data_11335
#######################
# Entry information #
#######################
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 11335
_Entry.Title
;
Solution Structure of the RING domain of the human Cell growth regulator with
RING finger domain 1 protein
;
_Entry.Type macromolecule
_Entry.Version_type original
_Entry.Submission_date 2010-08-10
_Entry.Accession_date 2010-08-10
_Entry.Last_release_date 2011-08-19
_Entry.Original_release_date 2011-08-19
_Entry.Origination author
_Entry.NMR_STAR_version 3.1.1.61
_Entry.Original_NMR_STAR_version 3.0.9.14
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Details .
_Entry.BMRB_internal_directory_name .
loop_
_Entry_author.Ordinal
_Entry_author.Given_name
_Entry_author.Family_name
_Entry_author.First_initial
_Entry_author.Middle_initials
_Entry_author.Family_title
_Entry_author.Entry_ID
1 K. Miyamoto . . . 11335
2 T. Tomizawa . . . 11335
3 S. Koshiba . . . 11335
4 S. Watanabe . . . 11335
5 T. Harada . . . 11335
6 T. Kigawa . . . 11335
7 S. Yokoyama . . . 11335
stop_
loop_
_SG_project.SG_project_ID
_SG_project.Project_name
_SG_project.Full_name_of_center
_SG_project.Initial_of_center
_SG_project.Entry_ID
. 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11335
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts 1 11335
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
'13C chemical shifts' 245 11335
'15N chemical shifts' 63 11335
'1H chemical shifts' 398 11335
stop_
loop_
_Release.Release_number
_Release.Format_type
_Release.Format_version
_Release.Date
_Release.Submission_date
_Release.Type
_Release.Author
_Release.Detail
_Release.Entry_ID
1 . . 2011-08-19 2010-08-10 original author . 11335
stop_
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 2EA5 'BMRB Entry Tracking System' 11335
stop_
save_
###############
# Citations #
###############
save_citation_1
_Citation.Sf_category citations
_Citation.Sf_framecode citation_1
_Citation.Entry_ID 11335
_Citation.ID 1
_Citation.Class 'entry citation'
_Citation.CAS_abstract_code .
_Citation.MEDLINE_UI_code .
_Citation.DOI .
_Citation.PubMed_ID .
_Citation.Full_citation .
_Citation.Title
;
Solution Structure of the RING domain of the human Cell growth regulator with
RING finger domain 1 protein
;
_Citation.Status 'in preparation'
_Citation.Type journal
_Citation.Journal_abbrev .
_Citation.Journal_name_full .
_Citation.Journal_volume .
_Citation.Journal_issue .
_Citation.Journal_ASTM .
_Citation.Journal_ISSN .
_Citation.Journal_CSD .
_Citation.Book_title .
_Citation.Book_chapter_title .
_Citation.Book_volume .
_Citation.Book_series .
_Citation.Book_publisher .
_Citation.Book_publisher_city .
_Citation.Book_ISBN .
_Citation.Conference_title .
_Citation.Conference_site .
_Citation.Conference_state_province .
_Citation.Conference_country .
_Citation.Conference_start_date .
_Citation.Conference_end_date .
_Citation.Conference_abstract_number .
_Citation.Thesis_institution .
_Citation.Thesis_institution_city .
_Citation.Thesis_institution_country .
_Citation.WWW_URL .
_Citation.Page_first .
_Citation.Page_last .
_Citation.Year .
_Citation.Details .
loop_
_Citation_author.Ordinal
_Citation_author.Given_name
_Citation_author.Family_name
_Citation_author.First_initial
_Citation_author.Middle_initials
_Citation_author.Family_title
_Citation_author.Entry_ID
_Citation_author.Citation_ID
1 K. Miyamoto . . . 11335 1
2 T. Tomizawa . . . 11335 1
3 S. Koshiba . . . 11335 1
4 S. Watanabe . . . 11335 1
5 T. Harada . . . 11335 1
6 T. Kigawa . . . 11335 1
7 S. Yokoyama . . . 11335 1
stop_
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID 11335
_Assembly.ID 1
_Assembly.Name 'Cell growth regulator with RING finger domain protein 1'
_Assembly.BMRB_code .
_Assembly.Number_of_components 3
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Non_standard_bonds .
_Assembly.Ambiguous_conformational_states .
_Assembly.Ambiguous_chem_comp_sites .
_Assembly.Molecules_in_chemical_exchange .
_Assembly.Paramagnetic no
_Assembly.Thiol_state .
_Assembly.Molecular_mass .
_Assembly.Enzyme_commission_number .
_Assembly.Details .
_Assembly.DB_query_date .
_Assembly.DB_query_revised_last_date .
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 'RING domain' 1 $entity_1 A . yes native no no . . . 11335 1
2 'ZINC ION no.1' 2 $ZN B . no native no no . . . 11335 1
3 'ZINC ION no.2' 2 $ZN C . no native no no . . . 11335 1
stop_
loop_
_Bond.ID
_Bond.Type
_Bond.Value_order
_Bond.Assembly_atom_ID_1
_Bond.Entity_assembly_ID_1
_Bond.Entity_assembly_name_1
_Bond.Entity_ID_1
_Bond.Comp_ID_1
_Bond.Comp_index_ID_1
_Bond.Seq_ID_1
_Bond.Atom_ID_1
_Bond.Assembly_atom_ID_2
_Bond.Entity_assembly_ID_2
_Bond.Entity_assembly_name_2
_Bond.Entity_ID_2
_Bond.Comp_ID_2
_Bond.Comp_index_ID_2
_Bond.Seq_ID_2
_Bond.Atom_ID_2
_Bond.Auth_entity_assembly_ID_1
_Bond.Auth_entity_assembly_name_1
_Bond.Auth_seq_ID_1
_Bond.Auth_comp_ID_1
_Bond.Auth_atom_ID_1
_Bond.Auth_entity_assembly_ID_2
_Bond.Auth_entity_assembly_name_2
_Bond.Auth_seq_ID_2
_Bond.Auth_comp_ID_2
_Bond.Auth_atom_ID_2
_Bond.Entry_ID
_Bond.Assembly_ID
1 coordination single . 1 'RING domain' 1 CYS 18 18 SG . 2 'ZINC ION no.1' 2 ZN 1 1 ZN . . 18 CYS SG . . . . ZN 11335 1
2 coordination single . 1 'RING domain' 1 CYS 21 21 SG . 2 'ZINC ION no.1' 2 ZN 1 1 ZN . . 21 CYS SG . . . . ZN 11335 1
3 coordination single . 1 'RING domain' 1 CYS 39 39 SG . 2 'ZINC ION no.1' 2 ZN 1 1 ZN . . 39 CYS SG . . . . ZN 11335 1
4 coordination single . 1 'RING domain' 1 CYS 42 42 SG . 2 'ZINC ION no.1' 2 ZN 1 1 ZN . . 42 CYS SG . . . . ZN 11335 1
5 coordination single . 1 'RING domain' 1 CYS 33 33 SG . 3 'ZINC ION no.2' 2 ZN 1 1 ZN . . 33 CYS SG . . . . ZN 11335 1
6 coordination single . 1 'RING domain' 1 HIS 35 35 ND1 . 3 'ZINC ION no.2' 2 ZN 1 1 ZN . . 35 HIS ND1 . . . . ZN 11335 1
7 coordination single . 1 'RING domain' 1 CYS 49 49 SG . 3 'ZINC ION no.2' 2 ZN 1 1 ZN . . 49 CYS SG . . . . ZN 11335 1
8 coordination single . 1 'RING domain' 1 CYS 52 52 SG . 3 'ZINC ION no.2' 2 ZN 1 1 ZN . . 52 CYS SG . . . . ZN 11335 1
stop_
loop_
_Entity_deleted_atom.ID
_Entity_deleted_atom.Entity_atom_list_ID
_Entity_deleted_atom.Entity_assembly_ID
_Entity_deleted_atom.Entity_ID
_Entity_deleted_atom.Comp_ID
_Entity_deleted_atom.Comp_index_ID
_Entity_deleted_atom.Seq_ID
_Entity_deleted_atom.Atom_ID
_Entity_deleted_atom.Auth_entity_assembly_ID
_Entity_deleted_atom.Auth_seq_ID
_Entity_deleted_atom.Auth_comp_ID
_Entity_deleted_atom.Auth_atom_ID
_Entity_deleted_atom.Entry_ID
_Entity_deleted_atom.Assembly_ID
. . 1 1 CYS 49 49 HG . 49 CYS HG 11335 1
. . 1 1 CYS 52 52 HG . 52 CYS HG 11335 1
. . 1 1 CYS 33 33 HG . 33 CYS HG 11335 1
. . 1 1 HIS 35 35 HD1 . 35 HIS HD1 11335 1
. . 1 1 CYS 39 39 HG . 39 CYS HG 11335 1
. . 1 1 CYS 42 42 HG . 42 CYS HG 11335 1
. . 1 1 CYS 18 18 HG . 18 CYS HG 11335 1
. . 1 1 CYS 21 21 HG . 21 CYS HG 11335 1
stop_
loop_
_Assembly_db_link.Author_supplied
_Assembly_db_link.Database_code
_Assembly_db_link.Accession_code
_Assembly_db_link.Entry_mol_code
_Assembly_db_link.Entry_mol_name
_Assembly_db_link.Entry_experimental_method
_Assembly_db_link.Entry_structure_resolution
_Assembly_db_link.Entry_relation_type
_Assembly_db_link.Entry_details
_Assembly_db_link.Entry_ID
_Assembly_db_link.Assembly_ID
yes PDB 2ea5 . . . . . . 11335 1
stop_
save_
####################################
# Biological polymers and ligands #
####################################
save_entity_1
_Entity.Sf_category entity
_Entity.Sf_framecode entity_1
_Entity.Entry_ID 11335
_Entity.ID 1
_Entity.BMRB_code .
_Entity.Name 'RING domain'
_Entity.Type polymer
_Entity.Polymer_common_type .
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_type_details .
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code_can .
_Entity.Polymer_seq_one_letter_code
;
GSSGSSGVEPSEENSKDCVV
CQNGTVNWVLLPCRHTCLCD
GCVKYFQQCPMCRQFVQESF
ALSGPSSG
;
_Entity.Target_identifier .
_Entity.Polymer_author_defined_seq .
_Entity.Polymer_author_seq_details .
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer no
_Entity.Nstd_chirality no
_Entity.Nstd_linkage no
_Entity.Nonpolymer_comp_ID .
_Entity.Nonpolymer_comp_label .
_Entity.Number_of_monomers 68
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state 'free and other bound'
_Entity.Src_method .
_Entity.Parent_entity_ID .
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight .
_Entity.Formula_weight_exptl .
_Entity.Formula_weight_exptl_meth .
_Entity.Details .
_Entity.DB_query_date .
_Entity.DB_query_revised_last_date 2015-11-26
loop_
_Entity_db_link.Ordinal
_Entity_db_link.Author_supplied
_Entity_db_link.Database_code
_Entity_db_link.Accession_code
_Entity_db_link.Entry_mol_code
_Entity_db_link.Entry_mol_name
_Entity_db_link.Entry_experimental_method
_Entity_db_link.Entry_structure_resolution
_Entity_db_link.Entry_relation_type
_Entity_db_link.Entry_details
_Entity_db_link.Chimera_segment_ID
_Entity_db_link.Seq_query_to_submitted_percent
_Entity_db_link.Seq_subject_length
_Entity_db_link.Seq_identity
_Entity_db_link.Seq_positive
_Entity_db_link.Seq_homology_expectation_val
_Entity_db_link.Seq_align_begin
_Entity_db_link.Seq_align_end
_Entity_db_link.Seq_difference_details
_Entity_db_link.Seq_alignment_details
_Entity_db_link.Entry_ID
_Entity_db_link.Entity_ID
1 no PDB 2EA5 . "Solution Structure Of The Ring Domain Of The Human Cell Growth Regulator With Ring Finger Domain 1 Protein" . . . . . 100.00 68 100.00 100.00 1.24e-40 . . . . 11335 1
2 no REF XP_003987699 . "PREDICTED: cell growth regulator with RING finger domain protein 1 [Felis catus]" . . . . . 72.06 332 97.96 100.00 7.63e-27 . . . . 11335 1
3 no REF XP_004279384 . "PREDICTED: cell growth regulator with RING finger domain protein 1 [Orcinus orca]" . . . . . 72.06 332 97.96 100.00 1.57e-26 . . . . 11335 1
4 no REF XP_004324763 . "PREDICTED: cell growth regulator with RING finger domain protein 1 [Tursiops truncatus]" . . . . . 72.06 332 97.96 100.00 1.63e-26 . . . . 11335 1
5 no REF XP_005685937 . "PREDICTED: cell growth regulator with RING finger domain protein 1 [Capra hircus]" . . . . . 72.06 330 97.96 100.00 1.10e-26 . . . . 11335 1
6 no REF XP_007062773 . "PREDICTED: microtubule-associated protein futsch-like [Chelonia mydas]" . . . . . 75.00 608 98.04 98.04 5.60e-28 . . . . 11335 1
stop_
loop_
_Entity_common_name.Name
_Entity_common_name.Type
_Entity_common_name.Entry_ID
_Entity_common_name.Entity_ID
'RING domain' . 11335 1
stop_
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . GLY . 11335 1
2 . SER . 11335 1
3 . SER . 11335 1
4 . GLY . 11335 1
5 . SER . 11335 1
6 . SER . 11335 1
7 . GLY . 11335 1
8 . VAL . 11335 1
9 . GLU . 11335 1
10 . PRO . 11335 1
11 . SER . 11335 1
12 . GLU . 11335 1
13 . GLU . 11335 1
14 . ASN . 11335 1
15 . SER . 11335 1
16 . LYS . 11335 1
17 . ASP . 11335 1
18 . CYS . 11335 1
19 . VAL . 11335 1
20 . VAL . 11335 1
21 . CYS . 11335 1
22 . GLN . 11335 1
23 . ASN . 11335 1
24 . GLY . 11335 1
25 . THR . 11335 1
26 . VAL . 11335 1
27 . ASN . 11335 1
28 . TRP . 11335 1
29 . VAL . 11335 1
30 . LEU . 11335 1
31 . LEU . 11335 1
32 . PRO . 11335 1
33 . CYS . 11335 1
34 . ARG . 11335 1
35 . HIS . 11335 1
36 . THR . 11335 1
37 . CYS . 11335 1
38 . LEU . 11335 1
39 . CYS . 11335 1
40 . ASP . 11335 1
41 . GLY . 11335 1
42 . CYS . 11335 1
43 . VAL . 11335 1
44 . LYS . 11335 1
45 . TYR . 11335 1
46 . PHE . 11335 1
47 . GLN . 11335 1
48 . GLN . 11335 1
49 . CYS . 11335 1
50 . PRO . 11335 1
51 . MET . 11335 1
52 . CYS . 11335 1
53 . ARG . 11335 1
54 . GLN . 11335 1
55 . PHE . 11335 1
56 . VAL . 11335 1
57 . GLN . 11335 1
58 . GLU . 11335 1
59 . SER . 11335 1
60 . PHE . 11335 1
61 . ALA . 11335 1
62 . LEU . 11335 1
63 . SER . 11335 1
64 . GLY . 11335 1
65 . PRO . 11335 1
66 . SER . 11335 1
67 . SER . 11335 1
68 . GLY . 11335 1
stop_
loop_
_Entity_poly_seq.Hetero
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
. GLY 1 1 11335 1
. SER 2 2 11335 1
. SER 3 3 11335 1
. GLY 4 4 11335 1
. SER 5 5 11335 1
. SER 6 6 11335 1
. GLY 7 7 11335 1
. VAL 8 8 11335 1
. GLU 9 9 11335 1
. PRO 10 10 11335 1
. SER 11 11 11335 1
. GLU 12 12 11335 1
. GLU 13 13 11335 1
. ASN 14 14 11335 1
. SER 15 15 11335 1
. LYS 16 16 11335 1
. ASP 17 17 11335 1
. CYS 18 18 11335 1
. VAL 19 19 11335 1
. VAL 20 20 11335 1
. CYS 21 21 11335 1
. GLN 22 22 11335 1
. ASN 23 23 11335 1
. GLY 24 24 11335 1
. THR 25 25 11335 1
. VAL 26 26 11335 1
. ASN 27 27 11335 1
. TRP 28 28 11335 1
. VAL 29 29 11335 1
. LEU 30 30 11335 1
. LEU 31 31 11335 1
. PRO 32 32 11335 1
. CYS 33 33 11335 1
. ARG 34 34 11335 1
. HIS 35 35 11335 1
. THR 36 36 11335 1
. CYS 37 37 11335 1
. LEU 38 38 11335 1
. CYS 39 39 11335 1
. ASP 40 40 11335 1
. GLY 41 41 11335 1
. CYS 42 42 11335 1
. VAL 43 43 11335 1
. LYS 44 44 11335 1
. TYR 45 45 11335 1
. PHE 46 46 11335 1
. GLN 47 47 11335 1
. GLN 48 48 11335 1
. CYS 49 49 11335 1
. PRO 50 50 11335 1
. MET 51 51 11335 1
. CYS 52 52 11335 1
. ARG 53 53 11335 1
. GLN 54 54 11335 1
. PHE 55 55 11335 1
. VAL 56 56 11335 1
. GLN 57 57 11335 1
. GLU 58 58 11335 1
. SER 59 59 11335 1
. PHE 60 60 11335 1
. ALA 61 61 11335 1
. LEU 62 62 11335 1
. SER 63 63 11335 1
. GLY 64 64 11335 1
. PRO 65 65 11335 1
. SER 66 66 11335 1
. SER 67 67 11335 1
. GLY 68 68 11335 1
stop_
save_
save_ZN
_Entity.Sf_category entity
_Entity.Sf_framecode ZN
_Entity.Entry_ID 11335
_Entity.ID 2
_Entity.BMRB_code .
_Entity.Name ZN
_Entity.Type non-polymer
_Entity.Polymer_common_type .
_Entity.Polymer_type .
_Entity.Polymer_type_details .
_Entity.Polymer_strand_ID .
_Entity.Polymer_seq_one_letter_code_can .
_Entity.Polymer_seq_one_letter_code .
_Entity.Target_identifier .
_Entity.Polymer_author_defined_seq .
_Entity.Polymer_author_seq_details .
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer .
_Entity.Nstd_chirality no
_Entity.Nstd_linkage no
_Entity.Nonpolymer_comp_ID ZN
_Entity.Nonpolymer_comp_label $chem_comp_ZN
_Entity.Number_of_monomers .
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic .
_Entity.Thiol_state .
_Entity.Src_method .
_Entity.Parent_entity_ID 2
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight .
_Entity.Formula_weight_exptl .
_Entity.Formula_weight_exptl_meth .
_Entity.Details .
_Entity.DB_query_date .
_Entity.DB_query_revised_last_date .
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 . ZN . 11335 2
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Entity_natural_src_list.Sf_category natural_source
_Entity_natural_src_list.Sf_framecode natural_source
_Entity_natural_src_list.Entry_ID 11335
_Entity_natural_src_list.ID 1
loop_
_Entity_natural_src.ID
_Entity_natural_src.Entity_ID
_Entity_natural_src.Entity_label
_Entity_natural_src.Entity_chimera_segment_ID
_Entity_natural_src.NCBI_taxonomy_ID
_Entity_natural_src.Type
_Entity_natural_src.Common
_Entity_natural_src.Organism_name_scientific
_Entity_natural_src.Organism_name_common
_Entity_natural_src.Organism_acronym
_Entity_natural_src.ICTVdb_decimal_code
_Entity_natural_src.Superkingdom
_Entity_natural_src.Kingdom
_Entity_natural_src.Genus
_Entity_natural_src.Species
_Entity_natural_src.Strain
_Entity_natural_src.Variant
_Entity_natural_src.Subvariant
_Entity_natural_src.Organ
_Entity_natural_src.Tissue
_Entity_natural_src.Tissue_fraction
_Entity_natural_src.Cell_line
_Entity_natural_src.Cell_type
_Entity_natural_src.ATCC_number
_Entity_natural_src.Organelle
_Entity_natural_src.Cellular_location
_Entity_natural_src.Fragment
_Entity_natural_src.Fraction
_Entity_natural_src.Secretion
_Entity_natural_src.Plasmid
_Entity_natural_src.Plasmid_details
_Entity_natural_src.Gene_mnemonic
_Entity_natural_src.Dev_stage
_Entity_natural_src.Details
_Entity_natural_src.Citation_ID
_Entity_natural_src.Citation_label
_Entity_natural_src.Entry_ID
_Entity_natural_src.Entity_natural_src_list_ID
1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11335 1
stop_
save_
#########################
# Experimental source #
#########################
save_experimental_source
_Entity_experimental_src_list.Sf_category experimental_source
_Entity_experimental_src_list.Sf_framecode experimental_source
_Entity_experimental_src_list.Entry_ID 11335
_Entity_experimental_src_list.ID 1
loop_
_Entity_experimental_src.ID
_Entity_experimental_src.Entity_ID
_Entity_experimental_src.Entity_label
_Entity_experimental_src.Entity_chimera_segment_ID
_Entity_experimental_src.Production_method
_Entity_experimental_src.Host_org_scientific_name
_Entity_experimental_src.Host_org_name_common
_Entity_experimental_src.Host_org_details
_Entity_experimental_src.Host_org_NCBI_taxonomy_ID
_Entity_experimental_src.Host_org_genus
_Entity_experimental_src.Host_org_species
_Entity_experimental_src.Host_org_strain
_Entity_experimental_src.Host_org_variant
_Entity_experimental_src.Host_org_subvariant
_Entity_experimental_src.Host_org_organ
_Entity_experimental_src.Host_org_tissue
_Entity_experimental_src.Host_org_tissue_fraction
_Entity_experimental_src.Host_org_cell_line
_Entity_experimental_src.Host_org_cell_type
_Entity_experimental_src.Host_org_cellular_location
_Entity_experimental_src.Host_org_organelle
_Entity_experimental_src.Host_org_gene
_Entity_experimental_src.Host_org_culture_collection
_Entity_experimental_src.Host_org_ATCC_number
_Entity_experimental_src.Vector_type
_Entity_experimental_src.PDBview_host_org_vector_name
_Entity_experimental_src.PDBview_plasmid_name
_Entity_experimental_src.Vector_name
_Entity_experimental_src.Vector_details
_Entity_experimental_src.Vendor_name
_Entity_experimental_src.Host_org_dev_stage
_Entity_experimental_src.Details
_Entity_experimental_src.Citation_ID
_Entity_experimental_src.Citation_label
_Entity_experimental_src.Entry_ID
_Entity_experimental_src.Entity_experimental_src_list_ID
1 1 $entity_1 . 'cell free synthesis' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . plasmid . . P051017-24 . . . . . . 11335 1
stop_
save_
#################################
# Polymer residues and ligands #
#################################
save_chem_comp_ZN
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_ZN
_Chem_comp.Entry_ID 11335
_Chem_comp.ID ZN
_Chem_comp.Provenance .
_Chem_comp.Name 'ZINC ION'
_Chem_comp.Type non-polymer
_Chem_comp.BMRB_code .
_Chem_comp.PDB_code ZN
_Chem_comp.Ambiguous_flag no
_Chem_comp.Initial_date 1999-07-08
_Chem_comp.Modified_date 2008-12-05
_Chem_comp.Release_status REL
_Chem_comp.Replaced_by .
_Chem_comp.Replaces .
_Chem_comp.One_letter_code .
_Chem_comp.Three_letter_code ZN
_Chem_comp.Number_atoms_all .
_Chem_comp.Number_atoms_nh .
_Chem_comp.PubChem_code .
_Chem_comp.Subcomponent_list .
_Chem_comp.InChI_code .
_Chem_comp.Mon_nstd_flag .
_Chem_comp.Mon_nstd_class .
_Chem_comp.Mon_nstd_details .
_Chem_comp.Mon_nstd_parent .
_Chem_comp.Mon_nstd_parent_comp_ID .
_Chem_comp.Std_deriv_one_letter_code .
_Chem_comp.Std_deriv_three_letter_code .
_Chem_comp.Std_deriv_BMRB_code .
_Chem_comp.Std_deriv_PDB_code .
_Chem_comp.Std_deriv_chem_comp_name .
_Chem_comp.Synonyms .
_Chem_comp.Formal_charge 2
_Chem_comp.Paramagnetic .
_Chem_comp.Aromatic no
_Chem_comp.Formula Zn
_Chem_comp.Formula_weight 65.409
_Chem_comp.Formula_mono_iso_wt_nat .
_Chem_comp.Formula_mono_iso_wt_13C .
_Chem_comp.Formula_mono_iso_wt_15N .
_Chem_comp.Formula_mono_iso_wt_13C_15N .
_Chem_comp.Image_file_name .
_Chem_comp.Image_file_format .
_Chem_comp.Topo_file_name .
_Chem_comp.Topo_file_format .
_Chem_comp.Struct_file_name .
_Chem_comp.Struct_file_format .
_Chem_comp.Stereochem_param_file_name .
_Chem_comp.Stereochem_param_file_format .
_Chem_comp.Model_details .
_Chem_comp.Model_erf .
_Chem_comp.Model_source .
_Chem_comp.Model_coordinates_details .
_Chem_comp.Model_coordinates_missing_flag no
_Chem_comp.Ideal_coordinates_details .
_Chem_comp.Ideal_coordinates_missing_flag no
_Chem_comp.Model_coordinates_db_code .
_Chem_comp.Processing_site RCSB
_Chem_comp.Vendor .
_Chem_comp.Vendor_product_code .
_Chem_comp.Details
;
Information obtained from PDB's Chemical Component Dictionary
at http://wwpdb-remediation.rutgers.edu/downloads.html
Downloaded on Tue Jun 9 16:52:42 2009
;
_Chem_comp.DB_query_date .
_Chem_comp.DB_last_query_revised_last_date .
loop_
_Chem_comp_descriptor.Descriptor
_Chem_comp_descriptor.Type
_Chem_comp_descriptor.Program
_Chem_comp_descriptor.Program_version
_Chem_comp_descriptor.Entry_ID
_Chem_comp_descriptor.Comp_ID
InChI=1/Zn/q+2 InChI InChI 1.02b 11335 ZN
PTFCDOFLOPIGGS-UHFFFAOYAK InChIKey InChI 1.02b 11335 ZN
[Zn++] SMILES CACTVS 3.341 11335 ZN
[Zn++] SMILES_CANONICAL CACTVS 3.341 11335 ZN
[Zn+2] SMILES ACDLabs 10.04 11335 ZN
[Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 11335 ZN
[Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 11335 ZN
stop_
loop_
_Chem_comp_identifier.Identifier
_Chem_comp_identifier.Type
_Chem_comp_identifier.Program
_Chem_comp_identifier.Program_version
_Chem_comp_identifier.Entry_ID
_Chem_comp_identifier.Comp_ID
zinc 'SYSTEMATIC NAME' ACDLabs 10.04 11335 ZN
'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 11335 ZN
stop_
loop_
_Chem_comp_atom.Atom_ID
_Chem_comp_atom.BMRB_code
_Chem_comp_atom.PDB_atom_ID
_Chem_comp_atom.Alt_atom_ID
_Chem_comp_atom.Auth_atom_ID
_Chem_comp_atom.Type_symbol
_Chem_comp_atom.Isotope_number
_Chem_comp_atom.Chirality
_Chem_comp_atom.Stereo_config
_Chem_comp_atom.Charge
_Chem_comp_atom.Partial_charge
_Chem_comp_atom.Oxidation_number
_Chem_comp_atom.Unpaired_electron_number
_Chem_comp_atom.Align
_Chem_comp_atom.Aromatic_flag
_Chem_comp_atom.Leaving_atom_flag
_Chem_comp_atom.Substruct_code
_Chem_comp_atom.Ionizable
_Chem_comp_atom.Drawing_2D_coord_x
_Chem_comp_atom.Drawing_2D_coord_y
_Chem_comp_atom.Model_Cartn_x
_Chem_comp_atom.Model_Cartn_x_esd
_Chem_comp_atom.Model_Cartn_y
_Chem_comp_atom.Model_Cartn_y_esd
_Chem_comp_atom.Model_Cartn_z
_Chem_comp_atom.Model_Cartn_z_esd
_Chem_comp_atom.Model_Cartn_x_ideal
_Chem_comp_atom.Model_Cartn_y_ideal
_Chem_comp_atom.Model_Cartn_z_ideal
_Chem_comp_atom.PDBX_ordinal
_Chem_comp_atom.Details
_Chem_comp_atom.Entry_ID
_Chem_comp_atom.Comp_ID
ZN . ZN . . ZN . . N 2 . . . . no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 11335 ZN
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Sample.Sf_category sample
_Sample.Sf_framecode sample_1
_Sample.Entry_ID 11335
_Sample.ID 1
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details
;
1.10mM RING domain {U-13C,15N;} 20mM {d-Tris-HCl(pH7.0);} 100mM {NaCl;}
1mM {d-DTT;} 0.02% {NaN3;} 0.05mM {ZNCl2;} 1.0mM {IDA;} 90% H2O, 10% D2O
;
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '90% H2O/10% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 'RING domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.10 . . mM . . . . 11335 1
2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11335 1
3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11335 1
4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11335 1
5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11335 1
6 ZnCl2 'natural abundance' . . . . . salt 0.05 . . mM . . . . 11335 1
7 IDA 'natural abundance' . . . . . salt 1.0 . . mM . . . . 11335 1
8 H2O . . . . . . solvent 90 . . % . . . . 11335 1
9 D2O . . . . . . solvent 10 . . % . . . . 11335 1
stop_
save_
#######################
# Sample conditions #
#######################
save_condition_1
_Sample_condition_list.Sf_category sample_conditions
_Sample_condition_list.Sf_framecode condition_1
_Sample_condition_list.Entry_ID 11335
_Sample_condition_list.ID 1
_Sample_condition_list.Details .
loop_
_Sample_condition_variable.Type
_Sample_condition_variable.Val
_Sample_condition_variable.Val_err
_Sample_condition_variable.Val_units
_Sample_condition_variable.Entry_ID
_Sample_condition_variable.Sample_condition_list_ID
'ionic strength' 120 0.1 mM 11335 1
pH 7.0 0.05 pH 11335 1
pressure 1 0.001 atm 11335 1
temperature 296 0.1 K 11335 1
stop_
save_
############################
# Computer software used #
############################
save_TOPSPIN
_Software.Sf_category software
_Software.Sf_framecode TOPSPIN
_Software.Entry_ID 11335
_Software.ID 1
_Software.Name TOPSPIN
_Software.Version 1.3
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
Bruker . . 11335 1
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
collection 11335 1
stop_
save_
save_NMRPipe
_Software.Sf_category software
_Software.Sf_framecode NMRPipe
_Software.Entry_ID 11335
_Software.ID 2
_Software.Name NMRPipe
_Software.Version 20031121
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Delaglio, F.' . . 11335 2
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
processing 11335 2
stop_
save_
save_NMRView
_Software.Sf_category software
_Software.Sf_framecode NMRView
_Software.Entry_ID 11335
_Software.ID 3
_Software.Name NMRView
_Software.Version 5.0.4
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Johnson, B. A.' . . 11335 3
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data analysis' 11335 3
stop_
save_
save_Kujira
_Software.Sf_category software
_Software.Sf_framecode Kujira
_Software.Entry_ID 11335
_Software.ID 4
_Software.Name Kujira
_Software.Version 0.9820
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Kobayashi, N.' . . 11335 4
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data analysis' 11335 4
stop_
save_
save_CYANA
_Software.Sf_category software
_Software.Sf_framecode CYANA
_Software.Entry_ID 11335
_Software.ID 5
_Software.Name CYANA
_Software.Version 2.0.17
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Guntert, P.' . . 11335 5
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
refinement 11335 5
'structure solution' 11335 5
stop_
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_spectrometer_1
_NMR_spectrometer.Sf_category NMR_spectrometer
_NMR_spectrometer.Sf_framecode spectrometer_1
_NMR_spectrometer.Entry_ID 11335
_NMR_spectrometer.ID 1
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model 'AVANCE II'
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 900
save_
save_NMR_spectrometer_list
_NMR_spectrometer_list.Sf_category NMR_spectrometer_list
_NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list
_NMR_spectrometer_list.Entry_ID 11335
_NMR_spectrometer_list.ID 1
loop_
_NMR_spectrometer_view.ID
_NMR_spectrometer_view.Name
_NMR_spectrometer_view.Manufacturer
_NMR_spectrometer_view.Model
_NMR_spectrometer_view.Serial_number
_NMR_spectrometer_view.Field_strength
_NMR_spectrometer_view.Details
_NMR_spectrometer_view.Citation_ID
_NMR_spectrometer_view.Citation_label
_NMR_spectrometer_view.Entry_ID
_NMR_spectrometer_view.NMR_spectrometer_list_ID
1 spectrometer_1 Bruker 'AVANCE II' . 900 . . . 11335 1
stop_
save_
#############################
# NMR applied experiments #
#############################
save_experiment_list
_Experiment_list.Sf_category experiment_list
_Experiment_list.Sf_framecode experiment_list
_Experiment_list.Entry_ID 11335
_Experiment_list.ID 1
_Experiment_list.Details .
loop_
_Experiment.ID
_Experiment.Name
_Experiment.Raw_data_flag
_Experiment.NMR_spec_expt_ID
_Experiment.NMR_spec_expt_label
_Experiment.MS_expt_ID
_Experiment.MS_expt_label
_Experiment.SAXS_expt_ID
_Experiment.SAXS_expt_label
_Experiment.FRET_expt_ID
_Experiment.FRET_expt_label
_Experiment.EMR_expt_ID
_Experiment.EMR_expt_label
_Experiment.Sample_ID
_Experiment.Sample_label
_Experiment.Sample_state
_Experiment.Sample_volume
_Experiment.Sample_volume_units
_Experiment.Sample_condition_list_ID
_Experiment.Sample_condition_list_label
_Experiment.Sample_spinning_rate
_Experiment.Sample_angle
_Experiment.NMR_tube_type
_Experiment.NMR_spectrometer_ID
_Experiment.NMR_spectrometer_label
_Experiment.NMR_spectrometer_probe_ID
_Experiment.NMR_spectrometer_probe_label
_Experiment.NMR_spectral_processing_ID
_Experiment.NMR_spectral_processing_label
_Experiment.Mass_spectrometer_ID
_Experiment.Mass_spectrometer_label
_Experiment.Xray_instrument_ID
_Experiment.Xray_instrument_label
_Experiment.Fluorescence_instrument_ID
_Experiment.Fluorescence_instrument_label
_Experiment.EMR_instrument_ID
_Experiment.EMR_instrument_label
_Experiment.Chromatographic_system_ID
_Experiment.Chromatographic_system_label
_Experiment.Chromatographic_column_ID
_Experiment.Chromatographic_column_label
_Experiment.Entry_ID
_Experiment.Experiment_list_ID
1 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11335 1
2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11335 1
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_reference_1
_Chem_shift_reference.Sf_category chem_shift_reference
_Chem_shift_reference.Sf_framecode reference_1
_Chem_shift_reference.Entry_ID 11335
_Chem_shift_reference.ID 1
_Chem_shift_reference.Details
;
Chemical shift reference of 1H was based on the proton of water (4.784ppm at
298K) and then those of 15N and 13C were calculated based on their gyromagnetic
ratios.
;
loop_
_Chem_shift_ref.Atom_type
_Chem_shift_ref.Atom_isotope_number
_Chem_shift_ref.Mol_common_name
_Chem_shift_ref.Atom_group
_Chem_shift_ref.Concentration_val
_Chem_shift_ref.Concentration_units
_Chem_shift_ref.Solvent
_Chem_shift_ref.Rank
_Chem_shift_ref.Chem_shift_units
_Chem_shift_ref.Chem_shift_val
_Chem_shift_ref.Ref_method
_Chem_shift_ref.Ref_type
_Chem_shift_ref.Indirect_shift_ratio
_Chem_shift_ref.External_ref_loc
_Chem_shift_ref.External_ref_sample_geometry
_Chem_shift_ref.External_ref_axis
_Chem_shift_ref.Indirect_shift_ratio_cit_ID
_Chem_shift_ref.Indirect_shift_ratio_cit_label
_Chem_shift_ref.Ref_correction_type
_Chem_shift_ref.Correction_val
_Chem_shift_ref.Correction_val_cit_ID
_Chem_shift_ref.Correction_val_cit_label
_Chem_shift_ref.Entry_ID
_Chem_shift_ref.Chem_shift_reference_ID
C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 11335 1
H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11335 1
N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11335 1
stop_
save_
###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 11335
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11335 1
2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11335 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $TOPSPIN . . 11335 1
2 $NMRPipe . . 11335 1
3 $NMRView . . 11335 1
4 $Kujira . . 11335 1
5 $CYANA . . 11335 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 7 7 GLY H H 1 8.425 0.030 . 1 . . . . 7 GLY H . 11335 1
2 . 1 1 7 7 GLY HA2 H 1 3.991 0.030 . 1 . . . . 7 GLY HA2 . 11335 1
3 . 1 1 7 7 GLY HA3 H 1 3.991 0.030 . 1 . . . . 7 GLY HA3 . 11335 1
4 . 1 1 7 7 GLY C C 13 173.827 0.300 . 1 . . . . 7 GLY C . 11335 1
5 . 1 1 7 7 GLY CA C 13 45.309 0.300 . 1 . . . . 7 GLY CA . 11335 1
6 . 1 1 7 7 GLY N N 15 111.252 0.300 . 1 . . . . 7 GLY N . 11335 1
7 . 1 1 8 8 VAL H H 1 7.951 0.030 . 1 . . . . 8 VAL H . 11335 1
8 . 1 1 8 8 VAL HA H 1 4.172 0.030 . 1 . . . . 8 VAL HA . 11335 1
9 . 1 1 8 8 VAL HB H 1 2.060 0.030 . 1 . . . . 8 VAL HB . 11335 1
10 . 1 1 8 8 VAL HG11 H 1 0.903 0.030 . 1 . . . . 8 VAL HG1 . 11335 1
11 . 1 1 8 8 VAL HG12 H 1 0.903 0.030 . 1 . . . . 8 VAL HG1 . 11335 1
12 . 1 1 8 8 VAL HG13 H 1 0.903 0.030 . 1 . . . . 8 VAL HG1 . 11335 1
13 . 1 1 8 8 VAL HG21 H 1 0.892 0.030 . 1 . . . . 8 VAL HG2 . 11335 1
14 . 1 1 8 8 VAL HG22 H 1 0.892 0.030 . 1 . . . . 8 VAL HG2 . 11335 1
15 . 1 1 8 8 VAL HG23 H 1 0.892 0.030 . 1 . . . . 8 VAL HG2 . 11335 1
16 . 1 1 8 8 VAL C C 13 176.062 0.300 . 1 . . . . 8 VAL C . 11335 1
17 . 1 1 8 8 VAL CA C 13 61.873 0.300 . 1 . . . . 8 VAL CA . 11335 1
18 . 1 1 8 8 VAL CB C 13 32.944 0.300 . 1 . . . . 8 VAL CB . 11335 1
19 . 1 1 8 8 VAL CG1 C 13 21.168 0.300 . 2 . . . . 8 VAL CG1 . 11335 1
20 . 1 1 8 8 VAL CG2 C 13 20.460 0.300 . 2 . . . . 8 VAL CG2 . 11335 1
21 . 1 1 8 8 VAL N N 15 119.183 0.300 . 1 . . . . 8 VAL N . 11335 1
22 . 1 1 9 9 GLU H H 1 8.549 0.030 . 1 . . . . 9 GLU H . 11335 1
23 . 1 1 9 9 GLU HA H 1 4.602 0.030 . 1 . . . . 9 GLU HA . 11335 1
24 . 1 1 9 9 GLU HB2 H 1 2.053 0.030 . 2 . . . . 9 GLU HB2 . 11335 1
25 . 1 1 9 9 GLU HB3 H 1 1.895 0.030 . 2 . . . . 9 GLU HB3 . 11335 1
26 . 1 1 9 9 GLU HG2 H 1 2.305 0.030 . 1 . . . . 9 GLU HG2 . 11335 1
27 . 1 1 9 9 GLU HG3 H 1 2.305 0.030 . 1 . . . . 9 GLU HG3 . 11335 1
28 . 1 1 9 9 GLU C C 13 174.627 0.300 . 1 . . . . 9 GLU C . 11335 1
29 . 1 1 9 9 GLU CA C 13 54.341 0.300 . 1 . . . . 9 GLU CA . 11335 1
30 . 1 1 9 9 GLU CB C 13 29.591 0.300 . 1 . . . . 9 GLU CB . 11335 1
31 . 1 1 9 9 GLU CG C 13 35.991 0.300 . 1 . . . . 9 GLU CG . 11335 1
32 . 1 1 9 9 GLU N N 15 126.678 0.300 . 1 . . . . 9 GLU N . 11335 1
33 . 1 1 10 10 PRO HA H 1 4.446 0.030 . 1 . . . . 10 PRO HA . 11335 1
34 . 1 1 10 10 PRO HB2 H 1 1.952 0.030 . 2 . . . . 10 PRO HB2 . 11335 1
35 . 1 1 10 10 PRO HB3 H 1 2.309 0.030 . 2 . . . . 10 PRO HB3 . 11335 1
36 . 1 1 10 10 PRO HD2 H 1 3.841 0.030 . 2 . . . . 10 PRO HD2 . 11335 1
37 . 1 1 10 10 PRO HD3 H 1 3.730 0.030 . 2 . . . . 10 PRO HD3 . 11335 1
38 . 1 1 10 10 PRO HG2 H 1 2.008 0.030 . 2 . . . . 10 PRO HG2 . 11335 1
39 . 1 1 10 10 PRO HG3 H 1 2.065 0.030 . 2 . . . . 10 PRO HG3 . 11335 1
40 . 1 1 10 10 PRO C C 13 177.587 0.300 . 1 . . . . 10 PRO C . 11335 1
41 . 1 1 10 10 PRO CA C 13 63.370 0.300 . 1 . . . . 10 PRO CA . 11335 1
42 . 1 1 10 10 PRO CB C 13 32.199 0.300 . 1 . . . . 10 PRO CB . 11335 1
43 . 1 1 10 10 PRO CD C 13 50.733 0.300 . 1 . . . . 10 PRO CD . 11335 1
44 . 1 1 10 10 PRO CG C 13 27.384 0.300 . 1 . . . . 10 PRO CG . 11335 1
45 . 1 1 11 11 SER H H 1 8.663 0.030 . 1 . . . . 11 SER H . 11335 1
46 . 1 1 11 11 SER HA H 1 4.460 0.030 . 1 . . . . 11 SER HA . 11335 1
47 . 1 1 11 11 SER HB2 H 1 3.756 0.030 . 2 . . . . 11 SER HB2 . 11335 1
48 . 1 1 11 11 SER HB3 H 1 3.949 0.030 . 2 . . . . 11 SER HB3 . 11335 1
49 . 1 1 11 11 SER C C 13 174.716 0.300 . 1 . . . . 11 SER C . 11335 1
50 . 1 1 11 11 SER CA C 13 58.267 0.300 . 1 . . . . 11 SER CA . 11335 1
51 . 1 1 11 11 SER CB C 13 64.066 0.300 . 1 . . . . 11 SER CB . 11335 1
52 . 1 1 11 11 SER N N 15 116.394 0.300 . 1 . . . . 11 SER N . 11335 1
53 . 1 1 12 12 GLU H H 1 8.523 0.030 . 1 . . . . 12 GLU H . 11335 1
54 . 1 1 12 12 GLU HA H 1 4.318 0.030 . 1 . . . . 12 GLU HA . 11335 1
55 . 1 1 12 12 GLU HB2 H 1 1.957 0.030 . 1 . . . . 12 GLU HB2 . 11335 1
56 . 1 1 12 12 GLU HB3 H 1 1.957 0.030 . 1 . . . . 12 GLU HB3 . 11335 1
57 . 1 1 12 12 GLU HG2 H 1 2.304 0.030 . 1 . . . . 12 GLU HG2 . 11335 1
58 . 1 1 12 12 GLU HG3 H 1 2.304 0.030 . 1 . . . . 12 GLU HG3 . 11335 1
59 . 1 1 12 12 GLU C C 13 176.616 0.300 . 1 . . . . 12 GLU C . 11335 1
60 . 1 1 12 12 GLU CA C 13 56.704 0.300 . 1 . . . . 12 GLU CA . 11335 1
61 . 1 1 12 12 GLU CB C 13 30.202 0.300 . 1 . . . . 12 GLU CB . 11335 1
62 . 1 1 12 12 GLU CG C 13 36.210 0.300 . 1 . . . . 12 GLU CG . 11335 1
63 . 1 1 12 12 GLU N N 15 123.214 0.300 . 1 . . . . 12 GLU N . 11335 1
64 . 1 1 13 13 GLU H H 1 8.423 0.030 . 1 . . . . 13 GLU H . 11335 1
65 . 1 1 13 13 GLU HA H 1 4.257 0.030 . 1 . . . . 13 GLU HA . 11335 1
66 . 1 1 13 13 GLU HB2 H 1 1.922 0.030 . 2 . . . . 13 GLU HB2 . 11335 1
67 . 1 1 13 13 GLU HB3 H 1 2.033 0.030 . 2 . . . . 13 GLU HB3 . 11335 1
68 . 1 1 13 13 GLU HG2 H 1 2.255 0.030 . 1 . . . . 13 GLU HG2 . 11335 1
69 . 1 1 13 13 GLU HG3 H 1 2.255 0.030 . 1 . . . . 13 GLU HG3 . 11335 1
70 . 1 1 13 13 GLU C C 13 176.263 0.300 . 1 . . . . 13 GLU C . 11335 1
71 . 1 1 13 13 GLU CA C 13 56.780 0.300 . 1 . . . . 13 GLU CA . 11335 1
72 . 1 1 13 13 GLU CB C 13 30.271 0.300 . 1 . . . . 13 GLU CB . 11335 1
73 . 1 1 13 13 GLU CG C 13 36.202 0.300 . 1 . . . . 13 GLU CG . 11335 1
74 . 1 1 13 13 GLU N N 15 121.877 0.300 . 1 . . . . 13 GLU N . 11335 1
75 . 1 1 14 14 ASN H H 1 8.393 0.030 . 1 . . . . 14 ASN H . 11335 1
76 . 1 1 14 14 ASN HA H 1 4.784 0.030 . 1 . . . . 14 ASN HA . 11335 1
77 . 1 1 14 14 ASN HB2 H 1 2.858 0.030 . 2 . . . . 14 ASN HB2 . 11335 1
78 . 1 1 14 14 ASN HB3 H 1 2.762 0.030 . 2 . . . . 14 ASN HB3 . 11335 1
79 . 1 1 14 14 ASN HD21 H 1 6.909 0.030 . 2 . . . . 14 ASN HD21 . 11335 1
80 . 1 1 14 14 ASN HD22 H 1 7.603 0.030 . 2 . . . . 14 ASN HD22 . 11335 1
81 . 1 1 14 14 ASN C C 13 175.233 0.300 . 1 . . . . 14 ASN C . 11335 1
82 . 1 1 14 14 ASN CA C 13 53.066 0.300 . 1 . . . . 14 ASN CA . 11335 1
83 . 1 1 14 14 ASN CB C 13 39.248 0.300 . 1 . . . . 14 ASN CB . 11335 1
84 . 1 1 14 14 ASN N N 15 119.940 0.300 . 1 . . . . 14 ASN N . 11335 1
85 . 1 1 14 14 ASN ND2 N 15 112.776 0.300 . 1 . . . . 14 ASN ND2 . 11335 1
86 . 1 1 15 15 SER H H 1 8.365 0.030 . 1 . . . . 15 SER H . 11335 1
87 . 1 1 15 15 SER HA H 1 4.384 0.030 . 1 . . . . 15 SER HA . 11335 1
88 . 1 1 15 15 SER HB2 H 1 3.858 0.030 . 2 . . . . 15 SER HB2 . 11335 1
89 . 1 1 15 15 SER HB3 H 1 3.924 0.030 . 2 . . . . 15 SER HB3 . 11335 1
90 . 1 1 15 15 SER C C 13 174.565 0.300 . 1 . . . . 15 SER C . 11335 1
91 . 1 1 15 15 SER CA C 13 58.823 0.300 . 1 . . . . 15 SER CA . 11335 1
92 . 1 1 15 15 SER CB C 13 63.602 0.300 . 1 . . . . 15 SER CB . 11335 1
93 . 1 1 15 15 SER N N 15 117.161 0.300 . 1 . . . . 15 SER N . 11335 1
94 . 1 1 16 16 LYS H H 1 8.458 0.030 . 1 . . . . 16 LYS H . 11335 1
95 . 1 1 16 16 LYS HA H 1 4.215 0.030 . 1 . . . . 16 LYS HA . 11335 1
96 . 1 1 16 16 LYS HB2 H 1 1.711 0.030 . 2 . . . . 16 LYS HB2 . 11335 1
97 . 1 1 16 16 LYS HB3 H 1 1.877 0.030 . 2 . . . . 16 LYS HB3 . 11335 1
98 . 1 1 16 16 LYS HD2 H 1 1.666 0.030 . 1 . . . . 16 LYS HD2 . 11335 1
99 . 1 1 16 16 LYS HD3 H 1 1.666 0.030 . 1 . . . . 16 LYS HD3 . 11335 1
100 . 1 1 16 16 LYS HE2 H 1 2.997 0.030 . 1 . . . . 16 LYS HE2 . 11335 1
101 . 1 1 16 16 LYS HE3 H 1 2.997 0.030 . 1 . . . . 16 LYS HE3 . 11335 1
102 . 1 1 16 16 LYS HG2 H 1 1.407 0.030 . 2 . . . . 16 LYS HG2 . 11335 1
103 . 1 1 16 16 LYS HG3 H 1 1.304 0.030 . 2 . . . . 16 LYS HG3 . 11335 1
104 . 1 1 16 16 LYS C C 13 175.420 0.300 . 1 . . . . 16 LYS C . 11335 1
105 . 1 1 16 16 LYS CA C 13 56.202 0.300 . 1 . . . . 16 LYS CA . 11335 1
106 . 1 1 16 16 LYS CB C 13 32.179 0.300 . 1 . . . . 16 LYS CB . 11335 1
107 . 1 1 16 16 LYS CD C 13 29.042 0.300 . 1 . . . . 16 LYS CD . 11335 1
108 . 1 1 16 16 LYS CE C 13 42.231 0.300 . 1 . . . . 16 LYS CE . 11335 1
109 . 1 1 16 16 LYS CG C 13 24.967 0.300 . 1 . . . . 16 LYS CG . 11335 1
110 . 1 1 16 16 LYS N N 15 123.097 0.300 . 1 . . . . 16 LYS N . 11335 1
111 . 1 1 17 17 ASP H H 1 8.149 0.030 . 1 . . . . 17 ASP H . 11335 1
112 . 1 1 17 17 ASP HA H 1 4.695 0.030 . 1 . . . . 17 ASP HA . 11335 1
113 . 1 1 17 17 ASP HB2 H 1 2.534 0.030 . 1 . . . . 17 ASP HB2 . 11335 1
114 . 1 1 17 17 ASP HB3 H 1 2.534 0.030 . 1 . . . . 17 ASP HB3 . 11335 1
115 . 1 1 17 17 ASP C C 13 175.579 0.300 . 1 . . . . 17 ASP C . 11335 1
116 . 1 1 17 17 ASP CA C 13 53.619 0.300 . 1 . . . . 17 ASP CA . 11335 1
117 . 1 1 17 17 ASP CB C 13 41.360 0.300 . 1 . . . . 17 ASP CB . 11335 1
118 . 1 1 17 17 ASP N N 15 119.497 0.300 . 1 . . . . 17 ASP N . 11335 1
119 . 1 1 18 18 CYS H H 1 8.327 0.030 . 1 . . . . 18 CYS H . 11335 1
120 . 1 1 18 18 CYS HA H 1 3.873 0.030 . 1 . . . . 18 CYS HA . 11335 1
121 . 1 1 18 18 CYS HB2 H 1 3.144 0.030 . 2 . . . . 18 CYS HB2 . 11335 1
122 . 1 1 18 18 CYS HB3 H 1 2.602 0.030 . 2 . . . . 18 CYS HB3 . 11335 1
123 . 1 1 18 18 CYS C C 13 177.628 0.300 . 1 . . . . 18 CYS C . 11335 1
124 . 1 1 18 18 CYS CA C 13 60.110 0.300 . 1 . . . . 18 CYS CA . 11335 1
125 . 1 1 18 18 CYS CB C 13 31.507 0.300 . 1 . . . . 18 CYS CB . 11335 1
126 . 1 1 18 18 CYS N N 15 124.749 0.300 . 1 . . . . 18 CYS N . 11335 1
127 . 1 1 19 19 VAL H H 1 8.379 0.030 . 1 . . . . 19 VAL H . 11335 1
128 . 1 1 19 19 VAL HA H 1 4.068 0.030 . 1 . . . . 19 VAL HA . 11335 1
129 . 1 1 19 19 VAL HB H 1 2.330 0.030 . 1 . . . . 19 VAL HB . 11335 1
130 . 1 1 19 19 VAL HG11 H 1 1.034 0.030 . 1 . . . . 19 VAL HG1 . 11335 1
131 . 1 1 19 19 VAL HG12 H 1 1.034 0.030 . 1 . . . . 19 VAL HG1 . 11335 1
132 . 1 1 19 19 VAL HG13 H 1 1.034 0.030 . 1 . . . . 19 VAL HG1 . 11335 1
133 . 1 1 19 19 VAL HG21 H 1 0.917 0.030 . 1 . . . . 19 VAL HG2 . 11335 1
134 . 1 1 19 19 VAL HG22 H 1 0.917 0.030 . 1 . . . . 19 VAL HG2 . 11335 1
135 . 1 1 19 19 VAL HG23 H 1 0.917 0.030 . 1 . . . . 19 VAL HG2 . 11335 1
136 . 1 1 19 19 VAL C C 13 175.805 0.300 . 1 . . . . 19 VAL C . 11335 1
137 . 1 1 19 19 VAL CA C 13 63.554 0.300 . 1 . . . . 19 VAL CA . 11335 1
138 . 1 1 19 19 VAL CB C 13 32.091 0.300 . 1 . . . . 19 VAL CB . 11335 1
139 . 1 1 19 19 VAL CG1 C 13 21.405 0.300 . 2 . . . . 19 VAL CG1 . 11335 1
140 . 1 1 19 19 VAL CG2 C 13 20.146 0.300 . 2 . . . . 19 VAL CG2 . 11335 1
141 . 1 1 19 19 VAL N N 15 125.404 0.300 . 1 . . . . 19 VAL N . 11335 1
142 . 1 1 20 20 VAL H H 1 8.578 0.030 . 1 . . . . 20 VAL H . 11335 1
143 . 1 1 20 20 VAL HA H 1 3.910 0.030 . 1 . . . . 20 VAL HA . 11335 1
144 . 1 1 20 20 VAL HB H 1 2.395 0.030 . 1 . . . . 20 VAL HB . 11335 1
145 . 1 1 20 20 VAL HG11 H 1 1.058 0.030 . 1 . . . . 20 VAL HG1 . 11335 1
146 . 1 1 20 20 VAL HG12 H 1 1.058 0.030 . 1 . . . . 20 VAL HG1 . 11335 1
147 . 1 1 20 20 VAL HG13 H 1 1.058 0.030 . 1 . . . . 20 VAL HG1 . 11335 1
148 . 1 1 20 20 VAL HG21 H 1 0.509 0.030 . 1 . . . . 20 VAL HG2 . 11335 1
149 . 1 1 20 20 VAL HG22 H 1 0.509 0.030 . 1 . . . . 20 VAL HG2 . 11335 1
150 . 1 1 20 20 VAL HG23 H 1 0.509 0.030 . 1 . . . . 20 VAL HG2 . 11335 1
151 . 1 1 20 20 VAL C C 13 176.817 0.300 . 1 . . . . 20 VAL C . 11335 1
152 . 1 1 20 20 VAL CA C 13 65.169 0.300 . 1 . . . . 20 VAL CA . 11335 1
153 . 1 1 20 20 VAL CB C 13 31.953 0.300 . 1 . . . . 20 VAL CB . 11335 1
154 . 1 1 20 20 VAL CG1 C 13 21.652 0.300 . 2 . . . . 20 VAL CG1 . 11335 1
155 . 1 1 20 20 VAL CG2 C 13 22.886 0.300 . 2 . . . . 20 VAL CG2 . 11335 1
156 . 1 1 20 20 VAL N N 15 123.779 0.300 . 1 . . . . 20 VAL N . 11335 1
157 . 1 1 21 21 CYS H H 1 7.849 0.030 . 1 . . . . 21 CYS H . 11335 1
158 . 1 1 21 21 CYS HA H 1 4.711 0.030 . 1 . . . . 21 CYS HA . 11335 1
159 . 1 1 21 21 CYS HB2 H 1 3.191 0.030 . 2 . . . . 21 CYS HB2 . 11335 1
160 . 1 1 21 21 CYS HB3 H 1 2.635 0.030 . 2 . . . . 21 CYS HB3 . 11335 1
161 . 1 1 21 21 CYS C C 13 176.238 0.300 . 1 . . . . 21 CYS C . 11335 1
162 . 1 1 21 21 CYS CA C 13 58.902 0.300 . 1 . . . . 21 CYS CA . 11335 1
163 . 1 1 21 21 CYS CB C 13 31.959 0.300 . 1 . . . . 21 CYS CB . 11335 1
164 . 1 1 21 21 CYS N N 15 117.133 0.300 . 1 . . . . 21 CYS N . 11335 1
165 . 1 1 22 22 GLN H H 1 7.713 0.030 . 1 . . . . 22 GLN H . 11335 1
166 . 1 1 22 22 GLN HA H 1 4.145 0.030 . 1 . . . . 22 GLN HA . 11335 1
167 . 1 1 22 22 GLN HB2 H 1 2.269 0.030 . 1 . . . . 22 GLN HB2 . 11335 1
168 . 1 1 22 22 GLN HB3 H 1 2.269 0.030 . 1 . . . . 22 GLN HB3 . 11335 1
169 . 1 1 22 22 GLN HE21 H 1 6.684 0.030 . 2 . . . . 22 GLN HE21 . 11335 1
170 . 1 1 22 22 GLN HE22 H 1 7.376 0.030 . 2 . . . . 22 GLN HE22 . 11335 1
171 . 1 1 22 22 GLN HG2 H 1 2.263 0.030 . 2 . . . . 22 GLN HG2 . 11335 1
172 . 1 1 22 22 GLN HG3 H 1 2.183 0.030 . 2 . . . . 22 GLN HG3 . 11335 1
173 . 1 1 22 22 GLN C C 13 176.101 0.300 . 1 . . . . 22 GLN C . 11335 1
174 . 1 1 22 22 GLN CA C 13 58.243 0.300 . 1 . . . . 22 GLN CA . 11335 1
175 . 1 1 22 22 GLN CB C 13 27.098 0.300 . 1 . . . . 22 GLN CB . 11335 1
176 . 1 1 22 22 GLN CG C 13 34.400 0.300 . 1 . . . . 22 GLN CG . 11335 1
177 . 1 1 22 22 GLN N N 15 118.014 0.300 . 1 . . . . 22 GLN N . 11335 1
178 . 1 1 22 22 GLN NE2 N 15 112.711 0.300 . 1 . . . . 22 GLN NE2 . 11335 1
179 . 1 1 23 23 ASN H H 1 9.014 0.030 . 1 . . . . 23 ASN H . 11335 1
180 . 1 1 23 23 ASN HA H 1 4.967 0.030 . 1 . . . . 23 ASN HA . 11335 1
181 . 1 1 23 23 ASN HB2 H 1 2.854 0.030 . 2 . . . . 23 ASN HB2 . 11335 1
182 . 1 1 23 23 ASN HB3 H 1 2.559 0.030 . 2 . . . . 23 ASN HB3 . 11335 1
183 . 1 1 23 23 ASN HD21 H 1 6.846 0.030 . 2 . . . . 23 ASN HD21 . 11335 1
184 . 1 1 23 23 ASN HD22 H 1 7.684 0.030 . 2 . . . . 23 ASN HD22 . 11335 1
185 . 1 1 23 23 ASN C C 13 174.792 0.300 . 1 . . . . 23 ASN C . 11335 1
186 . 1 1 23 23 ASN CA C 13 53.458 0.300 . 1 . . . . 23 ASN CA . 11335 1
187 . 1 1 23 23 ASN CB C 13 40.316 0.300 . 1 . . . . 23 ASN CB . 11335 1
188 . 1 1 23 23 ASN N N 15 118.385 0.300 . 1 . . . . 23 ASN N . 11335 1
189 . 1 1 23 23 ASN ND2 N 15 112.758 0.300 . 1 . . . . 23 ASN ND2 . 11335 1
190 . 1 1 24 24 GLY H H 1 7.638 0.030 . 1 . . . . 24 GLY H . 11335 1
191 . 1 1 24 24 GLY HA2 H 1 4.336 0.030 . 2 . . . . 24 GLY HA2 . 11335 1
192 . 1 1 24 24 GLY HA3 H 1 3.854 0.030 . 2 . . . . 24 GLY HA3 . 11335 1
193 . 1 1 24 24 GLY C C 13 172.185 0.300 . 1 . . . . 24 GLY C . 11335 1
194 . 1 1 24 24 GLY CA C 13 44.714 0.300 . 1 . . . . 24 GLY CA . 11335 1
195 . 1 1 24 24 GLY N N 15 108.213 0.300 . 1 . . . . 24 GLY N . 11335 1
196 . 1 1 25 25 THR H H 1 8.741 0.030 . 1 . . . . 25 THR H . 11335 1
197 . 1 1 25 25 THR HA H 1 4.599 0.030 . 1 . . . . 25 THR HA . 11335 1
198 . 1 1 25 25 THR HB H 1 3.939 0.030 . 1 . . . . 25 THR HB . 11335 1
199 . 1 1 25 25 THR HG21 H 1 1.289 0.030 . 1 . . . . 25 THR HG2 . 11335 1
200 . 1 1 25 25 THR HG22 H 1 1.289 0.030 . 1 . . . . 25 THR HG2 . 11335 1
201 . 1 1 25 25 THR HG23 H 1 1.289 0.030 . 1 . . . . 25 THR HG2 . 11335 1
202 . 1 1 25 25 THR C C 13 174.928 0.300 . 1 . . . . 25 THR C . 11335 1
203 . 1 1 25 25 THR CA C 13 61.959 0.300 . 1 . . . . 25 THR CA . 11335 1
204 . 1 1 25 25 THR CB C 13 70.066 0.300 . 1 . . . . 25 THR CB . 11335 1
205 . 1 1 25 25 THR CG2 C 13 21.941 0.300 . 1 . . . . 25 THR CG2 . 11335 1
206 . 1 1 25 25 THR N N 15 119.627 0.300 . 1 . . . . 25 THR N . 11335 1
207 . 1 1 26 26 VAL H H 1 8.910 0.030 . 1 . . . . 26 VAL H . 11335 1
208 . 1 1 26 26 VAL HA H 1 3.114 0.030 . 1 . . . . 26 VAL HA . 11335 1
209 . 1 1 26 26 VAL HB H 1 1.809 0.030 . 1 . . . . 26 VAL HB . 11335 1
210 . 1 1 26 26 VAL HG11 H 1 0.825 0.030 . 1 . . . . 26 VAL HG1 . 11335 1
211 . 1 1 26 26 VAL HG12 H 1 0.825 0.030 . 1 . . . . 26 VAL HG1 . 11335 1
212 . 1 1 26 26 VAL HG13 H 1 0.825 0.030 . 1 . . . . 26 VAL HG1 . 11335 1
213 . 1 1 26 26 VAL HG21 H 1 0.725 0.030 . 1 . . . . 26 VAL HG2 . 11335 1
214 . 1 1 26 26 VAL HG22 H 1 0.725 0.030 . 1 . . . . 26 VAL HG2 . 11335 1
215 . 1 1 26 26 VAL HG23 H 1 0.725 0.030 . 1 . . . . 26 VAL HG2 . 11335 1
216 . 1 1 26 26 VAL CA C 13 65.209 0.300 . 1 . . . . 26 VAL CA . 11335 1
217 . 1 1 26 26 VAL CB C 13 31.452 0.300 . 1 . . . . 26 VAL CB . 11335 1
218 . 1 1 26 26 VAL CG1 C 13 21.388 0.300 . 2 . . . . 26 VAL CG1 . 11335 1
219 . 1 1 26 26 VAL CG2 C 13 21.817 0.300 . 2 . . . . 26 VAL CG2 . 11335 1
220 . 1 1 26 26 VAL N N 15 128.029 0.300 . 1 . . . . 26 VAL N . 11335 1
221 . 1 1 27 27 ASN H H 1 8.675 0.030 . 1 . . . . 27 ASN H . 11335 1
222 . 1 1 27 27 ASN HA H 1 5.119 0.030 . 1 . . . . 27 ASN HA . 11335 1
223 . 1 1 27 27 ASN HB2 H 1 2.410 0.030 . 2 . . . . 27 ASN HB2 . 11335 1
224 . 1 1 27 27 ASN HB3 H 1 2.720 0.030 . 2 . . . . 27 ASN HB3 . 11335 1
225 . 1 1 27 27 ASN HD21 H 1 6.729 0.030 . 2 . . . . 27 ASN HD21 . 11335 1
226 . 1 1 27 27 ASN HD22 H 1 8.862 0.030 . 2 . . . . 27 ASN HD22 . 11335 1
227 . 1 1 27 27 ASN C C 13 172.609 0.300 . 1 . . . . 27 ASN C . 11335 1
228 . 1 1 27 27 ASN CA C 13 52.401 0.300 . 1 . . . . 27 ASN CA . 11335 1
229 . 1 1 27 27 ASN CB C 13 42.263 0.300 . 1 . . . . 27 ASN CB . 11335 1
230 . 1 1 27 27 ASN N N 15 121.633 0.300 . 1 . . . . 27 ASN N . 11335 1
231 . 1 1 27 27 ASN ND2 N 15 115.164 0.300 . 1 . . . . 27 ASN ND2 . 11335 1
232 . 1 1 28 28 TRP H H 1 7.151 0.030 . 1 . . . . 28 TRP H . 11335 1
233 . 1 1 28 28 TRP HA H 1 5.008 0.030 . 1 . . . . 28 TRP HA . 11335 1
234 . 1 1 28 28 TRP HB2 H 1 2.711 0.030 . 2 . . . . 28 TRP HB2 . 11335 1
235 . 1 1 28 28 TRP HB3 H 1 2.902 0.030 . 2 . . . . 28 TRP HB3 . 11335 1
236 . 1 1 28 28 TRP HD1 H 1 6.873 0.030 . 1 . . . . 28 TRP HD1 . 11335 1
237 . 1 1 28 28 TRP HE1 H 1 11.837 0.030 . 1 . . . . 28 TRP HE1 . 11335 1
238 . 1 1 28 28 TRP HE3 H 1 7.193 0.030 . 1 . . . . 28 TRP HE3 . 11335 1
239 . 1 1 28 28 TRP HH2 H 1 7.193 0.030 . 1 . . . . 28 TRP HH2 . 11335 1
240 . 1 1 28 28 TRP HZ2 H 1 7.479 0.030 . 1 . . . . 28 TRP HZ2 . 11335 1
241 . 1 1 28 28 TRP HZ3 H 1 6.949 0.030 . 1 . . . . 28 TRP HZ3 . 11335 1
242 . 1 1 28 28 TRP C C 13 174.906 0.300 . 1 . . . . 28 TRP C . 11335 1
243 . 1 1 28 28 TRP CA C 13 56.646 0.300 . 1 . . . . 28 TRP CA . 11335 1
244 . 1 1 28 28 TRP CB C 13 33.117 0.300 . 1 . . . . 28 TRP CB . 11335 1
245 . 1 1 28 28 TRP CD1 C 13 125.951 0.300 . 1 . . . . 28 TRP CD1 . 11335 1
246 . 1 1 28 28 TRP CE3 C 13 119.864 0.300 . 1 . . . . 28 TRP CE3 . 11335 1
247 . 1 1 28 28 TRP CH2 C 13 124.161 0.300 . 1 . . . . 28 TRP CH2 . 11335 1
248 . 1 1 28 28 TRP CZ2 C 13 114.614 0.300 . 1 . . . . 28 TRP CZ2 . 11335 1
249 . 1 1 28 28 TRP CZ3 C 13 121.604 0.300 . 1 . . . . 28 TRP CZ3 . 11335 1
250 . 1 1 28 28 TRP N N 15 116.697 0.300 . 1 . . . . 28 TRP N . 11335 1
251 . 1 1 28 28 TRP NE1 N 15 133.361 0.300 . 1 . . . . 28 TRP NE1 . 11335 1
252 . 1 1 29 29 VAL H H 1 9.248 0.030 . 1 . . . . 29 VAL H . 11335 1
253 . 1 1 29 29 VAL HA H 1 4.164 0.030 . 1 . . . . 29 VAL HA . 11335 1
254 . 1 1 29 29 VAL HB H 1 0.799 0.030 . 1 . . . . 29 VAL HB . 11335 1
255 . 1 1 29 29 VAL HG11 H 1 0.591 0.030 . 1 . . . . 29 VAL HG1 . 11335 1
256 . 1 1 29 29 VAL HG12 H 1 0.591 0.030 . 1 . . . . 29 VAL HG1 . 11335 1
257 . 1 1 29 29 VAL HG13 H 1 0.591 0.030 . 1 . . . . 29 VAL HG1 . 11335 1
258 . 1 1 29 29 VAL HG21 H 1 0.583 0.030 . 1 . . . . 29 VAL HG2 . 11335 1
259 . 1 1 29 29 VAL HG22 H 1 0.583 0.030 . 1 . . . . 29 VAL HG2 . 11335 1
260 . 1 1 29 29 VAL HG23 H 1 0.583 0.030 . 1 . . . . 29 VAL HG2 . 11335 1
261 . 1 1 29 29 VAL C C 13 174.661 0.300 . 1 . . . . 29 VAL C . 11335 1
262 . 1 1 29 29 VAL CA C 13 60.833 0.300 . 1 . . . . 29 VAL CA . 11335 1
263 . 1 1 29 29 VAL CB C 13 32.985 0.300 . 1 . . . . 29 VAL CB . 11335 1
264 . 1 1 29 29 VAL CG1 C 13 20.255 0.300 . 2 . . . . 29 VAL CG1 . 11335 1
265 . 1 1 29 29 VAL CG2 C 13 21.388 0.300 . 2 . . . . 29 VAL CG2 . 11335 1
266 . 1 1 29 29 VAL N N 15 126.501 0.300 . 1 . . . . 29 VAL N . 11335 1
267 . 1 1 30 30 LEU H H 1 7.621 0.030 . 1 . . . . 30 LEU H . 11335 1
268 . 1 1 30 30 LEU HA H 1 4.603 0.030 . 1 . . . . 30 LEU HA . 11335 1
269 . 1 1 30 30 LEU HB2 H 1 2.250 0.030 . 2 . . . . 30 LEU HB2 . 11335 1
270 . 1 1 30 30 LEU HB3 H 1 1.473 0.030 . 2 . . . . 30 LEU HB3 . 11335 1
271 . 1 1 30 30 LEU HD11 H 1 0.856 0.030 . 1 . . . . 30 LEU HD1 . 11335 1
272 . 1 1 30 30 LEU HD12 H 1 0.856 0.030 . 1 . . . . 30 LEU HD1 . 11335 1
273 . 1 1 30 30 LEU HD13 H 1 0.856 0.030 . 1 . . . . 30 LEU HD1 . 11335 1
274 . 1 1 30 30 LEU HD21 H 1 1.021 0.030 . 1 . . . . 30 LEU HD2 . 11335 1
275 . 1 1 30 30 LEU HD22 H 1 1.021 0.030 . 1 . . . . 30 LEU HD2 . 11335 1
276 . 1 1 30 30 LEU HD23 H 1 1.021 0.030 . 1 . . . . 30 LEU HD2 . 11335 1
277 . 1 1 30 30 LEU HG H 1 1.930 0.030 . 1 . . . . 30 LEU HG . 11335 1
278 . 1 1 30 30 LEU C C 13 175.054 0.300 . 1 . . . . 30 LEU C . 11335 1
279 . 1 1 30 30 LEU CA C 13 54.324 0.300 . 1 . . . . 30 LEU CA . 11335 1
280 . 1 1 30 30 LEU CB C 13 41.692 0.300 . 1 . . . . 30 LEU CB . 11335 1
281 . 1 1 30 30 LEU CD1 C 13 21.496 0.300 . 2 . . . . 30 LEU CD1 . 11335 1
282 . 1 1 30 30 LEU CD2 C 13 24.785 0.300 . 2 . . . . 30 LEU CD2 . 11335 1
283 . 1 1 30 30 LEU CG C 13 27.251 0.300 . 1 . . . . 30 LEU CG . 11335 1
284 . 1 1 30 30 LEU N N 15 124.464 0.300 . 1 . . . . 30 LEU N . 11335 1
285 . 1 1 31 31 LEU H H 1 8.930 0.030 . 1 . . . . 31 LEU H . 11335 1
286 . 1 1 31 31 LEU HA H 1 4.768 0.030 . 1 . . . . 31 LEU HA . 11335 1
287 . 1 1 31 31 LEU HB2 H 1 1.776 0.030 . 2 . . . . 31 LEU HB2 . 11335 1
288 . 1 1 31 31 LEU HB3 H 1 1.563 0.030 . 2 . . . . 31 LEU HB3 . 11335 1
289 . 1 1 31 31 LEU HD11 H 1 0.980 0.030 . 1 . . . . 31 LEU HD1 . 11335 1
290 . 1 1 31 31 LEU HD12 H 1 0.980 0.030 . 1 . . . . 31 LEU HD1 . 11335 1
291 . 1 1 31 31 LEU HD13 H 1 0.980 0.030 . 1 . . . . 31 LEU HD1 . 11335 1
292 . 1 1 31 31 LEU HD21 H 1 0.948 0.030 . 1 . . . . 31 LEU HD2 . 11335 1
293 . 1 1 31 31 LEU HD22 H 1 0.948 0.030 . 1 . . . . 31 LEU HD2 . 11335 1
294 . 1 1 31 31 LEU HD23 H 1 0.948 0.030 . 1 . . . . 31 LEU HD2 . 11335 1
295 . 1 1 31 31 LEU HG H 1 1.610 0.030 . 1 . . . . 31 LEU HG . 11335 1
296 . 1 1 31 31 LEU CA C 13 51.677 0.300 . 1 . . . . 31 LEU CA . 11335 1
297 . 1 1 31 31 LEU CB C 13 42.203 0.300 . 1 . . . . 31 LEU CB . 11335 1
298 . 1 1 31 31 LEU CD1 C 13 25.255 0.300 . 2 . . . . 31 LEU CD1 . 11335 1
299 . 1 1 31 31 LEU CD2 C 13 23.905 0.300 . 2 . . . . 31 LEU CD2 . 11335 1
300 . 1 1 31 31 LEU CG C 13 27.158 0.300 . 1 . . . . 31 LEU CG . 11335 1
301 . 1 1 31 31 LEU N N 15 121.060 0.300 . 1 . . . . 31 LEU N . 11335 1
302 . 1 1 32 32 PRO HA H 1 4.480 0.030 . 1 . . . . 32 PRO HA . 11335 1
303 . 1 1 32 32 PRO HB2 H 1 2.394 0.030 . 2 . . . . 32 PRO HB2 . 11335 1
304 . 1 1 32 32 PRO HB3 H 1 2.243 0.030 . 2 . . . . 32 PRO HB3 . 11335 1
305 . 1 1 32 32 PRO HD2 H 1 3.401 0.030 . 2 . . . . 32 PRO HD2 . 11335 1
306 . 1 1 32 32 PRO HD3 H 1 4.143 0.030 . 2 . . . . 32 PRO HD3 . 11335 1
307 . 1 1 32 32 PRO HG2 H 1 1.854 0.030 . 2 . . . . 32 PRO HG2 . 11335 1
308 . 1 1 32 32 PRO HG3 H 1 2.042 0.030 . 2 . . . . 32 PRO HG3 . 11335 1
309 . 1 1 32 32 PRO CA C 13 64.005 0.300 . 1 . . . . 32 PRO CA . 11335 1
310 . 1 1 32 32 PRO CB C 13 35.654 0.300 . 1 . . . . 32 PRO CB . 11335 1
311 . 1 1 32 32 PRO CD C 13 50.680 0.300 . 1 . . . . 32 PRO CD . 11335 1
312 . 1 1 32 32 PRO CG C 13 24.967 0.300 . 1 . . . . 32 PRO CG . 11335 1
313 . 1 1 33 33 CYS H H 1 8.533 0.030 . 1 . . . . 33 CYS H . 11335 1
314 . 1 1 33 33 CYS HA H 1 4.234 0.030 . 1 . . . . 33 CYS HA . 11335 1
315 . 1 1 33 33 CYS HB2 H 1 2.725 0.030 . 2 . . . . 33 CYS HB2 . 11335 1
316 . 1 1 33 33 CYS HB3 H 1 2.787 0.030 . 2 . . . . 33 CYS HB3 . 11335 1
317 . 1 1 33 33 CYS CA C 13 62.442 0.300 . 1 . . . . 33 CYS CA . 11335 1
318 . 1 1 33 33 CYS CB C 13 31.178 0.300 . 1 . . . . 33 CYS CB . 11335 1
319 . 1 1 33 33 CYS N N 15 123.369 0.300 . 1 . . . . 33 CYS N . 11335 1
320 . 1 1 34 34 ARG H H 1 8.880 0.030 . 1 . . . . 34 ARG H . 11335 1
321 . 1 1 34 34 ARG HA H 1 3.887 0.030 . 1 . . . . 34 ARG HA . 11335 1
322 . 1 1 34 34 ARG HB2 H 1 1.342 0.030 . 2 . . . . 34 ARG HB2 . 11335 1
323 . 1 1 34 34 ARG HB3 H 1 1.650 0.030 . 2 . . . . 34 ARG HB3 . 11335 1
324 . 1 1 34 34 ARG HD2 H 1 3.122 0.030 . 2 . . . . 34 ARG HD2 . 11335 1
325 . 1 1 34 34 ARG HD3 H 1 3.185 0.030 . 2 . . . . 34 ARG HD3 . 11335 1
326 . 1 1 34 34 ARG HG2 H 1 2.054 0.030 . 2 . . . . 34 ARG HG2 . 11335 1
327 . 1 1 34 34 ARG HG3 H 1 2.010 0.030 . 2 . . . . 34 ARG HG3 . 11335 1
328 . 1 1 34 34 ARG CA C 13 58.672 0.300 . 1 . . . . 34 ARG CA . 11335 1
329 . 1 1 34 34 ARG CB C 13 29.352 0.300 . 1 . . . . 34 ARG CB . 11335 1
330 . 1 1 34 34 ARG CD C 13 43.338 0.300 . 1 . . . . 34 ARG CD . 11335 1
331 . 1 1 34 34 ARG CG C 13 26.703 0.300 . 1 . . . . 34 ARG CG . 11335 1
332 . 1 1 34 34 ARG N N 15 116.213 0.300 . 1 . . . . 34 ARG N . 11335 1
333 . 1 1 35 35 HIS H H 1 8.724 0.030 . 1 . . . . 35 HIS H . 11335 1
334 . 1 1 35 35 HIS HA H 1 4.621 0.030 . 1 . . . . 35 HIS HA . 11335 1
335 . 1 1 35 35 HIS HB2 H 1 3.070 0.030 . 2 . . . . 35 HIS HB2 . 11335 1
336 . 1 1 35 35 HIS HB3 H 1 3.627 0.030 . 2 . . . . 35 HIS HB3 . 11335 1
337 . 1 1 35 35 HIS HD2 H 1 7.343 0.030 . 1 . . . . 35 HIS HD2 . 11335 1
338 . 1 1 35 35 HIS HE1 H 1 7.826 0.030 . 1 . . . . 35 HIS HE1 . 11335 1
339 . 1 1 35 35 HIS CA C 13 61.230 0.300 . 1 . . . . 35 HIS CA . 11335 1
340 . 1 1 35 35 HIS CB C 13 30.948 0.300 . 1 . . . . 35 HIS CB . 11335 1
341 . 1 1 35 35 HIS CD2 C 13 119.184 0.300 . 1 . . . . 35 HIS CD2 . 11335 1
342 . 1 1 35 35 HIS CE1 C 13 137.766 0.300 . 1 . . . . 35 HIS CE1 . 11335 1
343 . 1 1 35 35 HIS N N 15 122.455 0.300 . 1 . . . . 35 HIS N . 11335 1
344 . 1 1 36 36 THR H H 1 9.172 0.030 . 1 . . . . 36 THR H . 11335 1
345 . 1 1 36 36 THR HA H 1 5.133 0.030 . 1 . . . . 36 THR HA . 11335 1
346 . 1 1 36 36 THR HB H 1 4.102 0.030 . 1 . . . . 36 THR HB . 11335 1
347 . 1 1 36 36 THR HG21 H 1 1.094 0.030 . 1 . . . . 36 THR HG2 . 11335 1
348 . 1 1 36 36 THR HG22 H 1 1.094 0.030 . 1 . . . . 36 THR HG2 . 11335 1
349 . 1 1 36 36 THR HG23 H 1 1.094 0.030 . 1 . . . . 36 THR HG2 . 11335 1
350 . 1 1 36 36 THR CA C 13 59.435 0.300 . 1 . . . . 36 THR CA . 11335 1
351 . 1 1 36 36 THR CB C 13 69.504 0.300 . 1 . . . . 36 THR CB . 11335 1
352 . 1 1 36 36 THR CG2 C 13 20.825 0.300 . 1 . . . . 36 THR CG2 . 11335 1
353 . 1 1 36 36 THR N N 15 120.061 0.300 . 1 . . . . 36 THR N . 11335 1
354 . 1 1 37 37 CYS H H 1 9.235 0.030 . 1 . . . . 37 CYS H . 11335 1
355 . 1 1 37 37 CYS HA H 1 5.122 0.030 . 1 . . . . 37 CYS HA . 11335 1
356 . 1 1 37 37 CYS HB2 H 1 2.915 0.030 . 2 . . . . 37 CYS HB2 . 11335 1
357 . 1 1 37 37 CYS HB3 H 1 3.228 0.030 . 2 . . . . 37 CYS HB3 . 11335 1
358 . 1 1 37 37 CYS C C 13 171.830 0.300 . 1 . . . . 37 CYS C . 11335 1
359 . 1 1 37 37 CYS CA C 13 56.916 0.300 . 1 . . . . 37 CYS CA . 11335 1
360 . 1 1 37 37 CYS CB C 13 30.559 0.300 . 1 . . . . 37 CYS CB . 11335 1
361 . 1 1 37 37 CYS N N 15 119.726 0.300 . 1 . . . . 37 CYS N . 11335 1
362 . 1 1 38 38 LEU H H 1 7.375 0.030 . 1 . . . . 38 LEU H . 11335 1
363 . 1 1 38 38 LEU HA H 1 6.093 0.030 . 1 . . . . 38 LEU HA . 11335 1
364 . 1 1 38 38 LEU HB2 H 1 1.773 0.030 . 2 . . . . 38 LEU HB2 . 11335 1
365 . 1 1 38 38 LEU HB3 H 1 1.353 0.030 . 2 . . . . 38 LEU HB3 . 11335 1
366 . 1 1 38 38 LEU HD11 H 1 0.654 0.030 . 1 . . . . 38 LEU HD1 . 11335 1
367 . 1 1 38 38 LEU HD12 H 1 0.654 0.030 . 1 . . . . 38 LEU HD1 . 11335 1
368 . 1 1 38 38 LEU HD13 H 1 0.654 0.030 . 1 . . . . 38 LEU HD1 . 11335 1
369 . 1 1 38 38 LEU HD21 H 1 0.790 0.030 . 1 . . . . 38 LEU HD2 . 11335 1
370 . 1 1 38 38 LEU HD22 H 1 0.790 0.030 . 1 . . . . 38 LEU HD2 . 11335 1
371 . 1 1 38 38 LEU HD23 H 1 0.790 0.030 . 1 . . . . 38 LEU HD2 . 11335 1
372 . 1 1 38 38 LEU HG H 1 1.755 0.030 . 1 . . . . 38 LEU HG . 11335 1
373 . 1 1 38 38 LEU C C 13 176.853 0.300 . 1 . . . . 38 LEU C . 11335 1
374 . 1 1 38 38 LEU CA C 13 54.152 0.300 . 1 . . . . 38 LEU CA . 11335 1
375 . 1 1 38 38 LEU CB C 13 47.134 0.300 . 1 . . . . 38 LEU CB . 11335 1
376 . 1 1 38 38 LEU CD1 C 13 25.571 0.300 . 2 . . . . 38 LEU CD1 . 11335 1
377 . 1 1 38 38 LEU CD2 C 13 27.726 0.300 . 2 . . . . 38 LEU CD2 . 11335 1
378 . 1 1 38 38 LEU CG C 13 26.722 0.300 . 1 . . . . 38 LEU CG . 11335 1
379 . 1 1 38 38 LEU N N 15 122.111 0.300 . 1 . . . . 38 LEU N . 11335 1
380 . 1 1 39 39 CYS H H 1 8.731 0.030 . 1 . . . . 39 CYS H . 11335 1
381 . 1 1 39 39 CYS HA H 1 5.307 0.030 . 1 . . . . 39 CYS HA . 11335 1
382 . 1 1 39 39 CYS HB2 H 1 3.594 0.030 . 2 . . . . 39 CYS HB2 . 11335 1
383 . 1 1 39 39 CYS HB3 H 1 2.488 0.030 . 2 . . . . 39 CYS HB3 . 11335 1
384 . 1 1 39 39 CYS C C 13 174.749 0.300 . 1 . . . . 39 CYS C . 11335 1
385 . 1 1 39 39 CYS CA C 13 56.978 0.300 . 1 . . . . 39 CYS CA . 11335 1
386 . 1 1 39 39 CYS CB C 13 33.935 0.300 . 1 . . . . 39 CYS CB . 11335 1
387 . 1 1 39 39 CYS N N 15 122.258 0.300 . 1 . . . . 39 CYS N . 11335 1
388 . 1 1 40 40 ASP H H 1 9.198 0.030 . 1 . . . . 40 ASP H . 11335 1
389 . 1 1 40 40 ASP HA H 1 4.703 0.030 . 1 . . . . 40 ASP HA . 11335 1
390 . 1 1 40 40 ASP HB2 H 1 2.934 0.030 . 2 . . . . 40 ASP HB2 . 11335 1
391 . 1 1 40 40 ASP HB3 H 1 2.778 0.030 . 2 . . . . 40 ASP HB3 . 11335 1
392 . 1 1 40 40 ASP C C 13 177.968 0.300 . 1 . . . . 40 ASP C . 11335 1
393 . 1 1 40 40 ASP CA C 13 57.155 0.300 . 1 . . . . 40 ASP CA . 11335 1
394 . 1 1 40 40 ASP CB C 13 41.925 0.300 . 1 . . . . 40 ASP CB . 11335 1
395 . 1 1 40 40 ASP N N 15 116.896 0.300 . 1 . . . . 40 ASP N . 11335 1
396 . 1 1 41 41 GLY H H 1 8.810 0.030 . 1 . . . . 41 GLY H . 11335 1
397 . 1 1 41 41 GLY HA2 H 1 4.035 0.030 . 1 . . . . 41 GLY HA2 . 11335 1
398 . 1 1 41 41 GLY HA3 H 1 4.035 0.030 . 1 . . . . 41 GLY HA3 . 11335 1
399 . 1 1 41 41 GLY C C 13 176.114 0.300 . 1 . . . . 41 GLY C . 11335 1
400 . 1 1 41 41 GLY CA C 13 46.043 0.300 . 1 . . . . 41 GLY CA . 11335 1
401 . 1 1 41 41 GLY N N 15 110.323 0.300 . 1 . . . . 41 GLY N . 11335 1
402 . 1 1 42 42 CYS H H 1 8.202 0.030 . 1 . . . . 42 CYS H . 11335 1
403 . 1 1 42 42 CYS HA H 1 4.431 0.030 . 1 . . . . 42 CYS HA . 11335 1
404 . 1 1 42 42 CYS HB2 H 1 3.180 0.030 . 2 . . . . 42 CYS HB2 . 11335 1
405 . 1 1 42 42 CYS HB3 H 1 2.803 0.030 . 2 . . . . 42 CYS HB3 . 11335 1
406 . 1 1 42 42 CYS C C 13 178.162 0.300 . 1 . . . . 42 CYS C . 11335 1
407 . 1 1 42 42 CYS CA C 13 63.030 0.300 . 1 . . . . 42 CYS CA . 11335 1
408 . 1 1 42 42 CYS CB C 13 32.502 0.300 . 1 . . . . 42 CYS CB . 11335 1
409 . 1 1 42 42 CYS N N 15 123.574 0.300 . 1 . . . . 42 CYS N . 11335 1
410 . 1 1 43 43 VAL H H 1 7.814 0.030 . 1 . . . . 43 VAL H . 11335 1
411 . 1 1 43 43 VAL HA H 1 3.868 0.030 . 1 . . . . 43 VAL HA . 11335 1
412 . 1 1 43 43 VAL HB H 1 1.601 0.030 . 1 . . . . 43 VAL HB . 11335 1
413 . 1 1 43 43 VAL HG11 H 1 -0.303 0.030 . 1 . . . . 43 VAL HG1 . 11335 1
414 . 1 1 43 43 VAL HG12 H 1 -0.303 0.030 . 1 . . . . 43 VAL HG1 . 11335 1
415 . 1 1 43 43 VAL HG13 H 1 -0.303 0.030 . 1 . . . . 43 VAL HG1 . 11335 1
416 . 1 1 43 43 VAL HG21 H 1 0.342 0.030 . 1 . . . . 43 VAL HG2 . 11335 1
417 . 1 1 43 43 VAL HG22 H 1 0.342 0.030 . 1 . . . . 43 VAL HG2 . 11335 1
418 . 1 1 43 43 VAL HG23 H 1 0.342 0.030 . 1 . . . . 43 VAL HG2 . 11335 1
419 . 1 1 43 43 VAL C C 13 175.586 0.300 . 1 . . . . 43 VAL C . 11335 1
420 . 1 1 43 43 VAL CA C 13 65.360 0.300 . 1 . . . . 43 VAL CA . 11335 1
421 . 1 1 43 43 VAL CB C 13 30.898 0.300 . 1 . . . . 43 VAL CB . 11335 1
422 . 1 1 43 43 VAL CG1 C 13 17.167 0.300 . 2 . . . . 43 VAL CG1 . 11335 1
423 . 1 1 43 43 VAL CG2 C 13 20.089 0.300 . 2 . . . . 43 VAL CG2 . 11335 1
424 . 1 1 43 43 VAL N N 15 117.294 0.300 . 1 . . . . 43 VAL N . 11335 1
425 . 1 1 44 44 LYS H H 1 7.185 0.030 . 1 . . . . 44 LYS H . 11335 1
426 . 1 1 44 44 LYS HA H 1 3.875 0.030 . 1 . . . . 44 LYS HA . 11335 1
427 . 1 1 44 44 LYS HB2 H 1 1.399 0.030 . 2 . . . . 44 LYS HB2 . 11335 1
428 . 1 1 44 44 LYS HB3 H 1 1.312 0.030 . 2 . . . . 44 LYS HB3 . 11335 1
429 . 1 1 44 44 LYS HD2 H 1 1.419 0.030 . 1 . . . . 44 LYS HD2 . 11335 1
430 . 1 1 44 44 LYS HD3 H 1 1.419 0.030 . 1 . . . . 44 LYS HD3 . 11335 1
431 . 1 1 44 44 LYS HE2 H 1 2.785 0.030 . 2 . . . . 44 LYS HE2 . 11335 1
432 . 1 1 44 44 LYS HE3 H 1 2.828 0.030 . 2 . . . . 44 LYS HE3 . 11335 1
433 . 1 1 44 44 LYS HG2 H 1 0.827 0.030 . 2 . . . . 44 LYS HG2 . 11335 1
434 . 1 1 44 44 LYS HG3 H 1 0.972 0.030 . 2 . . . . 44 LYS HG3 . 11335 1
435 . 1 1 44 44 LYS C C 13 177.362 0.300 . 1 . . . . 44 LYS C . 11335 1
436 . 1 1 44 44 LYS CA C 13 57.278 0.300 . 1 . . . . 44 LYS CA . 11335 1
437 . 1 1 44 44 LYS CB C 13 31.528 0.300 . 1 . . . . 44 LYS CB . 11335 1
438 . 1 1 44 44 LYS CD C 13 28.808 0.300 . 1 . . . . 44 LYS CD . 11335 1
439 . 1 1 44 44 LYS CE C 13 41.944 0.300 . 1 . . . . 44 LYS CE . 11335 1
440 . 1 1 44 44 LYS CG C 13 24.134 0.300 . 1 . . . . 44 LYS CG . 11335 1
441 . 1 1 44 44 LYS N N 15 117.080 0.300 . 1 . . . . 44 LYS N . 11335 1
442 . 1 1 45 45 TYR H H 1 7.625 0.030 . 1 . . . . 45 TYR H . 11335 1
443 . 1 1 45 45 TYR HA H 1 4.364 0.030 . 1 . . . . 45 TYR HA . 11335 1
444 . 1 1 45 45 TYR HB2 H 1 2.943 0.030 . 2 . . . . 45 TYR HB2 . 11335 1
445 . 1 1 45 45 TYR HB3 H 1 2.671 0.030 . 2 . . . . 45 TYR HB3 . 11335 1
446 . 1 1 45 45 TYR HD1 H 1 7.124 0.030 . 1 . . . . 45 TYR HD1 . 11335 1
447 . 1 1 45 45 TYR HD2 H 1 7.124 0.030 . 1 . . . . 45 TYR HD2 . 11335 1
448 . 1 1 45 45 TYR HE1 H 1 6.856 0.030 . 1 . . . . 45 TYR HE1 . 11335 1
449 . 1 1 45 45 TYR HE2 H 1 6.856 0.030 . 1 . . . . 45 TYR HE2 . 11335 1
450 . 1 1 45 45 TYR C C 13 175.280 0.300 . 1 . . . . 45 TYR C . 11335 1
451 . 1 1 45 45 TYR CA C 13 58.460 0.300 . 1 . . . . 45 TYR CA . 11335 1
452 . 1 1 45 45 TYR CB C 13 38.414 0.300 . 1 . . . . 45 TYR CB . 11335 1
453 . 1 1 45 45 TYR CD1 C 13 132.941 0.300 . 1 . . . . 45 TYR CD1 . 11335 1
454 . 1 1 45 45 TYR CD2 C 13 132.941 0.300 . 1 . . . . 45 TYR CD2 . 11335 1
455 . 1 1 45 45 TYR CE1 C 13 118.458 0.300 . 1 . . . . 45 TYR CE1 . 11335 1
456 . 1 1 45 45 TYR CE2 C 13 118.458 0.300 . 1 . . . . 45 TYR CE2 . 11335 1
457 . 1 1 45 45 TYR N N 15 115.632 0.300 . 1 . . . . 45 TYR N . 11335 1
458 . 1 1 46 46 PHE H H 1 7.020 0.030 . 1 . . . . 46 PHE H . 11335 1
459 . 1 1 46 46 PHE HA H 1 4.443 0.030 . 1 . . . . 46 PHE HA . 11335 1
460 . 1 1 46 46 PHE HB2 H 1 2.555 0.030 . 2 . . . . 46 PHE HB2 . 11335 1
461 . 1 1 46 46 PHE HB3 H 1 3.178 0.030 . 2 . . . . 46 PHE HB3 . 11335 1
462 . 1 1 46 46 PHE HD1 H 1 7.540 0.030 . 1 . . . . 46 PHE HD1 . 11335 1
463 . 1 1 46 46 PHE HD2 H 1 7.540 0.030 . 1 . . . . 46 PHE HD2 . 11335 1
464 . 1 1 46 46 PHE HE1 H 1 7.294 0.030 . 1 . . . . 46 PHE HE1 . 11335 1
465 . 1 1 46 46 PHE HE2 H 1 7.294 0.030 . 1 . . . . 46 PHE HE2 . 11335 1
466 . 1 1 46 46 PHE HZ H 1 7.272 0.030 . 1 . . . . 46 PHE HZ . 11335 1
467 . 1 1 46 46 PHE C C 13 174.744 0.300 . 1 . . . . 46 PHE C . 11335 1
468 . 1 1 46 46 PHE CA C 13 59.427 0.300 . 1 . . . . 46 PHE CA . 11335 1
469 . 1 1 46 46 PHE CB C 13 40.160 0.300 . 1 . . . . 46 PHE CB . 11335 1
470 . 1 1 46 46 PHE CD1 C 13 132.315 0.300 . 1 . . . . 46 PHE CD1 . 11335 1
471 . 1 1 46 46 PHE CD2 C 13 132.315 0.300 . 1 . . . . 46 PHE CD2 . 11335 1
472 . 1 1 46 46 PHE CE1 C 13 131.331 0.300 . 1 . . . . 46 PHE CE1 . 11335 1
473 . 1 1 46 46 PHE CE2 C 13 131.331 0.300 . 1 . . . . 46 PHE CE2 . 11335 1
474 . 1 1 46 46 PHE CZ C 13 129.823 0.300 . 1 . . . . 46 PHE CZ . 11335 1
475 . 1 1 46 46 PHE N N 15 117.383 0.300 . 1 . . . . 46 PHE N . 11335 1
476 . 1 1 47 47 GLN H H 1 8.627 0.030 . 1 . . . . 47 GLN H . 11335 1
477 . 1 1 47 47 GLN HA H 1 4.345 0.030 . 1 . . . . 47 GLN HA . 11335 1
478 . 1 1 47 47 GLN HB2 H 1 2.267 0.030 . 2 . . . . 47 GLN HB2 . 11335 1
479 . 1 1 47 47 GLN HB3 H 1 2.007 0.030 . 2 . . . . 47 GLN HB3 . 11335 1
480 . 1 1 47 47 GLN HE21 H 1 6.728 0.030 . 2 . . . . 47 GLN HE21 . 11335 1
481 . 1 1 47 47 GLN HE22 H 1 7.528 0.030 . 2 . . . . 47 GLN HE22 . 11335 1
482 . 1 1 47 47 GLN HG2 H 1 2.411 0.030 . 2 . . . . 47 GLN HG2 . 11335 1
483 . 1 1 47 47 GLN HG3 H 1 2.374 0.030 . 2 . . . . 47 GLN HG3 . 11335 1
484 . 1 1 47 47 GLN CA C 13 56.180 0.300 . 1 . . . . 47 GLN CA . 11335 1
485 . 1 1 47 47 GLN CB C 13 29.778 0.300 . 1 . . . . 47 GLN CB . 11335 1
486 . 1 1 47 47 GLN CG C 13 34.912 0.300 . 1 . . . . 47 GLN CG . 11335 1
487 . 1 1 47 47 GLN NE2 N 15 112.923 0.300 . 1 . . . . 47 GLN NE2 . 11335 1
488 . 1 1 48 48 GLN H H 1 7.673 0.030 . 1 . . . . 48 GLN H . 11335 1
489 . 1 1 48 48 GLN HA H 1 4.773 0.030 . 1 . . . . 48 GLN HA . 11335 1
490 . 1 1 48 48 GLN HB2 H 1 1.532 0.030 . 2 . . . . 48 GLN HB2 . 11335 1
491 . 1 1 48 48 GLN HB3 H 1 1.746 0.030 . 2 . . . . 48 GLN HB3 . 11335 1
492 . 1 1 48 48 GLN HE21 H 1 6.941 0.030 . 2 . . . . 48 GLN HE21 . 11335 1
493 . 1 1 48 48 GLN HE22 H 1 7.389 0.030 . 2 . . . . 48 GLN HE22 . 11335 1
494 . 1 1 48 48 GLN HG2 H 1 1.874 0.030 . 1 . . . . 48 GLN HG2 . 11335 1
495 . 1 1 48 48 GLN HG3 H 1 1.874 0.030 . 1 . . . . 48 GLN HG3 . 11335 1
496 . 1 1 48 48 GLN CA C 13 53.560 0.300 . 1 . . . . 48 GLN CA . 11335 1
497 . 1 1 48 48 GLN CB C 13 32.647 0.300 . 1 . . . . 48 GLN CB . 11335 1
498 . 1 1 48 48 GLN CG C 13 34.786 0.300 . 1 . . . . 48 GLN CG . 11335 1
499 . 1 1 48 48 GLN N N 15 116.616 0.300 . 1 . . . . 48 GLN N . 11335 1
500 . 1 1 48 48 GLN NE2 N 15 111.392 0.300 . 1 . . . . 48 GLN NE2 . 11335 1
501 . 1 1 49 49 CYS H H 1 8.687 0.030 . 1 . . . . 49 CYS H . 11335 1
502 . 1 1 49 49 CYS HA H 1 4.084 0.030 . 1 . . . . 49 CYS HA . 11335 1
503 . 1 1 49 49 CYS HB2 H 1 2.847 0.030 . 2 . . . . 49 CYS HB2 . 11335 1
504 . 1 1 49 49 CYS HB3 H 1 3.220 0.030 . 2 . . . . 49 CYS HB3 . 11335 1
505 . 1 1 49 49 CYS CA C 13 56.346 0.300 . 1 . . . . 49 CYS CA . 11335 1
506 . 1 1 49 49 CYS CB C 13 31.888 0.300 . 1 . . . . 49 CYS CB . 11335 1
507 . 1 1 49 49 CYS N N 15 125.520 0.300 . 1 . . . . 49 CYS N . 11335 1
508 . 1 1 50 50 PRO HA H 1 4.381 0.030 . 1 . . . . 50 PRO HA . 11335 1
509 . 1 1 50 50 PRO HB2 H 1 1.854 0.030 . 2 . . . . 50 PRO HB2 . 11335 1
510 . 1 1 50 50 PRO HB3 H 1 1.601 0.030 . 2 . . . . 50 PRO HB3 . 11335 1
511 . 1 1 50 50 PRO HD2 H 1 3.762 0.030 . 2 . . . . 50 PRO HD2 . 11335 1
512 . 1 1 50 50 PRO HD3 H 1 3.401 0.030 . 2 . . . . 50 PRO HD3 . 11335 1
513 . 1 1 50 50 PRO HG2 H 1 1.477 0.030 . 2 . . . . 50 PRO HG2 . 11335 1
514 . 1 1 50 50 PRO HG3 H 1 1.101 0.030 . 2 . . . . 50 PRO HG3 . 11335 1
515 . 1 1 50 50 PRO C C 13 176.991 0.300 . 1 . . . . 50 PRO C . 11335 1
516 . 1 1 50 50 PRO CA C 13 64.317 0.300 . 1 . . . . 50 PRO CA . 11335 1
517 . 1 1 50 50 PRO CB C 13 31.570 0.300 . 1 . . . . 50 PRO CB . 11335 1
518 . 1 1 50 50 PRO CD C 13 50.381 0.300 . 1 . . . . 50 PRO CD . 11335 1
519 . 1 1 50 50 PRO CG C 13 26.988 0.300 . 1 . . . . 50 PRO CG . 11335 1
520 . 1 1 51 51 MET H H 1 9.236 0.030 . 1 . . . . 51 MET H . 11335 1
521 . 1 1 51 51 MET HA H 1 4.319 0.030 . 1 . . . . 51 MET HA . 11335 1
522 . 1 1 51 51 MET HB2 H 1 1.572 0.030 . 2 . . . . 51 MET HB2 . 11335 1
523 . 1 1 51 51 MET HB3 H 1 1.281 0.030 . 2 . . . . 51 MET HB3 . 11335 1
524 . 1 1 51 51 MET HE1 H 1 1.864 0.030 . 1 . . . . 51 MET HE . 11335 1
525 . 1 1 51 51 MET HE2 H 1 1.864 0.030 . 1 . . . . 51 MET HE . 11335 1
526 . 1 1 51 51 MET HE3 H 1 1.864 0.030 . 1 . . . . 51 MET HE . 11335 1
527 . 1 1 51 51 MET HG2 H 1 2.332 0.030 . 1 . . . . 51 MET HG2 . 11335 1
528 . 1 1 51 51 MET HG3 H 1 2.332 0.030 . 1 . . . . 51 MET HG3 . 11335 1
529 . 1 1 51 51 MET C C 13 177.153 0.300 . 1 . . . . 51 MET C . 11335 1
530 . 1 1 51 51 MET CA C 13 57.459 0.300 . 1 . . . . 51 MET CA . 11335 1
531 . 1 1 51 51 MET CB C 13 32.484 0.300 . 1 . . . . 51 MET CB . 11335 1
532 . 1 1 51 51 MET CE C 13 16.182 0.300 . 1 . . . . 51 MET CE . 11335 1
533 . 1 1 51 51 MET CG C 13 31.825 0.300 . 1 . . . . 51 MET CG . 11335 1
534 . 1 1 51 51 MET N N 15 119.736 0.300 . 1 . . . . 51 MET N . 11335 1
535 . 1 1 52 52 CYS H H 1 8.368 0.030 . 1 . . . . 52 CYS H . 11335 1
536 . 1 1 52 52 CYS HA H 1 5.012 0.030 . 1 . . . . 52 CYS HA . 11335 1
537 . 1 1 52 52 CYS HB2 H 1 3.458 0.030 . 2 . . . . 52 CYS HB2 . 11335 1
538 . 1 1 52 52 CYS HB3 H 1 2.714 0.030 . 2 . . . . 52 CYS HB3 . 11335 1
539 . 1 1 52 52 CYS C C 13 175.883 0.300 . 1 . . . . 52 CYS C . 11335 1
540 . 1 1 52 52 CYS CA C 13 58.427 0.300 . 1 . . . . 52 CYS CA . 11335 1
541 . 1 1 52 52 CYS CB C 13 32.963 0.300 . 1 . . . . 52 CYS CB . 11335 1
542 . 1 1 52 52 CYS N N 15 118.839 0.300 . 1 . . . . 52 CYS N . 11335 1
543 . 1 1 53 53 ARG H H 1 8.209 0.030 . 1 . . . . 53 ARG H . 11335 1
544 . 1 1 53 53 ARG HA H 1 4.040 0.030 . 1 . . . . 53 ARG HA . 11335 1
545 . 1 1 53 53 ARG HB2 H 1 2.193 0.030 . 2 . . . . 53 ARG HB2 . 11335 1
546 . 1 1 53 53 ARG HB3 H 1 2.009 0.030 . 2 . . . . 53 ARG HB3 . 11335 1
547 . 1 1 53 53 ARG HD2 H 1 3.167 0.030 . 2 . . . . 53 ARG HD2 . 11335 1
548 . 1 1 53 53 ARG HD3 H 1 3.097 0.030 . 2 . . . . 53 ARG HD3 . 11335 1
549 . 1 1 53 53 ARG HG2 H 1 1.550 0.030 . 2 . . . . 53 ARG HG2 . 11335 1
550 . 1 1 53 53 ARG HG3 H 1 1.482 0.030 . 2 . . . . 53 ARG HG3 . 11335 1
551 . 1 1 53 53 ARG C C 13 175.154 0.300 . 1 . . . . 53 ARG C . 11335 1
552 . 1 1 53 53 ARG CA C 13 58.104 0.300 . 1 . . . . 53 ARG CA . 11335 1
553 . 1 1 53 53 ARG CB C 13 26.869 0.300 . 1 . . . . 53 ARG CB . 11335 1
554 . 1 1 53 53 ARG CD C 13 42.617 0.300 . 1 . . . . 53 ARG CD . 11335 1
555 . 1 1 53 53 ARG CG C 13 27.254 0.300 . 1 . . . . 53 ARG CG . 11335 1
556 . 1 1 53 53 ARG N N 15 117.722 0.300 . 1 . . . . 53 ARG N . 11335 1
557 . 1 1 54 54 GLN H H 1 8.395 0.030 . 1 . . . . 54 GLN H . 11335 1
558 . 1 1 54 54 GLN HA H 1 4.368 0.030 . 1 . . . . 54 GLN HA . 11335 1
559 . 1 1 54 54 GLN HB2 H 1 2.168 0.030 . 1 . . . . 54 GLN HB2 . 11335 1
560 . 1 1 54 54 GLN HB3 H 1 2.168 0.030 . 1 . . . . 54 GLN HB3 . 11335 1
561 . 1 1 54 54 GLN HE21 H 1 7.757 0.030 . 2 . . . . 54 GLN HE21 . 11335 1
562 . 1 1 54 54 GLN HE22 H 1 7.030 0.030 . 2 . . . . 54 GLN HE22 . 11335 1
563 . 1 1 54 54 GLN HG2 H 1 2.767 0.030 . 2 . . . . 54 GLN HG2 . 11335 1
564 . 1 1 54 54 GLN HG3 H 1 2.516 0.030 . 2 . . . . 54 GLN HG3 . 11335 1
565 . 1 1 54 54 GLN C C 13 176.579 0.300 . 1 . . . . 54 GLN C . 11335 1
566 . 1 1 54 54 GLN CA C 13 56.983 0.300 . 1 . . . . 54 GLN CA . 11335 1
567 . 1 1 54 54 GLN CB C 13 29.909 0.300 . 1 . . . . 54 GLN CB . 11335 1
568 . 1 1 54 54 GLN CG C 13 35.305 0.300 . 1 . . . . 54 GLN CG . 11335 1
569 . 1 1 54 54 GLN N N 15 121.392 0.300 . 1 . . . . 54 GLN N . 11335 1
570 . 1 1 54 54 GLN NE2 N 15 114.027 0.300 . 1 . . . . 54 GLN NE2 . 11335 1
571 . 1 1 55 55 PHE H H 1 8.853 0.030 . 1 . . . . 55 PHE H . 11335 1
572 . 1 1 55 55 PHE HA H 1 4.507 0.030 . 1 . . . . 55 PHE HA . 11335 1
573 . 1 1 55 55 PHE HB2 H 1 3.195 0.030 . 2 . . . . 55 PHE HB2 . 11335 1
574 . 1 1 55 55 PHE HB3 H 1 3.049 0.030 . 2 . . . . 55 PHE HB3 . 11335 1
575 . 1 1 55 55 PHE HD1 H 1 7.299 0.030 . 1 . . . . 55 PHE HD1 . 11335 1
576 . 1 1 55 55 PHE HD2 H 1 7.299 0.030 . 1 . . . . 55 PHE HD2 . 11335 1
577 . 1 1 55 55 PHE HE1 H 1 7.362 0.030 . 1 . . . . 55 PHE HE1 . 11335 1
578 . 1 1 55 55 PHE HE2 H 1 7.362 0.030 . 1 . . . . 55 PHE HE2 . 11335 1
579 . 1 1 55 55 PHE HZ H 1 7.299 0.030 . 1 . . . . 55 PHE HZ . 11335 1
580 . 1 1 55 55 PHE C C 13 175.940 0.300 . 1 . . . . 55 PHE C . 11335 1
581 . 1 1 55 55 PHE CA C 13 59.930 0.300 . 1 . . . . 55 PHE CA . 11335 1
582 . 1 1 55 55 PHE CB C 13 39.157 0.300 . 1 . . . . 55 PHE CB . 11335 1
583 . 1 1 55 55 PHE CD1 C 13 131.816 0.300 . 1 . . . . 55 PHE CD1 . 11335 1
584 . 1 1 55 55 PHE CD2 C 13 131.816 0.300 . 1 . . . . 55 PHE CD2 . 11335 1
585 . 1 1 55 55 PHE CE1 C 13 131.554 0.300 . 1 . . . . 55 PHE CE1 . 11335 1
586 . 1 1 55 55 PHE CE2 C 13 131.554 0.300 . 1 . . . . 55 PHE CE2 . 11335 1
587 . 1 1 55 55 PHE CZ C 13 130.181 0.300 . 1 . . . . 55 PHE CZ . 11335 1
588 . 1 1 55 55 PHE N N 15 123.736 0.300 . 1 . . . . 55 PHE N . 11335 1
589 . 1 1 56 56 VAL H H 1 7.989 0.030 . 1 . . . . 56 VAL H . 11335 1
590 . 1 1 56 56 VAL HA H 1 4.055 0.030 . 1 . . . . 56 VAL HA . 11335 1
591 . 1 1 56 56 VAL HB H 1 1.784 0.030 . 1 . . . . 56 VAL HB . 11335 1
592 . 1 1 56 56 VAL HG11 H 1 0.926 0.030 . 1 . . . . 56 VAL HG1 . 11335 1
593 . 1 1 56 56 VAL HG12 H 1 0.926 0.030 . 1 . . . . 56 VAL HG1 . 11335 1
594 . 1 1 56 56 VAL HG13 H 1 0.926 0.030 . 1 . . . . 56 VAL HG1 . 11335 1
595 . 1 1 56 56 VAL HG21 H 1 0.780 0.030 . 1 . . . . 56 VAL HG2 . 11335 1
596 . 1 1 56 56 VAL HG22 H 1 0.780 0.030 . 1 . . . . 56 VAL HG2 . 11335 1
597 . 1 1 56 56 VAL HG23 H 1 0.780 0.030 . 1 . . . . 56 VAL HG2 . 11335 1
598 . 1 1 56 56 VAL C C 13 175.447 0.300 . 1 . . . . 56 VAL C . 11335 1
599 . 1 1 56 56 VAL CA C 13 62.442 0.300 . 1 . . . . 56 VAL CA . 11335 1
600 . 1 1 56 56 VAL CB C 13 32.493 0.300 . 1 . . . . 56 VAL CB . 11335 1
601 . 1 1 56 56 VAL CG1 C 13 22.265 0.300 . 2 . . . . 56 VAL CG1 . 11335 1
602 . 1 1 56 56 VAL CG2 C 13 22.084 0.300 . 2 . . . . 56 VAL CG2 . 11335 1
603 . 1 1 56 56 VAL N N 15 127.404 0.300 . 1 . . . . 56 VAL N . 11335 1
604 . 1 1 57 57 GLN H H 1 9.368 0.030 . 1 . . . . 57 GLN H . 11335 1
605 . 1 1 57 57 GLN HA H 1 4.272 0.030 . 1 . . . . 57 GLN HA . 11335 1
606 . 1 1 57 57 GLN HB2 H 1 2.194 0.030 . 2 . . . . 57 GLN HB2 . 11335 1
607 . 1 1 57 57 GLN HB3 H 1 2.020 0.030 . 2 . . . . 57 GLN HB3 . 11335 1
608 . 1 1 57 57 GLN HE21 H 1 6.954 0.030 . 2 . . . . 57 GLN HE21 . 11335 1
609 . 1 1 57 57 GLN HE22 H 1 7.775 0.030 . 2 . . . . 57 GLN HE22 . 11335 1
610 . 1 1 57 57 GLN HG2 H 1 2.522 0.030 . 1 . . . . 57 GLN HG2 . 11335 1
611 . 1 1 57 57 GLN HG3 H 1 2.522 0.030 . 1 . . . . 57 GLN HG3 . 11335 1
612 . 1 1 57 57 GLN C C 13 176.303 0.300 . 1 . . . . 57 GLN C . 11335 1
613 . 1 1 57 57 GLN CA C 13 57.391 0.300 . 1 . . . . 57 GLN CA . 11335 1
614 . 1 1 57 57 GLN CB C 13 30.086 0.300 . 1 . . . . 57 GLN CB . 11335 1
615 . 1 1 57 57 GLN CG C 13 34.071 0.300 . 1 . . . . 57 GLN CG . 11335 1
616 . 1 1 57 57 GLN N N 15 128.971 0.300 . 1 . . . . 57 GLN N . 11335 1
617 . 1 1 57 57 GLN NE2 N 15 112.445 0.300 . 1 . . . . 57 GLN NE2 . 11335 1
618 . 1 1 58 58 GLU H H 1 7.966 0.030 . 1 . . . . 58 GLU H . 11335 1
619 . 1 1 58 58 GLU HA H 1 4.629 0.030 . 1 . . . . 58 GLU HA . 11335 1
620 . 1 1 58 58 GLU HB2 H 1 2.156 0.030 . 2 . . . . 58 GLU HB2 . 11335 1
621 . 1 1 58 58 GLU HB3 H 1 2.099 0.030 . 2 . . . . 58 GLU HB3 . 11335 1
622 . 1 1 58 58 GLU HG2 H 1 2.217 0.030 . 1 . . . . 58 GLU HG2 . 11335 1
623 . 1 1 58 58 GLU HG3 H 1 2.217 0.030 . 1 . . . . 58 GLU HG3 . 11335 1
624 . 1 1 58 58 GLU C C 13 172.324 0.300 . 1 . . . . 58 GLU C . 11335 1
625 . 1 1 58 58 GLU CA C 13 55.120 0.300 . 1 . . . . 58 GLU CA . 11335 1
626 . 1 1 58 58 GLU CB C 13 33.353 0.300 . 1 . . . . 58 GLU CB . 11335 1
627 . 1 1 58 58 GLU CG C 13 36.322 0.300 . 1 . . . . 58 GLU CG . 11335 1
628 . 1 1 58 58 GLU N N 15 115.812 0.300 . 1 . . . . 58 GLU N . 11335 1
629 . 1 1 59 59 SER H H 1 8.453 0.030 . 1 . . . . 59 SER H . 11335 1
630 . 1 1 59 59 SER HA H 1 5.506 0.030 . 1 . . . . 59 SER HA . 11335 1
631 . 1 1 59 59 SER HB2 H 1 3.939 0.030 . 2 . . . . 59 SER HB2 . 11335 1
632 . 1 1 59 59 SER HB3 H 1 3.896 0.030 . 2 . . . . 59 SER HB3 . 11335 1
633 . 1 1 59 59 SER C C 13 173.481 0.300 . 1 . . . . 59 SER C . 11335 1
634 . 1 1 59 59 SER CA C 13 57.101 0.300 . 1 . . . . 59 SER CA . 11335 1
635 . 1 1 59 59 SER CB C 13 66.527 0.300 . 1 . . . . 59 SER CB . 11335 1
636 . 1 1 59 59 SER N N 15 113.318 0.300 . 1 . . . . 59 SER N . 11335 1
637 . 1 1 60 60 PHE H H 1 8.582 0.030 . 1 . . . . 60 PHE H . 11335 1
638 . 1 1 60 60 PHE HA H 1 5.175 0.030 . 1 . . . . 60 PHE HA . 11335 1
639 . 1 1 60 60 PHE HB2 H 1 2.998 0.030 . 2 . . . . 60 PHE HB2 . 11335 1
640 . 1 1 60 60 PHE HB3 H 1 3.121 0.030 . 2 . . . . 60 PHE HB3 . 11335 1
641 . 1 1 60 60 PHE HD1 H 1 7.033 0.030 . 1 . . . . 60 PHE HD1 . 11335 1
642 . 1 1 60 60 PHE HD2 H 1 7.033 0.030 . 1 . . . . 60 PHE HD2 . 11335 1
643 . 1 1 60 60 PHE HE1 H 1 7.178 0.030 . 1 . . . . 60 PHE HE1 . 11335 1
644 . 1 1 60 60 PHE HE2 H 1 7.178 0.030 . 1 . . . . 60 PHE HE2 . 11335 1
645 . 1 1 60 60 PHE HZ H 1 7.216 0.030 . 1 . . . . 60 PHE HZ . 11335 1
646 . 1 1 60 60 PHE C C 13 172.472 0.300 . 1 . . . . 60 PHE C . 11335 1
647 . 1 1 60 60 PHE CA C 13 56.603 0.300 . 1 . . . . 60 PHE CA . 11335 1
648 . 1 1 60 60 PHE CB C 13 42.000 0.300 . 1 . . . . 60 PHE CB . 11335 1
649 . 1 1 60 60 PHE CD1 C 13 132.347 0.300 . 1 . . . . 60 PHE CD1 . 11335 1
650 . 1 1 60 60 PHE CD2 C 13 132.347 0.300 . 1 . . . . 60 PHE CD2 . 11335 1
651 . 1 1 60 60 PHE CE1 C 13 130.948 0.300 . 1 . . . . 60 PHE CE1 . 11335 1
652 . 1 1 60 60 PHE CE2 C 13 130.948 0.300 . 1 . . . . 60 PHE CE2 . 11335 1
653 . 1 1 60 60 PHE CZ C 13 129.684 0.300 . 1 . . . . 60 PHE CZ . 11335 1
654 . 1 1 60 60 PHE N N 15 116.972 0.300 . 1 . . . . 60 PHE N . 11335 1
655 . 1 1 61 61 ALA H H 1 8.140 0.030 . 1 . . . . 61 ALA H . 11335 1
656 . 1 1 61 61 ALA HA H 1 3.836 0.030 . 1 . . . . 61 ALA HA . 11335 1
657 . 1 1 61 61 ALA HB1 H 1 0.431 0.030 . 1 . . . . 61 ALA HB . 11335 1
658 . 1 1 61 61 ALA HB2 H 1 0.431 0.030 . 1 . . . . 61 ALA HB . 11335 1
659 . 1 1 61 61 ALA HB3 H 1 0.431 0.030 . 1 . . . . 61 ALA HB . 11335 1
660 . 1 1 61 61 ALA C C 13 179.198 0.300 . 1 . . . . 61 ALA C . 11335 1
661 . 1 1 61 61 ALA CA C 13 50.165 0.300 . 1 . . . . 61 ALA CA . 11335 1
662 . 1 1 61 61 ALA CB C 13 19.057 0.300 . 1 . . . . 61 ALA CB . 11335 1
663 . 1 1 61 61 ALA N N 15 125.120 0.300 . 1 . . . . 61 ALA N . 11335 1
664 . 1 1 62 62 LEU H H 1 7.792 0.030 . 1 . . . . 62 LEU H . 11335 1
665 . 1 1 62 62 LEU HA H 1 4.032 0.030 . 1 . . . . 62 LEU HA . 11335 1
666 . 1 1 62 62 LEU HB2 H 1 1.660 0.030 . 2 . . . . 62 LEU HB2 . 11335 1
667 . 1 1 62 62 LEU HB3 H 1 1.398 0.030 . 2 . . . . 62 LEU HB3 . 11335 1
668 . 1 1 62 62 LEU HD11 H 1 0.697 0.030 . 1 . . . . 62 LEU HD1 . 11335 1
669 . 1 1 62 62 LEU HD12 H 1 0.697 0.030 . 1 . . . . 62 LEU HD1 . 11335 1
670 . 1 1 62 62 LEU HD13 H 1 0.697 0.030 . 1 . . . . 62 LEU HD1 . 11335 1
671 . 1 1 62 62 LEU HD21 H 1 0.723 0.030 . 1 . . . . 62 LEU HD2 . 11335 1
672 . 1 1 62 62 LEU HD22 H 1 0.723 0.030 . 1 . . . . 62 LEU HD2 . 11335 1
673 . 1 1 62 62 LEU HD23 H 1 0.723 0.030 . 1 . . . . 62 LEU HD2 . 11335 1
674 . 1 1 62 62 LEU HG H 1 1.142 0.030 . 1 . . . . 62 LEU HG . 11335 1
675 . 1 1 62 62 LEU C C 13 177.626 0.300 . 1 . . . . 62 LEU C . 11335 1
676 . 1 1 62 62 LEU CA C 13 55.907 0.300 . 1 . . . . 62 LEU CA . 11335 1
677 . 1 1 62 62 LEU CB C 13 42.107 0.300 . 1 . . . . 62 LEU CB . 11335 1
678 . 1 1 62 62 LEU CD1 C 13 25.271 0.300 . 2 . . . . 62 LEU CD1 . 11335 1
679 . 1 1 62 62 LEU CD2 C 13 23.010 0.300 . 2 . . . . 62 LEU CD2 . 11335 1
680 . 1 1 62 62 LEU CG C 13 27.012 0.300 . 1 . . . . 62 LEU CG . 11335 1
681 . 1 1 62 62 LEU N N 15 121.396 0.300 . 1 . . . . 62 LEU N . 11335 1
682 . 1 1 63 63 SER H H 1 7.869 0.030 . 1 . . . . 63 SER H . 11335 1
683 . 1 1 63 63 SER HA H 1 4.514 0.030 . 1 . . . . 63 SER HA . 11335 1
684 . 1 1 63 63 SER HB2 H 1 3.838 0.030 . 1 . . . . 63 SER HB2 . 11335 1
685 . 1 1 63 63 SER HB3 H 1 3.838 0.030 . 1 . . . . 63 SER HB3 . 11335 1
686 . 1 1 63 63 SER C C 13 174.261 0.300 . 1 . . . . 63 SER C . 11335 1
687 . 1 1 63 63 SER CA C 13 57.507 0.300 . 1 . . . . 63 SER CA . 11335 1
688 . 1 1 63 63 SER CB C 13 64.480 0.300 . 1 . . . . 63 SER CB . 11335 1
689 . 1 1 63 63 SER N N 15 113.157 0.300 . 1 . . . . 63 SER N . 11335 1
690 . 1 1 64 64 GLY H H 1 8.227 0.030 . 1 . . . . 64 GLY H . 11335 1
691 . 1 1 64 64 GLY HA2 H 1 4.163 0.030 . 2 . . . . 64 GLY HA2 . 11335 1
692 . 1 1 64 64 GLY HA3 H 1 4.115 0.030 . 2 . . . . 64 GLY HA3 . 11335 1
693 . 1 1 64 64 GLY C C 13 172.129 0.300 . 1 . . . . 64 GLY C . 11335 1
694 . 1 1 64 64 GLY CA C 13 44.771 0.300 . 1 . . . . 64 GLY CA . 11335 1
695 . 1 1 64 64 GLY N N 15 110.335 0.300 . 1 . . . . 64 GLY N . 11335 1
696 . 1 1 65 65 PRO HA H 1 4.476 0.030 . 1 . . . . 65 PRO HA . 11335 1
697 . 1 1 65 65 PRO HB2 H 1 2.341 0.030 . 1 . . . . 65 PRO HB2 . 11335 1
698 . 1 1 65 65 PRO HB3 H 1 2.341 0.030 . 1 . . . . 65 PRO HB3 . 11335 1
699 . 1 1 65 65 PRO HD2 H 1 3.650 0.030 . 1 . . . . 65 PRO HD2 . 11335 1
700 . 1 1 65 65 PRO HD3 H 1 3.650 0.030 . 1 . . . . 65 PRO HD3 . 11335 1
701 . 1 1 65 65 PRO HG2 H 1 2.011 0.030 . 1 . . . . 65 PRO HG2 . 11335 1
702 . 1 1 65 65 PRO HG3 H 1 2.011 0.030 . 1 . . . . 65 PRO HG3 . 11335 1
703 . 1 1 65 65 PRO CA C 13 63.602 0.300 . 1 . . . . 65 PRO CA . 11335 1
704 . 1 1 65 65 PRO CB C 13 32.366 0.300 . 1 . . . . 65 PRO CB . 11335 1
705 . 1 1 65 65 PRO CD C 13 49.833 0.300 . 1 . . . . 65 PRO CD . 11335 1
706 . 1 1 65 65 PRO CG C 13 27.159 0.300 . 1 . . . . 65 PRO CG . 11335 1
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