data_10075
#######################
# Entry information #
#######################
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10075
_Entry.Title
;
The fourth FN3 domain of human sidekick-2
;
_Entry.Type macromolecule
_Entry.Version_type original
_Entry.Submission_date 2006-12-25
_Entry.Accession_date 2006-12-27
_Entry.Last_release_date 2008-08-14
_Entry.Original_release_date 2008-08-14
_Entry.Origination author
_Entry.NMR_STAR_version 3.1.1.61
_Entry.Original_NMR_STAR_version .
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype .
_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 T. Nagashima . . . 10075
2 F. Hayashi . . . 10075
3 S. Yokoyama . . . 10075
stop_
loop_
_Entry_src.ID
_Entry_src.Project_name
_Entry_src.Organization_full_name
_Entry_src.Organization_initials
_Entry_src.Entry_ID
1 . 'Protein Research Group, RIKEN Genomic Sciences Center' . 10075
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts 1 10075
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
'13C chemical shifts' 479 10075
'15N chemical shifts' 113 10075
'1H chemical shifts' 757 10075
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 . . 2008-08-14 2006-12-25 original author . 10075
stop_
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 1WFN 'BMRB Entry Tracking System' 10075
stop_
save_
###############
# Citations #
###############
save_citation_1
_Citation.Sf_category citations
_Citation.Sf_framecode citation_1
_Citation.Entry_ID 10075
_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 'The fourth FN3 domain of human sidekick-2'
_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 T. Nagashima . . . 10075 1
2 F. Hayashi . . . 10075 1
3 S. Yokoyama . . . 10075 1
stop_
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID 10075
_Assembly.ID 1
_Assembly.Name 'sidekick 2'
_Assembly.BMRB_code .
_Assembly.Number_of_components 1
_Assembly.Organic_ligands 0
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds .
_Assembly.Ambiguous_conformational_states no
_Assembly.Ambiguous_chem_comp_sites no
_Assembly.Molecules_in_chemical_exchange no
_Assembly.Paramagnetic no
_Assembly.Thiol_state 'all free'
_Assembly.Molecular_mass .
_Assembly.Enzyme_commission_number .
_Assembly.Details .
_Assembly.DB_query_date .
_Assembly.DB_query_revised_last_date .
loop_
_Assembly_type.Type
_Assembly_type.Entry_ID
_Assembly_type.Assembly_ID
'protein monomer' 10075 1
stop_
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 'sidekick 2' 1 $entity_1 . . yes native no no . . . 10075 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
. PDB 1WFN . . . . . . 10075 1
stop_
save_
####################################
# Biological polymers and ligands #
####################################
save_entity_1
_Entity.Sf_category entity
_Entity.Sf_framecode entity_1
_Entity.Entry_ID 10075
_Entity.ID 1
_Entity.BMRB_code .
_Entity.Name 'FN3 domain'
_Entity.Type polymer
_Entity.Polymer_common_type .
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_type_details .
_Entity.Polymer_strand_ID .
_Entity.Polymer_seq_one_letter_code_can .
_Entity.Polymer_seq_one_letter_code
;
GSSGSSGPQLVRTHEDVPGP
VGHLSFSEILDTSLKVSWQE
PGEKNGILTGYRISWEEYNR
TNTRVTHYLPNVTLEYRVTG
LTALTTYTIEVAAMTSKGQG
QVSASTISSGVPPSGPSSG
;
_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 119
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state 'all free'
_Entity.Src_method .
_Entity.Parent_entity_ID 1
_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 2014-05-12
loop_
_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
no PDB 1WFN . "The Fourth Fn3 Domain Of Human Sidekick-2" . . . . . 100.00 119 100.00 100.00 6.32e-78 . . . . 10075 1
stop_
loop_
_Entity_common_name.Name
_Entity_common_name.Type
_Entity_common_name.Entry_ID
_Entity_common_name.Entity_ID
'FN3 domain' . 10075 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 . 10075 1
2 . SER . 10075 1
3 . SER . 10075 1
4 . GLY . 10075 1
5 . SER . 10075 1
6 . SER . 10075 1
7 . GLY . 10075 1
8 . PRO . 10075 1
9 . GLN . 10075 1
10 . LEU . 10075 1
11 . VAL . 10075 1
12 . ARG . 10075 1
13 . THR . 10075 1
14 . HIS . 10075 1
15 . GLU . 10075 1
16 . ASP . 10075 1
17 . VAL . 10075 1
18 . PRO . 10075 1
19 . GLY . 10075 1
20 . PRO . 10075 1
21 . VAL . 10075 1
22 . GLY . 10075 1
23 . HIS . 10075 1
24 . LEU . 10075 1
25 . SER . 10075 1
26 . PHE . 10075 1
27 . SER . 10075 1
28 . GLU . 10075 1
29 . ILE . 10075 1
30 . LEU . 10075 1
31 . ASP . 10075 1
32 . THR . 10075 1
33 . SER . 10075 1
34 . LEU . 10075 1
35 . LYS . 10075 1
36 . VAL . 10075 1
37 . SER . 10075 1
38 . TRP . 10075 1
39 . GLN . 10075 1
40 . GLU . 10075 1
41 . PRO . 10075 1
42 . GLY . 10075 1
43 . GLU . 10075 1
44 . LYS . 10075 1
45 . ASN . 10075 1
46 . GLY . 10075 1
47 . ILE . 10075 1
48 . LEU . 10075 1
49 . THR . 10075 1
50 . GLY . 10075 1
51 . TYR . 10075 1
52 . ARG . 10075 1
53 . ILE . 10075 1
54 . SER . 10075 1
55 . TRP . 10075 1
56 . GLU . 10075 1
57 . GLU . 10075 1
58 . TYR . 10075 1
59 . ASN . 10075 1
60 . ARG . 10075 1
61 . THR . 10075 1
62 . ASN . 10075 1
63 . THR . 10075 1
64 . ARG . 10075 1
65 . VAL . 10075 1
66 . THR . 10075 1
67 . HIS . 10075 1
68 . TYR . 10075 1
69 . LEU . 10075 1
70 . PRO . 10075 1
71 . ASN . 10075 1
72 . VAL . 10075 1
73 . THR . 10075 1
74 . LEU . 10075 1
75 . GLU . 10075 1
76 . TYR . 10075 1
77 . ARG . 10075 1
78 . VAL . 10075 1
79 . THR . 10075 1
80 . GLY . 10075 1
81 . LEU . 10075 1
82 . THR . 10075 1
83 . ALA . 10075 1
84 . LEU . 10075 1
85 . THR . 10075 1
86 . THR . 10075 1
87 . TYR . 10075 1
88 . THR . 10075 1
89 . ILE . 10075 1
90 . GLU . 10075 1
91 . VAL . 10075 1
92 . ALA . 10075 1
93 . ALA . 10075 1
94 . MET . 10075 1
95 . THR . 10075 1
96 . SER . 10075 1
97 . LYS . 10075 1
98 . GLY . 10075 1
99 . GLN . 10075 1
100 . GLY . 10075 1
101 . GLN . 10075 1
102 . VAL . 10075 1
103 . SER . 10075 1
104 . ALA . 10075 1
105 . SER . 10075 1
106 . THR . 10075 1
107 . ILE . 10075 1
108 . SER . 10075 1
109 . SER . 10075 1
110 . GLY . 10075 1
111 . VAL . 10075 1
112 . PRO . 10075 1
113 . PRO . 10075 1
114 . SER . 10075 1
115 . GLY . 10075 1
116 . PRO . 10075 1
117 . SER . 10075 1
118 . SER . 10075 1
119 . GLY . 10075 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 10075 1
. SER 2 2 10075 1
. SER 3 3 10075 1
. GLY 4 4 10075 1
. SER 5 5 10075 1
. SER 6 6 10075 1
. GLY 7 7 10075 1
. PRO 8 8 10075 1
. GLN 9 9 10075 1
. LEU 10 10 10075 1
. VAL 11 11 10075 1
. ARG 12 12 10075 1
. THR 13 13 10075 1
. HIS 14 14 10075 1
. GLU 15 15 10075 1
. ASP 16 16 10075 1
. VAL 17 17 10075 1
. PRO 18 18 10075 1
. GLY 19 19 10075 1
. PRO 20 20 10075 1
. VAL 21 21 10075 1
. GLY 22 22 10075 1
. HIS 23 23 10075 1
. LEU 24 24 10075 1
. SER 25 25 10075 1
. PHE 26 26 10075 1
. SER 27 27 10075 1
. GLU 28 28 10075 1
. ILE 29 29 10075 1
. LEU 30 30 10075 1
. ASP 31 31 10075 1
. THR 32 32 10075 1
. SER 33 33 10075 1
. LEU 34 34 10075 1
. LYS 35 35 10075 1
. VAL 36 36 10075 1
. SER 37 37 10075 1
. TRP 38 38 10075 1
. GLN 39 39 10075 1
. GLU 40 40 10075 1
. PRO 41 41 10075 1
. GLY 42 42 10075 1
. GLU 43 43 10075 1
. LYS 44 44 10075 1
. ASN 45 45 10075 1
. GLY 46 46 10075 1
. ILE 47 47 10075 1
. LEU 48 48 10075 1
. THR 49 49 10075 1
. GLY 50 50 10075 1
. TYR 51 51 10075 1
. ARG 52 52 10075 1
. ILE 53 53 10075 1
. SER 54 54 10075 1
. TRP 55 55 10075 1
. GLU 56 56 10075 1
. GLU 57 57 10075 1
. TYR 58 58 10075 1
. ASN 59 59 10075 1
. ARG 60 60 10075 1
. THR 61 61 10075 1
. ASN 62 62 10075 1
. THR 63 63 10075 1
. ARG 64 64 10075 1
. VAL 65 65 10075 1
. THR 66 66 10075 1
. HIS 67 67 10075 1
. TYR 68 68 10075 1
. LEU 69 69 10075 1
. PRO 70 70 10075 1
. ASN 71 71 10075 1
. VAL 72 72 10075 1
. THR 73 73 10075 1
. LEU 74 74 10075 1
. GLU 75 75 10075 1
. TYR 76 76 10075 1
. ARG 77 77 10075 1
. VAL 78 78 10075 1
. THR 79 79 10075 1
. GLY 80 80 10075 1
. LEU 81 81 10075 1
. THR 82 82 10075 1
. ALA 83 83 10075 1
. LEU 84 84 10075 1
. THR 85 85 10075 1
. THR 86 86 10075 1
. TYR 87 87 10075 1
. THR 88 88 10075 1
. ILE 89 89 10075 1
. GLU 90 90 10075 1
. VAL 91 91 10075 1
. ALA 92 92 10075 1
. ALA 93 93 10075 1
. MET 94 94 10075 1
. THR 95 95 10075 1
. SER 96 96 10075 1
. LYS 97 97 10075 1
. GLY 98 98 10075 1
. GLN 99 99 10075 1
. GLY 100 100 10075 1
. GLN 101 101 10075 1
. VAL 102 102 10075 1
. SER 103 103 10075 1
. ALA 104 104 10075 1
. SER 105 105 10075 1
. THR 106 106 10075 1
. ILE 107 107 10075 1
. SER 108 108 10075 1
. SER 109 109 10075 1
. GLY 110 110 10075 1
. VAL 111 111 10075 1
. PRO 112 112 10075 1
. PRO 113 113 10075 1
. SER 114 114 10075 1
. GLY 115 115 10075 1
. PRO 116 116 10075 1
. SER 117 117 10075 1
. SER 118 118 10075 1
. GLY 119 119 10075 1
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 10075
_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 . . . human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 10075 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 10075
_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' . . . . . . . . . . . . . . . . . . . plasmid . . P040223-46 . . . . . . 10075 1
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Sample.Sf_category sample
_Sample.Sf_framecode sample_1
_Sample.Entry_ID 10075
_Sample.ID 1
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details .
_Sample.Aggregate_sample_number .
_Sample.Solvent_system .
_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 'FN3 domain' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.21 . . mM . . . . 10075 1
2 d-TRIS . . . . . . buffer 20 . . mM . . . . 10075 1
3 NaCl . . . . . . salt 100 . . mM . . . . 10075 1
4 d-DTT . . . . . . salt 1 . . mM . . . . 10075 1
5 NaN3 . . . . . . . 0.02 . . % . . . . 10075 1
6 H2O . . . . . . solvent 90 . . % . . . . 10075 1
7 D2O . . . . . . solvent 10 . . % . . . . 10075 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 10075
_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 10075 1
pH 7.0 0.05 pH 10075 1
pressure 1 0.001 atm 10075 1
temperature 298 0.1 K 10075 1
stop_
save_
############################
# Computer software used #
############################
save_software_1
_Software.Sf_category software
_Software.Sf_framecode software_1
_Software.Entry_ID 10075
_Software.ID 1
_Software.Name VNMR
_Software.Version 6.1C
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
Varian . . 10075 1
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
collection 10075 1
stop_
save_
save_software_2
_Software.Sf_category software
_Software.Sf_framecode software_2
_Software.Entry_ID 10075
_Software.ID 2
_Software.Name NMRPipe
_Software.Version 20020425
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Delaglio, F.' . . 10075 2
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
processing 10075 2
stop_
save_
save_software_3
_Software.Sf_category software
_Software.Sf_framecode software_3
_Software.Entry_ID 10075
_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.' . . 10075 3
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data analysis' 10075 3
stop_
save_
save_software_4
_Software.Sf_category software
_Software.Sf_framecode software_4
_Software.Entry_ID 10075
_Software.ID 4
_Software.Name Kujira
_Software.Version 0.8992
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Kobayashi, N.' . . 10075 4
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data analysis' 10075 4
stop_
save_
save_software_5
_Software.Sf_category software
_Software.Sf_framecode software_5
_Software.Entry_ID 10075
_Software.ID 5
_Software.Name CYANA
_Software.Version 1.0.7
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Guntert, P.' . . 10075 5
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
refinement 10075 5
'structure solution' 10075 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 10075
_NMR_spectrometer.ID 1
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Varian
_NMR_spectrometer.Model INOVA
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 900
save_
save_spectrometer_2
_NMR_spectrometer.Sf_category NMR_spectrometer
_NMR_spectrometer.Sf_framecode spectrometer_2
_NMR_spectrometer.Entry_ID 10075
_NMR_spectrometer.ID 2
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Varian
_NMR_spectrometer.Model INOVA
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 800
save_
#############################
# NMR applied experiments #
#############################
save_NMR_experiment_list
_Experiment_list.Sf_category experiment_list
_Experiment_list.Sf_framecode NMR_experiment_list
_Experiment_list.Entry_ID 10075
_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 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10075 1
2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10075 1
stop_
save_
save_3D_13C-separated_NOESY
_NMR_spec_expt.Sf_category NMR_spectrometer_expt
_NMR_spec_expt.Sf_framecode 3D_13C-separated_NOESY
_NMR_spec_expt.Entry_ID 10075
_NMR_spec_expt.ID 1
_NMR_spec_expt.Name '3D 13C-separated NOESY'
_NMR_spec_expt.Type .
_NMR_spec_expt.Sample_volume .
_NMR_spec_expt.Sample_volume_units .
_NMR_spec_expt.NMR_tube_type .
_NMR_spec_expt.Sample_spinning_rate .
_NMR_spec_expt.Sample_angle .
_NMR_spec_expt.NMR_spectrometer_ID 1
_NMR_spec_expt.NMR_spectrometer_label $spectrometer_1
_NMR_spec_expt.NMR_spectrometer_probe_ID .
_NMR_spec_expt.NMR_spectrometer_probe_label .
_NMR_spec_expt.Carrier_freq_switch_time .
_NMR_spec_expt.Software_ID .
_NMR_spec_expt.Software_label .
_NMR_spec_expt.Method_ID .
_NMR_spec_expt.Method_label .
_NMR_spec_expt.Pulse_seq_accession_BMRB_code .
_NMR_spec_expt.Details .
save_
save_3D_15N-separated_NOESY
_NMR_spec_expt.Sf_category NMR_spectrometer_expt
_NMR_spec_expt.Sf_framecode 3D_15N-separated_NOESY
_NMR_spec_expt.Entry_ID 10075
_NMR_spec_expt.ID 2
_NMR_spec_expt.Name '3D 15N-separated NOESY'
_NMR_spec_expt.Type .
_NMR_spec_expt.Sample_volume .
_NMR_spec_expt.Sample_volume_units .
_NMR_spec_expt.NMR_tube_type .
_NMR_spec_expt.Sample_spinning_rate .
_NMR_spec_expt.Sample_angle .
_NMR_spec_expt.NMR_spectrometer_ID 1
_NMR_spec_expt.NMR_spectrometer_label $spectrometer_1
_NMR_spec_expt.NMR_spectrometer_probe_ID .
_NMR_spec_expt.NMR_spectrometer_probe_label .
_NMR_spec_expt.Carrier_freq_switch_time .
_NMR_spec_expt.Software_ID .
_NMR_spec_expt.Software_label .
_NMR_spec_expt.Method_ID .
_NMR_spec_expt.Method_label .
_NMR_spec_expt.Pulse_seq_accession_BMRB_code .
_NMR_spec_expt.Details .
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 10075
_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 . . . . . . . . . 10075 1
H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10075 1
N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10075 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 10075
_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 13C-separated NOESY' 1 $sample_1 isotropic 10075 1
2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10075 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 8 8 PRO HA H 1 4.421 0.030 . 1 . . . . 8 PRO HA . 10075 1
2 . 1 1 8 8 PRO HB2 H 1 2.271 0.030 . 2 . . . . 8 PRO HB2 . 10075 1
3 . 1 1 8 8 PRO HB3 H 1 1.894 0.030 . 2 . . . . 8 PRO HB3 . 10075 1
4 . 1 1 8 8 PRO HG2 H 1 2.014 0.030 . 1 . . . . 8 PRO HG2 . 10075 1
5 . 1 1 8 8 PRO HG3 H 1 2.014 0.030 . 1 . . . . 8 PRO HG3 . 10075 1
6 . 1 1 8 8 PRO HD2 H 1 3.631 0.030 . 1 . . . . 8 PRO HD2 . 10075 1
7 . 1 1 8 8 PRO HD3 H 1 3.631 0.030 . 1 . . . . 8 PRO HD3 . 10075 1
8 . 1 1 8 8 PRO C C 13 177.012 0.300 . 1 . . . . 8 PRO C . 10075 1
9 . 1 1 8 8 PRO CA C 13 63.212 0.300 . 1 . . . . 8 PRO CA . 10075 1
10 . 1 1 8 8 PRO CB C 13 32.168 0.300 . 1 . . . . 8 PRO CB . 10075 1
11 . 1 1 8 8 PRO CG C 13 27.250 0.300 . 1 . . . . 8 PRO CG . 10075 1
12 . 1 1 8 8 PRO CD C 13 49.857 0.300 . 1 . . . . 8 PRO CD . 10075 1
13 . 1 1 9 9 GLN H H 1 8.495 0.030 . 1 . . . . 9 GLN H . 10075 1
14 . 1 1 9 9 GLN HA H 1 4.307 0.030 . 1 . . . . 9 GLN HA . 10075 1
15 . 1 1 9 9 GLN HB2 H 1 2.074 0.030 . 2 . . . . 9 GLN HB2 . 10075 1
16 . 1 1 9 9 GLN HB3 H 1 1.961 0.030 . 2 . . . . 9 GLN HB3 . 10075 1
17 . 1 1 9 9 GLN HG2 H 1 2.373 0.030 . 1 . . . . 9 GLN HG2 . 10075 1
18 . 1 1 9 9 GLN HG3 H 1 2.373 0.030 . 1 . . . . 9 GLN HG3 . 10075 1
19 . 1 1 9 9 GLN HE21 H 1 7.500 0.030 . 2 . . . . 9 GLN HE21 . 10075 1
20 . 1 1 9 9 GLN HE22 H 1 6.867 0.030 . 2 . . . . 9 GLN HE22 . 10075 1
21 . 1 1 9 9 GLN C C 13 175.794 0.300 . 1 . . . . 9 GLN C . 10075 1
22 . 1 1 9 9 GLN CA C 13 55.648 0.300 . 1 . . . . 9 GLN CA . 10075 1
23 . 1 1 9 9 GLN CB C 13 29.451 0.300 . 1 . . . . 9 GLN CB . 10075 1
24 . 1 1 9 9 GLN CG C 13 33.814 0.300 . 1 . . . . 9 GLN CG . 10075 1
25 . 1 1 9 9 GLN N N 15 120.704 0.300 . 1 . . . . 9 GLN N . 10075 1
26 . 1 1 9 9 GLN NE2 N 15 112.915 0.300 . 1 . . . . 9 GLN NE2 . 10075 1
27 . 1 1 10 10 LEU H H 1 8.268 0.030 . 1 . . . . 10 LEU H . 10075 1
28 . 1 1 10 10 LEU HA H 1 4.363 0.030 . 1 . . . . 10 LEU HA . 10075 1
29 . 1 1 10 10 LEU HB2 H 1 1.615 0.030 . 2 . . . . 10 LEU HB2 . 10075 1
30 . 1 1 10 10 LEU HB3 H 1 1.564 0.030 . 2 . . . . 10 LEU HB3 . 10075 1
31 . 1 1 10 10 LEU HG H 1 1.572 0.030 . 1 . . . . 10 LEU HG . 10075 1
32 . 1 1 10 10 LEU HD11 H 1 0.909 0.030 . 1 . . . . 10 LEU HD1 . 10075 1
33 . 1 1 10 10 LEU HD12 H 1 0.909 0.030 . 1 . . . . 10 LEU HD1 . 10075 1
34 . 1 1 10 10 LEU HD13 H 1 0.909 0.030 . 1 . . . . 10 LEU HD1 . 10075 1
35 . 1 1 10 10 LEU HD21 H 1 0.855 0.030 . 1 . . . . 10 LEU HD2 . 10075 1
36 . 1 1 10 10 LEU HD22 H 1 0.855 0.030 . 1 . . . . 10 LEU HD2 . 10075 1
37 . 1 1 10 10 LEU HD23 H 1 0.855 0.030 . 1 . . . . 10 LEU HD2 . 10075 1
38 . 1 1 10 10 LEU C C 13 177.013 0.300 . 1 . . . . 10 LEU C . 10075 1
39 . 1 1 10 10 LEU CA C 13 55.220 0.300 . 1 . . . . 10 LEU CA . 10075 1
40 . 1 1 10 10 LEU CB C 13 42.405 0.300 . 1 . . . . 10 LEU CB . 10075 1
41 . 1 1 10 10 LEU CG C 13 27.030 0.300 . 1 . . . . 10 LEU CG . 10075 1
42 . 1 1 10 10 LEU CD1 C 13 24.840 0.300 . 2 . . . . 10 LEU CD1 . 10075 1
43 . 1 1 10 10 LEU CD2 C 13 23.668 0.300 . 2 . . . . 10 LEU CD2 . 10075 1
44 . 1 1 10 10 LEU N N 15 124.171 0.300 . 1 . . . . 10 LEU N . 10075 1
45 . 1 1 11 11 VAL H H 1 8.149 0.030 . 1 . . . . 11 VAL H . 10075 1
46 . 1 1 11 11 VAL HA H 1 4.091 0.030 . 1 . . . . 11 VAL HA . 10075 1
47 . 1 1 11 11 VAL HB H 1 2.018 0.030 . 1 . . . . 11 VAL HB . 10075 1
48 . 1 1 11 11 VAL HG11 H 1 0.897 0.030 . 1 . . . . 11 VAL HG1 . 10075 1
49 . 1 1 11 11 VAL HG12 H 1 0.897 0.030 . 1 . . . . 11 VAL HG1 . 10075 1
50 . 1 1 11 11 VAL HG13 H 1 0.897 0.030 . 1 . . . . 11 VAL HG1 . 10075 1
51 . 1 1 11 11 VAL HG21 H 1 0.925 0.030 . 1 . . . . 11 VAL HG2 . 10075 1
52 . 1 1 11 11 VAL HG22 H 1 0.925 0.030 . 1 . . . . 11 VAL HG2 . 10075 1
53 . 1 1 11 11 VAL HG23 H 1 0.925 0.030 . 1 . . . . 11 VAL HG2 . 10075 1
54 . 1 1 11 11 VAL C C 13 175.867 0.300 . 1 . . . . 11 VAL C . 10075 1
55 . 1 1 11 11 VAL CA C 13 62.248 0.300 . 1 . . . . 11 VAL CA . 10075 1
56 . 1 1 11 11 VAL CB C 13 32.834 0.300 . 1 . . . . 11 VAL CB . 10075 1
57 . 1 1 11 11 VAL CG1 C 13 21.163 0.300 . 2 . . . . 11 VAL CG1 . 10075 1
58 . 1 1 11 11 VAL CG2 C 13 20.700 0.300 . 2 . . . . 11 VAL CG2 . 10075 1
59 . 1 1 11 11 VAL N N 15 122.017 0.300 . 1 . . . . 11 VAL N . 10075 1
60 . 1 1 12 12 ARG H H 1 8.482 0.030 . 1 . . . . 12 ARG H . 10075 1
61 . 1 1 12 12 ARG HA H 1 4.442 0.030 . 1 . . . . 12 ARG HA . 10075 1
62 . 1 1 12 12 ARG HB2 H 1 1.816 0.030 . 2 . . . . 12 ARG HB2 . 10075 1
63 . 1 1 12 12 ARG HB3 H 1 1.728 0.030 . 2 . . . . 12 ARG HB3 . 10075 1
64 . 1 1 12 12 ARG HG2 H 1 1.611 0.030 . 2 . . . . 12 ARG HG2 . 10075 1
65 . 1 1 12 12 ARG HG3 H 1 1.567 0.030 . 2 . . . . 12 ARG HG3 . 10075 1
66 . 1 1 12 12 ARG HD2 H 1 3.185 0.030 . 1 . . . . 12 ARG HD2 . 10075 1
67 . 1 1 12 12 ARG HD3 H 1 3.185 0.030 . 1 . . . . 12 ARG HD3 . 10075 1
68 . 1 1 12 12 ARG C C 13 176.250 0.300 . 1 . . . . 12 ARG C . 10075 1
69 . 1 1 12 12 ARG CA C 13 55.812 0.300 . 1 . . . . 12 ARG CA . 10075 1
70 . 1 1 12 12 ARG CB C 13 31.012 0.300 . 1 . . . . 12 ARG CB . 10075 1
71 . 1 1 12 12 ARG CG C 13 27.194 0.300 . 1 . . . . 12 ARG CG . 10075 1
72 . 1 1 12 12 ARG CD C 13 43.387 0.300 . 1 . . . . 12 ARG CD . 10075 1
73 . 1 1 12 12 ARG N N 15 125.694 0.300 . 1 . . . . 12 ARG N . 10075 1
74 . 1 1 13 13 THR H H 1 8.269 0.030 . 1 . . . . 13 THR H . 10075 1
75 . 1 1 13 13 THR HA H 1 4.294 0.030 . 1 . . . . 13 THR HA . 10075 1
76 . 1 1 13 13 THR HB H 1 4.178 0.030 . 1 . . . . 13 THR HB . 10075 1
77 . 1 1 13 13 THR HG21 H 1 1.141 0.030 . 1 . . . . 13 THR HG2 . 10075 1
78 . 1 1 13 13 THR HG22 H 1 1.141 0.030 . 1 . . . . 13 THR HG2 . 10075 1
79 . 1 1 13 13 THR HG23 H 1 1.141 0.030 . 1 . . . . 13 THR HG2 . 10075 1
80 . 1 1 13 13 THR C C 13 174.197 0.300 . 1 . . . . 13 THR C . 10075 1
81 . 1 1 13 13 THR CA C 13 61.872 0.300 . 1 . . . . 13 THR CA . 10075 1
82 . 1 1 13 13 THR CB C 13 69.838 0.300 . 1 . . . . 13 THR CB . 10075 1
83 . 1 1 13 13 THR CG2 C 13 21.638 0.300 . 1 . . . . 13 THR CG2 . 10075 1
84 . 1 1 13 13 THR N N 15 115.664 0.300 . 1 . . . . 13 THR N . 10075 1
85 . 1 1 14 14 HIS H H 1 8.286 0.030 . 1 . . . . 14 HIS H . 10075 1
86 . 1 1 14 14 HIS HA H 1 4.620 0.030 . 1 . . . . 14 HIS HA . 10075 1
87 . 1 1 14 14 HIS HB2 H 1 3.122 0.030 . 2 . . . . 14 HIS HB2 . 10075 1
88 . 1 1 14 14 HIS HB3 H 1 3.052 0.030 . 2 . . . . 14 HIS HB3 . 10075 1
89 . 1 1 14 14 HIS HD2 H 1 7.000 0.030 . 1 . . . . 14 HIS HD2 . 10075 1
90 . 1 1 14 14 HIS C C 13 175.010 0.300 . 1 . . . . 14 HIS C . 10075 1
91 . 1 1 14 14 HIS CA C 13 56.351 0.300 . 1 . . . . 14 HIS CA . 10075 1
92 . 1 1 14 14 HIS CB C 13 30.926 0.300 . 1 . . . . 14 HIS CB . 10075 1
93 . 1 1 14 14 HIS CD2 C 13 120.064 0.300 . 1 . . . . 14 HIS CD2 . 10075 1
94 . 1 1 14 14 HIS N N 15 121.055 0.300 . 1 . . . . 14 HIS N . 10075 1
95 . 1 1 15 15 GLU H H 1 8.282 0.030 . 1 . . . . 15 GLU H . 10075 1
96 . 1 1 15 15 GLU HA H 1 4.350 0.030 . 1 . . . . 15 GLU HA . 10075 1
97 . 1 1 15 15 GLU HB2 H 1 2.054 0.030 . 2 . . . . 15 GLU HB2 . 10075 1
98 . 1 1 15 15 GLU HB3 H 1 1.845 0.030 . 2 . . . . 15 GLU HB3 . 10075 1
99 . 1 1 15 15 GLU HG2 H 1 2.243 0.030 . 2 . . . . 15 GLU HG2 . 10075 1
100 . 1 1 15 15 GLU HG3 H 1 2.190 0.030 . 2 . . . . 15 GLU HG3 . 10075 1
101 . 1 1 15 15 GLU C C 13 175.573 0.300 . 1 . . . . 15 GLU C . 10075 1
102 . 1 1 15 15 GLU CA C 13 56.415 0.300 . 1 . . . . 15 GLU CA . 10075 1
103 . 1 1 15 15 GLU CB C 13 31.059 0.300 . 1 . . . . 15 GLU CB . 10075 1
104 . 1 1 15 15 GLU CG C 13 36.699 0.300 . 1 . . . . 15 GLU CG . 10075 1
105 . 1 1 15 15 GLU N N 15 121.513 0.300 . 1 . . . . 15 GLU N . 10075 1
106 . 1 1 16 16 ASP H H 1 8.624 0.030 . 1 . . . . 16 ASP H . 10075 1
107 . 1 1 16 16 ASP HA H 1 4.728 0.030 . 1 . . . . 16 ASP HA . 10075 1
108 . 1 1 16 16 ASP HB2 H 1 2.684 0.030 . 2 . . . . 16 ASP HB2 . 10075 1
109 . 1 1 16 16 ASP HB3 H 1 2.594 0.030 . 2 . . . . 16 ASP HB3 . 10075 1
110 . 1 1 16 16 ASP C C 13 175.192 0.300 . 1 . . . . 16 ASP C . 10075 1
111 . 1 1 16 16 ASP CA C 13 53.727 0.300 . 1 . . . . 16 ASP CA . 10075 1
112 . 1 1 16 16 ASP CB C 13 42.174 0.300 . 1 . . . . 16 ASP CB . 10075 1
113 . 1 1 16 16 ASP N N 15 120.827 0.300 . 1 . . . . 16 ASP N . 10075 1
114 . 1 1 17 17 VAL H H 1 8.002 0.030 . 1 . . . . 17 VAL H . 10075 1
115 . 1 1 17 17 VAL HA H 1 4.581 0.030 . 1 . . . . 17 VAL HA . 10075 1
116 . 1 1 17 17 VAL HB H 1 1.893 0.030 . 1 . . . . 17 VAL HB . 10075 1
117 . 1 1 17 17 VAL HG11 H 1 0.658 0.030 . 1 . . . . 17 VAL HG1 . 10075 1
118 . 1 1 17 17 VAL HG12 H 1 0.658 0.030 . 1 . . . . 17 VAL HG1 . 10075 1
119 . 1 1 17 17 VAL HG13 H 1 0.658 0.030 . 1 . . . . 17 VAL HG1 . 10075 1
120 . 1 1 17 17 VAL HG21 H 1 0.847 0.030 . 1 . . . . 17 VAL HG2 . 10075 1
121 . 1 1 17 17 VAL HG22 H 1 0.847 0.030 . 1 . . . . 17 VAL HG2 . 10075 1
122 . 1 1 17 17 VAL HG23 H 1 0.847 0.030 . 1 . . . . 17 VAL HG2 . 10075 1
123 . 1 1 17 17 VAL C C 13 174.024 0.300 . 1 . . . . 17 VAL C . 10075 1
124 . 1 1 17 17 VAL CA C 13 58.891 0.300 . 1 . . . . 17 VAL CA . 10075 1
125 . 1 1 17 17 VAL CB C 13 32.109 0.300 . 1 . . . . 17 VAL CB . 10075 1
126 . 1 1 17 17 VAL CG1 C 13 21.653 0.300 . 2 . . . . 17 VAL CG1 . 10075 1
127 . 1 1 17 17 VAL CG2 C 13 18.087 0.300 . 2 . . . . 17 VAL CG2 . 10075 1
128 . 1 1 17 17 VAL N N 15 113.973 0.300 . 1 . . . . 17 VAL N . 10075 1
129 . 1 1 18 18 PRO HA H 1 4.427 0.030 . 1 . . . . 18 PRO HA . 10075 1
130 . 1 1 18 18 PRO HB2 H 1 2.379 0.030 . 2 . . . . 18 PRO HB2 . 10075 1
131 . 1 1 18 18 PRO HB3 H 1 2.116 0.030 . 2 . . . . 18 PRO HB3 . 10075 1
132 . 1 1 18 18 PRO HG2 H 1 2.037 0.030 . 2 . . . . 18 PRO HG2 . 10075 1
133 . 1 1 18 18 PRO HG3 H 1 1.625 0.030 . 2 . . . . 18 PRO HG3 . 10075 1
134 . 1 1 18 18 PRO HD2 H 1 3.872 0.030 . 2 . . . . 18 PRO HD2 . 10075 1
135 . 1 1 18 18 PRO HD3 H 1 3.360 0.030 . 2 . . . . 18 PRO HD3 . 10075 1
136 . 1 1 18 18 PRO C C 13 177.055 0.300 . 1 . . . . 18 PRO C . 10075 1
137 . 1 1 18 18 PRO CA C 13 63.655 0.300 . 1 . . . . 18 PRO CA . 10075 1
138 . 1 1 18 18 PRO CB C 13 33.427 0.300 . 1 . . . . 18 PRO CB . 10075 1
139 . 1 1 18 18 PRO CG C 13 27.543 0.300 . 1 . . . . 18 PRO CG . 10075 1
140 . 1 1 18 18 PRO CD C 13 50.385 0.300 . 1 . . . . 18 PRO CD . 10075 1
141 . 1 1 19 19 GLY H H 1 8.647 0.030 . 1 . . . . 19 GLY H . 10075 1
142 . 1 1 19 19 GLY HA2 H 1 4.265 0.030 . 2 . . . . 19 GLY HA2 . 10075 1
143 . 1 1 19 19 GLY HA3 H 1 4.087 0.030 . 2 . . . . 19 GLY HA3 . 10075 1
144 . 1 1 19 19 GLY CA C 13 44.818 0.300 . 1 . . . . 19 GLY CA . 10075 1
145 . 1 1 19 19 GLY N N 15 106.192 0.300 . 1 . . . . 19 GLY N . 10075 1
146 . 1 1 20 20 PRO HA H 1 4.549 0.030 . 1 . . . . 20 PRO HA . 10075 1
147 . 1 1 20 20 PRO HB2 H 1 2.053 0.030 . 2 . . . . 20 PRO HB2 . 10075 1
148 . 1 1 20 20 PRO HB3 H 1 1.959 0.030 . 2 . . . . 20 PRO HB3 . 10075 1
149 . 1 1 20 20 PRO HG2 H 1 2.028 0.030 . 1 . . . . 20 PRO HG2 . 10075 1
150 . 1 1 20 20 PRO HG3 H 1 2.028 0.030 . 1 . . . . 20 PRO HG3 . 10075 1
151 . 1 1 20 20 PRO HD2 H 1 3.722 0.030 . 2 . . . . 20 PRO HD2 . 10075 1
152 . 1 1 20 20 PRO HD3 H 1 3.455 0.030 . 2 . . . . 20 PRO HD3 . 10075 1
153 . 1 1 20 20 PRO C C 13 178.544 0.300 . 1 . . . . 20 PRO C . 10075 1
154 . 1 1 20 20 PRO CA C 13 62.273 0.300 . 1 . . . . 20 PRO CA . 10075 1
155 . 1 1 20 20 PRO CB C 13 32.209 0.300 . 1 . . . . 20 PRO CB . 10075 1
156 . 1 1 20 20 PRO CG C 13 27.112 0.300 . 1 . . . . 20 PRO CG . 10075 1
157 . 1 1 20 20 PRO CD C 13 49.065 0.300 . 1 . . . . 20 PRO CD . 10075 1
158 . 1 1 21 21 VAL H H 1 8.712 0.030 . 1 . . . . 21 VAL H . 10075 1
159 . 1 1 21 21 VAL HA H 1 4.081 0.030 . 1 . . . . 21 VAL HA . 10075 1
160 . 1 1 21 21 VAL HB H 1 2.951 0.030 . 1 . . . . 21 VAL HB . 10075 1
161 . 1 1 21 21 VAL HG11 H 1 1.040 0.030 . 1 . . . . 21 VAL HG1 . 10075 1
162 . 1 1 21 21 VAL HG12 H 1 1.040 0.030 . 1 . . . . 21 VAL HG1 . 10075 1
163 . 1 1 21 21 VAL HG13 H 1 1.040 0.030 . 1 . . . . 21 VAL HG1 . 10075 1
164 . 1 1 21 21 VAL HG21 H 1 0.654 0.030 . 1 . . . . 21 VAL HG2 . 10075 1
165 . 1 1 21 21 VAL HG22 H 1 0.654 0.030 . 1 . . . . 21 VAL HG2 . 10075 1
166 . 1 1 21 21 VAL HG23 H 1 0.654 0.030 . 1 . . . . 21 VAL HG2 . 10075 1
167 . 1 1 21 21 VAL C C 13 176.017 0.300 . 1 . . . . 21 VAL C . 10075 1
168 . 1 1 21 21 VAL CA C 13 62.291 0.300 . 1 . . . . 21 VAL CA . 10075 1
169 . 1 1 21 21 VAL CB C 13 31.161 0.300 . 1 . . . . 21 VAL CB . 10075 1
170 . 1 1 21 21 VAL CG1 C 13 22.609 0.300 . 2 . . . . 21 VAL CG1 . 10075 1
171 . 1 1 21 21 VAL CG2 C 13 17.582 0.300 . 2 . . . . 21 VAL CG2 . 10075 1
172 . 1 1 21 21 VAL N N 15 113.303 0.300 . 1 . . . . 21 VAL N . 10075 1
173 . 1 1 22 22 GLY H H 1 7.906 0.030 . 1 . . . . 22 GLY H . 10075 1
174 . 1 1 22 22 GLY HA2 H 1 4.049 0.030 . 2 . . . . 22 GLY HA2 . 10075 1
175 . 1 1 22 22 GLY HA3 H 1 3.927 0.030 . 2 . . . . 22 GLY HA3 . 10075 1
176 . 1 1 22 22 GLY C C 13 173.110 0.300 . 1 . . . . 22 GLY C . 10075 1
177 . 1 1 22 22 GLY CA C 13 44.683 0.300 . 1 . . . . 22 GLY CA . 10075 1
178 . 1 1 22 22 GLY N N 15 108.218 0.300 . 1 . . . . 22 GLY N . 10075 1
179 . 1 1 23 23 HIS H H 1 8.432 0.030 . 1 . . . . 23 HIS H . 10075 1
180 . 1 1 23 23 HIS HA H 1 4.200 0.030 . 1 . . . . 23 HIS HA . 10075 1
181 . 1 1 23 23 HIS HB2 H 1 3.067 0.030 . 2 . . . . 23 HIS HB2 . 10075 1
182 . 1 1 23 23 HIS HB3 H 1 2.875 0.030 . 2 . . . . 23 HIS HB3 . 10075 1
183 . 1 1 23 23 HIS HD2 H 1 6.933 0.030 . 1 . . . . 23 HIS HD2 . 10075 1
184 . 1 1 23 23 HIS C C 13 175.002 0.300 . 1 . . . . 23 HIS C . 10075 1
185 . 1 1 23 23 HIS CA C 13 56.745 0.300 . 1 . . . . 23 HIS CA . 10075 1
186 . 1 1 23 23 HIS CB C 13 29.885 0.300 . 1 . . . . 23 HIS CB . 10075 1
187 . 1 1 23 23 HIS CD2 C 13 119.966 0.300 . 1 . . . . 23 HIS CD2 . 10075 1
188 . 1 1 23 23 HIS N N 15 118.279 0.300 . 1 . . . . 23 HIS N . 10075 1
189 . 1 1 24 24 LEU H H 1 8.172 0.030 . 1 . . . . 24 LEU H . 10075 1
190 . 1 1 24 24 LEU HA H 1 4.651 0.030 . 1 . . . . 24 LEU HA . 10075 1
191 . 1 1 24 24 LEU HB2 H 1 1.299 0.030 . 2 . . . . 24 LEU HB2 . 10075 1
192 . 1 1 24 24 LEU HB3 H 1 1.250 0.030 . 2 . . . . 24 LEU HB3 . 10075 1
193 . 1 1 24 24 LEU HG H 1 1.415 0.030 . 1 . . . . 24 LEU HG . 10075 1
194 . 1 1 24 24 LEU HD11 H 1 0.764 0.030 . 1 . . . . 24 LEU HD1 . 10075 1
195 . 1 1 24 24 LEU HD12 H 1 0.764 0.030 . 1 . . . . 24 LEU HD1 . 10075 1
196 . 1 1 24 24 LEU HD13 H 1 0.764 0.030 . 1 . . . . 24 LEU HD1 . 10075 1
197 . 1 1 24 24 LEU HD21 H 1 0.685 0.030 . 1 . . . . 24 LEU HD2 . 10075 1
198 . 1 1 24 24 LEU HD22 H 1 0.685 0.030 . 1 . . . . 24 LEU HD2 . 10075 1
199 . 1 1 24 24 LEU HD23 H 1 0.685 0.030 . 1 . . . . 24 LEU HD2 . 10075 1
200 . 1 1 24 24 LEU C C 13 176.677 0.300 . 1 . . . . 24 LEU C . 10075 1
201 . 1 1 24 24 LEU CA C 13 55.498 0.300 . 1 . . . . 24 LEU CA . 10075 1
202 . 1 1 24 24 LEU CB C 13 42.347 0.300 . 1 . . . . 24 LEU CB . 10075 1
203 . 1 1 24 24 LEU CG C 13 26.936 0.300 . 1 . . . . 24 LEU CG . 10075 1
204 . 1 1 24 24 LEU CD1 C 13 25.241 0.300 . 2 . . . . 24 LEU CD1 . 10075 1
205 . 1 1 24 24 LEU CD2 C 13 24.611 0.300 . 2 . . . . 24 LEU CD2 . 10075 1
206 . 1 1 24 24 LEU N N 15 123.982 0.300 . 1 . . . . 24 LEU N . 10075 1
207 . 1 1 25 25 SER H H 1 8.838 0.030 . 1 . . . . 25 SER H . 10075 1
208 . 1 1 25 25 SER HA H 1 4.625 0.030 . 1 . . . . 25 SER HA . 10075 1
209 . 1 1 25 25 SER HB2 H 1 3.649 0.030 . 2 . . . . 25 SER HB2 . 10075 1
210 . 1 1 25 25 SER HB3 H 1 3.597 0.030 . 2 . . . . 25 SER HB3 . 10075 1
211 . 1 1 25 25 SER C C 13 172.077 0.300 . 1 . . . . 25 SER C . 10075 1
212 . 1 1 25 25 SER CA C 13 57.305 0.300 . 1 . . . . 25 SER CA . 10075 1
213 . 1 1 25 25 SER CB C 13 65.544 0.300 . 1 . . . . 25 SER CB . 10075 1
214 . 1 1 25 25 SER N N 15 120.340 0.300 . 1 . . . . 25 SER N . 10075 1
215 . 1 1 26 26 PHE H H 1 8.646 0.030 . 1 . . . . 26 PHE H . 10075 1
216 . 1 1 26 26 PHE HA H 1 5.812 0.030 . 1 . . . . 26 PHE HA . 10075 1
217 . 1 1 26 26 PHE HB2 H 1 2.967 0.030 . 2 . . . . 26 PHE HB2 . 10075 1
218 . 1 1 26 26 PHE HB3 H 1 2.915 0.030 . 2 . . . . 26 PHE HB3 . 10075 1
219 . 1 1 26 26 PHE HD1 H 1 7.273 0.030 . 1 . . . . 26 PHE HD1 . 10075 1
220 . 1 1 26 26 PHE HD2 H 1 7.273 0.030 . 1 . . . . 26 PHE HD2 . 10075 1
221 . 1 1 26 26 PHE HE1 H 1 7.190 0.030 . 1 . . . . 26 PHE HE1 . 10075 1
222 . 1 1 26 26 PHE HE2 H 1 7.190 0.030 . 1 . . . . 26 PHE HE2 . 10075 1
223 . 1 1 26 26 PHE HZ H 1 6.958 0.030 . 1 . . . . 26 PHE HZ . 10075 1
224 . 1 1 26 26 PHE C C 13 175.352 0.300 . 1 . . . . 26 PHE C . 10075 1
225 . 1 1 26 26 PHE CA C 13 55.956 0.300 . 1 . . . . 26 PHE CA . 10075 1
226 . 1 1 26 26 PHE CB C 13 42.272 0.300 . 1 . . . . 26 PHE CB . 10075 1
227 . 1 1 26 26 PHE CD1 C 13 132.162 0.300 . 1 . . . . 26 PHE CD1 . 10075 1
228 . 1 1 26 26 PHE CD2 C 13 132.162 0.300 . 1 . . . . 26 PHE CD2 . 10075 1
229 . 1 1 26 26 PHE CE1 C 13 130.790 0.300 . 1 . . . . 26 PHE CE1 . 10075 1
230 . 1 1 26 26 PHE CE2 C 13 130.790 0.300 . 1 . . . . 26 PHE CE2 . 10075 1
231 . 1 1 26 26 PHE CZ C 13 128.415 0.300 . 1 . . . . 26 PHE CZ . 10075 1
232 . 1 1 26 26 PHE N N 15 122.044 0.300 . 1 . . . . 26 PHE N . 10075 1
233 . 1 1 27 27 SER H H 1 9.395 0.030 . 1 . . . . 27 SER H . 10075 1
234 . 1 1 27 27 SER HA H 1 4.717 0.030 . 1 . . . . 27 SER HA . 10075 1
235 . 1 1 27 27 SER HB2 H 1 3.963 0.030 . 2 . . . . 27 SER HB2 . 10075 1
236 . 1 1 27 27 SER HB3 H 1 3.919 0.030 . 2 . . . . 27 SER HB3 . 10075 1
237 . 1 1 27 27 SER C C 13 171.358 0.300 . 1 . . . . 27 SER C . 10075 1
238 . 1 1 27 27 SER CA C 13 57.334 0.300 . 1 . . . . 27 SER CA . 10075 1
239 . 1 1 27 27 SER CB C 13 65.854 0.300 . 1 . . . . 27 SER CB . 10075 1
240 . 1 1 27 27 SER N N 15 116.552 0.300 . 1 . . . . 27 SER N . 10075 1
241 . 1 1 28 28 GLU H H 1 8.977 0.030 . 1 . . . . 28 GLU H . 10075 1
242 . 1 1 28 28 GLU HA H 1 3.746 0.030 . 1 . . . . 28 GLU HA . 10075 1
243 . 1 1 28 28 GLU HB2 H 1 1.966 0.030 . 2 . . . . 28 GLU HB2 . 10075 1
244 . 1 1 28 28 GLU HB3 H 1 1.908 0.030 . 2 . . . . 28 GLU HB3 . 10075 1
245 . 1 1 28 28 GLU HG2 H 1 2.173 0.030 . 1 . . . . 28 GLU HG2 . 10075 1
246 . 1 1 28 28 GLU HG3 H 1 2.173 0.030 . 1 . . . . 28 GLU HG3 . 10075 1
247 . 1 1 28 28 GLU C C 13 174.780 0.300 . 1 . . . . 28 GLU C . 10075 1
248 . 1 1 28 28 GLU CA C 13 56.481 0.300 . 1 . . . . 28 GLU CA . 10075 1
249 . 1 1 28 28 GLU CB C 13 27.179 0.300 . 1 . . . . 28 GLU CB . 10075 1
250 . 1 1 28 28 GLU CG C 13 36.323 0.300 . 1 . . . . 28 GLU CG . 10075 1
251 . 1 1 28 28 GLU N N 15 116.625 0.300 . 1 . . . . 28 GLU N . 10075 1
252 . 1 1 29 29 ILE H H 1 8.158 0.030 . 1 . . . . 29 ILE H . 10075 1
253 . 1 1 29 29 ILE HA H 1 3.826 0.030 . 1 . . . . 29 ILE HA . 10075 1
254 . 1 1 29 29 ILE HB H 1 1.837 0.030 . 1 . . . . 29 ILE HB . 10075 1
255 . 1 1 29 29 ILE HG12 H 1 1.467 0.030 . 2 . . . . 29 ILE HG12 . 10075 1
256 . 1 1 29 29 ILE HG13 H 1 0.932 0.030 . 2 . . . . 29 ILE HG13 . 10075 1
257 . 1 1 29 29 ILE HG21 H 1 0.940 0.030 . 1 . . . . 29 ILE HG2 . 10075 1
258 . 1 1 29 29 ILE HG22 H 1 0.940 0.030 . 1 . . . . 29 ILE HG2 . 10075 1
259 . 1 1 29 29 ILE HG23 H 1 0.940 0.030 . 1 . . . . 29 ILE HG2 . 10075 1
260 . 1 1 29 29 ILE HD11 H 1 0.890 0.030 . 1 . . . . 29 ILE HD1 . 10075 1
261 . 1 1 29 29 ILE HD12 H 1 0.890 0.030 . 1 . . . . 29 ILE HD1 . 10075 1
262 . 1 1 29 29 ILE HD13 H 1 0.890 0.030 . 1 . . . . 29 ILE HD1 . 10075 1
263 . 1 1 29 29 ILE C C 13 176.118 0.300 . 1 . . . . 29 ILE C . 10075 1
264 . 1 1 29 29 ILE CA C 13 63.635 0.300 . 1 . . . . 29 ILE CA . 10075 1
265 . 1 1 29 29 ILE CB C 13 37.288 0.300 . 1 . . . . 29 ILE CB . 10075 1
266 . 1 1 29 29 ILE CG1 C 13 27.996 0.300 . 1 . . . . 29 ILE CG1 . 10075 1
267 . 1 1 29 29 ILE CG2 C 13 18.184 0.300 . 1 . . . . 29 ILE CG2 . 10075 1
268 . 1 1 29 29 ILE CD1 C 13 14.207 0.300 . 1 . . . . 29 ILE CD1 . 10075 1
269 . 1 1 29 29 ILE N N 15 117.230 0.300 . 1 . . . . 29 ILE N . 10075 1
270 . 1 1 30 30 LEU H H 1 8.880 0.030 . 1 . . . . 30 LEU H . 10075 1
271 . 1 1 30 30 LEU HA H 1 4.921 0.030 . 1 . . . . 30 LEU HA . 10075 1
272 . 1 1 30 30 LEU HB2 H 1 1.914 0.030 . 2 . . . . 30 LEU HB2 . 10075 1
273 . 1 1 30 30 LEU HB3 H 1 1.708 0.030 . 2 . . . . 30 LEU HB3 . 10075 1
274 . 1 1 30 30 LEU HG H 1 1.538 0.030 . 1 . . . . 30 LEU HG . 10075 1
275 . 1 1 30 30 LEU HD11 H 1 0.842 0.030 . 1 . . . . 30 LEU HD1 . 10075 1
276 . 1 1 30 30 LEU HD12 H 1 0.842 0.030 . 1 . . . . 30 LEU HD1 . 10075 1
277 . 1 1 30 30 LEU HD13 H 1 0.842 0.030 . 1 . . . . 30 LEU HD1 . 10075 1
278 . 1 1 30 30 LEU HD21 H 1 0.887 0.030 . 1 . . . . 30 LEU HD2 . 10075 1
279 . 1 1 30 30 LEU HD22 H 1 0.887 0.030 . 1 . . . . 30 LEU HD2 . 10075 1
280 . 1 1 30 30 LEU HD23 H 1 0.887 0.030 . 1 . . . . 30 LEU HD2 . 10075 1
281 . 1 1 30 30 LEU C C 13 175.623 0.300 . 1 . . . . 30 LEU C . 10075 1
282 . 1 1 30 30 LEU CA C 13 53.151 0.300 . 1 . . . . 30 LEU CA . 10075 1
283 . 1 1 30 30 LEU CB C 13 43.504 0.300 . 1 . . . . 30 LEU CB . 10075 1
284 . 1 1 30 30 LEU CG C 13 27.165 0.300 . 1 . . . . 30 LEU CG . 10075 1
285 . 1 1 30 30 LEU CD1 C 13 25.528 0.300 . 2 . . . . 30 LEU CD1 . 10075 1
286 . 1 1 30 30 LEU CD2 C 13 22.684 0.300 . 2 . . . . 30 LEU CD2 . 10075 1
287 . 1 1 30 30 LEU N N 15 133.364 0.300 . 1 . . . . 30 LEU N . 10075 1
288 . 1 1 31 31 ASP H H 1 9.253 0.030 . 1 . . . . 31 ASP H . 10075 1
289 . 1 1 31 31 ASP HA H 1 4.198 0.030 . 1 . . . . 31 ASP HA . 10075 1
290 . 1 1 31 31 ASP HB2 H 1 2.518 0.030 . 2 . . . . 31 ASP HB2 . 10075 1
291 . 1 1 31 31 ASP HB3 H 1 2.313 0.030 . 2 . . . . 31 ASP HB3 . 10075 1
292 . 1 1 31 31 ASP C C 13 176.114 0.300 . 1 . . . . 31 ASP C . 10075 1
293 . 1 1 31 31 ASP CA C 13 56.376 0.300 . 1 . . . . 31 ASP CA . 10075 1
294 . 1 1 31 31 ASP CB C 13 39.371 0.300 . 1 . . . . 31 ASP CB . 10075 1
295 . 1 1 31 31 ASP N N 15 117.211 0.300 . 1 . . . . 31 ASP N . 10075 1
296 . 1 1 32 32 THR H H 1 7.037 0.030 . 1 . . . . 32 THR H . 10075 1
297 . 1 1 32 32 THR HA H 1 4.475 0.030 . 1 . . . . 32 THR HA . 10075 1
298 . 1 1 32 32 THR HB H 1 4.602 0.030 . 1 . . . . 32 THR HB . 10075 1
299 . 1 1 32 32 THR HG21 H 1 1.118 0.030 . 1 . . . . 32 THR HG2 . 10075 1
300 . 1 1 32 32 THR HG22 H 1 1.118 0.030 . 1 . . . . 32 THR HG2 . 10075 1
301 . 1 1 32 32 THR HG23 H 1 1.118 0.030 . 1 . . . . 32 THR HG2 . 10075 1
302 . 1 1 32 32 THR C C 13 174.591 0.300 . 1 . . . . 32 THR C . 10075 1
303 . 1 1 32 32 THR CA C 13 59.492 0.300 . 1 . . . . 32 THR CA . 10075 1
304 . 1 1 32 32 THR CB C 13 70.828 0.300 . 1 . . . . 32 THR CB . 10075 1
305 . 1 1 32 32 THR CG2 C 13 20.668 0.300 . 1 . . . . 32 THR CG2 . 10075 1
306 . 1 1 32 32 THR N N 15 98.709 0.300 . 1 . . . . 32 THR N . 10075 1
307 . 1 1 33 33 SER H H 1 7.218 0.030 . 1 . . . . 33 SER H . 10075 1
308 . 1 1 33 33 SER HA H 1 5.072 0.030 . 1 . . . . 33 SER HA . 10075 1
309 . 1 1 33 33 SER HB2 H 1 3.827 0.030 . 2 . . . . 33 SER HB2 . 10075 1
310 . 1 1 33 33 SER HB3 H 1 3.717 0.030 . 2 . . . . 33 SER HB3 . 10075 1
311 . 1 1 33 33 SER C C 13 170.686 0.300 . 1 . . . . 33 SER C . 10075 1
312 . 1 1 33 33 SER CA C 13 56.622 0.300 . 1 . . . . 33 SER CA . 10075 1
313 . 1 1 33 33 SER CB C 13 66.808 0.300 . 1 . . . . 33 SER CB . 10075 1
314 . 1 1 33 33 SER N N 15 113.926 0.300 . 1 . . . . 33 SER N . 10075 1
315 . 1 1 34 34 LEU H H 1 8.309 0.030 . 1 . . . . 34 LEU H . 10075 1
316 . 1 1 34 34 LEU HA H 1 4.882 0.030 . 1 . . . . 34 LEU HA . 10075 1
317 . 1 1 34 34 LEU HB2 H 1 2.148 0.030 . 2 . . . . 34 LEU HB2 . 10075 1
318 . 1 1 34 34 LEU HB3 H 1 1.386 0.030 . 2 . . . . 34 LEU HB3 . 10075 1
319 . 1 1 34 34 LEU HG H 1 1.309 0.030 . 1 . . . . 34 LEU HG . 10075 1
320 . 1 1 34 34 LEU HD11 H 1 0.363 0.030 . 1 . . . . 34 LEU HD1 . 10075 1
321 . 1 1 34 34 LEU HD12 H 1 0.363 0.030 . 1 . . . . 34 LEU HD1 . 10075 1
322 . 1 1 34 34 LEU HD13 H 1 0.363 0.030 . 1 . . . . 34 LEU HD1 . 10075 1
323 . 1 1 34 34 LEU HD21 H 1 0.634 0.030 . 1 . . . . 34 LEU HD2 . 10075 1
324 . 1 1 34 34 LEU HD22 H 1 0.634 0.030 . 1 . . . . 34 LEU HD2 . 10075 1
325 . 1 1 34 34 LEU HD23 H 1 0.634 0.030 . 1 . . . . 34 LEU HD2 . 10075 1
326 . 1 1 34 34 LEU C C 13 173.437 0.300 . 1 . . . . 34 LEU C . 10075 1
327 . 1 1 34 34 LEU CA C 13 54.922 0.300 . 1 . . . . 34 LEU CA . 10075 1
328 . 1 1 34 34 LEU CB C 13 44.632 0.300 . 1 . . . . 34 LEU CB . 10075 1
329 . 1 1 34 34 LEU CG C 13 25.210 0.300 . 1 . . . . 34 LEU CG . 10075 1
330 . 1 1 34 34 LEU CD1 C 13 27.968 0.300 . 2 . . . . 34 LEU CD1 . 10075 1
331 . 1 1 34 34 LEU CD2 C 13 26.024 0.300 . 2 . . . . 34 LEU CD2 . 10075 1
332 . 1 1 34 34 LEU N N 15 112.562 0.300 . 1 . . . . 34 LEU N . 10075 1
333 . 1 1 35 35 LYS H H 1 8.798 0.030 . 1 . . . . 35 LYS H . 10075 1
334 . 1 1 35 35 LYS HA H 1 4.911 0.030 . 1 . . . . 35 LYS HA . 10075 1
335 . 1 1 35 35 LYS HB2 H 1 1.793 0.030 . 2 . . . . 35 LYS HB2 . 10075 1
336 . 1 1 35 35 LYS HB3 H 1 1.305 0.030 . 2 . . . . 35 LYS HB3 . 10075 1
337 . 1 1 35 35 LYS HG2 H 1 1.032 0.030 . 2 . . . . 35 LYS HG2 . 10075 1
338 . 1 1 35 35 LYS HG3 H 1 0.974 0.030 . 2 . . . . 35 LYS HG3 . 10075 1
339 . 1 1 35 35 LYS HD2 H 1 1.347 0.030 . 2 . . . . 35 LYS HD2 . 10075 1
340 . 1 1 35 35 LYS HD3 H 1 1.315 0.030 . 2 . . . . 35 LYS HD3 . 10075 1
341 . 1 1 35 35 LYS HE2 H 1 2.537 0.030 . 1 . . . . 35 LYS HE2 . 10075 1
342 . 1 1 35 35 LYS HE3 H 1 2.537 0.030 . 1 . . . . 35 LYS HE3 . 10075 1
343 . 1 1 35 35 LYS C C 13 174.100 0.300 . 1 . . . . 35 LYS C . 10075 1
344 . 1 1 35 35 LYS CA C 13 55.742 0.300 . 1 . . . . 35 LYS CA . 10075 1
345 . 1 1 35 35 LYS CB C 13 34.367 0.300 . 1 . . . . 35 LYS CB . 10075 1
346 . 1 1 35 35 LYS CG C 13 25.706 0.300 . 1 . . . . 35 LYS CG . 10075 1
347 . 1 1 35 35 LYS CD C 13 29.127 0.300 . 1 . . . . 35 LYS CD . 10075 1
348 . 1 1 35 35 LYS CE C 13 41.935 0.300 . 1 . . . . 35 LYS CE . 10075 1
349 . 1 1 35 35 LYS N N 15 121.677 0.300 . 1 . . . . 35 LYS N . 10075 1
350 . 1 1 36 36 VAL H H 1 8.916 0.030 . 1 . . . . 36 VAL H . 10075 1
351 . 1 1 36 36 VAL HA H 1 4.917 0.030 . 1 . . . . 36 VAL HA . 10075 1
352 . 1 1 36 36 VAL HB H 1 2.153 0.030 . 1 . . . . 36 VAL HB . 10075 1
353 . 1 1 36 36 VAL HG11 H 1 1.048 0.030 . 1 . . . . 36 VAL HG1 . 10075 1
354 . 1 1 36 36 VAL HG12 H 1 1.048 0.030 . 1 . . . . 36 VAL HG1 . 10075 1
355 . 1 1 36 36 VAL HG13 H 1 1.048 0.030 . 1 . . . . 36 VAL HG1 . 10075 1
356 . 1 1 36 36 VAL HG21 H 1 1.129 0.030 . 1 . . . . 36 VAL HG2 . 10075 1
357 . 1 1 36 36 VAL HG22 H 1 1.129 0.030 . 1 . . . . 36 VAL HG2 . 10075 1
358 . 1 1 36 36 VAL HG23 H 1 1.129 0.030 . 1 . . . . 36 VAL HG2 . 10075 1
359 . 1 1 36 36 VAL C C 13 173.922 0.300 . 1 . . . . 36 VAL C . 10075 1
360 . 1 1 36 36 VAL CA C 13 59.879 0.300 . 1 . . . . 36 VAL CA . 10075 1
361 . 1 1 36 36 VAL CB C 13 34.525 0.300 . 1 . . . . 36 VAL CB . 10075 1
362 . 1 1 36 36 VAL CG1 C 13 23.252 0.300 . 2 . . . . 36 VAL CG1 . 10075 1
363 . 1 1 36 36 VAL CG2 C 13 21.865 0.300 . 2 . . . . 36 VAL CG2 . 10075 1
364 . 1 1 36 36 VAL N N 15 128.169 0.300 . 1 . . . . 36 VAL N . 10075 1
365 . 1 1 37 37 SER H H 1 8.861 0.030 . 1 . . . . 37 SER H . 10075 1
366 . 1 1 37 37 SER HA H 1 4.955 0.030 . 1 . . . . 37 SER HA . 10075 1
367 . 1 1 37 37 SER HB2 H 1 3.626 0.030 . 1 . . . . 37 SER HB2 . 10075 1
368 . 1 1 37 37 SER HB3 H 1 3.626 0.030 . 1 . . . . 37 SER HB3 . 10075 1
369 . 1 1 37 37 SER C C 13 172.188 0.300 . 1 . . . . 37 SER C . 10075 1
370 . 1 1 37 37 SER CA C 13 57.645 0.300 . 1 . . . . 37 SER CA . 10075 1
371 . 1 1 37 37 SER CB C 13 66.056 0.300 . 1 . . . . 37 SER CB . 10075 1
372 . 1 1 37 37 SER N N 15 119.890 0.300 . 1 . . . . 37 SER N . 10075 1
373 . 1 1 38 38 TRP H H 1 7.892 0.030 . 1 . . . . 38 TRP H . 10075 1
374 . 1 1 38 38 TRP HA H 1 4.935 0.030 . 1 . . . . 38 TRP HA . 10075 1
375 . 1 1 38 38 TRP HB2 H 1 3.285 0.030 . 2 . . . . 38 TRP HB2 . 10075 1
376 . 1 1 38 38 TRP HB3 H 1 2.982 0.030 . 2 . . . . 38 TRP HB3 . 10075 1
377 . 1 1 38 38 TRP HD1 H 1 6.525 0.030 . 1 . . . . 38 TRP HD1 . 10075 1
378 . 1 1 38 38 TRP HE1 H 1 6.204 0.030 . 1 . . . . 38 TRP HE1 . 10075 1
379 . 1 1 38 38 TRP HE3 H 1 6.832 0.030 . 1 . . . . 38 TRP HE3 . 10075 1
380 . 1 1 38 38 TRP HZ2 H 1 6.662 0.030 . 1 . . . . 38 TRP HZ2 . 10075 1
381 . 1 1 38 38 TRP HZ3 H 1 6.509 0.030 . 1 . . . . 38 TRP HZ3 . 10075 1
382 . 1 1 38 38 TRP HH2 H 1 6.407 0.030 . 1 . . . . 38 TRP HH2 . 10075 1
383 . 1 1 38 38 TRP C C 13 172.620 0.300 . 1 . . . . 38 TRP C . 10075 1
384 . 1 1 38 38 TRP CA C 13 56.635 0.300 . 1 . . . . 38 TRP CA . 10075 1
385 . 1 1 38 38 TRP CB C 13 30.145 0.300 . 1 . . . . 38 TRP CB . 10075 1
386 . 1 1 38 38 TRP CD1 C 13 125.597 0.300 . 1 . . . . 38 TRP CD1 . 10075 1
387 . 1 1 38 38 TRP CE3 C 13 119.962 0.300 . 1 . . . . 38 TRP CE3 . 10075 1
388 . 1 1 38 38 TRP CZ2 C 13 114.022 0.300 . 1 . . . . 38 TRP CZ2 . 10075 1
389 . 1 1 38 38 TRP CZ3 C 13 120.834 0.300 . 1 . . . . 38 TRP CZ3 . 10075 1
390 . 1 1 38 38 TRP CH2 C 13 122.604 0.300 . 1 . . . . 38 TRP CH2 . 10075 1
391 . 1 1 38 38 TRP N N 15 119.188 0.300 . 1 . . . . 38 TRP N . 10075 1
392 . 1 1 38 38 TRP NE1 N 15 125.735 0.300 . 1 . . . . 38 TRP NE1 . 10075 1
393 . 1 1 39 39 GLN H H 1 8.404 0.030 . 1 . . . . 39 GLN H . 10075 1
394 . 1 1 39 39 GLN HA H 1 4.662 0.030 . 1 . . . . 39 GLN HA . 10075 1
395 . 1 1 39 39 GLN HB2 H 1 2.173 0.030 . 2 . . . . 39 GLN HB2 . 10075 1
396 . 1 1 39 39 GLN HB3 H 1 1.768 0.030 . 2 . . . . 39 GLN HB3 . 10075 1
397 . 1 1 39 39 GLN HG2 H 1 2.365 0.030 . 1 . . . . 39 GLN HG2 . 10075 1
398 . 1 1 39 39 GLN HG3 H 1 2.365 0.030 . 1 . . . . 39 GLN HG3 . 10075 1
399 . 1 1 39 39 GLN HE21 H 1 7.567 0.030 . 2 . . . . 39 GLN HE21 . 10075 1
400 . 1 1 39 39 GLN HE22 H 1 6.799 0.030 . 2 . . . . 39 GLN HE22 . 10075 1
401 . 1 1 39 39 GLN C C 13 175.464 0.300 . 1 . . . . 39 GLN C . 10075 1
402 . 1 1 39 39 GLN CA C 13 53.476 0.300 . 1 . . . . 39 GLN CA . 10075 1
403 . 1 1 39 39 GLN CB C 13 31.910 0.300 . 1 . . . . 39 GLN CB . 10075 1
404 . 1 1 39 39 GLN CG C 13 34.057 0.300 . 1 . . . . 39 GLN CG . 10075 1
405 . 1 1 39 39 GLN N N 15 114.968 0.300 . 1 . . . . 39 GLN N . 10075 1
406 . 1 1 39 39 GLN NE2 N 15 112.342 0.300 . 1 . . . . 39 GLN NE2 . 10075 1
407 . 1 1 40 40 GLU H H 1 8.582 0.030 . 1 . . . . 40 GLU H . 10075 1
408 . 1 1 40 40 GLU HA H 1 4.772 0.030 . 1 . . . . 40 GLU HA . 10075 1
409 . 1 1 40 40 GLU HB2 H 1 2.068 0.030 . 2 . . . . 40 GLU HB2 . 10075 1
410 . 1 1 40 40 GLU HB3 H 1 1.973 0.030 . 2 . . . . 40 GLU HB3 . 10075 1
411 . 1 1 40 40 GLU HG2 H 1 2.410 0.030 . 1 . . . . 40 GLU HG2 . 10075 1
412 . 1 1 40 40 GLU HG3 H 1 2.410 0.030 . 1 . . . . 40 GLU HG3 . 10075 1
413 . 1 1 40 40 GLU C C 13 175.090 0.300 . 1 . . . . 40 GLU C . 10075 1
414 . 1 1 40 40 GLU CA C 13 55.011 0.300 . 1 . . . . 40 GLU CA . 10075 1
415 . 1 1 40 40 GLU CB C 13 29.997 0.300 . 1 . . . . 40 GLU CB . 10075 1
416 . 1 1 40 40 GLU CG C 13 36.535 0.300 . 1 . . . . 40 GLU CG . 10075 1
417 . 1 1 40 40 GLU N N 15 121.337 0.300 . 1 . . . . 40 GLU N . 10075 1
418 . 1 1 41 41 PRO HA H 1 4.402 0.030 . 1 . . . . 41 PRO HA . 10075 1
419 . 1 1 41 41 PRO HB2 H 1 2.090 0.030 . 2 . . . . 41 PRO HB2 . 10075 1
420 . 1 1 41 41 PRO HB3 H 1 1.611 0.030 . 2 . . . . 41 PRO HB3 . 10075 1
421 . 1 1 41 41 PRO HG2 H 1 1.948 0.030 . 2 . . . . 41 PRO HG2 . 10075 1
422 . 1 1 41 41 PRO HG3 H 1 1.850 0.030 . 2 . . . . 41 PRO HG3 . 10075 1
423 . 1 1 41 41 PRO HD2 H 1 4.180 0.030 . 2 . . . . 41 PRO HD2 . 10075 1
424 . 1 1 41 41 PRO HD3 H 1 3.843 0.030 . 2 . . . . 41 PRO HD3 . 10075 1
425 . 1 1 41 41 PRO C C 13 176.636 0.300 . 1 . . . . 41 PRO C . 10075 1
426 . 1 1 41 41 PRO CA C 13 63.186 0.300 . 1 . . . . 41 PRO CA . 10075 1
427 . 1 1 41 41 PRO CB C 13 32.411 0.300 . 1 . . . . 41 PRO CB . 10075 1
428 . 1 1 41 41 PRO CG C 13 28.338 0.300 . 1 . . . . 41 PRO CG . 10075 1
429 . 1 1 41 41 PRO CD C 13 51.078 0.300 . 1 . . . . 41 PRO CD . 10075 1
430 . 1 1 42 42 GLY H H 1 8.459 0.030 . 1 . . . . 42 GLY H . 10075 1
431 . 1 1 42 42 GLY HA2 H 1 3.941 0.030 . 2 . . . . 42 GLY HA2 . 10075 1
432 . 1 1 42 42 GLY HA3 H 1 3.863 0.030 . 2 . . . . 42 GLY HA3 . 10075 1
433 . 1 1 42 42 GLY C C 13 174.722 0.300 . 1 . . . . 42 GLY C . 10075 1
434 . 1 1 42 42 GLY CA C 13 46.267 0.300 . 1 . . . . 42 GLY CA . 10075 1
435 . 1 1 42 42 GLY N N 15 111.036 0.300 . 1 . . . . 42 GLY N . 10075 1
436 . 1 1 43 43 GLU H H 1 8.071 0.030 . 1 . . . . 43 GLU H . 10075 1
437 . 1 1 43 43 GLU HA H 1 4.540 0.030 . 1 . . . . 43 GLU HA . 10075 1
438 . 1 1 43 43 GLU HB2 H 1 1.970 0.030 . 2 . . . . 43 GLU HB2 . 10075 1
439 . 1 1 43 43 GLU HB3 H 1 1.936 0.030 . 2 . . . . 43 GLU HB3 . 10075 1
440 . 1 1 43 43 GLU HG2 H 1 2.200 0.030 . 1 . . . . 43 GLU HG2 . 10075 1
441 . 1 1 43 43 GLU HG3 H 1 2.200 0.030 . 1 . . . . 43 GLU HG3 . 10075 1
442 . 1 1 43 43 GLU C C 13 174.707 0.300 . 1 . . . . 43 GLU C . 10075 1
443 . 1 1 43 43 GLU CA C 13 54.761 0.300 . 1 . . . . 43 GLU CA . 10075 1
444 . 1 1 43 43 GLU CB C 13 29.740 0.300 . 1 . . . . 43 GLU CB . 10075 1
445 . 1 1 43 43 GLU CG C 13 35.949 0.300 . 1 . . . . 43 GLU CG . 10075 1
446 . 1 1 43 43 GLU N N 15 120.680 0.300 . 1 . . . . 43 GLU N . 10075 1
447 . 1 1 44 44 LYS H H 1 8.403 0.030 . 1 . . . . 44 LYS H . 10075 1
448 . 1 1 44 44 LYS HA H 1 3.912 0.030 . 1 . . . . 44 LYS HA . 10075 1
449 . 1 1 44 44 LYS HB2 H 1 2.016 0.030 . 2 . . . . 44 LYS HB2 . 10075 1
450 . 1 1 44 44 LYS HB3 H 1 1.782 0.030 . 2 . . . . 44 LYS HB3 . 10075 1
451 . 1 1 44 44 LYS HG2 H 1 1.545 0.030 . 2 . . . . 44 LYS HG2 . 10075 1
452 . 1 1 44 44 LYS HG3 H 1 1.261 0.030 . 2 . . . . 44 LYS HG3 . 10075 1
453 . 1 1 44 44 LYS HD2 H 1 1.836 0.030 . 2 . . . . 44 LYS HD2 . 10075 1
454 . 1 1 44 44 LYS HD3 H 1 1.741 0.030 . 2 . . . . 44 LYS HD3 . 10075 1
455 . 1 1 44 44 LYS HE2 H 1 3.065 0.030 . 2 . . . . 44 LYS HE2 . 10075 1
456 . 1 1 44 44 LYS HE3 H 1 3.026 0.030 . 2 . . . . 44 LYS HE3 . 10075 1
457 . 1 1 44 44 LYS C C 13 174.774 0.300 . 1 . . . . 44 LYS C . 10075 1
458 . 1 1 44 44 LYS CA C 13 59.216 0.300 . 1 . . . . 44 LYS CA . 10075 1
459 . 1 1 44 44 LYS CB C 13 33.297 0.300 . 1 . . . . 44 LYS CB . 10075 1
460 . 1 1 44 44 LYS CG C 13 26.635 0.300 . 1 . . . . 44 LYS CG . 10075 1
461 . 1 1 44 44 LYS CD C 13 29.439 0.300 . 1 . . . . 44 LYS CD . 10075 1
462 . 1 1 44 44 LYS CE C 13 42.473 0.300 . 1 . . . . 44 LYS CE . 10075 1
463 . 1 1 44 44 LYS N N 15 124.271 0.300 . 1 . . . . 44 LYS N . 10075 1
464 . 1 1 45 45 ASN H H 1 8.054 0.030 . 1 . . . . 45 ASN H . 10075 1
465 . 1 1 45 45 ASN HA H 1 4.277 0.030 . 1 . . . . 45 ASN HA . 10075 1
466 . 1 1 45 45 ASN HB2 H 1 2.692 0.030 . 2 . . . . 45 ASN HB2 . 10075 1
467 . 1 1 45 45 ASN HB3 H 1 2.495 0.030 . 2 . . . . 45 ASN HB3 . 10075 1
468 . 1 1 45 45 ASN HD21 H 1 7.622 0.030 . 2 . . . . 45 ASN HD21 . 10075 1
469 . 1 1 45 45 ASN HD22 H 1 7.245 0.030 . 2 . . . . 45 ASN HD22 . 10075 1
470 . 1 1 45 45 ASN C C 13 173.715 0.300 . 1 . . . . 45 ASN C . 10075 1
471 . 1 1 45 45 ASN CA C 13 53.973 0.300 . 1 . . . . 45 ASN CA . 10075 1
472 . 1 1 45 45 ASN CB C 13 37.113 0.300 . 1 . . . . 45 ASN CB . 10075 1
473 . 1 1 45 45 ASN N N 15 108.693 0.300 . 1 . . . . 45 ASN N . 10075 1
474 . 1 1 45 45 ASN ND2 N 15 115.494 0.300 . 1 . . . . 45 ASN ND2 . 10075 1
475 . 1 1 46 46 GLY H H 1 7.482 0.030 . 1 . . . . 46 GLY H . 10075 1
476 . 1 1 46 46 GLY HA2 H 1 4.212 0.030 . 2 . . . . 46 GLY HA2 . 10075 1
477 . 1 1 46 46 GLY HA3 H 1 3.786 0.030 . 2 . . . . 46 GLY HA3 . 10075 1
478 . 1 1 46 46 GLY C C 13 172.175 0.300 . 1 . . . . 46 GLY C . 10075 1
479 . 1 1 46 46 GLY CA C 13 44.246 0.300 . 1 . . . . 46 GLY CA . 10075 1
480 . 1 1 46 46 GLY N N 15 103.908 0.300 . 1 . . . . 46 GLY N . 10075 1
481 . 1 1 47 47 ILE H H 1 8.270 0.030 . 1 . . . . 47 ILE H . 10075 1
482 . 1 1 47 47 ILE HA H 1 4.089 0.030 . 1 . . . . 47 ILE HA . 10075 1
483 . 1 1 47 47 ILE HB H 1 1.790 0.030 . 1 . . . . 47 ILE HB . 10075 1
484 . 1 1 47 47 ILE HG12 H 1 1.543 0.030 . 2 . . . . 47 ILE HG12 . 10075 1
485 . 1 1 47 47 ILE HG13 H 1 1.212 0.030 . 2 . . . . 47 ILE HG13 . 10075 1
486 . 1 1 47 47 ILE HG21 H 1 0.853 0.030 . 1 . . . . 47 ILE HG2 . 10075 1
487 . 1 1 47 47 ILE HG22 H 1 0.853 0.030 . 1 . . . . 47 ILE HG2 . 10075 1
488 . 1 1 47 47 ILE HG23 H 1 0.853 0.030 . 1 . . . . 47 ILE HG2 . 10075 1
489 . 1 1 47 47 ILE HD11 H 1 0.854 0.030 . 1 . . . . 47 ILE HD1 . 10075 1
490 . 1 1 47 47 ILE HD12 H 1 0.854 0.030 . 1 . . . . 47 ILE HD1 . 10075 1
491 . 1 1 47 47 ILE HD13 H 1 0.854 0.030 . 1 . . . . 47 ILE HD1 . 10075 1
492 . 1 1 47 47 ILE C C 13 176.723 0.300 . 1 . . . . 47 ILE C . 10075 1
493 . 1 1 47 47 ILE CA C 13 60.204 0.300 . 1 . . . . 47 ILE CA . 10075 1
494 . 1 1 47 47 ILE CB C 13 38.293 0.300 . 1 . . . . 47 ILE CB . 10075 1
495 . 1 1 47 47 ILE CG1 C 13 27.543 0.300 . 1 . . . . 47 ILE CG1 . 10075 1
496 . 1 1 47 47 ILE CG2 C 13 17.178 0.300 . 1 . . . . 47 ILE CG2 . 10075 1
497 . 1 1 47 47 ILE CD1 C 13 12.279 0.300 . 1 . . . . 47 ILE CD1 . 10075 1
498 . 1 1 47 47 ILE N N 15 120.537 0.300 . 1 . . . . 47 ILE N . 10075 1
499 . 1 1 48 48 LEU H H 1 8.696 0.030 . 1 . . . . 48 LEU H . 10075 1
500 . 1 1 48 48 LEU HA H 1 4.717 0.030 . 1 . . . . 48 LEU HA . 10075 1
501 . 1 1 48 48 LEU HB2 H 1 1.851 0.030 . 2 . . . . 48 LEU HB2 . 10075 1
502 . 1 1 48 48 LEU HB3 H 1 1.397 0.030 . 2 . . . . 48 LEU HB3 . 10075 1
503 . 1 1 48 48 LEU HG H 1 1.794 0.030 . 1 . . . . 48 LEU HG . 10075 1
504 . 1 1 48 48 LEU HD11 H 1 0.999 0.030 . 1 . . . . 48 LEU HD1 . 10075 1
505 . 1 1 48 48 LEU HD12 H 1 0.999 0.030 . 1 . . . . 48 LEU HD1 . 10075 1
506 . 1 1 48 48 LEU HD13 H 1 0.999 0.030 . 1 . . . . 48 LEU HD1 . 10075 1
507 . 1 1 48 48 LEU HD21 H 1 0.792 0.030 . 1 . . . . 48 LEU HD2 . 10075 1
508 . 1 1 48 48 LEU HD22 H 1 0.792 0.030 . 1 . . . . 48 LEU HD2 . 10075 1
509 . 1 1 48 48 LEU HD23 H 1 0.792 0.030 . 1 . . . . 48 LEU HD2 . 10075 1
510 . 1 1 48 48 LEU C C 13 178.644 0.300 . 1 . . . . 48 LEU C . 10075 1
511 . 1 1 48 48 LEU CA C 13 55.231 0.300 . 1 . . . . 48 LEU CA . 10075 1
512 . 1 1 48 48 LEU CB C 13 41.942 0.300 . 1 . . . . 48 LEU CB . 10075 1
513 . 1 1 48 48 LEU CG C 13 27.257 0.300 . 1 . . . . 48 LEU CG . 10075 1
514 . 1 1 48 48 LEU CD1 C 13 26.662 0.300 . 2 . . . . 48 LEU CD1 . 10075 1
515 . 1 1 48 48 LEU CD2 C 13 24.110 0.300 . 2 . . . . 48 LEU CD2 . 10075 1
516 . 1 1 48 48 LEU N N 15 127.330 0.300 . 1 . . . . 48 LEU N . 10075 1
517 . 1 1 49 49 THR H H 1 9.209 0.030 . 1 . . . . 49 THR H . 10075 1
518 . 1 1 49 49 THR HA H 1 4.427 0.030 . 1 . . . . 49 THR HA . 10075 1
519 . 1 1 49 49 THR HB H 1 4.258 0.030 . 1 . . . . 49 THR HB . 10075 1
520 . 1 1 49 49 THR HG21 H 1 1.091 0.030 . 1 . . . . 49 THR HG2 . 10075 1
521 . 1 1 49 49 THR HG22 H 1 1.091 0.030 . 1 . . . . 49 THR HG2 . 10075 1
522 . 1 1 49 49 THR HG23 H 1 1.091 0.030 . 1 . . . . 49 THR HG2 . 10075 1
523 . 1 1 49 49 THR C C 13 175.772 0.300 . 1 . . . . 49 THR C . 10075 1
524 . 1 1 49 49 THR CA C 13 61.439 0.300 . 1 . . . . 49 THR CA . 10075 1
525 . 1 1 49 49 THR CB C 13 68.589 0.300 . 1 . . . . 49 THR CB . 10075 1
526 . 1 1 49 49 THR CG2 C 13 22.650 0.300 . 1 . . . . 49 THR CG2 . 10075 1
527 . 1 1 49 49 THR N N 15 114.128 0.300 . 1 . . . . 49 THR N . 10075 1
528 . 1 1 50 50 GLY H H 1 7.199 0.030 . 1 . . . . 50 GLY H . 10075 1
529 . 1 1 50 50 GLY HA2 H 1 4.616 0.030 . 2 . . . . 50 GLY HA2 . 10075 1
530 . 1 1 50 50 GLY HA3 H 1 3.529 0.030 . 2 . . . . 50 GLY HA3 . 10075 1
531 . 1 1 50 50 GLY C C 13 169.575 0.300 . 1 . . . . 50 GLY C . 10075 1
532 . 1 1 50 50 GLY CA C 13 45.105 0.300 . 1 . . . . 50 GLY CA . 10075 1
533 . 1 1 50 50 GLY N N 15 107.831 0.300 . 1 . . . . 50 GLY N . 10075 1
534 . 1 1 51 51 TYR H H 1 8.450 0.030 . 1 . . . . 51 TYR H . 10075 1
535 . 1 1 51 51 TYR HA H 1 5.152 0.030 . 1 . . . . 51 TYR HA . 10075 1
536 . 1 1 51 51 TYR HB2 H 1 2.615 0.030 . 2 . . . . 51 TYR HB2 . 10075 1
537 . 1 1 51 51 TYR HB3 H 1 2.562 0.030 . 2 . . . . 51 TYR HB3 . 10075 1
538 . 1 1 51 51 TYR HD1 H 1 7.030 0.030 . 1 . . . . 51 TYR HD1 . 10075 1
539 . 1 1 51 51 TYR HD2 H 1 7.030 0.030 . 1 . . . . 51 TYR HD2 . 10075 1
540 . 1 1 51 51 TYR HE1 H 1 6.771 0.030 . 1 . . . . 51 TYR HE1 . 10075 1
541 . 1 1 51 51 TYR HE2 H 1 6.771 0.030 . 1 . . . . 51 TYR HE2 . 10075 1
542 . 1 1 51 51 TYR C C 13 173.451 0.300 . 1 . . . . 51 TYR C . 10075 1
543 . 1 1 51 51 TYR CA C 13 57.252 0.300 . 1 . . . . 51 TYR CA . 10075 1
544 . 1 1 51 51 TYR CB C 13 43.504 0.300 . 1 . . . . 51 TYR CB . 10075 1
545 . 1 1 51 51 TYR CD1 C 13 132.855 0.300 . 1 . . . . 51 TYR CD1 . 10075 1
546 . 1 1 51 51 TYR CD2 C 13 132.855 0.300 . 1 . . . . 51 TYR CD2 . 10075 1
547 . 1 1 51 51 TYR CE1 C 13 117.915 0.300 . 1 . . . . 51 TYR CE1 . 10075 1
548 . 1 1 51 51 TYR CE2 C 13 117.915 0.300 . 1 . . . . 51 TYR CE2 . 10075 1
549 . 1 1 51 51 TYR N N 15 114.552 0.300 . 1 . . . . 51 TYR N . 10075 1
550 . 1 1 52 52 ARG H H 1 9.511 0.030 . 1 . . . . 52 ARG H . 10075 1
551 . 1 1 52 52 ARG HA H 1 4.757 0.030 . 1 . . . . 52 ARG HA . 10075 1
552 . 1 1 52 52 ARG HB2 H 1 1.658 0.030 . 2 . . . . 52 ARG HB2 . 10075 1
553 . 1 1 52 52 ARG HB3 H 1 1.628 0.030 . 2 . . . . 52 ARG HB3 . 10075 1
554 . 1 1 52 52 ARG HG2 H 1 1.148 0.030 . 2 . . . . 52 ARG HG2 . 10075 1
555 . 1 1 52 52 ARG HG3 H 1 1.057 0.030 . 2 . . . . 52 ARG HG3 . 10075 1
556 . 1 1 52 52 ARG HD2 H 1 2.910 0.030 . 2 . . . . 52 ARG HD2 . 10075 1
557 . 1 1 52 52 ARG HD3 H 1 2.794 0.030 . 2 . . . . 52 ARG HD3 . 10075 1
558 . 1 1 52 52 ARG HE H 1 7.274 0.030 . 1 . . . . 52 ARG HE . 10075 1
559 . 1 1 52 52 ARG C C 13 173.999 0.300 . 1 . . . . 52 ARG C . 10075 1
560 . 1 1 52 52 ARG CA C 13 54.809 0.300 . 1 . . . . 52 ARG CA . 10075 1
561 . 1 1 52 52 ARG CB C 13 31.627 0.300 . 1 . . . . 52 ARG CB . 10075 1
562 . 1 1 52 52 ARG CG C 13 26.449 0.300 . 1 . . . . 52 ARG CG . 10075 1
563 . 1 1 52 52 ARG CD C 13 42.893 0.300 . 1 . . . . 52 ARG CD . 10075 1
564 . 1 1 52 52 ARG N N 15 123.844 0.300 . 1 . . . . 52 ARG N . 10075 1
565 . 1 1 52 52 ARG NE N 15 82.834 0.300 . 1 . . . . 52 ARG NE . 10075 1
566 . 1 1 53 53 ILE H H 1 8.875 0.030 . 1 . . . . 53 ILE H . 10075 1
567 . 1 1 53 53 ILE HA H 1 5.551 0.030 . 1 . . . . 53 ILE HA . 10075 1
568 . 1 1 53 53 ILE HB H 1 1.264 0.030 . 1 . . . . 53 ILE HB . 10075 1
569 . 1 1 53 53 ILE HG12 H 1 1.860 0.030 . 2 . . . . 53 ILE HG12 . 10075 1
570 . 1 1 53 53 ILE HG13 H 1 1.100 0.030 . 2 . . . . 53 ILE HG13 . 10075 1
571 . 1 1 53 53 ILE HG21 H 1 0.747 0.030 . 1 . . . . 53 ILE HG2 . 10075 1
572 . 1 1 53 53 ILE HG22 H 1 0.747 0.030 . 1 . . . . 53 ILE HG2 . 10075 1
573 . 1 1 53 53 ILE HG23 H 1 0.747 0.030 . 1 . . . . 53 ILE HG2 . 10075 1
574 . 1 1 53 53 ILE HD11 H 1 0.824 0.030 . 1 . . . . 53 ILE HD1 . 10075 1
575 . 1 1 53 53 ILE HD12 H 1 0.824 0.030 . 1 . . . . 53 ILE HD1 . 10075 1
576 . 1 1 53 53 ILE HD13 H 1 0.824 0.030 . 1 . . . . 53 ILE HD1 . 10075 1
577 . 1 1 53 53 ILE C C 13 172.627 0.300 . 1 . . . . 53 ILE C . 10075 1
578 . 1 1 53 53 ILE CA C 13 57.895 0.300 . 1 . . . . 53 ILE CA . 10075 1
579 . 1 1 53 53 ILE CB C 13 41.653 0.300 . 1 . . . . 53 ILE CB . 10075 1
580 . 1 1 53 53 ILE CG1 C 13 29.180 0.300 . 1 . . . . 53 ILE CG1 . 10075 1
581 . 1 1 53 53 ILE CG2 C 13 15.840 0.300 . 1 . . . . 53 ILE CG2 . 10075 1
582 . 1 1 53 53 ILE CD1 C 13 14.752 0.300 . 1 . . . . 53 ILE CD1 . 10075 1
583 . 1 1 53 53 ILE N N 15 125.357 0.300 . 1 . . . . 53 ILE N . 10075 1
584 . 1 1 54 54 SER H H 1 9.237 0.030 . 1 . . . . 54 SER H . 10075 1
585 . 1 1 54 54 SER HA H 1 5.870 0.030 . 1 . . . . 54 SER HA . 10075 1
586 . 1 1 54 54 SER HB2 H 1 3.546 0.030 . 2 . . . . 54 SER HB2 . 10075 1
587 . 1 1 54 54 SER HB3 H 1 3.330 0.030 . 2 . . . . 54 SER HB3 . 10075 1
588 . 1 1 54 54 SER C C 13 172.781 0.300 . 1 . . . . 54 SER C . 10075 1
589 . 1 1 54 54 SER CA C 13 56.638 0.300 . 1 . . . . 54 SER CA . 10075 1
590 . 1 1 54 54 SER CB C 13 67.531 0.300 . 1 . . . . 54 SER CB . 10075 1
591 . 1 1 54 54 SER N N 15 120.524 0.300 . 1 . . . . 54 SER N . 10075 1
592 . 1 1 55 55 TRP H H 1 8.655 0.030 . 1 . . . . 55 TRP H . 10075 1
593 . 1 1 55 55 TRP HA H 1 6.029 0.030 . 1 . . . . 55 TRP HA . 10075 1
594 . 1 1 55 55 TRP HB2 H 1 3.478 0.030 . 2 . . . . 55 TRP HB2 . 10075 1
595 . 1 1 55 55 TRP HB3 H 1 2.854 0.030 . 2 . . . . 55 TRP HB3 . 10075 1
596 . 1 1 55 55 TRP HD1 H 1 6.675 0.030 . 1 . . . . 55 TRP HD1 . 10075 1
597 . 1 1 55 55 TRP HE1 H 1 10.236 0.030 . 1 . . . . 55 TRP HE1 . 10075 1
598 . 1 1 55 55 TRP HE3 H 1 7.186 0.030 . 1 . . . . 55 TRP HE3 . 10075 1
599 . 1 1 55 55 TRP HZ2 H 1 7.661 0.030 . 1 . . . . 55 TRP HZ2 . 10075 1
600 . 1 1 55 55 TRP HZ3 H 1 6.792 0.030 . 1 . . . . 55 TRP HZ3 . 10075 1
601 . 1 1 55 55 TRP HH2 H 1 7.213 0.030 . 1 . . . . 55 TRP HH2 . 10075 1
602 . 1 1 55 55 TRP C C 13 173.452 0.300 . 1 . . . . 55 TRP C . 10075 1
603 . 1 1 55 55 TRP CA C 13 56.127 0.300 . 1 . . . . 55 TRP CA . 10075 1
604 . 1 1 55 55 TRP CB C 13 33.529 0.300 . 1 . . . . 55 TRP CB . 10075 1
605 . 1 1 55 55 TRP CD1 C 13 125.997 0.300 . 1 . . . . 55 TRP CD1 . 10075 1
606 . 1 1 55 55 TRP CE3 C 13 121.010 0.300 . 1 . . . . 55 TRP CE3 . 10075 1
607 . 1 1 55 55 TRP CZ2 C 13 115.205 0.300 . 1 . . . . 55 TRP CZ2 . 10075 1
608 . 1 1 55 55 TRP CZ3 C 13 121.022 0.300 . 1 . . . . 55 TRP CZ3 . 10075 1
609 . 1 1 55 55 TRP CH2 C 13 123.998 0.300 . 1 . . . . 55 TRP CH2 . 10075 1
610 . 1 1 55 55 TRP N N 15 118.665 0.300 . 1 . . . . 55 TRP N . 10075 1
611 . 1 1 55 55 TRP NE1 N 15 129.837 0.300 . 1 . . . . 55 TRP NE1 . 10075 1
612 . 1 1 56 56 GLU H H 1 8.561 0.030 . 1 . . . . 56 GLU H . 10075 1
613 . 1 1 56 56 GLU HA H 1 4.870 0.030 . 1 . . . . 56 GLU HA . 10075 1
614 . 1 1 56 56 GLU HB2 H 1 1.933 0.030 . 2 . . . . 56 GLU HB2 . 10075 1
615 . 1 1 56 56 GLU HB3 H 1 1.841 0.030 . 2 . . . . 56 GLU HB3 . 10075 1
616 . 1 1 56 56 GLU HG2 H 1 2.195 0.030 . 2 . . . . 56 GLU HG2 . 10075 1
617 . 1 1 56 56 GLU HG3 H 1 2.026 0.030 . 2 . . . . 56 GLU HG3 . 10075 1
618 . 1 1 56 56 GLU C C 13 175.450 0.300 . 1 . . . . 56 GLU C . 10075 1
619 . 1 1 56 56 GLU CA C 13 53.684 0.300 . 1 . . . . 56 GLU CA . 10075 1
620 . 1 1 56 56 GLU CB C 13 32.675 0.300 . 1 . . . . 56 GLU CB . 10075 1
621 . 1 1 56 56 GLU CG C 13 34.285 0.300 . 1 . . . . 56 GLU CG . 10075 1
622 . 1 1 56 56 GLU N N 15 115.987 0.300 . 1 . . . . 56 GLU N . 10075 1
623 . 1 1 57 57 GLU H H 1 8.812 0.030 . 1 . . . . 57 GLU H . 10075 1
624 . 1 1 57 57 GLU HA H 1 3.923 0.030 . 1 . . . . 57 GLU HA . 10075 1
625 . 1 1 57 57 GLU HB2 H 1 1.951 0.030 . 2 . . . . 57 GLU HB2 . 10075 1
626 . 1 1 57 57 GLU HB3 H 1 1.886 0.030 . 2 . . . . 57 GLU HB3 . 10075 1
627 . 1 1 57 57 GLU HG2 H 1 2.385 0.030 . 2 . . . . 57 GLU HG2 . 10075 1
628 . 1 1 57 57 GLU HG3 H 1 2.042 0.030 . 2 . . . . 57 GLU HG3 . 10075 1
629 . 1 1 57 57 GLU C C 13 176.879 0.300 . 1 . . . . 57 GLU C . 10075 1
630 . 1 1 57 57 GLU CA C 13 57.334 0.300 . 1 . . . . 57 GLU CA . 10075 1
631 . 1 1 57 57 GLU CB C 13 29.325 0.300 . 1 . . . . 57 GLU CB . 10075 1
632 . 1 1 57 57 GLU CG C 13 36.851 0.300 . 1 . . . . 57 GLU CG . 10075 1
633 . 1 1 57 57 GLU N N 15 124.727 0.300 . 1 . . . . 57 GLU N . 10075 1
634 . 1 1 58 58 TYR H H 1 8.417 0.030 . 1 . . . . 58 TYR H . 10075 1
635 . 1 1 58 58 TYR HA H 1 4.088 0.030 . 1 . . . . 58 TYR HA . 10075 1
636 . 1 1 58 58 TYR HB2 H 1 2.615 0.030 . 2 . . . . 58 TYR HB2 . 10075 1
637 . 1 1 58 58 TYR HB3 H 1 2.562 0.030 . 2 . . . . 58 TYR HB3 . 10075 1
638 . 1 1 58 58 TYR HD1 H 1 6.989 0.030 . 1 . . . . 58 TYR HD1 . 10075 1
639 . 1 1 58 58 TYR HD2 H 1 6.989 0.030 . 1 . . . . 58 TYR HD2 . 10075 1
640 . 1 1 58 58 TYR HE1 H 1 6.779 0.030 . 1 . . . . 58 TYR HE1 . 10075 1
641 . 1 1 58 58 TYR HE2 H 1 6.779 0.030 . 1 . . . . 58 TYR HE2 . 10075 1
642 . 1 1 58 58 TYR C C 13 176.075 0.300 . 1 . . . . 58 TYR C . 10075 1
643 . 1 1 58 58 TYR CA C 13 59.517 0.300 . 1 . . . . 58 TYR CA . 10075 1
644 . 1 1 58 58 TYR CB C 13 38.906 0.300 . 1 . . . . 58 TYR CB . 10075 1
645 . 1 1 58 58 TYR CD1 C 13 133.023 0.300 . 1 . . . . 58 TYR CD1 . 10075 1
646 . 1 1 58 58 TYR CD2 C 13 133.023 0.300 . 1 . . . . 58 TYR CD2 . 10075 1
647 . 1 1 58 58 TYR CE1 C 13 118.342 0.300 . 1 . . . . 58 TYR CE1 . 10075 1
648 . 1 1 58 58 TYR CE2 C 13 118.342 0.300 . 1 . . . . 58 TYR CE2 . 10075 1
649 . 1 1 58 58 TYR N N 15 124.419 0.300 . 1 . . . . 58 TYR N . 10075 1
650 . 1 1 59 59 ASN H H 1 8.978 0.030 . 1 . . . . 59 ASN H . 10075 1
651 . 1 1 59 59 ASN HA H 1 4.118 0.030 . 1 . . . . 59 ASN HA . 10075 1
652 . 1 1 59 59 ASN HB2 H 1 2.922 0.030 . 2 . . . . 59 ASN HB2 . 10075 1
653 . 1 1 59 59 ASN HB3 H 1 2.234 0.030 . 2 . . . . 59 ASN HB3 . 10075 1
654 . 1 1 59 59 ASN HD21 H 1 7.269 0.030 . 2 . . . . 59 ASN HD21 . 10075 1
655 . 1 1 59 59 ASN HD22 H 1 6.541 0.030 . 2 . . . . 59 ASN HD22 . 10075 1
656 . 1 1 59 59 ASN C C 13 175.124 0.300 . 1 . . . . 59 ASN C . 10075 1
657 . 1 1 59 59 ASN CA C 13 53.603 0.300 . 1 . . . . 59 ASN CA . 10075 1
658 . 1 1 59 59 ASN CB C 13 37.865 0.300 . 1 . . . . 59 ASN CB . 10075 1
659 . 1 1 59 59 ASN N N 15 121.321 0.300 . 1 . . . . 59 ASN N . 10075 1
660 . 1 1 59 59 ASN ND2 N 15 110.738 0.300 . 1 . . . . 59 ASN ND2 . 10075 1
661 . 1 1 60 60 ARG H H 1 8.197 0.030 . 1 . . . . 60 ARG H . 10075 1
662 . 1 1 60 60 ARG HA H 1 4.772 0.030 . 1 . . . . 60 ARG HA . 10075 1
663 . 1 1 60 60 ARG HB2 H 1 1.763 0.030 . 2 . . . . 60 ARG HB2 . 10075 1
664 . 1 1 60 60 ARG HB3 H 1 1.646 0.030 . 2 . . . . 60 ARG HB3 . 10075 1
665 . 1 1 60 60 ARG HG2 H 1 1.568 0.030 . 2 . . . . 60 ARG HG2 . 10075 1
666 . 1 1 60 60 ARG HG3 H 1 1.507 0.030 . 2 . . . . 60 ARG HG3 . 10075 1
667 . 1 1 60 60 ARG HD2 H 1 3.226 0.030 . 2 . . . . 60 ARG HD2 . 10075 1
668 . 1 1 60 60 ARG HD3 H 1 3.151 0.030 . 2 . . . . 60 ARG HD3 . 10075 1
669 . 1 1 60 60 ARG C C 13 176.649 0.300 . 1 . . . . 60 ARG C . 10075 1
670 . 1 1 60 60 ARG CA C 13 54.374 0.300 . 1 . . . . 60 ARG CA . 10075 1
671 . 1 1 60 60 ARG CB C 13 30.921 0.300 . 1 . . . . 60 ARG CB . 10075 1
672 . 1 1 60 60 ARG CG C 13 26.403 0.300 . 1 . . . . 60 ARG CG . 10075 1
673 . 1 1 60 60 ARG CD C 13 43.688 0.300 . 1 . . . . 60 ARG CD . 10075 1
674 . 1 1 60 60 ARG N N 15 119.697 0.300 . 1 . . . . 60 ARG N . 10075 1
675 . 1 1 61 61 THR H H 1 8.608 0.030 . 1 . . . . 61 THR H . 10075 1
676 . 1 1 61 61 THR HA H 1 4.063 0.030 . 1 . . . . 61 THR HA . 10075 1
677 . 1 1 61 61 THR HB H 1 4.128 0.030 . 1 . . . . 61 THR HB . 10075 1
678 . 1 1 61 61 THR HG21 H 1 1.215 0.030 . 1 . . . . 61 THR HG2 . 10075 1
679 . 1 1 61 61 THR HG22 H 1 1.215 0.030 . 1 . . . . 61 THR HG2 . 10075 1
680 . 1 1 61 61 THR HG23 H 1 1.215 0.030 . 1 . . . . 61 THR HG2 . 10075 1
681 . 1 1 61 61 THR C C 13 175.514 0.300 . 1 . . . . 61 THR C . 10075 1
682 . 1 1 61 61 THR CA C 13 64.907 0.300 . 1 . . . . 61 THR CA . 10075 1
683 . 1 1 61 61 THR CB C 13 69.059 0.300 . 1 . . . . 61 THR CB . 10075 1
684 . 1 1 61 61 THR CG2 C 13 21.584 0.300 . 1 . . . . 61 THR CG2 . 10075 1
685 . 1 1 62 62 ASN H H 1 8.780 0.030 . 1 . . . . 62 ASN H . 10075 1
686 . 1 1 62 62 ASN HA H 1 4.582 0.030 . 1 . . . . 62 ASN HA . 10075 1
687 . 1 1 62 62 ASN HB2 H 1 2.943 0.030 . 2 . . . . 62 ASN HB2 . 10075 1
688 . 1 1 62 62 ASN HB3 H 1 2.872 0.030 . 2 . . . . 62 ASN HB3 . 10075 1
689 . 1 1 62 62 ASN HD21 H 1 7.645 0.030 . 2 . . . . 62 ASN HD21 . 10075 1
690 . 1 1 62 62 ASN HD22 H 1 6.812 0.030 . 2 . . . . 62 ASN HD22 . 10075 1
691 . 1 1 62 62 ASN C C 13 175.869 0.300 . 1 . . . . 62 ASN C . 10075 1
692 . 1 1 62 62 ASN CA C 13 55.016 0.300 . 1 . . . . 62 ASN CA . 10075 1
693 . 1 1 62 62 ASN CB C 13 36.902 0.300 . 1 . . . . 62 ASN CB . 10075 1
694 . 1 1 62 62 ASN N N 15 117.831 0.300 . 1 . . . . 62 ASN N . 10075 1
695 . 1 1 62 62 ASN ND2 N 15 113.179 0.300 . 1 . . . . 62 ASN ND2 . 10075 1
696 . 1 1 63 63 THR H H 1 7.965 0.030 . 1 . . . . 63 THR H . 10075 1
697 . 1 1 63 63 THR HA H 1 4.514 0.030 . 1 . . . . 63 THR HA . 10075 1
698 . 1 1 63 63 THR HB H 1 4.700 0.030 . 1 . . . . 63 THR HB . 10075 1
699 . 1 1 63 63 THR HG21 H 1 1.197 0.030 . 1 . . . . 63 THR HG2 . 10075 1
700 . 1 1 63 63 THR HG22 H 1 1.197 0.030 . 1 . . . . 63 THR HG2 . 10075 1
701 . 1 1 63 63 THR HG23 H 1 1.197 0.030 . 1 . . . . 63 THR HG2 . 10075 1
702 . 1 1 63 63 THR C C 13 174.552 0.300 . 1 . . . . 63 THR C . 10075 1
703 . 1 1 63 63 THR CA C 13 61.732 0.300 . 1 . . . . 63 THR CA . 10075 1
704 . 1 1 63 63 THR CB C 13 71.377 0.300 . 1 . . . . 63 THR CB . 10075 1
705 . 1 1 63 63 THR CG2 C 13 21.773 0.300 . 1 . . . . 63 THR CG2 . 10075 1
706 . 1 1 63 63 THR N N 15 108.898 0.300 . 1 . . . . 63 THR N . 10075 1
707 . 1 1 64 64 ARG H H 1 7.434 0.030 . 1 . . . . 64 ARG H . 10075 1
708 . 1 1 64 64 ARG HA H 1 4.683 0.030 . 1 . . . . 64 ARG HA . 10075 1
709 . 1 1 64 64 ARG HB2 H 1 2.114 0.030 . 2 . . . . 64 ARG HB2 . 10075 1
710 . 1 1 64 64 ARG HB3 H 1 1.643 0.030 . 2 . . . . 64 ARG HB3 . 10075 1
711 . 1 1 64 64 ARG HG2 H 1 1.316 0.030 . 2 . . . . 64 ARG HG2 . 10075 1
712 . 1 1 64 64 ARG HG3 H 1 1.254 0.030 . 2 . . . . 64 ARG HG3 . 10075 1
713 . 1 1 64 64 ARG HD2 H 1 3.024 0.030 . 2 . . . . 64 ARG HD2 . 10075 1
714 . 1 1 64 64 ARG HD3 H 1 2.999 0.030 . 2 . . . . 64 ARG HD3 . 10075 1
715 . 1 1 64 64 ARG HE H 1 7.136 0.030 . 1 . . . . 64 ARG HE . 10075 1
716 . 1 1 64 64 ARG C C 13 175.778 0.300 . 1 . . . . 64 ARG C . 10075 1
717 . 1 1 64 64 ARG CA C 13 57.308 0.300 . 1 . . . . 64 ARG CA . 10075 1
718 . 1 1 64 64 ARG CB C 13 31.399 0.300 . 1 . . . . 64 ARG CB . 10075 1
719 . 1 1 64 64 ARG CG C 13 27.495 0.300 . 1 . . . . 64 ARG CG . 10075 1
720 . 1 1 64 64 ARG CD C 13 43.394 0.300 . 1 . . . . 64 ARG CD . 10075 1
721 . 1 1 64 64 ARG N N 15 123.980 0.300 . 1 . . . . 64 ARG N . 10075 1
722 . 1 1 64 64 ARG NE N 15 84.104 0.300 . 1 . . . . 64 ARG NE . 10075 1
723 . 1 1 65 65 VAL H H 1 8.703 0.030 . 1 . . . . 65 VAL H . 10075 1
724 . 1 1 65 65 VAL HA H 1 3.860 0.030 . 1 . . . . 65 VAL HA . 10075 1
725 . 1 1 65 65 VAL HB H 1 0.297 0.030 . 1 . . . . 65 VAL HB . 10075 1
726 . 1 1 65 65 VAL HG11 H 1 0.378 0.030 . 1 . . . . 65 VAL HG1 . 10075 1
727 . 1 1 65 65 VAL HG12 H 1 0.378 0.030 . 1 . . . . 65 VAL HG1 . 10075 1
728 . 1 1 65 65 VAL HG13 H 1 0.378 0.030 . 1 . . . . 65 VAL HG1 . 10075 1
729 . 1 1 65 65 VAL HG21 H 1 0.650 0.030 . 1 . . . . 65 VAL HG2 . 10075 1
730 . 1 1 65 65 VAL HG22 H 1 0.650 0.030 . 1 . . . . 65 VAL HG2 . 10075 1
731 . 1 1 65 65 VAL HG23 H 1 0.650 0.030 . 1 . . . . 65 VAL HG2 . 10075 1
732 . 1 1 65 65 VAL C C 13 173.743 0.300 . 1 . . . . 65 VAL C . 10075 1
733 . 1 1 65 65 VAL CA C 13 61.400 0.300 . 1 . . . . 65 VAL CA . 10075 1
734 . 1 1 65 65 VAL CB C 13 33.938 0.300 . 1 . . . . 65 VAL CB . 10075 1
735 . 1 1 65 65 VAL CG1 C 13 22.020 0.300 . 2 . . . . 65 VAL CG1 . 10075 1
736 . 1 1 65 65 VAL CG2 C 13 20.543 0.300 . 2 . . . . 65 VAL CG2 . 10075 1
737 . 1 1 65 65 VAL N N 15 130.520 0.300 . 1 . . . . 65 VAL N . 10075 1
738 . 1 1 66 66 THR H H 1 7.780 0.030 . 1 . . . . 66 THR H . 10075 1
739 . 1 1 66 66 THR HA H 1 4.847 0.030 . 1 . . . . 66 THR HA . 10075 1
740 . 1 1 66 66 THR HB H 1 3.569 0.030 . 1 . . . . 66 THR HB . 10075 1
741 . 1 1 66 66 THR HG21 H 1 0.676 0.030 . 1 . . . . 66 THR HG2 . 10075 1
742 . 1 1 66 66 THR HG22 H 1 0.676 0.030 . 1 . . . . 66 THR HG2 . 10075 1
743 . 1 1 66 66 THR HG23 H 1 0.676 0.030 . 1 . . . . 66 THR HG2 . 10075 1
744 . 1 1 66 66 THR C C 13 173.129 0.300 . 1 . . . . 66 THR C . 10075 1
745 . 1 1 66 66 THR CA C 13 61.332 0.300 . 1 . . . . 66 THR CA . 10075 1
746 . 1 1 66 66 THR CB C 13 71.721 0.300 . 1 . . . . 66 THR CB . 10075 1
747 . 1 1 66 66 THR CG2 C 13 21.714 0.300 . 1 . . . . 66 THR CG2 . 10075 1
748 . 1 1 66 66 THR N N 15 119.564 0.300 . 1 . . . . 66 THR N . 10075 1
749 . 1 1 67 67 HIS H H 1 9.340 0.030 . 1 . . . . 67 HIS H . 10075 1
750 . 1 1 67 67 HIS HA H 1 4.815 0.030 . 1 . . . . 67 HIS HA . 10075 1
751 . 1 1 67 67 HIS HB2 H 1 2.874 0.030 . 2 . . . . 67 HIS HB2 . 10075 1
752 . 1 1 67 67 HIS HB3 H 1 2.633 0.030 . 2 . . . . 67 HIS HB3 . 10075 1
753 . 1 1 67 67 HIS HD2 H 1 6.593 0.030 . 1 . . . . 67 HIS HD2 . 10075 1
754 . 1 1 67 67 HIS HE1 H 1 7.966 0.030 . 1 . . . . 67 HIS HE1 . 10075 1
755 . 1 1 67 67 HIS C C 13 172.558 0.300 . 1 . . . . 67 HIS C . 10075 1
756 . 1 1 67 67 HIS CA C 13 54.764 0.300 . 1 . . . . 67 HIS CA . 10075 1
757 . 1 1 67 67 HIS CB C 13 35.145 0.300 . 1 . . . . 67 HIS CB . 10075 1
758 . 1 1 67 67 HIS CD2 C 13 118.384 0.300 . 1 . . . . 67 HIS CD2 . 10075 1
759 . 1 1 67 67 HIS CE1 C 13 138.673 0.300 . 1 . . . . 67 HIS CE1 . 10075 1
760 . 1 1 67 67 HIS N N 15 126.046 0.300 . 1 . . . . 67 HIS N . 10075 1
761 . 1 1 68 68 TYR H H 1 8.384 0.030 . 1 . . . . 68 TYR H . 10075 1
762 . 1 1 68 68 TYR HA H 1 5.127 0.030 . 1 . . . . 68 TYR HA . 10075 1
763 . 1 1 68 68 TYR HB2 H 1 2.984 0.030 . 2 . . . . 68 TYR HB2 . 10075 1
764 . 1 1 68 68 TYR HB3 H 1 2.731 0.030 . 2 . . . . 68 TYR HB3 . 10075 1
765 . 1 1 68 68 TYR HD1 H 1 7.039 0.030 . 1 . . . . 68 TYR HD1 . 10075 1
766 . 1 1 68 68 TYR HD2 H 1 7.039 0.030 . 1 . . . . 68 TYR HD2 . 10075 1
767 . 1 1 68 68 TYR HE1 H 1 6.653 0.030 . 1 . . . . 68 TYR HE1 . 10075 1
768 . 1 1 68 68 TYR HE2 H 1 6.653 0.030 . 1 . . . . 68 TYR HE2 . 10075 1
769 . 1 1 68 68 TYR C C 13 175.277 0.300 . 1 . . . . 68 TYR C . 10075 1
770 . 1 1 68 68 TYR CA C 13 57.645 0.300 . 1 . . . . 68 TYR CA . 10075 1
771 . 1 1 68 68 TYR CB C 13 39.571 0.300 . 1 . . . . 68 TYR CB . 10075 1
772 . 1 1 68 68 TYR CD1 C 13 132.946 0.300 . 1 . . . . 68 TYR CD1 . 10075 1
773 . 1 1 68 68 TYR CD2 C 13 132.946 0.300 . 1 . . . . 68 TYR CD2 . 10075 1
774 . 1 1 68 68 TYR CE1 C 13 117.809 0.300 . 1 . . . . 68 TYR CE1 . 10075 1
775 . 1 1 68 68 TYR CE2 C 13 117.809 0.300 . 1 . . . . 68 TYR CE2 . 10075 1
776 . 1 1 68 68 TYR N N 15 120.321 0.300 . 1 . . . . 68 TYR N . 10075 1
777 . 1 1 69 69 LEU H H 1 9.589 0.030 . 1 . . . . 69 LEU H . 10075 1
778 . 1 1 69 69 LEU HA H 1 5.103 0.030 . 1 . . . . 69 LEU HA . 10075 1
779 . 1 1 69 69 LEU HB2 H 1 1.923 0.030 . 1 . . . . 69 LEU HB2 . 10075 1
780 . 1 1 69 69 LEU HB3 H 1 1.923 0.030 . 1 . . . . 69 LEU HB3 . 10075 1
781 . 1 1 69 69 LEU HG H 1 1.590 0.030 . 1 . . . . 69 LEU HG . 10075 1
782 . 1 1 69 69 LEU HD11 H 1 0.954 0.030 . 1 . . . . 69 LEU HD1 . 10075 1
783 . 1 1 69 69 LEU HD12 H 1 0.954 0.030 . 1 . . . . 69 LEU HD1 . 10075 1
784 . 1 1 69 69 LEU HD13 H 1 0.954 0.030 . 1 . . . . 69 LEU HD1 . 10075 1
785 . 1 1 69 69 LEU HD21 H 1 0.949 0.030 . 1 . . . . 69 LEU HD2 . 10075 1
786 . 1 1 69 69 LEU HD22 H 1 0.949 0.030 . 1 . . . . 69 LEU HD2 . 10075 1
787 . 1 1 69 69 LEU HD23 H 1 0.949 0.030 . 1 . . . . 69 LEU HD2 . 10075 1
788 . 1 1 69 69 LEU C C 13 175.522 0.300 . 1 . . . . 69 LEU C . 10075 1
789 . 1 1 69 69 LEU CA C 13 51.884 0.300 . 1 . . . . 69 LEU CA . 10075 1
790 . 1 1 69 69 LEU CB C 13 44.019 0.300 . 1 . . . . 69 LEU CB . 10075 1
791 . 1 1 69 69 LEU CG C 13 27.285 0.300 . 1 . . . . 69 LEU CG . 10075 1
792 . 1 1 69 69 LEU CD1 C 13 26.029 0.300 . 2 . . . . 69 LEU CD1 . 10075 1
793 . 1 1 69 69 LEU CD2 C 13 23.480 0.300 . 2 . . . . 69 LEU CD2 . 10075 1
794 . 1 1 69 69 LEU N N 15 124.171 0.300 . 1 . . . . 69 LEU N . 10075 1
795 . 1 1 70 70 PRO HA H 1 4.950 0.030 . 1 . . . . 70 PRO HA . 10075 1
796 . 1 1 70 70 PRO HB2 H 1 2.618 0.030 . 2 . . . . 70 PRO HB2 . 10075 1
797 . 1 1 70 70 PRO HB3 H 1 2.190 0.030 . 2 . . . . 70 PRO HB3 . 10075 1
798 . 1 1 70 70 PRO HG2 H 1 2.212 0.030 . 1 . . . . 70 PRO HG2 . 10075 1
799 . 1 1 70 70 PRO HG3 H 1 2.212 0.030 . 1 . . . . 70 PRO HG3 . 10075 1
800 . 1 1 70 70 PRO HD2 H 1 4.033 0.030 . 2 . . . . 70 PRO HD2 . 10075 1
801 . 1 1 70 70 PRO HD3 H 1 3.884 0.030 . 2 . . . . 70 PRO HD3 . 10075 1
802 . 1 1 70 70 PRO C C 13 176.547 0.300 . 1 . . . . 70 PRO C . 10075 1
803 . 1 1 70 70 PRO CA C 13 62.612 0.300 . 1 . . . . 70 PRO CA . 10075 1
804 . 1 1 70 70 PRO CB C 13 33.369 0.300 . 1 . . . . 70 PRO CB . 10075 1
805 . 1 1 70 70 PRO CG C 13 27.286 0.300 . 1 . . . . 70 PRO CG . 10075 1
806 . 1 1 70 70 PRO CD C 13 50.458 0.300 . 1 . . . . 70 PRO CD . 10075 1
807 . 1 1 71 71 ASN H H 1 8.790 0.030 . 1 . . . . 71 ASN H . 10075 1
808 . 1 1 71 71 ASN HA H 1 4.249 0.030 . 1 . . . . 71 ASN HA . 10075 1
809 . 1 1 71 71 ASN HB2 H 1 2.940 0.030 . 2 . . . . 71 ASN HB2 . 10075 1
810 . 1 1 71 71 ASN HB3 H 1 2.217 0.030 . 2 . . . . 71 ASN HB3 . 10075 1
811 . 1 1 71 71 ASN HD21 H 1 7.456 0.030 . 2 . . . . 71 ASN HD21 . 10075 1
812 . 1 1 71 71 ASN HD22 H 1 6.839 0.030 . 2 . . . . 71 ASN HD22 . 10075 1
813 . 1 1 71 71 ASN C C 13 175.122 0.300 . 1 . . . . 71 ASN C . 10075 1
814 . 1 1 71 71 ASN CA C 13 55.126 0.300 . 1 . . . . 71 ASN CA . 10075 1
815 . 1 1 71 71 ASN CB C 13 37.228 0.300 . 1 . . . . 71 ASN CB . 10075 1
816 . 1 1 71 71 ASN N N 15 115.380 0.300 . 1 . . . . 71 ASN N . 10075 1
817 . 1 1 71 71 ASN ND2 N 15 110.596 0.300 . 1 . . . . 71 ASN ND2 . 10075 1
818 . 1 1 72 72 VAL H H 1 6.763 0.030 . 1 . . . . 72 VAL H . 10075 1
819 . 1 1 72 72 VAL HA H 1 4.427 0.030 . 1 . . . . 72 VAL HA . 10075 1
820 . 1 1 72 72 VAL HB H 1 2.532 0.030 . 1 . . . . 72 VAL HB . 10075 1
821 . 1 1 72 72 VAL HG11 H 1 1.044 0.030 . 1 . . . . 72 VAL HG1 . 10075 1
822 . 1 1 72 72 VAL HG12 H 1 1.044 0.030 . 1 . . . . 72 VAL HG1 . 10075 1
823 . 1 1 72 72 VAL HG13 H 1 1.044 0.030 . 1 . . . . 72 VAL HG1 . 10075 1
824 . 1 1 72 72 VAL HG21 H 1 0.920 0.030 . 1 . . . . 72 VAL HG2 . 10075 1
825 . 1 1 72 72 VAL HG22 H 1 0.920 0.030 . 1 . . . . 72 VAL HG2 . 10075 1
826 . 1 1 72 72 VAL HG23 H 1 0.920 0.030 . 1 . . . . 72 VAL HG2 . 10075 1
827 . 1 1 72 72 VAL C C 13 175.476 0.300 . 1 . . . . 72 VAL C . 10075 1
828 . 1 1 72 72 VAL CA C 13 61.124 0.300 . 1 . . . . 72 VAL CA . 10075 1
829 . 1 1 72 72 VAL CB C 13 31.852 0.300 . 1 . . . . 72 VAL CB . 10075 1
830 . 1 1 72 72 VAL CG1 C 13 21.601 0.300 . 2 . . . . 72 VAL CG1 . 10075 1
831 . 1 1 72 72 VAL CG2 C 13 18.176 0.300 . 2 . . . . 72 VAL CG2 . 10075 1
832 . 1 1 72 72 VAL N N 15 109.129 0.300 . 1 . . . . 72 VAL N . 10075 1
833 . 1 1 73 73 THR H H 1 7.777 0.030 . 1 . . . . 73 THR H . 10075 1
834 . 1 1 73 73 THR HA H 1 4.171 0.030 . 1 . . . . 73 THR HA . 10075 1
835 . 1 1 73 73 THR HB H 1 4.266 0.030 . 1 . . . . 73 THR HB . 10075 1
836 . 1 1 73 73 THR HG21 H 1 1.570 0.030 . 1 . . . . 73 THR HG2 . 10075 1
837 . 1 1 73 73 THR HG22 H 1 1.570 0.030 . 1 . . . . 73 THR HG2 . 10075 1
838 . 1 1 73 73 THR HG23 H 1 1.570 0.030 . 1 . . . . 73 THR HG2 . 10075 1
839 . 1 1 73 73 THR C C 13 170.883 0.300 . 1 . . . . 73 THR C . 10075 1
840 . 1 1 73 73 THR CA C 13 63.683 0.300 . 1 . . . . 73 THR CA . 10075 1
841 . 1 1 73 73 THR CB C 13 69.700 0.300 . 1 . . . . 73 THR CB . 10075 1
842 . 1 1 73 73 THR CG2 C 13 24.226 0.300 . 1 . . . . 73 THR CG2 . 10075 1
843 . 1 1 73 73 THR N N 15 121.587 0.300 . 1 . . . . 73 THR N . 10075 1
844 . 1 1 74 74 LEU H H 1 7.764 0.030 . 1 . . . . 74 LEU H . 10075 1
845 . 1 1 74 74 LEU HA H 1 3.211 0.030 . 1 . . . . 74 LEU HA . 10075 1
846 . 1 1 74 74 LEU HB2 H 1 1.481 0.030 . 2 . . . . 74 LEU HB2 . 10075 1
847 . 1 1 74 74 LEU HB3 H 1 0.894 0.030 . 2 . . . . 74 LEU HB3 . 10075 1
848 . 1 1 74 74 LEU HG H 1 1.220 0.030 . 1 . . . . 74 LEU HG . 10075 1
849 . 1 1 74 74 LEU HD11 H 1 0.812 0.030 . 1 . . . . 74 LEU HD1 . 10075 1
850 . 1 1 74 74 LEU HD12 H 1 0.812 0.030 . 1 . . . . 74 LEU HD1 . 10075 1
851 . 1 1 74 74 LEU HD13 H 1 0.812 0.030 . 1 . . . . 74 LEU HD1 . 10075 1
852 . 1 1 74 74 LEU HD21 H 1 0.614 0.030 . 1 . . . . 74 LEU HD2 . 10075 1
853 . 1 1 74 74 LEU HD22 H 1 0.614 0.030 . 1 . . . . 74 LEU HD2 . 10075 1
854 . 1 1 74 74 LEU HD23 H 1 0.614 0.030 . 1 . . . . 74 LEU HD2 . 10075 1
855 . 1 1 74 74 LEU C C 13 173.906 0.300 . 1 . . . . 74 LEU C . 10075 1
856 . 1 1 74 74 LEU CA C 13 52.849 0.300 . 1 . . . . 74 LEU CA . 10075 1
857 . 1 1 74 74 LEU CB C 13 41.711 0.300 . 1 . . . . 74 LEU CB . 10075 1
858 . 1 1 74 74 LEU CG C 13 27.129 0.300 . 1 . . . . 74 LEU CG . 10075 1
859 . 1 1 74 74 LEU CD1 C 13 26.045 0.300 . 2 . . . . 74 LEU CD1 . 10075 1
860 . 1 1 74 74 LEU CD2 C 13 23.691 0.300 . 2 . . . . 74 LEU CD2 . 10075 1
861 . 1 1 74 74 LEU N N 15 123.778 0.300 . 1 . . . . 74 LEU N . 10075 1
862 . 1 1 75 75 GLU H H 1 6.685 0.030 . 1 . . . . 75 GLU H . 10075 1
863 . 1 1 75 75 GLU HA H 1 4.616 0.030 . 1 . . . . 75 GLU HA . 10075 1
864 . 1 1 75 75 GLU HB2 H 1 1.724 0.030 . 2 . . . . 75 GLU HB2 . 10075 1
865 . 1 1 75 75 GLU HB3 H 1 1.504 0.030 . 2 . . . . 75 GLU HB3 . 10075 1
866 . 1 1 75 75 GLU HG2 H 1 1.933 0.030 . 2 . . . . 75 GLU HG2 . 10075 1
867 . 1 1 75 75 GLU HG3 H 1 1.700 0.030 . 2 . . . . 75 GLU HG3 . 10075 1
868 . 1 1 75 75 GLU C C 13 174.853 0.300 . 1 . . . . 75 GLU C . 10075 1
869 . 1 1 75 75 GLU CA C 13 53.659 0.300 . 1 . . . . 75 GLU CA . 10075 1
870 . 1 1 75 75 GLU CB C 13 32.941 0.300 . 1 . . . . 75 GLU CB . 10075 1
871 . 1 1 75 75 GLU CG C 13 34.761 0.300 . 1 . . . . 75 GLU CG . 10075 1
872 . 1 1 75 75 GLU N N 15 112.013 0.300 . 1 . . . . 75 GLU N . 10075 1
873 . 1 1 76 76 TYR H H 1 9.289 0.030 . 1 . . . . 76 TYR H . 10075 1
874 . 1 1 76 76 TYR HA H 1 4.439 0.030 . 1 . . . . 76 TYR HA . 10075 1
875 . 1 1 76 76 TYR HB2 H 1 3.190 0.030 . 2 . . . . 76 TYR HB2 . 10075 1
876 . 1 1 76 76 TYR HB3 H 1 2.636 0.030 . 2 . . . . 76 TYR HB3 . 10075 1
877 . 1 1 76 76 TYR HD1 H 1 6.986 0.030 . 1 . . . . 76 TYR HD1 . 10075 1
878 . 1 1 76 76 TYR HD2 H 1 6.986 0.030 . 1 . . . . 76 TYR HD2 . 10075 1
879 . 1 1 76 76 TYR HE1 H 1 6.810 0.030 . 1 . . . . 76 TYR HE1 . 10075 1
880 . 1 1 76 76 TYR HE2 H 1 6.810 0.030 . 1 . . . . 76 TYR HE2 . 10075 1
881 . 1 1 76 76 TYR C C 13 172.661 0.300 . 1 . . . . 76 TYR C . 10075 1
882 . 1 1 76 76 TYR CA C 13 59.013 0.300 . 1 . . . . 76 TYR CA . 10075 1
883 . 1 1 76 76 TYR CB C 13 43.340 0.300 . 1 . . . . 76 TYR CB . 10075 1
884 . 1 1 76 76 TYR CD1 C 13 132.713 0.300 . 1 . . . . 76 TYR CD1 . 10075 1
885 . 1 1 76 76 TYR CD2 C 13 132.713 0.300 . 1 . . . . 76 TYR CD2 . 10075 1
886 . 1 1 76 76 TYR CE1 C 13 118.694 0.300 . 1 . . . . 76 TYR CE1 . 10075 1
887 . 1 1 76 76 TYR CE2 C 13 118.694 0.300 . 1 . . . . 76 TYR CE2 . 10075 1
888 . 1 1 76 76 TYR N N 15 120.617 0.300 . 1 . . . . 76 TYR N . 10075 1
889 . 1 1 77 77 ARG H H 1 7.711 0.030 . 1 . . . . 77 ARG H . 10075 1
890 . 1 1 77 77 ARG HA H 1 4.611 0.030 . 1 . . . . 77 ARG HA . 10075 1
891 . 1 1 77 77 ARG HB2 H 1 1.505 0.030 . 2 . . . . 77 ARG HB2 . 10075 1
892 . 1 1 77 77 ARG HB3 H 1 1.263 0.030 . 2 . . . . 77 ARG HB3 . 10075 1
893 . 1 1 77 77 ARG HG2 H 1 1.263 0.030 . 2 . . . . 77 ARG HG2 . 10075 1
894 . 1 1 77 77 ARG HG3 H 1 1.078 0.030 . 2 . . . . 77 ARG HG3 . 10075 1
895 . 1 1 77 77 ARG HD2 H 1 3.004 0.030 . 2 . . . . 77 ARG HD2 . 10075 1
896 . 1 1 77 77 ARG HD3 H 1 2.943 0.030 . 2 . . . . 77 ARG HD3 . 10075 1
897 . 1 1 77 77 ARG C C 13 173.592 0.300 . 1 . . . . 77 ARG C . 10075 1
898 . 1 1 77 77 ARG CA C 13 54.690 0.300 . 1 . . . . 77 ARG CA . 10075 1
899 . 1 1 77 77 ARG CB C 13 29.712 0.300 . 1 . . . . 77 ARG CB . 10075 1
900 . 1 1 77 77 ARG CG C 13 27.035 0.300 . 1 . . . . 77 ARG CG . 10075 1
901 . 1 1 77 77 ARG CD C 13 42.502 0.300 . 1 . . . . 77 ARG CD . 10075 1
902 . 1 1 77 77 ARG N N 15 128.516 0.300 . 1 . . . . 77 ARG N . 10075 1
903 . 1 1 78 78 VAL H H 1 8.540 0.030 . 1 . . . . 78 VAL H . 10075 1
904 . 1 1 78 78 VAL HA H 1 3.133 0.030 . 1 . . . . 78 VAL HA . 10075 1
905 . 1 1 78 78 VAL HB H 1 1.276 0.030 . 1 . . . . 78 VAL HB . 10075 1
906 . 1 1 78 78 VAL HG11 H 1 0.378 0.030 . 1 . . . . 78 VAL HG1 . 10075 1
907 . 1 1 78 78 VAL HG12 H 1 0.378 0.030 . 1 . . . . 78 VAL HG1 . 10075 1
908 . 1 1 78 78 VAL HG13 H 1 0.378 0.030 . 1 . . . . 78 VAL HG1 . 10075 1
909 . 1 1 78 78 VAL HG21 H 1 -0.684 0.030 . 1 . . . . 78 VAL HG2 . 10075 1
910 . 1 1 78 78 VAL HG22 H 1 -0.684 0.030 . 1 . . . . 78 VAL HG2 . 10075 1
911 . 1 1 78 78 VAL HG23 H 1 -0.684 0.030 . 1 . . . . 78 VAL HG2 . 10075 1
912 . 1 1 78 78 VAL C C 13 174.942 0.300 . 1 . . . . 78 VAL C . 10075 1
913 . 1 1 78 78 VAL CA C 13 62.825 0.300 . 1 . . . . 78 VAL CA . 10075 1
914 . 1 1 78 78 VAL CB C 13 31.558 0.300 . 1 . . . . 78 VAL CB . 10075 1
915 . 1 1 78 78 VAL CG1 C 13 21.598 0.300 . 2 . . . . 78 VAL CG1 . 10075 1
916 . 1 1 78 78 VAL CG2 C 13 20.404 0.300 . 2 . . . . 78 VAL CG2 . 10075 1
917 . 1 1 78 78 VAL N N 15 130.372 0.300 . 1 . . . . 78 VAL N . 10075 1
918 . 1 1 79 79 THR H H 1 7.121 0.030 . 1 . . . . 79 THR H . 10075 1
919 . 1 1 79 79 THR HA H 1 4.867 0.030 . 1 . . . . 79 THR HA . 10075 1
920 . 1 1 79 79 THR HB H 1 4.364 0.030 . 1 . . . . 79 THR HB . 10075 1
921 . 1 1 79 79 THR HG21 H 1 0.985 0.030 . 1 . . . . 79 THR HG2 . 10075 1
922 . 1 1 79 79 THR HG22 H 1 0.985 0.030 . 1 . . . . 79 THR HG2 . 10075 1
923 . 1 1 79 79 THR HG23 H 1 0.985 0.030 . 1 . . . . 79 THR HG2 . 10075 1
924 . 1 1 79 79 THR C C 13 173.970 0.300 . 1 . . . . 79 THR C . 10075 1
925 . 1 1 79 79 THR CA C 13 59.650 0.300 . 1 . . . . 79 THR CA . 10075 1
926 . 1 1 79 79 THR CB C 13 72.042 0.300 . 1 . . . . 79 THR CB . 10075 1
927 . 1 1 79 79 THR CG2 C 13 21.312 0.300 . 1 . . . . 79 THR CG2 . 10075 1
928 . 1 1 79 79 THR N N 15 114.090 0.300 . 1 . . . . 79 THR N . 10075 1
929 . 1 1 80 80 GLY H H 1 8.733 0.030 . 1 . . . . 80 GLY H . 10075 1
930 . 1 1 80 80 GLY HA2 H 1 4.139 0.030 . 2 . . . . 80 GLY HA2 . 10075 1
931 . 1 1 80 80 GLY HA3 H 1 3.937 0.030 . 2 . . . . 80 GLY HA3 . 10075 1
932 . 1 1 80 80 GLY C C 13 175.745 0.300 . 1 . . . . 80 GLY C . 10075 1
933 . 1 1 80 80 GLY CA C 13 46.177 0.300 . 1 . . . . 80 GLY CA . 10075 1
934 . 1 1 80 80 GLY N N 15 106.384 0.300 . 1 . . . . 80 GLY N . 10075 1
935 . 1 1 81 81 LEU H H 1 8.264 0.030 . 1 . . . . 81 LEU H . 10075 1
936 . 1 1 81 81 LEU HA H 1 4.375 0.030 . 1 . . . . 81 LEU HA . 10075 1
937 . 1 1 81 81 LEU HB2 H 1 1.425 0.030 . 2 . . . . 81 LEU HB2 . 10075 1
938 . 1 1 81 81 LEU HB3 H 1 1.175 0.030 . 2 . . . . 81 LEU HB3 . 10075 1
939 . 1 1 81 81 LEU HG H 1 0.806 0.030 . 1 . . . . 81 LEU HG . 10075 1
940 . 1 1 81 81 LEU HD11 H 1 -0.023 0.030 . 1 . . . . 81 LEU HD1 . 10075 1
941 . 1 1 81 81 LEU HD12 H 1 -0.023 0.030 . 1 . . . . 81 LEU HD1 . 10075 1
942 . 1 1 81 81 LEU HD13 H 1 -0.023 0.030 . 1 . . . . 81 LEU HD1 . 10075 1
943 . 1 1 81 81 LEU HD21 H 1 -0.329 0.030 . 1 . . . . 81 LEU HD2 . 10075 1
944 . 1 1 81 81 LEU HD22 H 1 -0.329 0.030 . 1 . . . . 81 LEU HD2 . 10075 1
945 . 1 1 81 81 LEU HD23 H 1 -0.329 0.030 . 1 . . . . 81 LEU HD2 . 10075 1
946 . 1 1 81 81 LEU C C 13 175.436 0.300 . 1 . . . . 81 LEU C . 10075 1
947 . 1 1 81 81 LEU CA C 13 53.510 0.300 . 1 . . . . 81 LEU CA . 10075 1
948 . 1 1 81 81 LEU CB C 13 40.120 0.300 . 1 . . . . 81 LEU CB . 10075 1
949 . 1 1 81 81 LEU CG C 13 26.012 0.300 . 1 . . . . 81 LEU CG . 10075 1
950 . 1 1 81 81 LEU CD1 C 13 24.351 0.300 . 2 . . . . 81 LEU CD1 . 10075 1
951 . 1 1 81 81 LEU CD2 C 13 18.370 0.300 . 2 . . . . 81 LEU CD2 . 10075 1
952 . 1 1 81 81 LEU N N 15 118.572 0.300 . 1 . . . . 81 LEU N . 10075 1
953 . 1 1 82 82 THR H H 1 8.311 0.030 . 1 . . . . 82 THR H . 10075 1
954 . 1 1 82 82 THR HA H 1 4.456 0.030 . 1 . . . . 82 THR HA . 10075 1
955 . 1 1 82 82 THR HB H 1 4.010 0.030 . 1 . . . . 82 THR HB . 10075 1
956 . 1 1 82 82 THR HG21 H 1 1.323 0.030 . 1 . . . . 82 THR HG2 . 10075 1
957 . 1 1 82 82 THR HG22 H 1 1.323 0.030 . 1 . . . . 82 THR HG2 . 10075 1
958 . 1 1 82 82 THR HG23 H 1 1.323 0.030 . 1 . . . . 82 THR HG2 . 10075 1
959 . 1 1 82 82 THR C C 13 174.029 0.300 . 1 . . . . 82 THR C . 10075 1
960 . 1 1 82 82 THR CA C 13 61.124 0.300 . 1 . . . . 82 THR CA . 10075 1
961 . 1 1 82 82 THR CB C 13 71.021 0.300 . 1 . . . . 82 THR CB . 10075 1
962 . 1 1 82 82 THR CG2 C 13 21.771 0.300 . 1 . . . . 82 THR CG2 . 10075 1
963 . 1 1 82 82 THR N N 15 115.229 0.300 . 1 . . . . 82 THR N . 10075 1
964 . 1 1 83 83 ALA H H 1 8.617 0.030 . 1 . . . . 83 ALA H . 10075 1
965 . 1 1 83 83 ALA HA H 1 4.506 0.030 . 1 . . . . 83 ALA HA . 10075 1
966 . 1 1 83 83 ALA HB1 H 1 1.464 0.030 . 1 . . . . 83 ALA HB . 10075 1
967 . 1 1 83 83 ALA HB2 H 1 1.464 0.030 . 1 . . . . 83 ALA HB . 10075 1
968 . 1 1 83 83 ALA HB3 H 1 1.464 0.030 . 1 . . . . 83 ALA HB . 10075 1
969 . 1 1 83 83 ALA C C 13 177.943 0.300 . 1 . . . . 83 ALA C . 10075 1
970 . 1 1 83 83 ALA CA C 13 53.467 0.300 . 1 . . . . 83 ALA CA . 10075 1
971 . 1 1 83 83 ALA CB C 13 19.761 0.300 . 1 . . . . 83 ALA CB . 10075 1
972 . 1 1 83 83 ALA N N 15 128.160 0.300 . 1 . . . . 83 ALA N . 10075 1
973 . 1 1 84 84 LEU H H 1 8.240 0.030 . 1 . . . . 84 LEU H . 10075 1
974 . 1 1 84 84 LEU HA H 1 3.677 0.030 . 1 . . . . 84 LEU HA . 10075 1
975 . 1 1 84 84 LEU HB2 H 1 1.688 0.030 . 2 . . . . 84 LEU HB2 . 10075 1
976 . 1 1 84 84 LEU HB3 H 1 1.550 0.030 . 2 . . . . 84 LEU HB3 . 10075 1
977 . 1 1 84 84 LEU HG H 1 1.553 0.030 . 1 . . . . 84 LEU HG . 10075 1
978 . 1 1 84 84 LEU HD11 H 1 0.897 0.030 . 1 . . . . 84 LEU HD1 . 10075 1
979 . 1 1 84 84 LEU HD12 H 1 0.897 0.030 . 1 . . . . 84 LEU HD1 . 10075 1
980 . 1 1 84 84 LEU HD13 H 1 0.897 0.030 . 1 . . . . 84 LEU HD1 . 10075 1
981 . 1 1 84 84 LEU HD21 H 1 0.820 0.030 . 1 . . . . 84 LEU HD2 . 10075 1
982 . 1 1 84 84 LEU HD22 H 1 0.820 0.030 . 1 . . . . 84 LEU HD2 . 10075 1
983 . 1 1 84 84 LEU HD23 H 1 0.820 0.030 . 1 . . . . 84 LEU HD2 . 10075 1
984 . 1 1 84 84 LEU C C 13 175.373 0.300 . 1 . . . . 84 LEU C . 10075 1
985 . 1 1 84 84 LEU CA C 13 55.262 0.300 . 1 . . . . 84 LEU CA . 10075 1
986 . 1 1 84 84 LEU CB C 13 40.641 0.300 . 1 . . . . 84 LEU CB . 10075 1
987 . 1 1 84 84 LEU CG C 13 26.788 0.300 . 1 . . . . 84 LEU CG . 10075 1
988 . 1 1 84 84 LEU CD1 C 13 25.418 0.300 . 2 . . . . 84 LEU CD1 . 10075 1
989 . 1 1 84 84 LEU CD2 C 13 23.192 0.300 . 2 . . . . 84 LEU CD2 . 10075 1
990 . 1 1 84 84 LEU N N 15 123.307 0.300 . 1 . . . . 84 LEU N . 10075 1
991 . 1 1 85 85 THR H H 1 8.295 0.030 . 1 . . . . 85 THR H . 10075 1
992 . 1 1 85 85 THR HA H 1 4.463 0.030 . 1 . . . . 85 THR HA . 10075 1
993 . 1 1 85 85 THR HB H 1 4.110 0.030 . 1 . . . . 85 THR HB . 10075 1
994 . 1 1 85 85 THR HG21 H 1 0.771 0.030 . 1 . . . . 85 THR HG2 . 10075 1
995 . 1 1 85 85 THR HG22 H 1 0.771 0.030 . 1 . . . . 85 THR HG2 . 10075 1
996 . 1 1 85 85 THR HG23 H 1 0.771 0.030 . 1 . . . . 85 THR HG2 . 10075 1
997 . 1 1 85 85 THR C C 13 171.884 0.300 . 1 . . . . 85 THR C . 10075 1
998 . 1 1 85 85 THR CA C 13 62.468 0.300 . 1 . . . . 85 THR CA . 10075 1
999 . 1 1 85 85 THR CB C 13 70.910 0.300 . 1 . . . . 85 THR CB . 10075 1
1000 . 1 1 85 85 THR CG2 C 13 19.423 0.300 . 1 . . . . 85 THR CG2 . 10075 1
1001 . 1 1 85 85 THR N N 15 116.007 0.300 . 1 . . . . 85 THR N . 10075 1
1002 . 1 1 86 86 THR H H 1 8.441 0.030 . 1 . . . . 86 THR H . 10075 1
1003 . 1 1 86 86 THR HA H 1 4.654 0.030 . 1 . . . . 86 THR HA . 10075 1
1004 . 1 1 86 86 THR HB H 1 3.797 0.030 . 1 . . . . 86 THR HB . 10075 1
1005 . 1 1 86 86 THR HG21 H 1 0.852 0.030 . 1 . . . . 86 THR HG2 . 10075 1
1006 . 1 1 86 86 THR HG22 H 1 0.852 0.030 . 1 . . . . 86 THR HG2 . 10075 1
1007 . 1 1 86 86 THR HG23 H 1 0.852 0.030 . 1 . . . . 86 THR HG2 . 10075 1
1008 . 1 1 86 86 THR C C 13 173.082 0.300 . 1 . . . . 86 THR C . 10075 1
1009 . 1 1 86 86 THR CA C 13 63.195 0.300 . 1 . . . . 86 THR CA . 10075 1
1010 . 1 1 86 86 THR CB C 13 68.728 0.300 . 1 . . . . 86 THR CB . 10075 1
1011 . 1 1 86 86 THR CG2 C 13 22.042 0.300 . 1 . . . . 86 THR CG2 . 10075 1
1012 . 1 1 86 86 THR N N 15 122.524 0.300 . 1 . . . . 86 THR N . 10075 1
1013 . 1 1 87 87 TYR H H 1 9.428 0.030 . 1 . . . . 87 TYR H . 10075 1
1014 . 1 1 87 87 TYR HA H 1 5.226 0.030 . 1 . . . . 87 TYR HA . 10075 1
1015 . 1 1 87 87 TYR HB2 H 1 2.847 0.030 . 2 . . . . 87 TYR HB2 . 10075 1
1016 . 1 1 87 87 TYR HB3 H 1 2.530 0.030 . 2 . . . . 87 TYR HB3 . 10075 1
1017 . 1 1 87 87 TYR HD1 H 1 6.936 0.030 . 1 . . . . 87 TYR HD1 . 10075 1
1018 . 1 1 87 87 TYR HD2 H 1 6.936 0.030 . 1 . . . . 87 TYR HD2 . 10075 1
1019 . 1 1 87 87 TYR HE1 H 1 6.901 0.030 . 1 . . . . 87 TYR HE1 . 10075 1
1020 . 1 1 87 87 TYR HE2 H 1 6.901 0.030 . 1 . . . . 87 TYR HE2 . 10075 1
1021 . 1 1 87 87 TYR C C 13 175.178 0.300 . 1 . . . . 87 TYR C . 10075 1
1022 . 1 1 87 87 TYR CA C 13 57.953 0.300 . 1 . . . . 87 TYR CA . 10075 1
1023 . 1 1 87 87 TYR CB C 13 42.686 0.300 . 1 . . . . 87 TYR CB . 10075 1
1024 . 1 1 87 87 TYR CD1 C 13 132.891 0.300 . 1 . . . . 87 TYR CD1 . 10075 1
1025 . 1 1 87 87 TYR CD2 C 13 132.891 0.300 . 1 . . . . 87 TYR CD2 . 10075 1
1026 . 1 1 87 87 TYR CE1 C 13 118.749 0.300 . 1 . . . . 87 TYR CE1 . 10075 1
1027 . 1 1 87 87 TYR CE2 C 13 118.749 0.300 . 1 . . . . 87 TYR CE2 . 10075 1
1028 . 1 1 87 87 TYR N N 15 126.620 0.300 . 1 . . . . 87 TYR N . 10075 1
1029 . 1 1 88 88 THR H H 1 9.218 0.030 . 1 . . . . 88 THR H . 10075 1
1030 . 1 1 88 88 THR HA H 1 4.962 0.030 . 1 . . . . 88 THR HA . 10075 1
1031 . 1 1 88 88 THR HB H 1 4.005 0.030 . 1 . . . . 88 THR HB . 10075 1
1032 . 1 1 88 88 THR HG21 H 1 1.187 0.030 . 1 . . . . 88 THR HG2 . 10075 1
1033 . 1 1 88 88 THR HG22 H 1 1.187 0.030 . 1 . . . . 88 THR HG2 . 10075 1
1034 . 1 1 88 88 THR HG23 H 1 1.187 0.030 . 1 . . . . 88 THR HG2 . 10075 1
1035 . 1 1 88 88 THR C C 13 174.368 0.300 . 1 . . . . 88 THR C . 10075 1
1036 . 1 1 88 88 THR CA C 13 62.523 0.300 . 1 . . . . 88 THR CA . 10075 1
1037 . 1 1 88 88 THR CB C 13 70.047 0.300 . 1 . . . . 88 THR CB . 10075 1
1038 . 1 1 88 88 THR CG2 C 13 22.771 0.300 . 1 . . . . 88 THR CG2 . 10075 1
1039 . 1 1 88 88 THR N N 15 118.054 0.300 . 1 . . . . 88 THR N . 10075 1
1040 . 1 1 89 89 ILE H H 1 9.070 0.030 . 1 . . . . 89 ILE H . 10075 1
1041 . 1 1 89 89 ILE HA H 1 5.272 0.030 . 1 . . . . 89 ILE HA . 10075 1
1042 . 1 1 89 89 ILE HB H 1 1.942 0.030 . 1 . . . . 89 ILE HB . 10075 1
1043 . 1 1 89 89 ILE HG12 H 1 1.642 0.030 . 2 . . . . 89 ILE HG12 . 10075 1
1044 . 1 1 89 89 ILE HG13 H 1 1.419 0.030 . 2 . . . . 89 ILE HG13 . 10075 1
1045 . 1 1 89 89 ILE HG21 H 1 1.144 0.030 . 1 . . . . 89 ILE HG2 . 10075 1
1046 . 1 1 89 89 ILE HG22 H 1 1.144 0.030 . 1 . . . . 89 ILE HG2 . 10075 1
1047 . 1 1 89 89 ILE HG23 H 1 1.144 0.030 . 1 . . . . 89 ILE HG2 . 10075 1
1048 . 1 1 89 89 ILE HD11 H 1 0.714 0.030 . 1 . . . . 89 ILE HD1 . 10075 1
1049 . 1 1 89 89 ILE HD12 H 1 0.714 0.030 . 1 . . . . 89 ILE HD1 . 10075 1
1050 . 1 1 89 89 ILE HD13 H 1 0.714 0.030 . 1 . . . . 89 ILE HD1 . 10075 1
1051 . 1 1 89 89 ILE C C 13 173.841 0.300 . 1 . . . . 89 ILE C . 10075 1
1052 . 1 1 89 89 ILE CA C 13 60.050 0.300 . 1 . . . . 89 ILE CA . 10075 1
1053 . 1 1 89 89 ILE CB C 13 39.910 0.300 . 1 . . . . 89 ILE CB . 10075 1
1054 . 1 1 89 89 ILE CG1 C 13 28.911 0.300 . 1 . . . . 89 ILE CG1 . 10075 1
1055 . 1 1 89 89 ILE CG2 C 13 17.706 0.300 . 1 . . . . 89 ILE CG2 . 10075 1
1056 . 1 1 89 89 ILE CD1 C 13 13.738 0.300 . 1 . . . . 89 ILE CD1 . 10075 1
1057 . 1 1 89 89 ILE N N 15 129.002 0.300 . 1 . . . . 89 ILE N . 10075 1
1058 . 1 1 90 90 GLU H H 1 9.075 0.030 . 1 . . . . 90 GLU H . 10075 1
1059 . 1 1 90 90 GLU HA H 1 5.448 0.030 . 1 . . . . 90 GLU HA . 10075 1
1060 . 1 1 90 90 GLU HB2 H 1 1.824 0.030 . 2 . . . . 90 GLU HB2 . 10075 1
1061 . 1 1 90 90 GLU HB3 H 1 1.727 0.030 . 2 . . . . 90 GLU HB3 . 10075 1
1062 . 1 1 90 90 GLU HG2 H 1 2.153 0.030 . 2 . . . . 90 GLU HG2 . 10075 1
1063 . 1 1 90 90 GLU HG3 H 1 2.033 0.030 . 2 . . . . 90 GLU HG3 . 10075 1
1064 . 1 1 90 90 GLU C C 13 175.459 0.300 . 1 . . . . 90 GLU C . 10075 1
1065 . 1 1 90 90 GLU CA C 13 53.960 0.300 . 1 . . . . 90 GLU CA . 10075 1
1066 . 1 1 90 90 GLU CB C 13 35.032 0.300 . 1 . . . . 90 GLU CB . 10075 1
1067 . 1 1 90 90 GLU CG C 13 36.543 0.300 . 1 . . . . 90 GLU CG . 10075 1
1068 . 1 1 90 90 GLU N N 15 124.253 0.300 . 1 . . . . 90 GLU N . 10075 1
1069 . 1 1 91 91 VAL H H 1 8.543 0.030 . 1 . . . . 91 VAL H . 10075 1
1070 . 1 1 91 91 VAL HA H 1 5.052 0.030 . 1 . . . . 91 VAL HA . 10075 1
1071 . 1 1 91 91 VAL HB H 1 1.213 0.030 . 1 . . . . 91 VAL HB . 10075 1
1072 . 1 1 91 91 VAL HG11 H 1 0.296 0.030 . 1 . . . . 91 VAL HG1 . 10075 1
1073 . 1 1 91 91 VAL HG12 H 1 0.296 0.030 . 1 . . . . 91 VAL HG1 . 10075 1
1074 . 1 1 91 91 VAL HG13 H 1 0.296 0.030 . 1 . . . . 91 VAL HG1 . 10075 1
1075 . 1 1 91 91 VAL HG21 H 1 -0.450 0.030 . 1 . . . . 91 VAL HG2 . 10075 1
1076 . 1 1 91 91 VAL HG22 H 1 -0.450 0.030 . 1 . . . . 91 VAL HG2 . 10075 1
1077 . 1 1 91 91 VAL HG23 H 1 -0.450 0.030 . 1 . . . . 91 VAL HG2 . 10075 1
1078 . 1 1 91 91 VAL C C 13 175.695 0.300 . 1 . . . . 91 VAL C . 10075 1
1079 . 1 1 91 91 VAL CA C 13 60.768 0.300 . 1 . . . . 91 VAL CA . 10075 1
1080 . 1 1 91 91 VAL CB C 13 35.668 0.300 . 1 . . . . 91 VAL CB . 10075 1
1081 . 1 1 91 91 VAL CG1 C 13 21.942 0.300 . 2 . . . . 91 VAL CG1 . 10075 1
1082 . 1 1 91 91 VAL CG2 C 13 19.942 0.300 . 2 . . . . 91 VAL CG2 . 10075 1
1083 . 1 1 91 91 VAL N N 15 118.555 0.300 . 1 . . . . 91 VAL N . 10075 1
1084 . 1 1 92 92 ALA H H 1 9.001 0.030 . 1 . . . . 92 ALA H . 10075 1
1085 . 1 1 92 92 ALA HA H 1 4.703 0.030 . 1 . . . . 92 ALA HA . 10075 1
1086 . 1 1 92 92 ALA HB1 H 1 1.282 0.030 . 1 . . . . 92 ALA HB . 10075 1
1087 . 1 1 92 92 ALA HB2 H 1 1.282 0.030 . 1 . . . . 92 ALA HB . 10075 1
1088 . 1 1 92 92 ALA HB3 H 1 1.282 0.030 . 1 . . . . 92 ALA HB . 10075 1
1089 . 1 1 92 92 ALA C C 13 175.048 0.300 . 1 . . . . 92 ALA C . 10075 1
1090 . 1 1 92 92 ALA CA C 13 51.093 0.300 . 1 . . . . 92 ALA CA . 10075 1
1091 . 1 1 92 92 ALA CB C 13 23.611 0.300 . 1 . . . . 92 ALA CB . 10075 1
1092 . 1 1 92 92 ALA N N 15 129.999 0.300 . 1 . . . . 92 ALA N . 10075 1
1093 . 1 1 93 93 ALA H H 1 9.558 0.030 . 1 . . . . 93 ALA H . 10075 1
1094 . 1 1 93 93 ALA HA H 1 4.705 0.030 . 1 . . . . 93 ALA HA . 10075 1
1095 . 1 1 93 93 ALA HB1 H 1 1.386 0.030 . 1 . . . . 93 ALA HB . 10075 1
1096 . 1 1 93 93 ALA HB2 H 1 1.386 0.030 . 1 . . . . 93 ALA HB . 10075 1
1097 . 1 1 93 93 ALA HB3 H 1 1.386 0.030 . 1 . . . . 93 ALA HB . 10075 1
1098 . 1 1 93 93 ALA C C 13 175.411 0.300 . 1 . . . . 93 ALA C . 10075 1
1099 . 1 1 93 93 ALA CA C 13 51.120 0.300 . 1 . . . . 93 ALA CA . 10075 1
1100 . 1 1 93 93 ALA CB C 13 21.355 0.300 . 1 . . . . 93 ALA CB . 10075 1
1101 . 1 1 93 93 ALA N N 15 124.562 0.300 . 1 . . . . 93 ALA N . 10075 1
1102 . 1 1 94 94 MET H H 1 7.981 0.030 . 1 . . . . 94 MET H . 10075 1
1103 . 1 1 94 94 MET HA H 1 5.144 0.030 . 1 . . . . 94 MET HA . 10075 1
1104 . 1 1 94 94 MET HB2 H 1 1.880 0.030 . 2 . . . . 94 MET HB2 . 10075 1
1105 . 1 1 94 94 MET HB3 H 1 1.600 0.030 . 2 . . . . 94 MET HB3 . 10075 1
1106 . 1 1 94 94 MET HG2 H 1 2.263 0.030 . 2 . . . . 94 MET HG2 . 10075 1
1107 . 1 1 94 94 MET HG3 H 1 2.162 0.030 . 2 . . . . 94 MET HG3 . 10075 1
1108 . 1 1 94 94 MET HE1 H 1 1.898 0.030 . 1 . . . . 94 MET HE . 10075 1
1109 . 1 1 94 94 MET HE2 H 1 1.898 0.030 . 1 . . . . 94 MET HE . 10075 1
1110 . 1 1 94 94 MET HE3 H 1 1.898 0.030 . 1 . . . . 94 MET HE . 10075 1
1111 . 1 1 94 94 MET C C 13 175.594 0.300 . 1 . . . . 94 MET C . 10075 1
1112 . 1 1 94 94 MET CA C 13 54.534 0.300 . 1 . . . . 94 MET CA . 10075 1
1113 . 1 1 94 94 MET CB C 13 35.957 0.300 . 1 . . . . 94 MET CB . 10075 1
1114 . 1 1 94 94 MET CG C 13 31.153 0.300 . 1 . . . . 94 MET CG . 10075 1
1115 . 1 1 94 94 MET CE C 13 16.247 0.300 . 1 . . . . 94 MET CE . 10075 1
1116 . 1 1 94 94 MET N N 15 116.249 0.300 . 1 . . . . 94 MET N . 10075 1
1117 . 1 1 95 95 THR H H 1 8.226 0.030 . 1 . . . . 95 THR H . 10075 1
1118 . 1 1 95 95 THR HA H 1 5.028 0.030 . 1 . . . . 95 THR HA . 10075 1
1119 . 1 1 95 95 THR HB H 1 4.653 0.030 . 1 . . . . 95 THR HB . 10075 1
1120 . 1 1 95 95 THR HG21 H 1 1.071 0.030 . 1 . . . . 95 THR HG2 . 10075 1
1121 . 1 1 95 95 THR HG22 H 1 1.071 0.030 . 1 . . . . 95 THR HG2 . 10075 1
1122 . 1 1 95 95 THR HG23 H 1 1.071 0.030 . 1 . . . . 95 THR HG2 . 10075 1
1123 . 1 1 95 95 THR C C 13 176.669 0.300 . 1 . . . . 95 THR C . 10075 1
1124 . 1 1 95 95 THR CA C 13 60.222 0.300 . 1 . . . . 95 THR CA . 10075 1
1125 . 1 1 95 95 THR CB C 13 73.200 0.300 . 1 . . . . 95 THR CB . 10075 1
1126 . 1 1 95 95 THR CG2 C 13 21.771 0.300 . 1 . . . . 95 THR CG2 . 10075 1
1127 . 1 1 95 95 THR N N 15 110.698 0.300 . 1 . . . . 95 THR N . 10075 1
1128 . 1 1 96 96 SER H H 1 9.674 0.030 . 1 . . . . 96 SER H . 10075 1
1129 . 1 1 96 96 SER HA H 1 4.178 0.030 . 1 . . . . 96 SER HA . 10075 1
1130 . 1 1 96 96 SER HB2 H 1 3.986 0.030 . 2 . . . . 96 SER HB2 . 10075 1
1131 . 1 1 96 96 SER HB3 H 1 3.935 0.030 . 2 . . . . 96 SER HB3 . 10075 1
1132 . 1 1 96 96 SER C C 13 175.462 0.300 . 1 . . . . 96 SER C . 10075 1
1133 . 1 1 96 96 SER CA C 13 61.160 0.300 . 1 . . . . 96 SER CA . 10075 1
1134 . 1 1 96 96 SER CB C 13 62.651 0.300 . 1 . . . . 96 SER CB . 10075 1
1135 . 1 1 96 96 SER N N 15 116.309 0.300 . 1 . . . . 96 SER N . 10075 1
1136 . 1 1 97 97 LYS H H 1 7.766 0.030 . 1 . . . . 97 LYS H . 10075 1
1137 . 1 1 97 97 LYS HA H 1 4.277 0.030 . 1 . . . . 97 LYS HA . 10075 1
1138 . 1 1 97 97 LYS HB2 H 1 1.769 0.030 . 2 . . . . 97 LYS HB2 . 10075 1
1139 . 1 1 97 97 LYS HB3 H 1 1.534 0.030 . 2 . . . . 97 LYS HB3 . 10075 1
1140 . 1 1 97 97 LYS HG2 H 1 1.425 0.030 . 2 . . . . 97 LYS HG2 . 10075 1
1141 . 1 1 97 97 LYS HG3 H 1 1.370 0.030 . 2 . . . . 97 LYS HG3 . 10075 1
1142 . 1 1 97 97 LYS HD2 H 1 1.647 0.030 . 1 . . . . 97 LYS HD2 . 10075 1
1143 . 1 1 97 97 LYS HD3 H 1 1.647 0.030 . 1 . . . . 97 LYS HD3 . 10075 1
1144 . 1 1 97 97 LYS HE2 H 1 2.977 0.030 . 1 . . . . 97 LYS HE2 . 10075 1
1145 . 1 1 97 97 LYS HE3 H 1 2.977 0.030 . 1 . . . . 97 LYS HE3 . 10075 1
1146 . 1 1 97 97 LYS C C 13 176.207 0.300 . 1 . . . . 97 LYS C . 10075 1
1147 . 1 1 97 97 LYS CA C 13 55.935 0.300 . 1 . . . . 97 LYS CA . 10075 1
1148 . 1 1 97 97 LYS CB C 13 32.645 0.300 . 1 . . . . 97 LYS CB . 10075 1
1149 . 1 1 97 97 LYS CG C 13 24.932 0.300 . 1 . . . . 97 LYS CG . 10075 1
1150 . 1 1 97 97 LYS CD C 13 28.338 0.300 . 1 . . . . 97 LYS CD . 10075 1
1151 . 1 1 97 97 LYS CE C 13 42.199 0.300 . 1 . . . . 97 LYS CE . 10075 1
1152 . 1 1 97 97 LYS N N 15 118.814 0.300 . 1 . . . . 97 LYS N . 10075 1
1153 . 1 1 98 98 GLY H H 1 7.522 0.030 . 1 . . . . 98 GLY H . 10075 1
1154 . 1 1 98 98 GLY HA2 H 1 4.427 0.030 . 2 . . . . 98 GLY HA2 . 10075 1
1155 . 1 1 98 98 GLY HA3 H 1 3.790 0.030 . 2 . . . . 98 GLY HA3 . 10075 1
1156 . 1 1 98 98 GLY C C 13 171.737 0.300 . 1 . . . . 98 GLY C . 10075 1
1157 . 1 1 98 98 GLY CA C 13 44.340 0.300 . 1 . . . . 98 GLY CA . 10075 1
1158 . 1 1 98 98 GLY N N 15 107.023 0.300 . 1 . . . . 98 GLY N . 10075 1
1159 . 1 1 99 99 GLN H H 1 8.322 0.030 . 1 . . . . 99 GLN H . 10075 1
1160 . 1 1 99 99 GLN HA H 1 4.750 0.030 . 1 . . . . 99 GLN HA . 10075 1
1161 . 1 1 99 99 GLN HB2 H 1 2.075 0.030 . 2 . . . . 99 GLN HB2 . 10075 1
1162 . 1 1 99 99 GLN HB3 H 1 1.930 0.030 . 2 . . . . 99 GLN HB3 . 10075 1
1163 . 1 1 99 99 GLN HG2 H 1 2.410 0.030 . 2 . . . . 99 GLN HG2 . 10075 1
1164 . 1 1 99 99 GLN HG3 H 1 2.357 0.030 . 2 . . . . 99 GLN HG3 . 10075 1
1165 . 1 1 99 99 GLN HE21 H 1 7.607 0.030 . 2 . . . . 99 GLN HE21 . 10075 1
1166 . 1 1 99 99 GLN HE22 H 1 6.991 0.030 . 2 . . . . 99 GLN HE22 . 10075 1
1167 . 1 1 99 99 GLN C C 13 176.821 0.300 . 1 . . . . 99 GLN C . 10075 1
1168 . 1 1 99 99 GLN CA C 13 55.537 0.300 . 1 . . . . 99 GLN CA . 10075 1
1169 . 1 1 99 99 GLN CB C 13 30.868 0.300 . 1 . . . . 99 GLN CB . 10075 1
1170 . 1 1 99 99 GLN CG C 13 34.512 0.300 . 1 . . . . 99 GLN CG . 10075 1
1171 . 1 1 99 99 GLN N N 15 117.880 0.300 . 1 . . . . 99 GLN N . 10075 1
1172 . 1 1 99 99 GLN NE2 N 15 111.929 0.300 . 1 . . . . 99 GLN NE2 . 10075 1
1173 . 1 1 100 100 GLY H H 1 8.858 0.030 . 1 . . . . 100 GLY H . 10075 1
1174 . 1 1 100 100 GLY HA2 H 1 4.230 0.030 . 2 . . . . 100 GLY HA2 . 10075 1
1175 . 1 1 100 100 GLY HA3 H 1 4.061 0.030 . 2 . . . . 100 GLY HA3 . 10075 1
1176 . 1 1 100 100 GLY C C 13 172.914 0.300 . 1 . . . . 100 GLY C . 10075 1
1177 . 1 1 100 100 GLY CA C 13 44.367 0.300 . 1 . . . . 100 GLY CA . 10075 1
1178 . 1 1 100 100 GLY N N 15 109.496 0.300 . 1 . . . . 100 GLY N . 10075 1
1179 . 1 1 101 101 GLN H H 1 7.616 0.030 . 1 . . . . 101 GLN H . 10075 1
1180 . 1 1 101 101 GLN HA H 1 4.130 0.030 . 1 . . . . 101 GLN HA . 10075 1
1181 . 1 1 101 101 GLN HB2 H 1 1.834 0.030 . 1 . . . . 101 GLN HB2 . 10075 1
1182 . 1 1 101 101 GLN HB3 H 1 1.834 0.030 . 1 . . . . 101 GLN HB3 . 10075 1
1183 . 1 1 101 101 GLN HG2 H 1 2.535 0.030 . 2 . . . . 101 GLN HG2 . 10075 1
1184 . 1 1 101 101 GLN HG3 H 1 2.451 0.030 . 2 . . . . 101 GLN HG3 . 10075 1
1185 . 1 1 101 101 GLN HE21 H 1 7.804 0.030 . 2 . . . . 101 GLN HE21 . 10075 1
1186 . 1 1 101 101 GLN HE22 H 1 7.006 0.030 . 2 . . . . 101 GLN HE22 . 10075 1
1187 . 1 1 101 101 GLN C C 13 177.488 0.300 . 1 . . . . 101 GLN C . 10075 1
1188 . 1 1 101 101 GLN CA C 13 56.441 0.300 . 1 . . . . 101 GLN CA . 10075 1
1189 . 1 1 101 101 GLN CB C 13 29.746 0.300 . 1 . . . . 101 GLN CB . 10075 1
1190 . 1 1 101 101 GLN CG C 13 33.880 0.300 . 1 . . . . 101 GLN CG . 10075 1
1191 . 1 1 101 101 GLN N N 15 116.498 0.300 . 1 . . . . 101 GLN N . 10075 1
1192 . 1 1 101 101 GLN NE2 N 15 113.076 0.300 . 1 . . . . 101 GLN NE2 . 10075 1
1193 . 1 1 102 102 VAL H H 1 8.859 0.030 . 1 . . . . 102 VAL H . 10075 1
1194 . 1 1 102 102 VAL HA H 1 4.029 0.030 . 1 . . . . 102 VAL HA . 10075 1
1195 . 1 1 102 102 VAL HB H 1 2.007 0.030 . 1 . . . . 102 VAL HB . 10075 1
1196 . 1 1 102 102 VAL HG11 H 1 0.952 0.030 . 1 . . . . 102 VAL HG1 . 10075 1
1197 . 1 1 102 102 VAL HG12 H 1 0.952 0.030 . 1 . . . . 102 VAL HG1 . 10075 1
1198 . 1 1 102 102 VAL HG13 H 1 0.952 0.030 . 1 . . . . 102 VAL HG1 . 10075 1
1199 . 1 1 102 102 VAL HG21 H 1 0.844 0.030 . 1 . . . . 102 VAL HG2 . 10075 1
1200 . 1 1 102 102 VAL HG22 H 1 0.844 0.030 . 1 . . . . 102 VAL HG2 . 10075 1
1201 . 1 1 102 102 VAL HG23 H 1 0.844 0.030 . 1 . . . . 102 VAL HG2 . 10075 1
1202 . 1 1 102 102 VAL C C 13 175.286 0.300 . 1 . . . . 102 VAL C . 10075 1
1203 . 1 1 102 102 VAL CA C 13 63.155 0.300 . 1 . . . . 102 VAL CA . 10075 1
1204 . 1 1 102 102 VAL CB C 13 33.521 0.300 . 1 . . . . 102 VAL CB . 10075 1
1205 . 1 1 102 102 VAL CG1 C 13 22.257 0.300 . 2 . . . . 102 VAL CG1 . 10075 1
1206 . 1 1 102 102 VAL CG2 C 13 21.606 0.300 . 2 . . . . 102 VAL CG2 . 10075 1
1207 . 1 1 102 102 VAL N N 15 126.741 0.300 . 1 . . . . 102 VAL N . 10075 1
1208 . 1 1 103 103 SER H H 1 8.016 0.030 . 1 . . . . 103 SER H . 10075 1
1209 . 1 1 103 103 SER HA H 1 4.840 0.030 . 1 . . . . 103 SER HA . 10075 1
1210 . 1 1 103 103 SER HB2 H 1 3.900 0.030 . 2 . . . . 103 SER HB2 . 10075 1
1211 . 1 1 103 103 SER HB3 H 1 3.710 0.030 . 2 . . . . 103 SER HB3 . 10075 1
1212 . 1 1 103 103 SER C C 13 171.560 0.300 . 1 . . . . 103 SER C . 10075 1
1213 . 1 1 103 103 SER CA C 13 57.814 0.300 . 1 . . . . 103 SER CA . 10075 1
1214 . 1 1 103 103 SER CB C 13 64.919 0.300 . 1 . . . . 103 SER CB . 10075 1
1215 . 1 1 103 103 SER N N 15 122.156 0.300 . 1 . . . . 103 SER N . 10075 1
1216 . 1 1 104 104 ALA H H 1 8.709 0.030 . 1 . . . . 104 ALA H . 10075 1
1217 . 1 1 104 104 ALA HA H 1 5.899 0.030 . 1 . . . . 104 ALA HA . 10075 1
1218 . 1 1 104 104 ALA HB1 H 1 1.351 0.030 . 1 . . . . 104 ALA HB . 10075 1
1219 . 1 1 104 104 ALA HB2 H 1 1.351 0.030 . 1 . . . . 104 ALA HB . 10075 1
1220 . 1 1 104 104 ALA HB3 H 1 1.351 0.030 . 1 . . . . 104 ALA HB . 10075 1
1221 . 1 1 104 104 ALA C C 13 177.503 0.300 . 1 . . . . 104 ALA C . 10075 1
1222 . 1 1 104 104 ALA CA C 13 50.338 0.300 . 1 . . . . 104 ALA CA . 10075 1
1223 . 1 1 104 104 ALA CB C 13 23.941 0.300 . 1 . . . . 104 ALA CB . 10075 1
1224 . 1 1 104 104 ALA N N 15 127.520 0.300 . 1 . . . . 104 ALA N . 10075 1
1225 . 1 1 105 105 SER H H 1 8.990 0.030 . 1 . . . . 105 SER H . 10075 1
1226 . 1 1 105 105 SER HA H 1 4.832 0.030 . 1 . . . . 105 SER HA . 10075 1
1227 . 1 1 105 105 SER HB2 H 1 3.939 0.030 . 2 . . . . 105 SER HB2 . 10075 1
1228 . 1 1 105 105 SER HB3 H 1 3.849 0.030 . 2 . . . . 105 SER HB3 . 10075 1
1229 . 1 1 105 105 SER C C 13 172.775 0.300 . 1 . . . . 105 SER C . 10075 1
1230 . 1 1 105 105 SER CA C 13 57.893 0.300 . 1 . . . . 105 SER CA . 10075 1
1231 . 1 1 105 105 SER CB C 13 66.808 0.300 . 1 . . . . 105 SER CB . 10075 1
1232 . 1 1 105 105 SER N N 15 115.154 0.300 . 1 . . . . 105 SER N . 10075 1
1233 . 1 1 106 106 THR H H 1 8.242 0.030 . 1 . . . . 106 THR H . 10075 1
1234 . 1 1 106 106 THR HA H 1 5.658 0.030 . 1 . . . . 106 THR HA . 10075 1
1235 . 1 1 106 106 THR HB H 1 3.831 0.030 . 1 . . . . 106 THR HB . 10075 1
1236 . 1 1 106 106 THR HG21 H 1 1.020 0.030 . 1 . . . . 106 THR HG2 . 10075 1
1237 . 1 1 106 106 THR HG22 H 1 1.020 0.030 . 1 . . . . 106 THR HG2 . 10075 1
1238 . 1 1 106 106 THR HG23 H 1 1.020 0.030 . 1 . . . . 106 THR HG2 . 10075 1
1239 . 1 1 106 106 THR C C 13 173.631 0.300 . 1 . . . . 106 THR C . 10075 1
1240 . 1 1 106 106 THR CA C 13 60.697 0.300 . 1 . . . . 106 THR CA . 10075 1
1241 . 1 1 106 106 THR CB C 13 71.145 0.300 . 1 . . . . 106 THR CB . 10075 1
1242 . 1 1 106 106 THR CG2 C 13 22.247 0.300 . 1 . . . . 106 THR CG2 . 10075 1
1243 . 1 1 106 106 THR N N 15 116.620 0.300 . 1 . . . . 106 THR N . 10075 1
1244 . 1 1 107 107 ILE H H 1 9.034 0.030 . 1 . . . . 107 ILE H . 10075 1
1245 . 1 1 107 107 ILE HA H 1 4.493 0.030 . 1 . . . . 107 ILE HA . 10075 1
1246 . 1 1 107 107 ILE HB H 1 1.117 0.030 . 1 . . . . 107 ILE HB . 10075 1
1247 . 1 1 107 107 ILE HG12 H 1 1.047 0.030 . 2 . . . . 107 ILE HG12 . 10075 1
1248 . 1 1 107 107 ILE HG13 H 1 0.622 0.030 . 2 . . . . 107 ILE HG13 . 10075 1
1249 . 1 1 107 107 ILE HG21 H 1 0.216 0.030 . 1 . . . . 107 ILE HG2 . 10075 1
1250 . 1 1 107 107 ILE HG22 H 1 0.216 0.030 . 1 . . . . 107 ILE HG2 . 10075 1
1251 . 1 1 107 107 ILE HG23 H 1 0.216 0.030 . 1 . . . . 107 ILE HG2 . 10075 1
1252 . 1 1 107 107 ILE HD11 H 1 0.699 0.030 . 1 . . . . 107 ILE HD1 . 10075 1
1253 . 1 1 107 107 ILE HD12 H 1 0.699 0.030 . 1 . . . . 107 ILE HD1 . 10075 1
1254 . 1 1 107 107 ILE HD13 H 1 0.699 0.030 . 1 . . . . 107 ILE HD1 . 10075 1
1255 . 1 1 107 107 ILE C C 13 172.151 0.300 . 1 . . . . 107 ILE C . 10075 1
1256 . 1 1 107 107 ILE CA C 13 57.377 0.300 . 1 . . . . 107 ILE CA . 10075 1
1257 . 1 1 107 107 ILE CB C 13 41.538 0.300 . 1 . . . . 107 ILE CB . 10075 1
1258 . 1 1 107 107 ILE CG1 C 13 27.998 0.300 . 1 . . . . 107 ILE CG1 . 10075 1
1259 . 1 1 107 107 ILE CG2 C 13 17.904 0.300 . 1 . . . . 107 ILE CG2 . 10075 1
1260 . 1 1 107 107 ILE CD1 C 13 14.009 0.300 . 1 . . . . 107 ILE CD1 . 10075 1
1261 . 1 1 107 107 ILE N N 15 122.535 0.300 . 1 . . . . 107 ILE N . 10075 1
1262 . 1 1 108 108 SER H H 1 7.676 0.030 . 1 . . . . 108 SER H . 10075 1
1263 . 1 1 108 108 SER HA H 1 5.614 0.030 . 1 . . . . 108 SER HA . 10075 1
1264 . 1 1 108 108 SER HB2 H 1 3.652 0.030 . 2 . . . . 108 SER HB2 . 10075 1
1265 . 1 1 108 108 SER HB3 H 1 3.535 0.030 . 2 . . . . 108 SER HB3 . 10075 1
1266 . 1 1 108 108 SER C C 13 174.778 0.300 . 1 . . . . 108 SER C . 10075 1
1267 . 1 1 108 108 SER CA C 13 56.081 0.300 . 1 . . . . 108 SER CA . 10075 1
1268 . 1 1 108 108 SER CB C 13 64.438 0.300 . 1 . . . . 108 SER CB . 10075 1
1269 . 1 1 108 108 SER N N 15 118.442 0.300 . 1 . . . . 108 SER N . 10075 1
1270 . 1 1 109 109 SER H H 1 9.184 0.030 . 1 . . . . 109 SER H . 10075 1
1271 . 1 1 109 109 SER HA H 1 4.215 0.030 . 1 . . . . 109 SER HA . 10075 1
1272 . 1 1 109 109 SER HB2 H 1 4.484 0.030 . 2 . . . . 109 SER HB2 . 10075 1
1273 . 1 1 109 109 SER HB3 H 1 3.790 0.030 . 2 . . . . 109 SER HB3 . 10075 1
1274 . 1 1 109 109 SER C C 13 174.952 0.300 . 1 . . . . 109 SER C . 10075 1
1275 . 1 1 109 109 SER CA C 13 58.118 0.300 . 1 . . . . 109 SER CA . 10075 1
1276 . 1 1 109 109 SER CB C 13 63.657 0.300 . 1 . . . . 109 SER CB . 10075 1
1277 . 1 1 109 109 SER N N 15 119.722 0.300 . 1 . . . . 109 SER N . 10075 1
1278 . 1 1 110 110 GLY H H 1 8.153 0.030 . 1 . . . . 110 GLY H . 10075 1
1279 . 1 1 110 110 GLY HA2 H 1 4.229 0.030 . 2 . . . . 110 GLY HA2 . 10075 1
1280 . 1 1 110 110 GLY HA3 H 1 3.530 0.030 . 2 . . . . 110 GLY HA3 . 10075 1
1281 . 1 1 110 110 GLY C C 13 172.517 0.300 . 1 . . . . 110 GLY C . 10075 1
1282 . 1 1 110 110 GLY CA C 13 44.286 0.300 . 1 . . . . 110 GLY CA . 10075 1
1283 . 1 1 110 110 GLY N N 15 106.369 0.300 . 1 . . . . 110 GLY N . 10075 1
1284 . 1 1 111 111 VAL H H 1 7.665 0.030 . 1 . . . . 111 VAL H . 10075 1
1285 . 1 1 111 111 VAL HA H 1 4.398 0.030 . 1 . . . . 111 VAL HA . 10075 1
1286 . 1 1 111 111 VAL HB H 1 2.162 0.030 . 1 . . . . 111 VAL HB . 10075 1
1287 . 1 1 111 111 VAL HG11 H 1 1.030 0.030 . 1 . . . . 111 VAL HG1 . 10075 1
1288 . 1 1 111 111 VAL HG12 H 1 1.030 0.030 . 1 . . . . 111 VAL HG1 . 10075 1
1289 . 1 1 111 111 VAL HG13 H 1 1.030 0.030 . 1 . . . . 111 VAL HG1 . 10075 1
1290 . 1 1 111 111 VAL HG21 H 1 0.924 0.030 . 1 . . . . 111 VAL HG2 . 10075 1
1291 . 1 1 111 111 VAL HG22 H 1 0.924 0.030 . 1 . . . . 111 VAL HG2 . 10075 1
1292 . 1 1 111 111 VAL HG23 H 1 0.924 0.030 . 1 . . . . 111 VAL HG2 . 10075 1
1293 . 1 1 111 111 VAL C C 13 173.947 0.300 . 1 . . . . 111 VAL C . 10075 1
1294 . 1 1 111 111 VAL CA C 13 59.132 0.300 . 1 . . . . 111 VAL CA . 10075 1
1295 . 1 1 111 111 VAL CB C 13 32.475 0.300 . 1 . . . . 111 VAL CB . 10075 1
1296 . 1 1 111 111 VAL CG1 C 13 21.665 0.300 . 2 . . . . 111 VAL CG1 . 10075 1
1297 . 1 1 111 111 VAL CG2 C 13 19.652 0.300 . 2 . . . . 111 VAL CG2 . 10075 1
1298 . 1 1 111 111 VAL N N 15 113.742 0.300 . 1 . . . . 111 VAL N . 10075 1
1299 . 1 1 112 112 PRO HA H 1 4.688 0.030 . 1 . . . . 112 PRO HA . 10075 1
1300 . 1 1 112 112 PRO HB2 H 1 2.326 0.030 . 2 . . . . 112 PRO HB2 . 10075 1
1301 . 1 1 112 112 PRO HB3 H 1 1.905 0.030 . 2 . . . . 112 PRO HB3 . 10075 1
1302 . 1 1 112 112 PRO HG2 H 1 2.065 0.030 . 2 . . . . 112 PRO HG2 . 10075 1
1303 . 1 1 112 112 PRO HG3 H 1 2.002 0.030 . 2 . . . . 112 PRO HG3 . 10075 1
1304 . 1 1 112 112 PRO HD2 H 1 3.720 0.030 . 2 . . . . 112 PRO HD2 . 10075 1
1305 . 1 1 112 112 PRO HD3 H 1 3.680 0.030 . 2 . . . . 112 PRO HD3 . 10075 1
1306 . 1 1 112 112 PRO CA C 13 61.472 0.300 . 1 . . . . 112 PRO CA . 10075 1
1307 . 1 1 112 112 PRO CB C 13 30.776 0.300 . 1 . . . . 112 PRO CB . 10075 1
1308 . 1 1 112 112 PRO CG C 13 27.420 0.300 . 1 . . . . 112 PRO CG . 10075 1
1309 . 1 1 112 112 PRO CD C 13 50.619 0.300 . 1 . . . . 112 PRO CD . 10075 1
1310 . 1 1 113 113 PRO HA H 1 4.471 0.030 . 1 . . . . 113 PRO HA . 10075 1
1311 . 1 1 113 113 PRO HB2 H 1 2.327 0.030 . 2 . . . . 113 PRO HB2 . 10075 1
1312 . 1 1 113 113 PRO HB3 H 1 1.968 0.030 . 2 . . . . 113 PRO HB3 . 10075 1
1313 . 1 1 113 113 PRO HG2 H 1 2.060 0.030 . 1 . . . . 113 PRO HG2 . 10075 1
1314 . 1 1 113 113 PRO HG3 H 1 2.060 0.030 . 1 . . . . 113 PRO HG3 . 10075 1
1315 . 1 1 113 113 PRO HD2 H 1 3.837 0.030 . 2 . . . . 113 PRO HD2 . 10075 1
1316 . 1 1 113 113 PRO HD3 H 1 3.662 0.030 . 2 . . . . 113 PRO HD3 . 10075 1
1317 . 1 1 113 113 PRO C C 13 177.056 0.300 . 1 . . . . 113 PRO C . 10075 1
1318 . 1 1 113 113 PRO CA C 13 63.106 0.300 . 1 . . . . 113 PRO CA . 10075 1
1319 . 1 1 113 113 PRO CB C 13 32.093 0.300 . 1 . . . . 113 PRO CB . 10075 1
1320 . 1 1 113 113 PRO CG C 13 27.465 0.300 . 1 . . . . 113 PRO CG . 10075 1
1321 . 1 1 113 113 PRO CD C 13 50.715 0.300 . 1 . . . . 113 PRO CD . 10075 1
1322 . 1 1 114 114 SER H H 1 8.349 0.030 . 1 . . . . 114 SER H . 10075 1
1323 . 1 1 114 114 SER HA H 1 4.472 0.030 . 1 . . . . 114 SER HA . 10075 1
1324 . 1 1 114 114 SER HB2 H 1 3.879 0.030 . 1 . . . . 114 SER HB2 . 10075 1
1325 . 1 1 114 114 SER HB3 H 1 3.879 0.030 . 1 . . . . 114 SER HB3 . 10075 1
1326 . 1 1 114 114 SER C C 13 174.639 0.300 . 1 . . . . 114 SER C . 10075 1
1327 . 1 1 114 114 SER CA C 13 58.296 0.300 . 1 . . . . 114 SER CA . 10075 1
1328 . 1 1 114 114 SER CB C 13 64.090 0.300 . 1 . . . . 114 SER CB . 10075 1
1329 . 1 1 114 114 SER N N 15 115.680 0.300 . 1 . . . . 114 SER N . 10075 1
1330 . 1 1 115 115 GLY H H 1 8.222 0.030 . 1 . . . . 115 GLY H . 10075 1
1331 . 1 1 115 115 GLY HA2 H 1 4.163 0.030 . 2 . . . . 115 GLY HA2 . 10075 1
1332 . 1 1 115 115 GLY HA3 H 1 4.107 0.030 . 2 . . . . 115 GLY HA3 . 10075 1
1333 . 1 1 115 115 GLY C C 13 171.754 0.300 . 1 . . . . 115 GLY C . 10075 1
1334 . 1 1 115 115 GLY CA C 13 44.682 0.300 . 1 . . . . 115 GLY CA . 10075 1
1335 . 1 1 115 115 GLY N N 15 110.564 0.300 . 1 . . . . 115 GLY N . 10075 1
1336 . 1 1 116 116 PRO HD2 H 1 3.630 0.030 . 1 . . . . 116 PRO HD2 . 10075 1
1337 . 1 1 116 116 PRO HD3 H 1 3.630 0.030 . 1 . . . . 116 PRO HD3 . 10075 1
1338 . 1 1 118 118 SER HA H 1 4.508 0.030 . 1 . . . . 118 SER HA . 10075 1
1339 . 1 1 118 118 SER HB2 H 1 3.900 0.030 . 1 . . . . 118 SER HB2 . 10075 1
1340 . 1 1 118 118 SER HB3 H 1 3.900 0.030 . 1 . . . . 118 SER HB3 . 10075 1
1341 . 1 1 118 118 SER C C 13 173.931 0.300 . 1 . . . . 118 SER C . 10075 1
1342 . 1 1 118 118 SER CA C 13 58.412 0.300 . 1 . . . . 118 SER CA . 10075 1
1343 . 1 1 118 118 SER CB C 13 64.208 0.300 . 1 . . . . 118 SER CB . 10075 1
1344 . 1 1 119 119 GLY H H 1 8.046 0.030 . 1 . . . . 119 GLY H . 10075 1
1345 . 1 1 119 119 GLY HA2 H 1 3.787 0.030 . 1 . . . . 119 GLY HA2 . 10075 1
1346 . 1 1 119 119 GLY HA3 H 1 3.787 0.030 . 1 . . . . 119 GLY HA3 . 10075 1
1347 . 1 1 119 119 GLY C C 13 178.997 0.300 . 1 . . . . 119 GLY C . 10075 1
1348 . 1 1 119 119 GLY CA C 13 46.266 0.300 . 1 . . . . 119 GLY CA . 10075 1
1349 . 1 1 119 119 GLY N N 15 116.876 0.300 . 1 . . . . 119 GLY N . 10075 1
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