683 2.154 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HB . . . . . . . . . rr_6e5k 1
. 10 . 3969 . 1 1 25 MVA HG11 H -3.708 1.045 3.666 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG11 . . . . . . . . . rr_6e5k 1
. 10 . 3970 . 1 1 25 MVA HG12 H -2.912 2.582 3.329 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG12 . . . . . . . . . rr_6e5k 1
. 10 . 3971 . 1 1 25 MVA HG13 H -3.146 1.409 2.034 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG13 . . . . . . . . . rr_6e5k 1
. 10 . 3972 . 1 1 25 MVA HG21 H -5.840 2.046 4.499 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG21 . . . . . . . . . rr_6e5k 1
. 10 . 3973 . 1 1 25 MVA HG22 H -6.551 3.400 3.619 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG22 . . . . . . . . . rr_6e5k 1
. 10 . 3974 . 1 1 25 MVA HG23 H -4.994 3.590 4.425 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HG23 . . . . . . . . . rr_6e5k 1
. 10 . 3975 . 1 1 25 MVA HN1 H -4.575 5.286 3.585 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN1 . . . . . . . . . rr_6e5k 1
. 10 . 3976 . 1 1 25 MVA HN2 H -3.313 6.318 2.921 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN2 . . . . . . . . . rr_6e5k 1
. 10 . 3977 . 1 1 25 MVA HN3 H -2.882 4.845 3.788 . . . 1.0 . . . . . . . . . . . . A . 25 MVA HN3 . . . . . . . . . rr_6e5k 1
. 10 . 3978 . 1 1 25 MVA N N -3.649 4.537 1.852 . . . 1.0 . . . . . . . . . . . . A . 25 MVA N . . . . . . . . . rr_6e5k 1
. 10 . 3979 . 1 1 25 MVA O O -6.378 5.330 2.047 . . . 1.0 . . . . . . . . . . . . A . 25 MVA O . . . . . . . . . rr_6e5k 1
. 10 . 3980 . 1 1 26 HIS C C -9.249 3.097 0.215 . . . 1.0 . . . . . . . . . . . . A . 26 HIS C . . . . . . . . . rr_6e5k 1
. 10 . 3981 . 1 1 26 HIS CA C -8.276 4.262 0.314 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CA . . . . . . . . . rr_6e5k 1
. 10 . 3982 . 1 1 26 HIS CB C -8.348 5.107 -0.958 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CB . . . . . . . . . rr_6e5k 1
. 10 . 3983 . 1 1 26 HIS CD2 C -6.376 6.791 -1.059 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CD2 . . . . . . . . . rr_6e5k 1
. 10 . 3984 . 1 1 26 HIS CE1 C -7.470 8.597 -0.481 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CE1 . . . . . . . . . rr_6e5k 1
. 10 . 3985 . 1 1 26 HIS CG C -7.665 6.437 -0.848 . . . 1.0 . . . . . . . . . . . . A . 26 HIS CG . . . . . . . . . rr_6e5k 1
. 10 . 3986 . 1 1 26 HIS H H -6.624 2.978 0.025 . . . 1.0 . . . . . . . . . . . . A . 26 HIS H . . . . . . . . . rr_6e5k 1
. 10 . 3987 . 1 1 26 HIS HA H -8.545 4.873 1.159 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HA . . . . . . . . . rr_6e5k 1
. 10 . 3988 . 1 1 26 HIS HB2 H -7.883 4.564 -1.763 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB2 . . . . . . . . . rr_6e5k 1
. 10 . 3989 . 1 1 26 HIS HB3 H -9.384 5.284 -1.202 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HB3 . . . . . . . . . rr_6e5k 1
. 10 . 3990 . 1 1 26 HIS HD1 H -9.277 7.662 -0.257 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD1 . . . . . . . . . rr_6e5k 1
. 10 . 3991 . 1 1 26 HIS HD2 H -5.570 6.132 -1.353 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HD2 . . . . . . . . . rr_6e5k 1
. 10 . 3992 . 1 1 26 HIS HE1 H -7.706 9.621 -0.236 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE1 . . . . . . . . . rr_6e5k 1
. 10 . 3993 . 1 1 26 HIS HE2 H -5.518 8.705 -1.075 . . . 1.0 . . . . . . . . . . . . A . 26 HIS HE2 . . . . . . . . . rr_6e5k 1
. 10 . 3994 . 1 1 26 HIS N N -6.930 3.760 0.537 . . . 1.0 . . . . . . . . . . . . A . 26 HIS N . . . . . . . . . rr_6e5k 1
. 10 . 3995 . 1 1 26 HIS ND1 N -8.321 7.591 -0.486 . . . 1.0 . . . . . . . . . . . . A . 26 HIS ND1 . . . . . . . . . rr_6e5k 1
. 10 . 3996 . 1 1 26 HIS NE2 N -6.282 8.140 -0.826 . . . 1.0 . . . . . . . . . . . . A . 26 HIS NE2 . . . . . . . . . rr_6e5k 1
. 10 . 3997 . 1 1 26 HIS O O -9.256 2.359 -0.774 . . . 1.0 . . . . . . . . . . . . A . 26 HIS O . . . . . . . . . rr_6e5k 1
. 10 . 3998 . 1 1 27 CYS C C -12.320 2.262 0.656 . . . 1.0 . . . . . . . . . . . . A . 27 CYS C . . . . . . . . . rr_6e5k 1
. 10 . 3999 . 1 1 27 CYS CA C -11.010 1.836 1.304 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CA . . . . . . . . . rr_6e5k 1
. 10 . 4000 . 1 1 27 CYS CB C -11.240 1.405 2.752 . . . 1.0 . . . . . . . . . . . . A . 27 CYS CB . . . . . . . . . rr_6e5k 1
. 10 . 4001 . 1 1 27 CYS H H -9.989 3.544 2.006 . . . 1.0 . . . . . . . . . . . . A . 27 CYS H . . . . . . . . . rr_6e5k 1
. 10 . 4002 . 1 1 27 CYS HA H -10.601 1.006 0.750 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HA . . . . . . . . . rr_6e5k 1
. 10 . 4003 . 1 1 27 CYS HB2 H -11.644 2.238 3.307 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB2 . . . . . . . . . rr_6e5k 1
. 10 . 4004 . 1 1 27 CYS HB3 H -11.947 0.590 2.769 . . . 1.0 . . . . . . . . . . . . A . 27 CYS HB3 . . . . . . . . . rr_6e5k 1
. 10 . 4005 . 1 1 27 CYS N N -10.045 2.921 1.251 . . . 1.0 . . . . . . . . . . . . A . 27 CYS N . . . . . . . . . rr_6e5k 1
. 10 . 4006 . 1 1 27 CYS O O -12.807 1.616 -0.273 . . . 1.0 . . . . . . . . . . . . A . 27 CYS O . . . . . . . . . rr_6e5k 1
. 10 . 4007 . 1 1 27 CYS SG S -9.728 0.849 3.608 . . . 1.0 . . . . . . . . . . . . A . 27 CYS SG . . . . . . . . . rr_6e5k 1
. 10 . 4008 . 1 1 28 NH2 HN1 H -12.445 3.817 1.884 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN1 . . . . . . . . . rr_6e5k 1
. 10 . 4009 . 1 1 28 NH2 HN2 H -13.731 3.653 0.742 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 HN2 . . . . . . . . . rr_6e5k 1
. 10 . 4010 . 1 1 28 NH2 N N -12.888 3.352 1.142 . . . 1.0 . . . . . . . . . . . . A . 28 NH2 N . . . . . . . . . rr_6e5k 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_6e5k
_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 6e5k.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_6e5k 1
1 6e5k.mr . . XPLOR/CNS 2 distance NOE ambi 435 rr_6e5k 1
1 6e5k.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 26 rr_6e5k 1
1 6e5k.mr . . XPLOR/CNS 4 distance NOE ambi 46 rr_6e5k 1
1 6e5k.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 10 rr_6e5k 1
1 6e5k.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_6e5k 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_6e5k
_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: '6e5k'" . . . . distance "general distance" . 398 rr_6e5k 1
2 "From CCPN project: '6e5k'" . . . . distance "general distance" . 34 rr_6e5k 1
3 "From CCPN project: '6e5k'" . . . . distance "hydrogen bond" . 26 rr_6e5k 1
4 "From CCPN project: '6e5k'" . . . . "dihedral angle" "Not applicable" . 10 rr_6e5k 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 6e5k.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_6e5k 1
1 6e5k.mr . . XPLOR/CNS 2 distance NOE ambi 435 rr_6e5k 1
1 6e5k.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 26 rr_6e5k 1
1 6e5k.mr . . XPLOR/CNS 4 distance NOE ambi 46 rr_6e5k 1
1 6e5k.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 10 rr_6e5k 1
1 6e5k.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_6e5k 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2
_Gen_dist_constraint_list.Entry_ID rr_6e5k
_Gen_dist_constraint_list.ID 1
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details "Generated by Wattos"
_Gen_dist_constraint_list.Constraint_file_ID 1
_Gen_dist_constraint_list.Block_ID 2
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . rr_6e5k 1
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 4 4 CYS HB2 H . . . 1 1 4 4 CYS HB3 H . . . . . 1.612 1.287 1.937 . . . . . A . 4 CYS HB2 . . A . 4 CYS HB3 . . . 4 . HB1 . . . . . 4 . HB2 . . rr_6e5k 1
2 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 23 23 TYR HB3 H . . . . . 1.659 1.315 2.003 . . . . . A . 23 TYR HB2 . . A . 23 TYR HB3 . . . 23 . HB1 . . . . . 23 . HB2 . . rr_6e5k 1
3 1 . . 1 1 2 2 ASP HB2 H . . . 1 1 2 2 ASP HB3 H . . . . . 1.688 1.332 2.044 . . . . . A . 2 ASP HB2 . . A . 2 ASP HB3 . . . 2 . HB1 . . . . . 2 . HB2 . . rr_6e5k 1
4 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 26 26 HIS HB3 H . . . . . 1.721 1.351 2.091 . . . . . A . 26 HIS HB2 . . A . 26 HIS HB3 . . . 26 . HB1 . . . . . 26 . HB2 . . rr_6e5k 1
5 1 . . 1 1 27 27 CYS HB2 H . . . 1 1 27 27 CYS HB3 H . . . . . 1.748 1.366 2.130 . . . . . A . 27 CYS HB2 . . A . 27 CYS HB3 . . . 27 . HB1 . . . . . 27 . HB2 . . rr_6e5k 1
6 1 . . 1 1 19 19 ASP HB2 H . . . 1 1 19 19 ASP HB3 H . . . . . 1.752 1.368 2.136 . . . . . A . 19 ASP HB2 . . A . 19 ASP HB3 . . . 19 . HB1 . . . . . 19 . HB2 . . rr_6e5k 1
7 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 14 14 CYS HB3 H . . . . . 1.769 1.378 2.160 . . . . . A . 14 CYS HB2 . . A . 14 CYS HB3 . . . 14 . HB1 . . . . . 14 . HB2 . . rr_6e5k 1
8 1 . . 1 1 13 13 GLY HA2 H . . . 1 1 13 13 GLY HA3 H . . . . . 1.771 1.379 2.163 . . . . . A . 13 GLY HA2 . . A . 13 GLY HA3 . . . 13 . HA1 . . . . . 13 . HA2 . . rr_6e5k 1
9 1 . . 1 1 18 18 CYS HB2 H . . . 1 1 18 18 CYS HB3 H . . . . . 1.773 1.380 2.166 . . . . . A . 18 CYS HB2 . . A . 18 CYS HB3 . . . 18 . HB1 . . . . . 18 . HB2 . . rr_6e5k 1
10 1 . . 1 1 15 15 GLU HG2 H . . . 1 1 15 15 GLU HG3 H . . . . . 1.783 1.386 2.180 . . . . . A . 15 GLU HG2 . . A . 15 GLU HG3 . . . 15 . HG1 . . . . . 15 . HG2 . . rr_6e5k 1
11 1 . . 1 1 1 1 ASN HD21 H . . . 1 1 1 1 ASN HD22 H . . . . . 1.811 1.401 2.221 . . . . . A . 1 ASN HD21 . . A . 1 ASN HD22 . . . 1 . HD21 . . . . . 1 . HD22 . . rr_6e5k 1
12 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 21 21 PRO HD3 H . . . . . 1.813 1.402 2.224 . . . . . A . 21 PRO HD2 . . A . 21 PRO HD3 . . . 21 . HD1 . . . . . 21 . HD2 . . rr_6e5k 1
13 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HB3 H . . . . . 1.819 1.405 2.233 . . . . . A . 11 TYR HB2 . . A . 11 TYR HB3 . . . 11 . HB1 . . . . . 11 . HB2 . . rr_6e5k 1
14 1 . . 1 1 20 20 DPR HB2 H . . . 1 1 20 20 DPR HB3 H . . . . . 1.852 1.423 2.281 . . . . . A . 20 DPR HB2 . . A . 20 DPR HB3 . . . 20 . HB1 . . . . . 20 . HB2 . . rr_6e5k 1
15 1 . . 1 1 20 20 DPR HD2 H . . . 1 1 20 20 DPR HD3 H . . . . . 1.868 1.432 2.304 . . . . . A . 20 DPR HD2 . . A . 20 DPR HD3 . . . 20 . HD1 . . . . . 20 . HD2 . . rr_6e5k 1
16 1 OR . 1 1 22 22 ARG HB3 H . . . 1 1 22 22 ARG HG2 H . . . . . 1.972 1.486 2.458 . . . . . A . 22 ARG HB3 . . A . 22 ARG HG2 . . . 22 . HB2 . . . . . 22 . HG1 . . rr_6e5k 1
16 2 OR . 1 1 22 22 ARG HB2 H . . . 1 1 22 22 ARG HG2 H . . . . . 1.972 1.486 2.458 . . . . . A . 22 ARG HB2 . . A . 22 ARG HG2 . . . 22 . HB1 . . . . . 22 . HG1 . . rr_6e5k 1
16 3 OR . 1 1 22 22 ARG HG3 H . . . 1 1 22 22 ARG HB2 H . . . . . 1.972 1.486 2.458 . . . . . A . 22 ARG HG3 . . A . 22 ARG HB2 . . . 22 . HG2 . . . . . 22 . HB1 . . rr_6e5k 1
16 4 OR . 1 1 22 22 ARG HG3 H . . . 1 1 22 22 ARG HB3 H . . . . . 1.972 1.486 2.458 . . . . . A . 22 ARG HG3 . . A . 22 ARG HB3 . . . 22 . HG2 . . . . . 22 . HB2 . . rr_6e5k 1
17 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 11 11 TYR HE2 H . . . . . 1.984 1.492 2.476 . . . . . A . 11 TYR HD1 . . A . 11 TYR HE2 . . . 11 . HD1 . . . . . 11 . HE2 . . rr_6e5k 1
17 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 11 11 TYR HE2 H . . . . . 1.984 1.492 2.476 . . . . . A . 11 TYR HD2 . . A . 11 TYR HE2 . . . 11 . HD2 . . . . . 11 . HE2 . . rr_6e5k 1
17 3 OR . 1 1 11 11 TYR HE1 H . . . 1 1 11 11 TYR HD2 H . . . . . 1.984 1.492 2.476 . . . . . A . 11 TYR HE1 . . A . 11 TYR HD2 . . . 11 . HE1 . . . . . 11 . HD2 . . rr_6e5k 1
17 4 OR . 1 1 11 11 TYR HE1 H . . . 1 1 11 11 TYR HD1 H . . . . . 1.984 1.492 2.476 . . . . . A . 11 TYR HE1 . . A . 11 TYR HD1 . . . 11 . HE1 . . . . . 11 . HD1 . . rr_6e5k 1
18 1 . . 1 1 18 18 CYS HA H . . . 1 1 19 19 ASP H H . . . . . 2.021 1.510 2.532 . . . . . A . 18 CYS HA . . A . 19 ASP H . . . 18 . HA . . . . . 19 . HN . . rr_6e5k 1
19 1 . . 1 1 7 7 LEU HB2 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.040 1.520 2.560 . . . . . A . 7 LEU HB2 . . A . 7 LEU MD2 . . . 7 . HB1 . . . . . 7 . HD21 . . rr_6e5k 1
20 1 . . 1 1 16 16 MVA HA H . . . 1 1 17 17 ARG H H . . . . . 2.040 1.520 2.560 . . . . . A . 16 MVA HA . . A . 17 ARG H . . . 16 . HA . . . . . 17 . HN . . rr_6e5k 1
21 1 OR . 1 1 15 15 GLU HG2 H . . . 1 1 15 15 GLU HB2 H . . . . . 2.048 1.524 2.572 . . . . . A . 15 GLU HG2 . . A . 15 GLU HB2 . . . 15 . HG1 . . . . . 15 . HB1 . . rr_6e5k 1
21 2 OR . 1 1 15 15 GLU HG2 H . . . 1 1 15 15 GLU HB3 H . . . . . 2.048 1.524 2.572 . . . . . A . 15 GLU HG2 . . A . 15 GLU HB3 . . . 15 . HG1 . . . . . 15 . HB2 . . rr_6e5k 1
22 1 . . 1 1 25 25 MVA HA H . . . 1 1 26 26 HIS H H . . . . . 2.078 1.538 2.618 . . . . . A . 25 MVA HA . . A . 26 HIS H . . . 25 . HA . . . . . 26 . HN . . rr_6e5k 1
23 1 . . 1 1 26 26 HIS HA H . . . 1 1 27 27 CYS H H . . . . . 2.079 1.539 2.619 . . . . . A . 26 HIS HA . . A . 27 CYS H . . . 26 . HA . . . . . 27 . HN . . rr_6e5k 1
24 1 . . 1 1 17 17 ARG HA H . . . 1 1 18 18 CYS H H . . . . . 2.080 1.539 2.621 . . . . . A . 17 ARG HA . . A . 18 CYS H . . . 17 . HA . . . . . 18 . HN . . rr_6e5k 1
25 1 . . 1 1 23 23 TYR HA H . . . 1 1 24 24 GLU H H . . . . . 2.132 1.564 2.700 . . . . . A . 23 TYR HA . . A . 24 GLU H . . . 23 . HA . . . . . 24 . HN . . rr_6e5k 1
26 1 . . 1 1 22 22 ARG HA H . . . 1 1 23 23 TYR H H . . . . . 2.142 1.568 2.716 . . . . . A . 22 ARG HA . . A . 23 TYR H . . . 22 . HA . . . . . 23 . HN . . rr_6e5k 1
27 1 . . 1 1 20 20 DPR HD3 H . . . 1 1 19 19 ASP HA H . . . . . 2.161 1.577 2.745 . . . . . A . 20 DPR HD3 . . A . 19 ASP HA . . . 20 . HD2 . . . . . 19 . HA . . rr_6e5k 1
28 1 . . 1 1 21 21 PRO HD3 H . . . 1 1 20 20 DPR HA H . . . . . 2.170 1.581 2.759 . . . . . A . 21 PRO HD3 . . A . 20 DPR HA . . . 21 . HD2 . . . . . 20 . HA . . rr_6e5k 1
29 1 . . 1 1 16 16 MVA HB H . . . 1 1 16 16 MVA HG21 H . . . . . 2.195 1.593 2.797 . . . . . A . 16 MVA HB . . A . 16 MVA HG21 . . . 16 . HB . . . . . 16 . HG21 . . rr_6e5k 1
30 1 . . 1 1 25 25 MVA HG21 H . . . 1 1 25 25 MVA HG11 H . . . . . 2.201 1.596 2.806 . . . . . A . 25 MVA HG21 . . A . 25 MVA HG11 . . . 25 . HG21 . . . . . 25 . HG11 . . rr_6e5k 1
31 1 . . 1 1 16 16 MVA HB H . . . 1 1 16 16 MVA HG11 H . . . . . 2.202 1.596 2.808 . . . . . A . 16 MVA HB . . A . 16 MVA HG11 . . . 16 . HB . . . . . 16 . HG11 . . rr_6e5k 1
32 1 . . 1 1 14 14 CYS HA H . . . 1 1 15 15 GLU H H . . . . . 2.232 1.609 2.855 . . . . . A . 14 CYS HA . . A . 15 GLU H . . . 14 . HA . . . . . 15 . HN . . rr_6e5k 1
33 1 . . 1 1 25 25 MVA HG11 H . . . 1 1 25 25 MVA HB H . . . . . 2.237 1.611 2.863 . . . . . A . 25 MVA HG11 . . A . 25 MVA HB . . . 25 . HG11 . . . . . 25 . HB . . rr_6e5k 1
34 1 OR . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.260 1.621 2.899 . . . . . A . 11 TYR HB2 . . A . 11 TYR HD2 . . . 11 . HB1 . . . . . 11 . HD2 . . rr_6e5k 1
34 2 OR . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.260 1.621 2.899 . . . . . A . 11 TYR HB2 . . A . 11 TYR HD1 . . . 11 . HB1 . . . . . 11 . HD1 . . rr_6e5k 1
35 1 . . 1 1 25 25 MVA HG21 H . . . 1 1 25 25 MVA HB H . . . . . 2.268 1.625 2.911 . . . . . A . 25 MVA HG21 . . A . 25 MVA HB . . . 25 . HG21 . . . . . 25 . HB . . rr_6e5k 1
36 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 20 20 DPR HA H . . . . . 2.268 1.625 2.911 . . . . . A . 21 PRO HD2 . . A . 20 DPR HA . . . 21 . HD1 . . . . . 20 . HA . . rr_6e5k 1
37 1 . . 1 1 21 21 PRO HG2 H . . . 1 1 21 21 PRO HB3 H . . . . . 2.270 1.626 2.914 . . . . . A . 21 PRO HG2 . . A . 21 PRO HB3 . . . 21 . HG1 . . . . . 21 . HB2 . . rr_6e5k 1
38 1 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HB2 H . . . . . 2.272 1.627 2.917 . . . . . A . 8 LYS HA . . A . 8 LYS HB2 . . . 8 . HA . . . . . 8 . HB1 . . rr_6e5k 1
38 2 OR . 1 1 8 8 LYS HB3 H . . . 1 1 8 8 LYS HA H . . . . . 2.272 1.627 2.917 . . . . . A . 8 LYS HB3 . . A . 8 LYS HA . . . 8 . HB2 . . . . . 8 . HA . . rr_6e5k 1
39 1 OR . 1 1 5 5 LYS HE3 H . . . 1 1 5 5 LYS HD2 H . . . . . 2.277 1.629 2.925 . . . . . A . 5 LYS HE3 . . A . 5 LYS HD2 . . . 5 . HE2 . . . . . 5 . HD1 . . rr_6e5k 1
39 2 OR . 1 1 5 5 LYS HE2 H . . . 1 1 5 5 LYS HD2 H . . . . . 2.277 1.629 2.925 . . . . . A . 5 LYS HE2 . . A . 5 LYS HD2 . . . 5 . HE1 . . . . . 5 . HD1 . . rr_6e5k 1
39 3 OR . 1 1 5 5 LYS HD3 H . . . 1 1 5 5 LYS HE2 H . . . . . 2.277 1.629 2.925 . . . . . A . 5 LYS HD3 . . A . 5 LYS HE2 . . . 5 . HD2 . . . . . 5 . HE1 . . rr_6e5k 1
39 4 OR . 1 1 5 5 LYS HD3 H . . . 1 1 5 5 LYS HE3 H . . . . . 2.277 1.629 2.925 . . . . . A . 5 LYS HD3 . . A . 5 LYS HE3 . . . 5 . HD2 . . . . . 5 . HE2 . . rr_6e5k 1
40 1 OR . 1 1 15 15 GLU HB2 H . . . 1 1 15 15 GLU H H . . . . . 2.297 1.637 2.957 . . . . . A . 15 GLU HB2 . . A . 15 GLU H . . . 15 . HB1 . . . . . 15 . HN . . rr_6e5k 1
40 2 OR . 1 1 15 15 GLU HB3 H . . . 1 1 15 15 GLU H H . . . . . 2.297 1.637 2.957 . . . . . A . 15 GLU HB3 . . A . 15 GLU H . . . 15 . HB2 . . . . . 15 . HN . . rr_6e5k 1
41 1 OR . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HB2 H . . . . . 2.301 1.639 2.963 . . . . . A . 5 LYS H . . A . 5 LYS HB2 . . . 5 . HN . . . . . 5 . HB1 . . rr_6e5k 1
41 2 OR . 1 1 5 5 LYS HB3 H . . . 1 1 5 5 LYS H H . . . . . 2.301 1.639 2.963 . . . . . A . 5 LYS HB3 . . A . 5 LYS H . . . 5 . HB2 . . . . . 5 . HN . . rr_6e5k 1
42 1 OR . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU HB2 H . . . . . 2.304 1.640 2.968 . . . . . A . 15 GLU HA . . A . 15 GLU HB2 . . . 15 . HA . . . . . 15 . HB1 . . rr_6e5k 1
42 2 OR . 1 1 15 15 GLU HA H . . . 1 1 15 15 GLU HB3 H . . . . . 2.304 1.640 2.968 . . . . . A . 15 GLU HA . . A . 15 GLU HB3 . . . 15 . HA . . . . . 15 . HB2 . . rr_6e5k 1
43 1 OR . 1 1 8 8 LYS HB2 H . . . 1 1 8 8 LYS H H . . . . . 2.308 1.642 2.974 . . . . . A . 8 LYS HB2 . . A . 8 LYS H . . . 8 . HB1 . . . . . 8 . HN . . rr_6e5k 1
43 2 OR . 1 1 8 8 LYS HB3 H . . . 1 1 8 8 LYS H H . . . . . 2.308 1.642 2.974 . . . . . A . 8 LYS HB3 . . A . 8 LYS H . . . 8 . HB2 . . . . . 8 . HN . . rr_6e5k 1
44 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 23 23 TYR HA H . . . . . 2.328 1.651 3.005 . . . . . A . 23 TYR HB2 . . A . 23 TYR HA . . . 23 . HB1 . . . . . 23 . HA . . rr_6e5k 1
45 1 . . 1 1 20 20 DPR HB3 H . . . 1 1 20 20 DPR HA H . . . . . 2.335 1.653 3.017 . . . . . A . 20 DPR HB3 . . A . 20 DPR HA . . . 20 . HB2 . . . . . 20 . HA . . rr_6e5k 1
46 1 . . 1 1 23 23 TYR HB3 H . . . 1 1 23 23 TYR HA H . . . . . 2.337 1.655 3.019 . . . . . A . 23 TYR HB3 . . A . 23 TYR HA . . . 23 . HB2 . . . . . 23 . HA . . rr_6e5k 1
47 1 . . 1 1 7 7 LEU HB3 H . . . 1 1 7 7 LEU H H . . . . . 2.340 1.656 3.024 . . . . . A . 7 LEU HB3 . . A . 7 LEU H . . . 7 . HB2 . . . . . 7 . HN . . rr_6e5k 1
48 1 OR . 1 1 22 22 ARG HB2 H . . . 1 1 22 22 ARG H H . . . . . 2.341 1.656 3.026 . . . . . A . 22 ARG HB2 . . A . 22 ARG H . . . 22 . HB1 . . . . . 22 . HN . . rr_6e5k 1
48 2 OR . 1 1 22 22 ARG HB3 H . . . 1 1 22 22 ARG H H . . . . . 2.341 1.656 3.026 . . . . . A . 22 ARG HB3 . . A . 22 ARG H . . . 22 . HB2 . . . . . 22 . HN . . rr_6e5k 1
49 1 . . 1 1 21 21 PRO HB3 H . . . 1 1 21 21 PRO HA H . . . . . 2.343 1.657 3.029 . . . . . A . 21 PRO HB3 . . A . 21 PRO HA . . . 21 . HB2 . . . . . 21 . HA . . rr_6e5k 1
50 1 . . 1 1 13 13 GLY HA2 H . . . 1 1 13 13 GLY H H . . . . . 2.350 1.659 3.041 . . . . . A . 13 GLY HA2 . . A . 13 GLY H . . . 13 . HA1 . . . . . 13 . HN . . rr_6e5k 1
51 1 OR . 1 1 22 22 ARG HB2 H . . . 1 1 22 22 ARG HA H . . . . . 2.353 1.661 3.045 . . . . . A . 22 ARG HB2 . . A . 22 ARG HA . . . 22 . HB1 . . . . . 22 . HA . . rr_6e5k 1
51 2 OR . 1 1 22 22 ARG HB3 H . . . 1 1 22 22 ARG HA H . . . . . 2.353 1.661 3.045 . . . . . A . 22 ARG HB3 . . A . 22 ARG HA . . . 22 . HB2 . . . . . 22 . HA . . rr_6e5k 1
52 1 OR . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HD2 H . . . . . 2.359 1.664 3.054 . . . . . A . 11 TYR HB3 . . A . 11 TYR HD2 . . . 11 . HB2 . . . . . 11 . HD2 . . rr_6e5k 1
52 2 OR . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HD1 H . . . . . 2.359 1.664 3.054 . . . . . A . 11 TYR HB3 . . A . 11 TYR HD1 . . . 11 . HB2 . . . . . 11 . HD1 . . rr_6e5k 1
53 1 OR . 1 1 24 24 GLU HB2 H . . . 1 1 24 24 GLU HG2 H . . . . . 2.367 1.666 3.068 . . . . . A . 24 GLU HB2 . . A . 24 GLU HG2 . . . 24 . HB1 . . . . . 24 . HG1 . . rr_6e5k 1
53 2 OR . 1 1 24 24 GLU HB2 H . . . 1 1 24 24 GLU HG3 H . . . . . 2.367 1.666 3.068 . . . . . A . 24 GLU HB2 . . A . 24 GLU HG3 . . . 24 . HB1 . . . . . 24 . HG2 . . rr_6e5k 1
54 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 14 14 CYS HA H . . . . . 2.376 1.670 3.082 . . . . . A . 14 CYS HB2 . . A . 14 CYS HA . . . 14 . HB1 . . . . . 14 . HA . . rr_6e5k 1
55 1 OR . 1 1 23 23 TYR HB2 H . . . 1 1 23 23 TYR HD2 H . . . . . 2.385 1.674 3.096 . . . . . A . 23 TYR HB2 . . A . 23 TYR HD2 . . . 23 . HB1 . . . . . 23 . HD2 . . rr_6e5k 1
55 2 OR . 1 1 23 23 TYR HB2 H . . . 1 1 23 23 TYR HD1 H . . . . . 2.385 1.674 3.096 . . . . . A . 23 TYR HB2 . . A . 23 TYR HD1 . . . 23 . HB1 . . . . . 23 . HD1 . . rr_6e5k 1
56 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 21 21 PRO HG3 H . . . . . 2.390 1.676 3.104 . . . . . A . 21 PRO HD2 . . A . 21 PRO HG3 . . . 21 . HD1 . . . . . 21 . HG2 . . rr_6e5k 1
57 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 25 25 MVA HG21 H . . . . . 2.392 1.677 3.107 . . . . . A . 14 CYS HB2 . . A . 25 MVA HG21 . . . 14 . HB1 . . . . . 25 . HG21 . . rr_6e5k 1
58 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 11 11 TYR HA H . . . . . 2.392 1.677 3.107 . . . . . A . 11 TYR HD2 . . A . 11 TYR HA . . . 11 . HD2 . . . . . 11 . HA . . rr_6e5k 1
58 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 11 11 TYR HA H . . . . . 2.392 1.677 3.107 . . . . . A . 11 TYR HD1 . . A . 11 TYR HA . . . 11 . HD1 . . . . . 11 . HA . . rr_6e5k 1
59 1 OR . 1 1 23 23 TYR HB3 H . . . 1 1 23 23 TYR HD2 H . . . . . 2.392 1.677 3.107 . . . . . A . 23 TYR HB3 . . A . 23 TYR HD2 . . . 23 . HB2 . . . . . 23 . HD2 . . rr_6e5k 1
59 2 OR . 1 1 23 23 TYR HB3 H . . . 1 1 23 23 TYR HD1 H . . . . . 2.392 1.677 3.107 . . . . . A . 23 TYR HB3 . . A . 23 TYR HD1 . . . 23 . HB2 . . . . . 23 . HD1 . . rr_6e5k 1
60 1 . . 1 1 14 14 CYS HB3 H . . . 1 1 14 14 CYS H H . . . . . 2.394 1.677 3.111 . . . . . A . 14 CYS HB3 . . A . 14 CYS H . . . 14 . HB2 . . . . . 14 . HN . . rr_6e5k 1
61 1 . . 1 1 4 4 CYS HB3 H . . . 1 1 4 4 CYS HA H . . . . . 2.397 1.679 3.115 . . . . . A . 4 CYS HB3 . . A . 4 CYS HA . . . 4 . HB2 . . . . . 4 . HA . . rr_6e5k 1
62 1 OR . 1 1 8 8 LYS HE3 H . . . 1 1 8 8 LYS HD2 H . . . . . 2.397 1.679 3.115 . . . . . A . 8 LYS HE3 . . A . 8 LYS HD2 . . . 8 . HE2 . . . . . 8 . HD1 . . rr_6e5k 1
62 2 OR . 1 1 8 8 LYS HE2 H . . . 1 1 8 8 LYS HD2 H . . . . . 2.397 1.679 3.115 . . . . . A . 8 LYS HE2 . . A . 8 LYS HD2 . . . 8 . HE1 . . . . . 8 . HD1 . . rr_6e5k 1
62 3 OR . 1 1 8 8 LYS HD3 H . . . 1 1 8 8 LYS HE2 H . . . . . 2.397 1.679 3.115 . . . . . A . 8 LYS HD3 . . A . 8 LYS HE2 . . . 8 . HD2 . . . . . 8 . HE1 . . rr_6e5k 1
62 4 OR . 1 1 8 8 LYS HD3 H . . . 1 1 8 8 LYS HE3 H . . . . . 2.397 1.679 3.115 . . . . . A . 8 LYS HD3 . . A . 8 LYS HE3 . . . 8 . HD2 . . . . . 8 . HE2 . . rr_6e5k 1
63 1 . . 1 1 16 16 MVA HA H . . . 1 1 16 16 MVA HG21 H . . . . . 2.405 1.682 3.128 . . . . . A . 16 MVA HA . . A . 16 MVA HG21 . . . 16 . HA . . . . . 16 . HG21 . . rr_6e5k 1
64 1 OR . 1 1 8 8 LYS HB2 H . . . 1 1 8 8 LYS HG3 H . . . . . 2.412 1.685 3.139 . . . . . A . 8 LYS HB2 . . A . 8 LYS HG3 . . . 8 . HB1 . . . . . 8 . HG2 . . rr_6e5k 1
64 2 OR . 1 1 8 8 LYS HB3 H . . . 1 1 8 8 LYS HG3 H . . . . . 2.412 1.685 3.139 . . . . . A . 8 LYS HB3 . . A . 8 LYS HG3 . . . 8 . HB2 . . . . . 8 . HG2 . . rr_6e5k 1
65 1 . . 1 1 3 3 ABA H H . . . 1 1 2 2 ASP HA H . . . . . 2.418 1.687 3.149 . . . . . A . 3 AIB H . . A . 2 ASP HA . . . 3 . HN . . . . . 2 . HA . . rr_6e5k 1
66 1 . . 1 1 18 18 CYS HB3 H . . . 1 1 18 18 CYS HA H . . . . . 2.418 1.687 3.149 . . . . . A . 18 CYS HB3 . . A . 18 CYS HA . . . 18 . HB2 . . . . . 18 . HA . . rr_6e5k 1
67 1 . . 1 1 27 27 CYS HB3 H . . . 1 1 27 27 CYS HA H . . . . . 2.424 1.690 3.158 . . . . . A . 27 CYS HB3 . . A . 27 CYS HA . . . 27 . HB2 . . . . . 27 . HA . . rr_6e5k 1
68 1 . . 1 1 21 21 PRO HA H . . . 1 1 21 21 PRO HB2 H . . . . . 2.427 1.691 3.163 . . . . . A . 21 PRO HA . . A . 21 PRO HB2 . . . 21 . HA . . . . . 21 . HB1 . . rr_6e5k 1
69 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 15 15 GLU H H . . . . . 2.427 1.691 3.163 . . . . . A . 14 CYS HB2 . . A . 15 GLU H . . . 14 . HB1 . . . . . 15 . HN . . rr_6e5k 1
70 1 . . 1 1 16 16 MVA HA H . . . 1 1 16 16 MVA HG11 H . . . . . 2.431 1.692 3.170 . . . . . A . 16 MVA HA . . A . 16 MVA HG11 . . . 16 . HA . . . . . 16 . HG11 . . rr_6e5k 1
71 1 OR . 1 1 22 22 ARG HG2 H . . . 1 1 22 22 ARG HD2 H . . . . . 2.431 1.692 3.170 . . . . . A . 22 ARG HG2 . . A . 22 ARG HD2 . . . 22 . HG1 . . . . . 22 . HD1 . . rr_6e5k 1
71 2 OR . 1 1 22 22 ARG HG2 H . . . 1 1 22 22 ARG HD3 H . . . . . 2.431 1.692 3.170 . . . . . A . 22 ARG HG2 . . A . 22 ARG HD3 . . . 22 . HG1 . . . . . 22 . HD2 . . rr_6e5k 1
71 3 OR . 1 1 22 22 ARG HG3 H . . . 1 1 22 22 ARG HD2 H . . . . . 2.431 1.692 3.170 . . . . . A . 22 ARG HG3 . . A . 22 ARG HD2 . . . 22 . HG2 . . . . . 22 . HD1 . . rr_6e5k 1
71 4 OR . 1 1 22 22 ARG HG3 H . . . 1 1 22 22 ARG HD3 H . . . . . 2.431 1.692 3.170 . . . . . A . 22 ARG HG3 . . A . 22 ARG HD3 . . . 22 . HG2 . . . . . 22 . HD2 . . rr_6e5k 1
72 1 . . 1 1 25 25 MVA HA H . . . 1 1 25 25 MVA HG21 H . . . . . 2.437 1.695 3.179 . . . . . A . 25 MVA HA . . A . 25 MVA HG21 . . . 25 . HA . . . . . 25 . HG21 . . rr_6e5k 1
73 1 . . 1 1 27 27 CYS HB2 H . . . 1 1 27 27 CYS H H . . . . . 2.440 1.696 3.184 . . . . . A . 27 CYS HB2 . . A . 27 CYS H . . . 27 . HB1 . . . . . 27 . HN . . rr_6e5k 1
74 1 . . 1 1 20 20 DPR HD2 H . . . 1 1 19 19 ASP HA H . . . . . 2.443 1.697 3.189 . . . . . A . 20 DPR HD2 . . A . 19 ASP HA . . . 20 . HD1 . . . . . 19 . HA . . rr_6e5k 1
75 1 . . 1 1 21 21 PRO HD3 H . . . 1 1 21 21 PRO HG2 H . . . . . 2.446 1.698 3.194 . . . . . A . 21 PRO HD3 . . A . 21 PRO HG2 . . . 21 . HD2 . . . . . 21 . HG1 . . rr_6e5k 1
76 1 OR . 1 1 5 5 LYS HB2 H . . . 1 1 5 5 LYS HG2 H . . . . . 2.446 1.698 3.194 . . . . . A . 5 LYS HB2 . . A . 5 LYS HG2 . . . 5 . HB1 . . . . . 5 . HG1 . . rr_6e5k 1
76 2 OR . 1 1 5 5 LYS HB3 H . . . 1 1 5 5 LYS HG2 H . . . . . 2.446 1.698 3.194 . . . . . A . 5 LYS HB3 . . A . 5 LYS HG2 . . . 5 . HB2 . . . . . 5 . HG1 . . rr_6e5k 1
77 1 . . 1 1 14 14 CYS HB3 H . . . 1 1 11 11 TYR HB3 H . . . . . 2.451 1.700 3.202 . . . . . A . 14 CYS HB3 . . A . 11 TYR HB3 . . . 14 . HB2 . . . . . 11 . HB2 . . rr_6e5k 1
78 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HA H . . . . . 2.462 1.704 3.220 . . . . . A . 11 TYR HB3 . . A . 11 TYR HA . . . 11 . HB2 . . . . . 11 . HA . . rr_6e5k 1
79 1 . . 1 1 7 7 LEU H H . . . 1 1 7 7 LEU HG H . . . . . 2.462 1.704 3.220 . . . . . A . 7 LEU H . . A . 7 LEU HG . . . 7 . HN . . . . . 7 . HG . . rr_6e5k 1
80 1 . . 1 1 4 4 CYS HB2 H . . . 1 1 4 4 CYS H H . . . . . 2.464 1.705 3.223 . . . . . A . 4 CYS HB2 . . A . 4 CYS H . . . 4 . HB1 . . . . . 4 . HN . . rr_6e5k 1
81 1 OR . 1 1 25 25 MVA HG11 H . . . 1 1 23 23 TYR HD2 H . . . . . 2.464 1.705 3.223 . . . . . A . 25 MVA HG11 . . A . 23 TYR HD2 . . . 25 . HG11 . . . . . 23 . HD2 . . rr_6e5k 1
81 2 OR . 1 1 25 25 MVA HG11 H . . . 1 1 23 23 TYR HD1 H . . . . . 2.464 1.705 3.223 . . . . . A . 25 MVA HG11 . . A . 23 TYR HD1 . . . 25 . HG11 . . . . . 23 . HD1 . . rr_6e5k 1
82 1 . . 1 1 20 20 DPR HD2 H . . . 1 1 20 20 DPR HG3 H . . . . . 2.467 1.706 3.228 . . . . . A . 20 DPR HD2 . . A . 20 DPR HG3 . . . 20 . HD1 . . . . . 20 . HG2 . . rr_6e5k 1
83 1 . . 1 1 19 19 ASP HB2 H . . . 1 1 19 19 ASP HA H . . . . . 2.472 1.708 3.236 . . . . . A . 19 ASP HB2 . . A . 19 ASP HA . . . 19 . HB1 . . . . . 19 . HA . . rr_6e5k 1
84 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 7 7 LEU HA H . . . . . 2.472 1.708 3.236 . . . . . A . 7 LEU MD2 . . A . 7 LEU HA . . . 7 . HD21 . . . . . 7 . HA . . rr_6e5k 1
85 1 . . 1 1 7 7 LEU HG H . . . 1 1 7 7 LEU MD1 H . . . . . 2.475 1.709 3.241 . . . . . A . 7 LEU HG . . A . 7 LEU MD1 . . . 7 . HG . . . . . 7 . HD11 . . rr_6e5k 1
86 1 . . 1 1 24 24 GLU HA H . . . 1 1 24 24 GLU HB3 H . . . . . 2.475 1.709 3.241 . . . . . A . 24 GLU HA . . A . 24 GLU HB3 . . . 24 . HA . . . . . 24 . HB2 . . rr_6e5k 1
87 1 . . 1 1 26 26 HIS HB3 H . . . 1 1 26 26 HIS HA H . . . . . 2.477 1.710 3.244 . . . . . A . 26 HIS HB3 . . A . 26 HIS HA . . . 26 . HB2 . . . . . 26 . HA . . rr_6e5k 1
88 1 . . 1 1 25 25 MVA HA H . . . 1 1 25 25 MVA HG11 H . . . . . 2.477 1.710 3.244 . . . . . A . 25 MVA HA . . A . 25 MVA HG11 . . . 25 . HA . . . . . 25 . HG11 . . rr_6e5k 1
89 1 . . 1 1 13 13 GLY HA3 H . . . 1 1 13 13 GLY H H . . . . . 2.484 1.713 3.255 . . . . . A . 13 GLY HA3 . . A . 13 GLY H . . . 13 . HA2 . . . . . 13 . HN . . rr_6e5k 1
90 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR H H . . . . . 2.489 1.714 3.264 . . . . . A . 11 TYR HB2 . . A . 11 TYR H . . . 11 . HB1 . . . . . 11 . HN . . rr_6e5k 1
91 1 . . 1 1 11 11 TYR H H . . . 1 1 10 10 ARG H H . . . . . 2.493 1.716 3.270 . . . . . A . 11 TYR H . . A . 10 ARG H . . . 11 . HN . . . . . 10 . HN . . rr_6e5k 1
92 1 . . 1 1 8 8 LYS H H . . . 1 1 7 7 LEU H H . . . . . 2.496 1.717 3.275 . . . . . A . 8 LYS H . . A . 7 LEU H . . . 8 . HN . . . . . 7 . HN . . rr_6e5k 1
93 1 . . 1 1 20 20 DPR HD3 H . . . 1 1 20 20 DPR HG2 H . . . . . 2.502 1.720 3.284 . . . . . A . 20 DPR HD3 . . A . 20 DPR HG2 . . . 20 . HD2 . . . . . 20 . HG1 . . rr_6e5k 1
94 1 . . 1 1 24 24 GLU H H . . . 1 1 24 24 GLU HB2 H . . . . . 2.502 1.720 3.284 . . . . . A . 24 GLU H . . A . 24 GLU HB2 . . . 24 . HN . . . . . 24 . HB1 . . rr_6e5k 1
95 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 26 26 HIS H H . . . . . 2.502 1.720 3.284 . . . . . A . 26 HIS HB2 . . A . 26 HIS H . . . 26 . HB1 . . . . . 26 . HN . . rr_6e5k 1
96 1 . . 1 1 18 18 CYS HB2 H . . . 1 1 18 18 CYS H H . . . . . 2.507 1.721 3.293 . . . . . A . 18 CYS HB2 . . A . 18 CYS H . . . 18 . HB1 . . . . . 18 . HN . . rr_6e5k 1
97 1 . . 1 1 10 10 ARG H H . . . 1 1 10 10 ARG HB3 H . . . . . 2.507 1.721 3.293 . . . . . A . 10 ARG H . . A . 10 ARG HB3 . . . 10 . HN . . . . . 10 . HB2 . . rr_6e5k 1
98 1 . . 1 1 11 11 TYR HA H . . . 1 1 12 12 ABA H H . . . . . 2.509 1.722 3.296 . . . . . A . 11 TYR HA . . A . 12 AIB H . . . 11 . HA . . . . . 12 . HN . . rr_6e5k 1
99 1 . . 1 1 14 14 CYS HB3 H . . . 1 1 25 25 MVA HG21 H . . . . . 2.530 1.730 3.330 . . . . . A . 14 CYS HB3 . . A . 25 MVA HG21 . . . 14 . HB2 . . . . . 25 . HG21 . . rr_6e5k 1
100 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 26 26 HIS HA H . . . . . 2.534 1.731 3.337 . . . . . A . 26 HIS HB2 . . A . 26 HIS HA . . . 26 . HB1 . . . . . 26 . HA . . rr_6e5k 1
101 1 . . 1 1 17 17 ARG HG3 H . . . 1 1 17 17 ARG HB3 H . . . . . 2.536 1.732 3.340 . . . . . A . 17 ARG HG3 . . A . 17 ARG HB3 . . . 17 . HG2 . . . . . 17 . HB2 . . rr_6e5k 1
102 1 . . 1 1 4 4 CYS HA H . . . 1 1 4 4 CYS H H . . . . . 2.538 1.733 3.343 . . . . . A . 4 CYS HA . . A . 4 CYS H . . . 4 . HA . . . . . 4 . HN . . rr_6e5k 1
103 1 . . 1 1 16 16 MVA HG21 H . . . 1 1 25 25 MVA HG11 H . . . . . 2.546 1.736 3.356 . . . . . A . 16 MVA HG21 . . A . 25 MVA HG11 . . . 16 . HG21 . . . . . 25 . HG11 . . rr_6e5k 1
104 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 16 16 MVA HG11 H . . . . . 2.550 1.737 3.363 . . . . . A . 11 TYR HB2 . . A . 16 MVA HG11 . . . 11 . HB1 . . . . . 16 . HG11 . . rr_6e5k 1
105 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 16 16 MVA HG21 H . . . . . 2.563 1.742 3.384 . . . . . A . 23 TYR HB2 . . A . 16 MVA HG21 . . . 23 . HB1 . . . . . 16 . HG21 . . rr_6e5k 1
106 1 OR . 1 1 22 22 ARG HB2 H . . . 1 1 22 22 ARG HD3 H . . . . . 2.565 1.742 3.388 . . . . . A . 22 ARG HB2 . . A . 22 ARG HD3 . . . 22 . HB1 . . . . . 22 . HD2 . . rr_6e5k 1
106 2 OR . 1 1 22 22 ARG HB2 H . . . 1 1 22 22 ARG HD2 H . . . . . 2.565 1.742 3.388 . . . . . A . 22 ARG HB2 . . A . 22 ARG HD2 . . . 22 . HB1 . . . . . 22 . HD1 . . rr_6e5k 1
106 3 OR . 1 1 22 22 ARG HB3 H . . . 1 1 22 22 ARG HD2 H . . . . . 2.565 1.742 3.388 . . . . . A . 22 ARG HB3 . . A . 22 ARG HD2 . . . 22 . HB2 . . . . . 22 . HD1 . . rr_6e5k 1
106 4 OR . 1 1 22 22 ARG HB3 H . . . 1 1 22 22 ARG HD3 H . . . . . 2.565 1.742 3.388 . . . . . A . 22 ARG HB3 . . A . 22 ARG HD3 . . . 22 . HB2 . . . . . 22 . HD2 . . rr_6e5k 1
107 1 . . 1 1 17 17 ARG H H . . . 1 1 17 17 ARG HB3 H . . . . . 2.565 1.742 3.388 . . . . . A . 17 ARG H . . A . 17 ARG HB3 . . . 17 . HN . . . . . 17 . HB2 . . rr_6e5k 1
108 1 . . 1 1 4 4 CYS HB2 H . . . 1 1 4 4 CYS HA H . . . . . 2.570 1.745 3.395 . . . . . A . 4 CYS HB2 . . A . 4 CYS HA . . . 4 . HB1 . . . . . 4 . HA . . rr_6e5k 1
109 1 . . 1 1 17 17 ARG HA H . . . 1 1 17 17 ARG HB3 H . . . . . 2.576 1.746 3.406 . . . . . A . 17 ARG HA . . A . 17 ARG HB3 . . . 17 . HA . . . . . 17 . HB2 . . rr_6e5k 1
110 1 . . 1 1 21 21 PRO HD3 H . . . 1 1 21 21 PRO HG3 H . . . . . 2.579 1.748 3.410 . . . . . A . 21 PRO HD3 . . A . 21 PRO HG3 . . . 21 . HD2 . . . . . 21 . HG2 . . rr_6e5k 1
111 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 24 24 GLU H H . . . . . 2.581 1.748 3.414 . . . . . A . 23 TYR HB2 . . A . 24 GLU H . . . 23 . HB1 . . . . . 24 . HN . . rr_6e5k 1
112 1 . . 1 1 18 18 CYS HB2 H . . . 1 1 18 18 CYS HA H . . . . . 2.585 1.749 3.421 . . . . . A . 18 CYS HB2 . . A . 18 CYS HA . . . 18 . HB1 . . . . . 18 . HA . . rr_6e5k 1
113 1 . . 1 1 17 17 ARG HA H . . . 1 1 17 17 ARG HB2 H . . . . . 2.585 1.749 3.421 . . . . . A . 17 ARG HA . . A . 17 ARG HB2 . . . 17 . HA . . . . . 17 . HB1 . . rr_6e5k 1
114 1 . . 1 1 17 17 ARG H H . . . 1 1 17 17 ARG HB2 H . . . . . 2.595 1.753 3.437 . . . . . A . 17 ARG H . . A . 17 ARG HB2 . . . 17 . HN . . . . . 17 . HB1 . . rr_6e5k 1
115 1 OR . 1 1 22 22 ARG HB2 H . . . 1 1 23 23 TYR H H . . . . . 2.599 1.754 3.444 . . . . . A . 22 ARG HB2 . . A . 23 TYR H . . . 22 . HB1 . . . . . 23 . HN . . rr_6e5k 1
115 2 OR . 1 1 22 22 ARG HB3 H . . . 1 1 23 23 TYR H H . . . . . 2.599 1.754 3.444 . . . . . A . 22 ARG HB3 . . A . 23 TYR H . . . 22 . HB2 . . . . . 23 . HN . . rr_6e5k 1
116 1 . . 1 1 7 7 LEU HB2 H . . . 1 1 7 7 LEU HA H . . . . . 2.607 1.758 3.456 . . . . . A . 7 LEU HB2 . . A . 7 LEU HA . . . 7 . HB1 . . . . . 7 . HA . . rr_6e5k 1
117 1 . . 1 1 7 7 LEU HB2 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.616 1.760 3.472 . . . . . A . 7 LEU HB2 . . A . 7 LEU MD1 . . . 7 . HB1 . . . . . 7 . HD11 . . rr_6e5k 1
118 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 16 16 MVA HG11 H . . . . . 2.619 1.762 3.476 . . . . . A . 11 TYR HD1 . . A . 16 MVA HG11 . . . 11 . HD1 . . . . . 16 . HG11 . . rr_6e5k 1
118 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 16 16 MVA HG11 H . . . . . 2.619 1.762 3.476 . . . . . A . 11 TYR HD2 . . A . 16 MVA HG11 . . . 11 . HD2 . . . . . 16 . HG11 . . rr_6e5k 1
119 1 . . 1 1 13 13 GLY H H . . . 1 1 14 14 CYS H H . . . . . 2.619 1.762 3.476 . . . . . A . 13 GLY H . . A . 14 CYS H . . . 13 . HN . . . . . 14 . HN . . rr_6e5k 1
120 1 . . 1 1 16 16 MVA HG11 H . . . 1 1 8 8 LYS HA H . . . . . 2.621 1.762 3.480 . . . . . A . 16 MVA HG11 . . A . 8 LYS HA . . . 16 . HG11 . . . . . 8 . HA . . rr_6e5k 1
121 1 . . 1 1 14 14 CYS HB3 H . . . 1 1 14 14 CYS HA H . . . . . 2.627 1.765 3.489 . . . . . A . 14 CYS HB3 . . A . 14 CYS HA . . . 14 . HB2 . . . . . 14 . HA . . rr_6e5k 1
122 1 OR . 1 1 24 24 GLU HA H . . . 1 1 24 24 GLU HG2 H . . . . . 2.629 1.765 3.493 . . . . . A . 24 GLU HA . . A . 24 GLU HG2 . . . 24 . HA . . . . . 24 . HG1 . . rr_6e5k 1
122 2 OR . 1 1 24 24 GLU HA H . . . 1 1 24 24 GLU HG3 H . . . . . 2.629 1.765 3.493 . . . . . A . 24 GLU HA . . A . 24 GLU HG3 . . . 24 . HA . . . . . 24 . HG2 . . rr_6e5k 1
123 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 27 27 CYS HA H . . . . . 2.632 1.766 3.498 . . . . . A . 14 CYS HB2 . . A . 27 CYS HA . . . 14 . HB1 . . . . . 27 . HA . . rr_6e5k 1
124 1 . . 1 1 2 2 ASP HB2 H . . . 1 1 2 2 ASP HA H . . . . . 2.637 1.768 3.506 . . . . . A . 2 ASP HB2 . . A . 2 ASP HA . . . 2 . HB1 . . . . . 2 . HA . . rr_6e5k 1
125 1 OR . 1 1 26 26 HIS HB2 H . . . 1 1 15 15 GLU HB2 H . . . . . 2.642 1.769 3.515 . . . . . A . 26 HIS HB2 . . A . 15 GLU HB2 . . . 26 . HB1 . . . . . 15 . HB1 . . rr_6e5k 1
125 2 OR . 1 1 26 26 HIS HB2 H . . . 1 1 15 15 GLU HB3 H . . . . . 2.642 1.769 3.515 . . . . . A . 26 HIS HB2 . . A . 15 GLU HB3 . . . 26 . HB1 . . . . . 15 . HB2 . . rr_6e5k 1
126 1 . . 1 1 2 2 ASP HB3 H . . . 1 1 2 2 ASP HA H . . . . . 2.642 1.769 3.515 . . . . . A . 2 ASP HB3 . . A . 2 ASP HA . . . 2 . HB2 . . . . . 2 . HA . . rr_6e5k 1
127 1 . . 1 1 19 19 ASP HB3 H . . . 1 1 19 19 ASP HA H . . . . . 2.645 1.771 3.519 . . . . . A . 19 ASP HB3 . . A . 19 ASP HA . . . 19 . HB2 . . . . . 19 . HA . . rr_6e5k 1
128 1 . . 1 1 20 20 DPR HB2 H . . . 1 1 20 20 DPR HA H . . . . . 2.645 1.771 3.519 . . . . . A . 20 DPR HB2 . . A . 20 DPR HA . . . 20 . HB1 . . . . . 20 . HA . . rr_6e5k 1
129 1 OR . 1 1 16 16 MVA HG21 H . . . 1 1 23 23 TYR HD1 H . . . . . 2.650 1.772 3.528 . . . . . A . 16 MVA HG21 . . A . 23 TYR HD1 . . . 16 . HG21 . . . . . 23 . HD1 . . rr_6e5k 1
129 2 OR . 1 1 16 16 MVA HG21 H . . . 1 1 23 23 TYR HD2 H . . . . . 2.650 1.772 3.528 . . . . . A . 16 MVA HG21 . . A . 23 TYR HD2 . . . 16 . HG21 . . . . . 23 . HD2 . . rr_6e5k 1
130 1 . . 1 1 10 10 ARG H H . . . 1 1 10 10 ARG HB2 H . . . . . 2.650 1.772 3.528 . . . . . A . 10 ARG H . . A . 10 ARG HB2 . . . 10 . HN . . . . . 10 . HB1 . . rr_6e5k 1
131 1 OR . 1 1 22 22 ARG HG2 H . . . 1 1 22 22 ARG HA H . . . . . 2.650 1.772 3.528 . . . . . A . 22 ARG HG2 . . A . 22 ARG HA . . . 22 . HG1 . . . . . 22 . HA . . rr_6e5k 1
131 2 OR . 1 1 22 22 ARG HG3 H . . . 1 1 22 22 ARG HA H . . . . . 2.650 1.772 3.528 . . . . . A . 22 ARG HG3 . . A . 22 ARG HA . . . 22 . HG2 . . . . . 22 . HA . . rr_6e5k 1
132 1 . . 1 1 14 14 CYS HA H . . . 1 1 14 14 CYS H H . . . . . 2.653 1.773 3.533 . . . . . A . 14 CYS HA . . A . 14 CYS H . . . 14 . HA . . . . . 14 . HN . . rr_6e5k 1
133 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 16 16 MVA HG21 H . . . . . 2.664 1.777 3.551 . . . . . A . 7 LEU MD2 . . A . 16 MVA HG21 . . . 7 . HD21 . . . . . 16 . HG21 . . rr_6e5k 1
134 1 . . 1 1 5 5 LYS H H . . . 1 1 4 4 CYS H H . . . . . 2.664 1.777 3.551 . . . . . A . 5 LYS H . . A . 4 CYS H . . . 5 . HN . . . . . 4 . HN . . rr_6e5k 1
135 1 OR . 1 1 17 17 ARG HB2 H . . . 1 1 17 17 ARG HD2 H . . . . . 2.667 1.778 3.556 . . . . . A . 17 ARG HB2 . . A . 17 ARG HD2 . . . 17 . HB1 . . . . . 17 . HD1 . . rr_6e5k 1
135 2 OR . 1 1 17 17 ARG HB2 H . . . 1 1 17 17 ARG HD3 H . . . . . 2.667 1.778 3.556 . . . . . A . 17 ARG HB2 . . A . 17 ARG HD3 . . . 17 . HB1 . . . . . 17 . HD2 . . rr_6e5k 1
136 1 . . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS H H . . . . . 2.670 1.779 3.561 . . . . . A . 8 LYS HA . . A . 8 LYS H . . . 8 . HA . . . . . 8 . HN . . rr_6e5k 1
137 1 . . 1 1 9 9 ABA H H . . . 1 1 8 8 LYS HA H . . . . . 2.676 1.781 3.571 . . . . . A . 9 AIB H . . A . 8 LYS HA . . . 9 . HN . . . . . 8 . HA . . rr_6e5k 1
138 1 . . 1 1 19 19 ASP HB3 H . . . 1 1 19 19 ASP H H . . . . . 2.676 1.781 3.571 . . . . . A . 19 ASP HB3 . . A . 19 ASP H . . . 19 . HB2 . . . . . 19 . HN . . rr_6e5k 1
139 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 25 25 MVA HG21 H . . . . . 2.676 1.781 3.571 . . . . . A . 11 TYR HD1 . . A . 25 MVA HG21 . . . 11 . HD1 . . . . . 25 . HG21 . . rr_6e5k 1
139 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 25 25 MVA HG21 H . . . . . 2.676 1.781 3.571 . . . . . A . 11 TYR HD2 . . A . 25 MVA HG21 . . . 11 . HD2 . . . . . 25 . HG21 . . rr_6e5k 1
140 1 . . 1 1 23 23 TYR HA H . . . 1 1 23 23 TYR H H . . . . . 2.685 1.784 3.586 . . . . . A . 23 TYR HA . . A . 23 TYR H . . . 23 . HA . . . . . 23 . HN . . rr_6e5k 1
141 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.688 1.785 3.591 . . . . . A . 11 TYR HE2 . . A . 7 LEU MD2 . . . 11 . HE2 . . . . . 7 . HD21 . . rr_6e5k 1
141 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 7 7 LEU MD2 H . . . . . 2.688 1.785 3.591 . . . . . A . 11 TYR HE1 . . A . 7 LEU MD2 . . . 11 . HE1 . . . . . 7 . HD21 . . rr_6e5k 1
142 1 . . 1 1 12 12 ABA H H . . . 1 1 11 11 TYR H H . . . . . 2.688 1.785 3.591 . . . . . A . 12 AIB H . . A . 11 TYR H . . . 12 . HN . . . . . 11 . HN . . rr_6e5k 1
143 1 OR . 1 1 25 25 MVA HG11 H . . . 1 1 23 23 TYR HE1 H . . . . . 2.694 1.787 3.601 . . . . . A . 25 MVA HG11 . . A . 23 TYR HE1 . . . 25 . HG11 . . . . . 23 . HE1 . . rr_6e5k 1
143 2 OR . 1 1 25 25 MVA HG11 H . . . 1 1 23 23 TYR HE2 H . . . . . 2.694 1.787 3.601 . . . . . A . 25 MVA HG11 . . A . 23 TYR HE2 . . . 25 . HG11 . . . . . 23 . HE2 . . rr_6e5k 1
144 1 . . 1 1 4 4 CYS HB3 H . . . 1 1 4 4 CYS H H . . . . . 2.697 1.788 3.606 . . . . . A . 4 CYS HB3 . . A . 4 CYS H . . . 4 . HB2 . . . . . 4 . HN . . rr_6e5k 1
145 1 . . 1 1 18 18 CYS HA H . . . 1 1 18 18 CYS H H . . . . . 2.700 1.789 3.611 . . . . . A . 18 CYS HA . . A . 18 CYS H . . . 18 . HA . . . . . 18 . HN . . rr_6e5k 1
146 1 OR . 1 1 6 6 ABA H H . . . 1 1 5 5 LYS HB2 H . . . . . 2.700 1.789 3.611 . . . . . A . 6 AIB H . . A . 5 LYS HB2 . . . 6 . HN . . . . . 5 . HB1 . . rr_6e5k 1
146 2 OR . 1 1 6 6 ABA H H . . . 1 1 5 5 LYS HB3 H . . . . . 2.700 1.789 3.611 . . . . . A . 6 AIB H . . A . 5 LYS HB3 . . . 6 . HN . . . . . 5 . HB2 . . rr_6e5k 1
147 1 OR . 1 1 5 5 LYS HB2 H . . . 1 1 5 5 LYS HG3 H . . . . . 2.703 1.790 3.616 . . . . . A . 5 LYS HB2 . . A . 5 LYS HG3 . . . 5 . HB1 . . . . . 5 . HG2 . . rr_6e5k 1
147 2 OR . 1 1 5 5 LYS HB3 H . . . 1 1 5 5 LYS HG3 H . . . . . 2.703 1.790 3.616 . . . . . A . 5 LYS HB3 . . A . 5 LYS HG3 . . . 5 . HB2 . . . . . 5 . HG2 . . rr_6e5k 1
148 1 . . 1 1 6 6 ABA H H . . . 1 1 7 7 LEU H H . . . . . 2.706 1.791 3.621 . . . . . A . 6 AIB H . . A . 7 LEU H . . . 6 . HN . . . . . 7 . HN . . rr_6e5k 1
149 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 7 7 LEU HG H . . . . . 2.709 1.792 3.626 . . . . . A . 7 LEU MD2 . . A . 7 LEU HG . . . 7 . HD21 . . . . . 7 . HG . . rr_6e5k 1
150 1 . . 1 1 17 17 ARG H H . . . 1 1 16 16 MVA HG21 H . . . . . 2.719 1.795 3.643 . . . . . A . 17 ARG H . . A . 16 MVA HG21 . . . 17 . HN . . . . . 16 . HG21 . . rr_6e5k 1
151 1 . . 1 1 6 6 ABA H H . . . 1 1 5 5 LYS HA H . . . . . 2.722 1.796 3.648 . . . . . A . 6 AIB H . . A . 5 LYS HA . . . 6 . HN . . . . . 5 . HA . . rr_6e5k 1
152 1 OR . 1 1 22 22 ARG HG2 H . . . 1 1 22 22 ARG H H . . . . . 2.722 1.796 3.648 . . . . . A . 22 ARG HG2 . . A . 22 ARG H . . . 22 . HG1 . . . . . 22 . HN . . rr_6e5k 1
152 2 OR . 1 1 22 22 ARG HG3 H . . . 1 1 22 22 ARG H H . . . . . 2.722 1.796 3.648 . . . . . A . 22 ARG HG3 . . A . 22 ARG H . . . 22 . HG2 . . . . . 22 . HN . . rr_6e5k 1
153 1 . . 1 1 7 7 LEU HB3 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.722 1.796 3.648 . . . . . A . 7 LEU HB3 . . A . 7 LEU MD1 . . . 7 . HB2 . . . . . 7 . HD11 . . rr_6e5k 1
154 1 . . 1 1 27 27 CYS HB2 H . . . 1 1 27 27 CYS HA H . . . . . 2.725 1.797 3.653 . . . . . A . 27 CYS HB2 . . A . 27 CYS HA . . . 27 . HB1 . . . . . 27 . HA . . rr_6e5k 1
155 1 OR . 1 1 17 17 ARG HD2 H . . . 1 1 17 17 ARG HG2 H . . . . . 2.725 1.797 3.653 . . . . . A . 17 ARG HD2 . . A . 17 ARG HG2 . . . 17 . HD1 . . . . . 17 . HG1 . . rr_6e5k 1
155 2 OR . 1 1 17 17 ARG HD3 H . . . 1 1 17 17 ARG HG2 H . . . . . 2.725 1.797 3.653 . . . . . A . 17 ARG HD3 . . A . 17 ARG HG2 . . . 17 . HD2 . . . . . 17 . HG1 . . rr_6e5k 1
156 1 . . 1 1 17 17 ARG H H . . . 1 1 17 17 ARG HA H . . . . . 2.729 1.798 3.660 . . . . . A . 17 ARG H . . A . 17 ARG HA . . . 17 . HN . . . . . 17 . HA . . rr_6e5k 1
157 1 . . 1 1 1 1 ASN HA H . . . 1 1 2 2 ASP H H . . . . . 2.732 1.799 3.665 . . . . . A . 1 ASN HA . . A . 2 ASP H . . . 1 . HA . . . . . 2 . HN . . rr_6e5k 1
158 1 . . 1 1 26 26 HIS H H . . . 1 1 25 25 MVA HG21 H . . . . . 2.735 1.800 3.670 . . . . . A . 26 HIS H . . A . 25 MVA HG21 . . . 26 . HN . . . . . 25 . HG21 . . rr_6e5k 1
159 1 . . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HA H . . . . . 2.735 1.800 3.670 . . . . . A . 5 LYS H . . A . 5 LYS HA . . . 5 . HN . . . . . 5 . HA . . rr_6e5k 1
160 1 . . 1 1 27 27 CYS H H . . . 1 1 27 27 CYS HA H . . . . . 2.739 1.801 3.677 . . . . . A . 27 CYS H . . A . 27 CYS HA . . . 27 . HN . . . . . 27 . HA . . rr_6e5k 1
161 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 25 25 MVA HG21 H . . . . . 2.742 1.802 3.682 . . . . . A . 11 TYR HB3 . . A . 25 MVA HG21 . . . 11 . HB2 . . . . . 25 . HG21 . . rr_6e5k 1
162 1 . . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HG2 H . . . . . 2.742 1.802 3.682 . . . . . A . 8 LYS HA . . A . 8 LYS HG2 . . . 8 . HA . . . . . 8 . HG1 . . rr_6e5k 1
163 1 . . 1 1 11 11 TYR HA H . . . 1 1 11 11 TYR H H . . . . . 2.746 1.804 3.688 . . . . . A . 11 TYR HA . . A . 11 TYR H . . . 11 . HA . . . . . 11 . HN . . rr_6e5k 1
164 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 25 25 MVA HG11 H . . . . . 2.749 1.804 3.694 . . . . . A . 11 TYR HE2 . . A . 25 MVA HG11 . . . 11 . HE2 . . . . . 25 . HG11 . . rr_6e5k 1
164 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 25 25 MVA HG11 H . . . . . 2.749 1.804 3.694 . . . . . A . 11 TYR HE1 . . A . 25 MVA HG11 . . . 11 . HE1 . . . . . 25 . HG11 . . rr_6e5k 1
165 1 . . 1 1 9 9 ABA H H . . . 1 1 10 10 ARG H H . . . . . 2.749 1.804 3.694 . . . . . A . 9 AIB H . . A . 10 ARG H . . . 9 . HN . . . . . 10 . HN . . rr_6e5k 1
166 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HA H . . . . . 2.753 1.806 3.700 . . . . . A . 11 TYR HB2 . . A . 11 TYR HA . . . 11 . HB1 . . . . . 11 . HA . . rr_6e5k 1
167 1 . . 1 1 15 15 GLU HG3 H . . . 1 1 15 15 GLU HA H . . . . . 2.753 1.806 3.700 . . . . . A . 15 GLU HG3 . . A . 15 GLU HA . . . 15 . HG2 . . . . . 15 . HA . . rr_6e5k 1
168 1 . . 1 1 8 8 LYS H H . . . 1 1 7 7 LEU HA H . . . . . 2.760 1.808 3.712 . . . . . A . 8 LYS H . . A . 7 LEU HA . . . 8 . HN . . . . . 7 . HA . . rr_6e5k 1
169 1 OR . 1 1 9 9 ABA H H . . . 1 1 8 8 LYS HB2 H . . . . . 2.764 1.809 3.719 . . . . . A . 9 AIB H . . A . 8 LYS HB2 . . . 9 . HN . . . . . 8 . HB1 . . rr_6e5k 1
169 2 OR . 1 1 9 9 ABA H H . . . 1 1 8 8 LYS HB3 H . . . . . 2.764 1.809 3.719 . . . . . A . 9 AIB H . . A . 8 LYS HB3 . . . 9 . HN . . . . . 8 . HB2 . . rr_6e5k 1
170 1 . . 1 1 7 7 LEU H H . . . 1 1 7 7 LEU HA H . . . . . 2.767 1.810 3.724 . . . . . A . 7 LEU H . . A . 7 LEU HA . . . 7 . HN . . . . . 7 . HA . . rr_6e5k 1
171 1 . . 1 1 19 19 ASP H H . . . 1 1 19 19 ASP HA H . . . . . 2.767 1.810 3.724 . . . . . A . 19 ASP H . . A . 19 ASP HA . . . 19 . HN . . . . . 19 . HA . . rr_6e5k 1
172 1 . . 1 1 21 21 PRO HD3 H . . . 1 1 22 22 ARG H H . . . . . 2.775 1.813 3.737 . . . . . A . 21 PRO HD3 . . A . 22 ARG H . . . 21 . HD2 . . . . . 22 . HN . . rr_6e5k 1
173 1 . . 1 1 20 20 DPR HD3 H . . . 1 1 20 20 DPR HG3 H . . . . . 2.775 1.813 3.737 . . . . . A . 20 DPR HD3 . . A . 20 DPR HG3 . . . 20 . HD2 . . . . . 20 . HG2 . . rr_6e5k 1
174 1 . . 1 1 20 20 DPR HD2 H . . . 1 1 20 20 DPR HG2 H . . . . . 2.782 1.814 3.750 . . . . . A . 20 DPR HD2 . . A . 20 DPR HG2 . . . 20 . HD1 . . . . . 20 . HG1 . . rr_6e5k 1
175 1 . . 1 1 22 22 ARG HA H . . . 1 1 22 22 ARG H H . . . . . 2.786 1.816 3.756 . . . . . A . 22 ARG HA . . A . 22 ARG H . . . 22 . HA . . . . . 22 . HN . . rr_6e5k 1
176 1 . . 1 1 25 25 MVA HA H . . . 1 1 25 25 MVA HB H . . . . . 2.802 1.821 3.783 . . . . . A . 25 MVA HA . . A . 25 MVA HB . . . 25 . HA . . . . . 25 . HB . . rr_6e5k 1
177 1 OR . 1 1 17 17 ARG HB3 H . . . 1 1 17 17 ARG HD2 H . . . . . 2.802 1.821 3.783 . . . . . A . 17 ARG HB3 . . A . 17 ARG HD2 . . . 17 . HB2 . . . . . 17 . HD1 . . rr_6e5k 1
177 2 OR . 1 1 17 17 ARG HB3 H . . . 1 1 17 17 ARG HD3 H . . . . . 2.802 1.821 3.783 . . . . . A . 17 ARG HB3 . . A . 17 ARG HD3 . . . 17 . HB2 . . . . . 17 . HD2 . . rr_6e5k 1
178 1 . . 1 1 16 16 MVA HG21 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.814 1.824 3.804 . . . . . A . 16 MVA HG21 . . A . 7 LEU MD1 . . . 16 . HG21 . . . . . 7 . HD11 . . rr_6e5k 1
179 1 . . 1 1 26 26 HIS H H . . . 1 1 26 26 HIS HA H . . . . . 2.818 1.825 3.811 . . . . . A . 26 HIS H . . A . 26 HIS HA . . . 26 . HN . . . . . 26 . HA . . rr_6e5k 1
180 1 . . 1 1 9 9 ABA H H . . . 1 1 8 8 LYS H H . . . . . 2.818 1.825 3.811 . . . . . A . 9 AIB H . . A . 8 LYS H . . . 9 . HN . . . . . 8 . HN . . rr_6e5k 1
181 1 OR . 1 1 23 23 TYR H H . . . 1 1 23 23 TYR HD2 H . . . . . 2.827 1.828 3.826 . . . . . A . 23 TYR H . . A . 23 TYR HD2 . . . 23 . HN . . . . . 23 . HD2 . . rr_6e5k 1
181 2 OR . 1 1 23 23 TYR H H . . . 1 1 23 23 TYR HD1 H . . . . . 2.827 1.828 3.826 . . . . . A . 23 TYR H . . A . 23 TYR HD1 . . . 23 . HN . . . . . 23 . HD1 . . rr_6e5k 1
182 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 7 7 LEU HB2 H . . . . . 2.827 1.828 3.826 . . . . . A . 11 TYR HD2 . . A . 7 LEU HB2 . . . 11 . HD2 . . . . . 7 . HB1 . . rr_6e5k 1
182 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 7 7 LEU HB2 H . . . . . 2.827 1.828 3.826 . . . . . A . 11 TYR HD1 . . A . 7 LEU HB2 . . . 11 . HD1 . . . . . 7 . HB1 . . rr_6e5k 1
183 1 . . 1 1 24 24 GLU HA H . . . 1 1 24 24 GLU HB2 H . . . . . 2.836 1.831 3.841 . . . . . A . 24 GLU HA . . A . 24 GLU HB2 . . . 24 . HA . . . . . 24 . HB1 . . rr_6e5k 1
184 1 . . 1 1 18 18 CYS HB3 H . . . 1 1 18 18 CYS H H . . . . . 2.836 1.831 3.841 . . . . . A . 18 CYS HB3 . . A . 18 CYS H . . . 18 . HB2 . . . . . 18 . HN . . rr_6e5k 1
185 1 . . 1 1 16 16 MVA HA H . . . 1 1 16 16 MVA HB H . . . . . 2.836 1.831 3.841 . . . . . A . 16 MVA HA . . A . 16 MVA HB . . . 16 . HA . . . . . 16 . HB . . rr_6e5k 1
186 1 . . 1 1 16 16 MVA HG11 H . . . 1 1 7 7 LEU HB3 H . . . . . 2.836 1.831 3.841 . . . . . A . 16 MVA HG11 . . A . 7 LEU HB3 . . . 16 . HG11 . . . . . 7 . HB2 . . rr_6e5k 1
187 1 . . 1 1 19 19 ASP H H . . . 1 1 23 23 TYR HA H . . . . . 2.844 1.833 3.855 . . . . . A . 19 ASP H . . A . 23 TYR HA . . . 19 . HN . . . . . 23 . HA . . rr_6e5k 1
188 1 . . 1 1 12 12 ABA H H . . . 1 1 10 10 ARG HA H . . . . . 2.844 1.833 3.855 . . . . . A . 12 AIB H . . A . 10 ARG HA . . . 12 . HN . . . . . 10 . HA . . rr_6e5k 1
189 1 . . 1 1 17 17 ARG H H . . . 1 1 24 24 GLU H H . . . . . 2.844 1.833 3.855 . . . . . A . 17 ARG H . . A . 24 GLU H . . . 17 . HN . . . . . 24 . HN . . rr_6e5k 1
190 1 . . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG HG3 H . . . . . 2.844 1.833 3.855 . . . . . A . 10 ARG HA . . A . 10 ARG HG3 . . . 10 . HA . . . . . 10 . HG2 . . rr_6e5k 1
191 1 . . 1 1 21 21 PRO HG2 H . . . 1 1 22 22 ARG H H . . . . . 2.849 1.834 3.864 . . . . . A . 21 PRO HG2 . . A . 22 ARG H . . . 21 . HG1 . . . . . 22 . HN . . rr_6e5k 1
192 1 . . 1 1 23 23 TYR HB3 H . . . 1 1 16 16 MVA HG21 H . . . . . 2.854 1.836 3.872 . . . . . A . 23 TYR HB3 . . A . 16 MVA HG21 . . . 23 . HB2 . . . . . 16 . HG21 . . rr_6e5k 1
193 1 . . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HG3 H . . . . . 2.858 1.837 3.879 . . . . . A . 8 LYS HA . . A . 8 LYS HG3 . . . 8 . HA . . . . . 8 . HG2 . . rr_6e5k 1
194 1 . . 1 1 20 20 DPR HB2 H . . . 1 1 20 20 DPR HD2 H . . . . . 2.863 1.839 3.887 . . . . . A . 20 DPR HB2 . . A . 20 DPR HD2 . . . 20 . HB1 . . . . . 20 . HD1 . . rr_6e5k 1
195 1 . . 1 1 6 6 ABA H H . . . 1 1 5 5 LYS H H . . . . . 2.863 1.839 3.887 . . . . . A . 6 AIB H . . A . 5 LYS H . . . 6 . HN . . . . . 5 . HN . . rr_6e5k 1
196 1 . . 1 1 8 8 LYS H H . . . 1 1 7 7 LEU HB3 H . . . . . 2.872 1.841 3.903 . . . . . A . 8 LYS H . . A . 7 LEU HB3 . . . 8 . HN . . . . . 7 . HB2 . . rr_6e5k 1
197 1 . . 1 1 26 26 HIS H H . . . 1 1 15 15 GLU H H . . . . . 2.874 1.842 3.906 . . . . . A . 26 HIS H . . A . 15 GLU H . . . 26 . HN . . . . . 15 . HN . . rr_6e5k 1
198 1 . . 1 1 23 23 TYR HB3 H . . . 1 1 18 18 CYS HA H . . . . . 2.874 1.842 3.906 . . . . . A . 23 TYR HB3 . . A . 18 CYS HA . . . 23 . HB2 . . . . . 18 . HA . . rr_6e5k 1
199 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 23 23 TYR H H . . . . . 2.878 1.842 3.914 . . . . . A . 23 TYR HB2 . . A . 23 TYR H . . . 23 . HB1 . . . . . 23 . HN . . rr_6e5k 1
200 1 OR . 1 1 17 17 ARG HG3 H . . . 1 1 17 17 ARG HD2 H . . . . . 2.878 1.842 3.914 . . . . . A . 17 ARG HG3 . . A . 17 ARG HD2 . . . 17 . HG2 . . . . . 17 . HD1 . . rr_6e5k 1
200 2 OR . 1 1 17 17 ARG HG3 H . . . 1 1 17 17 ARG HD3 H . . . . . 2.878 1.842 3.914 . . . . . A . 17 ARG HG3 . . A . 17 ARG HD3 . . . 17 . HG2 . . . . . 17 . HD2 . . rr_6e5k 1
201 1 . . 1 1 24 24 GLU HA H . . . 1 1 24 24 GLU H H . . . . . 2.882 1.843 3.921 . . . . . A . 24 GLU HA . . A . 24 GLU H . . . 24 . HA . . . . . 24 . HN . . rr_6e5k 1
202 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 7 7 LEU HB3 H . . . . . 2.883 1.844 3.922 . . . . . A . 7 LEU MD2 . . A . 7 LEU HB3 . . . 7 . HD21 . . . . . 7 . HB2 . . rr_6e5k 1
203 1 . . 1 1 5 5 LYS H H . . . 1 1 4 4 CYS HA H . . . . . 2.884 1.844 3.924 . . . . . A . 5 LYS H . . A . 4 CYS HA . . . 5 . HN . . . . . 4 . HA . . rr_6e5k 1
204 1 . . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG HG2 H . . . . . 2.884 1.844 3.924 . . . . . A . 10 ARG HA . . A . 10 ARG HG2 . . . 10 . HA . . . . . 10 . HG1 . . rr_6e5k 1
205 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 10 10 ARG HB2 H . . . . . 2.884 1.844 3.924 . . . . . A . 11 TYR HE2 . . A . 10 ARG HB2 . . . 11 . HE2 . . . . . 10 . HB1 . . rr_6e5k 1
205 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 10 10 ARG HB2 H . . . . . 2.884 1.844 3.924 . . . . . A . 11 TYR HE1 . . A . 10 ARG HB2 . . . 11 . HE1 . . . . . 10 . HB1 . . rr_6e5k 1
206 1 . . 1 1 7 7 LEU HB2 H . . . 1 1 7 7 LEU H H . . . . . 2.886 1.845 3.927 . . . . . A . 7 LEU HB2 . . A . 7 LEU H . . . 7 . HB1 . . . . . 7 . HN . . rr_6e5k 1
207 1 . . 1 1 17 17 ARG HA H . . . 1 1 17 17 ARG HG2 H . . . . . 2.889 1.846 3.932 . . . . . A . 17 ARG HA . . A . 17 ARG HG2 . . . 17 . HA . . . . . 17 . HG1 . . rr_6e5k 1
208 1 . . 1 1 3 3 ABA H H . . . 1 1 4 4 CYS H H . . . . . 2.898 1.848 3.948 . . . . . A . 3 AIB H . . A . 4 CYS H . . . 3 . HN . . . . . 4 . HN . . rr_6e5k 1
209 1 . . 1 1 17 17 ARG HA H . . . 1 1 17 17 ARG HG3 H . . . . . 2.908 1.851 3.965 . . . . . A . 17 ARG HA . . A . 17 ARG HG3 . . . 17 . HA . . . . . 17 . HG2 . . rr_6e5k 1
210 1 . . 1 1 8 8 LYS H H . . . 1 1 8 8 LYS HG3 H . . . . . 2.920 1.854 3.986 . . . . . A . 8 LYS H . . A . 8 LYS HG3 . . . 8 . HN . . . . . 8 . HG2 . . rr_6e5k 1
211 1 . . 1 1 20 20 DPR HA H . . . 1 1 20 20 DPR HG2 H . . . . . 2.925 1.855 3.995 . . . . . A . 20 DPR HA . . A . 20 DPR HG2 . . . 20 . HA . . . . . 20 . HG1 . . rr_6e5k 1
212 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.925 1.855 3.995 . . . . . A . 11 TYR HE2 . . A . 7 LEU MD1 . . . 11 . HE2 . . . . . 7 . HD11 . . rr_6e5k 1
212 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.925 1.855 3.995 . . . . . A . 11 TYR HE1 . . A . 7 LEU MD1 . . . 11 . HE1 . . . . . 7 . HD11 . . rr_6e5k 1
213 1 . . 1 1 27 27 CYS HB3 H . . . 1 1 27 27 CYS H H . . . . . 2.930 1.857 4.003 . . . . . A . 27 CYS HB3 . . A . 27 CYS H . . . 27 . HB2 . . . . . 27 . HN . . rr_6e5k 1
214 1 OR . 1 1 24 24 GLU H H . . . 1 1 24 24 GLU HG2 H . . . . . 2.932 1.858 4.006 . . . . . A . 24 GLU H . . A . 24 GLU HG2 . . . 24 . HN . . . . . 24 . HG1 . . rr_6e5k 1
214 2 OR . 1 1 24 24 GLU H H . . . 1 1 24 24 GLU HG3 H . . . . . 2.932 1.858 4.006 . . . . . A . 24 GLU H . . A . 24 GLU HG3 . . . 24 . HN . . . . . 24 . HG2 . . rr_6e5k 1
215 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 21 21 PRO HB3 H . . . . . 2.936 1.858 4.014 . . . . . A . 21 PRO HD2 . . A . 21 PRO HB3 . . . 21 . HD1 . . . . . 21 . HB2 . . rr_6e5k 1
216 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 10 10 ARG HB2 H . . . . . 2.941 1.860 4.022 . . . . . A . 11 TYR HD2 . . A . 10 ARG HB2 . . . 11 . HD2 . . . . . 10 . HB1 . . rr_6e5k 1
216 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 10 10 ARG HB2 H . . . . . 2.941 1.860 4.022 . . . . . A . 11 TYR HD1 . . A . 10 ARG HB2 . . . 11 . HD1 . . . . . 10 . HB1 . . rr_6e5k 1
217 1 . . 1 1 24 24 GLU H H . . . 1 1 24 24 GLU HB3 H . . . . . 2.942 1.860 4.024 . . . . . A . 24 GLU H . . A . 24 GLU HB3 . . . 24 . HN . . . . . 24 . HB2 . . rr_6e5k 1
218 1 . . 1 1 13 13 GLY HA3 H . . . 1 1 14 14 CYS H H . . . . . 2.942 1.860 4.024 . . . . . A . 13 GLY HA3 . . A . 14 CYS H . . . 13 . HA2 . . . . . 14 . HN . . rr_6e5k 1
219 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 16 16 MVA HG11 H . . . . . 2.945 1.861 4.029 . . . . . A . 11 TYR HB3 . . A . 16 MVA HG11 . . . 11 . HB2 . . . . . 16 . HG11 . . rr_6e5k 1
220 1 OR . 1 1 23 23 TYR HB2 H . . . 1 1 23 23 TYR HE2 H . . . . . 2.948 1.862 4.034 . . . . . A . 23 TYR HB2 . . A . 23 TYR HE2 . . . 23 . HB1 . . . . . 23 . HE2 . . rr_6e5k 1
220 2 OR . 1 1 23 23 TYR HB2 H . . . 1 1 23 23 TYR HE1 H . . . . . 2.948 1.862 4.034 . . . . . A . 23 TYR HB2 . . A . 23 TYR HE1 . . . 23 . HB1 . . . . . 23 . HE1 . . rr_6e5k 1
221 1 . . 1 1 16 16 MVA HG11 H . . . 1 1 7 7 LEU MD1 H . . . . . 2.956 1.864 4.048 . . . . . A . 16 MVA HG11 . . A . 7 LEU MD1 . . . 16 . HG11 . . . . . 7 . HD11 . . rr_6e5k 1
222 1 . . 1 1 26 26 HIS HA H . . . 1 1 25 25 MVA HG21 H . . . . . 2.959 1.864 4.054 . . . . . A . 26 HIS HA . . A . 25 MVA HG21 . . . 26 . HA . . . . . 25 . HG21 . . rr_6e5k 1
223 1 OR . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG HD2 H . . . . . 2.959 1.864 4.054 . . . . . A . 7 LEU HA . . A . 10 ARG HD2 . . . 7 . HA . . . . . 10 . HD1 . . rr_6e5k 1
223 2 OR . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG HD3 H . . . . . 2.959 1.864 4.054 . . . . . A . 7 LEU HA . . A . 10 ARG HD3 . . . 7 . HA . . . . . 10 . HD2 . . rr_6e5k 1
224 1 OR . 1 1 23 23 TYR HA H . . . 1 1 23 23 TYR HD2 H . . . . . 2.962 1.865 4.059 . . . . . A . 23 TYR HA . . A . 23 TYR HD2 . . . 23 . HA . . . . . 23 . HD2 . . rr_6e5k 1
224 2 OR . 1 1 23 23 TYR HA H . . . 1 1 23 23 TYR HD1 H . . . . . 2.962 1.865 4.059 . . . . . A . 23 TYR HA . . A . 23 TYR HD1 . . . 23 . HA . . . . . 23 . HD1 . . rr_6e5k 1
225 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 18 18 CYS HA H . . . . . 2.967 1.867 4.067 . . . . . A . 23 TYR HB2 . . A . 18 CYS HA . . . 23 . HB1 . . . . . 18 . HA . . rr_6e5k 1
226 1 OR . 1 1 23 23 TYR HB3 H . . . 1 1 23 23 TYR HE2 H . . . . . 2.968 1.867 4.069 . . . . . A . 23 TYR HB3 . . A . 23 TYR HE2 . . . 23 . HB2 . . . . . 23 . HE2 . . rr_6e5k 1
226 2 OR . 1 1 23 23 TYR HB3 H . . . 1 1 23 23 TYR HE1 H . . . . . 2.968 1.867 4.069 . . . . . A . 23 TYR HB3 . . A . 23 TYR HE1 . . . 23 . HB2 . . . . . 23 . HE1 . . rr_6e5k 1
227 1 . . 1 1 13 13 GLY HA2 H . . . 1 1 14 14 CYS H H . . . . . 2.972 1.868 4.076 . . . . . A . 13 GLY HA2 . . A . 14 CYS H . . . 13 . HA1 . . . . . 14 . HN . . rr_6e5k 1
228 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 25 25 MVA HG11 H . . . . . 2.973 1.868 4.078 . . . . . A . 11 TYR HD1 . . A . 25 MVA HG11 . . . 11 . HD1 . . . . . 25 . HG11 . . rr_6e5k 1
228 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 25 25 MVA HG11 H . . . . . 2.973 1.868 4.078 . . . . . A . 11 TYR HD2 . . A . 25 MVA HG11 . . . 11 . HD2 . . . . . 25 . HG11 . . rr_6e5k 1
229 1 OR . 1 1 15 15 GLU HB2 H . . . 1 1 26 26 HIS H H . . . . . 2.974 1.868 4.080 . . . . . A . 15 GLU HB2 . . A . 26 HIS H . . . 15 . HB1 . . . . . 26 . HN . . rr_6e5k 1
229 2 OR . 1 1 15 15 GLU HB3 H . . . 1 1 26 26 HIS H H . . . . . 2.974 1.868 4.080 . . . . . A . 15 GLU HB3 . . A . 26 HIS H . . . 15 . HB2 . . . . . 26 . HN . . rr_6e5k 1
230 1 . . 1 1 7 7 LEU HB2 H . . . 1 1 16 16 MVA HB H . . . . . 2.980 1.870 4.090 . . . . . A . 7 LEU HB2 . . A . 16 MVA HB . . . 7 . HB1 . . . . . 16 . HB . . rr_6e5k 1
231 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR H H . . . . . 2.985 1.871 4.099 . . . . . A . 11 TYR HB3 . . A . 11 TYR H . . . 11 . HB2 . . . . . 11 . HN . . rr_6e5k 1
232 1 . . 1 1 23 23 TYR HB3 H . . . 1 1 23 23 TYR H H . . . . . 2.992 1.873 4.111 . . . . . A . 23 TYR HB3 . . A . 23 TYR H . . . 23 . HB2 . . . . . 23 . HN . . rr_6e5k 1
233 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 7 7 LEU HB2 H . . . . . 2.995 1.874 4.116 . . . . . A . 11 TYR HE2 . . A . 7 LEU HB2 . . . 11 . HE2 . . . . . 7 . HB1 . . rr_6e5k 1
233 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 7 7 LEU HB2 H . . . . . 2.995 1.874 4.116 . . . . . A . 11 TYR HE1 . . A . 7 LEU HB2 . . . 11 . HE1 . . . . . 7 . HB1 . . rr_6e5k 1
234 1 . . 1 1 4 4 CYS HA H . . . 1 1 7 7 LEU MD1 H . . . . . 2.996 1.874 4.118 . . . . . A . 4 CYS HA . . A . 7 LEU MD1 . . . 4 . HA . . . . . 7 . HD11 . . rr_6e5k 1
235 1 . . 1 1 24 24 GLU H H . . . 1 1 16 16 MVA HG21 H . . . . . 2.996 1.874 4.118 . . . . . A . 24 GLU H . . A . 16 MVA HG21 . . . 24 . HN . . . . . 16 . HG21 . . rr_6e5k 1
236 1 . . 1 1 20 20 DPR HB3 H . . . 1 1 20 20 DPR HG2 H . . . . . 2.998 1.875 4.121 . . . . . A . 20 DPR HB3 . . A . 20 DPR HG2 . . . 20 . HB2 . . . . . 20 . HG1 . . rr_6e5k 1
237 1 . . 1 1 2 2 ASP HA H . . . 1 1 2 2 ASP H H . . . . . 3.012 1.878 4.146 . . . . . A . 2 ASP HA . . A . 2 ASP H . . . 2 . HA . . . . . 2 . HN . . rr_6e5k 1
238 1 . . 1 1 16 16 MVA HA H . . . 1 1 26 26 HIS H H . . . . . 3.018 1.879 4.157 . . . . . A . 16 MVA HA . . A . 26 HIS H . . . 16 . HA . . . . . 26 . HN . . rr_6e5k 1
239 1 . . 1 1 15 15 GLU H H . . . 1 1 27 27 CYS HA H . . . . . 3.019 1.879 4.159 . . . . . A . 15 GLU H . . A . 27 CYS HA . . . 15 . HN . . . . . 27 . HA . . rr_6e5k 1
240 1 . . 1 1 22 22 ARG H H . . . 1 1 21 21 PRO HA H . . . . . 3.030 1.883 4.177 . . . . . A . 22 ARG H . . A . 21 PRO HA . . . 22 . HN . . . . . 21 . HA . . rr_6e5k 1
241 1 . . 1 1 20 20 DPR HB2 H . . . 1 1 20 20 DPR HD3 H . . . . . 3.041 1.885 4.197 . . . . . A . 20 DPR HB2 . . A . 20 DPR HD3 . . . 20 . HB1 . . . . . 20 . HD2 . . rr_6e5k 1
242 1 OR . 1 1 11 11 TYR HE1 H . . . 1 1 10 10 ARG HD2 H . . . . . 3.045 1.886 4.204 . . . . . A . 11 TYR HE1 . . A . 10 ARG HD2 . . . 11 . HE1 . . . . . 10 . HD1 . . rr_6e5k 1
242 2 OR . 1 1 11 11 TYR HE2 H . . . 1 1 10 10 ARG HD2 H . . . . . 3.045 1.886 4.204 . . . . . A . 11 TYR HE2 . . A . 10 ARG HD2 . . . 11 . HE2 . . . . . 10 . HD1 . . rr_6e5k 1
242 3 OR . 1 1 11 11 TYR HE2 H . . . 1 1 10 10 ARG HD3 H . . . . . 3.045 1.886 4.204 . . . . . A . 11 TYR HE2 . . A . 10 ARG HD3 . . . 11 . HE2 . . . . . 10 . HD2 . . rr_6e5k 1
242 4 OR . 1 1 11 11 TYR HE1 H . . . 1 1 10 10 ARG HD3 H . . . . . 3.045 1.886 4.204 . . . . . A . 11 TYR HE1 . . A . 10 ARG HD3 . . . 11 . HE1 . . . . . 10 . HD2 . . rr_6e5k 1
243 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 21 21 PRO HG2 H . . . . . 3.047 1.887 4.207 . . . . . A . 21 PRO HD2 . . A . 21 PRO HG2 . . . 21 . HD1 . . . . . 21 . HG1 . . rr_6e5k 1
244 1 OR . 1 1 23 23 TYR HD2 H . . . 1 1 7 7 LEU MD1 H . . . . . 3.050 1.888 4.212 . . . . . A . 23 TYR HD2 . . A . 7 LEU MD1 . . . 23 . HD2 . . . . . 7 . HD11 . . rr_6e5k 1
244 2 OR . 1 1 23 23 TYR HD1 H . . . 1 1 7 7 LEU MD1 H . . . . . 3.050 1.888 4.212 . . . . . A . 23 TYR HD1 . . A . 7 LEU MD1 . . . 23 . HD1 . . . . . 7 . HD11 . . rr_6e5k 1
245 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 20 20 DPR HB3 H . . . . . 3.063 1.890 4.236 . . . . . A . 21 PRO HD2 . . A . 20 DPR HB3 . . . 21 . HD1 . . . . . 20 . HB2 . . rr_6e5k 1
246 1 . . 1 1 2 2 ASP HB2 H . . . 1 1 2 2 ASP H H . . . . . 3.067 1.891 4.243 . . . . . A . 2 ASP HB2 . . A . 2 ASP H . . . 2 . HB1 . . . . . 2 . HN . . rr_6e5k 1
247 1 OR . 1 1 22 22 ARG HA H . . . 1 1 23 23 TYR HD2 H . . . . . 3.067 1.891 4.243 . . . . . A . 22 ARG HA . . A . 23 TYR HD2 . . . 22 . HA . . . . . 23 . HD2 . . rr_6e5k 1
247 2 OR . 1 1 22 22 ARG HA H . . . 1 1 23 23 TYR HD1 H . . . . . 3.067 1.891 4.243 . . . . . A . 22 ARG HA . . A . 23 TYR HD1 . . . 22 . HA . . . . . 23 . HD1 . . rr_6e5k 1
248 1 . . 1 1 20 20 DPR HD2 H . . . 1 1 19 19 ASP H H . . . . . 3.069 1.892 4.246 . . . . . A . 20 DPR HD2 . . A . 19 ASP H . . . 20 . HD1 . . . . . 19 . HN . . rr_6e5k 1
249 1 . . 1 1 17 17 ARG H H . . . 1 1 25 25 MVA HA H . . . . . 3.070 1.892 4.248 . . . . . A . 17 ARG H . . A . 25 MVA HA . . . 17 . HN . . . . . 25 . HA . . rr_6e5k 1
250 1 OR . 1 1 7 7 LEU MD2 H . . . 1 1 10 10 ARG HD2 H . . . . . 3.074 1.893 4.255 . . . . . A . 7 LEU MD2 . . A . 10 ARG HD2 . . . 7 . HD21 . . . . . 10 . HD1 . . rr_6e5k 1
250 2 OR . 1 1 7 7 LEU MD2 H . . . 1 1 10 10 ARG HD3 H . . . . . 3.074 1.893 4.255 . . . . . A . 7 LEU MD2 . . A . 10 ARG HD3 . . . 7 . HD21 . . . . . 10 . HD2 . . rr_6e5k 1
251 1 . . 1 1 18 18 CYS H H . . . 1 1 17 17 ARG HB3 H . . . . . 3.081 1.894 4.268 . . . . . A . 18 CYS H . . A . 17 ARG HB3 . . . 18 . HN . . . . . 17 . HB2 . . rr_6e5k 1
252 1 . . 1 1 18 18 CYS HA H . . . 1 1 24 24 GLU H H . . . . . 3.094 1.897 4.291 . . . . . A . 18 CYS HA . . A . 24 GLU H . . . 18 . HA . . . . . 24 . HN . . rr_6e5k 1
253 1 . . 1 1 18 18 CYS HB2 H . . . 1 1 19 19 ASP H H . . . . . 3.105 1.900 4.310 . . . . . A . 18 CYS HB2 . . A . 19 ASP H . . . 18 . HB1 . . . . . 19 . HN . . rr_6e5k 1
254 1 . . 1 1 19 19 ASP H H . . . 1 1 22 22 ARG H H . . . . . 3.109 1.901 4.317 . . . . . A . 19 ASP H . . A . 22 ARG H . . . 19 . HN . . . . . 22 . HN . . rr_6e5k 1
255 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 16 16 MVA HG21 H . . . . . 3.112 1.901 4.323 . . . . . A . 11 TYR HD1 . . A . 16 MVA HG21 . . . 11 . HD1 . . . . . 16 . HG21 . . rr_6e5k 1
255 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 16 16 MVA HG21 H . . . . . 3.112 1.901 4.323 . . . . . A . 11 TYR HD2 . . A . 16 MVA HG21 . . . 11 . HD2 . . . . . 16 . HG21 . . rr_6e5k 1
256 1 . . 1 1 2 2 ASP HB3 H . . . 1 1 2 2 ASP H H . . . . . 3.116 1.902 4.330 . . . . . A . 2 ASP HB3 . . A . 2 ASP H . . . 2 . HB2 . . . . . 2 . HN . . rr_6e5k 1
257 1 . . 1 1 16 16 MVA HG21 H . . . 1 1 7 7 LEU HB3 H . . . . . 3.122 1.903 4.341 . . . . . A . 16 MVA HG21 . . A . 7 LEU HB3 . . . 16 . HG21 . . . . . 7 . HB2 . . rr_6e5k 1
258 1 OR . 1 1 2 2 ASP H H . . . 1 1 1 1 ASN HB2 H . . . . . 3.127 1.904 4.350 . . . . . A . 2 ASP H . . A . 1 ASN HB2 . . . 2 . HN . . . . . 1 . HB1 . . rr_6e5k 1
258 2 OR . 1 1 2 2 ASP H H . . . 1 1 1 1 ASN HB3 H . . . . . 3.127 1.904 4.350 . . . . . A . 2 ASP H . . A . 1 ASN HB3 . . . 2 . HN . . . . . 1 . HB2 . . rr_6e5k 1
259 1 . . 1 1 14 14 CYS HB3 H . . . 1 1 27 27 CYS HA H . . . . . 3.130 1.905 4.355 . . . . . A . 14 CYS HB3 . . A . 27 CYS HA . . . 14 . HB2 . . . . . 27 . HA . . rr_6e5k 1
260 1 . . 1 1 16 16 MVA HA H . . . 1 1 25 25 MVA HG11 H . . . . . 3.134 1.907 4.361 . . . . . A . 16 MVA HA . . A . 25 MVA HG11 . . . 16 . HA . . . . . 25 . HG11 . . rr_6e5k 1
261 1 . . 1 1 15 15 GLU HG2 H . . . 1 1 15 15 GLU HA H . . . . . 3.135 1.906 4.364 . . . . . A . 15 GLU HG2 . . A . 15 GLU HA . . . 15 . HG1 . . . . . 15 . HA . . rr_6e5k 1
262 1 . . 1 1 5 5 LYS HG2 H . . . 1 1 5 5 LYS HA H . . . . . 3.143 1.908 4.378 . . . . . A . 5 LYS HG2 . . A . 5 LYS HA . . . 5 . HG1 . . . . . 5 . HA . . rr_6e5k 1
263 1 OR . 1 1 22 22 ARG HG2 H . . . 1 1 23 23 TYR H H . . . . . 3.144 1.908 4.380 . . . . . A . 22 ARG HG2 . . A . 23 TYR H . . . 22 . HG1 . . . . . 23 . HN . . rr_6e5k 1
263 2 OR . 1 1 22 22 ARG HG3 H . . . 1 1 23 23 TYR H H . . . . . 3.144 1.908 4.380 . . . . . A . 22 ARG HG3 . . A . 23 TYR H . . . 22 . HG2 . . . . . 23 . HN . . rr_6e5k 1
264 1 . . 1 1 8 8 LYS H H . . . 1 1 5 5 LYS HA H . . . . . 3.150 1.910 4.390 . . . . . A . 8 LYS H . . A . 5 LYS HA . . . 8 . HN . . . . . 5 . HA . . rr_6e5k 1
265 1 OR . 1 1 16 16 MVA HG21 H . . . 1 1 23 23 TYR HE2 H . . . . . 3.151 1.910 4.392 . . . . . A . 16 MVA HG21 . . A . 23 TYR HE2 . . . 16 . HG21 . . . . . 23 . HE2 . . rr_6e5k 1
265 2 OR . 1 1 16 16 MVA HG21 H . . . 1 1 23 23 TYR HE1 H . . . . . 3.151 1.910 4.392 . . . . . A . 16 MVA HG21 . . A . 23 TYR HE1 . . . 16 . HG21 . . . . . 23 . HE1 . . rr_6e5k 1
266 1 OR . 1 1 22 22 ARG HD2 H . . . 1 1 22 22 ARG HE H . . . . . 3.163 1.913 4.413 . . . . . A . 22 ARG HD2 . . A . 22 ARG HE . . . 22 . HD1 . . . . . 22 . HE . . rr_6e5k 1
266 2 OR . 1 1 22 22 ARG HD3 H . . . 1 1 22 22 ARG HE H . . . . . 3.163 1.913 4.413 . . . . . A . 22 ARG HD3 . . A . 22 ARG HE . . . 22 . HD2 . . . . . 22 . HE . . rr_6e5k 1
267 1 . . 1 1 24 24 GLU H H . . . 1 1 17 17 ARG HB2 H . . . . . 3.166 1.913 4.419 . . . . . A . 24 GLU H . . A . 17 ARG HB2 . . . 24 . HN . . . . . 17 . HB1 . . rr_6e5k 1
268 1 . . 1 1 18 18 CYS H H . . . 1 1 16 16 MVA HG11 H . . . . . 3.168 1.913 4.423 . . . . . A . 18 CYS H . . A . 16 MVA HG11 . . . 18 . HN . . . . . 16 . HG11 . . rr_6e5k 1
269 1 . . 1 1 7 7 LEU HB3 H . . . 1 1 4 4 CYS HA H . . . . . 3.174 1.915 4.433 . . . . . A . 7 LEU HB3 . . A . 4 CYS HA . . . 7 . HB2 . . . . . 4 . HA . . rr_6e5k 1
270 1 . . 1 1 23 23 TYR HB3 H . . . 1 1 24 24 GLU H H . . . . . 3.176 1.915 4.437 . . . . . A . 23 TYR HB3 . . A . 24 GLU H . . . 23 . HB2 . . . . . 24 . HN . . rr_6e5k 1
271 1 . . 1 1 21 21 PRO HG2 H . . . 1 1 21 21 PRO HA H . . . . . 3.178 1.916 4.440 . . . . . A . 21 PRO HG2 . . A . 21 PRO HA . . . 21 . HG1 . . . . . 21 . HA . . rr_6e5k 1
272 1 . . 1 1 10 10 ARG H H . . . 1 1 10 10 ARG HG2 H . . . . . 3.179 1.916 4.442 . . . . . A . 10 ARG H . . A . 10 ARG HG2 . . . 10 . HN . . . . . 10 . HG1 . . rr_6e5k 1
273 1 . . 1 1 20 20 DPR HB3 H . . . 1 1 20 20 DPR HD2 H . . . . . 3.181 1.916 4.446 . . . . . A . 20 DPR HB3 . . A . 20 DPR HD2 . . . 20 . HB2 . . . . . 20 . HD1 . . rr_6e5k 1
274 1 OR . 1 1 1 1 ASN HA H . . . 1 1 1 1 ASN HB2 H . . . . . 3.184 1.917 4.451 . . . . . A . 1 ASN HA . . A . 1 ASN HB2 . . . 1 . HA . . . . . 1 . HB1 . . rr_6e5k 1
274 2 OR . 1 1 1 1 ASN HA H . . . 1 1 1 1 ASN HB3 H . . . . . 3.184 1.917 4.451 . . . . . A . 1 ASN HA . . A . 1 ASN HB3 . . . 1 . HA . . . . . 1 . HB2 . . rr_6e5k 1
275 1 . . 1 1 4 4 CYS HB3 H . . . 1 1 5 5 LYS H H . . . . . 3.191 1.918 4.464 . . . . . A . 4 CYS HB3 . . A . 5 LYS H . . . 4 . HB2 . . . . . 5 . HN . . rr_6e5k 1
276 1 OR . 1 1 22 22 ARG HG2 H . . . 1 1 22 22 ARG HE H . . . . . 3.193 1.919 4.467 . . . . . A . 22 ARG HG2 . . A . 22 ARG HE . . . 22 . HG1 . . . . . 22 . HE . . rr_6e5k 1
276 2 OR . 1 1 22 22 ARG HG3 H . . . 1 1 22 22 ARG HE H . . . . . 3.193 1.919 4.467 . . . . . A . 22 ARG HG3 . . A . 22 ARG HE . . . 22 . HG2 . . . . . 22 . HE . . rr_6e5k 1
277 1 . . 1 1 17 17 ARG HG2 H . . . 1 1 17 17 ARG HE H . . . . . 3.202 1.920 4.484 . . . . . A . 17 ARG HG2 . . A . 17 ARG HE . . . 17 . HG1 . . . . . 17 . HE . . rr_6e5k 1
278 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 8 8 LYS HA H . . . . . 3.205 1.921 4.489 . . . . . A . 11 TYR HB2 . . A . 8 LYS HA . . . 11 . HB1 . . . . . 8 . HA . . rr_6e5k 1
279 1 . . 1 1 10 10 ARG H H . . . 1 1 10 10 ARG HG3 H . . . . . 3.211 1.922 4.500 . . . . . A . 10 ARG H . . A . 10 ARG HG3 . . . 10 . HN . . . . . 10 . HG2 . . rr_6e5k 1
280 1 . . 1 1 24 24 GLU HA H . . . 1 1 25 25 MVA HG11 H . . . . . 3.214 1.922 4.506 . . . . . A . 24 GLU HA . . A . 25 MVA HG11 . . . 24 . HA . . . . . 25 . HG11 . . rr_6e5k 1
281 1 . . 1 1 7 7 LEU HA H . . . 1 1 7 7 LEU MD1 H . . . . . 3.216 1.923 4.509 . . . . . A . 7 LEU HA . . A . 7 LEU MD1 . . . 7 . HA . . . . . 7 . HD11 . . rr_6e5k 1
282 1 . . 1 1 20 20 DPR HB3 H . . . 1 1 20 20 DPR HD3 H . . . . . 3.219 1.924 4.514 . . . . . A . 20 DPR HB3 . . A . 20 DPR HD3 . . . 20 . HB2 . . . . . 20 . HD2 . . rr_6e5k 1
283 1 . . 1 1 25 25 MVA HA H . . . 1 1 16 16 MVA HG21 H . . . . . 3.220 1.924 4.516 . . . . . A . 25 MVA HA . . A . 16 MVA HG21 . . . 25 . HA . . . . . 16 . HG21 . . rr_6e5k 1
284 1 . . 1 1 13 13 GLY H H . . . 1 1 12 12 ABA H H . . . . . 3.221 1.924 4.518 . . . . . A . 13 GLY H . . A . 12 AIB H . . . 13 . HN . . . . . 12 . HN . . rr_6e5k 1
285 1 OR . 1 1 24 24 GLU H H . . . 1 1 23 23 TYR HD2 H . . . . . 3.223 1.925 4.521 . . . . . A . 24 GLU H . . A . 23 TYR HD2 . . . 24 . HN . . . . . 23 . HD2 . . rr_6e5k 1
285 2 OR . 1 1 24 24 GLU H H . . . 1 1 23 23 TYR HD1 H . . . . . 3.223 1.925 4.521 . . . . . A . 24 GLU H . . A . 23 TYR HD1 . . . 24 . HN . . . . . 23 . HD1 . . rr_6e5k 1
286 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 8 8 LYS HA H . . . . . 3.232 1.927 4.537 . . . . . A . 11 TYR HD2 . . A . 8 LYS HA . . . 11 . HD2 . . . . . 8 . HA . . rr_6e5k 1
286 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 8 8 LYS HA H . . . . . 3.232 1.927 4.537 . . . . . A . 11 TYR HD1 . . A . 8 LYS HA . . . 11 . HD1 . . . . . 8 . HA . . rr_6e5k 1
287 1 . . 1 1 23 23 TYR HB3 H . . . 1 1 7 7 LEU MD1 H . . . . . 3.238 1.927 4.549 . . . . . A . 23 TYR HB3 . . A . 7 LEU MD1 . . . 23 . HB2 . . . . . 7 . HD11 . . rr_6e5k 1
288 1 . . 1 1 8 8 LYS HA H . . . 1 1 11 11 TYR H H . . . . . 3.248 1.929 4.567 . . . . . A . 8 LYS HA . . A . 11 TYR H . . . 8 . HA . . . . . 11 . HN . . rr_6e5k 1
289 1 OR . 1 1 7 7 LEU MD2 H . . . 1 1 23 23 TYR HE2 H . . . . . 3.249 1.929 4.569 . . . . . A . 7 LEU MD2 . . A . 23 TYR HE2 . . . 7 . HD21 . . . . . 23 . HE2 . . rr_6e5k 1
289 2 OR . 1 1 7 7 LEU MD2 H . . . 1 1 23 23 TYR HE1 H . . . . . 3.249 1.929 4.569 . . . . . A . 7 LEU MD2 . . A . 23 TYR HE1 . . . 7 . HD21 . . . . . 23 . HE1 . . rr_6e5k 1
290 1 . . 1 1 17 17 ARG H H . . . 1 1 17 17 ARG HG3 H . . . . . 3.257 1.931 4.583 . . . . . A . 17 ARG H . . A . 17 ARG HG3 . . . 17 . HN . . . . . 17 . HG2 . . rr_6e5k 1
291 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 26 26 HIS H H . . . . . 3.257 1.931 4.583 . . . . . A . 14 CYS HB2 . . A . 26 HIS H . . . 14 . HB1 . . . . . 26 . HN . . rr_6e5k 1
292 1 . . 1 1 18 18 CYS HB2 H . . . 1 1 4 4 CYS HA H . . . . . 3.260 1.932 4.588 . . . . . A . 18 CYS HB2 . . A . 4 CYS HA . . . 18 . HB1 . . . . . 4 . HA . . rr_6e5k 1
293 1 . . 1 1 15 15 GLU HG2 H . . . 1 1 15 15 GLU H H . . . . . 3.260 1.932 4.588 . . . . . A . 15 GLU HG2 . . A . 15 GLU H . . . 15 . HG1 . . . . . 15 . HN . . rr_6e5k 1
294 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 7 7 LEU H H . . . . . 3.264 1.932 4.596 . . . . . A . 7 LEU MD2 . . A . 7 LEU H . . . 7 . HD21 . . . . . 7 . HN . . rr_6e5k 1
295 1 . . 1 1 21 21 PRO HD3 H . . . 1 1 20 20 DPR HB3 H . . . . . 3.269 1.933 4.605 . . . . . A . 21 PRO HD3 . . A . 20 DPR HB3 . . . 21 . HD2 . . . . . 20 . HB2 . . rr_6e5k 1
296 1 . . 1 1 17 17 ARG H H . . . 1 1 17 17 ARG HG2 H . . . . . 3.269 1.933 4.605 . . . . . A . 17 ARG H . . A . 17 ARG HG2 . . . 17 . HN . . . . . 17 . HG1 . . rr_6e5k 1
297 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 14 14 CYS H H . . . . . 3.276 1.934 4.618 . . . . . A . 11 TYR HB3 . . A . 14 CYS H . . . 11 . HB2 . . . . . 14 . HN . . rr_6e5k 1
298 1 OR . 1 1 16 16 MVA HG11 H . . . 1 1 8 8 LYS HB3 H . . . . . 3.280 1.935 4.625 . . . . . A . 16 MVA HG11 . . A . 8 LYS HB3 . . . 16 . HG11 . . . . . 8 . HB2 . . rr_6e5k 1
298 2 OR . 1 1 16 16 MVA HG11 H . . . 1 1 8 8 LYS HB2 H . . . . . 3.280 1.935 4.625 . . . . . A . 16 MVA HG11 . . A . 8 LYS HB2 . . . 16 . HG11 . . . . . 8 . HB1 . . rr_6e5k 1
299 1 . . 1 1 3 3 ABA H H . . . 1 1 2 2 ASP H H . . . . . 3.286 1.936 4.636 . . . . . A . 3 AIB H . . A . 2 ASP H . . . 3 . HN . . . . . 2 . HN . . rr_6e5k 1
300 1 OR . 1 1 18 18 CYS HA H . . . 1 1 23 23 TYR HD2 H . . . . . 3.288 1.936 4.640 . . . . . A . 18 CYS HA . . A . 23 TYR HD2 . . . 18 . HA . . . . . 23 . HD2 . . rr_6e5k 1
300 2 OR . 1 1 18 18 CYS HA H . . . 1 1 23 23 TYR HD1 H . . . . . 3.288 1.936 4.640 . . . . . A . 18 CYS HA . . A . 23 TYR HD1 . . . 18 . HA . . . . . 23 . HD1 . . rr_6e5k 1
301 1 . . 1 1 4 4 CYS HB2 H . . . 1 1 5 5 LYS H H . . . . . 3.292 1.937 4.647 . . . . . A . 4 CYS HB2 . . A . 5 LYS H . . . 4 . HB1 . . . . . 5 . HN . . rr_6e5k 1
302 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 15 15 GLU H H . . . . . 3.293 1.937 4.649 . . . . . A . 26 HIS HB2 . . A . 15 GLU H . . . 26 . HB1 . . . . . 15 . HN . . rr_6e5k 1
303 1 OR . 1 1 11 11 TYR HE1 H . . . 1 1 16 16 MVA HG11 H . . . . . 3.296 1.938 4.654 . . . . . A . 11 TYR HE1 . . A . 16 MVA HG11 . . . 11 . HE1 . . . . . 16 . HG11 . . rr_6e5k 1
303 2 OR . 1 1 11 11 TYR HE2 H . . . 1 1 16 16 MVA HG11 H . . . . . 3.296 1.938 4.654 . . . . . A . 11 TYR HE2 . . A . 16 MVA HG11 . . . 11 . HE2 . . . . . 16 . HG11 . . rr_6e5k 1
304 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 10 10 ARG HG3 H . . . . . 3.297 1.938 4.656 . . . . . A . 11 TYR HD2 . . A . 10 ARG HG3 . . . 11 . HD2 . . . . . 10 . HG2 . . rr_6e5k 1
304 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 10 10 ARG HG3 H . . . . . 3.297 1.938 4.656 . . . . . A . 11 TYR HD1 . . A . 10 ARG HG3 . . . 11 . HD1 . . . . . 10 . HG2 . . rr_6e5k 1
305 1 . . 1 1 20 20 DPR HD3 H . . . 1 1 20 20 DPR HA H . . . . . 3.298 1.938 4.658 . . . . . A . 20 DPR HD3 . . A . 20 DPR HA . . . 20 . HD2 . . . . . 20 . HA . . rr_6e5k 1
306 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 7 7 LEU HA H . . . . . 3.301 1.939 4.663 . . . . . A . 11 TYR HD2 . . A . 7 LEU HA . . . 11 . HD2 . . . . . 7 . HA . . rr_6e5k 1
306 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 7 7 LEU HA H . . . . . 3.301 1.939 4.663 . . . . . A . 11 TYR HD1 . . A . 7 LEU HA . . . 11 . HD1 . . . . . 7 . HA . . rr_6e5k 1
307 1 . . 1 1 26 26 HIS HB3 H . . . 1 1 27 27 CYS H H . . . . . 3.301 1.939 4.663 . . . . . A . 26 HIS HB3 . . A . 27 CYS H . . . 26 . HB2 . . . . . 27 . HN . . rr_6e5k 1
308 1 . . 1 1 21 21 PRO HD3 H . . . 1 1 21 21 PRO HB3 H . . . . . 3.305 1.940 4.670 . . . . . A . 21 PRO HD3 . . A . 21 PRO HB3 . . . 21 . HD2 . . . . . 21 . HB2 . . rr_6e5k 1
309 1 . . 1 1 16 16 MVA HA H . . . 1 1 25 25 MVA HG21 H . . . . . 3.319 1.942 4.696 . . . . . A . 16 MVA HA . . A . 25 MVA HG21 . . . 16 . HA . . . . . 25 . HG21 . . rr_6e5k 1
310 1 OR . 1 1 14 14 CYS HB3 H . . . 1 1 11 11 TYR HD2 H . . . . . 3.320 1.942 4.698 . . . . . A . 14 CYS HB3 . . A . 11 TYR HD2 . . . 14 . HB2 . . . . . 11 . HD2 . . rr_6e5k 1
310 2 OR . 1 1 14 14 CYS HB3 H . . . 1 1 11 11 TYR HD1 H . . . . . 3.320 1.942 4.698 . . . . . A . 14 CYS HB3 . . A . 11 TYR HD1 . . . 14 . HB2 . . . . . 11 . HD1 . . rr_6e5k 1
311 1 . . 1 1 18 18 CYS HB3 H . . . 1 1 16 16 MVA HG21 H . . . . . 3.320 1.942 4.698 . . . . . A . 18 CYS HB3 . . A . 16 MVA HG21 . . . 18 . HB2 . . . . . 16 . HG21 . . rr_6e5k 1
312 1 OR . 1 1 1 1 ASN HD22 H . . . 1 1 1 1 ASN HB2 H . . . . . 3.326 1.944 4.708 . . . . . A . 1 ASN HD22 . . A . 1 ASN HB2 . . . 1 . HD22 . . . . . 1 . HB1 . . rr_6e5k 1
312 2 OR . 1 1 1 1 ASN HD22 H . . . 1 1 1 1 ASN HB3 H . . . . . 3.326 1.944 4.708 . . . . . A . 1 ASN HD22 . . A . 1 ASN HB3 . . . 1 . HD22 . . . . . 1 . HB2 . . rr_6e5k 1
313 1 . . 1 1 7 7 LEU H H . . . 1 1 5 5 LYS HA H . . . . . 3.328 1.943 4.713 . . . . . A . 7 LEU H . . A . 5 LYS HA . . . 7 . HN . . . . . 5 . HA . . rr_6e5k 1
314 1 . . 1 1 16 16 MVA HB H . . . 1 1 8 8 LYS HA H . . . . . 3.348 1.947 4.749 . . . . . A . 16 MVA HB . . A . 8 LYS HA . . . 16 . HB . . . . . 8 . HA . . rr_6e5k 1
315 1 . . 1 1 26 26 HIS HB2 H . . . 1 1 27 27 CYS H H . . . . . 3.348 1.947 4.749 . . . . . A . 26 HIS HB2 . . A . 27 CYS H . . . 26 . HB1 . . . . . 27 . HN . . rr_6e5k 1
316 1 OR . 1 1 10 10 ARG HD2 H . . . 1 1 10 10 ARG HE H . . . . . 3.349 1.947 4.751 . . . . . A . 10 ARG HD2 . . A . 10 ARG HE . . . 10 . HD1 . . . . . 10 . HE . . rr_6e5k 1
316 2 OR . 1 1 10 10 ARG HD3 H . . . 1 1 10 10 ARG HE H . . . . . 3.349 1.947 4.751 . . . . . A . 10 ARG HD3 . . A . 10 ARG HE . . . 10 . HD2 . . . . . 10 . HE . . rr_6e5k 1
317 1 . . 1 1 7 7 LEU H H . . . 1 1 7 7 LEU MD1 H . . . . . 3.363 1.949 4.777 . . . . . A . 7 LEU H . . A . 7 LEU MD1 . . . 7 . HN . . . . . 7 . HD11 . . rr_6e5k 1
318 1 . . 1 1 8 8 LYS HA H . . . 1 1 10 10 ARG H H . . . . . 3.369 1.950 4.788 . . . . . A . 8 LYS HA . . A . 10 ARG H . . . 8 . HA . . . . . 10 . HN . . rr_6e5k 1
319 1 . . 1 1 15 15 GLU HA H . . . 1 1 16 16 MVA HG11 H . . . . . 3.370 1.950 4.790 . . . . . A . 15 GLU HA . . A . 16 MVA HG11 . . . 15 . HA . . . . . 16 . HG11 . . rr_6e5k 1
320 1 . . 1 1 2 2 ASP HB2 H . . . 1 1 3 3 ABA H H . . . . . 3.378 1.952 4.804 . . . . . A . 2 ASP HB2 . . A . 3 AIB H . . . 2 . HB1 . . . . . 3 . HN . . rr_6e5k 1
321 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 22 22 ARG H H . . . . . 3.379 1.952 4.806 . . . . . A . 21 PRO HD2 . . A . 22 ARG H . . . 21 . HD1 . . . . . 22 . HN . . rr_6e5k 1
322 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 7 7 LEU MD1 H . . . . . 3.382 1.952 4.812 . . . . . A . 11 TYR HD1 . . A . 7 LEU MD1 . . . 11 . HD1 . . . . . 7 . HD11 . . rr_6e5k 1
322 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 7 7 LEU MD1 H . . . . . 3.382 1.952 4.812 . . . . . A . 11 TYR HD2 . . A . 7 LEU MD1 . . . 11 . HD2 . . . . . 7 . HD11 . . rr_6e5k 1
323 1 . . 1 1 18 18 CYS H H . . . 1 1 17 17 ARG HG3 H . . . . . 3.390 1.954 4.826 . . . . . A . 18 CYS H . . A . 17 ARG HG3 . . . 18 . HN . . . . . 17 . HG2 . . rr_6e5k 1
324 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 8 8 LYS HB2 H . . . . . 3.391 1.953 4.829 . . . . . A . 11 TYR HD1 . . A . 8 LYS HB2 . . . 11 . HD1 . . . . . 8 . HB1 . . rr_6e5k 1
324 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 8 8 LYS HB2 H . . . . . 3.391 1.953 4.829 . . . . . A . 11 TYR HD2 . . A . 8 LYS HB2 . . . 11 . HD2 . . . . . 8 . HB1 . . rr_6e5k 1
324 3 OR . 1 1 11 11 TYR HD2 H . . . 1 1 8 8 LYS HB3 H . . . . . 3.391 1.953 4.829 . . . . . A . 11 TYR HD2 . . A . 8 LYS HB3 . . . 11 . HD2 . . . . . 8 . HB2 . . rr_6e5k 1
324 4 OR . 1 1 11 11 TYR HD1 H . . . 1 1 8 8 LYS HB3 H . . . . . 3.391 1.953 4.829 . . . . . A . 11 TYR HD1 . . A . 8 LYS HB3 . . . 11 . HD1 . . . . . 8 . HB2 . . rr_6e5k 1
325 1 . . 1 1 19 19 ASP HB3 H . . . 1 1 22 22 ARG H H . . . . . 3.398 1.955 4.841 . . . . . A . 19 ASP HB3 . . A . 22 ARG H . . . 19 . HB2 . . . . . 22 . HN . . rr_6e5k 1
326 1 . . 1 1 7 7 LEU H H . . . 1 1 4 4 CYS HA H . . . . . 3.404 1.956 4.852 . . . . . A . 7 LEU H . . A . 4 CYS HA . . . 7 . HN . . . . . 4 . HA . . rr_6e5k 1
327 1 . . 1 1 10 10 ARG HG2 H . . . 1 1 10 10 ARG HE H . . . . . 3.407 1.956 4.858 . . . . . A . 10 ARG HG2 . . A . 10 ARG HE . . . 10 . HG1 . . . . . 10 . HE . . rr_6e5k 1
328 1 . . 1 1 10 10 ARG HB3 H . . . 1 1 10 10 ARG HE H . . . . . 3.407 1.956 4.858 . . . . . A . 10 ARG HB3 . . A . 10 ARG HE . . . 10 . HB2 . . . . . 10 . HE . . rr_6e5k 1
329 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 16 16 MVA HG11 H . . . . . 3.415 1.957 4.873 . . . . . A . 23 TYR HB2 . . A . 16 MVA HG11 . . . 23 . HB1 . . . . . 16 . HG11 . . rr_6e5k 1
330 1 . . 1 1 23 23 TYR HA H . . . 1 1 16 16 MVA HG21 H . . . . . 3.417 1.958 4.876 . . . . . A . 23 TYR HA . . A . 16 MVA HG21 . . . 23 . HA . . . . . 16 . HG21 . . rr_6e5k 1
331 1 . . 1 1 26 26 HIS H H . . . 1 1 25 25 MVA HG11 H . . . . . 3.423 1.958 4.888 . . . . . A . 26 HIS H . . A . 25 MVA HG11 . . . 26 . HN . . . . . 25 . HG11 . . rr_6e5k 1
332 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 7 7 LEU HA H . . . . . 3.428 1.959 4.897 . . . . . A . 11 TYR HE2 . . A . 7 LEU HA . . . 11 . HE2 . . . . . 7 . HA . . rr_6e5k 1
332 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 7 7 LEU HA H . . . . . 3.428 1.959 4.897 . . . . . A . 11 TYR HE1 . . A . 7 LEU HA . . . 11 . HE1 . . . . . 7 . HA . . rr_6e5k 1
333 1 . . 1 1 5 5 LYS HG3 H . . . 1 1 5 5 LYS HA H . . . . . 3.431 1.959 4.903 . . . . . A . 5 LYS HG3 . . A . 5 LYS HA . . . 5 . HG2 . . . . . 5 . HA . . rr_6e5k 1
334 1 OR . 1 1 5 5 LYS HE2 H . . . 1 1 1 1 ASN HA H . . . . . 3.431 1.959 4.903 . . . . . A . 5 LYS HE2 . . A . 1 ASN HA . . . 5 . HE1 . . . . . 1 . HA . . rr_6e5k 1
334 2 OR . 1 1 5 5 LYS HE3 H . . . 1 1 1 1 ASN HA H . . . . . 3.431 1.959 4.903 . . . . . A . 5 LYS HE3 . . A . 1 ASN HA . . . 5 . HE2 . . . . . 1 . HA . . rr_6e5k 1
335 1 . . 1 1 17 17 ARG HG3 H . . . 1 1 17 17 ARG HE H . . . . . 3.441 1.961 4.921 . . . . . A . 17 ARG HG3 . . A . 17 ARG HE . . . 17 . HG2 . . . . . 17 . HE . . rr_6e5k 1
336 1 . . 1 1 18 18 CYS HA H . . . 1 1 16 16 MVA HG21 H . . . . . 3.443 1.961 4.925 . . . . . A . 18 CYS HA . . A . 16 MVA HG21 . . . 18 . HA . . . . . 16 . HG21 . . rr_6e5k 1
337 1 . . 1 1 16 16 MVA HA H . . . 1 1 26 26 HIS HD2 H . . . . . 3.446 1.961 4.931 . . . . . A . 16 MVA HA . . A . 26 HIS HD2 . . . 16 . HA . . . . . 26 . HD2 . . rr_6e5k 1
338 1 . . 1 1 14 14 CYS HB2 H . . . 1 1 27 27 CYS H H . . . . . 3.455 1.963 4.947 . . . . . A . 14 CYS HB2 . . A . 27 CYS H . . . 14 . HB1 . . . . . 27 . HN . . rr_6e5k 1
339 1 . . 1 1 24 24 GLU HB2 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.457 1.963 4.951 . . . . . A . 24 GLU HB2 . . A . 26 HIS HD2 . . . 24 . HB1 . . . . . 26 . HD2 . . rr_6e5k 1
340 1 OR . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HE2 H . . . . . 3.459 1.964 4.954 . . . . . A . 11 TYR HB2 . . A . 11 TYR HE2 . . . 11 . HB1 . . . . . 11 . HE2 . . rr_6e5k 1
340 2 OR . 1 1 11 11 TYR HB2 H . . . 1 1 11 11 TYR HE1 H . . . . . 3.459 1.964 4.954 . . . . . A . 11 TYR HB2 . . A . 11 TYR HE1 . . . 11 . HB1 . . . . . 11 . HE1 . . rr_6e5k 1
341 1 . . 1 1 18 18 CYS H H . . . 1 1 16 16 MVA HG21 H . . . . . 3.460 1.963 4.957 . . . . . A . 18 CYS H . . A . 16 MVA HG21 . . . 18 . HN . . . . . 16 . HG21 . . rr_6e5k 1
342 1 . . 1 1 17 17 ARG H H . . . 1 1 16 16 MVA HG11 H . . . . . 3.462 1.964 4.960 . . . . . A . 17 ARG H . . A . 16 MVA HG11 . . . 17 . HN . . . . . 16 . HG11 . . rr_6e5k 1
343 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 25 25 MVA HG11 H . . . . . 3.466 1.965 4.967 . . . . . A . 23 TYR HB2 . . A . 25 MVA HG11 . . . 23 . HB1 . . . . . 25 . HG11 . . rr_6e5k 1
344 1 . . 1 1 24 24 GLU HA H . . . 1 1 17 17 ARG H H . . . . . 3.469 1.964 4.974 . . . . . A . 24 GLU HA . . A . 17 ARG H . . . 24 . HA . . . . . 17 . HN . . rr_6e5k 1
345 1 . . 1 1 15 15 GLU H H . . . 1 1 14 14 CYS H H . . . . . 3.477 1.966 4.988 . . . . . A . 15 GLU H . . A . 14 CYS H . . . 15 . HN . . . . . 14 . HN . . rr_6e5k 1
346 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 4 4 CYS HA H . . . . . 3.478 1.966 4.990 . . . . . A . 7 LEU MD2 . . A . 4 CYS HA . . . 7 . HD21 . . . . . 4 . HA . . rr_6e5k 1
347 1 . . 1 1 21 21 PRO HD2 H . . . 1 1 21 21 PRO HA H . . . . . 3.497 1.968 5.026 . . . . . A . 21 PRO HD2 . . A . 21 PRO HA . . . 21 . HD1 . . . . . 21 . HA . . rr_6e5k 1
348 1 OR . 1 1 22 22 ARG HA H . . . 1 1 23 23 TYR HE2 H . . . . . 3.509 1.970 5.048 . . . . . A . 22 ARG HA . . A . 23 TYR HE2 . . . 22 . HA . . . . . 23 . HE2 . . rr_6e5k 1
348 2 OR . 1 1 22 22 ARG HA H . . . 1 1 23 23 TYR HE1 H . . . . . 3.509 1.970 5.048 . . . . . A . 22 ARG HA . . A . 23 TYR HE1 . . . 22 . HA . . . . . 23 . HE1 . . rr_6e5k 1
349 1 . . 1 1 2 2 ASP HA H . . . 1 1 4 4 CYS H H . . . . . 3.514 1.970 5.058 . . . . . A . 2 ASP HA . . A . 4 CYS H . . . 2 . HA . . . . . 4 . HN . . rr_6e5k 1
350 1 OR . 1 1 23 23 TYR H H . . . 1 1 23 23 TYR HE2 H . . . . . 3.526 1.972 5.080 . . . . . A . 23 TYR H . . A . 23 TYR HE2 . . . 23 . HN . . . . . 23 . HE2 . . rr_6e5k 1
350 2 OR . 1 1 23 23 TYR H H . . . 1 1 23 23 TYR HE1 H . . . . . 3.526 1.972 5.080 . . . . . A . 23 TYR H . . A . 23 TYR HE1 . . . 23 . HN . . . . . 23 . HE1 . . rr_6e5k 1
351 1 OR . 1 1 23 23 TYR HA H . . . 1 1 24 24 GLU HG2 H . . . . . 3.555 1.975 5.135 . . . . . A . 23 TYR HA . . A . 24 GLU HG2 . . . 23 . HA . . . . . 24 . HG1 . . rr_6e5k 1
351 2 OR . 1 1 23 23 TYR HA H . . . 1 1 24 24 GLU HG3 H . . . . . 3.555 1.975 5.135 . . . . . A . 23 TYR HA . . A . 24 GLU HG3 . . . 23 . HA . . . . . 24 . HG2 . . rr_6e5k 1
352 1 . . 1 1 14 14 CYS H H . . . 1 1 11 11 TYR H H . . . . . 3.564 1.976 5.152 . . . . . A . 14 CYS H . . A . 11 TYR H . . . 14 . HN . . . . . 11 . HN . . rr_6e5k 1
353 1 . . 1 1 27 27 CYS H H . . . 1 1 25 25 MVA HG21 H . . . . . 3.566 1.976 5.156 . . . . . A . 27 CYS H . . A . 25 MVA HG21 . . . 27 . HN . . . . . 25 . HG21 . . rr_6e5k 1
354 1 . . 1 1 24 24 GLU H H . . . 1 1 25 25 MVA HG11 H . . . . . 3.568 1.976 5.160 . . . . . A . 24 GLU H . . A . 25 MVA HG11 . . . 24 . HN . . . . . 25 . HG11 . . rr_6e5k 1
355 1 . . 1 1 10 10 ARG HB2 H . . . 1 1 10 10 ARG HE H . . . . . 3.577 1.978 5.176 . . . . . A . 10 ARG HB2 . . A . 10 ARG HE . . . 10 . HB1 . . . . . 10 . HE . . rr_6e5k 1
356 1 OR . 1 1 7 7 LEU MD1 H . . . 1 1 23 23 TYR HE1 H . . . . . 3.586 1.979 5.193 . . . . . A . 7 LEU MD1 . . A . 23 TYR HE1 . . . 7 . HD11 . . . . . 23 . HE1 . . rr_6e5k 1
356 2 OR . 1 1 7 7 LEU MD1 H . . . 1 1 23 23 TYR HE2 H . . . . . 3.586 1.979 5.193 . . . . . A . 7 LEU MD1 . . A . 23 TYR HE2 . . . 7 . HD11 . . . . . 23 . HE2 . . rr_6e5k 1
357 1 . . 1 1 16 16 MVA HG21 H . . . 1 1 8 8 LYS HA H . . . . . 3.588 1.978 5.198 . . . . . A . 16 MVA HG21 . . A . 8 LYS HA . . . 16 . HG21 . . . . . 8 . HA . . rr_6e5k 1
358 1 . . 1 1 16 16 MVA HG21 H . . . 1 1 4 4 CYS HA H . . . . . 3.600 1.980 5.220 . . . . . A . 16 MVA HG21 . . A . 4 CYS HA . . . 16 . HG21 . . . . . 4 . HA . . rr_6e5k 1
359 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 16 16 MVA HG21 H . . . . . 3.607 1.981 5.233 . . . . . A . 11 TYR HB2 . . A . 16 MVA HG21 . . . 11 . HB1 . . . . . 16 . HG21 . . rr_6e5k 1
360 1 OR . 1 1 16 16 MVA HG11 H . . . 1 1 23 23 TYR HD2 H . . . . . 3.612 1.982 5.242 . . . . . A . 16 MVA HG11 . . A . 23 TYR HD2 . . . 16 . HG11 . . . . . 23 . HD2 . . rr_6e5k 1
360 2 OR . 1 1 16 16 MVA HG11 H . . . 1 1 23 23 TYR HD1 H . . . . . 3.612 1.982 5.242 . . . . . A . 16 MVA HG11 . . A . 23 TYR HD1 . . . 16 . HG11 . . . . . 23 . HD1 . . rr_6e5k 1
361 1 . . 1 1 20 20 DPR HD2 H . . . 1 1 20 20 DPR HA H . . . . . 3.621 1.982 5.260 . . . . . A . 20 DPR HD2 . . A . 20 DPR HA . . . 20 . HD1 . . . . . 20 . HA . . rr_6e5k 1
362 1 . . 1 1 24 24 GLU HB3 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.621 1.982 5.260 . . . . . A . 24 GLU HB3 . . A . 26 HIS HD2 . . . 24 . HB2 . . . . . 26 . HD2 . . rr_6e5k 1
363 1 OR . 1 1 18 18 CYS HB3 H . . . 1 1 23 23 TYR HD2 H . . . . . 3.638 1.983 5.293 . . . . . A . 18 CYS HB3 . . A . 23 TYR HD2 . . . 18 . HB2 . . . . . 23 . HD2 . . rr_6e5k 1
363 2 OR . 1 1 18 18 CYS HB3 H . . . 1 1 23 23 TYR HD1 H . . . . . 3.638 1.983 5.293 . . . . . A . 18 CYS HB3 . . A . 23 TYR HD1 . . . 18 . HB2 . . . . . 23 . HD1 . . rr_6e5k 1
364 1 . . 1 1 10 10 ARG HG3 H . . . 1 1 10 10 ARG HE H . . . . . 3.641 1.984 5.298 . . . . . A . 10 ARG HG3 . . A . 10 ARG HE . . . 10 . HG2 . . . . . 10 . HE . . rr_6e5k 1
365 1 OR . 1 1 16 16 MVA HG21 H . . . 1 1 24 24 GLU HG2 H . . . . . 3.643 1.984 5.302 . . . . . A . 16 MVA HG21 . . A . 24 GLU HG2 . . . 16 . HG21 . . . . . 24 . HG1 . . rr_6e5k 1
365 2 OR . 1 1 16 16 MVA HG21 H . . . 1 1 24 24 GLU HG3 H . . . . . 3.643 1.984 5.302 . . . . . A . 16 MVA HG21 . . A . 24 GLU HG3 . . . 16 . HG21 . . . . . 24 . HG2 . . rr_6e5k 1
366 1 . . 1 1 25 25 MVA HG21 H . . . 1 1 15 15 GLU H H . . . . . 3.646 1.984 5.308 . . . . . A . 25 MVA HG21 . . A . 15 GLU H . . . 25 . HG21 . . . . . 15 . HN . . rr_6e5k 1
367 1 . . 1 1 17 17 ARG H H . . . 1 1 23 23 TYR HA H . . . . . 3.651 1.985 5.317 . . . . . A . 17 ARG H . . A . 23 TYR HA . . . 17 . HN . . . . . 23 . HA . . rr_6e5k 1
368 1 . . 1 1 18 18 CYS H H . . . 1 1 17 17 ARG HG2 H . . . . . 3.664 1.986 5.342 . . . . . A . 18 CYS H . . A . 17 ARG HG2 . . . 18 . HN . . . . . 17 . HG1 . . rr_6e5k 1
369 1 . . 1 1 25 25 MVA HG21 H . . . 1 1 14 14 CYS H H . . . . . 3.669 1.986 5.352 . . . . . A . 25 MVA HG21 . . A . 14 CYS H . . . 25 . HG21 . . . . . 14 . HN . . rr_6e5k 1
370 1 . . 1 1 26 26 HIS HA H . . . 1 1 26 26 HIS HD2 H . . . . . 3.672 1.986 5.358 . . . . . A . 26 HIS HA . . A . 26 HIS HD2 . . . 26 . HA . . . . . 26 . HD2 . . rr_6e5k 1
371 1 OR . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HE2 H . . . . . 3.675 1.987 5.363 . . . . . A . 11 TYR HB3 . . A . 11 TYR HE2 . . . 11 . HB2 . . . . . 11 . HE2 . . rr_6e5k 1
371 2 OR . 1 1 11 11 TYR HB3 H . . . 1 1 11 11 TYR HE1 H . . . . . 3.675 1.987 5.363 . . . . . A . 11 TYR HB3 . . A . 11 TYR HE1 . . . 11 . HB2 . . . . . 11 . HE1 . . rr_6e5k 1
372 1 OR . 1 1 17 17 ARG HD2 H . . . 1 1 17 17 ARG HE H . . . . . 3.697 1.989 5.405 . . . . . A . 17 ARG HD2 . . A . 17 ARG HE . . . 17 . HD1 . . . . . 17 . HE . . rr_6e5k 1
372 2 OR . 1 1 17 17 ARG HD3 H . . . 1 1 17 17 ARG HE H . . . . . 3.697 1.989 5.405 . . . . . A . 17 ARG HD3 . . A . 17 ARG HE . . . 17 . HD2 . . . . . 17 . HE . . rr_6e5k 1
373 1 OR . 1 1 16 16 MVA HA H . . . 1 1 23 23 TYR HD2 H . . . . . 3.702 1.989 5.415 . . . . . A . 16 MVA HA . . A . 23 TYR HD2 . . . 16 . HA . . . . . 23 . HD2 . . rr_6e5k 1
373 2 OR . 1 1 16 16 MVA HA H . . . 1 1 23 23 TYR HD1 H . . . . . 3.702 1.989 5.415 . . . . . A . 16 MVA HA . . A . 23 TYR HD1 . . . 16 . HA . . . . . 23 . HD1 . . rr_6e5k 1
374 1 . . 1 1 5 5 LYS H H . . . 1 1 2 2 ASP HA H . . . . . 3.720 1.991 5.449 . . . . . A . 5 LYS H . . A . 2 ASP HA . . . 5 . HN . . . . . 2 . HA . . rr_6e5k 1
375 1 . . 1 1 26 26 HIS H H . . . 1 1 27 27 CYS H H . . . . . 3.720 1.991 5.449 . . . . . A . 26 HIS H . . A . 27 CYS H . . . 26 . HN . . . . . 27 . HN . . rr_6e5k 1
376 1 . . 1 1 16 16 MVA HG11 H . . . 1 1 15 15 GLU H H . . . . . 3.731 1.991 5.471 . . . . . A . 16 MVA HG11 . . A . 15 GLU H . . . 16 . HG11 . . . . . 15 . HN . . rr_6e5k 1
377 1 OR . 1 1 15 15 GLU HB2 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.731 1.991 5.471 . . . . . A . 15 GLU HB2 . . A . 26 HIS HD2 . . . 15 . HB1 . . . . . 26 . HD2 . . rr_6e5k 1
377 2 OR . 1 1 15 15 GLU HB3 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.731 1.991 5.471 . . . . . A . 15 GLU HB3 . . A . 26 HIS HD2 . . . 15 . HB2 . . . . . 26 . HD2 . . rr_6e5k 1
378 1 . . 1 1 16 16 MVA HA H . . . 1 1 24 24 GLU H H . . . . . 3.734 1.991 5.477 . . . . . A . 16 MVA HA . . A . 24 GLU H . . . 16 . HA . . . . . 24 . HN . . rr_6e5k 1
379 1 . . 1 1 15 15 GLU HA H . . . 1 1 16 16 MVA HB H . . . . . 3.753 1.993 5.513 . . . . . A . 15 GLU HA . . A . 16 MVA HB . . . 15 . HA . . . . . 16 . HB . . rr_6e5k 1
380 1 . . 1 1 11 11 TYR HB2 H . . . 1 1 12 12 ABA H H . . . . . 3.759 1.993 5.525 . . . . . A . 11 TYR HB2 . . A . 12 AIB H . . . 11 . HB1 . . . . . 12 . HN . . rr_6e5k 1
381 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 11 11 TYR HA H . . . . . 3.762 1.993 5.531 . . . . . A . 11 TYR HE2 . . A . 11 TYR HA . . . 11 . HE2 . . . . . 11 . HA . . rr_6e5k 1
381 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 11 11 TYR HA H . . . . . 3.762 1.993 5.531 . . . . . A . 11 TYR HE1 . . A . 11 TYR HA . . . 11 . HE1 . . . . . 11 . HA . . rr_6e5k 1
382 1 . . 1 1 24 24 GLU H H . . . 1 1 23 23 TYR H H . . . . . 3.772 1.994 5.550 . . . . . A . 24 GLU H . . A . 23 TYR H . . . 24 . HN . . . . . 23 . HN . . rr_6e5k 1
383 1 . . 1 1 2 2 ASP HB3 H . . . 1 1 5 5 LYS H H . . . . . 3.785 1.994 5.576 . . . . . A . 2 ASP HB3 . . A . 5 LYS H . . . 2 . HB2 . . . . . 5 . HN . . rr_6e5k 1
384 1 . . 1 1 17 17 ARG H H . . . 1 1 24 24 GLU HB3 H . . . . . 3.802 1.995 5.609 . . . . . A . 17 ARG H . . A . 24 GLU HB3 . . . 17 . HN . . . . . 24 . HB2 . . rr_6e5k 1
385 1 . . 1 1 7 7 LEU MD2 H . . . 1 1 8 8 LYS H H . . . . . 3.815 1.995 5.635 . . . . . A . 7 LEU MD2 . . A . 8 LYS H . . . 7 . HD21 . . . . . 8 . HN . . rr_6e5k 1
386 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 10 10 ARG H H . . . . . 3.822 1.996 5.648 . . . . . A . 11 TYR HD2 . . A . 10 ARG H . . . 11 . HD2 . . . . . 10 . HN . . rr_6e5k 1
386 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 10 10 ARG H H . . . . . 3.822 1.996 5.648 . . . . . A . 11 TYR HD1 . . A . 10 ARG H . . . 11 . HD1 . . . . . 10 . HN . . rr_6e5k 1
387 1 OR . 1 1 8 8 LYS HB2 H . . . 1 1 10 10 ARG H H . . . . . 3.830 1.997 5.663 . . . . . A . 8 LYS HB2 . . A . 10 ARG H . . . 8 . HB1 . . . . . 10 . HN . . rr_6e5k 1
387 2 OR . 1 1 8 8 LYS HB3 H . . . 1 1 10 10 ARG H H . . . . . 3.830 1.997 5.663 . . . . . A . 8 LYS HB3 . . A . 10 ARG H . . . 8 . HB2 . . . . . 10 . HN . . rr_6e5k 1
388 1 . . 1 1 6 6 ABA H H . . . 1 1 4 4 CYS HA H . . . . . 3.830 1.997 5.663 . . . . . A . 6 AIB H . . A . 4 CYS HA . . . 6 . HN . . . . . 4 . HA . . rr_6e5k 1
389 1 . . 1 1 11 11 TYR HB3 H . . . 1 1 12 12 ABA H H . . . . . 3.851 1.997 5.705 . . . . . A . 11 TYR HB3 . . A . 12 AIB H . . . 11 . HB2 . . . . . 12 . HN . . rr_6e5k 1
390 1 . . 1 1 23 23 TYR H H . . . 1 1 22 22 ARG H H . . . . . 3.863 1.998 5.728 . . . . . A . 23 TYR H . . A . 22 ARG H . . . 23 . HN . . . . . 22 . HN . . rr_6e5k 1
391 1 . . 1 1 2 2 ASP HB3 H . . . 1 1 3 3 ABA H H . . . . . 3.878 1.998 5.758 . . . . . A . 2 ASP HB3 . . A . 3 AIB H . . . 2 . HB2 . . . . . 3 . HN . . rr_6e5k 1
392 1 . . 1 1 23 23 TYR HB2 H . . . 1 1 7 7 LEU MD2 H . . . . . 3.898 1.999 5.797 . . . . . A . 23 TYR HB2 . . A . 7 LEU MD2 . . . 23 . HB1 . . . . . 7 . HD21 . . rr_6e5k 1
393 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 12 12 ABA H H . . . . . 3.906 1.999 5.813 . . . . . A . 11 TYR HD2 . . A . 12 AIB H . . . 11 . HD2 . . . . . 12 . HN . . rr_6e5k 1
393 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 12 12 ABA H H . . . . . 3.906 1.999 5.813 . . . . . A . 11 TYR HD1 . . A . 12 AIB H . . . 11 . HD1 . . . . . 12 . HN . . rr_6e5k 1
394 1 . . 1 1 16 16 MVA HG11 H . . . 1 1 8 8 LYS H H . . . . . 3.932 2.000 5.864 . . . . . A . 16 MVA HG11 . . A . 8 LYS H . . . 16 . HG11 . . . . . 8 . HN . . rr_6e5k 1
395 1 OR . 1 1 11 11 TYR HD2 H . . . 1 1 8 8 LYS H H . . . . . 3.972 2.000 5.944 . . . . . A . 11 TYR HD2 . . A . 8 LYS H . . . 11 . HD2 . . . . . 8 . HN . . rr_6e5k 1
395 2 OR . 1 1 11 11 TYR HD1 H . . . 1 1 8 8 LYS H H . . . . . 3.972 2.000 5.944 . . . . . A . 11 TYR HD1 . . A . 8 LYS H . . . 11 . HD1 . . . . . 8 . HN . . rr_6e5k 1
396 1 . . 1 1 16 16 MVA HG21 H . . . 1 1 7 7 LEU H H . . . . . 3.995 2.000 5.990 . . . . . A . 16 MVA HG21 . . A . 7 LEU H . . . 16 . HG21 . . . . . 7 . HN . . rr_6e5k 1
397 1 OR . 1 1 25 25 MVA HA H . . . 1 1 23 23 TYR HD2 H . . . . . 4.030 2.000 6.060 . . . . . A . 25 MVA HA . . A . 23 TYR HD2 . . . 25 . HA . . . . . 23 . HD2 . . rr_6e5k 1
397 2 OR . 1 1 25 25 MVA HA H . . . 1 1 23 23 TYR HD1 H . . . . . 4.030 2.000 6.060 . . . . . A . 25 MVA HA . . A . 23 TYR HD1 . . . 25 . HA . . . . . 23 . HD1 . . rr_6e5k 1
398 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 16 16 MVA HG21 H . . . . . 4.107 1.999 6.215 . . . . . A . 11 TYR HE2 . . A . 16 MVA HG21 . . . 11 . HE2 . . . . . 16 . HG21 . . rr_6e5k 1
398 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 16 16 MVA HG21 H . . . . . 4.107 1.999 6.215 . . . . . A . 11 TYR HE1 . . A . 16 MVA HG21 . . . 11 . HE1 . . . . . 16 . HG21 . . rr_6e5k 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 "# Restraints file 1: unambig.tbl" 1 1 1 32 rr_6e5k 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 "spec=NOESY, no=3, id=0, vol=3.200000e+08" 2 127 2 169 rr_6e5k 1
2 "spec=NOESY, no=4, id=1, vol=2.690000e+08" 3 127 3 169 rr_6e5k 1
3 "spec=NOESY, no=5, id=2, vol=2.430000e+08" 4 127 4 169 rr_6e5k 1
4 "spec=NOESY, no=6, id=3, vol=2.160000e+08" 5 127 5 169 rr_6e5k 1
5 "spec=NOESY, no=7, id=4, vol=2.040000e+08" 6 127 6 169 rr_6e5k 1
6 "spec=NOESY, no=8, id=5, vol=1.970000e+08" 7 127 7 169 rr_6e5k 1
7 "spec=NOESY, no=9, id=6, vol=1.940000e+08" 8 127 8 169 rr_6e5k 1
8 "spec=NOESY, no=10, id=7, vol=1.830000e+08" 9 127 9 170 rr_6e5k 1
9 "spec=NOESY, no=11, id=8, vol=1.820000e+08" 10 127 10 170 rr_6e5k 1
10 "spec=NOESY, no=12, id=9, vol=1.810000e+08" 11 127 11 170 rr_6e5k 1
11 "spec=NOESY, no=13, id=10, vol=1.750000e+08" 12 127 12 171 rr_6e5k 1
12 "spec=NOESY, no=14, id=11, vol=1.590000e+08" 13 127 13 171 rr_6e5k 1
13 "spec=NOESY, no=15, id=12, vol=1.580000e+08" 14 127 14 171 rr_6e5k 1
14 "spec=NOESY, no=16, id=13, vol=1.550000e+08" 15 127 15 171 rr_6e5k 1
15 "spec=NOESY, no=17, id=14, vol=1.390000e+08" 16 127 16 171 rr_6e5k 1
16 "spec=NOESY, no=19, id=16, vol=1.060000e+08" 18 127 18 171 rr_6e5k 1
17 "spec=NOESY, no=18, id=15, vol=1.320000e+08" 17 127 17 171 rr_6e5k 1
18 "spec=NOESY, no=20, id=17, vol=9.970000e+07" 21 127 21 171 rr_6e5k 1
19 "spec=NOESY, no=21, id=18, vol=9.550000e+07" 24 127 24 171 rr_6e5k 1
20 "spec=NOESY, no=22, id=19, vol=9.200000e+07" 28 127 28 171 rr_6e5k 1
21 "spec=NOESY, no=24, id=21, vol=7.800000e+07" 33 127 33 171 rr_6e5k 1
22 "spec=NOESY, no=23, id=20, vol=8.230000e+07" 32 127 32 171 rr_6e5k 1
23 "spec=NOESY, no=26, id=23, vol=7.610000e+07" 37 127 37 171 rr_6e5k 1
24 "spec=NOESY, no=25, id=22, vol=7.790000e+07" 36 127 36 171 rr_6e5k 1
25 "spec=NOESY, no=27, id=24, vol=6.970000e+07" 39 127 39 171 rr_6e5k 1
26 "spec=NOESY, no=28, id=25, vol=6.960000e+07" 40 127 40 171 rr_6e5k 1
27 "spec=NOESY, no=29, id=26, vol=6.930000e+07" 41 127 41 171 rr_6e5k 1
28 "spec=NOESY, no=31, id=28, vol=5.970000e+07" 42 127 42 171 rr_6e5k 1
29 "spec=NOESY, no=32, id=29, vol=5.810000e+07" 43 127 43 171 rr_6e5k 1
30 "spec=NOESY, no=33, id=30, vol=5.510000e+07" 44 127 44 171 rr_6e5k 1
31 "spec=NOESY, no=35, id=32, vol=5.020000e+07" 46 127 46 171 rr_6e5k 1
32 "spec=NOESY, no=34, id=31, vol=5.380000e+07" 45 127 45 171 rr_6e5k 1
33 "spec=NOESY, no=36, id=33, vol=4.940000e+07" 49 127 49 171 rr_6e5k 1
34 "spec=NOESY, no=37, id=34, vol=4.920000e+07" 58 127 58 171 rr_6e5k 1
35 "spec=NOESY, no=40, id=37, vol=4.480000e+07" 62 127 62 171 rr_6e5k 1
36 "spec=NOESY, no=39, id=36, vol=4.540000e+07" 61 127 61 171 rr_6e5k 1
37 "spec=NOESY, no=42, id=39, vol=4.320000e+07" 65 127 65 171 rr_6e5k 1
38 "spec=NOESY, no=44, id=41, vol=4.210000e+07" 71 127 71 171 rr_6e5k 1
39 "spec=NOESY, no=45, id=42, vol=4.160000e+07" 73 127 73 171 rr_6e5k 1
40 "spec=NOESY, no=46, id=43, vol=4.130000e+07" 76 127 76 171 rr_6e5k 1
41 "spec=NOESY, no=47, id=44, vol=4.120000e+07" 79 127 79 171 rr_6e5k 1
42 "spec=NOESY, no=49, id=46, vol=4.080000e+07" 81 127 81 171 rr_6e5k 1
43 "spec=NOESY, no=48, id=45, vol=4.100000e+07" 80 127 80 171 rr_6e5k 1
44 "spec=NOESY, no=50, id=47, vol=4.030000e+07" 83 127 83 171 rr_6e5k 1
45 "spec=NOESY, no=51, id=48, vol=3.820000e+07" 87 127 87 171 rr_6e5k 1
46 "spec=NOESY, no=52, id=49, vol=3.780000e+07" 89 127 89 171 rr_6e5k 1
47 "spec=NOESY, no=53, id=50, vol=3.750000e+07" 91 127 91 171 rr_6e5k 1
48 "spec=NOESY, no=54, id=51, vol=3.710000e+07" 93 127 93 171 rr_6e5k 1
49 "spec=NOESY, no=56, id=53, vol=3.560000e+07" 95 127 95 171 rr_6e5k 1
50 "spec=NOESY, no=57, id=54, vol=3.530000e+07" 98 127 98 171 rr_6e5k 1
51 "spec=NOESY, no=58, id=55, vol=3.460000e+07" 99 127 99 171 rr_6e5k 1
52 "spec=NOESY, no=59, id=56, vol=3.450000e+07" 100 127 100 171 rr_6e5k 1
53 "spec=NOESY, no=61, id=58, vol=3.410000e+07" 102 127 102 171 rr_6e5k 1
54 "spec=NOESY, no=60, id=57, vol=3.420000e+07" 101 127 101 171 rr_6e5k 1
55 "spec=NOESY, no=62, id=59, vol=3.390000e+07" 104 127 104 171 rr_6e5k 1
56 "spec=NOESY, no=65, id=62, vol=3.310000e+07" 106 127 106 171 rr_6e5k 1
57 "spec=NOESY, no=64, id=61, vol=3.330000e+07" 105 127 105 171 rr_6e5k 1
58 "spec=NOESY, no=67, id=64, vol=3.260000e+07" 108 127 108 171 rr_6e5k 1
59 "spec=NOESY, no=68, id=65, vol=3.190000e+07" 110 127 110 171 rr_6e5k 1
60 "spec=NOESY, no=70, id=67, vol=3.050000e+07" 113 127 113 171 rr_6e5k 1
61 "spec=NOESY, no=69, id=66, vol=3.120000e+07" 112 127 112 171 rr_6e5k 1
62 "spec=NOESY, no=71, id=68, vol=3.010000e+07" 115 127 115 171 rr_6e5k 1
63 "spec=NOESY, no=73, id=70, vol=3.000000e+07" 125 127 125 171 rr_6e5k 1
64 "spec=NOESY, no=72, id=69, vol=3.010000e+07" 124 127 124 171 rr_6e5k 1
65 "spec=NOESY, no=74, id=71, vol=3.000000e+07" 128 127 128 171 rr_6e5k 1
66 "spec=NOESY, no=75, id=72, vol=3.000000e+07" 130 127 130 171 rr_6e5k 1
67 "spec=NOESY, no=76, id=73, vol=2.980000e+07" 132 127 132 171 rr_6e5k 1
68 "spec=NOESY, no=78, id=75, vol=2.960000e+07" 134 127 134 171 rr_6e5k 1
69 "spec=NOESY, no=77, id=74, vol=2.960000e+07" 133 127 133 171 rr_6e5k 1
70 "spec=NOESY, no=79, id=76, vol=2.900000e+07" 138 127 138 171 rr_6e5k 1
71 "spec=NOESY, no=81, id=78, vol=2.850000e+07" 141 127 141 171 rr_6e5k 1
72 "spec=NOESY, no=82, id=79, vol=2.810000e+07" 143 127 143 171 rr_6e5k 1
73 "spec=NOESY, no=83, id=80, vol=2.810000e+07" 144 127 144 171 rr_6e5k 1
74 "spec=NOESY, no=84, id=81, vol=2.770000e+07" 145 127 145 171 rr_6e5k 1
75 "spec=NOESY, no=85, id=82, vol=2.750000e+07" 146 127 146 171 rr_6e5k 1
76 "spec=NOESY, no=87, id=84, vol=2.720000e+07" 148 127 148 171 rr_6e5k 1
77 "spec=NOESY, no=86, id=83, vol=2.750000e+07" 147 127 147 171 rr_6e5k 1
78 "spec=NOESY, no=88, id=85, vol=2.720000e+07" 151 127 151 171 rr_6e5k 1
79 "spec=NOESY, no=89, id=86, vol=2.690000e+07" 155 127 155 171 rr_6e5k 1
80 "spec=NOESY, no=90, id=87, vol=2.680000e+07" 164 127 164 171 rr_6e5k 1
81 "spec=NOESY, no=91, id=88, vol=2.680000e+07" 167 127 167 171 rr_6e5k 1
82 "spec=NOESY, no=92, id=89, vol=2.660000e+07" 170 127 170 171 rr_6e5k 1
83 "spec=NOESY, no=93, id=90, vol=2.640000e+07" 171 127 171 171 rr_6e5k 1
84 "spec=NOESY, no=95, id=92, vol=2.620000e+07" 173 127 173 171 rr_6e5k 1
85 "spec=NOESY, no=94, id=91, vol=2.620000e+07" 172 127 172 171 rr_6e5k 1
86 "spec=NOESY, no=97, id=94, vol=2.580000e+07" 176 127 176 171 rr_6e5k 1
87 "spec=NOESY, no=96, id=93, vol=2.590000e+07" 175 127 175 171 rr_6e5k 1
88 "spec=NOESY, no=98, id=95, vol=2.520000e+07" 179 127 179 171 rr_6e5k 1
89 "spec=NOESY, no=99, id=96, vol=2.520000e+07" 180 127 180 171 rr_6e5k 1
90 "spec=NOESY, no=101, id=98, vol=2.510000e+07" 182 127 182 172 rr_6e5k 1
91 "spec=NOESY, no=100, id=97, vol=2.510000e+07" 181 127 181 172 rr_6e5k 1
92 "spec=NOESY, no=102, id=99, vol=2.490000e+07" 188 127 188 172 rr_6e5k 1
93 "spec=NOESY, no=104, id=101, vol=2.460000e+07" 190 127 190 173 rr_6e5k 1
94 "spec=NOESY, no=103, id=100, vol=2.460000e+07" 189 127 189 173 rr_6e5k 1
95 "spec=NOESY, no=105, id=102, vol=2.440000e+07" 193 127 193 173 rr_6e5k 1
96 "spec=NOESY, no=106, id=103, vol=2.440000e+07" 196 127 196 173 rr_6e5k 1
97 "spec=NOESY, no=108, id=105, vol=2.430000e+07" 198 127 198 173 rr_6e5k 1
98 "spec=NOESY, no=107, id=104, vol=2.430000e+07" 197 127 197 173 rr_6e5k 1
99 "spec=NOESY, no=110, id=107, vol=2.390000e+07" 201 127 201 173 rr_6e5k 1
100 "spec=NOESY, no=111, id=108, vol=2.360000e+07" 202 127 202 173 rr_6e5k 1
101 "spec=NOESY, no=112, id=109, vol=2.340000e+07" 203 127 203 173 rr_6e5k 1
102 "spec=NOESY, no=113, id=110, vol=2.320000e+07" 204 127 204 173 rr_6e5k 1
103 "spec=NOESY, no=114, id=111, vol=2.290000e+07" 205 127 205 173 rr_6e5k 1
104 "spec=NOESY, no=115, id=112, vol=2.290000e+07" 206 127 206 173 rr_6e5k 1
105 "spec=NOESY, no=116, id=113, vol=2.290000e+07" 207 127 207 173 rr_6e5k 1
106 "spec=NOESY, no=117, id=114, vol=2.260000e+07" 208 127 208 173 rr_6e5k 1
107 "spec=NOESY, no=118, id=115, vol=2.260000e+07" 209 127 209 173 rr_6e5k 1
108 "spec=NOESY, no=121, id=118, vol=2.190000e+07" 211 127 211 173 rr_6e5k 1
109 "spec=NOESY, no=119, id=116, vol=2.250000e+07" 210 127 210 173 rr_6e5k 1
110 "spec=NOESY, no=122, id=119, vol=2.140000e+07" 217 127 217 173 rr_6e5k 1
111 "spec=NOESY, no=123, id=120, vol=2.120000e+07" 220 127 220 173 rr_6e5k 1
112 "spec=NOESY, no=124, id=121, vol=2.110000e+07" 221 127 221 173 rr_6e5k 1
113 "spec=NOESY, no=126, id=123, vol=2.100000e+07" 223 127 223 173 rr_6e5k 1
114 "spec=NOESY, no=125, id=122, vol=2.100000e+07" 222 127 222 173 rr_6e5k 1
115 "spec=NOESY, no=127, id=124, vol=2.060000e+07" 226 127 226 173 rr_6e5k 1
116 "spec=NOESY, no=128, id=125, vol=2.040000e+07" 235 127 235 173 rr_6e5k 1
117 "spec=NOESY, no=129, id=126, vol=1.980000e+07" 238 127 238 173 rr_6e5k 1
118 "spec=NOESY, no=130, id=127, vol=1.970000e+07" 241 127 241 173 rr_6e5k 1
119 "spec=NOESY, no=131, id=128, vol=1.970000e+07" 245 127 245 173 rr_6e5k 1
120 "spec=NOESY, no=132, id=129, vol=1.950000e+07" 246 127 246 173 rr_6e5k 1
121 "spec=NOESY, no=133, id=130, vol=1.920000e+07" 247 127 247 173 rr_6e5k 1
122 "spec=NOESY, no=134, id=131, vol=1.910000e+07" 248 127 248 173 rr_6e5k 1
123 "spec=NOESY, no=135, id=132, vol=1.900000e+07" 249 127 249 173 rr_6e5k 1
124 "spec=NOESY, no=136, id=133, vol=1.880000e+07" 250 127 250 173 rr_6e5k 1
125 "spec=NOESY, no=138, id=135, vol=1.870000e+07" 252 127 252 173 rr_6e5k 1
126 "spec=NOESY, no=137, id=134, vol=1.880000e+07" 251 127 251 173 rr_6e5k 1
127 "spec=NOESY, no=140, id=137, vol=1.820000e+07" 256 127 256 173 rr_6e5k 1
128 "spec=NOESY, no=139, id=136, vol=1.840000e+07" 255 127 255 173 rr_6e5k 1
129 "spec=NOESY, no=142, id=139, vol=1.750000e+07" 259 127 259 173 rr_6e5k 1
130 "spec=NOESY, no=141, id=138, vol=1.790000e+07" 258 127 258 173 rr_6e5k 1
131 "spec=NOESY, no=143, id=140, vol=1.740000e+07" 262 127 262 173 rr_6e5k 1
132 "spec=NOESY, no=146, id=143, vol=1.730000e+07" 269 127 269 173 rr_6e5k 1
133 "spec=NOESY, no=144, id=141, vol=1.740000e+07" 268 127 268 173 rr_6e5k 1
134 "spec=NOESY, no=149, id=146, vol=1.700000e+07" 273 127 273 173 rr_6e5k 1
135 "spec=NOESY, no=147, id=144, vol=1.710000e+07" 272 127 272 173 rr_6e5k 1
136 "spec=NOESY, no=150, id=147, vol=1.690000e+07" 275 127 275 173 rr_6e5k 1
137 "spec=NOESY, no=152, id=149, vol=1.650000e+07" 277 127 277 173 rr_6e5k 1
138 "spec=NOESY, no=151, id=148, vol=1.670000e+07" 276 127 276 173 rr_6e5k 1
139 "spec=NOESY, no=153, id=150, vol=1.650000e+07" 279 127 279 173 rr_6e5k 1
140 "spec=NOESY, no=154, id=151, vol=1.650000e+07" 282 127 282 173 rr_6e5k 1
141 "spec=NOESY, no=155, id=152, vol=1.640000e+07" 283 127 283 173 rr_6e5k 1
142 "spec=NOESY, no=158, id=155, vol=1.620000e+07" 285 127 285 173 rr_6e5k 1
143 "spec=NOESY, no=156, id=153, vol=1.640000e+07" 284 127 284 173 rr_6e5k 1
144 "spec=NOESY, no=160, id=157, vol=1.620000e+07" 292 127 292 173 rr_6e5k 1
145 "spec=NOESY, no=159, id=156, vol=1.620000e+07" 291 127 291 173 rr_6e5k 1
146 "spec=NOESY, no=162, id=159, vol=1.570000e+07" 295 127 295 173 rr_6e5k 1
147 "spec=NOESY, no=161, id=158, vol=1.610000e+07" 294 127 294 173 rr_6e5k 1
148 "spec=NOESY, no=164, id=161, vol=1.560000e+07" 305 127 305 173 rr_6e5k 1
149 "spec=NOESY, no=163, id=160, vol=1.570000e+07" 304 127 304 173 rr_6e5k 1
150 "spec=NOESY, no=165, id=162, vol=1.550000e+07" 307 127 307 173 rr_6e5k 1
151 "spec=NOESY, no=167, id=164, vol=1.530000e+07" 308 127 308 173 rr_6e5k 1
152 "spec=NOESY, no=169, id=166, vol=1.530000e+07" 310 127 310 173 rr_6e5k 1
153 "spec=NOESY, no=168, id=165, vol=1.530000e+07" 309 127 309 173 rr_6e5k 1
154 "spec=NOESY, no=172, id=169, vol=1.490000e+07" 317 127 317 173 rr_6e5k 1
155 "spec=NOESY, no=171, id=168, vol=1.500000e+07" 316 127 316 173 rr_6e5k 1
156 "spec=NOESY, no=174, id=171, vol=1.470000e+07" 324 127 324 173 rr_6e5k 1
157 "spec=NOESY, no=173, id=170, vol=1.490000e+07" 323 127 323 173 rr_6e5k 1
158 "spec=NOESY, no=175, id=172, vol=1.460000e+07" 330 127 330 173 rr_6e5k 1
159 "spec=NOESY, no=177, id=174, vol=1.450000e+07" 332 127 332 173 rr_6e5k 1
160 "spec=NOESY, no=176, id=173, vol=1.450000e+07" 331 127 331 173 rr_6e5k 1
161 "spec=NOESY, no=178, id=175, vol=1.440000e+07" 334 127 334 173 rr_6e5k 1
162 "spec=NOESY, no=180, id=177, vol=1.430000e+07" 337 127 337 173 rr_6e5k 1
163 "spec=NOESY, no=179, id=176, vol=1.440000e+07" 336 127 336 173 rr_6e5k 1
164 "spec=NOESY, no=182, id=179, vol=1.420000e+07" 341 127 341 173 rr_6e5k 1
165 "spec=NOESY, no=181, id=178, vol=1.430000e+07" 340 127 340 173 rr_6e5k 1
166 "spec=NOESY, no=184, id=181, vol=1.390000e+07" 344 127 344 173 rr_6e5k 1
167 "spec=NOESY, no=186, id=183, vol=1.380000e+07" 348 127 348 173 rr_6e5k 1
168 "spec=NOESY, no=185, id=182, vol=1.380000e+07" 347 127 347 173 rr_6e5k 1
169 "spec=NOESY, no=187, id=184, vol=1.380000e+07" 350 127 350 173 rr_6e5k 1
170 "spec=NOESY, no=189, id=186, vol=1.370000e+07" 354 127 354 173 rr_6e5k 1
171 "spec=NOESY, no=188, id=185, vol=1.370000e+07" 353 127 353 173 rr_6e5k 1
172 "spec=NOESY, no=190, id=187, vol=1.360000e+07" 356 127 356 173 rr_6e5k 1
173 "spec=NOESY, no=192, id=189, vol=1.340000e+07" 358 127 358 173 rr_6e5k 1
174 "spec=NOESY, no=191, id=188, vol=1.350000e+07" 357 127 357 173 rr_6e5k 1
175 "spec=NOESY, no=194, id=191, vol=1.340000e+07" 361 127 361 173 rr_6e5k 1
176 "spec=NOESY, no=196, id=193, vol=1.320000e+07" 363 127 363 173 rr_6e5k 1
177 "spec=NOESY, no=195, id=192, vol=1.330000e+07" 362 127 362 173 rr_6e5k 1
178 "spec=NOESY, no=197, id=194, vol=1.320000e+07" 366 127 366 173 rr_6e5k 1
179 "spec=NOESY, no=200, id=197, vol=1.300000e+07" 368 127 368 173 rr_6e5k 1
180 "spec=NOESY, no=199, id=196, vol=1.310000e+07" 367 127 367 173 rr_6e5k 1
181 "spec=NOESY, no=201, id=198, vol=1.300000e+07" 374 127 374 173 rr_6e5k 1
182 "spec=NOESY, no=202, id=199, vol=1.290000e+07" 375 127 375 173 rr_6e5k 1
183 "spec=NOESY, no=203, id=200, vol=1.290000e+07" 376 127 376 173 rr_6e5k 1
184 "spec=NOESY, no=207, id=204, vol=1.260000e+07" 378 127 378 173 rr_6e5k 1
185 "spec=NOESY, no=206, id=203, vol=1.270000e+07" 377 127 377 173 rr_6e5k 1
186 "spec=NOESY, no=208, id=205, vol=1.250000e+07" 380 127 380 173 rr_6e5k 1
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209 "spec=NOESY, no=234, id=231, vol=1.030000e+07" 418 127 418 173 rr_6e5k 1
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290 "spec=NOESY, no=331, id=327, vol=5.610000e+06" 594 127 594 173 rr_6e5k 1
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380 "spec=NOESY, no=448, id=442, vol=3.010000e+06" 786 127 786 173 rr_6e5k 1
381 "spec=NOESY, no=447, id=441, vol=3.070000e+06" 785 127 785 173 rr_6e5k 1
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383 "spec=NOESY, no=449, id=443, vol=2.980000e+06" 788 127 788 173 rr_6e5k 1
384 "spec=NOESY, no=452, id=446, vol=2.780000e+06" 791 127 791 173 rr_6e5k 1
385 "spec=NOESY, no=454, id=448, vol=2.730000e+06" 794 127 794 173 rr_6e5k 1
386 "spec=NOESY, no=453, id=447, vol=2.740000e+06" 793 127 793 173 rr_6e5k 1
387 "spec=NOESY, no=456, id=450, vol=2.720000e+06" 797 127 797 173 rr_6e5k 1
388 "spec=NOESY, no=458, id=452, vol=2.640000e+06" 801 127 801 173 rr_6e5k 1
389 "spec=NOESY, no=457, id=451, vol=2.680000e+06" 800 127 800 173 rr_6e5k 1
390 "spec=NOESY, no=459, id=453, vol=2.630000e+06" 807 127 807 173 rr_6e5k 1
391 "spec=NOESY, no=461, id=454, vol=2.590000e+06" 810 127 810 173 rr_6e5k 1
392 "spec=NOESY, no=462, id=455, vol=2.580000e+06" 813 127 813 173 rr_6e5k 1
393 "spec=NOESY, no=463, id=456, vol=2.550000e+06" 816 127 816 173 rr_6e5k 1
394 "spec=NOESY, no=464, id=457, vol=2.530000e+06" 819 127 819 173 rr_6e5k 1
395 "spec=NOESY, no=465, id=458, vol=2.490000e+06" 825 127 825 173 rr_6e5k 1
396 "spec=NOESY, no=470, id=463, vol=2.420000e+06" 827 127 827 173 rr_6e5k 1
397 "spec=NOESY, no=466, id=459, vol=2.490000e+06" 826 127 826 173 rr_6e5k 1
398 "spec=NOESY, no=472, id=465, vol=2.400000e+06" 830 127 830 173 rr_6e5k 1
399 "spec=NOESY, no=471, id=464, vol=2.410000e+06" 829 127 829 173 rr_6e5k 1
400 "spec=NOESY, no=473, id=466, vol=2.390000e+06" 836 127 836 173 rr_6e5k 1
401 "spec=NOESY, no=474, id=467, vol=2.370000e+06" 839 127 839 173 rr_6e5k 1
402 "spec=NOESY, no=478, id=471, vol=2.300000e+06" 841 127 841 173 rr_6e5k 1
403 "spec=NOESY, no=477, id=470, vol=2.320000e+06" 840 127 840 173 rr_6e5k 1
404 "spec=NOESY, no=482, id=475, vol=2.280000e+06" 845 127 845 173 rr_6e5k 1
405 "spec=NOESY, no=479, id=472, vol=2.290000e+06" 844 127 844 173 rr_6e5k 1
406 "spec=NOESY, no=483, id=476, vol=2.200000e+06" 847 127 847 173 rr_6e5k 1
407 "spec=NOESY, no=485, id=478, vol=2.180000e+06" 849 127 849 173 rr_6e5k 1
408 "spec=NOESY, no=486, id=479, vol=2.120000e+06" 851 127 851 173 rr_6e5k 1
409 "spec=NOESY, no=488, id=481, vol=2.080000e+06" 853 127 853 173 rr_6e5k 1
410 "spec=NOESY, no=487, id=480, vol=2.120000e+06" 852 127 852 173 rr_6e5k 1
411 "spec=NOESY, no=489, id=482, vol=2.080000e+06" 856 127 856 173 rr_6e5k 1
412 "spec=NOESY, no=492, id=485, vol=2.050000e+06" 859 127 859 173 rr_6e5k 1
413 "spec=NOESY, no=491, id=484, vol=2.070000e+06" 858 127 858 173 rr_6e5k 1
414 "spec=NOESY, no=494, id=487, vol=2.020000e+06" 862 127 862 173 rr_6e5k 1
415 "spec=NOESY, no=495, id=488, vol=2.010000e+06" 863 127 863 173 rr_6e5k 1
416 "spec=NOESY, no=497, id=490, vol=1.980000e+06" 865 127 865 173 rr_6e5k 1
417 "spec=NOESY, no=496, id=489, vol=1.990000e+06" 864 127 864 173 rr_6e5k 1
418 "spec=NOESY, no=499, id=492, vol=1.950000e+06" 867 127 867 173 rr_6e5k 1
419 "spec=NOESY, no=500, id=493, vol=1.910000e+06" 868 127 868 173 rr_6e5k 1
420 "spec=NOESY, no=502, id=495, vol=1.910000e+06" 869 127 869 173 rr_6e5k 1
421 "spec=NOESY, no=505, id=498, vol=1.820000e+06" 871 127 871 173 rr_6e5k 1
422 "spec=NOESY, no=503, id=496, vol=1.860000e+06" 870 127 870 173 rr_6e5k 1
423 "spec=NOESY, no=506, id=499, vol=1.800000e+06" 874 127 874 173 rr_6e5k 1
424 "spec=NOESY, no=507, id=500, vol=1.780000e+06" 876 127 876 173 rr_6e5k 1
425 "spec=NOESY, no=508, id=501, vol=1.780000e+06" 878 127 878 173 rr_6e5k 1
426 "spec=NOESY, no=509, id=502, vol=1.720000e+06" 879 127 879 173 rr_6e5k 1
427 "spec=NOESY, no=510, id=503, vol=1.690000e+06" 880 127 880 173 rr_6e5k 1
428 "spec=NOESY, no=513, id=506, vol=1.600000e+06" 882 127 882 173 rr_6e5k 1
429 "spec=NOESY, no=511, id=504, vol=1.650000e+06" 881 127 881 173 rr_6e5k 1
430 "spec=NOESY, no=514, id=507, vol=1.580000e+06" 885 127 885 173 rr_6e5k 1
431 "spec=NOESY, no=518, id=511, vol=1.520000e+06" 887 127 887 173 rr_6e5k 1
432 "spec=NOESY, no=520, id=513, vol=1.430000e+06" 890 127 890 173 rr_6e5k 1
433 "spec=NOESY, no=521, id=514, vol=1.380000e+06" 892 127 892 173 rr_6e5k 1
434 "spec=NOESY, no=524, id=517, vol=1.310000e+06" 895 127 895 173 rr_6e5k 1
435 "spec=NOESY, no=525, id=518, vol=1.170000e+06" 897 127 897 173 rr_6e5k 1
stop_
loop_
_Gen_dist_constraint_conv_err.ID
_Gen_dist_constraint_conv_err.Gen_dist_constraint_parse_file_ID
_Gen_dist_constraint_conv_err.Parse_file_constraint_ID
_Gen_dist_constraint_conv_err.Conv_error_type
_Gen_dist_constraint_conv_err.Conv_error_note
_Gen_dist_constraint_conv_err.Entry_ID
_Gen_dist_constraint_conv_err.Gen_dist_constraint_list_ID
1 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .28.HN1' (nmrStar names),' .28.HN2' (nmrStar names) not linked" rr_6e5k 1
2 2 17 1 "Not handling restraint 17, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
3 2 17 1 "Not handling restraint 17, item 3, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
4 2 17 1 "Not handling restraint 17, item 4, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
5 2 18 1 "Not handling restraint 18, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
6 2 18 1 "Not handling restraint 18, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
7 2 18 1 "Not handling restraint 18, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
8 2 37 1 "Not handling restraint 37, item 2, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 1
9 2 37 1 "Not handling restraint 37, item 3, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 1
10 2 37 1 "Not handling restraint 37, item 4, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 1
11 2 37 1 "Not handling restraint 37, item 5, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 1
12 2 37 1 "Not handling restraint 37, item 6, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 1
13 2 37 1 "Not handling restraint 37, item 7, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 1
14 2 39 1 "Not handling restraint 39, item 2, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 1
15 2 39 1 "Not handling restraint 39, item 3, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 1
16 2 39 1 "Not handling restraint 39, item 4, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 1
17 2 49 1 "Not handling restraint 49, item 2, resonance(s) ' .3.HB12' (nmrStar names) not linked" rr_6e5k 1
18 2 49 1 "Not handling restraint 49, item 3, resonance(s) ' .3.HB11' (nmrStar names) not linked" rr_6e5k 1
19 2 49 1 "Not handling restraint 49, item 4, resonance(s) ' .3.HB13' (nmrStar names) not linked" rr_6e5k 1
20 2 62 1 "Not handling restraint 62, item 3, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
21 2 62 1 "Not handling restraint 62, item 6, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
22 2 62 1 "Not handling restraint 62, item 9, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
23 2 79 1 "Not handling restraint 79, item 3, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
24 2 79 1 "Not handling restraint 79, item 6, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
25 2 79 1 "Not handling restraint 79, item 9, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
26 2 81 1 "Not handling restraint 81, item 2, resonance(s) ' .12.HB12' (nmrStar names) not linked" rr_6e5k 1
27 2 81 1 "Not handling restraint 81, item 3, resonance(s) ' .12.HB11' (nmrStar names) not linked" rr_6e5k 1
28 2 81 1 "Not handling restraint 81, item 4, resonance(s) ' .12.HB13' (nmrStar names) not linked" rr_6e5k 1
29 2 87 1 "Not handling restraint 87, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" rr_6e5k 1
30 2 87 1 "Not handling restraint 87, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" rr_6e5k 1
31 2 87 1 "Not handling restraint 87, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" rr_6e5k 1
32 2 109 1 "Not handling restraint 109, item 2, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 1
33 2 109 1 "Not handling restraint 109, item 3, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 1
34 2 109 1 "Not handling restraint 109, item 4, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 1
35 2 109 1 "Not handling restraint 109, item 5, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 1
36 2 109 1 "Not handling restraint 109, item 6, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 1
37 2 109 1 "Not handling restraint 109, item 7, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 1
38 2 114 1 "Not handling restraint 114, item 2, resonance(s) ' .3.HB12' (nmrStar names) not linked" rr_6e5k 1
39 2 114 1 "Not handling restraint 114, item 3, resonance(s) ' .3.HB11' (nmrStar names) not linked" rr_6e5k 1
40 2 114 1 "Not handling restraint 114, item 4, resonance(s) ' .3.HB13' (nmrStar names) not linked" rr_6e5k 1
41 2 126 1 "Not handling restraint 126, item 2, resonance(s) ' .12.HB12' (nmrStar names) not linked" rr_6e5k 1
42 2 126 1 "Not handling restraint 126, item 3, resonance(s) ' .12.HB11' (nmrStar names) not linked" rr_6e5k 1
43 2 126 1 "Not handling restraint 126, item 4, resonance(s) ' .12.HB13' (nmrStar names) not linked" rr_6e5k 1
44 2 139 1 "Not handling restraint 139, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
45 2 139 1 "Not handling restraint 139, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
46 2 139 1 "Not handling restraint 139, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
47 2 162 1 "Not handling restraint 162, item 1, resonance(s) ' .28.HN2' (nmrStar names) not linked" rr_6e5k 1
48 2 163 1 "Not handling restraint 163, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" rr_6e5k 1
49 2 163 1 "Not handling restraint 163, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" rr_6e5k 1
50 2 163 1 "Not handling restraint 163, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" rr_6e5k 1
51 2 224 1 "Not handling restraint 224, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
52 2 224 1 "Not handling restraint 224, item 3, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
53 2 224 1 "Not handling restraint 224, item 4, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
54 2 230 1 "Not handling restraint 230, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
55 2 230 1 "Not handling restraint 230, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
56 2 230 1 "Not handling restraint 230, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
57 2 230 1 "Not handling restraint 230, item 5, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
58 2 230 1 "Not handling restraint 230, item 6, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
59 2 230 1 "Not handling restraint 230, item 7, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
60 2 231 1 "Not handling restraint 231, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
61 2 231 1 "Not handling restraint 231, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
62 2 231 1 "Not handling restraint 231, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
63 2 259 1 "Not handling restraint 259, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
64 2 259 1 "Not handling restraint 259, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
65 2 259 1 "Not handling restraint 259, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
66 2 261 1 "Not handling restraint 261, item 3, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
67 2 261 1 "Not handling restraint 261, item 6, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
68 2 261 1 "Not handling restraint 261, item 9, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
69 2 272 1 "Not handling restraint 272, item 3, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
70 2 272 1 "Not handling restraint 272, item 6, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
71 2 272 1 "Not handling restraint 272, item 9, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
72 2 276 1 "Not handling restraint 276, item 1, resonance(s) ' .28.HN1' (nmrStar names) not linked" rr_6e5k 1
73 2 287 1 "Not handling restraint 287, item 1, resonance(s) ' .28.HN2' (nmrStar names) not linked" rr_6e5k 1
74 2 301 1 "Not handling restraint 301, item 2, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 1
75 2 301 1 "Not handling restraint 301, item 3, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 1
76 2 301 1 "Not handling restraint 301, item 4, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 1
77 2 301 1 "Not handling restraint 301, item 5, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 1
78 2 301 1 "Not handling restraint 301, item 6, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 1
79 2 301 1 "Not handling restraint 301, item 7, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 1
80 2 304 1 "Not handling restraint 304, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
81 2 304 1 "Not handling restraint 304, item 3, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
82 2 304 1 "Not handling restraint 304, item 4, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
83 2 304 1 "Not handling restraint 304, item 5, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
84 2 304 1 "Not handling restraint 304, item 6, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
85 2 304 1 "Not handling restraint 304, item 7, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
86 2 308 1 "Not handling restraint 308, item 2, resonance(s) ' .12.HB12' (nmrStar names) not linked" rr_6e5k 1
87 2 308 1 "Not handling restraint 308, item 3, resonance(s) ' .12.HB11' (nmrStar names) not linked" rr_6e5k 1
88 2 308 1 "Not handling restraint 308, item 4, resonance(s) ' .12.HB13' (nmrStar names) not linked" rr_6e5k 1
89 2 315 1 "Not handling restraint 315, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
90 2 315 1 "Not handling restraint 315, item 3, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
91 2 315 1 "Not handling restraint 315, item 4, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
92 2 340 1 "Not handling restraint 340, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" rr_6e5k 1
93 2 340 1 "Not handling restraint 340, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" rr_6e5k 1
94 2 340 1 "Not handling restraint 340, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" rr_6e5k 1
95 2 349 1 "Not handling restraint 349, item 2, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 1
96 2 349 1 "Not handling restraint 349, item 3, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 1
97 2 349 1 "Not handling restraint 349, item 4, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 1
98 2 349 1 "Not handling restraint 349, item 5, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 1
99 2 349 1 "Not handling restraint 349, item 6, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 1
100 2 349 1 "Not handling restraint 349, item 7, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 1
101 2 354 1 "Not handling restraint 354, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
102 2 354 1 "Not handling restraint 354, item 3, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
103 2 354 1 "Not handling restraint 354, item 4, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
104 2 354 1 "Not handling restraint 354, item 5, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
105 2 354 1 "Not handling restraint 354, item 6, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
106 2 354 1 "Not handling restraint 354, item 7, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
107 2 357 1 "Not handling restraint 357, item 1, resonance(s) ' .28.HN1' (nmrStar names) not linked" rr_6e5k 1
108 2 378 1 "Not handling restraint 378, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
109 2 378 1 "Not handling restraint 378, item 3, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
110 2 378 1 "Not handling restraint 378, item 4, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
111 2 391 1 "Not handling restraint 391, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
112 2 391 1 "Not handling restraint 391, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
113 2 391 1 "Not handling restraint 391, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
114 2 413 1 "Not handling restraint 413, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
115 2 413 1 "Not handling restraint 413, item 3, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
116 2 413 1 "Not handling restraint 413, item 4, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
117 2 414 1 "Not handling restraint 414, item 1, resonance(s) ' .28.HN2' (nmrStar names) not linked" rr_6e5k 1
118 2 419 1 "Not handling restraint 419, item 1, resonance(s) ' .28.HN2' (nmrStar names) not linked" rr_6e5k 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_6e5k
_Gen_dist_constraint_list.ID 3
_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_6e5k 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 OR . 1 1 10 10 ARG HB3 H . . . 1 1 10 10 ARG HA H . . . . . 2.212 1.600 2.824 . . . . . A . 10 ARG HB3 . . A . 10 ARG HA . . . 10 . HB2 . . . . . 10 . HA . . rr_6e5k 2
1 2 OR . 1 1 7 7 LEU HB3 H . . . 1 1 7 7 LEU HA H . . . . . 2.212 1.600 2.824 . . . . . A . 7 LEU HB3 . . A . 7 LEU HA . . . 7 . HB2 . . . . . 7 . HA . . rr_6e5k 2
2 1 OR . 1 1 5 5 LYS HB2 H . . . 1 1 5 5 LYS HA H . . . . . 2.323 1.648 2.998 . . . . . A . 5 LYS HB2 . . A . 5 LYS HA . . . 5 . HB1 . . . . . 5 . HA . . rr_6e5k 2
2 2 OR . 1 1 5 5 LYS HB3 H . . . 1 1 5 5 LYS HA H . . . . . 2.323 1.648 2.998 . . . . . A . 5 LYS HB3 . . A . 5 LYS HA . . . 5 . HB2 . . . . . 5 . HA . . rr_6e5k 2
2 3 OR . 1 1 8 8 LYS HB2 H . . . 1 1 5 5 LYS HA H . . . . . 2.323 1.648 2.998 . . . . . A . 8 LYS HB2 . . A . 5 LYS HA . . . 8 . HB1 . . . . . 5 . HA . . rr_6e5k 2
2 4 OR . 1 1 8 8 LYS HB3 H . . . 1 1 5 5 LYS HA H . . . . . 2.323 1.648 2.998 . . . . . A . 8 LYS HB3 . . A . 5 LYS HA . . . 8 . HB2 . . . . . 5 . HA . . rr_6e5k 2
3 1 OR . 1 1 10 10 ARG HB2 H . . . 1 1 10 10 ARG HA H . . . . . 2.349 1.659 3.039 . . . . . A . 10 ARG HB2 . . A . 10 ARG HA . . . 10 . HB1 . . . . . 10 . HA . . rr_6e5k 2
3 2 OR . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG HB2 H . . . . . 2.349 1.659 3.039 . . . . . A . 7 LEU HA . . A . 10 ARG HB2 . . . 7 . HA . . . . . 10 . HB1 . . rr_6e5k 2
4 1 OR . 1 1 8 8 LYS HB3 H . . . 1 1 8 8 LYS HG2 H . . . . . 2.411 1.685 3.137 . . . . . A . 8 LYS HB3 . . A . 8 LYS HG2 . . . 8 . HB2 . . . . . 8 . HG1 . . rr_6e5k 2
4 2 OR . 1 1 8 8 LYS HB2 H . . . 1 1 8 8 LYS HG2 H . . . . . 2.411 1.685 3.137 . . . . . A . 8 LYS HB2 . . A . 8 LYS HG2 . . . 8 . HB1 . . . . . 8 . HG1 . . rr_6e5k 2
4 3 OR . 1 1 5 5 LYS HB2 H . . . 1 1 5 5 LYS HG2 H . . . . . 2.411 1.685 3.137 . . . . . A . 5 LYS HB2 . . A . 5 LYS HG2 . . . 5 . HB1 . . . . . 5 . HG1 . . rr_6e5k 2
4 4 OR . 1 1 5 5 LYS HB3 H . . . 1 1 5 5 LYS HG2 H . . . . . 2.411 1.685 3.137 . . . . . A . 5 LYS HB3 . . A . 5 LYS HG2 . . . 5 . HB2 . . . . . 5 . HG1 . . rr_6e5k 2
5 1 OR . 1 1 10 10 ARG H H . . . 1 1 10 10 ARG HA H . . . . . 2.513 1.724 3.302 . . . . . A . 10 ARG H . . A . 10 ARG HA . . . 10 . HN . . . . . 10 . HA . . rr_6e5k 2
5 2 OR . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG H H . . . . . 2.513 1.724 3.302 . . . . . A . 7 LEU HA . . A . 10 ARG H . . . 7 . HA . . . . . 10 . HN . . rr_6e5k 2
6 1 OR . 1 1 18 18 CYS HB3 H . . . 1 1 19 19 ASP H H . . . . . 2.619 1.762 3.476 . . . . . A . 18 CYS HB3 . . A . 19 ASP H . . . 18 . HB2 . . . . . 19 . HN . . rr_6e5k 2
6 2 OR . 1 1 14 14 CYS HB3 H . . . 1 1 15 15 GLU H H . . . . . 2.619 1.762 3.476 . . . . . A . 14 CYS HB3 . . A . 15 GLU H . . . 14 . HB2 . . . . . 15 . HN . . rr_6e5k 2
7 1 OR . 1 1 19 19 ASP HB2 H . . . 1 1 19 19 ASP H H . . . . . 2.676 1.781 3.571 . . . . . A . 19 ASP HB2 . . A . 19 ASP H . . . 19 . HB1 . . . . . 19 . HN . . rr_6e5k 2
7 2 OR . 1 1 15 15 GLU HG3 H . . . 1 1 15 15 GLU H H . . . . . 2.676 1.781 3.571 . . . . . A . 15 GLU HG3 . . A . 15 GLU H . . . 15 . HG2 . . . . . 15 . HN . . rr_6e5k 2
8 1 OR . 1 1 8 8 LYS H H . . . 1 1 11 11 TYR H H . . . . . 2.712 1.792 3.632 . . . . . A . 8 LYS H . . A . 11 TYR H . . . 8 . HN . . . . . 11 . HN . . rr_6e5k 2
8 2 OR . 1 1 5 5 LYS H H . . . 1 1 8 8 LYS H H . . . . . 2.712 1.792 3.632 . . . . . A . 5 LYS H . . A . 8 LYS H . . . 5 . HN . . . . . 8 . HN . . rr_6e5k 2
9 1 OR . 1 1 11 11 TYR H H . . . 1 1 10 10 ARG HB2 H . . . . . 2.735 1.800 3.670 . . . . . A . 11 TYR H . . A . 10 ARG HB2 . . . 11 . HN . . . . . 10 . HB1 . . rr_6e5k 2
9 2 OR . 1 1 5 5 LYS H H . . . 1 1 5 5 LYS HG3 H . . . . . 2.735 1.800 3.670 . . . . . A . 5 LYS H . . A . 5 LYS HG3 . . . 5 . HN . . . . . 5 . HG2 . . rr_6e5k 2
10 1 OR . 1 1 26 26 HIS HB2 H . . . 1 1 26 26 HIS HD2 H . . . . . 2.746 1.804 3.688 . . . . . A . 26 HIS HB2 . . A . 26 HIS HD2 . . . 26 . HB1 . . . . . 26 . HD2 . . rr_6e5k 2
10 2 OR . 1 1 17 17 ARG HD2 H . . . 1 1 17 17 ARG HE H . . . . . 2.746 1.804 3.688 . . . . . A . 17 ARG HD2 . . A . 17 ARG HE . . . 17 . HD1 . . . . . 17 . HE . . rr_6e5k 2
10 3 OR . 1 1 17 17 ARG HD3 H . . . 1 1 17 17 ARG HE H . . . . . 2.746 1.804 3.688 . . . . . A . 17 ARG HD3 . . A . 17 ARG HE . . . 17 . HD2 . . . . . 17 . HE . . rr_6e5k 2
11 1 OR . 1 1 11 11 TYR HB2 H . . . 1 1 14 14 CYS H H . . . . . 2.836 1.831 3.841 . . . . . A . 11 TYR HB2 . . A . 14 CYS H . . . 11 . HB1 . . . . . 14 . HN . . rr_6e5k 2
11 2 OR . 1 1 14 14 CYS HB2 H . . . 1 1 14 14 CYS H H . . . . . 2.836 1.831 3.841 . . . . . A . 14 CYS HB2 . . A . 14 CYS H . . . 14 . HB1 . . . . . 14 . HN . . rr_6e5k 2
12 1 OR . 1 1 11 11 TYR H H . . . 1 1 10 10 ARG HA H . . . . . 2.867 1.839 3.895 . . . . . A . 11 TYR H . . A . 10 ARG HA . . . 11 . HN . . . . . 10 . HA . . rr_6e5k 2
12 2 OR . 1 1 7 7 LEU HA H . . . 1 1 11 11 TYR H H . . . . . 2.867 1.839 3.895 . . . . . A . 7 LEU HA . . A . 11 TYR H . . . 7 . HA . . . . . 11 . HN . . rr_6e5k 2
13 1 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HD2 H . . . . . 2.894 1.847 3.941 . . . . . A . 8 LYS HA . . A . 8 LYS HD2 . . . 8 . HA . . . . . 8 . HD1 . . rr_6e5k 2
13 2 OR . 1 1 8 8 LYS HA H . . . 1 1 8 8 LYS HD3 H . . . . . 2.894 1.847 3.941 . . . . . A . 8 LYS HA . . A . 8 LYS HD3 . . . 8 . HA . . . . . 8 . HD2 . . rr_6e5k 2
13 3 OR . 1 1 8 8 LYS HA H . . . 1 1 7 7 LEU HB3 H . . . . . 2.894 1.847 3.941 . . . . . A . 8 LYS HA . . A . 7 LEU HB3 . . . 8 . HA . . . . . 7 . HB2 . . rr_6e5k 2
14 1 OR . 1 1 8 8 LYS H H . . . 1 1 8 8 LYS HG2 H . . . . . 2.909 1.851 3.967 . . . . . A . 8 LYS H . . A . 8 LYS HG2 . . . 8 . HN . . . . . 8 . HG1 . . rr_6e5k 2
14 2 OR . 1 1 7 7 LEU HB2 H . . . 1 1 8 8 LYS H H . . . . . 2.909 1.851 3.967 . . . . . A . 7 LEU HB2 . . A . 8 LYS H . . . 7 . HB1 . . . . . 8 . HN . . rr_6e5k 2
15 1 OR . 1 1 11 11 TYR HD1 H . . . 1 1 10 10 ARG HB3 H . . . . . 2.921 1.855 3.987 . . . . . A . 11 TYR HD1 . . A . 10 ARG HB3 . . . 11 . HD1 . . . . . 10 . HB2 . . rr_6e5k 2
15 2 OR . 1 1 11 11 TYR HD2 H . . . 1 1 10 10 ARG HB3 H . . . . . 2.921 1.855 3.987 . . . . . A . 11 TYR HD2 . . A . 10 ARG HB3 . . . 11 . HD2 . . . . . 10 . HB2 . . rr_6e5k 2
15 3 OR . 1 1 11 11 TYR HD2 H . . . 1 1 7 7 LEU HB3 H . . . . . 2.921 1.855 3.987 . . . . . A . 11 TYR HD2 . . A . 7 LEU HB3 . . . 11 . HD2 . . . . . 7 . HB2 . . rr_6e5k 2
15 4 OR . 1 1 11 11 TYR HD1 H . . . 1 1 7 7 LEU HB3 H . . . . . 2.921 1.855 3.987 . . . . . A . 11 TYR HD1 . . A . 7 LEU HB3 . . . 11 . HD1 . . . . . 7 . HB2 . . rr_6e5k 2
16 1 OR . 1 1 8 8 LYS HD2 H . . . 1 1 5 5 LYS HA H . . . . . 2.976 1.869 4.083 . . . . . A . 8 LYS HD2 . . A . 5 LYS HA . . . 8 . HD1 . . . . . 5 . HA . . rr_6e5k 2
16 2 OR . 1 1 8 8 LYS HD3 H . . . 1 1 5 5 LYS HA H . . . . . 2.976 1.869 4.083 . . . . . A . 8 LYS HD3 . . A . 5 LYS HA . . . 8 . HD2 . . . . . 5 . HA . . rr_6e5k 2
16 3 OR . 1 1 5 5 LYS HD2 H . . . 1 1 5 5 LYS HA H . . . . . 2.976 1.869 4.083 . . . . . A . 5 LYS HD2 . . A . 5 LYS HA . . . 5 . HD1 . . . . . 5 . HA . . rr_6e5k 2
16 4 OR . 1 1 5 5 LYS HD3 H . . . 1 1 5 5 LYS HA H . . . . . 2.976 1.869 4.083 . . . . . A . 5 LYS HD3 . . A . 5 LYS HA . . . 5 . HD2 . . . . . 5 . HA . . rr_6e5k 2
17 1 OR . 1 1 22 22 ARG HB2 H . . . 1 1 22 22 ARG HE H . . . . . 3.002 1.875 4.129 . . . . . A . 22 ARG HB2 . . A . 22 ARG HE . . . 22 . HB1 . . . . . 22 . HE . . rr_6e5k 2
17 2 OR . 1 1 22 22 ARG HB3 H . . . 1 1 22 22 ARG HE H . . . . . 3.002 1.875 4.129 . . . . . A . 22 ARG HB3 . . A . 22 ARG HE . . . 22 . HB2 . . . . . 22 . HE . . rr_6e5k 2
17 3 OR . 1 1 17 17 ARG HB3 H . . . 1 1 17 17 ARG HE H . . . . . 3.002 1.875 4.129 . . . . . A . 17 ARG HB3 . . A . 17 ARG HE . . . 17 . HB2 . . . . . 17 . HE . . rr_6e5k 2
18 1 OR . 1 1 16 16 MVA HG21 H . . . 1 1 25 25 MVA HG21 H . . . . . 3.085 1.895 4.275 . . . . . A . 16 MVA HG21 . . A . 25 MVA HG21 . . . 16 . HG21 . . . . . 25 . HG21 . . rr_6e5k 2
18 2 OR . 1 1 7 7 LEU MD2 H . . . 1 1 16 16 MVA HG21 H . . . . . 3.085 1.895 4.275 . . . . . A . 7 LEU MD2 . . A . 16 MVA HG21 . . . 7 . HD21 . . . . . 16 . HG21 . . rr_6e5k 2
19 1 OR . 1 1 11 11 TYR HE2 H . . . 1 1 10 10 ARG HB3 H . . . . . 3.152 1.910 4.394 . . . . . A . 11 TYR HE2 . . A . 10 ARG HB3 . . . 11 . HE2 . . . . . 10 . HB2 . . rr_6e5k 2
19 2 OR . 1 1 11 11 TYR HE1 H . . . 1 1 10 10 ARG HB3 H . . . . . 3.152 1.910 4.394 . . . . . A . 11 TYR HE1 . . A . 10 ARG HB3 . . . 11 . HE1 . . . . . 10 . HB2 . . rr_6e5k 2
19 3 OR . 1 1 11 11 TYR HE2 H . . . 1 1 7 7 LEU HB3 H . . . . . 3.152 1.910 4.394 . . . . . A . 11 TYR HE2 . . A . 7 LEU HB3 . . . 11 . HE2 . . . . . 7 . HB2 . . rr_6e5k 2
19 4 OR . 1 1 11 11 TYR HE1 H . . . 1 1 7 7 LEU HB3 H . . . . . 3.152 1.910 4.394 . . . . . A . 11 TYR HE1 . . A . 7 LEU HB3 . . . 11 . HE1 . . . . . 7 . HB2 . . rr_6e5k 2
20 1 OR . 1 1 19 19 ASP HB2 H . . . 1 1 22 22 ARG HB2 H . . . . . 3.167 1.913 4.421 . . . . . A . 19 ASP HB2 . . A . 22 ARG HB2 . . . 19 . HB1 . . . . . 22 . HB1 . . rr_6e5k 2
20 2 OR . 1 1 19 19 ASP HB2 H . . . 1 1 22 22 ARG HB3 H . . . . . 3.167 1.913 4.421 . . . . . A . 19 ASP HB2 . . A . 22 ARG HB3 . . . 19 . HB1 . . . . . 22 . HB2 . . rr_6e5k 2
20 3 OR . 1 1 19 19 ASP HB2 H . . . 1 1 17 17 ARG HB3 H . . . . . 3.167 1.913 4.421 . . . . . A . 19 ASP HB2 . . A . 17 ARG HB3 . . . 19 . HB1 . . . . . 17 . HB2 . . rr_6e5k 2
21 1 OR . 1 1 22 22 ARG HB2 H . . . 1 1 19 19 ASP H H . . . . . 3.237 1.927 4.547 . . . . . A . 22 ARG HB2 . . A . 19 ASP H . . . 22 . HB1 . . . . . 19 . HN . . rr_6e5k 2
21 2 OR . 1 1 22 22 ARG HB3 H . . . 1 1 19 19 ASP H H . . . . . 3.237 1.927 4.547 . . . . . A . 22 ARG HB3 . . A . 19 ASP H . . . 22 . HB2 . . . . . 19 . HN . . rr_6e5k 2
21 3 OR . 1 1 19 19 ASP H H . . . 1 1 17 17 ARG HB3 H . . . . . 3.237 1.927 4.547 . . . . . A . 19 ASP H . . A . 17 ARG HB3 . . . 19 . HN . . . . . 17 . HB2 . . rr_6e5k 2
22 1 OR . 1 1 22 22 ARG H H . . . 1 1 21 21 PRO HB2 H . . . . . 3.253 1.930 4.576 . . . . . A . 22 ARG H . . A . 21 PRO HB2 . . . 22 . HN . . . . . 21 . HB1 . . rr_6e5k 2
22 2 OR . 1 1 22 22 ARG H H . . . 1 1 21 21 PRO HG3 H . . . . . 3.253 1.930 4.576 . . . . . A . 22 ARG H . . A . 21 PRO HG3 . . . 22 . HN . . . . . 21 . HG2 . . rr_6e5k 2
23 1 OR . 1 1 25 25 MVA HG21 H . . . 1 1 23 23 TYR HD1 H . . . . . 3.257 1.931 4.583 . . . . . A . 25 MVA HG21 . . A . 23 TYR HD1 . . . 25 . HG21 . . . . . 23 . HD1 . . rr_6e5k 2
23 2 OR . 1 1 25 25 MVA HG21 H . . . 1 1 23 23 TYR HD2 H . . . . . 3.257 1.931 4.583 . . . . . A . 25 MVA HG21 . . A . 23 TYR HD2 . . . 25 . HG21 . . . . . 23 . HD2 . . rr_6e5k 2
23 3 OR . 1 1 7 7 LEU MD2 H . . . 1 1 23 23 TYR HD2 H . . . . . 3.257 1.931 4.583 . . . . . A . 7 LEU MD2 . . A . 23 TYR HD2 . . . 7 . HD21 . . . . . 23 . HD2 . . rr_6e5k 2
23 4 OR . 1 1 7 7 LEU MD2 H . . . 1 1 23 23 TYR HD1 H . . . . . 3.257 1.931 4.583 . . . . . A . 7 LEU MD2 . . A . 23 TYR HD1 . . . 7 . HD21 . . . . . 23 . HD1 . . rr_6e5k 2
24 1 OR . 1 1 18 18 CYS H H . . . 1 1 17 17 ARG HB2 H . . . . . 3.259 1.932 4.586 . . . . . A . 18 CYS H . . A . 17 ARG HB2 . . . 18 . HN . . . . . 17 . HB1 . . rr_6e5k 2
24 2 OR . 1 1 18 18 CYS H H . . . 1 1 7 7 LEU HB3 H . . . . . 3.259 1.932 4.586 . . . . . A . 18 CYS H . . A . 7 LEU HB3 . . . 18 . HN . . . . . 7 . HB2 . . rr_6e5k 2
25 1 OR . 1 1 8 8 LYS HB3 H . . . 1 1 7 7 LEU H H . . . . . 3.297 1.938 4.656 . . . . . A . 8 LYS HB3 . . A . 7 LEU H . . . 8 . HB2 . . . . . 7 . HN . . rr_6e5k 2
25 2 OR . 1 1 5 5 LYS HB2 H . . . 1 1 7 7 LEU H H . . . . . 3.297 1.938 4.656 . . . . . A . 5 LYS HB2 . . A . 7 LEU H . . . 5 . HB1 . . . . . 7 . HN . . rr_6e5k 2
25 3 OR . 1 1 5 5 LYS HB3 H . . . 1 1 7 7 LEU H H . . . . . 3.297 1.938 4.656 . . . . . A . 5 LYS HB3 . . A . 7 LEU H . . . 5 . HB2 . . . . . 7 . HN . . rr_6e5k 2
25 4 OR . 1 1 8 8 LYS HB2 H . . . 1 1 7 7 LEU H H . . . . . 3.297 1.938 4.656 . . . . . A . 8 LYS HB2 . . A . 7 LEU H . . . 8 . HB1 . . . . . 7 . HN . . rr_6e5k 2
26 1 OR . 1 1 16 16 MVA HG21 H . . . 1 1 8 8 LYS HB3 H . . . . . 3.320 1.942 4.698 . . . . . A . 16 MVA HG21 . . A . 8 LYS HB3 . . . 16 . HG21 . . . . . 8 . HB2 . . rr_6e5k 2
26 2 OR . 1 1 16 16 MVA HG21 H . . . 1 1 8 8 LYS HB2 H . . . . . 3.320 1.942 4.698 . . . . . A . 16 MVA HG21 . . A . 8 LYS HB2 . . . 16 . HG21 . . . . . 8 . HB1 . . rr_6e5k 2
26 3 OR . 1 1 16 16 MVA HG21 H . . . 1 1 24 24 GLU HB2 H . . . . . 3.320 1.942 4.698 . . . . . A . 16 MVA HG21 . . A . 24 GLU HB2 . . . 16 . HG21 . . . . . 24 . HB1 . . rr_6e5k 2
27 1 OR . 1 1 14 14 CYS HB2 H . . . 1 1 25 25 MVA HG11 H . . . . . 3.385 1.952 4.818 . . . . . A . 14 CYS HB2 . . A . 25 MVA HG11 . . . 14 . HB1 . . . . . 25 . HG11 . . rr_6e5k 2
27 2 OR . 1 1 11 11 TYR HB2 H . . . 1 1 25 25 MVA HG11 H . . . . . 3.385 1.952 4.818 . . . . . A . 11 TYR HB2 . . A . 25 MVA HG11 . . . 11 . HB1 . . . . . 25 . HG11 . . rr_6e5k 2
28 1 OR . 1 1 4 4 CYS HB2 H . . . 1 1 16 16 MVA HG21 H . . . . . 3.526 1.972 5.080 . . . . . A . 4 CYS HB2 . . A . 16 MVA HG21 . . . 4 . HB1 . . . . . 16 . HG21 . . rr_6e5k 2
28 2 OR . 1 1 16 16 MVA HG21 H . . . 1 1 17 17 ARG HD3 H . . . . . 3.526 1.972 5.080 . . . . . A . 16 MVA HG21 . . A . 17 ARG HD3 . . . 16 . HG21 . . . . . 17 . HD2 . . rr_6e5k 2
28 3 OR . 1 1 16 16 MVA HG21 H . . . 1 1 17 17 ARG HD2 H . . . . . 3.526 1.972 5.080 . . . . . A . 16 MVA HG21 . . A . 17 ARG HD2 . . . 16 . HG21 . . . . . 17 . HD1 . . rr_6e5k 2
29 1 OR . 1 1 18 18 CYS HA H . . . 1 1 17 17 ARG H H . . . . . 3.566 1.976 5.156 . . . . . A . 18 CYS HA . . A . 17 ARG H . . . 18 . HA . . . . . 17 . HN . . rr_6e5k 2
29 2 OR . 1 1 15 15 GLU HA H . . . 1 1 17 17 ARG H H . . . . . 3.566 1.976 5.156 . . . . . A . 15 GLU HA . . A . 17 ARG H . . . 15 . HA . . . . . 17 . HN . . rr_6e5k 2
30 1 OR . 1 1 17 17 ARG H H . . . 1 1 26 26 HIS H H . . . . . 3.636 1.983 5.289 . . . . . A . 17 ARG H . . A . 26 HIS H . . . 17 . HN . . . . . 26 . HN . . rr_6e5k 2
30 2 OR . 1 1 17 17 ARG H H . . . 1 1 18 18 CYS H H . . . . . 3.636 1.983 5.289 . . . . . A . 17 ARG H . . A . 18 CYS H . . . 17 . HN . . . . . 18 . HN . . rr_6e5k 2
31 1 OR . 1 1 9 9 ABA H H . . . 1 1 10 10 ARG HA H . . . . . 3.636 1.983 5.289 . . . . . A . 9 AIB H . . A . 10 ARG HA . . . 9 . HN . . . . . 10 . HA . . rr_6e5k 2
31 2 OR . 1 1 9 9 ABA H H . . . 1 1 7 7 LEU HA H . . . . . 3.636 1.983 5.289 . . . . . A . 9 AIB H . . A . 7 LEU HA . . . 9 . HN . . . . . 7 . HA . . rr_6e5k 2
32 1 OR . 1 1 17 17 ARG HB2 H . . . 1 1 26 26 HIS HD2 H . . . . . 3.675 1.987 5.363 . . . . . A . 17 ARG HB2 . . A . 26 HIS HD2 . . . 17 . HB1 . . . . . 26 . HD2 . . rr_6e5k 2
32 2 OR . 1 1 17 17 ARG HB2 H . . . 1 1 17 17 ARG HE H . . . . . 3.675 1.987 5.363 . . . . . A . 17 ARG HB2 . . A . 17 ARG HE . . . 17 . HB1 . . . . . 17 . HE . . rr_6e5k 2
33 1 OR . 1 1 10 10 ARG HA H . . . 1 1 10 10 ARG HE H . . . . . 4.010 2.000 6.020 . . . . . A . 10 ARG HA . . A . 10 ARG HE . . . 10 . HA . . . . . 10 . HE . . rr_6e5k 2
33 2 OR . 1 1 7 7 LEU HA H . . . 1 1 10 10 ARG HE H . . . . . 4.010 2.000 6.020 . . . . . A . 7 LEU HA . . A . 10 ARG HE . . . 7 . HA . . . . . 10 . HE . . rr_6e5k 2
34 1 OR . 1 1 10 10 ARG H H . . . 1 1 8 8 LYS HG2 H . . . . . 4.543 1.964 7.122 . . . . . A . 10 ARG H . . A . 8 LYS HG2 . . . 10 . HN . . . . . 8 . HG1 . . rr_6e5k 2
34 2 OR . 1 1 7 7 LEU HB2 H . . . 1 1 10 10 ARG H H . . . . . 4.543 1.964 7.122 . . . . . A . 7 LEU HB2 . . A . 10 ARG H . . . 7 . HB1 . . . . . 10 . HN . . rr_6e5k 2
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 "# Restraints file 3: ambig.tbl" 1 1 1 30 rr_6e5k 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 "spec=NOESY, no=38, id=35, vol=4.790000e+07" 2 127 2 171 rr_6e5k 2
2 "spec=NOESY, no=41, id=38, vol=4.410000e+07" 4 127 4 171 rr_6e5k 2
3 "spec=NOESY, no=55, id=52, vol=3.570000e+07" 16 127 16 171 rr_6e5k 2
4 "spec=NOESY, no=63, id=60, vol=3.340000e+07" 20 127 20 171 rr_6e5k 2
5 "spec=NOESY, no=66, id=63, vol=3.280000e+07" 22 127 22 171 rr_6e5k 2
6 "spec=NOESY, no=80, id=77, vol=2.860000e+07" 28 127 28 171 rr_6e5k 2
7 "spec=NOESY, no=120, id=117, vol=2.230000e+07" 32 127 32 173 rr_6e5k 2
8 "spec=NOESY, no=145, id=142, vol=1.740000e+07" 34 127 34 173 rr_6e5k 2
9 "spec=NOESY, no=148, id=145, vol=1.710000e+07" 36 127 36 173 rr_6e5k 2
10 "spec=NOESY, no=166, id=163, vol=1.530000e+07" 40 127 40 173 rr_6e5k 2
11 "spec=NOESY, no=170, id=167, vol=1.530000e+07" 42 127 42 173 rr_6e5k 2
12 "spec=NOESY, no=183, id=180, vol=1.410000e+07" 66 127 66 173 rr_6e5k 2
13 "spec=NOESY, no=193, id=190, vol=1.340000e+07" 68 127 68 173 rr_6e5k 2
14 "spec=NOESY, no=198, id=195, vol=1.310000e+07" 70 127 70 173 rr_6e5k 2
15 "spec=NOESY, no=205, id=202, vol=1.270000e+07" 73 127 73 173 rr_6e5k 2
16 "spec=NOESY, no=216, id=213, vol=1.140000e+07" 85 127 85 173 rr_6e5k 2
17 "spec=NOESY, no=227, id=224, vol=1.080000e+07" 94 127 94 173 rr_6e5k 2
18 "spec=NOESY, no=237, id=234, vol=1.010000e+07" 96 127 96 173 rr_6e5k 2
19 "spec=NOESY, no=251, id=248, vol=9.560000e+06" 98 127 98 173 rr_6e5k 2
20 "spec=NOESY, no=254, id=251, vol=9.270000e+06" 101 127 101 173 rr_6e5k 2
21 "spec=NOESY, no=256, id=253, vol=9.040000e+06" 103 127 103 173 rr_6e5k 2
22 "spec=NOESY, no=279, id=276, vol=8.080000e+06" 107 127 107 173 rr_6e5k 2
23 "spec=NOESY, no=288, id=284, vol=7.670000e+06" 111 127 111 173 rr_6e5k 2
24 "spec=NOESY, no=289, id=285, vol=7.670000e+06" 115 127 115 173 rr_6e5k 2
25 "spec=NOESY, no=300, id=296, vol=6.990000e+06" 118 127 118 173 rr_6e5k 2
26 "spec=NOESY, no=311, id=307, vol=6.510000e+06" 130 127 130 173 rr_6e5k 2
27 "spec=NOESY, no=330, id=326, vol=5.730000e+06" 148 127 148 173 rr_6e5k 2
28 "spec=NOESY, no=334, id=330, vol=5.560000e+06" 152 127 152 173 rr_6e5k 2
29 "spec=NOESY, no=337, id=333, vol=5.480000e+06" 155 127 155 173 rr_6e5k 2
30 "spec=NOESY, no=359, id=355, vol=4.880000e+06" 159 127 159 173 rr_6e5k 2
31 "spec=NOESY, no=366, id=362, vol=4.740000e+06" 162 127 162 173 rr_6e5k 2
32 "spec=NOESY, no=367, id=363, vol=4.700000e+06" 164 127 164 173 rr_6e5k 2
33 "spec=NOESY, no=370, id=366, vol=4.690000e+06" 176 127 176 173 rr_6e5k 2
34 "spec=NOESY, no=376, id=372, vol=4.570000e+06" 178 127 178 173 rr_6e5k 2
35 "spec=NOESY, no=386, id=382, vol=4.370000e+06" 185 127 185 173 rr_6e5k 2
36 "spec=NOESY, no=396, id=391, vol=4.190000e+06" 189 127 189 173 rr_6e5k 2
37 "spec=NOESY, no=413, id=408, vol=3.730000e+06" 198 127 198 173 rr_6e5k 2
38 "spec=NOESY, no=450, id=444, vol=2.920000e+06" 204 127 204 173 rr_6e5k 2
39 "spec=NOESY, no=455, id=449, vol=2.730000e+06" 213 127 213 173 rr_6e5k 2
40 "spec=NOESY, no=468, id=461, vol=2.430000e+06" 215 127 215 173 rr_6e5k 2
41 "spec=NOESY, no=469, id=462, vol=2.430000e+06" 217 127 217 173 rr_6e5k 2
42 "spec=NOESY, no=481, id=474, vol=2.280000e+06" 219 127 219 173 rr_6e5k 2
43 "spec=NOESY, no=504, id=497, vol=1.840000e+06" 221 127 221 173 rr_6e5k 2
44 "spec=NOESY, no=522, id=515, vol=1.350000e+06" 227 127 227 173 rr_6e5k 2
45 "spec=NOESY, no=529, id=522, vol=6.390000e+05" 229 127 229 173 rr_6e5k 2
46 "spec=NOESY, no=531, id=524, vol=1.790000e+05" 231 127 231 173 rr_6e5k 2
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 2 1 "Not handling restraint 2, item 10, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 2
2 4 2 1 "Not handling restraint 2, item 11, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 2
3 4 2 1 "Not handling restraint 2, item 12, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 2
4 4 2 1 "Not handling restraint 2, item 13, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 2
5 4 2 1 "Not handling restraint 2, item 2, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 2
6 4 2 1 "Not handling restraint 2, item 3, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 2
7 4 2 1 "Not handling restraint 2, item 4, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 2
8 4 2 1 "Not handling restraint 2, item 5, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
9 4 2 1 "Not handling restraint 2, item 6, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
10 4 2 1 "Not handling restraint 2, item 7, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
11 4 2 1 "Not handling restraint 2, item 8, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 2
12 4 2 1 "Not handling restraint 2, item 9, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 2
13 4 5 1 "Not handling restraint 5, item 2, resonance(s) ' .3.HB12' (nmrStar names) not linked" rr_6e5k 2
14 4 5 1 "Not handling restraint 5, item 3, resonance(s) ' .3.HB11' (nmrStar names) not linked" rr_6e5k 2
15 4 5 1 "Not handling restraint 5, item 4, resonance(s) ' .3.HB13' (nmrStar names) not linked" rr_6e5k 2
16 4 5 1 "Not handling restraint 5, item 5, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
17 4 5 1 "Not handling restraint 5, item 6, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
18 4 5 1 "Not handling restraint 5, item 7, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
19 4 9 1 "Not handling restraint 9, item 3, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 2
20 4 9 1 "Not handling restraint 9, item 4, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 2
21 4 9 1 "Not handling restraint 9, item 5, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 2
22 4 11 1 "Not handling restraint 11, item 10, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 2
23 4 11 1 "Not handling restraint 11, item 11, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 2
24 4 11 1 "Not handling restraint 11, item 12, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 2
25 4 11 1 "Not handling restraint 11, item 13, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 2
26 4 11 1 "Not handling restraint 11, item 14, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 2
27 4 11 1 "Not handling restraint 11, item 15, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 2
28 4 11 1 "Not handling restraint 11, item 16, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 2
29 4 11 1 "Not handling restraint 11, item 17, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 2
30 4 11 1 "Not handling restraint 11, item 18, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 2
31 4 11 1 "Not handling restraint 11, item 19, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 2
32 4 11 1 "Not handling restraint 11, item 2, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 2
33 4 11 1 "Not handling restraint 11, item 20, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
34 4 11 1 "Not handling restraint 11, item 21, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
35 4 11 1 "Not handling restraint 11, item 22, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
36 4 11 1 "Not handling restraint 11, item 23, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
37 4 11 1 "Not handling restraint 11, item 24, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
38 4 11 1 "Not handling restraint 11, item 25, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
39 4 11 1 "Not handling restraint 11, item 3, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 2
40 4 11 1 "Not handling restraint 11, item 4, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 2
41 4 11 1 "Not handling restraint 11, item 5, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 2
42 4 11 1 "Not handling restraint 11, item 6, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 2
43 4 11 1 "Not handling restraint 11, item 7, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 2
44 4 11 1 "Not handling restraint 11, item 8, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 2
45 4 11 1 "Not handling restraint 11, item 9, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 2
46 4 15 1 "Not handling restraint 15, item 10, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 2
47 4 15 1 "Not handling restraint 15, item 11, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 2
48 4 15 1 "Not handling restraint 15, item 12, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 2
49 4 15 1 "Not handling restraint 15, item 13, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 2
50 4 15 1 "Not handling restraint 15, item 2, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 2
51 4 15 1 "Not handling restraint 15, item 3, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 2
52 4 15 1 "Not handling restraint 15, item 4, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 2
53 4 15 1 "Not handling restraint 15, item 5, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
54 4 15 1 "Not handling restraint 15, item 6, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
55 4 15 1 "Not handling restraint 15, item 7, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
56 4 15 1 "Not handling restraint 15, item 8, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 2
57 4 15 1 "Not handling restraint 15, item 9, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 2
58 4 16 1 "Not handling restraint 16, item 10, resonance(s) ' .12.HB23' (nmrStar names) not linked" rr_6e5k 2
59 4 16 1 "Not handling restraint 16, item 2, resonance(s) ' .3.HB12' (nmrStar names) not linked" rr_6e5k 2
60 4 16 1 "Not handling restraint 16, item 3, resonance(s) ' .3.HB11' (nmrStar names) not linked" rr_6e5k 2
61 4 16 1 "Not handling restraint 16, item 4, resonance(s) ' .3.HB13' (nmrStar names) not linked" rr_6e5k 2
62 4 16 1 "Not handling restraint 16, item 5, resonance(s) ' .3.HB22' (nmrStar names) not linked" rr_6e5k 2
63 4 16 1 "Not handling restraint 16, item 6, resonance(s) ' .3.HB21' (nmrStar names) not linked" rr_6e5k 2
64 4 16 1 "Not handling restraint 16, item 7, resonance(s) ' .3.HB23' (nmrStar names) not linked" rr_6e5k 2
65 4 16 1 "Not handling restraint 16, item 8, resonance(s) ' .12.HB22' (nmrStar names) not linked" rr_6e5k 2
66 4 16 1 "Not handling restraint 16, item 9, resonance(s) ' .12.HB21' (nmrStar names) not linked" rr_6e5k 2
67 4 23 1 "Not handling restraint 23, item 3, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 2
68 4 23 1 "Not handling restraint 23, item 4, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 2
69 4 23 1 "Not handling restraint 23, item 5, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 2
70 4 25 1 "Not handling restraint 25, item 10, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 2
71 4 25 1 "Not handling restraint 25, item 11, resonance(s) ' .3.HB12' (nmrStar names) not linked" rr_6e5k 2
72 4 25 1 "Not handling restraint 25, item 12, resonance(s) ' .3.HB11' (nmrStar names) not linked" rr_6e5k 2
73 4 25 1 "Not handling restraint 25, item 13, resonance(s) ' .3.HB13' (nmrStar names) not linked" rr_6e5k 2
74 4 25 1 "Not handling restraint 25, item 2, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 2
75 4 25 1 "Not handling restraint 25, item 3, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 2
76 4 25 1 "Not handling restraint 25, item 4, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 2
77 4 25 1 "Not handling restraint 25, item 5, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 2
78 4 25 1 "Not handling restraint 25, item 6, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 2
79 4 25 1 "Not handling restraint 25, item 7, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 2
80 4 25 1 "Not handling restraint 25, item 8, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 2
81 4 25 1 "Not handling restraint 25, item 9, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 2
82 4 29 1 "Not handling restraint 29, item 3, resonance(s) ' .12.HB12' (nmrStar names) not linked" rr_6e5k 2
83 4 29 1 "Not handling restraint 29, item 4, resonance(s) ' .12.HB11' (nmrStar names) not linked" rr_6e5k 2
84 4 29 1 "Not handling restraint 29, item 5, resonance(s) ' .12.HB13' (nmrStar names) not linked" rr_6e5k 2
85 4 34 1 "Not handling restraint 34, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 2
86 4 34 1 "Not handling restraint 34, item 3, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 2
87 4 34 1 "Not handling restraint 34, item 4, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 2
88 4 34 1 "Not handling restraint 34, item 5, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 2
89 4 34 1 "Not handling restraint 34, item 6, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 2
90 4 34 1 "Not handling restraint 34, item 7, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 2
91 4 43 1 "Not handling restraint 43, item 2, resonance(s) ' .3.HB22' (nmrStar names) not linked" rr_6e5k 2
92 4 43 1 "Not handling restraint 43, item 3, resonance(s) ' .3.HB21' (nmrStar names) not linked" rr_6e5k 2
93 4 43 1 "Not handling restraint 43, item 4, resonance(s) ' .3.HB23' (nmrStar names) not linked" rr_6e5k 2
94 4 43 1 "Not handling restraint 43, item 5, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
95 4 43 1 "Not handling restraint 43, item 6, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
96 4 43 1 "Not handling restraint 43, item 7, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
97 4 46 1 "Not handling restraint 46, item 10, resonance(s) ' .28.HN1' (nmrStar names),' .25.HM3' (nmrStar names) not linked" rr_6e5k 2
98 4 46 1 "Not handling restraint 46, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 2
99 4 46 1 "Not handling restraint 46, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 2
100 4 46 1 "Not handling restraint 46, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 2
101 4 46 1 "Not handling restraint 46, item 5, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 2
102 4 46 1 "Not handling restraint 46, item 6, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 2
103 4 46 1 "Not handling restraint 46, item 7, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 2
104 4 46 1 "Not handling restraint 46, item 8, resonance(s) ' .28.HN1' (nmrStar names),' .25.HM1' (nmrStar names) not linked" rr_6e5k 2
105 4 46 1 "Not handling restraint 46, item 9, resonance(s) ' .28.HN1' (nmrStar names),' .25.HM2' (nmrStar names) not linked" rr_6e5k 2
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_6e5k
_Gen_dist_constraint_list.ID 2
_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_6e5k 3
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 ABA H H . . . 1 1 2 2 ASP O O . . . . . 1.9 1.8 2.0 . . . . . A . 6 AIB H . . A . 2 ASP O . . . 6 . HN . . . . . 2 . O . . rr_6e5k 3
2 1 . . 1 1 2 2 ASP O O . . . 1 1 6 6 ABA N N . . . . . 2.9 2.7 3.1 . . . . . A . 2 ASP O . . A . 6 AIB N . . . 2 . O . . . . . 6 . N . . rr_6e5k 3
3 1 . . 1 1 7 7 LEU H H . . . 1 1 3 3 ABA O O . . . . . 1.9 1.8 2.0 . . . . . A . 7 LEU H . . A . 3 AIB O . . . 7 . HN . . . . . 3 . O . . rr_6e5k 3
4 1 . . 1 1 3 3 ABA O O . . . 1 1 7 7 LEU N N . . . . . 2.9 2.7 3.1 . . . . . A . 3 AIB O . . A . 7 LEU N . . . 3 . O . . . . . 7 . N . . rr_6e5k 3
5 1 . . 1 1 8 8 LYS H H . . . 1 1 4 4 CYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 8 LYS H . . A . 4 CYS O . . . 8 . HN . . . . . 4 . O . . rr_6e5k 3
6 1 . . 1 1 4 4 CYS O O . . . 1 1 8 8 LYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 4 CYS O . . A . 8 LYS N . . . 4 . O . . . . . 8 . N . . rr_6e5k 3
7 1 . . 1 1 9 9 ABA H H . . . 1 1 5 5 LYS O O . . . . . 1.9 1.8 2.0 . . . . . A . 9 AIB H . . A . 5 LYS O . . . 9 . HN . . . . . 5 . O . . rr_6e5k 3
8 1 . . 1 1 5 5 LYS O O . . . 1 1 9 9 ABA N N . . . . . 2.9 2.7 3.1 . . . . . A . 5 LYS O . . A . 9 AIB N . . . 5 . O . . . . . 9 . N . . rr_6e5k 3
9 1 . . 1 1 10 10 ARG H H . . . 1 1 6 6 ABA O O . . . . . 1.9 1.8 2.0 . . . . . A . 10 ARG H . . A . 6 AIB O . . . 10 . HN . . . . . 6 . O . . rr_6e5k 3
10 1 . . 1 1 6 6 ABA O O . . . 1 1 10 10 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 6 AIB O . . A . 10 ARG N . . . 6 . O . . . . . 10 . N . . rr_6e5k 3
11 1 . . 1 1 11 11 TYR H H . . . 1 1 7 7 LEU O O . . . . . 1.9 1.8 2.0 . . . . . A . 11 TYR H . . A . 7 LEU O . . . 11 . HN . . . . . 7 . O . . rr_6e5k 3
12 1 . . 1 1 7 7 LEU O O . . . 1 1 11 11 TYR N N . . . . . 2.9 2.7 3.1 . . . . . A . 7 LEU O . . A . 11 TYR N . . . 7 . O . . . . . 11 . N . . rr_6e5k 3
13 1 . . 1 1 14 14 CYS H H . . . 1 1 11 11 TYR O O . . . . . 1.9 1.8 2.0 . . . . . A . 14 CYS H . . A . 11 TYR O . . . 14 . HN . . . . . 11 . O . . rr_6e5k 3
14 1 . . 1 1 11 11 TYR O O . . . 1 1 14 14 CYS N N . . . . . 2.9 2.7 3.1 . . . . . A . 11 TYR O . . A . 14 CYS N . . . 11 . O . . . . . 14 . N . . rr_6e5k 3
15 1 . . 1 1 22 22 ARG H H . . . 1 1 19 19 ASP O O . . . . . 1.9 1.8 2.0 . . . . . A . 22 ARG H . . A . 19 ASP O . . . 22 . HN . . . . . 19 . O . . rr_6e5k 3
16 1 . . 1 1 19 19 ASP O O . . . 1 1 22 22 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 19 ASP O . . A . 22 ARG N . . . 19 . O . . . . . 22 . N . . rr_6e5k 3
17 1 . . 1 1 19 19 ASP H H . . . 1 1 22 22 ARG O O . . . . . 1.9 1.8 2.0 . . . . . A . 19 ASP H . . A . 22 ARG O . . . 19 . HN . . . . . 22 . O . . rr_6e5k 3
18 1 . . 1 1 22 22 ARG O O . . . 1 1 19 19 ASP N N . . . . . 2.9 2.7 3.1 . . . . . A . 22 ARG O . . A . 19 ASP N . . . 22 . O . . . . . 19 . N . . rr_6e5k 3
19 1 . . 1 1 24 24 GLU H H . . . 1 1 17 17 ARG O O . . . . . 1.9 1.8 2.0 . . . . . A . 24 GLU H . . A . 17 ARG O . . . 24 . HN . . . . . 17 . O . . rr_6e5k 3
20 1 . . 1 1 17 17 ARG O O . . . 1 1 24 24 GLU N N . . . . . 2.9 2.7 3.1 . . . . . A . 17 ARG O . . A . 24 GLU N . . . 17 . O . . . . . 24 . N . . rr_6e5k 3
21 1 . . 1 1 17 17 ARG H H . . . 1 1 24 24 GLU O O . . . . . 1.9 1.8 2.0 . . . . . A . 17 ARG H . . A . 24 GLU O . . . 17 . HN . . . . . 24 . O . . rr_6e5k 3
22 1 . . 1 1 24 24 GLU O O . . . 1 1 17 17 ARG N N . . . . . 2.9 2.7 3.1 . . . . . A . 24 GLU O . . A . 17 ARG N . . . 24 . O . . . . . 17 . N . . rr_6e5k 3
23 1 . . 1 1 26 26 HIS H H . . . 1 1 15 15 GLU O O . . . . . 1.9 1.8 2.0 . . . . . A . 26 HIS H . . A . 15 GLU O . . . 26 . HN . . . . . 15 . O . . rr_6e5k 3
24 1 . . 1 1 15 15 GLU O O . . . 1 1 26 26 HIS N N . . . . . 2.9 2.7 3.1 . . . . . A . 15 GLU O . . A . 26 HIS N . . . 15 . O . . . . . 26 . N . . rr_6e5k 3
25 1 . . 1 1 15 15 GLU H H . . . 1 1 26 26 HIS O O . . . . . 1.9 1.8 2.0 . . . . . A . 15 GLU H . . A . 26 HIS O . . . 15 . HN . . . . . 26 . O . . rr_6e5k 3
26 1 . . 1 1 26 26 HIS O O . . . 1 1 15 15 GLU N N . . . . . 2.9 2.7 3.1 . . . . . A . 26 HIS O . . A . 15 GLU N . . . 26 . O . . . . . 15 . N . . rr_6e5k 3
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 helix 2 1 2 7 rr_6e5k 3
2 "helix to hairpin turn" 15 1 15 23 rr_6e5k 3
3 hairpin 18 1 18 9 rr_6e5k 3
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 "# Restraints file 2: wsh2006_hbonds_v2.tbl" 1 1 1 42 rr_6e5k 3
stop_
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Sf_framecode CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Entry_ID rr_6e5k
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Details "Generated by Wattos"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
loop_
_Distance_constraint_software.Software_ID
_Distance_constraint_software.Software_label
_Distance_constraint_software.Method_ID
_Distance_constraint_software.Method_label
_Distance_constraint_software.Entry_ID
_Distance_constraint_software.Distance_constraint_list_ID
. . . . rr_6e5k 1
stop_
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . rr_6e5k 1
2 1 . . . rr_6e5k 1
3 1 . . . rr_6e5k 1
4 1 . . . rr_6e5k 1
5 1 . . . rr_6e5k 1
6 1 . . . rr_6e5k 1
7 1 . . . rr_6e5k 1
8 1 . . . rr_6e5k 1
9 1 . . . rr_6e5k 1
10 1 . . . rr_6e5k 1
11 1 . . . rr_6e5k 1
12 1 . . . rr_6e5k 1
13 1 . . . rr_6e5k 1
14 1 . . . rr_6e5k 1
15 1 . . . rr_6e5k 1
16 1 2 . OR rr_6e5k 1
16 2 . 3 . rr_6e5k 1
16 3 . 4 . rr_6e5k 1
16 4 . 5 . rr_6e5k 1
16 5 . . . rr_6e5k 1
17 1 2 . OR rr_6e5k 1
17 2 . 3 . rr_6e5k 1
17 3 . 4 . rr_6e5k 1
17 4 . 5 . rr_6e5k 1
17 5 . . . rr_6e5k 1
18 1 . . . rr_6e5k 1
19 1 . . . rr_6e5k 1
20 1 . . . rr_6e5k 1
21 1 2 . OR rr_6e5k 1
21 2 . 3 . rr_6e5k 1
21 3 . . . rr_6e5k 1
22 1 . . . rr_6e5k 1
23 1 . . . rr_6e5k 1
24 1 . . . rr_6e5k 1
25 1 . . . rr_6e5k 1
26 1 . . . rr_6e5k 1
27 1 . . . rr_6e5k 1
28 1 . . . rr_6e5k 1
29 1 . . . rr_6e5k 1
30 1 . . . rr_6e5k 1
31 1 . . . rr_6e5k 1
32 1 . . . rr_6e5k 1
33 1 . . . rr_6e5k 1
34 1 2 . OR rr_6e5k 1
34 2 . 3 . rr_6e5k 1
34 3 . . . rr_6e5k 1
35 1 . . . rr_6e5k 1
36 1 . . . rr_6e5k 1
37 1 . . . rr_6e5k 1
38 1 2 . OR rr_6e5k 1
38 2 . 3 . rr_6e5k 1
38 3 . . . rr_6e5k 1
39 1 2 . OR rr_6e5k 1
39 2 . 3 . rr_6e5k 1
39 3 . 4 . rr_6e5k 1
39 4 . 5 . rr_6e5k 1
39 5 . . . rr_6e5k 1
40 1 2 . OR rr_6e5k 1
40 2 . 3 . rr_6e5k 1
40 3 . . . rr_6e5k 1
41 1 2 . OR rr_6e5k 1
41 2 . 3 . rr_6e5k 1
41 3 . . . rr_6e5k 1
42 1 2 . OR rr_6e5k 1
42 2 . 3 . rr_6e5k 1
42 3 . . . rr_6e5k 1
43 1 2 . OR rr_6e5k 1
43 2 . 3 . rr_6e5k 1
43 3 . . . rr_6e5k 1
44 1 . . . rr_6e5k 1
45 1 . . . rr_6e5k 1
46 1 . . . rr_6e5k 1
47 1 . . . rr_6e5k 1
48 1 2 . OR rr_6e5k 1
48 2 . 3 . rr_6e5k 1
48 3 . . . rr_6e5k 1
49 1 . . . rr_6e5k 1
50 1 . . . rr_6e5k 1
51 1 2 . OR rr_6e5k 1
51 2 . 3 . rr_6e5k 1
51 3 . . . rr_6e5k 1
52 1 2 . OR rr_6e5k 1
52 2 . 3 . rr_6e5k 1
52 3 . . . rr_6e5k 1
53 1 2 . OR rr_6e5k 1
53 2 . 3 . rr_6e5k 1
53 3 . . . rr_6e5k 1
54 1 . . . rr_6e5k 1
55 1 2 . OR rr_6e5k 1
55 2 . 3 . rr_6e5k 1
55 3 . . . rr_6e5k 1
56 1 . . . rr_6e5k 1
57 1 . . . rr_6e5k 1
58 1 2 . OR rr_6e5k 1
58 2 . 3 . rr_6e5k 1
58 3 . . . rr_6e5k 1
59 1 2 . OR rr_6e5k 1
59 2 . 3 . rr_6e5k 1
59 3 . . . rr_6e5k 1
60 1 . . . rr_6e5k 1
61 1 . . . rr_6e5k 1
62 1 2 . OR rr_6e5k 1
62 2 . 3 . rr_6e5k 1
62 3 . 4 . rr_6e5k 1
62 4 . 5 . rr_6e5k 1
62 5 . . . rr_6e5k 1
63 1 . . . rr_6e5k 1
64 1 2 . OR rr_6e5k 1
64 2 . 3 . rr_6e5k 1
64 3 . . . rr_6e5k 1
65 1 . . . rr_6e5k 1
66 1 . . . rr_6e5k 1
67 1 . . . rr_6e5k 1
68 1 . . . rr_6e5k 1
69 1 . . . rr_6e5k 1
70 1 . . . rr_6e5k 1
71 1 2 . OR rr_6e5k 1
71 2 . 3 . rr_6e5k 1
71 3 . 4 . rr_6e5k 1
71 4 . 5 . rr_6e5k 1
71 5 . . . rr_6e5k 1
72 1 . . . rr_6e5k 1
73 1 . . . rr_6e5k 1
74 1 . . . rr_6e5k 1
75 1 . . . rr_6e5k 1
76 1 2 . OR rr_6e5k 1
76 2 . 3 . rr_6e5k 1
76 3 . . . rr_6e5k 1
77 1 . . . rr_6e5k 1
78 1 . . . rr_6e5k 1
79 1 . . . rr_6e5k 1
80 1 . . . rr_6e5k 1
81 1 2 . OR rr_6e5k 1
81 2 . 3 . rr_6e5k 1
81 3 . . . rr_6e5k 1
82 1 . . . rr_6e5k 1
83 1 . . . rr_6e5k 1
84 1 . . . rr_6e5k 1
85 1 . . . rr_6e5k 1
86 1 . . . rr_6e5k 1
87 1 . . . rr_6e5k 1
88 1 . . . rr_6e5k 1
89 1 . . . rr_6e5k 1
90 1 . . . rr_6e5k 1
91 1 . . . rr_6e5k 1
92 1 . . . rr_6e5k 1
93 1 . . . rr_6e5k 1
94 1 . . . rr_6e5k 1
95 1 . . . rr_6e5k 1
96 1 . . . rr_6e5k 1
97 1 . . . rr_6e5k 1
98 1 . . . rr_6e5k 1
99 1 . . . rr_6e5k 1
100 1 . . . rr_6e5k 1
101 1 . . . rr_6e5k 1
102 1 . . . rr_6e5k 1
103 1 . . . rr_6e5k 1
104 1 . . . rr_6e5k 1
105 1 . . . rr_6e5k 1
106 1 2 . OR rr_6e5k 1
106 2 . 3 . rr_6e5k 1
106 3 . 4 . rr_6e5k 1
106 4 . 5 . rr_6e5k 1
106 5 . . . rr_6e5k 1
107 1 . . . rr_6e5k 1
108 1 . . . rr_6e5k 1
109 1 . . . rr_6e5k 1
110 1 . . . rr_6e5k 1
111 1 . . . rr_6e5k 1
112 1 . . . rr_6e5k 1
113 1 . . . rr_6e5k 1
114 1 . . . rr_6e5k 1
115 1 2 . OR rr_6e5k 1
115 2 . 3 . rr_6e5k 1
115 3 . . . rr_6e5k 1
116 1 . . . rr_6e5k 1
117 1 . . . rr_6e5k 1
118 1 2 . OR rr_6e5k 1
118 2 . 3 . rr_6e5k 1
118 3 . . . rr_6e5k 1
119 1 . . . rr_6e5k 1
120 1 . . . rr_6e5k 1
121 1 . . . rr_6e5k 1
122 1 2 . OR rr_6e5k 1
122 2 . 3 . rr_6e5k 1
122 3 . . . rr_6e5k 1
123 1 . . . rr_6e5k 1
124 1 . . . rr_6e5k 1
125 1 2 . OR rr_6e5k 1
125 2 . 3 . rr_6e5k 1
125 3 . . . rr_6e5k 1
126 1 . . . rr_6e5k 1
127 1 . . . rr_6e5k 1
128 1 . . . rr_6e5k 1
129 1 2 . OR rr_6e5k 1
129 2 . 3 . rr_6e5k 1
129 3 . . . rr_6e5k 1
130 1 . . . rr_6e5k 1
131 1 2 . OR rr_6e5k 1
131 2 . 3 . rr_6e5k 1
131 3 . . . rr_6e5k 1
132 1 . . . rr_6e5k 1
133 1 . . . rr_6e5k 1
134 1 . . . rr_6e5k 1
135 1 2 . OR rr_6e5k 1
135 2 . 3 . rr_6e5k 1
135 3 . . . rr_6e5k 1
136 1 . . . rr_6e5k 1
137 1 . . . rr_6e5k 1
138 1 . . . rr_6e5k 1
139 1 2 . OR rr_6e5k 1
139 2 . 3 . rr_6e5k 1
139 3 . . . rr_6e5k 1
140 1 . . . rr_6e5k 1
141 1 2 . OR rr_6e5k 1
141 2 . 3 . rr_6e5k 1
141 3 . . . rr_6e5k 1
142 1 . . . rr_6e5k 1
143 1 2 . OR rr_6e5k 1
143 2 . 3 . rr_6e5k 1
143 3 . . . rr_6e5k 1
144 1 . . . rr_6e5k 1
145 1 . . . rr_6e5k 1
146 1 2 . OR rr_6e5k 1
146 2 . 3 . rr_6e5k 1
146 3 . . . rr_6e5k 1
147 1 2 . OR rr_6e5k 1
147 2 . 3 . rr_6e5k 1
147 3 . . . rr_6e5k 1
148 1 . . . rr_6e5k 1
149 1 . . . rr_6e5k 1
150 1 . . . rr_6e5k 1
151 1 . . . rr_6e5k 1
152 1 2 . OR rr_6e5k 1
152 2 . 3 . rr_6e5k 1
152 3 . . . rr_6e5k 1
153 1 . . . rr_6e5k 1
154 1 . . . rr_6e5k 1
155 1 2 . OR rr_6e5k 1
155 2 . 3 . rr_6e5k 1
155 3 . . . rr_6e5k 1
156 1 . . . rr_6e5k 1
157 1 . . . rr_6e5k 1
158 1 . . . rr_6e5k 1
159 1 . . . rr_6e5k 1
160 1 . . . rr_6e5k 1
161 1 . . . rr_6e5k 1
162 1 . . . rr_6e5k 1
163 1 . . . rr_6e5k 1
164 1 2 . OR rr_6e5k 1
164 2 . 3 . rr_6e5k 1
164 3 . . . rr_6e5k 1
165 1 . . . rr_6e5k 1
166 1 . . . rr_6e5k 1
167 1 . . . rr_6e5k 1
168 1 . . . rr_6e5k 1
169 1 2 . OR rr_6e5k 1
169 2 . 3 . rr_6e5k 1
169 3 . . . rr_6e5k 1
170 1 . . . rr_6e5k 1
171 1 . . . rr_6e5k 1
172 1 . . . rr_6e5k 1
173 1 . . . rr_6e5k 1
174 1 . . . rr_6e5k 1
175 1 . . . rr_6e5k 1
176 1 . . . rr_6e5k 1
177 1 2 . OR rr_6e5k 1
177 2 . 3 . rr_6e5k 1
177 3 . . . rr_6e5k 1
178 1 . . . rr_6e5k 1
179 1 . . . rr_6e5k 1
180 1 . . . rr_6e5k 1
181 1 2 . OR rr_6e5k 1
181 2 . 3 . rr_6e5k 1
181 3 . . . rr_6e5k 1
182 1 2 . OR rr_6e5k 1
182 2 . 3 . rr_6e5k 1
182 3 . . . rr_6e5k 1
183 1 . . . rr_6e5k 1
184 1 . . . rr_6e5k 1
185 1 . . . rr_6e5k 1
186 1 . . . rr_6e5k 1
187 1 . . . rr_6e5k 1
188 1 . . . rr_6e5k 1
189 1 . . . rr_6e5k 1
190 1 . . . rr_6e5k 1
191 1 . . . rr_6e5k 1
192 1 . . . rr_6e5k 1
193 1 . . . rr_6e5k 1
194 1 . . . rr_6e5k 1
195 1 . . . rr_6e5k 1
196 1 . . . rr_6e5k 1
197 1 . . . rr_6e5k 1
198 1 . . . rr_6e5k 1
199 1 . . . rr_6e5k 1
200 1 2 . OR rr_6e5k 1
200 2 . 3 . rr_6e5k 1
200 3 . . . rr_6e5k 1
201 1 . . . rr_6e5k 1
202 1 . . . rr_6e5k 1
203 1 . . . rr_6e5k 1
204 1 . . . rr_6e5k 1
205 1 2 . OR rr_6e5k 1
205 2 . 3 . rr_6e5k 1
205 3 . . . rr_6e5k 1
206 1 . . . rr_6e5k 1
207 1 . . . rr_6e5k 1
208 1 . . . rr_6e5k 1
209 1 . . . rr_6e5k 1
210 1 . . . rr_6e5k 1
211 1 . . . rr_6e5k 1
212 1 2 . OR rr_6e5k 1
212 2 . 3 . rr_6e5k 1
212 3 . . . rr_6e5k 1
213 1 . . . rr_6e5k 1
214 1 2 . OR rr_6e5k 1
214 2 . 3 . rr_6e5k 1
214 3 . . . rr_6e5k 1
215 1 . . . rr_6e5k 1
216 1 2 . OR rr_6e5k 1
216 2 . 3 . rr_6e5k 1
216 3 . . . rr_6e5k 1
217 1 . . . rr_6e5k 1
218 1 . . . rr_6e5k 1
219 1 . . . rr_6e5k 1
220 1 2 . OR rr_6e5k 1
220 2 . 3 . rr_6e5k 1
220 3 . . . rr_6e5k 1
221 1 . . . rr_6e5k 1
222 1 . . . rr_6e5k 1
223 1 2 . OR rr_6e5k 1
223 2 . 3 . rr_6e5k 1
223 3 . . . rr_6e5k 1
224 1 2 . OR rr_6e5k 1
224 2 . 3 . rr_6e5k 1
224 3 . . . rr_6e5k 1
225 1 . . . rr_6e5k 1
226 1 2 . OR rr_6e5k 1
226 2 . 3 . rr_6e5k 1
226 3 . . . rr_6e5k 1
227 1 . . . rr_6e5k 1
228 1 2 . OR rr_6e5k 1
228 2 . 3 . rr_6e5k 1
228 3 . . . rr_6e5k 1
229 1 2 . OR rr_6e5k 1
229 2 . 3 . rr_6e5k 1
229 3 . . . rr_6e5k 1
230 1 . . . rr_6e5k 1
231 1 . . . rr_6e5k 1
232 1 . . . rr_6e5k 1
233 1 2 . OR rr_6e5k 1
233 2 . 3 . rr_6e5k 1
233 3 . . . rr_6e5k 1
234 1 . . . rr_6e5k 1
235 1 . . . rr_6e5k 1
236 1 . . . rr_6e5k 1
237 1 . . . rr_6e5k 1
238 1 . . . rr_6e5k 1
239 1 . . . rr_6e5k 1
240 1 . . . rr_6e5k 1
241 1 . . . rr_6e5k 1
242 1 2 . OR rr_6e5k 1
242 2 . 3 . rr_6e5k 1
242 3 . 4 . rr_6e5k 1
242 4 . 5 . rr_6e5k 1
242 5 . . . rr_6e5k 1
243 1 . . . rr_6e5k 1
244 1 2 . OR rr_6e5k 1
244 2 . 3 . rr_6e5k 1
244 3 . . . rr_6e5k 1
245 1 . . . rr_6e5k 1
246 1 . . . rr_6e5k 1
247 1 2 . OR rr_6e5k 1
247 2 . 3 . rr_6e5k 1
247 3 . . . rr_6e5k 1
248 1 . . . rr_6e5k 1
249 1 . . . rr_6e5k 1
250 1 2 . OR rr_6e5k 1
250 2 . 3 . rr_6e5k 1
250 3 . . . rr_6e5k 1
251 1 . . . rr_6e5k 1
252 1 . . . rr_6e5k 1
253 1 . . . rr_6e5k 1
254 1 . . . rr_6e5k 1
255 1 2 . OR rr_6e5k 1
255 2 . 3 . rr_6e5k 1
255 3 . . . rr_6e5k 1
256 1 . . . rr_6e5k 1
257 1 . . . rr_6e5k 1
258 1 2 . OR rr_6e5k 1
258 2 . 3 . rr_6e5k 1
258 3 . . . rr_6e5k 1
259 1 . . . rr_6e5k 1
260 1 . . . rr_6e5k 1
261 1 . . . rr_6e5k 1
262 1 . . . rr_6e5k 1
263 1 2 . OR rr_6e5k 1
263 2 . 3 . rr_6e5k 1
263 3 . . . rr_6e5k 1
264 1 . . . rr_6e5k 1
265 1 2 . OR rr_6e5k 1
265 2 . 3 . rr_6e5k 1
265 3 . . . rr_6e5k 1
266 1 2 . OR rr_6e5k 1
266 2 . 3 . rr_6e5k 1
266 3 . . . rr_6e5k 1
267 1 . . . rr_6e5k 1
268 1 . . . rr_6e5k 1
269 1 . . . rr_6e5k 1
270 1 . . . rr_6e5k 1
271 1 . . . rr_6e5k 1
272 1 . . . rr_6e5k 1
273 1 . . . rr_6e5k 1
274 1 2 . OR rr_6e5k 1
274 2 . 3 . rr_6e5k 1
274 3 . . . rr_6e5k 1
275 1 . . . rr_6e5k 1
276 1 2 . OR rr_6e5k 1
276 2 . 3 . rr_6e5k 1
276 3 . . . rr_6e5k 1
277 1 . . . rr_6e5k 1
278 1 . . . rr_6e5k 1
279 1 . . . rr_6e5k 1
280 1 . . . rr_6e5k 1
281 1 . . . rr_6e5k 1
282 1 . . . rr_6e5k 1
283 1 . . . rr_6e5k 1
284 1 . . . rr_6e5k 1
285 1 2 . OR rr_6e5k 1
285 2 . 3 . rr_6e5k 1
285 3 . . . rr_6e5k 1
286 1 2 . OR rr_6e5k 1
286 2 . 3 . rr_6e5k 1
286 3 . . . rr_6e5k 1
287 1 . . . rr_6e5k 1
288 1 . . . rr_6e5k 1
289 1 2 . OR rr_6e5k 1
289 2 . 3 . rr_6e5k 1
289 3 . . . rr_6e5k 1
290 1 . . . rr_6e5k 1
291 1 . . . rr_6e5k 1
292 1 . . . rr_6e5k 1
293 1 . . . rr_6e5k 1
294 1 . . . rr_6e5k 1
295 1 . . . rr_6e5k 1
296 1 . . . rr_6e5k 1
297 1 . . . rr_6e5k 1
298 1 2 . OR rr_6e5k 1
298 2 . 3 . rr_6e5k 1
298 3 . . . rr_6e5k 1
299 1 . . . rr_6e5k 1
300 1 2 . OR rr_6e5k 1
300 2 . 3 . rr_6e5k 1
300 3 . . . rr_6e5k 1
301 1 . . . rr_6e5k 1
302 1 . . . rr_6e5k 1
303 1 2 . OR rr_6e5k 1
303 2 . 3 . rr_6e5k 1
303 3 . . . rr_6e5k 1
304 1 2 . OR rr_6e5k 1
304 2 . 3 . rr_6e5k 1
304 3 . . . rr_6e5k 1
305 1 . . . rr_6e5k 1
306 1 2 . OR rr_6e5k 1
306 2 . 3 . rr_6e5k 1
306 3 . . . rr_6e5k 1
307 1 . . . rr_6e5k 1
308 1 . . . rr_6e5k 1
309 1 . . . rr_6e5k 1
310 1 2 . OR rr_6e5k 1
310 2 . 3 . rr_6e5k 1
310 3 . . . rr_6e5k 1
311 1 . . . rr_6e5k 1
312 1 2 . OR rr_6e5k 1
312 2 . 3 . rr_6e5k 1
312 3 . . . rr_6e5k 1
313 1 . . . rr_6e5k 1
314 1 . . . rr_6e5k 1
315 1 . . . rr_6e5k 1
316 1 2 . OR rr_6e5k 1
316 2 . 3 . rr_6e5k 1
316 3 . . . rr_6e5k 1
317 1 . . . rr_6e5k 1
318 1 . . . rr_6e5k 1
319 1 . . . rr_6e5k 1
320 1 . . . rr_6e5k 1
321 1 . . . rr_6e5k 1
322 1 2 . OR rr_6e5k 1
322 2 . 3 . rr_6e5k 1
322 3 . . . rr_6e5k 1
323 1 . . . rr_6e5k 1
324 1 2 . OR rr_6e5k 1
324 2 . 3 . rr_6e5k 1
324 3 . 4 . rr_6e5k 1
324 4 . 5 . rr_6e5k 1
324 5 . . . rr_6e5k 1
325 1 . . . rr_6e5k 1
326 1 . . . rr_6e5k 1
327 1 . . . rr_6e5k 1
328 1 . . . rr_6e5k 1
329 1 . . . rr_6e5k 1
330 1 . . . rr_6e5k 1
331 1 . . . rr_6e5k 1
332 1 2 . OR rr_6e5k 1
332 2 . 3 . rr_6e5k 1
332 3 . . . rr_6e5k 1
333 1 . . . rr_6e5k 1
334 1 2 . OR rr_6e5k 1
334 2 . 3 . rr_6e5k 1
334 3 . . . rr_6e5k 1
335 1 . . . rr_6e5k 1
336 1 . . . rr_6e5k 1
337 1 . . . rr_6e5k 1
338 1 . . . rr_6e5k 1
339 1 . . . rr_6e5k 1
340 1 2 . OR rr_6e5k 1
340 2 . 3 . rr_6e5k 1
340 3 . . . rr_6e5k 1
341 1 . . . rr_6e5k 1
342 1 . . . rr_6e5k 1
343 1 . . . rr_6e5k 1
344 1 . . . rr_6e5k 1
345 1 . . . rr_6e5k 1
346 1 . . . rr_6e5k 1
347 1 . . . rr_6e5k 1
348 1 2 . OR rr_6e5k 1
348 2 . 3 . rr_6e5k 1
348 3 . . . rr_6e5k 1
349 1 . . . rr_6e5k 1
350 1 2 . OR rr_6e5k 1
350 2 . 3 . rr_6e5k 1
350 3 . . . rr_6e5k 1
351 1 2 . OR rr_6e5k 1
351 2 . 3 . rr_6e5k 1
351 3 . . . rr_6e5k 1
352 1 . . . rr_6e5k 1
353 1 . . . rr_6e5k 1
354 1 . . . rr_6e5k 1
355 1 . . . rr_6e5k 1
356 1 2 . OR rr_6e5k 1
356 2 . 3 . rr_6e5k 1
356 3 . . . rr_6e5k 1
357 1 . . . rr_6e5k 1
358 1 . . . rr_6e5k 1
359 1 . . . rr_6e5k 1
360 1 2 . OR rr_6e5k 1
360 2 . 3 . rr_6e5k 1
360 3 . . . rr_6e5k 1
361 1 . . . rr_6e5k 1
362 1 . . . rr_6e5k 1
363 1 2 . OR rr_6e5k 1
363 2 . 3 . rr_6e5k 1
363 3 . . . rr_6e5k 1
364 1 . . . rr_6e5k 1
365 1 2 . OR rr_6e5k 1
365 2 . 3 . rr_6e5k 1
365 3 . . . rr_6e5k 1
366 1 . . . rr_6e5k 1
367 1 . . . rr_6e5k 1
368 1 . . . rr_6e5k 1
369 1 . . . rr_6e5k 1
370 1 . . . rr_6e5k 1
371 1 2 . OR rr_6e5k 1
371 2 . 3 . rr_6e5k 1
371 3 . . . rr_6e5k 1
372 1 2 . OR rr_6e5k 1
372 2 . 3 . rr_6e5k 1
372 3 . . . rr_6e5k 1
373 1 2 . OR rr_6e5k 1
373 2 . 3 . rr_6e5k 1
373 3 . . . rr_6e5k 1
374 1 . . . rr_6e5k 1
375 1 . . . rr_6e5k 1
376 1 . . . rr_6e5k 1
377 1 2 . OR rr_6e5k 1
377 2 . 3 . rr_6e5k 1
377 3 . . . rr_6e5k 1
378 1 . . . rr_6e5k 1
379 1 . . . rr_6e5k 1
380 1 . . . rr_6e5k 1
381 1 2 . OR rr_6e5k 1
381 2 . 3 . rr_6e5k 1
381 3 . . . rr_6e5k 1
382 1 . . . rr_6e5k 1
383 1 . . . rr_6e5k 1
384 1 . . . rr_6e5k 1
385 1 . . . rr_6e5k 1
386 1 2 . OR rr_6e5k 1
386 2 . 3 . rr_6e5k 1
386 3 . . . rr_6e5k 1
387 1 2 . OR rr_6e5k 1
387 2 . 3 . rr_6e5k 1
387 3 . . . rr_6e5k 1
388 1 . . . rr_6e5k 1
389 1 . . . rr_6e5k 1
390 1 . . . rr_6e5k 1
391 1 . . . rr_6e5k 1
392 1 . . . rr_6e5k 1
393 1 2 . OR rr_6e5k 1
393 2 . 3 . rr_6e5k 1
393 3 . . . rr_6e5k 1
394 1 . . . rr_6e5k 1
395 1 2 . OR rr_6e5k 1
395 2 . 3 . rr_6e5k 1
395 3 . . . rr_6e5k 1
396 1 . . . rr_6e5k 1
397 1 2 . OR rr_6e5k 1
397 2 . 3 . rr_6e5k 1
397 3 . . . rr_6e5k 1
398 1 2 . OR rr_6e5k 1
398 2 . 3 . rr_6e5k 1
398 3 . . . rr_6e5k 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Contribution_fractional_val
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Atom_type
_Dist_constraint.Atom_isotope_number
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_entity_assembly_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 . 1 . 1 1 4 4 CYS HB2 H . . . . 4 . HB1 rr_6e5k 1
1 1 . 2 . 1 1 4 4 CYS HB3 H . . . . 4 . HB2 rr_6e5k 1
2 1 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
2 1 . 2 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
3 1 . 1 . 1 1 2 2 ASP HB2 H . . . . 2 . HB1 rr_6e5k 1
3 1 . 2 . 1 1 2 2 ASP HB3 H . . . . 2 . HB2 rr_6e5k 1
4 1 . 1 . 1 1 26 26 HIS HB2 H . . . . 26 . HB1 rr_6e5k 1
4 1 . 2 . 1 1 26 26 HIS HB3 H . . . . 26 . HB2 rr_6e5k 1
5 1 . 1 . 1 1 27 27 CYS HB2 H . . . . 27 . HB1 rr_6e5k 1
5 1 . 2 . 1 1 27 27 CYS HB3 H . . . . 27 . HB2 rr_6e5k 1
6 1 . 1 . 1 1 19 19 ASP HB2 H . . . . 19 . HB1 rr_6e5k 1
6 1 . 2 . 1 1 19 19 ASP HB3 H . . . . 19 . HB2 rr_6e5k 1
7 1 . 1 . 1 1 14 14 CYS HB2 H . . . . 14 . HB1 rr_6e5k 1
7 1 . 2 . 1 1 14 14 CYS HB3 H . . . . 14 . HB2 rr_6e5k 1
8 1 . 1 . 1 1 13 13 GLY HA2 H . . . . 13 . HA1 rr_6e5k 1
8 1 . 2 . 1 1 13 13 GLY HA3 H . . . . 13 . HA2 rr_6e5k 1
9 1 . 1 . 1 1 18 18 CYS HB2 H . . . . 18 . HB1 rr_6e5k 1
9 1 . 2 . 1 1 18 18 CYS HB3 H . . . . 18 . HB2 rr_6e5k 1
10 1 . 1 . 1 1 15 15 GLU HG2 H . . . . 15 . HG1 rr_6e5k 1
10 1 . 2 . 1 1 15 15 GLU HG3 H . . . . 15 . HG2 rr_6e5k 1
11 1 . 1 . 1 1 1 1 ASN HD21 H . . . . 1 . HD21 rr_6e5k 1
11 1 . 2 . 1 1 1 1 ASN HD22 H . . . . 1 . HD22 rr_6e5k 1
12 1 . 1 . 1 1 21 21 PRO HD2 H . . . . 21 . HD1 rr_6e5k 1
12 1 . 2 . 1 1 21 21 PRO HD3 H . . . . 21 . HD2 rr_6e5k 1
13 1 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
13 1 . 2 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
14 1 . 1 . 1 1 20 20 DPR HB2 H . . . . 20 . HB1 rr_6e5k 1
14 1 . 2 . 1 1 20 20 DPR HB3 H . . . . 20 . HB2 rr_6e5k 1
15 1 . 1 . 1 1 20 20 DPR HD2 H . . . . 20 . HD1 rr_6e5k 1
15 1 . 2 . 1 1 20 20 DPR HD3 H . . . . 20 . HD2 rr_6e5k 1
16 2 . 1 . 1 1 22 22 ARG HG2 H . . . . 22 . HG1 rr_6e5k 1
16 2 . 2 . 1 1 22 22 ARG HB3 H . . . . 22 . HB2 rr_6e5k 1
16 3 . 1 . 1 1 22 22 ARG HG2 H . . . . 22 . HG1 rr_6e5k 1
16 3 . 2 . 1 1 22 22 ARG HB2 H . . . . 22 . HB1 rr_6e5k 1
16 4 . 1 . 1 1 22 22 ARG HG3 H . . . . 22 . HG2 rr_6e5k 1
16 4 . 2 . 1 1 22 22 ARG HB2 H . . . . 22 . HB1 rr_6e5k 1
16 5 . 1 . 1 1 22 22 ARG HG3 H . . . . 22 . HG2 rr_6e5k 1
16 5 . 2 . 1 1 22 22 ARG HB3 H . . . . 22 . HB2 rr_6e5k 1
17 2 . 1 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
17 2 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
17 3 . 1 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
17 3 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
17 4 . 1 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
17 4 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
17 5 . 1 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
17 5 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
18 1 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 1
18 1 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 1
19 1 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
19 1 . 2 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 1
20 1 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
20 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
21 2 . 1 . 1 1 15 15 GLU HB2 H . . . . 15 . HB1 rr_6e5k 1
21 2 . 2 . 1 1 15 15 GLU HG2 H . . . . 15 . HG1 rr_6e5k 1
21 3 . 1 . 1 1 15 15 GLU HB3 H . . . . 15 . HB2 rr_6e5k 1
21 3 . 2 . 1 1 15 15 GLU HG2 H . . . . 15 . HG1 rr_6e5k 1
22 1 . 1 . 1 1 25 25 MVA HA H . . . . 25 . HA rr_6e5k 1
22 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
23 1 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_6e5k 1
23 1 . 2 . 1 1 27 27 CYS H H . . . . 27 . HN rr_6e5k 1
24 1 . 1 . 1 1 17 17 ARG HA H . . . . 17 . HA rr_6e5k 1
24 1 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 1
25 1 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
25 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
26 1 . 1 . 1 1 22 22 ARG HA H . . . . 22 . HA rr_6e5k 1
26 1 . 2 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
27 1 . 1 . 1 1 19 19 ASP HA H . . . . 19 . HA rr_6e5k 1
27 1 . 2 . 1 1 20 20 DPR HD3 H . . . . 20 . HD2 rr_6e5k 1
28 1 . 1 . 1 1 20 20 DPR HA H . . . . 20 . HA rr_6e5k 1
28 1 . 2 . 1 1 21 21 PRO HD3 H . . . . 21 . HD2 rr_6e5k 1
29 1 . 1 . 1 1 16 16 MVA HB H . . . . 16 . HB rr_6e5k 1
29 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
30 1 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
30 1 . 2 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
31 1 . 1 . 1 1 16 16 MVA HB H . . . . 16 . HB rr_6e5k 1
31 1 . 2 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
32 1 . 1 . 1 1 14 14 CYS HA H . . . . 14 . HA rr_6e5k 1
32 1 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
33 1 . 1 . 1 1 25 25 MVA HB H . . . . 25 . HB rr_6e5k 1
33 1 . 2 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
34 2 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
34 2 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
34 3 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
34 3 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
35 1 . 1 . 1 1 25 25 MVA HB H . . . . 25 . HB rr_6e5k 1
35 1 . 2 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
36 1 . 1 . 1 1 20 20 DPR HA H . . . . 20 . HA rr_6e5k 1
36 1 . 2 . 1 1 21 21 PRO HD2 H . . . . 21 . HD1 rr_6e5k 1
37 1 . 1 . 1 1 21 21 PRO HG2 H . . . . 21 . HG1 rr_6e5k 1
37 1 . 2 . 1 1 21 21 PRO HB3 H . . . . 21 . HB2 rr_6e5k 1
38 2 . 1 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 1
38 2 . 2 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
38 3 . 1 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 1
38 3 . 2 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
39 2 . 1 . 1 1 5 5 LYS HD2 H . . . . 5 . HD1 rr_6e5k 1
39 2 . 2 . 1 1 5 5 LYS HE3 H . . . . 5 . HE2 rr_6e5k 1
39 3 . 1 . 1 1 5 5 LYS HD2 H . . . . 5 . HD1 rr_6e5k 1
39 3 . 2 . 1 1 5 5 LYS HE2 H . . . . 5 . HE1 rr_6e5k 1
39 4 . 1 . 1 1 5 5 LYS HD3 H . . . . 5 . HD2 rr_6e5k 1
39 4 . 2 . 1 1 5 5 LYS HE2 H . . . . 5 . HE1 rr_6e5k 1
39 5 . 1 . 1 1 5 5 LYS HD3 H . . . . 5 . HD2 rr_6e5k 1
39 5 . 2 . 1 1 5 5 LYS HE3 H . . . . 5 . HE2 rr_6e5k 1
40 2 . 1 . 1 1 15 15 GLU HB2 H . . . . 15 . HB1 rr_6e5k 1
40 2 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
40 3 . 1 . 1 1 15 15 GLU HB3 H . . . . 15 . HB2 rr_6e5k 1
40 3 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
41 2 . 1 . 1 1 5 5 LYS HB2 H . . . . 5 . HB1 rr_6e5k 1
41 2 . 2 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 1
41 3 . 1 . 1 1 5 5 LYS HB3 H . . . . 5 . HB2 rr_6e5k 1
41 3 . 2 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 1
42 2 . 1 . 1 1 15 15 GLU HA H . . . . 15 . HA rr_6e5k 1
42 2 . 2 . 1 1 15 15 GLU HB2 H . . . . 15 . HB1 rr_6e5k 1
42 3 . 1 . 1 1 15 15 GLU HA H . . . . 15 . HA rr_6e5k 1
42 3 . 2 . 1 1 15 15 GLU HB3 H . . . . 15 . HB2 rr_6e5k 1
43 2 . 1 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 1
43 2 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
43 3 . 1 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 1
43 3 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
44 1 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
44 1 . 2 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
45 1 . 1 . 1 1 20 20 DPR HA H . . . . 20 . HA rr_6e5k 1
45 1 . 2 . 1 1 20 20 DPR HB3 H . . . . 20 . HB2 rr_6e5k 1
46 1 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
46 1 . 2 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
47 1 . 1 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 1
47 1 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
48 2 . 1 . 1 1 22 22 ARG HB2 H . . . . 22 . HB1 rr_6e5k 1
48 2 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
48 3 . 1 . 1 1 22 22 ARG HB3 H . . . . 22 . HB2 rr_6e5k 1
48 3 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
49 1 . 1 . 1 1 21 21 PRO HA H . . . . 21 . HA rr_6e5k 1
49 1 . 2 . 1 1 21 21 PRO HB3 H . . . . 21 . HB2 rr_6e5k 1
50 1 . 1 . 1 1 13 13 GLY HA2 H . . . . 13 . HA1 rr_6e5k 1
50 1 . 2 . 1 1 13 13 GLY H H . . . . 13 . HN rr_6e5k 1
51 2 . 1 . 1 1 22 22 ARG HA H . . . . 22 . HA rr_6e5k 1
51 2 . 2 . 1 1 22 22 ARG HB2 H . . . . 22 . HB1 rr_6e5k 1
51 3 . 1 . 1 1 22 22 ARG HA H . . . . 22 . HA rr_6e5k 1
51 3 . 2 . 1 1 22 22 ARG HB3 H . . . . 22 . HB2 rr_6e5k 1
52 2 . 1 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
52 2 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
52 3 . 1 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
52 3 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
53 2 . 1 . 1 1 24 24 GLU HB2 H . . . . 24 . HB1 rr_6e5k 1
53 2 . 2 . 1 1 24 24 GLU HG2 H . . . . 24 . HG1 rr_6e5k 1
53 3 . 1 . 1 1 24 24 GLU HB2 H . . . . 24 . HB1 rr_6e5k 1
53 3 . 2 . 1 1 24 24 GLU HG3 H . . . . 24 . HG2 rr_6e5k 1
54 1 . 1 . 1 1 14 14 CYS HA H . . . . 14 . HA rr_6e5k 1
54 1 . 2 . 1 1 14 14 CYS HB2 H . . . . 14 . HB1 rr_6e5k 1
55 2 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
55 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
55 3 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
55 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
56 1 . 1 . 1 1 21 21 PRO HG3 H . . . . 21 . HG2 rr_6e5k 1
56 1 . 2 . 1 1 21 21 PRO HD2 H . . . . 21 . HD1 rr_6e5k 1
57 1 . 1 . 1 1 14 14 CYS HB2 H . . . . 14 . HB1 rr_6e5k 1
57 1 . 2 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
58 2 . 1 . 1 1 11 11 TYR HA H . . . . 11 . HA rr_6e5k 1
58 2 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
58 3 . 1 . 1 1 11 11 TYR HA H . . . . 11 . HA rr_6e5k 1
58 3 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
59 2 . 1 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
59 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
59 3 . 1 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
59 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
60 1 . 1 . 1 1 14 14 CYS HB3 H . . . . 14 . HB2 rr_6e5k 1
60 1 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 1
61 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
61 1 . 2 . 1 1 4 4 CYS HB3 H . . . . 4 . HB2 rr_6e5k 1
62 2 . 1 . 1 1 8 8 LYS HD2 H . . . . 8 . HD1 rr_6e5k 1
62 2 . 2 . 1 1 8 8 LYS HE3 H . . . . 8 . HE2 rr_6e5k 1
62 3 . 1 . 1 1 8 8 LYS HD2 H . . . . 8 . HD1 rr_6e5k 1
62 3 . 2 . 1 1 8 8 LYS HE2 H . . . . 8 . HE1 rr_6e5k 1
62 4 . 1 . 1 1 8 8 LYS HD3 H . . . . 8 . HD2 rr_6e5k 1
62 4 . 2 . 1 1 8 8 LYS HE2 H . . . . 8 . HE1 rr_6e5k 1
62 5 . 1 . 1 1 8 8 LYS HD3 H . . . . 8 . HD2 rr_6e5k 1
62 5 . 2 . 1 1 8 8 LYS HE3 H . . . . 8 . HE2 rr_6e5k 1
63 1 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
63 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
64 2 . 1 . 1 1 8 8 LYS HG3 H . . . . 8 . HG2 rr_6e5k 1
64 2 . 2 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 1
64 3 . 1 . 1 1 8 8 LYS HG3 H . . . . 8 . HG2 rr_6e5k 1
64 3 . 2 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 1
65 1 . 1 . 1 1 2 2 ASP HA H . . . . 2 . HA rr_6e5k 1
65 1 . 2 . 1 1 3 3 ABA H H . . . . 3 . HN rr_6e5k 1
66 1 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 1
66 1 . 2 . 1 1 18 18 CYS HB3 H . . . . 18 . HB2 rr_6e5k 1
67 1 . 1 . 1 1 27 27 CYS HA H . . . . 27 . HA rr_6e5k 1
67 1 . 2 . 1 1 27 27 CYS HB3 H . . . . 27 . HB2 rr_6e5k 1
68 1 . 1 . 1 1 21 21 PRO HA H . . . . 21 . HA rr_6e5k 1
68 1 . 2 . 1 1 21 21 PRO HB2 H . . . . 21 . HB1 rr_6e5k 1
69 1 . 1 . 1 1 14 14 CYS HB2 H . . . . 14 . HB1 rr_6e5k 1
69 1 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
70 1 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
70 1 . 2 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
71 2 . 1 . 1 1 22 22 ARG HG2 H . . . . 22 . HG1 rr_6e5k 1
71 2 . 2 . 1 1 22 22 ARG HD2 H . . . . 22 . HD1 rr_6e5k 1
71 3 . 1 . 1 1 22 22 ARG HG2 H . . . . 22 . HG1 rr_6e5k 1
71 3 . 2 . 1 1 22 22 ARG HD3 H . . . . 22 . HD2 rr_6e5k 1
71 4 . 1 . 1 1 22 22 ARG HG3 H . . . . 22 . HG2 rr_6e5k 1
71 4 . 2 . 1 1 22 22 ARG HD2 H . . . . 22 . HD1 rr_6e5k 1
71 5 . 1 . 1 1 22 22 ARG HG3 H . . . . 22 . HG2 rr_6e5k 1
71 5 . 2 . 1 1 22 22 ARG HD3 H . . . . 22 . HD2 rr_6e5k 1
72 1 . 1 . 1 1 25 25 MVA HA H . . . . 25 . HA rr_6e5k 1
72 1 . 2 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
73 1 . 1 . 1 1 27 27 CYS HB2 H . . . . 27 . HB1 rr_6e5k 1
73 1 . 2 . 1 1 27 27 CYS H H . . . . 27 . HN rr_6e5k 1
74 1 . 1 . 1 1 19 19 ASP HA H . . . . 19 . HA rr_6e5k 1
74 1 . 2 . 1 1 20 20 DPR HD2 H . . . . 20 . HD1 rr_6e5k 1
75 1 . 1 . 1 1 21 21 PRO HG2 H . . . . 21 . HG1 rr_6e5k 1
75 1 . 2 . 1 1 21 21 PRO HD3 H . . . . 21 . HD2 rr_6e5k 1
76 2 . 1 . 1 1 5 5 LYS HG2 H . . . . 5 . HG1 rr_6e5k 1
76 2 . 2 . 1 1 5 5 LYS HB2 H . . . . 5 . HB1 rr_6e5k 1
76 3 . 1 . 1 1 5 5 LYS HG2 H . . . . 5 . HG1 rr_6e5k 1
76 3 . 2 . 1 1 5 5 LYS HB3 H . . . . 5 . HB2 rr_6e5k 1
77 1 . 1 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
77 1 . 2 . 1 1 14 14 CYS HB3 H . . . . 14 . HB2 rr_6e5k 1
78 1 . 1 . 1 1 11 11 TYR HA H . . . . 11 . HA rr_6e5k 1
78 1 . 2 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
79 1 . 1 . 1 1 7 7 LEU HG H . . . . 7 . HG rr_6e5k 1
79 1 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
80 1 . 1 . 1 1 4 4 CYS HB2 H . . . . 4 . HB1 rr_6e5k 1
80 1 . 2 . 1 1 4 4 CYS H H . . . . 4 . HN rr_6e5k 1
81 2 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
81 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
81 3 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
81 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
82 1 . 1 . 1 1 20 20 DPR HG3 H . . . . 20 . HG2 rr_6e5k 1
82 1 . 2 . 1 1 20 20 DPR HD2 H . . . . 20 . HD1 rr_6e5k 1
83 1 . 1 . 1 1 19 19 ASP HA H . . . . 19 . HA rr_6e5k 1
83 1 . 2 . 1 1 19 19 ASP HB2 H . . . . 19 . HB1 rr_6e5k 1
84 1 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
84 1 . 2 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
85 1 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
85 1 . 2 . 1 1 7 7 LEU HG H . . . . 7 . HG rr_6e5k 1
86 1 . 1 . 1 1 24 24 GLU HA H . . . . 24 . HA rr_6e5k 1
86 1 . 2 . 1 1 24 24 GLU HB3 H . . . . 24 . HB2 rr_6e5k 1
87 1 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_6e5k 1
87 1 . 2 . 1 1 26 26 HIS HB3 H . . . . 26 . HB2 rr_6e5k 1
88 1 . 1 . 1 1 25 25 MVA HA H . . . . 25 . HA rr_6e5k 1
88 1 . 2 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
89 1 . 1 . 1 1 13 13 GLY HA3 H . . . . 13 . HA2 rr_6e5k 1
89 1 . 2 . 1 1 13 13 GLY H H . . . . 13 . HN rr_6e5k 1
90 1 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
90 1 . 2 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 1
91 1 . 1 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
91 1 . 2 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 1
92 1 . 1 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
92 1 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
93 1 . 1 . 1 1 20 20 DPR HG2 H . . . . 20 . HG1 rr_6e5k 1
93 1 . 2 . 1 1 20 20 DPR HD3 H . . . . 20 . HD2 rr_6e5k 1
94 1 . 1 . 1 1 24 24 GLU HB2 H . . . . 24 . HB1 rr_6e5k 1
94 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
95 1 . 1 . 1 1 26 26 HIS HB2 H . . . . 26 . HB1 rr_6e5k 1
95 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
96 1 . 1 . 1 1 18 18 CYS HB2 H . . . . 18 . HB1 rr_6e5k 1
96 1 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 1
97 1 . 1 . 1 1 10 10 ARG HB3 H . . . . 10 . HB2 rr_6e5k 1
97 1 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
98 1 . 1 . 1 1 11 11 TYR HA H . . . . 11 . HA rr_6e5k 1
98 1 . 2 . 1 1 12 12 ABA H H . . . . 12 . HN rr_6e5k 1
99 1 . 1 . 1 1 14 14 CYS HB3 H . . . . 14 . HB2 rr_6e5k 1
99 1 . 2 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
100 1 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_6e5k 1
100 1 . 2 . 1 1 26 26 HIS HB2 H . . . . 26 . HB1 rr_6e5k 1
101 1 . 1 . 1 1 17 17 ARG HG3 H . . . . 17 . HG2 rr_6e5k 1
101 1 . 2 . 1 1 17 17 ARG HB3 H . . . . 17 . HB2 rr_6e5k 1
102 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
102 1 . 2 . 1 1 4 4 CYS H H . . . . 4 . HN rr_6e5k 1
103 1 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
103 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
104 1 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
104 1 . 2 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
105 1 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
105 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
106 2 . 1 . 1 1 22 22 ARG HB2 H . . . . 22 . HB1 rr_6e5k 1
106 2 . 2 . 1 1 22 22 ARG HD3 H . . . . 22 . HD2 rr_6e5k 1
106 3 . 1 . 1 1 22 22 ARG HB2 H . . . . 22 . HB1 rr_6e5k 1
106 3 . 2 . 1 1 22 22 ARG HD2 H . . . . 22 . HD1 rr_6e5k 1
106 4 . 1 . 1 1 22 22 ARG HB3 H . . . . 22 . HB2 rr_6e5k 1
106 4 . 2 . 1 1 22 22 ARG HD2 H . . . . 22 . HD1 rr_6e5k 1
106 5 . 1 . 1 1 22 22 ARG HB3 H . . . . 22 . HB2 rr_6e5k 1
106 5 . 2 . 1 1 22 22 ARG HD3 H . . . . 22 . HD2 rr_6e5k 1
107 1 . 1 . 1 1 17 17 ARG HB3 H . . . . 17 . HB2 rr_6e5k 1
107 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
108 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
108 1 . 2 . 1 1 4 4 CYS HB2 H . . . . 4 . HB1 rr_6e5k 1
109 1 . 1 . 1 1 17 17 ARG HA H . . . . 17 . HA rr_6e5k 1
109 1 . 2 . 1 1 17 17 ARG HB3 H . . . . 17 . HB2 rr_6e5k 1
110 1 . 1 . 1 1 21 21 PRO HG3 H . . . . 21 . HG2 rr_6e5k 1
110 1 . 2 . 1 1 21 21 PRO HD3 H . . . . 21 . HD2 rr_6e5k 1
111 1 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
111 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
112 1 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 1
112 1 . 2 . 1 1 18 18 CYS HB2 H . . . . 18 . HB1 rr_6e5k 1
113 1 . 1 . 1 1 17 17 ARG HA H . . . . 17 . HA rr_6e5k 1
113 1 . 2 . 1 1 17 17 ARG HB2 H . . . . 17 . HB1 rr_6e5k 1
114 1 . 1 . 1 1 17 17 ARG HB2 H . . . . 17 . HB1 rr_6e5k 1
114 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
115 2 . 1 . 1 1 22 22 ARG HB2 H . . . . 22 . HB1 rr_6e5k 1
115 2 . 2 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
115 3 . 1 . 1 1 22 22 ARG HB3 H . . . . 22 . HB2 rr_6e5k 1
115 3 . 2 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
116 1 . 1 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 1
116 1 . 2 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
117 1 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
117 1 . 2 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 1
118 2 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
118 2 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
118 3 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
118 3 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
119 1 . 1 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 1
119 1 . 2 . 1 1 13 13 GLY H H . . . . 13 . HN rr_6e5k 1
120 1 . 1 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
120 1 . 2 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
121 1 . 1 . 1 1 14 14 CYS HA H . . . . 14 . HA rr_6e5k 1
121 1 . 2 . 1 1 14 14 CYS HB3 H . . . . 14 . HB2 rr_6e5k 1
122 2 . 1 . 1 1 24 24 GLU HA H . . . . 24 . HA rr_6e5k 1
122 2 . 2 . 1 1 24 24 GLU HG2 H . . . . 24 . HG1 rr_6e5k 1
122 3 . 1 . 1 1 24 24 GLU HA H . . . . 24 . HA rr_6e5k 1
122 3 . 2 . 1 1 24 24 GLU HG3 H . . . . 24 . HG2 rr_6e5k 1
123 1 . 1 . 1 1 27 27 CYS HA H . . . . 27 . HA rr_6e5k 1
123 1 . 2 . 1 1 14 14 CYS HB2 H . . . . 14 . HB1 rr_6e5k 1
124 1 . 1 . 1 1 2 2 ASP HA H . . . . 2 . HA rr_6e5k 1
124 1 . 2 . 1 1 2 2 ASP HB2 H . . . . 2 . HB1 rr_6e5k 1
125 2 . 1 . 1 1 15 15 GLU HB2 H . . . . 15 . HB1 rr_6e5k 1
125 2 . 2 . 1 1 26 26 HIS HB2 H . . . . 26 . HB1 rr_6e5k 1
125 3 . 1 . 1 1 15 15 GLU HB3 H . . . . 15 . HB2 rr_6e5k 1
125 3 . 2 . 1 1 26 26 HIS HB2 H . . . . 26 . HB1 rr_6e5k 1
126 1 . 1 . 1 1 2 2 ASP HA H . . . . 2 . HA rr_6e5k 1
126 1 . 2 . 1 1 2 2 ASP HB3 H . . . . 2 . HB2 rr_6e5k 1
127 1 . 1 . 1 1 19 19 ASP HA H . . . . 19 . HA rr_6e5k 1
127 1 . 2 . 1 1 19 19 ASP HB3 H . . . . 19 . HB2 rr_6e5k 1
128 1 . 1 . 1 1 20 20 DPR HA H . . . . 20 . HA rr_6e5k 1
128 1 . 2 . 1 1 20 20 DPR HB2 H . . . . 20 . HB1 rr_6e5k 1
129 2 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
129 2 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
129 3 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
129 3 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
130 1 . 1 . 1 1 10 10 ARG HB2 H . . . . 10 . HB1 rr_6e5k 1
130 1 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
131 2 . 1 . 1 1 22 22 ARG HA H . . . . 22 . HA rr_6e5k 1
131 2 . 2 . 1 1 22 22 ARG HG2 H . . . . 22 . HG1 rr_6e5k 1
131 3 . 1 . 1 1 22 22 ARG HA H . . . . 22 . HA rr_6e5k 1
131 3 . 2 . 1 1 22 22 ARG HG3 H . . . . 22 . HG2 rr_6e5k 1
132 1 . 1 . 1 1 14 14 CYS HA H . . . . 14 . HA rr_6e5k 1
132 1 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 1
133 1 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
133 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
134 1 . 1 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 1
134 1 . 2 . 1 1 4 4 CYS H H . . . . 4 . HN rr_6e5k 1
135 2 . 1 . 1 1 17 17 ARG HB2 H . . . . 17 . HB1 rr_6e5k 1
135 2 . 2 . 1 1 17 17 ARG HD2 H . . . . 17 . HD1 rr_6e5k 1
135 3 . 1 . 1 1 17 17 ARG HB2 H . . . . 17 . HB1 rr_6e5k 1
135 3 . 2 . 1 1 17 17 ARG HD3 H . . . . 17 . HD2 rr_6e5k 1
136 1 . 1 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
136 1 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
137 1 . 1 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
137 1 . 2 . 1 1 9 9 ABA H H . . . . 9 . HN rr_6e5k 1
138 1 . 1 . 1 1 19 19 ASP HB3 H . . . . 19 . HB2 rr_6e5k 1
138 1 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 1
139 2 . 1 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
139 2 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
139 3 . 1 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
139 3 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
140 1 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
140 1 . 2 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
141 2 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
141 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
141 3 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
141 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
142 1 . 1 . 1 1 12 12 ABA H H . . . . 12 . HN rr_6e5k 1
142 1 . 2 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 1
143 2 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
143 2 . 2 . 1 1 23 23 TYR HE1 H . . . . 23 . HE1 rr_6e5k 1
143 3 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
143 3 . 2 . 1 1 23 23 TYR HE2 H . . . . 23 . HE2 rr_6e5k 1
144 1 . 1 . 1 1 4 4 CYS HB3 H . . . . 4 . HB2 rr_6e5k 1
144 1 . 2 . 1 1 4 4 CYS H H . . . . 4 . HN rr_6e5k 1
145 1 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 1
145 1 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 1
146 2 . 1 . 1 1 5 5 LYS HB2 H . . . . 5 . HB1 rr_6e5k 1
146 2 . 2 . 1 1 6 6 ABA H H . . . . 6 . HN rr_6e5k 1
146 3 . 1 . 1 1 5 5 LYS HB3 H . . . . 5 . HB2 rr_6e5k 1
146 3 . 2 . 1 1 6 6 ABA H H . . . . 6 . HN rr_6e5k 1
147 2 . 1 . 1 1 5 5 LYS HG3 H . . . . 5 . HG2 rr_6e5k 1
147 2 . 2 . 1 1 5 5 LYS HB2 H . . . . 5 . HB1 rr_6e5k 1
147 3 . 1 . 1 1 5 5 LYS HG3 H . . . . 5 . HG2 rr_6e5k 1
147 3 . 2 . 1 1 5 5 LYS HB3 H . . . . 5 . HB2 rr_6e5k 1
148 1 . 1 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
148 1 . 2 . 1 1 6 6 ABA H H . . . . 6 . HN rr_6e5k 1
149 1 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
149 1 . 2 . 1 1 7 7 LEU HG H . . . . 7 . HG rr_6e5k 1
150 1 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
150 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
151 1 . 1 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 1
151 1 . 2 . 1 1 6 6 ABA H H . . . . 6 . HN rr_6e5k 1
152 2 . 1 . 1 1 22 22 ARG HG2 H . . . . 22 . HG1 rr_6e5k 1
152 2 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
152 3 . 1 . 1 1 22 22 ARG HG3 H . . . . 22 . HG2 rr_6e5k 1
152 3 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
153 1 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
153 1 . 2 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 1
154 1 . 1 . 1 1 27 27 CYS HA H . . . . 27 . HA rr_6e5k 1
154 1 . 2 . 1 1 27 27 CYS HB2 H . . . . 27 . HB1 rr_6e5k 1
155 2 . 1 . 1 1 17 17 ARG HG2 H . . . . 17 . HG1 rr_6e5k 1
155 2 . 2 . 1 1 17 17 ARG HD2 H . . . . 17 . HD1 rr_6e5k 1
155 3 . 1 . 1 1 17 17 ARG HG2 H . . . . 17 . HG1 rr_6e5k 1
155 3 . 2 . 1 1 17 17 ARG HD3 H . . . . 17 . HD2 rr_6e5k 1
156 1 . 1 . 1 1 17 17 ARG HA H . . . . 17 . HA rr_6e5k 1
156 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
157 1 . 1 . 1 1 1 1 ASN HA H . . . . 1 . HA rr_6e5k 1
157 1 . 2 . 1 1 2 2 ASP H H . . . . 2 . HN rr_6e5k 1
158 1 . 1 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
158 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
159 1 . 1 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 1
159 1 . 2 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 1
160 1 . 1 . 1 1 27 27 CYS HA H . . . . 27 . HA rr_6e5k 1
160 1 . 2 . 1 1 27 27 CYS H H . . . . 27 . HN rr_6e5k 1
161 1 . 1 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
161 1 . 2 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
162 1 . 1 . 1 1 8 8 LYS HG2 H . . . . 8 . HG1 rr_6e5k 1
162 1 . 2 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
163 1 . 1 . 1 1 11 11 TYR HA H . . . . 11 . HA rr_6e5k 1
163 1 . 2 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 1
164 2 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
164 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
164 3 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
164 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
165 1 . 1 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
165 1 . 2 . 1 1 9 9 ABA H H . . . . 9 . HN rr_6e5k 1
166 1 . 1 . 1 1 11 11 TYR HA H . . . . 11 . HA rr_6e5k 1
166 1 . 2 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
167 1 . 1 . 1 1 15 15 GLU HA H . . . . 15 . HA rr_6e5k 1
167 1 . 2 . 1 1 15 15 GLU HG3 H . . . . 15 . HG2 rr_6e5k 1
168 1 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
168 1 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
169 2 . 1 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 1
169 2 . 2 . 1 1 9 9 ABA H H . . . . 9 . HN rr_6e5k 1
169 3 . 1 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 1
169 3 . 2 . 1 1 9 9 ABA H H . . . . 9 . HN rr_6e5k 1
170 1 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
170 1 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
171 1 . 1 . 1 1 19 19 ASP HA H . . . . 19 . HA rr_6e5k 1
171 1 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 1
172 1 . 1 . 1 1 21 21 PRO HD3 H . . . . 21 . HD2 rr_6e5k 1
172 1 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
173 1 . 1 . 1 1 20 20 DPR HG3 H . . . . 20 . HG2 rr_6e5k 1
173 1 . 2 . 1 1 20 20 DPR HD3 H . . . . 20 . HD2 rr_6e5k 1
174 1 . 1 . 1 1 20 20 DPR HG2 H . . . . 20 . HG1 rr_6e5k 1
174 1 . 2 . 1 1 20 20 DPR HD2 H . . . . 20 . HD1 rr_6e5k 1
175 1 . 1 . 1 1 22 22 ARG HA H . . . . 22 . HA rr_6e5k 1
175 1 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
176 1 . 1 . 1 1 25 25 MVA HA H . . . . 25 . HA rr_6e5k 1
176 1 . 2 . 1 1 25 25 MVA HB H . . . . 25 . HB rr_6e5k 1
177 2 . 1 . 1 1 17 17 ARG HB3 H . . . . 17 . HB2 rr_6e5k 1
177 2 . 2 . 1 1 17 17 ARG HD2 H . . . . 17 . HD1 rr_6e5k 1
177 3 . 1 . 1 1 17 17 ARG HB3 H . . . . 17 . HB2 rr_6e5k 1
177 3 . 2 . 1 1 17 17 ARG HD3 H . . . . 17 . HD2 rr_6e5k 1
178 1 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
178 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
179 1 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_6e5k 1
179 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
180 1 . 1 . 1 1 9 9 ABA H H . . . . 9 . HN rr_6e5k 1
180 1 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
181 2 . 1 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
181 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
181 3 . 1 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
181 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
182 2 . 1 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 1
182 2 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
182 3 . 1 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 1
182 3 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
183 1 . 1 . 1 1 24 24 GLU HA H . . . . 24 . HA rr_6e5k 1
183 1 . 2 . 1 1 24 24 GLU HB2 H . . . . 24 . HB1 rr_6e5k 1
184 1 . 1 . 1 1 18 18 CYS HB3 H . . . . 18 . HB2 rr_6e5k 1
184 1 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 1
185 1 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
185 1 . 2 . 1 1 16 16 MVA HB H . . . . 16 . HB rr_6e5k 1
186 1 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
186 1 . 2 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 1
187 1 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
187 1 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 1
188 1 . 1 . 1 1 10 10 ARG HA H . . . . 10 . HA rr_6e5k 1
188 1 . 2 . 1 1 12 12 ABA H H . . . . 12 . HN rr_6e5k 1
189 1 . 1 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
189 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
190 1 . 1 . 1 1 10 10 ARG HG3 H . . . . 10 . HG2 rr_6e5k 1
190 1 . 2 . 1 1 10 10 ARG HA H . . . . 10 . HA rr_6e5k 1
191 1 . 1 . 1 1 21 21 PRO HG2 H . . . . 21 . HG1 rr_6e5k 1
191 1 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
192 1 . 1 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
192 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
193 1 . 1 . 1 1 8 8 LYS HG3 H . . . . 8 . HG2 rr_6e5k 1
193 1 . 2 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
194 1 . 1 . 1 1 20 20 DPR HB2 H . . . . 20 . HB1 rr_6e5k 1
194 1 . 2 . 1 1 20 20 DPR HD2 H . . . . 20 . HD1 rr_6e5k 1
195 1 . 1 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 1
195 1 . 2 . 1 1 6 6 ABA H H . . . . 6 . HN rr_6e5k 1
196 1 . 1 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 1
196 1 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
197 1 . 1 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
197 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
198 1 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 1
198 1 . 2 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
199 1 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
199 1 . 2 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
200 2 . 1 . 1 1 17 17 ARG HG3 H . . . . 17 . HG2 rr_6e5k 1
200 2 . 2 . 1 1 17 17 ARG HD2 H . . . . 17 . HD1 rr_6e5k 1
200 3 . 1 . 1 1 17 17 ARG HG3 H . . . . 17 . HG2 rr_6e5k 1
200 3 . 2 . 1 1 17 17 ARG HD3 H . . . . 17 . HD2 rr_6e5k 1
201 1 . 1 . 1 1 24 24 GLU HA H . . . . 24 . HA rr_6e5k 1
201 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
202 1 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
202 1 . 2 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 1
203 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
203 1 . 2 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 1
204 1 . 1 . 1 1 10 10 ARG HG2 H . . . . 10 . HG1 rr_6e5k 1
204 1 . 2 . 1 1 10 10 ARG HA H . . . . 10 . HA rr_6e5k 1
205 2 . 1 . 1 1 10 10 ARG HB2 H . . . . 10 . HB1 rr_6e5k 1
205 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
205 3 . 1 . 1 1 10 10 ARG HB2 H . . . . 10 . HB1 rr_6e5k 1
205 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
206 1 . 1 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 1
206 1 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
207 1 . 1 . 1 1 17 17 ARG HA H . . . . 17 . HA rr_6e5k 1
207 1 . 2 . 1 1 17 17 ARG HG2 H . . . . 17 . HG1 rr_6e5k 1
208 1 . 1 . 1 1 4 4 CYS H H . . . . 4 . HN rr_6e5k 1
208 1 . 2 . 1 1 3 3 ABA H H . . . . 3 . HN rr_6e5k 1
209 1 . 1 . 1 1 17 17 ARG HA H . . . . 17 . HA rr_6e5k 1
209 1 . 2 . 1 1 17 17 ARG HG3 H . . . . 17 . HG2 rr_6e5k 1
210 1 . 1 . 1 1 8 8 LYS HG3 H . . . . 8 . HG2 rr_6e5k 1
210 1 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
211 1 . 1 . 1 1 20 20 DPR HA H . . . . 20 . HA rr_6e5k 1
211 1 . 2 . 1 1 20 20 DPR HG2 H . . . . 20 . HG1 rr_6e5k 1
212 2 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
212 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
212 3 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
212 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
213 1 . 1 . 1 1 27 27 CYS HB3 H . . . . 27 . HB2 rr_6e5k 1
213 1 . 2 . 1 1 27 27 CYS H H . . . . 27 . HN rr_6e5k 1
214 2 . 1 . 1 1 24 24 GLU HG2 H . . . . 24 . HG1 rr_6e5k 1
214 2 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
214 3 . 1 . 1 1 24 24 GLU HG3 H . . . . 24 . HG2 rr_6e5k 1
214 3 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
215 1 . 1 . 1 1 21 21 PRO HB3 H . . . . 21 . HB2 rr_6e5k 1
215 1 . 2 . 1 1 21 21 PRO HD2 H . . . . 21 . HD1 rr_6e5k 1
216 2 . 1 . 1 1 10 10 ARG HB2 H . . . . 10 . HB1 rr_6e5k 1
216 2 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
216 3 . 1 . 1 1 10 10 ARG HB2 H . . . . 10 . HB1 rr_6e5k 1
216 3 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
217 1 . 1 . 1 1 24 24 GLU HB3 H . . . . 24 . HB2 rr_6e5k 1
217 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
218 1 . 1 . 1 1 13 13 GLY HA3 H . . . . 13 . HA2 rr_6e5k 1
218 1 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 1
219 1 . 1 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
219 1 . 2 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
220 2 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
220 2 . 2 . 1 1 23 23 TYR HE2 H . . . . 23 . HE2 rr_6e5k 1
220 3 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
220 3 . 2 . 1 1 23 23 TYR HE1 H . . . . 23 . HE1 rr_6e5k 1
221 1 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
221 1 . 2 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
222 1 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_6e5k 1
222 1 . 2 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
223 2 . 1 . 1 1 10 10 ARG HD2 H . . . . 10 . HD1 rr_6e5k 1
223 2 . 2 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
223 3 . 1 . 1 1 10 10 ARG HD3 H . . . . 10 . HD2 rr_6e5k 1
223 3 . 2 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
224 2 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
224 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
224 3 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
224 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
225 1 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 1
225 1 . 2 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
226 2 . 1 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
226 2 . 2 . 1 1 23 23 TYR HE2 H . . . . 23 . HE2 rr_6e5k 1
226 3 . 1 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
226 3 . 2 . 1 1 23 23 TYR HE1 H . . . . 23 . HE1 rr_6e5k 1
227 1 . 1 . 1 1 13 13 GLY HA2 H . . . . 13 . HA1 rr_6e5k 1
227 1 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 1
228 2 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
228 2 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
228 3 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
228 3 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
229 2 . 1 . 1 1 15 15 GLU HB2 H . . . . 15 . HB1 rr_6e5k 1
229 2 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
229 3 . 1 . 1 1 15 15 GLU HB3 H . . . . 15 . HB2 rr_6e5k 1
229 3 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
230 1 . 1 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 1
230 1 . 2 . 1 1 16 16 MVA HB H . . . . 16 . HB rr_6e5k 1
231 1 . 1 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
231 1 . 2 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 1
232 1 . 1 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
232 1 . 2 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
233 2 . 1 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 1
233 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
233 3 . 1 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 1
233 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
234 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
234 1 . 2 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
235 1 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
235 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
236 1 . 1 . 1 1 20 20 DPR HG2 H . . . . 20 . HG1 rr_6e5k 1
236 1 . 2 . 1 1 20 20 DPR HB3 H . . . . 20 . HB2 rr_6e5k 1
237 1 . 1 . 1 1 2 2 ASP HA H . . . . 2 . HA rr_6e5k 1
237 1 . 2 . 1 1 2 2 ASP H H . . . . 2 . HN rr_6e5k 1
238 1 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
238 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
239 1 . 1 . 1 1 27 27 CYS HA H . . . . 27 . HA rr_6e5k 1
239 1 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
240 1 . 1 . 1 1 21 21 PRO HA H . . . . 21 . HA rr_6e5k 1
240 1 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
241 1 . 1 . 1 1 20 20 DPR HB2 H . . . . 20 . HB1 rr_6e5k 1
241 1 . 2 . 1 1 20 20 DPR HD3 H . . . . 20 . HD2 rr_6e5k 1
242 2 . 1 . 1 1 10 10 ARG HD2 H . . . . 10 . HD1 rr_6e5k 1
242 2 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
242 3 . 1 . 1 1 10 10 ARG HD2 H . . . . 10 . HD1 rr_6e5k 1
242 3 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
242 4 . 1 . 1 1 10 10 ARG HD3 H . . . . 10 . HD2 rr_6e5k 1
242 4 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
242 5 . 1 . 1 1 10 10 ARG HD3 H . . . . 10 . HD2 rr_6e5k 1
242 5 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
243 1 . 1 . 1 1 21 21 PRO HG2 H . . . . 21 . HG1 rr_6e5k 1
243 1 . 2 . 1 1 21 21 PRO HD2 H . . . . 21 . HD1 rr_6e5k 1
244 2 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
244 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
244 3 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
244 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
245 1 . 1 . 1 1 20 20 DPR HB3 H . . . . 20 . HB2 rr_6e5k 1
245 1 . 2 . 1 1 21 21 PRO HD2 H . . . . 21 . HD1 rr_6e5k 1
246 1 . 1 . 1 1 2 2 ASP HB2 H . . . . 2 . HB1 rr_6e5k 1
246 1 . 2 . 1 1 2 2 ASP H H . . . . 2 . HN rr_6e5k 1
247 2 . 1 . 1 1 22 22 ARG HA H . . . . 22 . HA rr_6e5k 1
247 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
247 3 . 1 . 1 1 22 22 ARG HA H . . . . 22 . HA rr_6e5k 1
247 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
248 1 . 1 . 1 1 20 20 DPR HD2 H . . . . 20 . HD1 rr_6e5k 1
248 1 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 1
249 1 . 1 . 1 1 25 25 MVA HA H . . . . 25 . HA rr_6e5k 1
249 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
250 2 . 1 . 1 1 10 10 ARG HD2 H . . . . 10 . HD1 rr_6e5k 1
250 2 . 2 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
250 3 . 1 . 1 1 10 10 ARG HD3 H . . . . 10 . HD2 rr_6e5k 1
250 3 . 2 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
251 1 . 1 . 1 1 17 17 ARG HB3 H . . . . 17 . HB2 rr_6e5k 1
251 1 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 1
252 1 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 1
252 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
253 1 . 1 . 1 1 18 18 CYS HB2 H . . . . 18 . HB1 rr_6e5k 1
253 1 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 1
254 1 . 1 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
254 1 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 1
255 2 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
255 2 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
255 3 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
255 3 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
256 1 . 1 . 1 1 2 2 ASP HB3 H . . . . 2 . HB2 rr_6e5k 1
256 1 . 2 . 1 1 2 2 ASP H H . . . . 2 . HN rr_6e5k 1
257 1 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
257 1 . 2 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 1
258 2 . 1 . 1 1 1 1 ASN HB2 H . . . . 1 . HB1 rr_6e5k 1
258 2 . 2 . 1 1 2 2 ASP H H . . . . 2 . HN rr_6e5k 1
258 3 . 1 . 1 1 1 1 ASN HB3 H . . . . 1 . HB2 rr_6e5k 1
258 3 . 2 . 1 1 2 2 ASP H H . . . . 2 . HN rr_6e5k 1
259 1 . 1 . 1 1 27 27 CYS HA H . . . . 27 . HA rr_6e5k 1
259 1 . 2 . 1 1 14 14 CYS HB3 H . . . . 14 . HB2 rr_6e5k 1
260 1 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
260 1 . 2 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
261 1 . 1 . 1 1 15 15 GLU HA H . . . . 15 . HA rr_6e5k 1
261 1 . 2 . 1 1 15 15 GLU HG2 H . . . . 15 . HG1 rr_6e5k 1
262 1 . 1 . 1 1 5 5 LYS HG2 H . . . . 5 . HG1 rr_6e5k 1
262 1 . 2 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 1
263 2 . 1 . 1 1 22 22 ARG HG2 H . . . . 22 . HG1 rr_6e5k 1
263 2 . 2 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
263 3 . 1 . 1 1 22 22 ARG HG3 H . . . . 22 . HG2 rr_6e5k 1
263 3 . 2 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
264 1 . 1 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 1
264 1 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
265 2 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
265 2 . 2 . 1 1 23 23 TYR HE2 H . . . . 23 . HE2 rr_6e5k 1
265 3 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
265 3 . 2 . 1 1 23 23 TYR HE1 H . . . . 23 . HE1 rr_6e5k 1
266 2 . 1 . 1 1 22 22 ARG HD2 H . . . . 22 . HD1 rr_6e5k 1
266 2 . 2 . 1 1 22 22 ARG HE H . . . . 22 . HE rr_6e5k 1
266 3 . 1 . 1 1 22 22 ARG HD3 H . . . . 22 . HD2 rr_6e5k 1
266 3 . 2 . 1 1 22 22 ARG HE H . . . . 22 . HE rr_6e5k 1
267 1 . 1 . 1 1 17 17 ARG HB2 H . . . . 17 . HB1 rr_6e5k 1
267 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
268 1 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
268 1 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 1
269 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
269 1 . 2 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 1
270 1 . 1 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
270 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
271 1 . 1 . 1 1 21 21 PRO HA H . . . . 21 . HA rr_6e5k 1
271 1 . 2 . 1 1 21 21 PRO HG2 H . . . . 21 . HG1 rr_6e5k 1
272 1 . 1 . 1 1 10 10 ARG HG2 H . . . . 10 . HG1 rr_6e5k 1
272 1 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
273 1 . 1 . 1 1 20 20 DPR HB3 H . . . . 20 . HB2 rr_6e5k 1
273 1 . 2 . 1 1 20 20 DPR HD2 H . . . . 20 . HD1 rr_6e5k 1
274 2 . 1 . 1 1 1 1 ASN HA H . . . . 1 . HA rr_6e5k 1
274 2 . 2 . 1 1 1 1 ASN HB2 H . . . . 1 . HB1 rr_6e5k 1
274 3 . 1 . 1 1 1 1 ASN HA H . . . . 1 . HA rr_6e5k 1
274 3 . 2 . 1 1 1 1 ASN HB3 H . . . . 1 . HB2 rr_6e5k 1
275 1 . 1 . 1 1 4 4 CYS HB3 H . . . . 4 . HB2 rr_6e5k 1
275 1 . 2 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 1
276 2 . 1 . 1 1 22 22 ARG HG2 H . . . . 22 . HG1 rr_6e5k 1
276 2 . 2 . 1 1 22 22 ARG HE H . . . . 22 . HE rr_6e5k 1
276 3 . 1 . 1 1 22 22 ARG HG3 H . . . . 22 . HG2 rr_6e5k 1
276 3 . 2 . 1 1 22 22 ARG HE H . . . . 22 . HE rr_6e5k 1
277 1 . 1 . 1 1 17 17 ARG HG2 H . . . . 17 . HG1 rr_6e5k 1
277 1 . 2 . 1 1 17 17 ARG HE H . . . . 17 . HE rr_6e5k 1
278 1 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
278 1 . 2 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
279 1 . 1 . 1 1 10 10 ARG HG3 H . . . . 10 . HG2 rr_6e5k 1
279 1 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
280 1 . 1 . 1 1 24 24 GLU HA H . . . . 24 . HA rr_6e5k 1
280 1 . 2 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
281 1 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
281 1 . 2 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
282 1 . 1 . 1 1 20 20 DPR HB3 H . . . . 20 . HB2 rr_6e5k 1
282 1 . 2 . 1 1 20 20 DPR HD3 H . . . . 20 . HD2 rr_6e5k 1
283 1 . 1 . 1 1 25 25 MVA HA H . . . . 25 . HA rr_6e5k 1
283 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
284 1 . 1 . 1 1 12 12 ABA H H . . . . 12 . HN rr_6e5k 1
284 1 . 2 . 1 1 13 13 GLY H H . . . . 13 . HN rr_6e5k 1
285 2 . 1 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
285 2 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
285 3 . 1 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
285 3 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
286 2 . 1 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
286 2 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
286 3 . 1 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
286 3 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
287 1 . 1 . 1 1 23 23 TYR HB3 H . . . . 23 . HB2 rr_6e5k 1
287 1 . 2 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
288 1 . 1 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
288 1 . 2 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 1
289 2 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
289 2 . 2 . 1 1 23 23 TYR HE2 H . . . . 23 . HE2 rr_6e5k 1
289 3 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
289 3 . 2 . 1 1 23 23 TYR HE1 H . . . . 23 . HE1 rr_6e5k 1
290 1 . 1 . 1 1 17 17 ARG HG3 H . . . . 17 . HG2 rr_6e5k 1
290 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
291 1 . 1 . 1 1 14 14 CYS HB2 H . . . . 14 . HB1 rr_6e5k 1
291 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
292 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
292 1 . 2 . 1 1 18 18 CYS HB2 H . . . . 18 . HB1 rr_6e5k 1
293 1 . 1 . 1 1 15 15 GLU HG2 H . . . . 15 . HG1 rr_6e5k 1
293 1 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
294 1 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
294 1 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
295 1 . 1 . 1 1 20 20 DPR HB3 H . . . . 20 . HB2 rr_6e5k 1
295 1 . 2 . 1 1 21 21 PRO HD3 H . . . . 21 . HD2 rr_6e5k 1
296 1 . 1 . 1 1 17 17 ARG HG2 H . . . . 17 . HG1 rr_6e5k 1
296 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
297 1 . 1 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
297 1 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 1
298 2 . 1 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 1
298 2 . 2 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
298 3 . 1 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 1
298 3 . 2 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
299 1 . 1 . 1 1 3 3 ABA H H . . . . 3 . HN rr_6e5k 1
299 1 . 2 . 1 1 2 2 ASP H H . . . . 2 . HN rr_6e5k 1
300 2 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 1
300 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
300 3 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 1
300 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
301 1 . 1 . 1 1 4 4 CYS HB2 H . . . . 4 . HB1 rr_6e5k 1
301 1 . 2 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 1
302 1 . 1 . 1 1 26 26 HIS HB2 H . . . . 26 . HB1 rr_6e5k 1
302 1 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
303 2 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
303 2 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
303 3 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
303 3 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
304 2 . 1 . 1 1 10 10 ARG HG3 H . . . . 10 . HG2 rr_6e5k 1
304 2 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
304 3 . 1 . 1 1 10 10 ARG HG3 H . . . . 10 . HG2 rr_6e5k 1
304 3 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
305 1 . 1 . 1 1 20 20 DPR HA H . . . . 20 . HA rr_6e5k 1
305 1 . 2 . 1 1 20 20 DPR HD3 H . . . . 20 . HD2 rr_6e5k 1
306 2 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
306 2 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
306 3 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
306 3 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
307 1 . 1 . 1 1 26 26 HIS HB3 H . . . . 26 . HB2 rr_6e5k 1
307 1 . 2 . 1 1 27 27 CYS H H . . . . 27 . HN rr_6e5k 1
308 1 . 1 . 1 1 21 21 PRO HB3 H . . . . 21 . HB2 rr_6e5k 1
308 1 . 2 . 1 1 21 21 PRO HD3 H . . . . 21 . HD2 rr_6e5k 1
309 1 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
309 1 . 2 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
310 2 . 1 . 1 1 14 14 CYS HB3 H . . . . 14 . HB2 rr_6e5k 1
310 2 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
310 3 . 1 . 1 1 14 14 CYS HB3 H . . . . 14 . HB2 rr_6e5k 1
310 3 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
311 1 . 1 . 1 1 18 18 CYS HB3 H . . . . 18 . HB2 rr_6e5k 1
311 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
312 2 . 1 . 1 1 1 1 ASN HB2 H . . . . 1 . HB1 rr_6e5k 1
312 2 . 2 . 1 1 1 1 ASN HD22 H . . . . 1 . HD22 rr_6e5k 1
312 3 . 1 . 1 1 1 1 ASN HB3 H . . . . 1 . HB2 rr_6e5k 1
312 3 . 2 . 1 1 1 1 ASN HD22 H . . . . 1 . HD22 rr_6e5k 1
313 1 . 1 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 1
313 1 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
314 1 . 1 . 1 1 16 16 MVA HB H . . . . 16 . HB rr_6e5k 1
314 1 . 2 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
315 1 . 1 . 1 1 26 26 HIS HB2 H . . . . 26 . HB1 rr_6e5k 1
315 1 . 2 . 1 1 27 27 CYS H H . . . . 27 . HN rr_6e5k 1
316 2 . 1 . 1 1 10 10 ARG HD2 H . . . . 10 . HD1 rr_6e5k 1
316 2 . 2 . 1 1 10 10 ARG HE H . . . . 10 . HE rr_6e5k 1
316 3 . 1 . 1 1 10 10 ARG HD3 H . . . . 10 . HD2 rr_6e5k 1
316 3 . 2 . 1 1 10 10 ARG HE H . . . . 10 . HE rr_6e5k 1
317 1 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
317 1 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
318 1 . 1 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
318 1 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
319 1 . 1 . 1 1 15 15 GLU HA H . . . . 15 . HA rr_6e5k 1
319 1 . 2 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
320 1 . 1 . 1 1 2 2 ASP HB2 H . . . . 2 . HB1 rr_6e5k 1
320 1 . 2 . 1 1 3 3 ABA H H . . . . 3 . HN rr_6e5k 1
321 1 . 1 . 1 1 21 21 PRO HD2 H . . . . 21 . HD1 rr_6e5k 1
321 1 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
322 2 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
322 2 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
322 3 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
322 3 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
323 1 . 1 . 1 1 17 17 ARG HG3 H . . . . 17 . HG2 rr_6e5k 1
323 1 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 1
324 2 . 1 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 1
324 2 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
324 3 . 1 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 1
324 3 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
324 4 . 1 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 1
324 4 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
324 5 . 1 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 1
324 5 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
325 1 . 1 . 1 1 19 19 ASP HB3 H . . . . 19 . HB2 rr_6e5k 1
325 1 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
326 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
326 1 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
327 1 . 1 . 1 1 10 10 ARG HG2 H . . . . 10 . HG1 rr_6e5k 1
327 1 . 2 . 1 1 10 10 ARG HE H . . . . 10 . HE rr_6e5k 1
328 1 . 1 . 1 1 10 10 ARG HB3 H . . . . 10 . HB2 rr_6e5k 1
328 1 . 2 . 1 1 10 10 ARG HE H . . . . 10 . HE rr_6e5k 1
329 1 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
329 1 . 2 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
330 1 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
330 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
331 1 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
331 1 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
332 2 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
332 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
332 3 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 1
332 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
333 1 . 1 . 1 1 5 5 LYS HG3 H . . . . 5 . HG2 rr_6e5k 1
333 1 . 2 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 1
334 2 . 1 . 1 1 1 1 ASN HA H . . . . 1 . HA rr_6e5k 1
334 2 . 2 . 1 1 5 5 LYS HE2 H . . . . 5 . HE1 rr_6e5k 1
334 3 . 1 . 1 1 1 1 ASN HA H . . . . 1 . HA rr_6e5k 1
334 3 . 2 . 1 1 5 5 LYS HE3 H . . . . 5 . HE2 rr_6e5k 1
335 1 . 1 . 1 1 17 17 ARG HG3 H . . . . 17 . HG2 rr_6e5k 1
335 1 . 2 . 1 1 17 17 ARG HE H . . . . 17 . HE rr_6e5k 1
336 1 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 1
336 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
337 1 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
337 1 . 2 . 1 1 26 26 HIS HD2 H . . . . 26 . HD2 rr_6e5k 1
338 1 . 1 . 1 1 14 14 CYS HB2 H . . . . 14 . HB1 rr_6e5k 1
338 1 . 2 . 1 1 27 27 CYS H H . . . . 27 . HN rr_6e5k 1
339 1 . 1 . 1 1 24 24 GLU HB2 H . . . . 24 . HB1 rr_6e5k 1
339 1 . 2 . 1 1 26 26 HIS HD2 H . . . . 26 . HD2 rr_6e5k 1
340 2 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
340 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
340 3 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
340 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
341 1 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
341 1 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 1
342 1 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
342 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
343 1 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
343 1 . 2 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
344 1 . 1 . 1 1 24 24 GLU HA H . . . . 24 . HA rr_6e5k 1
344 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
345 1 . 1 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 1
345 1 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
346 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
346 1 . 2 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
347 1 . 1 . 1 1 21 21 PRO HA H . . . . 21 . HA rr_6e5k 1
347 1 . 2 . 1 1 21 21 PRO HD2 H . . . . 21 . HD1 rr_6e5k 1
348 2 . 1 . 1 1 22 22 ARG HA H . . . . 22 . HA rr_6e5k 1
348 2 . 2 . 1 1 23 23 TYR HE2 H . . . . 23 . HE2 rr_6e5k 1
348 3 . 1 . 1 1 22 22 ARG HA H . . . . 22 . HA rr_6e5k 1
348 3 . 2 . 1 1 23 23 TYR HE1 H . . . . 23 . HE1 rr_6e5k 1
349 1 . 1 . 1 1 2 2 ASP HA H . . . . 2 . HA rr_6e5k 1
349 1 . 2 . 1 1 4 4 CYS H H . . . . 4 . HN rr_6e5k 1
350 2 . 1 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
350 2 . 2 . 1 1 23 23 TYR HE2 H . . . . 23 . HE2 rr_6e5k 1
350 3 . 1 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
350 3 . 2 . 1 1 23 23 TYR HE1 H . . . . 23 . HE1 rr_6e5k 1
351 2 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
351 2 . 2 . 1 1 24 24 GLU HG2 H . . . . 24 . HG1 rr_6e5k 1
351 3 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
351 3 . 2 . 1 1 24 24 GLU HG3 H . . . . 24 . HG2 rr_6e5k 1
352 1 . 1 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 1
352 1 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 1
353 1 . 1 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
353 1 . 2 . 1 1 27 27 CYS H H . . . . 27 . HN rr_6e5k 1
354 1 . 1 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 1
354 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
355 1 . 1 . 1 1 10 10 ARG HB2 H . . . . 10 . HB1 rr_6e5k 1
355 1 . 2 . 1 1 10 10 ARG HE H . . . . 10 . HE rr_6e5k 1
356 2 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
356 2 . 2 . 1 1 23 23 TYR HE1 H . . . . 23 . HE1 rr_6e5k 1
356 3 . 1 . 1 1 7 7 LEU MD1 H . . . . 7 . HD11 rr_6e5k 1
356 3 . 2 . 1 1 23 23 TYR HE2 H . . . . 23 . HE2 rr_6e5k 1
357 1 . 1 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 1
357 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
358 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
358 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
359 1 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
359 1 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
360 2 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
360 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
360 3 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
360 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
361 1 . 1 . 1 1 20 20 DPR HA H . . . . 20 . HA rr_6e5k 1
361 1 . 2 . 1 1 20 20 DPR HD2 H . . . . 20 . HD1 rr_6e5k 1
362 1 . 1 . 1 1 24 24 GLU HB3 H . . . . 24 . HB2 rr_6e5k 1
362 1 . 2 . 1 1 26 26 HIS HD2 H . . . . 26 . HD2 rr_6e5k 1
363 2 . 1 . 1 1 18 18 CYS HB3 H . . . . 18 . HB2 rr_6e5k 1
363 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
363 3 . 1 . 1 1 18 18 CYS HB3 H . . . . 18 . HB2 rr_6e5k 1
363 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
364 1 . 1 . 1 1 10 10 ARG HG3 H . . . . 10 . HG2 rr_6e5k 1
364 1 . 2 . 1 1 10 10 ARG HE H . . . . 10 . HE rr_6e5k 1
365 2 . 1 . 1 1 24 24 GLU HG2 H . . . . 24 . HG1 rr_6e5k 1
365 2 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
365 3 . 1 . 1 1 24 24 GLU HG3 H . . . . 24 . HG2 rr_6e5k 1
365 3 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
366 1 . 1 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
366 1 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
367 1 . 1 . 1 1 23 23 TYR HA H . . . . 23 . HA rr_6e5k 1
367 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
368 1 . 1 . 1 1 17 17 ARG HG2 H . . . . 17 . HG1 rr_6e5k 1
368 1 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 1
369 1 . 1 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 1
369 1 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 1
370 1 . 1 . 1 1 26 26 HIS HA H . . . . 26 . HA rr_6e5k 1
370 1 . 2 . 1 1 26 26 HIS HD2 H . . . . 26 . HD2 rr_6e5k 1
371 2 . 1 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
371 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
371 3 . 1 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
371 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
372 2 . 1 . 1 1 17 17 ARG HD2 H . . . . 17 . HD1 rr_6e5k 1
372 2 . 2 . 1 1 17 17 ARG HE H . . . . 17 . HE rr_6e5k 1
372 3 . 1 . 1 1 17 17 ARG HD3 H . . . . 17 . HD2 rr_6e5k 1
372 3 . 2 . 1 1 17 17 ARG HE H . . . . 17 . HE rr_6e5k 1
373 2 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
373 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
373 3 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
373 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
374 1 . 1 . 1 1 2 2 ASP HA H . . . . 2 . HA rr_6e5k 1
374 1 . 2 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 1
375 1 . 1 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 1
375 1 . 2 . 1 1 27 27 CYS H H . . . . 27 . HN rr_6e5k 1
376 1 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
376 1 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 1
377 2 . 1 . 1 1 15 15 GLU HB2 H . . . . 15 . HB1 rr_6e5k 1
377 2 . 2 . 1 1 26 26 HIS HD2 H . . . . 26 . HD2 rr_6e5k 1
377 3 . 1 . 1 1 15 15 GLU HB3 H . . . . 15 . HB2 rr_6e5k 1
377 3 . 2 . 1 1 26 26 HIS HD2 H . . . . 26 . HD2 rr_6e5k 1
378 1 . 1 . 1 1 16 16 MVA HA H . . . . 16 . HA rr_6e5k 1
378 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
379 1 . 1 . 1 1 15 15 GLU HA H . . . . 15 . HA rr_6e5k 1
379 1 . 2 . 1 1 16 16 MVA HB H . . . . 16 . HB rr_6e5k 1
380 1 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 1
380 1 . 2 . 1 1 12 12 ABA H H . . . . 12 . HN rr_6e5k 1
381 2 . 1 . 1 1 11 11 TYR HA H . . . . 11 . HA rr_6e5k 1
381 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
381 3 . 1 . 1 1 11 11 TYR HA H . . . . 11 . HA rr_6e5k 1
381 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
382 1 . 1 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
382 1 . 2 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 1
383 1 . 1 . 1 1 2 2 ASP HB3 H . . . . 2 . HB2 rr_6e5k 1
383 1 . 2 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 1
384 1 . 1 . 1 1 24 24 GLU HB3 H . . . . 24 . HB2 rr_6e5k 1
384 1 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 1
385 1 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
385 1 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
386 2 . 1 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
386 2 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
386 3 . 1 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
386 3 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
387 2 . 1 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 1
387 2 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
387 3 . 1 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 1
387 3 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 1
388 1 . 1 . 1 1 4 4 CYS HA H . . . . 4 . HA rr_6e5k 1
388 1 . 2 . 1 1 6 6 ABA H H . . . . 6 . HN rr_6e5k 1
389 1 . 1 . 1 1 11 11 TYR HB3 H . . . . 11 . HB2 rr_6e5k 1
389 1 . 2 . 1 1 12 12 ABA H H . . . . 12 . HN rr_6e5k 1
390 1 . 1 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 1
390 1 . 2 . 1 1 23 23 TYR H H . . . . 23 . HN rr_6e5k 1
391 1 . 1 . 1 1 2 2 ASP HB3 H . . . . 2 . HB2 rr_6e5k 1
391 1 . 2 . 1 1 3 3 ABA H H . . . . 3 . HN rr_6e5k 1
392 1 . 1 . 1 1 23 23 TYR HB2 H . . . . 23 . HB1 rr_6e5k 1
392 1 . 2 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 1
393 2 . 1 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
393 2 . 2 . 1 1 12 12 ABA H H . . . . 12 . HN rr_6e5k 1
393 3 . 1 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
393 3 . 2 . 1 1 12 12 ABA H H . . . . 12 . HN rr_6e5k 1
394 1 . 1 . 1 1 16 16 MVA HG11 H . . . . 16 . HG11 rr_6e5k 1
394 1 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
395 2 . 1 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 1
395 2 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
395 3 . 1 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 1
395 3 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 1
396 1 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
396 1 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 1
397 2 . 1 . 1 1 25 25 MVA HA H . . . . 25 . HA rr_6e5k 1
397 2 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 1
397 3 . 1 . 1 1 25 25 MVA HA H . . . . 25 . HA rr_6e5k 1
397 3 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 1
398 2 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
398 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 1
398 3 . 1 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 1
398 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Spectral_peak_list_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 1.612 1.287 1.937 rr_6e5k 1
2 1 . . . . . . 1.659 1.315 2.003 rr_6e5k 1
3 1 . . . . . . 1.688 1.332 2.044 rr_6e5k 1
4 1 . . . . . . 1.721 1.351 2.091 rr_6e5k 1
5 1 . . . . . . 1.748 1.366 2.130 rr_6e5k 1
6 1 . . . . . . 1.752 1.368 2.136 rr_6e5k 1
7 1 . . . . . . 1.769 1.378 2.160 rr_6e5k 1
8 1 . . . . . . 1.771 1.379 2.163 rr_6e5k 1
9 1 . . . . . . 1.773 1.380 2.166 rr_6e5k 1
10 1 . . . . . . 1.783 1.386 2.180 rr_6e5k 1
11 1 . . . . . . 1.811 1.401 2.221 rr_6e5k 1
12 1 . . . . . . 1.813 1.402 2.224 rr_6e5k 1
13 1 . . . . . . 1.819 1.405 2.233 rr_6e5k 1
14 1 . . . . . . 1.852 1.423 2.281 rr_6e5k 1
15 1 . . . . . . 1.868 1.432 2.304 rr_6e5k 1
16 2 . . . . . . 1.972 1.486 2.458 rr_6e5k 1
16 3 . . . . . . 1.972 1.486 2.458 rr_6e5k 1
16 4 . . . . . . 1.972 1.486 2.458 rr_6e5k 1
16 5 . . . . . . 1.972 1.486 2.458 rr_6e5k 1
17 2 . . . . . . 1.984 1.492 2.476 rr_6e5k 1
17 3 . . . . . . 1.984 1.492 2.476 rr_6e5k 1
17 4 . . . . . . 1.984 1.492 2.476 rr_6e5k 1
17 5 . . . . . . 1.984 1.492 2.476 rr_6e5k 1
18 1 . . . . . . 2.021 1.510 2.532 rr_6e5k 1
19 1 . . . . . . 2.040 1.520 2.560 rr_6e5k 1
20 1 . . . . . . 2.040 1.520 2.560 rr_6e5k 1
21 2 . . . . . . 2.048 1.524 2.572 rr_6e5k 1
21 3 . . . . . . 2.048 1.524 2.572 rr_6e5k 1
22 1 . . . . . . 2.078 1.538 2.618 rr_6e5k 1
23 1 . . . . . . 2.079 1.539 2.619 rr_6e5k 1
24 1 . . . . . . 2.080 1.539 2.621 rr_6e5k 1
25 1 . . . . . . 2.132 1.564 2.700 rr_6e5k 1
26 1 . . . . . . 2.142 1.568 2.716 rr_6e5k 1
27 1 . . . . . . 2.161 1.577 2.745 rr_6e5k 1
28 1 . . . . . . 2.170 1.581 2.759 rr_6e5k 1
29 1 . . . . . . 2.195 1.593 2.797 rr_6e5k 1
30 1 . . . . . . 2.201 1.596 2.806 rr_6e5k 1
31 1 . . . . . . 2.202 1.596 2.808 rr_6e5k 1
32 1 . . . . . . 2.232 1.609 2.855 rr_6e5k 1
33 1 . . . . . . 2.237 1.611 2.863 rr_6e5k 1
34 2 . . . . . . 2.260 1.621 2.899 rr_6e5k 1
34 3 . . . . . . 2.260 1.621 2.899 rr_6e5k 1
35 1 . . . . . . 2.268 1.625 2.911 rr_6e5k 1
36 1 . . . . . . 2.268 1.625 2.911 rr_6e5k 1
37 1 . . . . . . 2.270 1.626 2.914 rr_6e5k 1
38 2 . . . . . . 2.272 1.627 2.917 rr_6e5k 1
38 3 . . . . . . 2.272 1.627 2.917 rr_6e5k 1
39 2 . . . . . . 2.277 1.629 2.925 rr_6e5k 1
39 3 . . . . . . 2.277 1.629 2.925 rr_6e5k 1
39 4 . . . . . . 2.277 1.629 2.925 rr_6e5k 1
39 5 . . . . . . 2.277 1.629 2.925 rr_6e5k 1
40 2 . . . . . . 2.297 1.637 2.957 rr_6e5k 1
40 3 . . . . . . 2.297 1.637 2.957 rr_6e5k 1
41 2 . . . . . . 2.301 1.639 2.963 rr_6e5k 1
41 3 . . . . . . 2.301 1.639 2.963 rr_6e5k 1
42 2 . . . . . . 2.304 1.640 2.968 rr_6e5k 1
42 3 . . . . . . 2.304 1.640 2.968 rr_6e5k 1
43 2 . . . . . . 2.308 1.642 2.974 rr_6e5k 1
43 3 . . . . . . 2.308 1.642 2.974 rr_6e5k 1
44 1 . . . . . . 2.328 1.651 3.005 rr_6e5k 1
45 1 . . . . . . 2.335 1.653 3.017 rr_6e5k 1
46 1 . . . . . . 2.337 1.655 3.019 rr_6e5k 1
47 1 . . . . . . 2.340 1.656 3.024 rr_6e5k 1
48 2 . . . . . . 2.341 1.656 3.026 rr_6e5k 1
48 3 . . . . . . 2.341 1.656 3.026 rr_6e5k 1
49 1 . . . . . . 2.343 1.657 3.029 rr_6e5k 1
50 1 . . . . . . 2.350 1.659 3.041 rr_6e5k 1
51 2 . . . . . . 2.353 1.661 3.045 rr_6e5k 1
51 3 . . . . . . 2.353 1.661 3.045 rr_6e5k 1
52 2 . . . . . . 2.359 1.664 3.054 rr_6e5k 1
52 3 . . . . . . 2.359 1.664 3.054 rr_6e5k 1
53 2 . . . . . . 2.367 1.666 3.068 rr_6e5k 1
53 3 . . . . . . 2.367 1.666 3.068 rr_6e5k 1
54 1 . . . . . . 2.376 1.670 3.082 rr_6e5k 1
55 2 . . . . . . 2.385 1.674 3.096 rr_6e5k 1
55 3 . . . . . . 2.385 1.674 3.096 rr_6e5k 1
56 1 . . . . . . 2.390 1.676 3.104 rr_6e5k 1
57 1 . . . . . . 2.392 1.677 3.107 rr_6e5k 1
58 2 . . . . . . 2.392 1.677 3.107 rr_6e5k 1
58 3 . . . . . . 2.392 1.677 3.107 rr_6e5k 1
59 2 . . . . . . 2.392 1.677 3.107 rr_6e5k 1
59 3 . . . . . . 2.392 1.677 3.107 rr_6e5k 1
60 1 . . . . . . 2.394 1.677 3.111 rr_6e5k 1
61 1 . . . . . . 2.397 1.679 3.115 rr_6e5k 1
62 2 . . . . . . 2.397 1.679 3.115 rr_6e5k 1
62 3 . . . . . . 2.397 1.679 3.115 rr_6e5k 1
62 4 . . . . . . 2.397 1.679 3.115 rr_6e5k 1
62 5 . . . . . . 2.397 1.679 3.115 rr_6e5k 1
63 1 . . . . . . 2.405 1.682 3.128 rr_6e5k 1
64 2 . . . . . . 2.412 1.685 3.139 rr_6e5k 1
64 3 . . . . . . 2.412 1.685 3.139 rr_6e5k 1
65 1 . . . . . . 2.418 1.687 3.149 rr_6e5k 1
66 1 . . . . . . 2.418 1.687 3.149 rr_6e5k 1
67 1 . . . . . . 2.424 1.690 3.158 rr_6e5k 1
68 1 . . . . . . 2.427 1.691 3.163 rr_6e5k 1
69 1 . . . . . . 2.427 1.691 3.163 rr_6e5k 1
70 1 . . . . . . 2.431 1.692 3.170 rr_6e5k 1
71 2 . . . . . . 2.431 1.692 3.170 rr_6e5k 1
71 3 . . . . . . 2.431 1.692 3.170 rr_6e5k 1
71 4 . . . . . . 2.431 1.692 3.170 rr_6e5k 1
71 5 . . . . . . 2.431 1.692 3.170 rr_6e5k 1
72 1 . . . . . . 2.437 1.695 3.179 rr_6e5k 1
73 1 . . . . . . 2.440 1.696 3.184 rr_6e5k 1
74 1 . . . . . . 2.443 1.697 3.189 rr_6e5k 1
75 1 . . . . . . 2.446 1.698 3.194 rr_6e5k 1
76 2 . . . . . . 2.446 1.698 3.194 rr_6e5k 1
76 3 . . . . . . 2.446 1.698 3.194 rr_6e5k 1
77 1 . . . . . . 2.451 1.700 3.202 rr_6e5k 1
78 1 . . . . . . 2.462 1.704 3.220 rr_6e5k 1
79 1 . . . . . . 2.462 1.704 3.220 rr_6e5k 1
80 1 . . . . . . 2.464 1.705 3.223 rr_6e5k 1
81 2 . . . . . . 2.464 1.705 3.223 rr_6e5k 1
81 3 . . . . . . 2.464 1.705 3.223 rr_6e5k 1
82 1 . . . . . . 2.467 1.706 3.228 rr_6e5k 1
83 1 . . . . . . 2.472 1.708 3.236 rr_6e5k 1
84 1 . . . . . . 2.472 1.708 3.236 rr_6e5k 1
85 1 . . . . . . 2.475 1.709 3.241 rr_6e5k 1
86 1 . . . . . . 2.475 1.709 3.241 rr_6e5k 1
87 1 . . . . . . 2.477 1.710 3.244 rr_6e5k 1
88 1 . . . . . . 2.477 1.710 3.244 rr_6e5k 1
89 1 . . . . . . 2.484 1.713 3.255 rr_6e5k 1
90 1 . . . . . . 2.489 1.714 3.264 rr_6e5k 1
91 1 . . . . . . 2.493 1.716 3.270 rr_6e5k 1
92 1 . . . . . . 2.496 1.717 3.275 rr_6e5k 1
93 1 . . . . . . 2.502 1.720 3.284 rr_6e5k 1
94 1 . . . . . . 2.502 1.720 3.284 rr_6e5k 1
95 1 . . . . . . 2.502 1.720 3.284 rr_6e5k 1
96 1 . . . . . . 2.507 1.721 3.293 rr_6e5k 1
97 1 . . . . . . 2.507 1.721 3.293 rr_6e5k 1
98 1 . . . . . . 2.509 1.722 3.296 rr_6e5k 1
99 1 . . . . . . 2.530 1.730 3.330 rr_6e5k 1
100 1 . . . . . . 2.534 1.731 3.337 rr_6e5k 1
101 1 . . . . . . 2.536 1.732 3.340 rr_6e5k 1
102 1 . . . . . . 2.538 1.733 3.343 rr_6e5k 1
103 1 . . . . . . 2.546 1.736 3.356 rr_6e5k 1
104 1 . . . . . . 2.550 1.737 3.363 rr_6e5k 1
105 1 . . . . . . 2.563 1.742 3.384 rr_6e5k 1
106 2 . . . . . . 2.565 1.742 3.388 rr_6e5k 1
106 3 . . . . . . 2.565 1.742 3.388 rr_6e5k 1
106 4 . . . . . . 2.565 1.742 3.388 rr_6e5k 1
106 5 . . . . . . 2.565 1.742 3.388 rr_6e5k 1
107 1 . . . . . . 2.565 1.742 3.388 rr_6e5k 1
108 1 . . . . . . 2.570 1.745 3.395 rr_6e5k 1
109 1 . . . . . . 2.576 1.746 3.406 rr_6e5k 1
110 1 . . . . . . 2.579 1.748 3.410 rr_6e5k 1
111 1 . . . . . . 2.581 1.748 3.414 rr_6e5k 1
112 1 . . . . . . 2.585 1.749 3.421 rr_6e5k 1
113 1 . . . . . . 2.585 1.749 3.421 rr_6e5k 1
114 1 . . . . . . 2.595 1.753 3.437 rr_6e5k 1
115 2 . . . . . . 2.599 1.754 3.444 rr_6e5k 1
115 3 . . . . . . 2.599 1.754 3.444 rr_6e5k 1
116 1 . . . . . . 2.607 1.758 3.456 rr_6e5k 1
117 1 . . . . . . 2.616 1.760 3.472 rr_6e5k 1
118 2 . . . . . . 2.619 1.762 3.476 rr_6e5k 1
118 3 . . . . . . 2.619 1.762 3.476 rr_6e5k 1
119 1 . . . . . . 2.619 1.762 3.476 rr_6e5k 1
120 1 . . . . . . 2.621 1.762 3.480 rr_6e5k 1
121 1 . . . . . . 2.627 1.765 3.489 rr_6e5k 1
122 2 . . . . . . 2.629 1.765 3.493 rr_6e5k 1
122 3 . . . . . . 2.629 1.765 3.493 rr_6e5k 1
123 1 . . . . . . 2.632 1.766 3.498 rr_6e5k 1
124 1 . . . . . . 2.637 1.768 3.506 rr_6e5k 1
125 2 . . . . . . 2.642 1.769 3.515 rr_6e5k 1
125 3 . . . . . . 2.642 1.769 3.515 rr_6e5k 1
126 1 . . . . . . 2.642 1.769 3.515 rr_6e5k 1
127 1 . . . . . . 2.645 1.771 3.519 rr_6e5k 1
128 1 . . . . . . 2.645 1.771 3.519 rr_6e5k 1
129 2 . . . . . . 2.650 1.772 3.528 rr_6e5k 1
129 3 . . . . . . 2.650 1.772 3.528 rr_6e5k 1
130 1 . . . . . . 2.650 1.772 3.528 rr_6e5k 1
131 2 . . . . . . 2.650 1.772 3.528 rr_6e5k 1
131 3 . . . . . . 2.650 1.772 3.528 rr_6e5k 1
132 1 . . . . . . 2.653 1.773 3.533 rr_6e5k 1
133 1 . . . . . . 2.664 1.777 3.551 rr_6e5k 1
134 1 . . . . . . 2.664 1.777 3.551 rr_6e5k 1
135 2 . . . . . . 2.667 1.778 3.556 rr_6e5k 1
135 3 . . . . . . 2.667 1.778 3.556 rr_6e5k 1
136 1 . . . . . . 2.670 1.779 3.561 rr_6e5k 1
137 1 . . . . . . 2.676 1.781 3.571 rr_6e5k 1
138 1 . . . . . . 2.676 1.781 3.571 rr_6e5k 1
139 2 . . . . . . 2.676 1.781 3.571 rr_6e5k 1
139 3 . . . . . . 2.676 1.781 3.571 rr_6e5k 1
140 1 . . . . . . 2.685 1.784 3.586 rr_6e5k 1
141 2 . . . . . . 2.688 1.785 3.591 rr_6e5k 1
141 3 . . . . . . 2.688 1.785 3.591 rr_6e5k 1
142 1 . . . . . . 2.688 1.785 3.591 rr_6e5k 1
143 2 . . . . . . 2.694 1.787 3.601 rr_6e5k 1
143 3 . . . . . . 2.694 1.787 3.601 rr_6e5k 1
144 1 . . . . . . 2.697 1.788 3.606 rr_6e5k 1
145 1 . . . . . . 2.700 1.789 3.611 rr_6e5k 1
146 2 . . . . . . 2.700 1.789 3.611 rr_6e5k 1
146 3 . . . . . . 2.700 1.789 3.611 rr_6e5k 1
147 2 . . . . . . 2.703 1.790 3.616 rr_6e5k 1
147 3 . . . . . . 2.703 1.790 3.616 rr_6e5k 1
148 1 . . . . . . 2.706 1.791 3.621 rr_6e5k 1
149 1 . . . . . . 2.709 1.792 3.626 rr_6e5k 1
150 1 . . . . . . 2.719 1.795 3.643 rr_6e5k 1
151 1 . . . . . . 2.722 1.796 3.648 rr_6e5k 1
152 2 . . . . . . 2.722 1.796 3.648 rr_6e5k 1
152 3 . . . . . . 2.722 1.796 3.648 rr_6e5k 1
153 1 . . . . . . 2.722 1.796 3.648 rr_6e5k 1
154 1 . . . . . . 2.725 1.797 3.653 rr_6e5k 1
155 2 . . . . . . 2.725 1.797 3.653 rr_6e5k 1
155 3 . . . . . . 2.725 1.797 3.653 rr_6e5k 1
156 1 . . . . . . 2.729 1.798 3.660 rr_6e5k 1
157 1 . . . . . . 2.732 1.799 3.665 rr_6e5k 1
158 1 . . . . . . 2.735 1.800 3.670 rr_6e5k 1
159 1 . . . . . . 2.735 1.800 3.670 rr_6e5k 1
160 1 . . . . . . 2.739 1.801 3.677 rr_6e5k 1
161 1 . . . . . . 2.742 1.802 3.682 rr_6e5k 1
162 1 . . . . . . 2.742 1.802 3.682 rr_6e5k 1
163 1 . . . . . . 2.746 1.804 3.688 rr_6e5k 1
164 2 . . . . . . 2.749 1.804 3.694 rr_6e5k 1
164 3 . . . . . . 2.749 1.804 3.694 rr_6e5k 1
165 1 . . . . . . 2.749 1.804 3.694 rr_6e5k 1
166 1 . . . . . . 2.753 1.806 3.700 rr_6e5k 1
167 1 . . . . . . 2.753 1.806 3.700 rr_6e5k 1
168 1 . . . . . . 2.760 1.808 3.712 rr_6e5k 1
169 2 . . . . . . 2.764 1.809 3.719 rr_6e5k 1
169 3 . . . . . . 2.764 1.809 3.719 rr_6e5k 1
170 1 . . . . . . 2.767 1.810 3.724 rr_6e5k 1
171 1 . . . . . . 2.767 1.810 3.724 rr_6e5k 1
172 1 . . . . . . 2.775 1.813 3.737 rr_6e5k 1
173 1 . . . . . . 2.775 1.813 3.737 rr_6e5k 1
174 1 . . . . . . 2.782 1.814 3.750 rr_6e5k 1
175 1 . . . . . . 2.786 1.816 3.756 rr_6e5k 1
176 1 . . . . . . 2.802 1.821 3.783 rr_6e5k 1
177 2 . . . . . . 2.802 1.821 3.783 rr_6e5k 1
177 3 . . . . . . 2.802 1.821 3.783 rr_6e5k 1
178 1 . . . . . . 2.814 1.824 3.804 rr_6e5k 1
179 1 . . . . . . 2.818 1.825 3.811 rr_6e5k 1
180 1 . . . . . . 2.818 1.825 3.811 rr_6e5k 1
181 2 . . . . . . 2.827 1.828 3.826 rr_6e5k 1
181 3 . . . . . . 2.827 1.828 3.826 rr_6e5k 1
182 2 . . . . . . 2.827 1.828 3.826 rr_6e5k 1
182 3 . . . . . . 2.827 1.828 3.826 rr_6e5k 1
183 1 . . . . . . 2.836 1.831 3.841 rr_6e5k 1
184 1 . . . . . . 2.836 1.831 3.841 rr_6e5k 1
185 1 . . . . . . 2.836 1.831 3.841 rr_6e5k 1
186 1 . . . . . . 2.836 1.831 3.841 rr_6e5k 1
187 1 . . . . . . 2.844 1.833 3.855 rr_6e5k 1
188 1 . . . . . . 2.844 1.833 3.855 rr_6e5k 1
189 1 . . . . . . 2.844 1.833 3.855 rr_6e5k 1
190 1 . . . . . . 2.844 1.833 3.855 rr_6e5k 1
191 1 . . . . . . 2.849 1.834 3.864 rr_6e5k 1
192 1 . . . . . . 2.854 1.836 3.872 rr_6e5k 1
193 1 . . . . . . 2.858 1.837 3.879 rr_6e5k 1
194 1 . . . . . . 2.863 1.839 3.887 rr_6e5k 1
195 1 . . . . . . 2.863 1.839 3.887 rr_6e5k 1
196 1 . . . . . . 2.872 1.841 3.903 rr_6e5k 1
197 1 . . . . . . 2.874 1.842 3.906 rr_6e5k 1
198 1 . . . . . . 2.874 1.842 3.906 rr_6e5k 1
199 1 . . . . . . 2.878 1.842 3.914 rr_6e5k 1
200 2 . . . . . . 2.878 1.842 3.914 rr_6e5k 1
200 3 . . . . . . 2.878 1.842 3.914 rr_6e5k 1
201 1 . . . . . . 2.882 1.843 3.921 rr_6e5k 1
202 1 . . . . . . 2.883 1.844 3.922 rr_6e5k 1
203 1 . . . . . . 2.884 1.844 3.924 rr_6e5k 1
204 1 . . . . . . 2.884 1.844 3.924 rr_6e5k 1
205 2 . . . . . . 2.884 1.844 3.924 rr_6e5k 1
205 3 . . . . . . 2.884 1.844 3.924 rr_6e5k 1
206 1 . . . . . . 2.886 1.845 3.927 rr_6e5k 1
207 1 . . . . . . 2.889 1.846 3.932 rr_6e5k 1
208 1 . . . . . . 2.898 1.848 3.948 rr_6e5k 1
209 1 . . . . . . 2.908 1.851 3.965 rr_6e5k 1
210 1 . . . . . . 2.920 1.854 3.986 rr_6e5k 1
211 1 . . . . . . 2.925 1.855 3.995 rr_6e5k 1
212 2 . . . . . . 2.925 1.855 3.995 rr_6e5k 1
212 3 . . . . . . 2.925 1.855 3.995 rr_6e5k 1
213 1 . . . . . . 2.930 1.857 4.003 rr_6e5k 1
214 2 . . . . . . 2.932 1.858 4.006 rr_6e5k 1
214 3 . . . . . . 2.932 1.858 4.006 rr_6e5k 1
215 1 . . . . . . 2.936 1.858 4.014 rr_6e5k 1
216 2 . . . . . . 2.941 1.860 4.022 rr_6e5k 1
216 3 . . . . . . 2.941 1.860 4.022 rr_6e5k 1
217 1 . . . . . . 2.942 1.860 4.024 rr_6e5k 1
218 1 . . . . . . 2.942 1.860 4.024 rr_6e5k 1
219 1 . . . . . . 2.945 1.861 4.029 rr_6e5k 1
220 2 . . . . . . 2.948 1.862 4.034 rr_6e5k 1
220 3 . . . . . . 2.948 1.862 4.034 rr_6e5k 1
221 1 . . . . . . 2.956 1.864 4.048 rr_6e5k 1
222 1 . . . . . . 2.959 1.864 4.054 rr_6e5k 1
223 2 . . . . . . 2.959 1.864 4.054 rr_6e5k 1
223 3 . . . . . . 2.959 1.864 4.054 rr_6e5k 1
224 2 . . . . . . 2.962 1.865 4.059 rr_6e5k 1
224 3 . . . . . . 2.962 1.865 4.059 rr_6e5k 1
225 1 . . . . . . 2.967 1.867 4.067 rr_6e5k 1
226 2 . . . . . . 2.968 1.867 4.069 rr_6e5k 1
226 3 . . . . . . 2.968 1.867 4.069 rr_6e5k 1
227 1 . . . . . . 2.972 1.868 4.076 rr_6e5k 1
228 2 . . . . . . 2.973 1.868 4.078 rr_6e5k 1
228 3 . . . . . . 2.973 1.868 4.078 rr_6e5k 1
229 2 . . . . . . 2.974 1.868 4.080 rr_6e5k 1
229 3 . . . . . . 2.974 1.868 4.080 rr_6e5k 1
230 1 . . . . . . 2.980 1.870 4.090 rr_6e5k 1
231 1 . . . . . . 2.985 1.871 4.099 rr_6e5k 1
232 1 . . . . . . 2.992 1.873 4.111 rr_6e5k 1
233 2 . . . . . . 2.995 1.874 4.116 rr_6e5k 1
233 3 . . . . . . 2.995 1.874 4.116 rr_6e5k 1
234 1 . . . . . . 2.996 1.874 4.118 rr_6e5k 1
235 1 . . . . . . 2.996 1.874 4.118 rr_6e5k 1
236 1 . . . . . . 2.998 1.875 4.121 rr_6e5k 1
237 1 . . . . . . 3.012 1.878 4.146 rr_6e5k 1
238 1 . . . . . . 3.018 1.879 4.157 rr_6e5k 1
239 1 . . . . . . 3.019 1.879 4.159 rr_6e5k 1
240 1 . . . . . . 3.030 1.883 4.177 rr_6e5k 1
241 1 . . . . . . 3.041 1.885 4.197 rr_6e5k 1
242 2 . . . . . . 3.045 1.886 4.204 rr_6e5k 1
242 3 . . . . . . 3.045 1.886 4.204 rr_6e5k 1
242 4 . . . . . . 3.045 1.886 4.204 rr_6e5k 1
242 5 . . . . . . 3.045 1.886 4.204 rr_6e5k 1
243 1 . . . . . . 3.047 1.887 4.207 rr_6e5k 1
244 2 . . . . . . 3.050 1.888 4.212 rr_6e5k 1
244 3 . . . . . . 3.050 1.888 4.212 rr_6e5k 1
245 1 . . . . . . 3.063 1.890 4.236 rr_6e5k 1
246 1 . . . . . . 3.067 1.891 4.243 rr_6e5k 1
247 2 . . . . . . 3.067 1.891 4.243 rr_6e5k 1
247 3 . . . . . . 3.067 1.891 4.243 rr_6e5k 1
248 1 . . . . . . 3.069 1.892 4.246 rr_6e5k 1
249 1 . . . . . . 3.070 1.892 4.248 rr_6e5k 1
250 2 . . . . . . 3.074 1.893 4.255 rr_6e5k 1
250 3 . . . . . . 3.074 1.893 4.255 rr_6e5k 1
251 1 . . . . . . 3.081 1.894 4.268 rr_6e5k 1
252 1 . . . . . . 3.094 1.897 4.291 rr_6e5k 1
253 1 . . . . . . 3.105 1.900 4.310 rr_6e5k 1
254 1 . . . . . . 3.109 1.901 4.317 rr_6e5k 1
255 2 . . . . . . 3.112 1.901 4.323 rr_6e5k 1
255 3 . . . . . . 3.112 1.901 4.323 rr_6e5k 1
256 1 . . . . . . 3.116 1.902 4.330 rr_6e5k 1
257 1 . . . . . . 3.122 1.903 4.341 rr_6e5k 1
258 2 . . . . . . 3.127 1.904 4.350 rr_6e5k 1
258 3 . . . . . . 3.127 1.904 4.350 rr_6e5k 1
259 1 . . . . . . 3.130 1.905 4.355 rr_6e5k 1
260 1 . . . . . . 3.134 1.907 4.361 rr_6e5k 1
261 1 . . . . . . 3.135 1.906 4.364 rr_6e5k 1
262 1 . . . . . . 3.143 1.908 4.378 rr_6e5k 1
263 2 . . . . . . 3.144 1.908 4.380 rr_6e5k 1
263 3 . . . . . . 3.144 1.908 4.380 rr_6e5k 1
264 1 . . . . . . 3.150 1.910 4.390 rr_6e5k 1
265 2 . . . . . . 3.151 1.910 4.392 rr_6e5k 1
265 3 . . . . . . 3.151 1.910 4.392 rr_6e5k 1
266 2 . . . . . . 3.163 1.913 4.413 rr_6e5k 1
266 3 . . . . . . 3.163 1.913 4.413 rr_6e5k 1
267 1 . . . . . . 3.166 1.913 4.419 rr_6e5k 1
268 1 . . . . . . 3.168 1.913 4.423 rr_6e5k 1
269 1 . . . . . . 3.174 1.915 4.433 rr_6e5k 1
270 1 . . . . . . 3.176 1.915 4.437 rr_6e5k 1
271 1 . . . . . . 3.178 1.916 4.440 rr_6e5k 1
272 1 . . . . . . 3.179 1.916 4.442 rr_6e5k 1
273 1 . . . . . . 3.181 1.916 4.446 rr_6e5k 1
274 2 . . . . . . 3.184 1.917 4.451 rr_6e5k 1
274 3 . . . . . . 3.184 1.917 4.451 rr_6e5k 1
275 1 . . . . . . 3.191 1.918 4.464 rr_6e5k 1
276 2 . . . . . . 3.193 1.919 4.467 rr_6e5k 1
276 3 . . . . . . 3.193 1.919 4.467 rr_6e5k 1
277 1 . . . . . . 3.202 1.920 4.484 rr_6e5k 1
278 1 . . . . . . 3.205 1.921 4.489 rr_6e5k 1
279 1 . . . . . . 3.211 1.922 4.500 rr_6e5k 1
280 1 . . . . . . 3.214 1.922 4.506 rr_6e5k 1
281 1 . . . . . . 3.216 1.923 4.509 rr_6e5k 1
282 1 . . . . . . 3.219 1.924 4.514 rr_6e5k 1
283 1 . . . . . . 3.220 1.924 4.516 rr_6e5k 1
284 1 . . . . . . 3.221 1.924 4.518 rr_6e5k 1
285 2 . . . . . . 3.223 1.925 4.521 rr_6e5k 1
285 3 . . . . . . 3.223 1.925 4.521 rr_6e5k 1
286 2 . . . . . . 3.232 1.927 4.537 rr_6e5k 1
286 3 . . . . . . 3.232 1.927 4.537 rr_6e5k 1
287 1 . . . . . . 3.238 1.927 4.549 rr_6e5k 1
288 1 . . . . . . 3.248 1.929 4.567 rr_6e5k 1
289 2 . . . . . . 3.249 1.929 4.569 rr_6e5k 1
289 3 . . . . . . 3.249 1.929 4.569 rr_6e5k 1
290 1 . . . . . . 3.257 1.931 4.583 rr_6e5k 1
291 1 . . . . . . 3.257 1.931 4.583 rr_6e5k 1
292 1 . . . . . . 3.260 1.932 4.588 rr_6e5k 1
293 1 . . . . . . 3.260 1.932 4.588 rr_6e5k 1
294 1 . . . . . . 3.264 1.932 4.596 rr_6e5k 1
295 1 . . . . . . 3.269 1.933 4.605 rr_6e5k 1
296 1 . . . . . . 3.269 1.933 4.605 rr_6e5k 1
297 1 . . . . . . 3.276 1.934 4.618 rr_6e5k 1
298 2 . . . . . . 3.280 1.935 4.625 rr_6e5k 1
298 3 . . . . . . 3.280 1.935 4.625 rr_6e5k 1
299 1 . . . . . . 3.286 1.936 4.636 rr_6e5k 1
300 2 . . . . . . 3.288 1.936 4.640 rr_6e5k 1
300 3 . . . . . . 3.288 1.936 4.640 rr_6e5k 1
301 1 . . . . . . 3.292 1.937 4.647 rr_6e5k 1
302 1 . . . . . . 3.293 1.937 4.649 rr_6e5k 1
303 2 . . . . . . 3.296 1.938 4.654 rr_6e5k 1
303 3 . . . . . . 3.296 1.938 4.654 rr_6e5k 1
304 2 . . . . . . 3.297 1.938 4.656 rr_6e5k 1
304 3 . . . . . . 3.297 1.938 4.656 rr_6e5k 1
305 1 . . . . . . 3.298 1.938 4.658 rr_6e5k 1
306 2 . . . . . . 3.301 1.939 4.663 rr_6e5k 1
306 3 . . . . . . 3.301 1.939 4.663 rr_6e5k 1
307 1 . . . . . . 3.301 1.939 4.663 rr_6e5k 1
308 1 . . . . . . 3.305 1.940 4.670 rr_6e5k 1
309 1 . . . . . . 3.319 1.942 4.696 rr_6e5k 1
310 2 . . . . . . 3.320 1.942 4.698 rr_6e5k 1
310 3 . . . . . . 3.320 1.942 4.698 rr_6e5k 1
311 1 . . . . . . 3.320 1.942 4.698 rr_6e5k 1
312 2 . . . . . . 3.326 1.944 4.708 rr_6e5k 1
312 3 . . . . . . 3.326 1.944 4.708 rr_6e5k 1
313 1 . . . . . . 3.328 1.943 4.713 rr_6e5k 1
314 1 . . . . . . 3.348 1.947 4.749 rr_6e5k 1
315 1 . . . . . . 3.348 1.947 4.749 rr_6e5k 1
316 2 . . . . . . 3.349 1.947 4.751 rr_6e5k 1
316 3 . . . . . . 3.349 1.947 4.751 rr_6e5k 1
317 1 . . . . . . 3.363 1.949 4.777 rr_6e5k 1
318 1 . . . . . . 3.369 1.950 4.788 rr_6e5k 1
319 1 . . . . . . 3.370 1.950 4.790 rr_6e5k 1
320 1 . . . . . . 3.378 1.952 4.804 rr_6e5k 1
321 1 . . . . . . 3.379 1.952 4.806 rr_6e5k 1
322 2 . . . . . . 3.382 1.952 4.812 rr_6e5k 1
322 3 . . . . . . 3.382 1.952 4.812 rr_6e5k 1
323 1 . . . . . . 3.390 1.954 4.826 rr_6e5k 1
324 2 . . . . . . 3.391 1.953 4.829 rr_6e5k 1
324 3 . . . . . . 3.391 1.953 4.829 rr_6e5k 1
324 4 . . . . . . 3.391 1.953 4.829 rr_6e5k 1
324 5 . . . . . . 3.391 1.953 4.829 rr_6e5k 1
325 1 . . . . . . 3.398 1.955 4.841 rr_6e5k 1
326 1 . . . . . . 3.404 1.956 4.852 rr_6e5k 1
327 1 . . . . . . 3.407 1.956 4.858 rr_6e5k 1
328 1 . . . . . . 3.407 1.956 4.858 rr_6e5k 1
329 1 . . . . . . 3.415 1.957 4.873 rr_6e5k 1
330 1 . . . . . . 3.417 1.958 4.876 rr_6e5k 1
331 1 . . . . . . 3.423 1.958 4.888 rr_6e5k 1
332 2 . . . . . . 3.428 1.959 4.897 rr_6e5k 1
332 3 . . . . . . 3.428 1.959 4.897 rr_6e5k 1
333 1 . . . . . . 3.431 1.959 4.903 rr_6e5k 1
334 2 . . . . . . 3.431 1.959 4.903 rr_6e5k 1
334 3 . . . . . . 3.431 1.959 4.903 rr_6e5k 1
335 1 . . . . . . 3.441 1.961 4.921 rr_6e5k 1
336 1 . . . . . . 3.443 1.961 4.925 rr_6e5k 1
337 1 . . . . . . 3.446 1.961 4.931 rr_6e5k 1
338 1 . . . . . . 3.455 1.963 4.947 rr_6e5k 1
339 1 . . . . . . 3.457 1.963 4.951 rr_6e5k 1
340 2 . . . . . . 3.459 1.964 4.954 rr_6e5k 1
340 3 . . . . . . 3.459 1.964 4.954 rr_6e5k 1
341 1 . . . . . . 3.460 1.963 4.957 rr_6e5k 1
342 1 . . . . . . 3.462 1.964 4.960 rr_6e5k 1
343 1 . . . . . . 3.466 1.965 4.967 rr_6e5k 1
344 1 . . . . . . 3.469 1.964 4.974 rr_6e5k 1
345 1 . . . . . . 3.477 1.966 4.988 rr_6e5k 1
346 1 . . . . . . 3.478 1.966 4.990 rr_6e5k 1
347 1 . . . . . . 3.497 1.968 5.026 rr_6e5k 1
348 2 . . . . . . 3.509 1.970 5.048 rr_6e5k 1
348 3 . . . . . . 3.509 1.970 5.048 rr_6e5k 1
349 1 . . . . . . 3.514 1.970 5.058 rr_6e5k 1
350 2 . . . . . . 3.526 1.972 5.080 rr_6e5k 1
350 3 . . . . . . 3.526 1.972 5.080 rr_6e5k 1
351 2 . . . . . . 3.555 1.975 5.135 rr_6e5k 1
351 3 . . . . . . 3.555 1.975 5.135 rr_6e5k 1
352 1 . . . . . . 3.564 1.976 5.152 rr_6e5k 1
353 1 . . . . . . 3.566 1.976 5.156 rr_6e5k 1
354 1 . . . . . . 3.568 1.976 5.160 rr_6e5k 1
355 1 . . . . . . 3.577 1.978 5.176 rr_6e5k 1
356 2 . . . . . . 3.586 1.979 5.193 rr_6e5k 1
356 3 . . . . . . 3.586 1.979 5.193 rr_6e5k 1
357 1 . . . . . . 3.588 1.978 5.198 rr_6e5k 1
358 1 . . . . . . 3.600 1.980 5.220 rr_6e5k 1
359 1 . . . . . . 3.607 1.981 5.233 rr_6e5k 1
360 2 . . . . . . 3.612 1.982 5.242 rr_6e5k 1
360 3 . . . . . . 3.612 1.982 5.242 rr_6e5k 1
361 1 . . . . . . 3.621 1.982 5.260 rr_6e5k 1
362 1 . . . . . . 3.621 1.982 5.260 rr_6e5k 1
363 2 . . . . . . 3.638 1.983 5.293 rr_6e5k 1
363 3 . . . . . . 3.638 1.983 5.293 rr_6e5k 1
364 1 . . . . . . 3.641 1.984 5.298 rr_6e5k 1
365 2 . . . . . . 3.643 1.984 5.302 rr_6e5k 1
365 3 . . . . . . 3.643 1.984 5.302 rr_6e5k 1
366 1 . . . . . . 3.646 1.984 5.308 rr_6e5k 1
367 1 . . . . . . 3.651 1.985 5.317 rr_6e5k 1
368 1 . . . . . . 3.664 1.986 5.342 rr_6e5k 1
369 1 . . . . . . 3.669 1.986 5.352 rr_6e5k 1
370 1 . . . . . . 3.672 1.986 5.358 rr_6e5k 1
371 2 . . . . . . 3.675 1.987 5.363 rr_6e5k 1
371 3 . . . . . . 3.675 1.987 5.363 rr_6e5k 1
372 2 . . . . . . 3.697 1.989 5.405 rr_6e5k 1
372 3 . . . . . . 3.697 1.989 5.405 rr_6e5k 1
373 2 . . . . . . 3.702 1.989 5.415 rr_6e5k 1
373 3 . . . . . . 3.702 1.989 5.415 rr_6e5k 1
374 1 . . . . . . 3.720 1.991 5.449 rr_6e5k 1
375 1 . . . . . . 3.720 1.991 5.449 rr_6e5k 1
376 1 . . . . . . 3.731 1.991 5.471 rr_6e5k 1
377 2 . . . . . . 3.731 1.991 5.471 rr_6e5k 1
377 3 . . . . . . 3.731 1.991 5.471 rr_6e5k 1
378 1 . . . . . . 3.734 1.991 5.477 rr_6e5k 1
379 1 . . . . . . 3.753 1.993 5.513 rr_6e5k 1
380 1 . . . . . . 3.759 1.993 5.525 rr_6e5k 1
381 2 . . . . . . 3.762 1.993 5.531 rr_6e5k 1
381 3 . . . . . . 3.762 1.993 5.531 rr_6e5k 1
382 1 . . . . . . 3.772 1.994 5.550 rr_6e5k 1
383 1 . . . . . . 3.785 1.994 5.576 rr_6e5k 1
384 1 . . . . . . 3.802 1.995 5.609 rr_6e5k 1
385 1 . . . . . . 3.815 1.995 5.635 rr_6e5k 1
386 2 . . . . . . 3.822 1.996 5.648 rr_6e5k 1
386 3 . . . . . . 3.822 1.996 5.648 rr_6e5k 1
387 2 . . . . . . 3.830 1.997 5.663 rr_6e5k 1
387 3 . . . . . . 3.830 1.997 5.663 rr_6e5k 1
388 1 . . . . . . 3.830 1.997 5.663 rr_6e5k 1
389 1 . . . . . . 3.851 1.997 5.705 rr_6e5k 1
390 1 . . . . . . 3.863 1.998 5.728 rr_6e5k 1
391 1 . . . . . . 3.878 1.998 5.758 rr_6e5k 1
392 1 . . . . . . 3.898 1.999 5.797 rr_6e5k 1
393 2 . . . . . . 3.906 1.999 5.813 rr_6e5k 1
393 3 . . . . . . 3.906 1.999 5.813 rr_6e5k 1
394 1 . . . . . . 3.932 2.000 5.864 rr_6e5k 1
395 2 . . . . . . 3.972 2.000 5.944 rr_6e5k 1
395 3 . . . . . . 3.972 2.000 5.944 rr_6e5k 1
396 1 . . . . . . 3.995 2.000 5.990 rr_6e5k 1
397 2 . . . . . . 4.030 2.000 6.060 rr_6e5k 1
397 3 . . . . . . 4.030 2.000 6.060 rr_6e5k 1
398 2 . . . . . . 4.107 1.999 6.215 rr_6e5k 1
398 3 . . . . . . 4.107 1.999 6.215 rr_6e5k 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 "# Restraints file 1: unambig.tbl" 1 1 1 32 rr_6e5k 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 "spec=NOESY, no=3, id=0, vol=3.200000e+08" 2 127 2 169 rr_6e5k 1
2 "spec=NOESY, no=4, id=1, vol=2.690000e+08" 3 127 3 169 rr_6e5k 1
3 "spec=NOESY, no=5, id=2, vol=2.430000e+08" 4 127 4 169 rr_6e5k 1
4 "spec=NOESY, no=6, id=3, vol=2.160000e+08" 5 127 5 169 rr_6e5k 1
5 "spec=NOESY, no=7, id=4, vol=2.040000e+08" 6 127 6 169 rr_6e5k 1
6 "spec=NOESY, no=8, id=5, vol=1.970000e+08" 7 127 7 169 rr_6e5k 1
7 "spec=NOESY, no=9, id=6, vol=1.940000e+08" 8 127 8 169 rr_6e5k 1
8 "spec=NOESY, no=10, id=7, vol=1.830000e+08" 9 127 9 170 rr_6e5k 1
9 "spec=NOESY, no=11, id=8, vol=1.820000e+08" 10 127 10 170 rr_6e5k 1
10 "spec=NOESY, no=12, id=9, vol=1.810000e+08" 11 127 11 170 rr_6e5k 1
11 "spec=NOESY, no=13, id=10, vol=1.750000e+08" 12 127 12 171 rr_6e5k 1
12 "spec=NOESY, no=14, id=11, vol=1.590000e+08" 13 127 13 171 rr_6e5k 1
13 "spec=NOESY, no=15, id=12, vol=1.580000e+08" 14 127 14 171 rr_6e5k 1
14 "spec=NOESY, no=16, id=13, vol=1.550000e+08" 15 127 15 171 rr_6e5k 1
15 "spec=NOESY, no=17, id=14, vol=1.390000e+08" 16 127 16 171 rr_6e5k 1
16 "spec=NOESY, no=19, id=16, vol=1.060000e+08" 18 127 18 171 rr_6e5k 1
17 "spec=NOESY, no=18, id=15, vol=1.320000e+08" 17 127 17 171 rr_6e5k 1
18 "spec=NOESY, no=20, id=17, vol=9.970000e+07" 21 127 21 171 rr_6e5k 1
19 "spec=NOESY, no=21, id=18, vol=9.550000e+07" 24 127 24 171 rr_6e5k 1
20 "spec=NOESY, no=22, id=19, vol=9.200000e+07" 28 127 28 171 rr_6e5k 1
21 "spec=NOESY, no=24, id=21, vol=7.800000e+07" 33 127 33 171 rr_6e5k 1
22 "spec=NOESY, no=23, id=20, vol=8.230000e+07" 32 127 32 171 rr_6e5k 1
23 "spec=NOESY, no=26, id=23, vol=7.610000e+07" 37 127 37 171 rr_6e5k 1
24 "spec=NOESY, no=25, id=22, vol=7.790000e+07" 36 127 36 171 rr_6e5k 1
25 "spec=NOESY, no=27, id=24, vol=6.970000e+07" 39 127 39 171 rr_6e5k 1
26 "spec=NOESY, no=28, id=25, vol=6.960000e+07" 40 127 40 171 rr_6e5k 1
27 "spec=NOESY, no=29, id=26, vol=6.930000e+07" 41 127 41 171 rr_6e5k 1
28 "spec=NOESY, no=31, id=28, vol=5.970000e+07" 42 127 42 171 rr_6e5k 1
29 "spec=NOESY, no=32, id=29, vol=5.810000e+07" 43 127 43 171 rr_6e5k 1
30 "spec=NOESY, no=33, id=30, vol=5.510000e+07" 44 127 44 171 rr_6e5k 1
31 "spec=NOESY, no=35, id=32, vol=5.020000e+07" 46 127 46 171 rr_6e5k 1
32 "spec=NOESY, no=34, id=31, vol=5.380000e+07" 45 127 45 171 rr_6e5k 1
33 "spec=NOESY, no=36, id=33, vol=4.940000e+07" 49 127 49 171 rr_6e5k 1
34 "spec=NOESY, no=37, id=34, vol=4.920000e+07" 58 127 58 171 rr_6e5k 1
35 "spec=NOESY, no=40, id=37, vol=4.480000e+07" 62 127 62 171 rr_6e5k 1
36 "spec=NOESY, no=39, id=36, vol=4.540000e+07" 61 127 61 171 rr_6e5k 1
37 "spec=NOESY, no=42, id=39, vol=4.320000e+07" 65 127 65 171 rr_6e5k 1
38 "spec=NOESY, no=44, id=41, vol=4.210000e+07" 71 127 71 171 rr_6e5k 1
39 "spec=NOESY, no=45, id=42, vol=4.160000e+07" 73 127 73 171 rr_6e5k 1
40 "spec=NOESY, no=46, id=43, vol=4.130000e+07" 76 127 76 171 rr_6e5k 1
41 "spec=NOESY, no=47, id=44, vol=4.120000e+07" 79 127 79 171 rr_6e5k 1
42 "spec=NOESY, no=49, id=46, vol=4.080000e+07" 81 127 81 171 rr_6e5k 1
43 "spec=NOESY, no=48, id=45, vol=4.100000e+07" 80 127 80 171 rr_6e5k 1
44 "spec=NOESY, no=50, id=47, vol=4.030000e+07" 83 127 83 171 rr_6e5k 1
45 "spec=NOESY, no=51, id=48, vol=3.820000e+07" 87 127 87 171 rr_6e5k 1
46 "spec=NOESY, no=52, id=49, vol=3.780000e+07" 89 127 89 171 rr_6e5k 1
47 "spec=NOESY, no=53, id=50, vol=3.750000e+07" 91 127 91 171 rr_6e5k 1
48 "spec=NOESY, no=54, id=51, vol=3.710000e+07" 93 127 93 171 rr_6e5k 1
49 "spec=NOESY, no=56, id=53, vol=3.560000e+07" 95 127 95 171 rr_6e5k 1
50 "spec=NOESY, no=57, id=54, vol=3.530000e+07" 98 127 98 171 rr_6e5k 1
51 "spec=NOESY, no=58, id=55, vol=3.460000e+07" 99 127 99 171 rr_6e5k 1
52 "spec=NOESY, no=59, id=56, vol=3.450000e+07" 100 127 100 171 rr_6e5k 1
53 "spec=NOESY, no=61, id=58, vol=3.410000e+07" 102 127 102 171 rr_6e5k 1
54 "spec=NOESY, no=60, id=57, vol=3.420000e+07" 101 127 101 171 rr_6e5k 1
55 "spec=NOESY, no=62, id=59, vol=3.390000e+07" 104 127 104 171 rr_6e5k 1
56 "spec=NOESY, no=65, id=62, vol=3.310000e+07" 106 127 106 171 rr_6e5k 1
57 "spec=NOESY, no=64, id=61, vol=3.330000e+07" 105 127 105 171 rr_6e5k 1
58 "spec=NOESY, no=67, id=64, vol=3.260000e+07" 108 127 108 171 rr_6e5k 1
59 "spec=NOESY, no=68, id=65, vol=3.190000e+07" 110 127 110 171 rr_6e5k 1
60 "spec=NOESY, no=70, id=67, vol=3.050000e+07" 113 127 113 171 rr_6e5k 1
61 "spec=NOESY, no=69, id=66, vol=3.120000e+07" 112 127 112 171 rr_6e5k 1
62 "spec=NOESY, no=71, id=68, vol=3.010000e+07" 115 127 115 171 rr_6e5k 1
63 "spec=NOESY, no=73, id=70, vol=3.000000e+07" 125 127 125 171 rr_6e5k 1
64 "spec=NOESY, no=72, id=69, vol=3.010000e+07" 124 127 124 171 rr_6e5k 1
65 "spec=NOESY, no=74, id=71, vol=3.000000e+07" 128 127 128 171 rr_6e5k 1
66 "spec=NOESY, no=75, id=72, vol=3.000000e+07" 130 127 130 171 rr_6e5k 1
67 "spec=NOESY, no=76, id=73, vol=2.980000e+07" 132 127 132 171 rr_6e5k 1
68 "spec=NOESY, no=78, id=75, vol=2.960000e+07" 134 127 134 171 rr_6e5k 1
69 "spec=NOESY, no=77, id=74, vol=2.960000e+07" 133 127 133 171 rr_6e5k 1
70 "spec=NOESY, no=79, id=76, vol=2.900000e+07" 138 127 138 171 rr_6e5k 1
71 "spec=NOESY, no=81, id=78, vol=2.850000e+07" 141 127 141 171 rr_6e5k 1
72 "spec=NOESY, no=82, id=79, vol=2.810000e+07" 143 127 143 171 rr_6e5k 1
73 "spec=NOESY, no=83, id=80, vol=2.810000e+07" 144 127 144 171 rr_6e5k 1
74 "spec=NOESY, no=84, id=81, vol=2.770000e+07" 145 127 145 171 rr_6e5k 1
75 "spec=NOESY, no=85, id=82, vol=2.750000e+07" 146 127 146 171 rr_6e5k 1
76 "spec=NOESY, no=87, id=84, vol=2.720000e+07" 148 127 148 171 rr_6e5k 1
77 "spec=NOESY, no=86, id=83, vol=2.750000e+07" 147 127 147 171 rr_6e5k 1
78 "spec=NOESY, no=88, id=85, vol=2.720000e+07" 151 127 151 171 rr_6e5k 1
79 "spec=NOESY, no=89, id=86, vol=2.690000e+07" 155 127 155 171 rr_6e5k 1
80 "spec=NOESY, no=90, id=87, vol=2.680000e+07" 164 127 164 171 rr_6e5k 1
81 "spec=NOESY, no=91, id=88, vol=2.680000e+07" 167 127 167 171 rr_6e5k 1
82 "spec=NOESY, no=92, id=89, vol=2.660000e+07" 170 127 170 171 rr_6e5k 1
83 "spec=NOESY, no=93, id=90, vol=2.640000e+07" 171 127 171 171 rr_6e5k 1
84 "spec=NOESY, no=95, id=92, vol=2.620000e+07" 173 127 173 171 rr_6e5k 1
85 "spec=NOESY, no=94, id=91, vol=2.620000e+07" 172 127 172 171 rr_6e5k 1
86 "spec=NOESY, no=97, id=94, vol=2.580000e+07" 176 127 176 171 rr_6e5k 1
87 "spec=NOESY, no=96, id=93, vol=2.590000e+07" 175 127 175 171 rr_6e5k 1
88 "spec=NOESY, no=98, id=95, vol=2.520000e+07" 179 127 179 171 rr_6e5k 1
89 "spec=NOESY, no=99, id=96, vol=2.520000e+07" 180 127 180 171 rr_6e5k 1
90 "spec=NOESY, no=101, id=98, vol=2.510000e+07" 182 127 182 172 rr_6e5k 1
91 "spec=NOESY, no=100, id=97, vol=2.510000e+07" 181 127 181 172 rr_6e5k 1
92 "spec=NOESY, no=102, id=99, vol=2.490000e+07" 188 127 188 172 rr_6e5k 1
93 "spec=NOESY, no=104, id=101, vol=2.460000e+07" 190 127 190 173 rr_6e5k 1
94 "spec=NOESY, no=103, id=100, vol=2.460000e+07" 189 127 189 173 rr_6e5k 1
95 "spec=NOESY, no=105, id=102, vol=2.440000e+07" 193 127 193 173 rr_6e5k 1
96 "spec=NOESY, no=106, id=103, vol=2.440000e+07" 196 127 196 173 rr_6e5k 1
97 "spec=NOESY, no=108, id=105, vol=2.430000e+07" 198 127 198 173 rr_6e5k 1
98 "spec=NOESY, no=107, id=104, vol=2.430000e+07" 197 127 197 173 rr_6e5k 1
99 "spec=NOESY, no=110, id=107, vol=2.390000e+07" 201 127 201 173 rr_6e5k 1
100 "spec=NOESY, no=111, id=108, vol=2.360000e+07" 202 127 202 173 rr_6e5k 1
101 "spec=NOESY, no=112, id=109, vol=2.340000e+07" 203 127 203 173 rr_6e5k 1
102 "spec=NOESY, no=113, id=110, vol=2.320000e+07" 204 127 204 173 rr_6e5k 1
103 "spec=NOESY, no=114, id=111, vol=2.290000e+07" 205 127 205 173 rr_6e5k 1
104 "spec=NOESY, no=115, id=112, vol=2.290000e+07" 206 127 206 173 rr_6e5k 1
105 "spec=NOESY, no=116, id=113, vol=2.290000e+07" 207 127 207 173 rr_6e5k 1
106 "spec=NOESY, no=117, id=114, vol=2.260000e+07" 208 127 208 173 rr_6e5k 1
107 "spec=NOESY, no=118, id=115, vol=2.260000e+07" 209 127 209 173 rr_6e5k 1
108 "spec=NOESY, no=121, id=118, vol=2.190000e+07" 211 127 211 173 rr_6e5k 1
109 "spec=NOESY, no=119, id=116, vol=2.250000e+07" 210 127 210 173 rr_6e5k 1
110 "spec=NOESY, no=122, id=119, vol=2.140000e+07" 217 127 217 173 rr_6e5k 1
111 "spec=NOESY, no=123, id=120, vol=2.120000e+07" 220 127 220 173 rr_6e5k 1
112 "spec=NOESY, no=124, id=121, vol=2.110000e+07" 221 127 221 173 rr_6e5k 1
113 "spec=NOESY, no=126, id=123, vol=2.100000e+07" 223 127 223 173 rr_6e5k 1
114 "spec=NOESY, no=125, id=122, vol=2.100000e+07" 222 127 222 173 rr_6e5k 1
115 "spec=NOESY, no=127, id=124, vol=2.060000e+07" 226 127 226 173 rr_6e5k 1
116 "spec=NOESY, no=128, id=125, vol=2.040000e+07" 235 127 235 173 rr_6e5k 1
117 "spec=NOESY, no=129, id=126, vol=1.980000e+07" 238 127 238 173 rr_6e5k 1
118 "spec=NOESY, no=130, id=127, vol=1.970000e+07" 241 127 241 173 rr_6e5k 1
119 "spec=NOESY, no=131, id=128, vol=1.970000e+07" 245 127 245 173 rr_6e5k 1
120 "spec=NOESY, no=132, id=129, vol=1.950000e+07" 246 127 246 173 rr_6e5k 1
121 "spec=NOESY, no=133, id=130, vol=1.920000e+07" 247 127 247 173 rr_6e5k 1
122 "spec=NOESY, no=134, id=131, vol=1.910000e+07" 248 127 248 173 rr_6e5k 1
123 "spec=NOESY, no=135, id=132, vol=1.900000e+07" 249 127 249 173 rr_6e5k 1
124 "spec=NOESY, no=136, id=133, vol=1.880000e+07" 250 127 250 173 rr_6e5k 1
125 "spec=NOESY, no=138, id=135, vol=1.870000e+07" 252 127 252 173 rr_6e5k 1
126 "spec=NOESY, no=137, id=134, vol=1.880000e+07" 251 127 251 173 rr_6e5k 1
127 "spec=NOESY, no=140, id=137, vol=1.820000e+07" 256 127 256 173 rr_6e5k 1
128 "spec=NOESY, no=139, id=136, vol=1.840000e+07" 255 127 255 173 rr_6e5k 1
129 "spec=NOESY, no=142, id=139, vol=1.750000e+07" 259 127 259 173 rr_6e5k 1
130 "spec=NOESY, no=141, id=138, vol=1.790000e+07" 258 127 258 173 rr_6e5k 1
131 "spec=NOESY, no=143, id=140, vol=1.740000e+07" 262 127 262 173 rr_6e5k 1
132 "spec=NOESY, no=146, id=143, vol=1.730000e+07" 269 127 269 173 rr_6e5k 1
133 "spec=NOESY, no=144, id=141, vol=1.740000e+07" 268 127 268 173 rr_6e5k 1
134 "spec=NOESY, no=149, id=146, vol=1.700000e+07" 273 127 273 173 rr_6e5k 1
135 "spec=NOESY, no=147, id=144, vol=1.710000e+07" 272 127 272 173 rr_6e5k 1
136 "spec=NOESY, no=150, id=147, vol=1.690000e+07" 275 127 275 173 rr_6e5k 1
137 "spec=NOESY, no=152, id=149, vol=1.650000e+07" 277 127 277 173 rr_6e5k 1
138 "spec=NOESY, no=151, id=148, vol=1.670000e+07" 276 127 276 173 rr_6e5k 1
139 "spec=NOESY, no=153, id=150, vol=1.650000e+07" 279 127 279 173 rr_6e5k 1
140 "spec=NOESY, no=154, id=151, vol=1.650000e+07" 282 127 282 173 rr_6e5k 1
141 "spec=NOESY, no=155, id=152, vol=1.640000e+07" 283 127 283 173 rr_6e5k 1
142 "spec=NOESY, no=158, id=155, vol=1.620000e+07" 285 127 285 173 rr_6e5k 1
143 "spec=NOESY, no=156, id=153, vol=1.640000e+07" 284 127 284 173 rr_6e5k 1
144 "spec=NOESY, no=160, id=157, vol=1.620000e+07" 292 127 292 173 rr_6e5k 1
145 "spec=NOESY, no=159, id=156, vol=1.620000e+07" 291 127 291 173 rr_6e5k 1
146 "spec=NOESY, no=162, id=159, vol=1.570000e+07" 295 127 295 173 rr_6e5k 1
147 "spec=NOESY, no=161, id=158, vol=1.610000e+07" 294 127 294 173 rr_6e5k 1
148 "spec=NOESY, no=164, id=161, vol=1.560000e+07" 305 127 305 173 rr_6e5k 1
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347 "spec=NOESY, no=408, id=403, vol=3.830000e+06" 712 127 712 173 rr_6e5k 1
348 "spec=NOESY, no=407, id=402, vol=3.840000e+06" 711 127 711 173 rr_6e5k 1
349 "spec=NOESY, no=409, id=404, vol=3.810000e+06" 715 127 715 173 rr_6e5k 1
350 "spec=NOESY, no=410, id=405, vol=3.780000e+06" 721 127 721 173 rr_6e5k 1
351 "spec=NOESY, no=412, id=407, vol=3.750000e+06" 723 127 723 173 rr_6e5k 1
352 "spec=NOESY, no=411, id=406, vol=3.770000e+06" 722 127 722 173 rr_6e5k 1
353 "spec=NOESY, no=415, id=410, vol=3.690000e+06" 730 127 730 173 rr_6e5k 1
354 "spec=NOESY, no=414, id=409, vol=3.700000e+06" 729 127 729 173 rr_6e5k 1
355 "spec=NOESY, no=416, id=411, vol=3.690000e+06" 736 127 736 173 rr_6e5k 1
356 "spec=NOESY, no=417, id=412, vol=3.650000e+06" 740 127 740 173 rr_6e5k 1
357 "spec=NOESY, no=418, id=413, vol=3.650000e+06" 741 127 741 173 rr_6e5k 1
358 "spec=NOESY, no=420, id=415, vol=3.610000e+06" 742 127 742 173 rr_6e5k 1
359 "spec=NOESY, no=421, id=416, vol=3.590000e+06" 743 127 743 173 rr_6e5k 1
360 "spec=NOESY, no=423, id=418, vol=3.540000e+06" 745 127 745 173 rr_6e5k 1
361 "spec=NOESY, no=422, id=417, vol=3.590000e+06" 744 127 744 173 rr_6e5k 1
362 "spec=NOESY, no=424, id=419, vol=3.530000e+06" 748 127 748 173 rr_6e5k 1
363 "spec=NOESY, no=426, id=421, vol=3.490000e+06" 751 127 751 173 rr_6e5k 1
364 "spec=NOESY, no=428, id=422, vol=3.460000e+06" 754 127 754 173 rr_6e5k 1
365 "spec=NOESY, no=430, id=424, vol=3.440000e+06" 757 127 757 173 rr_6e5k 1
366 "spec=NOESY, no=429, id=423, vol=3.440000e+06" 756 127 756 173 rr_6e5k 1
367 "spec=NOESY, no=432, id=426, vol=3.370000e+06" 760 127 760 173 rr_6e5k 1
368 "spec=NOESY, no=431, id=425, vol=3.380000e+06" 759 127 759 173 rr_6e5k 1
369 "spec=NOESY, no=433, id=427, vol=3.350000e+06" 763 127 763 173 rr_6e5k 1
370 "spec=NOESY, no=434, id=428, vol=3.300000e+06" 764 127 764 173 rr_6e5k 1
371 "spec=NOESY, no=436, id=430, vol=3.280000e+06" 766 127 766 173 rr_6e5k 1
372 "spec=NOESY, no=435, id=429, vol=3.290000e+06" 765 127 765 173 rr_6e5k 1
373 "spec=NOESY, no=437, id=431, vol=3.270000e+06" 768 127 768 173 rr_6e5k 1
374 "spec=NOESY, no=438, id=432, vol=3.260000e+06" 771 127 771 173 rr_6e5k 1
375 "spec=NOESY, no=439, id=433, vol=3.240000e+06" 774 127 774 173 rr_6e5k 1
376 "spec=NOESY, no=440, id=434, vol=3.220000e+06" 777 127 777 173 rr_6e5k 1
377 "spec=NOESY, no=444, id=438, vol=3.180000e+06" 779 127 779 173 rr_6e5k 1
378 "spec=NOESY, no=443, id=437, vol=3.180000e+06" 778 127 778 173 rr_6e5k 1
379 "spec=NOESY, no=445, id=439, vol=3.170000e+06" 782 127 782 173 rr_6e5k 1
380 "spec=NOESY, no=448, id=442, vol=3.010000e+06" 786 127 786 173 rr_6e5k 1
381 "spec=NOESY, no=447, id=441, vol=3.070000e+06" 785 127 785 173 rr_6e5k 1
382 "spec=NOESY, no=451, id=445, vol=2.920000e+06" 789 127 789 173 rr_6e5k 1
383 "spec=NOESY, no=449, id=443, vol=2.980000e+06" 788 127 788 173 rr_6e5k 1
384 "spec=NOESY, no=452, id=446, vol=2.780000e+06" 791 127 791 173 rr_6e5k 1
385 "spec=NOESY, no=454, id=448, vol=2.730000e+06" 794 127 794 173 rr_6e5k 1
386 "spec=NOESY, no=453, id=447, vol=2.740000e+06" 793 127 793 173 rr_6e5k 1
387 "spec=NOESY, no=456, id=450, vol=2.720000e+06" 797 127 797 173 rr_6e5k 1
388 "spec=NOESY, no=458, id=452, vol=2.640000e+06" 801 127 801 173 rr_6e5k 1
389 "spec=NOESY, no=457, id=451, vol=2.680000e+06" 800 127 800 173 rr_6e5k 1
390 "spec=NOESY, no=459, id=453, vol=2.630000e+06" 807 127 807 173 rr_6e5k 1
391 "spec=NOESY, no=461, id=454, vol=2.590000e+06" 810 127 810 173 rr_6e5k 1
392 "spec=NOESY, no=462, id=455, vol=2.580000e+06" 813 127 813 173 rr_6e5k 1
393 "spec=NOESY, no=463, id=456, vol=2.550000e+06" 816 127 816 173 rr_6e5k 1
394 "spec=NOESY, no=464, id=457, vol=2.530000e+06" 819 127 819 173 rr_6e5k 1
395 "spec=NOESY, no=465, id=458, vol=2.490000e+06" 825 127 825 173 rr_6e5k 1
396 "spec=NOESY, no=470, id=463, vol=2.420000e+06" 827 127 827 173 rr_6e5k 1
397 "spec=NOESY, no=466, id=459, vol=2.490000e+06" 826 127 826 173 rr_6e5k 1
398 "spec=NOESY, no=472, id=465, vol=2.400000e+06" 830 127 830 173 rr_6e5k 1
399 "spec=NOESY, no=471, id=464, vol=2.410000e+06" 829 127 829 173 rr_6e5k 1
400 "spec=NOESY, no=473, id=466, vol=2.390000e+06" 836 127 836 173 rr_6e5k 1
401 "spec=NOESY, no=474, id=467, vol=2.370000e+06" 839 127 839 173 rr_6e5k 1
402 "spec=NOESY, no=478, id=471, vol=2.300000e+06" 841 127 841 173 rr_6e5k 1
403 "spec=NOESY, no=477, id=470, vol=2.320000e+06" 840 127 840 173 rr_6e5k 1
404 "spec=NOESY, no=482, id=475, vol=2.280000e+06" 845 127 845 173 rr_6e5k 1
405 "spec=NOESY, no=479, id=472, vol=2.290000e+06" 844 127 844 173 rr_6e5k 1
406 "spec=NOESY, no=483, id=476, vol=2.200000e+06" 847 127 847 173 rr_6e5k 1
407 "spec=NOESY, no=485, id=478, vol=2.180000e+06" 849 127 849 173 rr_6e5k 1
408 "spec=NOESY, no=486, id=479, vol=2.120000e+06" 851 127 851 173 rr_6e5k 1
409 "spec=NOESY, no=488, id=481, vol=2.080000e+06" 853 127 853 173 rr_6e5k 1
410 "spec=NOESY, no=487, id=480, vol=2.120000e+06" 852 127 852 173 rr_6e5k 1
411 "spec=NOESY, no=489, id=482, vol=2.080000e+06" 856 127 856 173 rr_6e5k 1
412 "spec=NOESY, no=492, id=485, vol=2.050000e+06" 859 127 859 173 rr_6e5k 1
413 "spec=NOESY, no=491, id=484, vol=2.070000e+06" 858 127 858 173 rr_6e5k 1
414 "spec=NOESY, no=494, id=487, vol=2.020000e+06" 862 127 862 173 rr_6e5k 1
415 "spec=NOESY, no=495, id=488, vol=2.010000e+06" 863 127 863 173 rr_6e5k 1
416 "spec=NOESY, no=497, id=490, vol=1.980000e+06" 865 127 865 173 rr_6e5k 1
417 "spec=NOESY, no=496, id=489, vol=1.990000e+06" 864 127 864 173 rr_6e5k 1
418 "spec=NOESY, no=499, id=492, vol=1.950000e+06" 867 127 867 173 rr_6e5k 1
419 "spec=NOESY, no=500, id=493, vol=1.910000e+06" 868 127 868 173 rr_6e5k 1
420 "spec=NOESY, no=502, id=495, vol=1.910000e+06" 869 127 869 173 rr_6e5k 1
421 "spec=NOESY, no=505, id=498, vol=1.820000e+06" 871 127 871 173 rr_6e5k 1
422 "spec=NOESY, no=503, id=496, vol=1.860000e+06" 870 127 870 173 rr_6e5k 1
423 "spec=NOESY, no=506, id=499, vol=1.800000e+06" 874 127 874 173 rr_6e5k 1
424 "spec=NOESY, no=507, id=500, vol=1.780000e+06" 876 127 876 173 rr_6e5k 1
425 "spec=NOESY, no=508, id=501, vol=1.780000e+06" 878 127 878 173 rr_6e5k 1
426 "spec=NOESY, no=509, id=502, vol=1.720000e+06" 879 127 879 173 rr_6e5k 1
427 "spec=NOESY, no=510, id=503, vol=1.690000e+06" 880 127 880 173 rr_6e5k 1
428 "spec=NOESY, no=513, id=506, vol=1.600000e+06" 882 127 882 173 rr_6e5k 1
429 "spec=NOESY, no=511, id=504, vol=1.650000e+06" 881 127 881 173 rr_6e5k 1
430 "spec=NOESY, no=514, id=507, vol=1.580000e+06" 885 127 885 173 rr_6e5k 1
431 "spec=NOESY, no=518, id=511, vol=1.520000e+06" 887 127 887 173 rr_6e5k 1
432 "spec=NOESY, no=520, id=513, vol=1.430000e+06" 890 127 890 173 rr_6e5k 1
433 "spec=NOESY, no=521, id=514, vol=1.380000e+06" 892 127 892 173 rr_6e5k 1
434 "spec=NOESY, no=524, id=517, vol=1.310000e+06" 895 127 895 173 rr_6e5k 1
435 "spec=NOESY, no=525, id=518, vol=1.170000e+06" 897 127 897 173 rr_6e5k 1
stop_
loop_
_Dist_constraint_conv_err.ID
_Dist_constraint_conv_err.Dist_constraint_parse_file_ID
_Dist_constraint_conv_err.Parse_file_constraint_ID
_Dist_constraint_conv_err.Conv_error_type
_Dist_constraint_conv_err.Conv_error_note
_Dist_constraint_conv_err.Entry_ID
_Dist_constraint_conv_err.Distance_constraint_list_ID
1 2 5 1 "Not handling restraint 5, item 1, resonance(s) ' .28.HN1' (nmrStar names),' .28.HN2' (nmrStar names) not linked" rr_6e5k 1
2 2 17 1 "Not handling restraint 17, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
3 2 17 1 "Not handling restraint 17, item 3, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
4 2 17 1 "Not handling restraint 17, item 4, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
5 2 18 1 "Not handling restraint 18, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
6 2 18 1 "Not handling restraint 18, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
7 2 18 1 "Not handling restraint 18, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
8 2 37 1 "Not handling restraint 37, item 2, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 1
9 2 37 1 "Not handling restraint 37, item 3, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 1
10 2 37 1 "Not handling restraint 37, item 4, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 1
11 2 37 1 "Not handling restraint 37, item 5, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 1
12 2 37 1 "Not handling restraint 37, item 6, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 1
13 2 37 1 "Not handling restraint 37, item 7, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 1
14 2 39 1 "Not handling restraint 39, item 2, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 1
15 2 39 1 "Not handling restraint 39, item 3, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 1
16 2 39 1 "Not handling restraint 39, item 4, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 1
17 2 49 1 "Not handling restraint 49, item 2, resonance(s) ' .3.HB12' (nmrStar names) not linked" rr_6e5k 1
18 2 49 1 "Not handling restraint 49, item 3, resonance(s) ' .3.HB11' (nmrStar names) not linked" rr_6e5k 1
19 2 49 1 "Not handling restraint 49, item 4, resonance(s) ' .3.HB13' (nmrStar names) not linked" rr_6e5k 1
20 2 62 1 "Not handling restraint 62, item 3, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
21 2 62 1 "Not handling restraint 62, item 6, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
22 2 62 1 "Not handling restraint 62, item 9, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
23 2 79 1 "Not handling restraint 79, item 3, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
24 2 79 1 "Not handling restraint 79, item 6, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
25 2 79 1 "Not handling restraint 79, item 9, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
26 2 81 1 "Not handling restraint 81, item 2, resonance(s) ' .12.HB12' (nmrStar names) not linked" rr_6e5k 1
27 2 81 1 "Not handling restraint 81, item 3, resonance(s) ' .12.HB11' (nmrStar names) not linked" rr_6e5k 1
28 2 81 1 "Not handling restraint 81, item 4, resonance(s) ' .12.HB13' (nmrStar names) not linked" rr_6e5k 1
29 2 87 1 "Not handling restraint 87, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" rr_6e5k 1
30 2 87 1 "Not handling restraint 87, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" rr_6e5k 1
31 2 87 1 "Not handling restraint 87, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" rr_6e5k 1
32 2 109 1 "Not handling restraint 109, item 2, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 1
33 2 109 1 "Not handling restraint 109, item 3, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 1
34 2 109 1 "Not handling restraint 109, item 4, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 1
35 2 109 1 "Not handling restraint 109, item 5, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 1
36 2 109 1 "Not handling restraint 109, item 6, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 1
37 2 109 1 "Not handling restraint 109, item 7, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 1
38 2 114 1 "Not handling restraint 114, item 2, resonance(s) ' .3.HB12' (nmrStar names) not linked" rr_6e5k 1
39 2 114 1 "Not handling restraint 114, item 3, resonance(s) ' .3.HB11' (nmrStar names) not linked" rr_6e5k 1
40 2 114 1 "Not handling restraint 114, item 4, resonance(s) ' .3.HB13' (nmrStar names) not linked" rr_6e5k 1
41 2 126 1 "Not handling restraint 126, item 2, resonance(s) ' .12.HB12' (nmrStar names) not linked" rr_6e5k 1
42 2 126 1 "Not handling restraint 126, item 3, resonance(s) ' .12.HB11' (nmrStar names) not linked" rr_6e5k 1
43 2 126 1 "Not handling restraint 126, item 4, resonance(s) ' .12.HB13' (nmrStar names) not linked" rr_6e5k 1
44 2 139 1 "Not handling restraint 139, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
45 2 139 1 "Not handling restraint 139, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
46 2 139 1 "Not handling restraint 139, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
47 2 162 1 "Not handling restraint 162, item 1, resonance(s) ' .28.HN2' (nmrStar names) not linked" rr_6e5k 1
48 2 163 1 "Not handling restraint 163, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" rr_6e5k 1
49 2 163 1 "Not handling restraint 163, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" rr_6e5k 1
50 2 163 1 "Not handling restraint 163, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" rr_6e5k 1
51 2 224 1 "Not handling restraint 224, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
52 2 224 1 "Not handling restraint 224, item 3, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
53 2 224 1 "Not handling restraint 224, item 4, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
54 2 230 1 "Not handling restraint 230, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
55 2 230 1 "Not handling restraint 230, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
56 2 230 1 "Not handling restraint 230, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
57 2 230 1 "Not handling restraint 230, item 5, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
58 2 230 1 "Not handling restraint 230, item 6, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
59 2 230 1 "Not handling restraint 230, item 7, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
60 2 231 1 "Not handling restraint 231, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
61 2 231 1 "Not handling restraint 231, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
62 2 231 1 "Not handling restraint 231, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
63 2 259 1 "Not handling restraint 259, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
64 2 259 1 "Not handling restraint 259, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
65 2 259 1 "Not handling restraint 259, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
66 2 261 1 "Not handling restraint 261, item 3, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
67 2 261 1 "Not handling restraint 261, item 6, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
68 2 261 1 "Not handling restraint 261, item 9, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
69 2 272 1 "Not handling restraint 272, item 3, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
70 2 272 1 "Not handling restraint 272, item 6, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
71 2 272 1 "Not handling restraint 272, item 9, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
72 2 276 1 "Not handling restraint 276, item 1, resonance(s) ' .28.HN1' (nmrStar names) not linked" rr_6e5k 1
73 2 287 1 "Not handling restraint 287, item 1, resonance(s) ' .28.HN2' (nmrStar names) not linked" rr_6e5k 1
74 2 301 1 "Not handling restraint 301, item 2, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 1
75 2 301 1 "Not handling restraint 301, item 3, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 1
76 2 301 1 "Not handling restraint 301, item 4, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 1
77 2 301 1 "Not handling restraint 301, item 5, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 1
78 2 301 1 "Not handling restraint 301, item 6, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 1
79 2 301 1 "Not handling restraint 301, item 7, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 1
80 2 304 1 "Not handling restraint 304, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
81 2 304 1 "Not handling restraint 304, item 3, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
82 2 304 1 "Not handling restraint 304, item 4, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
83 2 304 1 "Not handling restraint 304, item 5, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
84 2 304 1 "Not handling restraint 304, item 6, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
85 2 304 1 "Not handling restraint 304, item 7, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
86 2 308 1 "Not handling restraint 308, item 2, resonance(s) ' .12.HB12' (nmrStar names) not linked" rr_6e5k 1
87 2 308 1 "Not handling restraint 308, item 3, resonance(s) ' .12.HB11' (nmrStar names) not linked" rr_6e5k 1
88 2 308 1 "Not handling restraint 308, item 4, resonance(s) ' .12.HB13' (nmrStar names) not linked" rr_6e5k 1
89 2 315 1 "Not handling restraint 315, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
90 2 315 1 "Not handling restraint 315, item 3, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
91 2 315 1 "Not handling restraint 315, item 4, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
92 2 340 1 "Not handling restraint 340, item 2, resonance(s) ' .12.HB22' (nmrStar names) not linked" rr_6e5k 1
93 2 340 1 "Not handling restraint 340, item 3, resonance(s) ' .12.HB21' (nmrStar names) not linked" rr_6e5k 1
94 2 340 1 "Not handling restraint 340, item 4, resonance(s) ' .12.HB23' (nmrStar names) not linked" rr_6e5k 1
95 2 349 1 "Not handling restraint 349, item 2, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 1
96 2 349 1 "Not handling restraint 349, item 3, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 1
97 2 349 1 "Not handling restraint 349, item 4, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 1
98 2 349 1 "Not handling restraint 349, item 5, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 1
99 2 349 1 "Not handling restraint 349, item 6, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 1
100 2 349 1 "Not handling restraint 349, item 7, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 1
101 2 354 1 "Not handling restraint 354, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
102 2 354 1 "Not handling restraint 354, item 3, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
103 2 354 1 "Not handling restraint 354, item 4, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
104 2 354 1 "Not handling restraint 354, item 5, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
105 2 354 1 "Not handling restraint 354, item 6, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
106 2 354 1 "Not handling restraint 354, item 7, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
107 2 357 1 "Not handling restraint 357, item 1, resonance(s) ' .28.HN1' (nmrStar names) not linked" rr_6e5k 1
108 2 378 1 "Not handling restraint 378, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
109 2 378 1 "Not handling restraint 378, item 3, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
110 2 378 1 "Not handling restraint 378, item 4, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
111 2 391 1 "Not handling restraint 391, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 1
112 2 391 1 "Not handling restraint 391, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 1
113 2 391 1 "Not handling restraint 391, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 1
114 2 413 1 "Not handling restraint 413, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 1
115 2 413 1 "Not handling restraint 413, item 3, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 1
116 2 413 1 "Not handling restraint 413, item 4, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 1
117 2 414 1 "Not handling restraint 414, item 1, resonance(s) ' .28.HN2' (nmrStar names) not linked" rr_6e5k 1
118 2 419 1 "Not handling restraint 419, item 1, resonance(s) ' .28.HN2' (nmrStar names) not linked" rr_6e5k 1
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_6e5k
_Distance_constraint_list.ID 3
_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_6e5k 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 2 . OR rr_6e5k 2
1 2 . 3 . rr_6e5k 2
1 3 . . . rr_6e5k 2
2 1 2 . OR rr_6e5k 2
2 2 . 3 . rr_6e5k 2
2 3 . 4 . rr_6e5k 2
2 4 . 5 . rr_6e5k 2
2 5 . . . rr_6e5k 2
3 1 2 . OR rr_6e5k 2
3 2 . 3 . rr_6e5k 2
3 3 . . . rr_6e5k 2
4 1 2 . OR rr_6e5k 2
4 2 . 3 . rr_6e5k 2
4 3 . 4 . rr_6e5k 2
4 4 . 5 . rr_6e5k 2
4 5 . . . rr_6e5k 2
5 1 2 . OR rr_6e5k 2
5 2 . 3 . rr_6e5k 2
5 3 . . . rr_6e5k 2
6 1 2 . OR rr_6e5k 2
6 2 . 3 . rr_6e5k 2
6 3 . . . rr_6e5k 2
7 1 2 . OR rr_6e5k 2
7 2 . 3 . rr_6e5k 2
7 3 . . . rr_6e5k 2
8 1 2 . OR rr_6e5k 2
8 2 . 3 . rr_6e5k 2
8 3 . . . rr_6e5k 2
9 1 2 . OR rr_6e5k 2
9 2 . 3 . rr_6e5k 2
9 3 . . . rr_6e5k 2
10 1 2 . OR rr_6e5k 2
10 2 . 3 . rr_6e5k 2
10 3 . 4 . rr_6e5k 2
10 4 . . . rr_6e5k 2
11 1 2 . OR rr_6e5k 2
11 2 . 3 . rr_6e5k 2
11 3 . . . rr_6e5k 2
12 1 2 . OR rr_6e5k 2
12 2 . 3 . rr_6e5k 2
12 3 . . . rr_6e5k 2
13 1 2 . OR rr_6e5k 2
13 2 . 3 . rr_6e5k 2
13 3 . 4 . rr_6e5k 2
13 4 . . . rr_6e5k 2
14 1 2 . OR rr_6e5k 2
14 2 . 3 . rr_6e5k 2
14 3 . . . rr_6e5k 2
15 1 2 . OR rr_6e5k 2
15 2 . 3 . rr_6e5k 2
15 3 . 4 . rr_6e5k 2
15 4 . 5 . rr_6e5k 2
15 5 . . . rr_6e5k 2
16 1 2 . OR rr_6e5k 2
16 2 . 3 . rr_6e5k 2
16 3 . 4 . rr_6e5k 2
16 4 . 5 . rr_6e5k 2
16 5 . . . rr_6e5k 2
17 1 2 . OR rr_6e5k 2
17 2 . 3 . rr_6e5k 2
17 3 . 4 . rr_6e5k 2
17 4 . . . rr_6e5k 2
18 1 2 . OR rr_6e5k 2
18 2 . 3 . rr_6e5k 2
18 3 . . . rr_6e5k 2
19 1 2 . OR rr_6e5k 2
19 2 . 3 . rr_6e5k 2
19 3 . 4 . rr_6e5k 2
19 4 . 5 . rr_6e5k 2
19 5 . . . rr_6e5k 2
20 1 2 . OR rr_6e5k 2
20 2 . 3 . rr_6e5k 2
20 3 . 4 . rr_6e5k 2
20 4 . . . rr_6e5k 2
21 1 2 . OR rr_6e5k 2
21 2 . 3 . rr_6e5k 2
21 3 . 4 . rr_6e5k 2
21 4 . . . rr_6e5k 2
22 1 2 . OR rr_6e5k 2
22 2 . 3 . rr_6e5k 2
22 3 . . . rr_6e5k 2
23 1 2 . OR rr_6e5k 2
23 2 . 3 . rr_6e5k 2
23 3 . 4 . rr_6e5k 2
23 4 . 5 . rr_6e5k 2
23 5 . . . rr_6e5k 2
24 1 2 . OR rr_6e5k 2
24 2 . 3 . rr_6e5k 2
24 3 . . . rr_6e5k 2
25 1 2 . OR rr_6e5k 2
25 2 . 3 . rr_6e5k 2
25 3 . 4 . rr_6e5k 2
25 4 . 5 . rr_6e5k 2
25 5 . . . rr_6e5k 2
26 1 2 . OR rr_6e5k 2
26 2 . 3 . rr_6e5k 2
26 3 . 4 . rr_6e5k 2
26 4 . . . rr_6e5k 2
27 1 2 . OR rr_6e5k 2
27 2 . 3 . rr_6e5k 2
27 3 . . . rr_6e5k 2
28 1 2 . OR rr_6e5k 2
28 2 . 3 . rr_6e5k 2
28 3 . 4 . rr_6e5k 2
28 4 . . . rr_6e5k 2
29 1 2 . OR rr_6e5k 2
29 2 . 3 . rr_6e5k 2
29 3 . . . rr_6e5k 2
30 1 2 . OR rr_6e5k 2
30 2 . 3 . rr_6e5k 2
30 3 . . . rr_6e5k 2
31 1 2 . OR rr_6e5k 2
31 2 . 3 . rr_6e5k 2
31 3 . . . rr_6e5k 2
32 1 2 . OR rr_6e5k 2
32 2 . 3 . rr_6e5k 2
32 3 . . . rr_6e5k 2
33 1 2 . OR rr_6e5k 2
33 2 . 3 . rr_6e5k 2
33 3 . . . rr_6e5k 2
34 1 2 . OR rr_6e5k 2
34 2 . 3 . rr_6e5k 2
34 3 . . . rr_6e5k 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 2 . 1 . 1 1 10 10 ARG HB3 H . . . . 10 . HB2 rr_6e5k 2
1 2 . 2 . 1 1 10 10 ARG HA H . . . . 10 . HA rr_6e5k 2
1 3 . 1 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 2
1 3 . 2 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 2
2 2 . 1 . 1 1 5 5 LYS HB2 H . . . . 5 . HB1 rr_6e5k 2
2 2 . 2 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 2
2 3 . 1 . 1 1 5 5 LYS HB3 H . . . . 5 . HB2 rr_6e5k 2
2 3 . 2 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 2
2 4 . 1 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 2
2 4 . 2 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 2
2 5 . 1 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 2
2 5 . 2 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 2
3 2 . 1 . 1 1 10 10 ARG HB2 H . . . . 10 . HB1 rr_6e5k 2
3 2 . 2 . 1 1 10 10 ARG HA H . . . . 10 . HA rr_6e5k 2
3 3 . 1 . 1 1 10 10 ARG HB2 H . . . . 10 . HB1 rr_6e5k 2
3 3 . 2 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 2
4 2 . 1 . 1 1 8 8 LYS HG2 H . . . . 8 . HG1 rr_6e5k 2
4 2 . 2 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 2
4 3 . 1 . 1 1 8 8 LYS HG2 H . . . . 8 . HG1 rr_6e5k 2
4 3 . 2 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 2
4 4 . 1 . 1 1 5 5 LYS HG2 H . . . . 5 . HG1 rr_6e5k 2
4 4 . 2 . 1 1 5 5 LYS HB2 H . . . . 5 . HB1 rr_6e5k 2
4 5 . 1 . 1 1 5 5 LYS HG2 H . . . . 5 . HG1 rr_6e5k 2
4 5 . 2 . 1 1 5 5 LYS HB3 H . . . . 5 . HB2 rr_6e5k 2
5 2 . 1 . 1 1 10 10 ARG HA H . . . . 10 . HA rr_6e5k 2
5 2 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 2
5 3 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 2
5 3 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 2
6 2 . 1 . 1 1 18 18 CYS HB3 H . . . . 18 . HB2 rr_6e5k 2
6 2 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 2
6 3 . 1 . 1 1 14 14 CYS HB3 H . . . . 14 . HB2 rr_6e5k 2
6 3 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 2
7 2 . 1 . 1 1 19 19 ASP HB2 H . . . . 19 . HB1 rr_6e5k 2
7 2 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 2
7 3 . 1 . 1 1 15 15 GLU HG3 H . . . . 15 . HG2 rr_6e5k 2
7 3 . 2 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 2
8 2 . 1 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 2
8 2 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 2
8 3 . 1 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 2
8 3 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 2
9 2 . 1 . 1 1 10 10 ARG HB2 H . . . . 10 . HB1 rr_6e5k 2
9 2 . 2 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 2
9 3 . 1 . 1 1 5 5 LYS HG3 H . . . . 5 . HG2 rr_6e5k 2
9 3 . 2 . 1 1 5 5 LYS H H . . . . 5 . HN rr_6e5k 2
10 2 . 1 . 1 1 26 26 HIS HB2 H . . . . 26 . HB1 rr_6e5k 2
10 2 . 2 . 1 1 26 26 HIS HD2 H . . . . 26 . HD2 rr_6e5k 2
10 3 . 1 . 1 1 17 17 ARG HD2 H . . . . 17 . HD1 rr_6e5k 2
10 3 . 2 . 1 1 17 17 ARG HE H . . . . 17 . HE rr_6e5k 2
10 4 . 1 . 1 1 17 17 ARG HD3 H . . . . 17 . HD2 rr_6e5k 2
10 4 . 2 . 1 1 17 17 ARG HE H . . . . 17 . HE rr_6e5k 2
11 2 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 2
11 2 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 2
11 3 . 1 . 1 1 14 14 CYS HB2 H . . . . 14 . HB1 rr_6e5k 2
11 3 . 2 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 2
12 2 . 1 . 1 1 10 10 ARG HA H . . . . 10 . HA rr_6e5k 2
12 2 . 2 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 2
12 3 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 2
12 3 . 2 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 2
13 2 . 1 . 1 1 8 8 LYS HD2 H . . . . 8 . HD1 rr_6e5k 2
13 2 . 2 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 2
13 3 . 1 . 1 1 8 8 LYS HD3 H . . . . 8 . HD2 rr_6e5k 2
13 3 . 2 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 2
13 4 . 1 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 2
13 4 . 2 . 1 1 8 8 LYS HA H . . . . 8 . HA rr_6e5k 2
14 2 . 1 . 1 1 8 8 LYS HG2 H . . . . 8 . HG1 rr_6e5k 2
14 2 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 2
14 3 . 1 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 2
14 3 . 2 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 2
15 2 . 1 . 1 1 10 10 ARG HB3 H . . . . 10 . HB2 rr_6e5k 2
15 2 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 2
15 3 . 1 . 1 1 10 10 ARG HB3 H . . . . 10 . HB2 rr_6e5k 2
15 3 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 2
15 4 . 1 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 2
15 4 . 2 . 1 1 11 11 TYR HD2 H . . . . 11 . HD2 rr_6e5k 2
15 5 . 1 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 2
15 5 . 2 . 1 1 11 11 TYR HD1 H . . . . 11 . HD1 rr_6e5k 2
16 2 . 1 . 1 1 8 8 LYS HD2 H . . . . 8 . HD1 rr_6e5k 2
16 2 . 2 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 2
16 3 . 1 . 1 1 8 8 LYS HD3 H . . . . 8 . HD2 rr_6e5k 2
16 3 . 2 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 2
16 4 . 1 . 1 1 5 5 LYS HD2 H . . . . 5 . HD1 rr_6e5k 2
16 4 . 2 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 2
16 5 . 1 . 1 1 5 5 LYS HD3 H . . . . 5 . HD2 rr_6e5k 2
16 5 . 2 . 1 1 5 5 LYS HA H . . . . 5 . HA rr_6e5k 2
17 2 . 1 . 1 1 22 22 ARG HB2 H . . . . 22 . HB1 rr_6e5k 2
17 2 . 2 . 1 1 22 22 ARG HE H . . . . 22 . HE rr_6e5k 2
17 3 . 1 . 1 1 22 22 ARG HB3 H . . . . 22 . HB2 rr_6e5k 2
17 3 . 2 . 1 1 22 22 ARG HE H . . . . 22 . HE rr_6e5k 2
17 4 . 1 . 1 1 17 17 ARG HB3 H . . . . 17 . HB2 rr_6e5k 2
17 4 . 2 . 1 1 17 17 ARG HE H . . . . 17 . HE rr_6e5k 2
18 2 . 1 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 2
18 2 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 2
18 3 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 2
18 3 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 2
19 2 . 1 . 1 1 10 10 ARG HB3 H . . . . 10 . HB2 rr_6e5k 2
19 2 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 2
19 3 . 1 . 1 1 10 10 ARG HB3 H . . . . 10 . HB2 rr_6e5k 2
19 3 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 2
19 4 . 1 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 2
19 4 . 2 . 1 1 11 11 TYR HE2 H . . . . 11 . HE2 rr_6e5k 2
19 5 . 1 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 2
19 5 . 2 . 1 1 11 11 TYR HE1 H . . . . 11 . HE1 rr_6e5k 2
20 2 . 1 . 1 1 22 22 ARG HB2 H . . . . 22 . HB1 rr_6e5k 2
20 2 . 2 . 1 1 19 19 ASP HB2 H . . . . 19 . HB1 rr_6e5k 2
20 3 . 1 . 1 1 22 22 ARG HB3 H . . . . 22 . HB2 rr_6e5k 2
20 3 . 2 . 1 1 19 19 ASP HB2 H . . . . 19 . HB1 rr_6e5k 2
20 4 . 1 . 1 1 17 17 ARG HB3 H . . . . 17 . HB2 rr_6e5k 2
20 4 . 2 . 1 1 19 19 ASP HB2 H . . . . 19 . HB1 rr_6e5k 2
21 2 . 1 . 1 1 22 22 ARG HB2 H . . . . 22 . HB1 rr_6e5k 2
21 2 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 2
21 3 . 1 . 1 1 22 22 ARG HB3 H . . . . 22 . HB2 rr_6e5k 2
21 3 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 2
21 4 . 1 . 1 1 17 17 ARG HB3 H . . . . 17 . HB2 rr_6e5k 2
21 4 . 2 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 2
22 2 . 1 . 1 1 21 21 PRO HB2 H . . . . 21 . HB1 rr_6e5k 2
22 2 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 2
22 3 . 1 . 1 1 21 21 PRO HG3 H . . . . 21 . HG2 rr_6e5k 2
22 3 . 2 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 2
23 2 . 1 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 2
23 2 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 2
23 3 . 1 . 1 1 25 25 MVA HG21 H . . . . 25 . HG21 rr_6e5k 2
23 3 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 2
23 4 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 2
23 4 . 2 . 1 1 23 23 TYR HD2 H . . . . 23 . HD2 rr_6e5k 2
23 5 . 1 . 1 1 7 7 LEU MD2 H . . . . 7 . HD21 rr_6e5k 2
23 5 . 2 . 1 1 23 23 TYR HD1 H . . . . 23 . HD1 rr_6e5k 2
24 2 . 1 . 1 1 17 17 ARG HB2 H . . . . 17 . HB1 rr_6e5k 2
24 2 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 2
24 3 . 1 . 1 1 7 7 LEU HB3 H . . . . 7 . HB2 rr_6e5k 2
24 3 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 2
25 2 . 1 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 2
25 2 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 2
25 3 . 1 . 1 1 5 5 LYS HB2 H . . . . 5 . HB1 rr_6e5k 2
25 3 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 2
25 4 . 1 . 1 1 5 5 LYS HB3 H . . . . 5 . HB2 rr_6e5k 2
25 4 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 2
25 5 . 1 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 2
25 5 . 2 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 2
26 2 . 1 . 1 1 8 8 LYS HB3 H . . . . 8 . HB2 rr_6e5k 2
26 2 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 2
26 3 . 1 . 1 1 8 8 LYS HB2 H . . . . 8 . HB1 rr_6e5k 2
26 3 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 2
26 4 . 1 . 1 1 24 24 GLU HB2 H . . . . 24 . HB1 rr_6e5k 2
26 4 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 2
27 2 . 1 . 1 1 14 14 CYS HB2 H . . . . 14 . HB1 rr_6e5k 2
27 2 . 2 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 2
27 3 . 1 . 1 1 11 11 TYR HB2 H . . . . 11 . HB1 rr_6e5k 2
27 3 . 2 . 1 1 25 25 MVA HG11 H . . . . 25 . HG11 rr_6e5k 2
28 2 . 1 . 1 1 4 4 CYS HB2 H . . . . 4 . HB1 rr_6e5k 2
28 2 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 2
28 3 . 1 . 1 1 17 17 ARG HD3 H . . . . 17 . HD2 rr_6e5k 2
28 3 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 2
28 4 . 1 . 1 1 17 17 ARG HD2 H . . . . 17 . HD1 rr_6e5k 2
28 4 . 2 . 1 1 16 16 MVA HG21 H . . . . 16 . HG21 rr_6e5k 2
29 2 . 1 . 1 1 18 18 CYS HA H . . . . 18 . HA rr_6e5k 2
29 2 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 2
29 3 . 1 . 1 1 15 15 GLU HA H . . . . 15 . HA rr_6e5k 2
29 3 . 2 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 2
30 2 . 1 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 2
30 2 . 2 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 2
30 3 . 1 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 2
30 3 . 2 . 1 1 18 18 CYS H H . . . . 18 . HN rr_6e5k 2
31 2 . 1 . 1 1 10 10 ARG HA H . . . . 10 . HA rr_6e5k 2
31 2 . 2 . 1 1 9 9 ABA H H . . . . 9 . HN rr_6e5k 2
31 3 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 2
31 3 . 2 . 1 1 9 9 ABA H H . . . . 9 . HN rr_6e5k 2
32 2 . 1 . 1 1 17 17 ARG HB2 H . . . . 17 . HB1 rr_6e5k 2
32 2 . 2 . 1 1 26 26 HIS HD2 H . . . . 26 . HD2 rr_6e5k 2
32 3 . 1 . 1 1 17 17 ARG HB2 H . . . . 17 . HB1 rr_6e5k 2
32 3 . 2 . 1 1 17 17 ARG HE H . . . . 17 . HE rr_6e5k 2
33 2 . 1 . 1 1 10 10 ARG HA H . . . . 10 . HA rr_6e5k 2
33 2 . 2 . 1 1 10 10 ARG HE H . . . . 10 . HE rr_6e5k 2
33 3 . 1 . 1 1 7 7 LEU HA H . . . . 7 . HA rr_6e5k 2
33 3 . 2 . 1 1 10 10 ARG HE H . . . . 10 . HE rr_6e5k 2
34 2 . 1 . 1 1 8 8 LYS HG2 H . . . . 8 . HG1 rr_6e5k 2
34 2 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 2
34 3 . 1 . 1 1 7 7 LEU HB2 H . . . . 7 . HB1 rr_6e5k 2
34 3 . 2 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 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 2 . . . . . . 2.212 1.600 2.824 rr_6e5k 2
1 3 . . . . . . 2.212 1.600 2.824 rr_6e5k 2
2 2 . . . . . . 2.323 1.648 2.998 rr_6e5k 2
2 3 . . . . . . 2.323 1.648 2.998 rr_6e5k 2
2 4 . . . . . . 2.323 1.648 2.998 rr_6e5k 2
2 5 . . . . . . 2.323 1.648 2.998 rr_6e5k 2
3 2 . . . . . . 2.349 1.659 3.039 rr_6e5k 2
3 3 . . . . . . 2.349 1.659 3.039 rr_6e5k 2
4 2 . . . . . . 2.411 1.685 3.137 rr_6e5k 2
4 3 . . . . . . 2.411 1.685 3.137 rr_6e5k 2
4 4 . . . . . . 2.411 1.685 3.137 rr_6e5k 2
4 5 . . . . . . 2.411 1.685 3.137 rr_6e5k 2
5 2 . . . . . . 2.513 1.724 3.302 rr_6e5k 2
5 3 . . . . . . 2.513 1.724 3.302 rr_6e5k 2
6 2 . . . . . . 2.619 1.762 3.476 rr_6e5k 2
6 3 . . . . . . 2.619 1.762 3.476 rr_6e5k 2
7 2 . . . . . . 2.676 1.781 3.571 rr_6e5k 2
7 3 . . . . . . 2.676 1.781 3.571 rr_6e5k 2
8 2 . . . . . . 2.712 1.792 3.632 rr_6e5k 2
8 3 . . . . . . 2.712 1.792 3.632 rr_6e5k 2
9 2 . . . . . . 2.735 1.800 3.670 rr_6e5k 2
9 3 . . . . . . 2.735 1.800 3.670 rr_6e5k 2
10 2 . . . . . . 2.746 1.804 3.688 rr_6e5k 2
10 3 . . . . . . 2.746 1.804 3.688 rr_6e5k 2
10 4 . . . . . . 2.746 1.804 3.688 rr_6e5k 2
11 2 . . . . . . 2.836 1.831 3.841 rr_6e5k 2
11 3 . . . . . . 2.836 1.831 3.841 rr_6e5k 2
12 2 . . . . . . 2.867 1.839 3.895 rr_6e5k 2
12 3 . . . . . . 2.867 1.839 3.895 rr_6e5k 2
13 2 . . . . . . 2.894 1.847 3.941 rr_6e5k 2
13 3 . . . . . . 2.894 1.847 3.941 rr_6e5k 2
13 4 . . . . . . 2.894 1.847 3.941 rr_6e5k 2
14 2 . . . . . . 2.909 1.851 3.967 rr_6e5k 2
14 3 . . . . . . 2.909 1.851 3.967 rr_6e5k 2
15 2 . . . . . . 2.921 1.855 3.987 rr_6e5k 2
15 3 . . . . . . 2.921 1.855 3.987 rr_6e5k 2
15 4 . . . . . . 2.921 1.855 3.987 rr_6e5k 2
15 5 . . . . . . 2.921 1.855 3.987 rr_6e5k 2
16 2 . . . . . . 2.976 1.869 4.083 rr_6e5k 2
16 3 . . . . . . 2.976 1.869 4.083 rr_6e5k 2
16 4 . . . . . . 2.976 1.869 4.083 rr_6e5k 2
16 5 . . . . . . 2.976 1.869 4.083 rr_6e5k 2
17 2 . . . . . . 3.002 1.875 4.129 rr_6e5k 2
17 3 . . . . . . 3.002 1.875 4.129 rr_6e5k 2
17 4 . . . . . . 3.002 1.875 4.129 rr_6e5k 2
18 2 . . . . . . 3.085 1.895 4.275 rr_6e5k 2
18 3 . . . . . . 3.085 1.895 4.275 rr_6e5k 2
19 2 . . . . . . 3.152 1.910 4.394 rr_6e5k 2
19 3 . . . . . . 3.152 1.910 4.394 rr_6e5k 2
19 4 . . . . . . 3.152 1.910 4.394 rr_6e5k 2
19 5 . . . . . . 3.152 1.910 4.394 rr_6e5k 2
20 2 . . . . . . 3.167 1.913 4.421 rr_6e5k 2
20 3 . . . . . . 3.167 1.913 4.421 rr_6e5k 2
20 4 . . . . . . 3.167 1.913 4.421 rr_6e5k 2
21 2 . . . . . . 3.237 1.927 4.547 rr_6e5k 2
21 3 . . . . . . 3.237 1.927 4.547 rr_6e5k 2
21 4 . . . . . . 3.237 1.927 4.547 rr_6e5k 2
22 2 . . . . . . 3.253 1.930 4.576 rr_6e5k 2
22 3 . . . . . . 3.253 1.930 4.576 rr_6e5k 2
23 2 . . . . . . 3.257 1.931 4.583 rr_6e5k 2
23 3 . . . . . . 3.257 1.931 4.583 rr_6e5k 2
23 4 . . . . . . 3.257 1.931 4.583 rr_6e5k 2
23 5 . . . . . . 3.257 1.931 4.583 rr_6e5k 2
24 2 . . . . . . 3.259 1.932 4.586 rr_6e5k 2
24 3 . . . . . . 3.259 1.932 4.586 rr_6e5k 2
25 2 . . . . . . 3.297 1.938 4.656 rr_6e5k 2
25 3 . . . . . . 3.297 1.938 4.656 rr_6e5k 2
25 4 . . . . . . 3.297 1.938 4.656 rr_6e5k 2
25 5 . . . . . . 3.297 1.938 4.656 rr_6e5k 2
26 2 . . . . . . 3.320 1.942 4.698 rr_6e5k 2
26 3 . . . . . . 3.320 1.942 4.698 rr_6e5k 2
26 4 . . . . . . 3.320 1.942 4.698 rr_6e5k 2
27 2 . . . . . . 3.385 1.952 4.818 rr_6e5k 2
27 3 . . . . . . 3.385 1.952 4.818 rr_6e5k 2
28 2 . . . . . . 3.526 1.972 5.080 rr_6e5k 2
28 3 . . . . . . 3.526 1.972 5.080 rr_6e5k 2
28 4 . . . . . . 3.526 1.972 5.080 rr_6e5k 2
29 2 . . . . . . 3.566 1.976 5.156 rr_6e5k 2
29 3 . . . . . . 3.566 1.976 5.156 rr_6e5k 2
30 2 . . . . . . 3.636 1.983 5.289 rr_6e5k 2
30 3 . . . . . . 3.636 1.983 5.289 rr_6e5k 2
31 2 . . . . . . 3.636 1.983 5.289 rr_6e5k 2
31 3 . . . . . . 3.636 1.983 5.289 rr_6e5k 2
32 2 . . . . . . 3.675 1.987 5.363 rr_6e5k 2
32 3 . . . . . . 3.675 1.987 5.363 rr_6e5k 2
33 2 . . . . . . 4.010 2.000 6.020 rr_6e5k 2
33 3 . . . . . . 4.010 2.000 6.020 rr_6e5k 2
34 2 . . . . . . 4.543 1.964 7.122 rr_6e5k 2
34 3 . . . . . . 4.543 1.964 7.122 rr_6e5k 2
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 "# Restraints file 3: ambig.tbl" 1 1 1 30 rr_6e5k 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 "spec=NOESY, no=38, id=35, vol=4.790000e+07" 2 127 2 171 rr_6e5k 2
2 "spec=NOESY, no=41, id=38, vol=4.410000e+07" 4 127 4 171 rr_6e5k 2
3 "spec=NOESY, no=55, id=52, vol=3.570000e+07" 16 127 16 171 rr_6e5k 2
4 "spec=NOESY, no=63, id=60, vol=3.340000e+07" 20 127 20 171 rr_6e5k 2
5 "spec=NOESY, no=66, id=63, vol=3.280000e+07" 22 127 22 171 rr_6e5k 2
6 "spec=NOESY, no=80, id=77, vol=2.860000e+07" 28 127 28 171 rr_6e5k 2
7 "spec=NOESY, no=120, id=117, vol=2.230000e+07" 32 127 32 173 rr_6e5k 2
8 "spec=NOESY, no=145, id=142, vol=1.740000e+07" 34 127 34 173 rr_6e5k 2
9 "spec=NOESY, no=148, id=145, vol=1.710000e+07" 36 127 36 173 rr_6e5k 2
10 "spec=NOESY, no=166, id=163, vol=1.530000e+07" 40 127 40 173 rr_6e5k 2
11 "spec=NOESY, no=170, id=167, vol=1.530000e+07" 42 127 42 173 rr_6e5k 2
12 "spec=NOESY, no=183, id=180, vol=1.410000e+07" 66 127 66 173 rr_6e5k 2
13 "spec=NOESY, no=193, id=190, vol=1.340000e+07" 68 127 68 173 rr_6e5k 2
14 "spec=NOESY, no=198, id=195, vol=1.310000e+07" 70 127 70 173 rr_6e5k 2
15 "spec=NOESY, no=205, id=202, vol=1.270000e+07" 73 127 73 173 rr_6e5k 2
16 "spec=NOESY, no=216, id=213, vol=1.140000e+07" 85 127 85 173 rr_6e5k 2
17 "spec=NOESY, no=227, id=224, vol=1.080000e+07" 94 127 94 173 rr_6e5k 2
18 "spec=NOESY, no=237, id=234, vol=1.010000e+07" 96 127 96 173 rr_6e5k 2
19 "spec=NOESY, no=251, id=248, vol=9.560000e+06" 98 127 98 173 rr_6e5k 2
20 "spec=NOESY, no=254, id=251, vol=9.270000e+06" 101 127 101 173 rr_6e5k 2
21 "spec=NOESY, no=256, id=253, vol=9.040000e+06" 103 127 103 173 rr_6e5k 2
22 "spec=NOESY, no=279, id=276, vol=8.080000e+06" 107 127 107 173 rr_6e5k 2
23 "spec=NOESY, no=288, id=284, vol=7.670000e+06" 111 127 111 173 rr_6e5k 2
24 "spec=NOESY, no=289, id=285, vol=7.670000e+06" 115 127 115 173 rr_6e5k 2
25 "spec=NOESY, no=300, id=296, vol=6.990000e+06" 118 127 118 173 rr_6e5k 2
26 "spec=NOESY, no=311, id=307, vol=6.510000e+06" 130 127 130 173 rr_6e5k 2
27 "spec=NOESY, no=330, id=326, vol=5.730000e+06" 148 127 148 173 rr_6e5k 2
28 "spec=NOESY, no=334, id=330, vol=5.560000e+06" 152 127 152 173 rr_6e5k 2
29 "spec=NOESY, no=337, id=333, vol=5.480000e+06" 155 127 155 173 rr_6e5k 2
30 "spec=NOESY, no=359, id=355, vol=4.880000e+06" 159 127 159 173 rr_6e5k 2
31 "spec=NOESY, no=366, id=362, vol=4.740000e+06" 162 127 162 173 rr_6e5k 2
32 "spec=NOESY, no=367, id=363, vol=4.700000e+06" 164 127 164 173 rr_6e5k 2
33 "spec=NOESY, no=370, id=366, vol=4.690000e+06" 176 127 176 173 rr_6e5k 2
34 "spec=NOESY, no=376, id=372, vol=4.570000e+06" 178 127 178 173 rr_6e5k 2
35 "spec=NOESY, no=386, id=382, vol=4.370000e+06" 185 127 185 173 rr_6e5k 2
36 "spec=NOESY, no=396, id=391, vol=4.190000e+06" 189 127 189 173 rr_6e5k 2
37 "spec=NOESY, no=413, id=408, vol=3.730000e+06" 198 127 198 173 rr_6e5k 2
38 "spec=NOESY, no=450, id=444, vol=2.920000e+06" 204 127 204 173 rr_6e5k 2
39 "spec=NOESY, no=455, id=449, vol=2.730000e+06" 213 127 213 173 rr_6e5k 2
40 "spec=NOESY, no=468, id=461, vol=2.430000e+06" 215 127 215 173 rr_6e5k 2
41 "spec=NOESY, no=469, id=462, vol=2.430000e+06" 217 127 217 173 rr_6e5k 2
42 "spec=NOESY, no=481, id=474, vol=2.280000e+06" 219 127 219 173 rr_6e5k 2
43 "spec=NOESY, no=504, id=497, vol=1.840000e+06" 221 127 221 173 rr_6e5k 2
44 "spec=NOESY, no=522, id=515, vol=1.350000e+06" 227 127 227 173 rr_6e5k 2
45 "spec=NOESY, no=529, id=522, vol=6.390000e+05" 229 127 229 173 rr_6e5k 2
46 "spec=NOESY, no=531, id=524, vol=1.790000e+05" 231 127 231 173 rr_6e5k 2
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 2 1 "Not handling restraint 2, item 10, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 2
2 4 2 1 "Not handling restraint 2, item 11, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 2
3 4 2 1 "Not handling restraint 2, item 12, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 2
4 4 2 1 "Not handling restraint 2, item 13, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 2
5 4 2 1 "Not handling restraint 2, item 2, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 2
6 4 2 1 "Not handling restraint 2, item 3, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 2
7 4 2 1 "Not handling restraint 2, item 4, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 2
8 4 2 1 "Not handling restraint 2, item 5, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
9 4 2 1 "Not handling restraint 2, item 6, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
10 4 2 1 "Not handling restraint 2, item 7, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
11 4 2 1 "Not handling restraint 2, item 8, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 2
12 4 2 1 "Not handling restraint 2, item 9, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 2
13 4 5 1 "Not handling restraint 5, item 2, resonance(s) ' .3.HB12' (nmrStar names) not linked" rr_6e5k 2
14 4 5 1 "Not handling restraint 5, item 3, resonance(s) ' .3.HB11' (nmrStar names) not linked" rr_6e5k 2
15 4 5 1 "Not handling restraint 5, item 4, resonance(s) ' .3.HB13' (nmrStar names) not linked" rr_6e5k 2
16 4 5 1 "Not handling restraint 5, item 5, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
17 4 5 1 "Not handling restraint 5, item 6, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
18 4 5 1 "Not handling restraint 5, item 7, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
19 4 9 1 "Not handling restraint 9, item 3, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 2
20 4 9 1 "Not handling restraint 9, item 4, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 2
21 4 9 1 "Not handling restraint 9, item 5, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 2
22 4 11 1 "Not handling restraint 11, item 10, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 2
23 4 11 1 "Not handling restraint 11, item 11, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 2
24 4 11 1 "Not handling restraint 11, item 12, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 2
25 4 11 1 "Not handling restraint 11, item 13, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 2
26 4 11 1 "Not handling restraint 11, item 14, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 2
27 4 11 1 "Not handling restraint 11, item 15, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 2
28 4 11 1 "Not handling restraint 11, item 16, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 2
29 4 11 1 "Not handling restraint 11, item 17, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 2
30 4 11 1 "Not handling restraint 11, item 18, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 2
31 4 11 1 "Not handling restraint 11, item 19, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 2
32 4 11 1 "Not handling restraint 11, item 2, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 2
33 4 11 1 "Not handling restraint 11, item 20, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
34 4 11 1 "Not handling restraint 11, item 21, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
35 4 11 1 "Not handling restraint 11, item 22, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
36 4 11 1 "Not handling restraint 11, item 23, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
37 4 11 1 "Not handling restraint 11, item 24, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
38 4 11 1 "Not handling restraint 11, item 25, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
39 4 11 1 "Not handling restraint 11, item 3, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 2
40 4 11 1 "Not handling restraint 11, item 4, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 2
41 4 11 1 "Not handling restraint 11, item 5, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 2
42 4 11 1 "Not handling restraint 11, item 6, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 2
43 4 11 1 "Not handling restraint 11, item 7, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 2
44 4 11 1 "Not handling restraint 11, item 8, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 2
45 4 11 1 "Not handling restraint 11, item 9, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 2
46 4 15 1 "Not handling restraint 15, item 10, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 2
47 4 15 1 "Not handling restraint 15, item 11, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 2
48 4 15 1 "Not handling restraint 15, item 12, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 2
49 4 15 1 "Not handling restraint 15, item 13, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 2
50 4 15 1 "Not handling restraint 15, item 2, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 2
51 4 15 1 "Not handling restraint 15, item 3, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 2
52 4 15 1 "Not handling restraint 15, item 4, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 2
53 4 15 1 "Not handling restraint 15, item 5, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
54 4 15 1 "Not handling restraint 15, item 6, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
55 4 15 1 "Not handling restraint 15, item 7, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
56 4 15 1 "Not handling restraint 15, item 8, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 2
57 4 15 1 "Not handling restraint 15, item 9, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 2
58 4 16 1 "Not handling restraint 16, item 10, resonance(s) ' .12.HB23' (nmrStar names) not linked" rr_6e5k 2
59 4 16 1 "Not handling restraint 16, item 2, resonance(s) ' .3.HB12' (nmrStar names) not linked" rr_6e5k 2
60 4 16 1 "Not handling restraint 16, item 3, resonance(s) ' .3.HB11' (nmrStar names) not linked" rr_6e5k 2
61 4 16 1 "Not handling restraint 16, item 4, resonance(s) ' .3.HB13' (nmrStar names) not linked" rr_6e5k 2
62 4 16 1 "Not handling restraint 16, item 5, resonance(s) ' .3.HB22' (nmrStar names) not linked" rr_6e5k 2
63 4 16 1 "Not handling restraint 16, item 6, resonance(s) ' .3.HB21' (nmrStar names) not linked" rr_6e5k 2
64 4 16 1 "Not handling restraint 16, item 7, resonance(s) ' .3.HB23' (nmrStar names) not linked" rr_6e5k 2
65 4 16 1 "Not handling restraint 16, item 8, resonance(s) ' .12.HB22' (nmrStar names) not linked" rr_6e5k 2
66 4 16 1 "Not handling restraint 16, item 9, resonance(s) ' .12.HB21' (nmrStar names) not linked" rr_6e5k 2
67 4 23 1 "Not handling restraint 23, item 3, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 2
68 4 23 1 "Not handling restraint 23, item 4, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 2
69 4 23 1 "Not handling restraint 23, item 5, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 2
70 4 25 1 "Not handling restraint 25, item 10, resonance(s) ' .9.HB23' (nmrStar names) not linked" rr_6e5k 2
71 4 25 1 "Not handling restraint 25, item 11, resonance(s) ' .3.HB12' (nmrStar names) not linked" rr_6e5k 2
72 4 25 1 "Not handling restraint 25, item 12, resonance(s) ' .3.HB11' (nmrStar names) not linked" rr_6e5k 2
73 4 25 1 "Not handling restraint 25, item 13, resonance(s) ' .3.HB13' (nmrStar names) not linked" rr_6e5k 2
74 4 25 1 "Not handling restraint 25, item 2, resonance(s) ' .6.HB12' (nmrStar names) not linked" rr_6e5k 2
75 4 25 1 "Not handling restraint 25, item 3, resonance(s) ' .6.HB11' (nmrStar names) not linked" rr_6e5k 2
76 4 25 1 "Not handling restraint 25, item 4, resonance(s) ' .6.HB13' (nmrStar names) not linked" rr_6e5k 2
77 4 25 1 "Not handling restraint 25, item 5, resonance(s) ' .9.HB12' (nmrStar names) not linked" rr_6e5k 2
78 4 25 1 "Not handling restraint 25, item 6, resonance(s) ' .9.HB11' (nmrStar names) not linked" rr_6e5k 2
79 4 25 1 "Not handling restraint 25, item 7, resonance(s) ' .9.HB13' (nmrStar names) not linked" rr_6e5k 2
80 4 25 1 "Not handling restraint 25, item 8, resonance(s) ' .9.HB22' (nmrStar names) not linked" rr_6e5k 2
81 4 25 1 "Not handling restraint 25, item 9, resonance(s) ' .9.HB21' (nmrStar names) not linked" rr_6e5k 2
82 4 29 1 "Not handling restraint 29, item 3, resonance(s) ' .12.HB12' (nmrStar names) not linked" rr_6e5k 2
83 4 29 1 "Not handling restraint 29, item 4, resonance(s) ' .12.HB11' (nmrStar names) not linked" rr_6e5k 2
84 4 29 1 "Not handling restraint 29, item 5, resonance(s) ' .12.HB13' (nmrStar names) not linked" rr_6e5k 2
85 4 34 1 "Not handling restraint 34, item 2, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 2
86 4 34 1 "Not handling restraint 34, item 3, resonance(s) ' .16.HM1' (nmrStar names) not linked" rr_6e5k 2
87 4 34 1 "Not handling restraint 34, item 4, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 2
88 4 34 1 "Not handling restraint 34, item 5, resonance(s) ' .16.HM2' (nmrStar names) not linked" rr_6e5k 2
89 4 34 1 "Not handling restraint 34, item 6, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 2
90 4 34 1 "Not handling restraint 34, item 7, resonance(s) ' .16.HM3' (nmrStar names) not linked" rr_6e5k 2
91 4 43 1 "Not handling restraint 43, item 2, resonance(s) ' .3.HB22' (nmrStar names) not linked" rr_6e5k 2
92 4 43 1 "Not handling restraint 43, item 3, resonance(s) ' .3.HB21' (nmrStar names) not linked" rr_6e5k 2
93 4 43 1 "Not handling restraint 43, item 4, resonance(s) ' .3.HB23' (nmrStar names) not linked" rr_6e5k 2
94 4 43 1 "Not handling restraint 43, item 5, resonance(s) ' .6.HB22' (nmrStar names) not linked" rr_6e5k 2
95 4 43 1 "Not handling restraint 43, item 6, resonance(s) ' .6.HB21' (nmrStar names) not linked" rr_6e5k 2
96 4 43 1 "Not handling restraint 43, item 7, resonance(s) ' .6.HB23' (nmrStar names) not linked" rr_6e5k 2
97 4 46 1 "Not handling restraint 46, item 10, resonance(s) ' .28.HN1' (nmrStar names),' .25.HM3' (nmrStar names) not linked" rr_6e5k 2
98 4 46 1 "Not handling restraint 46, item 2, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 2
99 4 46 1 "Not handling restraint 46, item 3, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 2
100 4 46 1 "Not handling restraint 46, item 4, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 2
101 4 46 1 "Not handling restraint 46, item 5, resonance(s) ' .25.HM1' (nmrStar names) not linked" rr_6e5k 2
102 4 46 1 "Not handling restraint 46, item 6, resonance(s) ' .25.HM2' (nmrStar names) not linked" rr_6e5k 2
103 4 46 1 "Not handling restraint 46, item 7, resonance(s) ' .25.HM3' (nmrStar names) not linked" rr_6e5k 2
104 4 46 1 "Not handling restraint 46, item 8, resonance(s) ' .28.HN1' (nmrStar names),' .25.HM1' (nmrStar names) not linked" rr_6e5k 2
105 4 46 1 "Not handling restraint 46, item 9, resonance(s) ' .28.HN1' (nmrStar names),' .25.HM2' (nmrStar names) not linked" rr_6e5k 2
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_6e5k
_Distance_constraint_list.ID 2
_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_6e5k 3
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_6e5k 3
2 1 . . . rr_6e5k 3
3 1 . . . rr_6e5k 3
4 1 . . . rr_6e5k 3
5 1 . . . rr_6e5k 3
6 1 . . . rr_6e5k 3
7 1 . . . rr_6e5k 3
8 1 . . . rr_6e5k 3
9 1 . . . rr_6e5k 3
10 1 . . . rr_6e5k 3
11 1 . . . rr_6e5k 3
12 1 . . . rr_6e5k 3
13 1 . . . rr_6e5k 3
14 1 . . . rr_6e5k 3
15 1 . . . rr_6e5k 3
16 1 . . . rr_6e5k 3
17 1 . . . rr_6e5k 3
18 1 . . . rr_6e5k 3
19 1 . . . rr_6e5k 3
20 1 . . . rr_6e5k 3
21 1 . . . rr_6e5k 3
22 1 . . . rr_6e5k 3
23 1 . . . rr_6e5k 3
24 1 . . . rr_6e5k 3
25 1 . . . rr_6e5k 3
26 1 . . . rr_6e5k 3
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 ABA H H . . . . 6 . HN rr_6e5k 3
1 1 . 2 . 1 1 2 2 ASP O O . . . . 2 . O rr_6e5k 3
2 1 . 1 . 1 1 6 6 ABA N N . . . . 6 . N rr_6e5k 3
2 1 . 2 . 1 1 2 2 ASP O O . . . . 2 . O rr_6e5k 3
3 1 . 1 . 1 1 7 7 LEU H H . . . . 7 . HN rr_6e5k 3
3 1 . 2 . 1 1 3 3 ABA O O . . . . 3 . O rr_6e5k 3
4 1 . 1 . 1 1 7 7 LEU N N . . . . 7 . N rr_6e5k 3
4 1 . 2 . 1 1 3 3 ABA O O . . . . 3 . O rr_6e5k 3
5 1 . 1 . 1 1 8 8 LYS H H . . . . 8 . HN rr_6e5k 3
5 1 . 2 . 1 1 4 4 CYS O O . . . . 4 . O rr_6e5k 3
6 1 . 1 . 1 1 8 8 LYS N N . . . . 8 . N rr_6e5k 3
6 1 . 2 . 1 1 4 4 CYS O O . . . . 4 . O rr_6e5k 3
7 1 . 1 . 1 1 9 9 ABA H H . . . . 9 . HN rr_6e5k 3
7 1 . 2 . 1 1 5 5 LYS O O . . . . 5 . O rr_6e5k 3
8 1 . 1 . 1 1 9 9 ABA N N . . . . 9 . N rr_6e5k 3
8 1 . 2 . 1 1 5 5 LYS O O . . . . 5 . O rr_6e5k 3
9 1 . 1 . 1 1 10 10 ARG H H . . . . 10 . HN rr_6e5k 3
9 1 . 2 . 1 1 6 6 ABA O O . . . . 6 . O rr_6e5k 3
10 1 . 1 . 1 1 10 10 ARG N N . . . . 10 . N rr_6e5k 3
10 1 . 2 . 1 1 6 6 ABA O O . . . . 6 . O rr_6e5k 3
11 1 . 1 . 1 1 11 11 TYR H H . . . . 11 . HN rr_6e5k 3
11 1 . 2 . 1 1 7 7 LEU O O . . . . 7 . O rr_6e5k 3
12 1 . 1 . 1 1 11 11 TYR N N . . . . 11 . N rr_6e5k 3
12 1 . 2 . 1 1 7 7 LEU O O . . . . 7 . O rr_6e5k 3
13 1 . 1 . 1 1 14 14 CYS H H . . . . 14 . HN rr_6e5k 3
13 1 . 2 . 1 1 11 11 TYR O O . . . . 11 . O rr_6e5k 3
14 1 . 1 . 1 1 14 14 CYS N N . . . . 14 . N rr_6e5k 3
14 1 . 2 . 1 1 11 11 TYR O O . . . . 11 . O rr_6e5k 3
15 1 . 1 . 1 1 22 22 ARG H H . . . . 22 . HN rr_6e5k 3
15 1 . 2 . 1 1 19 19 ASP O O . . . . 19 . O rr_6e5k 3
16 1 . 1 . 1 1 22 22 ARG N N . . . . 22 . N rr_6e5k 3
16 1 . 2 . 1 1 19 19 ASP O O . . . . 19 . O rr_6e5k 3
17 1 . 1 . 1 1 19 19 ASP H H . . . . 19 . HN rr_6e5k 3
17 1 . 2 . 1 1 22 22 ARG O O . . . . 22 . O rr_6e5k 3
18 1 . 1 . 1 1 19 19 ASP N N . . . . 19 . N rr_6e5k 3
18 1 . 2 . 1 1 22 22 ARG O O . . . . 22 . O rr_6e5k 3
19 1 . 1 . 1 1 24 24 GLU H H . . . . 24 . HN rr_6e5k 3
19 1 . 2 . 1 1 17 17 ARG O O . . . . 17 . O rr_6e5k 3
20 1 . 1 . 1 1 24 24 GLU N N . . . . 24 . N rr_6e5k 3
20 1 . 2 . 1 1 17 17 ARG O O . . . . 17 . O rr_6e5k 3
21 1 . 1 . 1 1 17 17 ARG H H . . . . 17 . HN rr_6e5k 3
21 1 . 2 . 1 1 24 24 GLU O O . . . . 24 . O rr_6e5k 3
22 1 . 1 . 1 1 17 17 ARG N N . . . . 17 . N rr_6e5k 3
22 1 . 2 . 1 1 24 24 GLU O O . . . . 24 . O rr_6e5k 3
23 1 . 1 . 1 1 26 26 HIS H H . . . . 26 . HN rr_6e5k 3
23 1 . 2 . 1 1 15 15 GLU O O . . . . 15 . O rr_6e5k 3
24 1 . 1 . 1 1 26 26 HIS N N . . . . 26 . N rr_6e5k 3
24 1 . 2 . 1 1 15 15 GLU O O . . . . 15 . O rr_6e5k 3
25 1 . 1 . 1 1 15 15 GLU H H . . . . 15 . HN rr_6e5k 3
25 1 . 2 . 1 1 26 26 HIS O O . . . . 26 . O rr_6e5k 3
26 1 . 1 . 1 1 15 15 GLU N N . . . . 15 . N rr_6e5k 3
26 1 . 2 . 1 1 26 26 HIS O O . . . . 26 . O rr_6e5k 3
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Spectral_peak_list_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
2 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
3 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
4 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
5 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
6 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
7 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
8 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
9 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
10 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
11 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
12 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
13 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
14 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
15 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
16 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
17 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
18 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
19 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
20 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
21 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
22 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
23 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
24 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
25 1 . . . . . . 1.9 1.8 2.0 rr_6e5k 3
26 1 . . . . . . 2.9 2.7 3.1 rr_6e5k 3
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 helix 2 1 2 7 rr_6e5k 3
2 "helix to hairpin turn" 15 1 15 23 rr_6e5k 3
3 hairpin 18 1 18 9 rr_6e5k 3
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 "# Restraints file 2: wsh2006_hbonds_v2.tbl" 1 1 1 42 rr_6e5k 3
stop_
save_
save_CNS/XPLOR_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_5
_Torsion_angle_constraint_list.Entry_ID rr_6e5k
_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 5
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_6e5k 1
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 3 3 ABA C C . . 1 1 4 4 CYS N N . . 1 1 4 4 CYS CA C . . 1 1 4 4 CYS C C . -90.0 -40.0 . . . A . 3 AIB C . . A . 4 CYS N . . A . 4 CYS CA . . A . 4 CYS C . . . 3 . C . . . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . rr_6e5k 1
2 . . 1 1 4 4 CYS C C . . 1 1 5 5 LYS N N . . 1 1 5 5 LYS CA C . . 1 1 5 5 LYS C C . -90.0 -40.0 . . . A . 4 CYS C . . A . 5 LYS N . . A . 5 LYS CA . . A . 5 LYS C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . rr_6e5k 1
3 . . 1 1 6 6 ABA C C . . 1 1 7 7 LEU N N . . 1 1 7 7 LEU CA C . . 1 1 7 7 LEU C C . -90.0 -40.0 . . . A . 6 AIB C . . A . 7 LEU N . . A . 7 LEU CA . . A . 7 LEU C . . . 6 . C . . . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . rr_6e5k 1
4 . . 1 1 7 7 LEU C C . . 1 1 8 8 LYS N N . . 1 1 8 8 LYS CA C . . 1 1 8 8 LYS C C . -90.0 -40.0 . . . A . 7 LEU C . . A . 8 LYS N . . A . 8 LYS CA . . A . 8 LYS C . . . 7 . C . . . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . rr_6e5k 1
5 . . 1 1 13 13 GLY C C . . 1 1 14 14 CYS N N . . 1 1 14 14 CYS CA C . . 1 1 14 14 CYS C C . -160.0 -80.0 . . . A . 13 GLY C . . A . 14 CYS N . . A . 14 CYS CA . . A . 14 CYS C . . . 13 . C . . . . . 14 . N . . . . . 14 . CA . . . . . 14 . C . . rr_6e5k 1
6 . . 1 1 17 17 ARG C C . . 1 1 18 18 CYS N N . . 1 1 18 18 CYS CA C . . 1 1 18 18 CYS C C . -160.0 -80.0 . . . A . 17 ARG C . . A . 18 CYS N . . A . 18 CYS CA . . A . 18 CYS C . . . 17 . C . . . . . 18 . N . . . . . 18 . CA . . . . . 18 . C . . rr_6e5k 1
7 . . 1 1 21 21 PRO C C . . 1 1 22 22 ARG N N . . 1 1 22 22 ARG CA C . . 1 1 22 22 ARG C C . -160.0 -80.0 . . . A . 21 PRO C . . A . 22 ARG N . . A . 22 ARG CA . . A . 22 ARG C . . . 21 . C . . . . . 22 . N . . . . . 22 . CA . . . . . 22 . C . . rr_6e5k 1
8 . . 1 1 22 22 ARG C C . . 1 1 23 23 TYR N N . . 1 1 23 23 TYR CA C . . 1 1 23 23 TYR C C . -160.0 -80.0 . . . A . 22 ARG C . . A . 23 TYR N . . A . 23 TYR CA . . A . 23 TYR C . . . 22 . C . . . . . 23 . N . . . . . 23 . CA . . . . . 23 . C . . rr_6e5k 1
9 . . 1 1 23 23 TYR C C . . 1 1 24 24 GLU N N . . 1 1 24 24 GLU CA C . . 1 1 24 24 GLU C C . -160.0 -80.0 . . . A . 23 TYR C . . A . 24 GLU N . . A . 24 GLU CA . . A . 24 GLU C . . . 23 . C . . . . . 24 . N . . . . . 24 . CA . . . . . 24 . C . . rr_6e5k 1
10 . . 1 1 25 25 MVA C C . . 1 1 26 26 HIS N N . . 1 1 26 26 HIS CA C . . 1 1 26 26 HIS C C . -160.0 -80.0 . . . A . 25 MVA C . . A . 26 HIS N . . A . 26 HIS CA . . A . 26 HIS C . . . 25 . C . . . . . 26 . N . . . . . 26 . CA . . . . . 26 . C . . rr_6e5k 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
;Phi angle constraints
C4
;
2 1 3 4 rr_6e5k 1
2 K5 6 1 6 4 rr_6e5k 1
3 L7 9 1 9 4 rr_6e5k 1
4 K8 12 1 12 4 rr_6e5k 1
5 C14 15 1 15 5 rr_6e5k 1
6 C18 18 1 18 5 rr_6e5k 1
7 R22 21 1 21 5 rr_6e5k 1
8 Y23 24 1 24 5 rr_6e5k 1
9 E24 27 1 27 5 rr_6e5k 1
10 H26 30 1 30 5 rr_6e5k 1
stop_
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1 "# Restraints file 4: wsh2006_dihedrals.tbl" 1 1 1 42 rr_6e5k 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_6e5k
_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 DE NOVO PROTEIN 20-JUL-18 6E5K *TITLE HETEROGENEOUS-BACKBONE MIMICS OF A DESIGNED DISULFIDE-RICH PROTEIN: *TITLE 2 AIB TURN, AIB HELIX, N-METHYL HAIRPIN *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: DESIGNED PEPTIDE NC_HEE_D1: AIB TURN, AIB HELIX, N-METHYL *COMPND 3 HAIRPIN MUTANT; *COMPND 4 CHAIN: A; *COMPND 5 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; *SOURCE 4 ORGANISM_TAXID: 32630 *KEYWDS HETEROGENEOUS BACKBONE FOLDAMER, DE NOVO PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 10 *AUTHOR C.C.CABALTEJA,D.S.MIHALKO,W.S.HORNE *REVDAT 1 21-NOV-18 6E5K 0"
save_
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