data_11085
#######################
# Entry information #
#######################
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 11085
_Entry.Title
;
Solution structure of the CH domain of human NEDD9 interacting protein with
calponin homology and LIM domains
;
_Entry.Type macromolecule
_Entry.Version_type original
_Entry.Submission_date 2009-12-28
_Entry.Accession_date 2009-12-28
_Entry.Last_release_date 2011-01-04
_Entry.Original_release_date 2011-01-04
_Entry.Origination author
_Entry.NMR_STAR_version 3.1.1.61
_Entry.Original_NMR_STAR_version 3.0.9.14
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Details .
_Entry.BMRB_internal_directory_name .
loop_
_Entry_author.Ordinal
_Entry_author.Given_name
_Entry_author.Family_name
_Entry_author.First_initial
_Entry_author.Middle_initials
_Entry_author.Family_title
_Entry_author.Entry_ID
1 T. Tomizawa . . . 11085
2 T. Kigawa . . . 11085
3 S. Koshiba . . . 11085
4 M. Inoue . . . 11085
5 S. Yokoyama . . . 11085
stop_
loop_
_SG_project.SG_project_ID
_SG_project.Project_name
_SG_project.Full_name_of_center
_SG_project.Initial_of_center
_SG_project.Entry_ID
. 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11085
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts 1 11085
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
'13C chemical shifts' 472 11085
'15N chemical shifts' 112 11085
'1H chemical shifts' 740 11085
stop_
loop_
_Release.Release_number
_Release.Format_type
_Release.Format_version
_Release.Date
_Release.Submission_date
_Release.Type
_Release.Author
_Release.Detail
_Release.Entry_ID
1 . . 2011-01-04 2009-12-28 original author . 11085
stop_
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 1WYL 'BMRB Entry Tracking System' 11085
stop_
save_
###############
# Citations #
###############
save_citation_1
_Citation.Sf_category citations
_Citation.Sf_framecode citation_1
_Citation.Entry_ID 11085
_Citation.ID 1
_Citation.Class 'entry citation'
_Citation.CAS_abstract_code .
_Citation.MEDLINE_UI_code .
_Citation.DOI .
_Citation.PubMed_ID .
_Citation.Full_citation .
_Citation.Title
;
Solution structure of the CH domain of human NEDD9 interacting protein with
calponin homology and LIM domains
;
_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. Tomizawa . . . 11085 1
2 T. Kigawa . . . 11085 1
3 S. Koshiba . . . 11085 1
4 M. Inoue . . . 11085 1
5 S. Yokoyama . . . 11085 1
stop_
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID 11085
_Assembly.ID 1
_Assembly.Name 'NEDD9 interacting protein with calponin homology and LIM domains'
_Assembly.BMRB_code .
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Non_standard_bonds .
_Assembly.Ambiguous_conformational_states .
_Assembly.Ambiguous_chem_comp_sites .
_Assembly.Molecules_in_chemical_exchange .
_Assembly.Paramagnetic no
_Assembly.Thiol_state .
_Assembly.Molecular_mass .
_Assembly.Enzyme_commission_number .
_Assembly.Details .
_Assembly.DB_query_date .
_Assembly.DB_query_revised_last_date .
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.PDB_chain_ID
_Entity_assembly.Experimental_data_reported
_Entity_assembly.Physical_state
_Entity_assembly.Conformational_isomer
_Entity_assembly.Chemical_exchange_state
_Entity_assembly.Magnetic_equivalence_group_code
_Entity_assembly.Role
_Entity_assembly.Details
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1 'CH domain' 1 $entity_1 A . yes native no no . . . 11085 1
stop_
loop_
_Assembly_db_link.Author_supplied
_Assembly_db_link.Database_code
_Assembly_db_link.Accession_code
_Assembly_db_link.Entry_mol_code
_Assembly_db_link.Entry_mol_name
_Assembly_db_link.Entry_experimental_method
_Assembly_db_link.Entry_structure_resolution
_Assembly_db_link.Entry_relation_type
_Assembly_db_link.Entry_details
_Assembly_db_link.Entry_ID
_Assembly_db_link.Assembly_ID
yes PDB 1wyl . . . . . . 11085 1
stop_
save_
####################################
# Biological polymers and ligands #
####################################
save_entity_1
_Entity.Sf_category entity
_Entity.Sf_framecode entity_1
_Entity.Entry_ID 11085
_Entity.ID 1
_Entity.BMRB_code .
_Entity.Name 'CH domain'
_Entity.Type polymer
_Entity.Polymer_common_type .
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_type_details .
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code_can .
_Entity.Polymer_seq_one_letter_code
;
GSSGSSGTQEELLRWCQEQT
AGYPGVHVSDLSSSWADGLA
LCALVYRLQPGLLEPSELQG
LGALEATAWALKVAENELGI
TPVVSAQAVVAGSDPLGLIA
YLSHFHSAFKSGPSSG
;
_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 116
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state 'all free'
_Entity.Src_method .
_Entity.Parent_entity_ID .
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight .
_Entity.Formula_weight_exptl .
_Entity.Formula_weight_exptl_meth .
_Entity.Details .
_Entity.DB_query_date .
_Entity.DB_query_revised_last_date 2015-11-26
loop_
_Entity_db_link.Ordinal
_Entity_db_link.Author_supplied
_Entity_db_link.Database_code
_Entity_db_link.Accession_code
_Entity_db_link.Entry_mol_code
_Entity_db_link.Entry_mol_name
_Entity_db_link.Entry_experimental_method
_Entity_db_link.Entry_structure_resolution
_Entity_db_link.Entry_relation_type
_Entity_db_link.Entry_details
_Entity_db_link.Chimera_segment_ID
_Entity_db_link.Seq_query_to_submitted_percent
_Entity_db_link.Seq_subject_length
_Entity_db_link.Seq_identity
_Entity_db_link.Seq_positive
_Entity_db_link.Seq_homology_expectation_val
_Entity_db_link.Seq_align_begin
_Entity_db_link.Seq_align_end
_Entity_db_link.Seq_difference_details
_Entity_db_link.Seq_alignment_details
_Entity_db_link.Entry_ID
_Entity_db_link.Entity_ID
1 no PDB 1WYL . "Solution Structure Of The Ch Domain Of Human Nedd9 Interacting Protein With Calponin Homology And Lim Domains" . . . . . 100.00 116 100.00 100.00 2.76e-74 . . . . 11085 1
2 no PDB 2DK9 . "Solution Structure Of Calponin Homology Domain Of Human Mical-1" . . . . . 93.10 118 99.07 100.00 1.18e-68 . . . . 11085 1
3 no DBJ BAB13949 . "unnamed protein product [Homo sapiens]" . . . . . 94.83 1067 97.27 100.00 8.26e-63 . . . . 11085 1
4 no DBJ BAB15124 . "unnamed protein product [Homo sapiens]" . . . . . 94.83 1067 97.27 100.00 8.35e-63 . . . . 11085 1
5 no DBJ BAB86289 . "CasL interacting molecule MICAL [Homo sapiens]" . . . . . 94.83 1067 97.27 100.00 8.35e-63 . . . . 11085 1
6 no DBJ BAD18727 . "FLJ00407 protein [Homo sapiens]" . . . . . 91.38 591 99.06 100.00 2.14e-63 . . . . 11085 1
7 no DBJ BAH12301 . "unnamed protein product [Homo sapiens]" . . . . . 94.83 1086 97.27 100.00 9.63e-63 . . . . 11085 1
8 no EMBL CAB59266 . "hypothetical protein [Homo sapiens]" . . . . . 94.83 646 97.27 100.00 9.89e-65 . . . . 11085 1
9 no GB AAH09972 . "MICAL1 protein [Homo sapiens]" . . . . . 94.83 981 97.27 100.00 4.00e-63 . . . . 11085 1
10 no GB AAH42144 . "Microtubule associated monoxygenase, calponin and LIM domain containing 1 [Homo sapiens]" . . . . . 94.83 1067 97.27 100.00 8.02e-63 . . . . 11085 1
11 no GB AAH52983 . "Microtubule associated monoxygenase, calponin and LIM domain containing 1 [Homo sapiens]" . . . . . 94.83 1067 97.27 100.00 8.02e-63 . . . . 11085 1
12 no GB AIC63549 . "MICAL1, partial [synthetic construct]" . . . . . 94.83 981 97.27 100.00 4.00e-63 . . . . 11085 1
13 no GB EAW48341 . "microtubule associated monoxygenase, calponin and LIM domain containing 1, isoform CRA_c [Homo sapiens]" . . . . . 94.83 981 97.27 100.00 3.84e-63 . . . . 11085 1
14 no REF NP_001152763 . "protein-methionine sulfoxide oxidase MICAL1 isoform 2 [Homo sapiens]" . . . . . 94.83 981 97.27 100.00 3.84e-63 . . . . 11085 1
15 no REF NP_001273542 . "protein-methionine sulfoxide oxidase MICAL1 isoform 3 [Homo sapiens]" . . . . . 94.83 1086 97.27 100.00 1.05e-62 . . . . 11085 1
16 no REF NP_073602 . "protein-methionine sulfoxide oxidase MICAL1 isoform 1 [Homo sapiens]" . . . . . 94.83 1067 97.27 100.00 8.02e-63 . . . . 11085 1
17 no REF XP_011905848 . "PREDICTED: protein-methionine sulfoxide oxidase MICAL1 isoform X1 [Cercocebus atys]" . . . . . 88.79 1086 97.09 99.03 1.72e-57 . . . . 11085 1
18 no REF XP_011905849 . "PREDICTED: protein-methionine sulfoxide oxidase MICAL1 isoform X1 [Cercocebus atys]" . . . . . 88.79 1086 97.09 99.03 1.72e-57 . . . . 11085 1
19 no SP Q8TDZ2 . "RecName: Full=Protein-methionine sulfoxide oxidase MICAL1; AltName: Full=Molecule interacting with CasL protein 1; Short=MICAL-" . . . . . 94.83 1067 97.27 100.00 8.02e-63 . . . . 11085 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 . 11085 1
2 . SER . 11085 1
3 . SER . 11085 1
4 . GLY . 11085 1
5 . SER . 11085 1
6 . SER . 11085 1
7 . GLY . 11085 1
8 . THR . 11085 1
9 . GLN . 11085 1
10 . GLU . 11085 1
11 . GLU . 11085 1
12 . LEU . 11085 1
13 . LEU . 11085 1
14 . ARG . 11085 1
15 . TRP . 11085 1
16 . CYS . 11085 1
17 . GLN . 11085 1
18 . GLU . 11085 1
19 . GLN . 11085 1
20 . THR . 11085 1
21 . ALA . 11085 1
22 . GLY . 11085 1
23 . TYR . 11085 1
24 . PRO . 11085 1
25 . GLY . 11085 1
26 . VAL . 11085 1
27 . HIS . 11085 1
28 . VAL . 11085 1
29 . SER . 11085 1
30 . ASP . 11085 1
31 . LEU . 11085 1
32 . SER . 11085 1
33 . SER . 11085 1
34 . SER . 11085 1
35 . TRP . 11085 1
36 . ALA . 11085 1
37 . ASP . 11085 1
38 . GLY . 11085 1
39 . LEU . 11085 1
40 . ALA . 11085 1
41 . LEU . 11085 1
42 . CYS . 11085 1
43 . ALA . 11085 1
44 . LEU . 11085 1
45 . VAL . 11085 1
46 . TYR . 11085 1
47 . ARG . 11085 1
48 . LEU . 11085 1
49 . GLN . 11085 1
50 . PRO . 11085 1
51 . GLY . 11085 1
52 . LEU . 11085 1
53 . LEU . 11085 1
54 . GLU . 11085 1
55 . PRO . 11085 1
56 . SER . 11085 1
57 . GLU . 11085 1
58 . LEU . 11085 1
59 . GLN . 11085 1
60 . GLY . 11085 1
61 . LEU . 11085 1
62 . GLY . 11085 1
63 . ALA . 11085 1
64 . LEU . 11085 1
65 . GLU . 11085 1
66 . ALA . 11085 1
67 . THR . 11085 1
68 . ALA . 11085 1
69 . TRP . 11085 1
70 . ALA . 11085 1
71 . LEU . 11085 1
72 . LYS . 11085 1
73 . VAL . 11085 1
74 . ALA . 11085 1
75 . GLU . 11085 1
76 . ASN . 11085 1
77 . GLU . 11085 1
78 . LEU . 11085 1
79 . GLY . 11085 1
80 . ILE . 11085 1
81 . THR . 11085 1
82 . PRO . 11085 1
83 . VAL . 11085 1
84 . VAL . 11085 1
85 . SER . 11085 1
86 . ALA . 11085 1
87 . GLN . 11085 1
88 . ALA . 11085 1
89 . VAL . 11085 1
90 . VAL . 11085 1
91 . ALA . 11085 1
92 . GLY . 11085 1
93 . SER . 11085 1
94 . ASP . 11085 1
95 . PRO . 11085 1
96 . LEU . 11085 1
97 . GLY . 11085 1
98 . LEU . 11085 1
99 . ILE . 11085 1
100 . ALA . 11085 1
101 . TYR . 11085 1
102 . LEU . 11085 1
103 . SER . 11085 1
104 . HIS . 11085 1
105 . PHE . 11085 1
106 . HIS . 11085 1
107 . SER . 11085 1
108 . ALA . 11085 1
109 . PHE . 11085 1
110 . LYS . 11085 1
111 . SER . 11085 1
112 . GLY . 11085 1
113 . PRO . 11085 1
114 . SER . 11085 1
115 . SER . 11085 1
116 . GLY . 11085 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 11085 1
. SER 2 2 11085 1
. SER 3 3 11085 1
. GLY 4 4 11085 1
. SER 5 5 11085 1
. SER 6 6 11085 1
. GLY 7 7 11085 1
. THR 8 8 11085 1
. GLN 9 9 11085 1
. GLU 10 10 11085 1
. GLU 11 11 11085 1
. LEU 12 12 11085 1
. LEU 13 13 11085 1
. ARG 14 14 11085 1
. TRP 15 15 11085 1
. CYS 16 16 11085 1
. GLN 17 17 11085 1
. GLU 18 18 11085 1
. GLN 19 19 11085 1
. THR 20 20 11085 1
. ALA 21 21 11085 1
. GLY 22 22 11085 1
. TYR 23 23 11085 1
. PRO 24 24 11085 1
. GLY 25 25 11085 1
. VAL 26 26 11085 1
. HIS 27 27 11085 1
. VAL 28 28 11085 1
. SER 29 29 11085 1
. ASP 30 30 11085 1
. LEU 31 31 11085 1
. SER 32 32 11085 1
. SER 33 33 11085 1
. SER 34 34 11085 1
. TRP 35 35 11085 1
. ALA 36 36 11085 1
. ASP 37 37 11085 1
. GLY 38 38 11085 1
. LEU 39 39 11085 1
. ALA 40 40 11085 1
. LEU 41 41 11085 1
. CYS 42 42 11085 1
. ALA 43 43 11085 1
. LEU 44 44 11085 1
. VAL 45 45 11085 1
. TYR 46 46 11085 1
. ARG 47 47 11085 1
. LEU 48 48 11085 1
. GLN 49 49 11085 1
. PRO 50 50 11085 1
. GLY 51 51 11085 1
. LEU 52 52 11085 1
. LEU 53 53 11085 1
. GLU 54 54 11085 1
. PRO 55 55 11085 1
. SER 56 56 11085 1
. GLU 57 57 11085 1
. LEU 58 58 11085 1
. GLN 59 59 11085 1
. GLY 60 60 11085 1
. LEU 61 61 11085 1
. GLY 62 62 11085 1
. ALA 63 63 11085 1
. LEU 64 64 11085 1
. GLU 65 65 11085 1
. ALA 66 66 11085 1
. THR 67 67 11085 1
. ALA 68 68 11085 1
. TRP 69 69 11085 1
. ALA 70 70 11085 1
. LEU 71 71 11085 1
. LYS 72 72 11085 1
. VAL 73 73 11085 1
. ALA 74 74 11085 1
. GLU 75 75 11085 1
. ASN 76 76 11085 1
. GLU 77 77 11085 1
. LEU 78 78 11085 1
. GLY 79 79 11085 1
. ILE 80 80 11085 1
. THR 81 81 11085 1
. PRO 82 82 11085 1
. VAL 83 83 11085 1
. VAL 84 84 11085 1
. SER 85 85 11085 1
. ALA 86 86 11085 1
. GLN 87 87 11085 1
. ALA 88 88 11085 1
. VAL 89 89 11085 1
. VAL 90 90 11085 1
. ALA 91 91 11085 1
. GLY 92 92 11085 1
. SER 93 93 11085 1
. ASP 94 94 11085 1
. PRO 95 95 11085 1
. LEU 96 96 11085 1
. GLY 97 97 11085 1
. LEU 98 98 11085 1
. ILE 99 99 11085 1
. ALA 100 100 11085 1
. TYR 101 101 11085 1
. LEU 102 102 11085 1
. SER 103 103 11085 1
. HIS 104 104 11085 1
. PHE 105 105 11085 1
. HIS 106 106 11085 1
. SER 107 107 11085 1
. ALA 108 108 11085 1
. PHE 109 109 11085 1
. LYS 110 110 11085 1
. SER 111 111 11085 1
. GLY 112 112 11085 1
. PRO 113 113 11085 1
. SER 114 114 11085 1
. SER 115 115 11085 1
. GLY 116 116 11085 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 11085
_Entity_natural_src_list.ID 1
loop_
_Entity_natural_src.ID
_Entity_natural_src.Entity_ID
_Entity_natural_src.Entity_label
_Entity_natural_src.Entity_chimera_segment_ID
_Entity_natural_src.NCBI_taxonomy_ID
_Entity_natural_src.Type
_Entity_natural_src.Common
_Entity_natural_src.Organism_name_scientific
_Entity_natural_src.Organism_name_common
_Entity_natural_src.Organism_acronym
_Entity_natural_src.ICTVdb_decimal_code
_Entity_natural_src.Superkingdom
_Entity_natural_src.Kingdom
_Entity_natural_src.Genus
_Entity_natural_src.Species
_Entity_natural_src.Strain
_Entity_natural_src.Variant
_Entity_natural_src.Subvariant
_Entity_natural_src.Organ
_Entity_natural_src.Tissue
_Entity_natural_src.Tissue_fraction
_Entity_natural_src.Cell_line
_Entity_natural_src.Cell_type
_Entity_natural_src.ATCC_number
_Entity_natural_src.Organelle
_Entity_natural_src.Cellular_location
_Entity_natural_src.Fragment
_Entity_natural_src.Fraction
_Entity_natural_src.Secretion
_Entity_natural_src.Plasmid
_Entity_natural_src.Plasmid_details
_Entity_natural_src.Gene_mnemonic
_Entity_natural_src.Dev_stage
_Entity_natural_src.Details
_Entity_natural_src.Citation_ID
_Entity_natural_src.Citation_label
_Entity_natural_src.Entry_ID
_Entity_natural_src.Entity_natural_src_list_ID
1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11085 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 11085
_Entity_experimental_src_list.ID 1
loop_
_Entity_experimental_src.ID
_Entity_experimental_src.Entity_ID
_Entity_experimental_src.Entity_label
_Entity_experimental_src.Entity_chimera_segment_ID
_Entity_experimental_src.Production_method
_Entity_experimental_src.Host_org_scientific_name
_Entity_experimental_src.Host_org_name_common
_Entity_experimental_src.Host_org_details
_Entity_experimental_src.Host_org_NCBI_taxonomy_ID
_Entity_experimental_src.Host_org_genus
_Entity_experimental_src.Host_org_species
_Entity_experimental_src.Host_org_strain
_Entity_experimental_src.Host_org_variant
_Entity_experimental_src.Host_org_subvariant
_Entity_experimental_src.Host_org_organ
_Entity_experimental_src.Host_org_tissue
_Entity_experimental_src.Host_org_tissue_fraction
_Entity_experimental_src.Host_org_cell_line
_Entity_experimental_src.Host_org_cell_type
_Entity_experimental_src.Host_org_cellular_location
_Entity_experimental_src.Host_org_organelle
_Entity_experimental_src.Host_org_gene
_Entity_experimental_src.Host_org_culture_collection
_Entity_experimental_src.Host_org_ATCC_number
_Entity_experimental_src.Vector_type
_Entity_experimental_src.PDBview_host_org_vector_name
_Entity_experimental_src.PDBview_plasmid_name
_Entity_experimental_src.Vector_name
_Entity_experimental_src.Vector_details
_Entity_experimental_src.Vendor_name
_Entity_experimental_src.Host_org_dev_stage
_Entity_experimental_src.Details
_Entity_experimental_src.Citation_ID
_Entity_experimental_src.Citation_label
_Entity_experimental_src.Entry_ID
_Entity_experimental_src.Entity_experimental_src_list_ID
1 1 $entity_1 . 'cell free synthesis' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . . . . P040315-92 . . . . . . 11085 1
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Sample.Sf_category sample
_Sample.Sf_framecode sample_1
_Sample.Entry_ID 11085
_Sample.ID 1
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details
;
1.22mM CH domain [U-15N,13C], 20mM d-Tris-HCl, 100mM NaCl, 1mM d-DTT,
0.02% NaN3, 10% D2O
;
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '90% H2O, 10% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 'CH domain' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . protein 1.22 . . mM . . . . 11085 1
2 TRIS '[U-100% 2H]' . . . . . buffer 20 . . mM . . . . 11085 1
3 'sodium chloride' 'natural abundance' . . . . . salt 100 . . mM . . . . 11085 1
4 DTT '[U-100% 2H]' . . . . . salt 1 . . mM . . . . 11085 1
5 'sodium azide' 'natural abundance' . . . . . salt 0.02 . . % . . . . 11085 1
6 D2O . . . . . . solvent 10 . . % . . . . 11085 1
7 H2O . . . . . . solvent 90 . . % . . . . 11085 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 11085
_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 11085 1
pH 7.0 0.05 pH 11085 1
pressure 1 0.001 atm 11085 1
temperature 296 0.1 K 11085 1
stop_
save_
############################
# Computer software used #
############################
save_XWINNMR
_Software.Sf_category software
_Software.Sf_framecode XWINNMR
_Software.Entry_ID 11085
_Software.ID 1
_Software.Name xwinnmr
_Software.Version 2.6
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
Bruker . . 11085 1
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
collection 11085 1
stop_
save_
save_NMRPipe
_Software.Sf_category software
_Software.Sf_framecode NMRPipe
_Software.Entry_ID 11085
_Software.ID 2
_Software.Name NMRPipe
_Software.Version 20030801
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Delaglio, F.' . . 11085 2
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
processing 11085 2
stop_
save_
save_NMRview
_Software.Sf_category software
_Software.Sf_framecode NMRview
_Software.Entry_ID 11085
_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.' . . 11085 3
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data analysis' 11085 3
stop_
save_
save_Kujira
_Software.Sf_category software
_Software.Sf_framecode Kujira
_Software.Entry_ID 11085
_Software.ID 4
_Software.Name Kujira
_Software.Version 0.9295
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Kobayashi, N.' . . 11085 4
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data analysis' 11085 4
stop_
save_
save_CYANA
_Software.Sf_category software
_Software.Sf_framecode CYANA
_Software.Entry_ID 11085
_Software.ID 5
_Software.Name CYANA
_Software.Version 2.0.17
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Guntert, P.' . . 11085 5
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'structure solution' 11085 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 11085
_NMR_spectrometer.ID 1
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model AVANCE
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 800
save_
save_NMR_spectrometer_list
_NMR_spectrometer_list.Sf_category NMR_spectrometer_list
_NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list
_NMR_spectrometer_list.Entry_ID 11085
_NMR_spectrometer_list.ID 1
loop_
_NMR_spectrometer_view.ID
_NMR_spectrometer_view.Name
_NMR_spectrometer_view.Manufacturer
_NMR_spectrometer_view.Model
_NMR_spectrometer_view.Serial_number
_NMR_spectrometer_view.Field_strength
_NMR_spectrometer_view.Details
_NMR_spectrometer_view.Citation_ID
_NMR_spectrometer_view.Citation_label
_NMR_spectrometer_view.Entry_ID
_NMR_spectrometer_view.NMR_spectrometer_list_ID
1 spectrometer_1 Bruker AVANCE . 800 . . . 11085 1
stop_
save_
#############################
# NMR applied experiments #
#############################
save_experiment_list
_Experiment_list.Sf_category experiment_list
_Experiment_list.Sf_framecode experiment_list
_Experiment_list.Entry_ID 11085
_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 1H-15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11085 1
2 '3D 1H-13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11085 1
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_reference_1
_Chem_shift_reference.Sf_category chem_shift_reference
_Chem_shift_reference.Sf_framecode reference_1
_Chem_shift_reference.Entry_ID 11085
_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 . . . . . . . . . 11085 1
H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11085 1
N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11085 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 11085
_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 1H-15N-separated NOESY' 1 $sample_1 isotropic 11085 1
2 '3D 1H-13C-separated NOESY' 1 $sample_1 isotropic 11085 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $XWINNMR . . 11085 1
2 $NMRPipe . . 11085 1
3 $NMRview . . 11085 1
4 $Kujira . . 11085 1
5 $CYANA . . 11085 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 6 6 SER HA H 1 4.406 0.030 . 1 . . . . 6 SER HA . 11085 1
2 . 1 1 6 6 SER HB2 H 1 3.795 0.030 . 2 . . . . 6 SER HB2 . 11085 1
3 . 1 1 6 6 SER C C 13 172.780 0.300 . 1 . . . . 6 SER C . 11085 1
4 . 1 1 6 6 SER CA C 13 56.479 0.300 . 1 . . . . 6 SER CA . 11085 1
5 . 1 1 6 6 SER CB C 13 61.210 0.300 . 1 . . . . 6 SER CB . 11085 1
6 . 1 1 7 7 GLY H H 1 8.398 0.030 . 1 . . . . 7 GLY H . 11085 1
7 . 1 1 7 7 GLY HA2 H 1 3.954 0.030 . 1 . . . . 7 GLY HA2 . 11085 1
8 . 1 1 7 7 GLY HA3 H 1 3.954 0.030 . 1 . . . . 7 GLY HA3 . 11085 1
9 . 1 1 7 7 GLY C C 13 172.731 0.300 . 1 . . . . 7 GLY C . 11085 1
10 . 1 1 7 7 GLY CA C 13 43.302 0.300 . 1 . . . . 7 GLY CA . 11085 1
11 . 1 1 7 7 GLY N N 15 110.610 0.300 . 1 . . . . 7 GLY N . 11085 1
12 . 1 1 8 8 THR H H 1 8.079 0.030 . 1 . . . . 8 THR H . 11085 1
13 . 1 1 8 8 THR HA H 1 4.261 0.030 . 1 . . . . 8 THR HA . 11085 1
14 . 1 1 8 8 THR HB H 1 4.361 0.030 . 1 . . . . 8 THR HB . 11085 1
15 . 1 1 8 8 THR HG21 H 1 1.159 0.030 . 1 . . . . 8 THR HG2 . 11085 1
16 . 1 1 8 8 THR HG22 H 1 1.159 0.030 . 1 . . . . 8 THR HG2 . 11085 1
17 . 1 1 8 8 THR HG23 H 1 1.159 0.030 . 1 . . . . 8 THR HG2 . 11085 1
18 . 1 1 8 8 THR C C 13 174.002 0.300 . 1 . . . . 8 THR C . 11085 1
19 . 1 1 8 8 THR CA C 13 60.204 0.300 . 1 . . . . 8 THR CA . 11085 1
20 . 1 1 8 8 THR CB C 13 67.686 0.300 . 1 . . . . 8 THR CB . 11085 1
21 . 1 1 8 8 THR CG2 C 13 19.465 0.300 . 1 . . . . 8 THR CG2 . 11085 1
22 . 1 1 8 8 THR N N 15 112.781 0.300 . 1 . . . . 8 THR N . 11085 1
23 . 1 1 9 9 GLN H H 1 8.644 0.030 . 1 . . . . 9 GLN H . 11085 1
24 . 1 1 9 9 GLN HA H 1 3.936 0.030 . 1 . . . . 9 GLN HA . 11085 1
25 . 1 1 9 9 GLN HB2 H 1 2.028 0.030 . 2 . . . . 9 GLN HB2 . 11085 1
26 . 1 1 9 9 GLN HB3 H 1 1.899 0.030 . 2 . . . . 9 GLN HB3 . 11085 1
27 . 1 1 9 9 GLN HE21 H 1 7.418 0.030 . 2 . . . . 9 GLN HE21 . 11085 1
28 . 1 1 9 9 GLN HE22 H 1 6.671 0.030 . 2 . . . . 9 GLN HE22 . 11085 1
29 . 1 1 9 9 GLN HG2 H 1 2.121 0.030 . 2 . . . . 9 GLN HG2 . 11085 1
30 . 1 1 9 9 GLN HG3 H 1 2.359 0.030 . 2 . . . . 9 GLN HG3 . 11085 1
31 . 1 1 9 9 GLN C C 13 175.317 0.300 . 1 . . . . 9 GLN C . 11085 1
32 . 1 1 9 9 GLN CA C 13 56.691 0.300 . 1 . . . . 9 GLN CA . 11085 1
33 . 1 1 9 9 GLN CB C 13 25.448 0.300 . 1 . . . . 9 GLN CB . 11085 1
34 . 1 1 9 9 GLN CG C 13 32.359 0.300 . 1 . . . . 9 GLN CG . 11085 1
35 . 1 1 9 9 GLN NE2 N 15 110.449 0.300 . 1 . . . . 9 GLN NE2 . 11085 1
36 . 1 1 10 10 GLU H H 1 8.331 0.030 . 1 . . . . 10 GLU H . 11085 1
37 . 1 1 10 10 GLU HA H 1 3.898 0.030 . 1 . . . . 10 GLU HA . 11085 1
38 . 1 1 10 10 GLU HB2 H 1 1.902 0.030 . 2 . . . . 10 GLU HB2 . 11085 1
39 . 1 1 10 10 GLU HB3 H 1 2.008 0.030 . 2 . . . . 10 GLU HB3 . 11085 1
40 . 1 1 10 10 GLU HG2 H 1 2.244 0.030 . 1 . . . . 10 GLU HG2 . 11085 1
41 . 1 1 10 10 GLU HG3 H 1 2.244 0.030 . 1 . . . . 10 GLU HG3 . 11085 1
42 . 1 1 10 10 GLU C C 13 176.525 0.300 . 1 . . . . 10 GLU C . 11085 1
43 . 1 1 10 10 GLU CA C 13 57.735 0.300 . 1 . . . . 10 GLU CA . 11085 1
44 . 1 1 10 10 GLU CB C 13 26.877 0.300 . 1 . . . . 10 GLU CB . 11085 1
45 . 1 1 10 10 GLU CG C 13 34.255 0.300 . 1 . . . . 10 GLU CG . 11085 1
46 . 1 1 10 10 GLU N N 15 120.046 0.300 . 1 . . . . 10 GLU N . 11085 1
47 . 1 1 11 11 GLU H H 1 7.873 0.030 . 1 . . . . 11 GLU H . 11085 1
48 . 1 1 11 11 GLU HA H 1 3.964 0.030 . 1 . . . . 11 GLU HA . 11085 1
49 . 1 1 11 11 GLU HB2 H 1 2.004 0.030 . 2 . . . . 11 GLU HB2 . 11085 1
50 . 1 1 11 11 GLU HB3 H 1 1.906 0.030 . 2 . . . . 11 GLU HB3 . 11085 1
51 . 1 1 11 11 GLU HG2 H 1 2.236 0.030 . 2 . . . . 11 GLU HG2 . 11085 1
52 . 1 1 11 11 GLU HG3 H 1 2.202 0.030 . 2 . . . . 11 GLU HG3 . 11085 1
53 . 1 1 11 11 GLU C C 13 176.400 0.300 . 1 . . . . 11 GLU C . 11085 1
54 . 1 1 11 11 GLU CA C 13 56.784 0.300 . 1 . . . . 11 GLU CA . 11085 1
55 . 1 1 11 11 GLU CB C 13 26.959 0.300 . 1 . . . . 11 GLU CB . 11085 1
56 . 1 1 11 11 GLU CG C 13 34.172 0.300 . 1 . . . . 11 GLU CG . 11085 1
57 . 1 1 11 11 GLU N N 15 119.982 0.300 . 1 . . . . 11 GLU N . 11085 1
58 . 1 1 12 12 LEU H H 1 7.800 0.030 . 1 . . . . 12 LEU H . 11085 1
59 . 1 1 12 12 LEU HA H 1 3.601 0.030 . 1 . . . . 12 LEU HA . 11085 1
60 . 1 1 12 12 LEU HB2 H 1 1.832 0.030 . 2 . . . . 12 LEU HB2 . 11085 1
61 . 1 1 12 12 LEU HB3 H 1 1.385 0.030 . 2 . . . . 12 LEU HB3 . 11085 1
62 . 1 1 12 12 LEU HD11 H 1 0.637 0.030 . 1 . . . . 12 LEU HD1 . 11085 1
63 . 1 1 12 12 LEU HD12 H 1 0.637 0.030 . 1 . . . . 12 LEU HD1 . 11085 1
64 . 1 1 12 12 LEU HD13 H 1 0.637 0.030 . 1 . . . . 12 LEU HD1 . 11085 1
65 . 1 1 12 12 LEU HD21 H 1 0.755 0.030 . 1 . . . . 12 LEU HD2 . 11085 1
66 . 1 1 12 12 LEU HD22 H 1 0.755 0.030 . 1 . . . . 12 LEU HD2 . 11085 1
67 . 1 1 12 12 LEU HD23 H 1 0.755 0.030 . 1 . . . . 12 LEU HD2 . 11085 1
68 . 1 1 12 12 LEU HG H 1 1.308 0.030 . 1 . . . . 12 LEU HG . 11085 1
69 . 1 1 12 12 LEU C C 13 176.295 0.300 . 1 . . . . 12 LEU C . 11085 1
70 . 1 1 12 12 LEU CA C 13 55.471 0.300 . 1 . . . . 12 LEU CA . 11085 1
71 . 1 1 12 12 LEU CB C 13 39.213 0.300 . 1 . . . . 12 LEU CB . 11085 1
72 . 1 1 12 12 LEU CD1 C 13 21.229 0.300 . 2 . . . . 12 LEU CD1 . 11085 1
73 . 1 1 12 12 LEU CD2 C 13 24.018 0.300 . 2 . . . . 12 LEU CD2 . 11085 1
74 . 1 1 12 12 LEU CG C 13 24.644 0.300 . 1 . . . . 12 LEU CG . 11085 1
75 . 1 1 12 12 LEU N N 15 121.333 0.300 . 1 . . . . 12 LEU N . 11085 1
76 . 1 1 13 13 LEU H H 1 8.283 0.030 . 1 . . . . 13 LEU H . 11085 1
77 . 1 1 13 13 LEU HA H 1 3.875 0.030 . 1 . . . . 13 LEU HA . 11085 1
78 . 1 1 13 13 LEU HB2 H 1 1.909 0.030 . 2 . . . . 13 LEU HB2 . 11085 1
79 . 1 1 13 13 LEU HB3 H 1 1.278 0.030 . 2 . . . . 13 LEU HB3 . 11085 1
80 . 1 1 13 13 LEU HD11 H 1 0.563 0.030 . 1 . . . . 13 LEU HD1 . 11085 1
81 . 1 1 13 13 LEU HD12 H 1 0.563 0.030 . 1 . . . . 13 LEU HD1 . 11085 1
82 . 1 1 13 13 LEU HD13 H 1 0.563 0.030 . 1 . . . . 13 LEU HD1 . 11085 1
83 . 1 1 13 13 LEU HD21 H 1 0.748 0.030 . 1 . . . . 13 LEU HD2 . 11085 1
84 . 1 1 13 13 LEU HD22 H 1 0.748 0.030 . 1 . . . . 13 LEU HD2 . 11085 1
85 . 1 1 13 13 LEU HD23 H 1 0.748 0.030 . 1 . . . . 13 LEU HD2 . 11085 1
86 . 1 1 13 13 LEU HG H 1 1.202 0.030 . 1 . . . . 13 LEU HG . 11085 1
87 . 1 1 13 13 LEU C C 13 175.516 0.300 . 1 . . . . 13 LEU C . 11085 1
88 . 1 1 13 13 LEU CA C 13 56.645 0.300 . 1 . . . . 13 LEU CA . 11085 1
89 . 1 1 13 13 LEU CB C 13 38.729 0.300 . 1 . . . . 13 LEU CB . 11085 1
90 . 1 1 13 13 LEU CD1 C 13 21.337 0.300 . 2 . . . . 13 LEU CD1 . 11085 1
91 . 1 1 13 13 LEU CD2 C 13 23.879 0.300 . 2 . . . . 13 LEU CD2 . 11085 1
92 . 1 1 13 13 LEU CG C 13 24.463 0.300 . 1 . . . . 13 LEU CG . 11085 1
93 . 1 1 13 13 LEU N N 15 119.572 0.300 . 1 . . . . 13 LEU N . 11085 1
94 . 1 1 14 14 ARG H H 1 7.902 0.030 . 1 . . . . 14 ARG H . 11085 1
95 . 1 1 14 14 ARG HA H 1 4.153 0.030 . 1 . . . . 14 ARG HA . 11085 1
96 . 1 1 14 14 ARG HB2 H 1 1.870 0.030 . 1 . . . . 14 ARG HB2 . 11085 1
97 . 1 1 14 14 ARG HB3 H 1 1.870 0.030 . 1 . . . . 14 ARG HB3 . 11085 1
98 . 1 1 14 14 ARG HD2 H 1 3.176 0.030 . 1 . . . . 14 ARG HD2 . 11085 1
99 . 1 1 14 14 ARG HD3 H 1 3.176 0.030 . 1 . . . . 14 ARG HD3 . 11085 1
100 . 1 1 14 14 ARG HG2 H 1 1.610 0.030 . 2 . . . . 14 ARG HG2 . 11085 1
101 . 1 1 14 14 ARG HG3 H 1 1.715 0.030 . 2 . . . . 14 ARG HG3 . 11085 1
102 . 1 1 14 14 ARG C C 13 176.588 0.300 . 1 . . . . 14 ARG C . 11085 1
103 . 1 1 14 14 ARG CA C 13 56.897 0.300 . 1 . . . . 14 ARG CA . 11085 1
104 . 1 1 14 14 ARG CB C 13 27.471 0.300 . 1 . . . . 14 ARG CB . 11085 1
105 . 1 1 14 14 ARG CD C 13 40.878 0.300 . 1 . . . . 14 ARG CD . 11085 1
106 . 1 1 14 14 ARG CG C 13 25.040 0.300 . 1 . . . . 14 ARG CG . 11085 1
107 . 1 1 14 14 ARG N N 15 117.399 0.300 . 1 . . . . 14 ARG N . 11085 1
108 . 1 1 15 15 TRP H H 1 8.266 0.030 . 1 . . . . 15 TRP H . 11085 1
109 . 1 1 15 15 TRP HA H 1 4.247 0.030 . 1 . . . . 15 TRP HA . 11085 1
110 . 1 1 15 15 TRP HB2 H 1 3.224 0.030 . 1 . . . . 15 TRP HB2 . 11085 1
111 . 1 1 15 15 TRP HB3 H 1 3.224 0.030 . 1 . . . . 15 TRP HB3 . 11085 1
112 . 1 1 15 15 TRP HD1 H 1 7.470 0.030 . 1 . . . . 15 TRP HD1 . 11085 1
113 . 1 1 15 15 TRP HE1 H 1 10.168 0.030 . 1 . . . . 15 TRP HE1 . 11085 1
114 . 1 1 15 15 TRP HE3 H 1 7.643 0.030 . 1 . . . . 15 TRP HE3 . 11085 1
115 . 1 1 15 15 TRP HH2 H 1 6.894 0.030 . 1 . . . . 15 TRP HH2 . 11085 1
116 . 1 1 15 15 TRP HZ2 H 1 7.231 0.030 . 1 . . . . 15 TRP HZ2 . 11085 1
117 . 1 1 15 15 TRP HZ3 H 1 6.797 0.030 . 1 . . . . 15 TRP HZ3 . 11085 1
118 . 1 1 15 15 TRP C C 13 176.446 0.300 . 1 . . . . 15 TRP C . 11085 1
119 . 1 1 15 15 TRP CA C 13 60.282 0.300 . 1 . . . . 15 TRP CA . 11085 1
120 . 1 1 15 15 TRP CB C 13 25.888 0.300 . 1 . . . . 15 TRP CB . 11085 1
121 . 1 1 15 15 TRP CD1 C 13 125.310 0.300 . 1 . . . . 15 TRP CD1 . 11085 1
122 . 1 1 15 15 TRP CE3 C 13 119.032 0.300 . 1 . . . . 15 TRP CE3 . 11085 1
123 . 1 1 15 15 TRP CH2 C 13 121.542 0.300 . 1 . . . . 15 TRP CH2 . 11085 1
124 . 1 1 15 15 TRP CZ2 C 13 111.870 0.300 . 1 . . . . 15 TRP CZ2 . 11085 1
125 . 1 1 15 15 TRP CZ3 C 13 118.952 0.300 . 1 . . . . 15 TRP CZ3 . 11085 1
126 . 1 1 15 15 TRP N N 15 120.221 0.300 . 1 . . . . 15 TRP N . 11085 1
127 . 1 1 15 15 TRP NE1 N 15 130.156 0.300 . 1 . . . . 15 TRP NE1 . 11085 1
128 . 1 1 16 16 CYS H H 1 8.782 0.030 . 1 . . . . 16 CYS H . 11085 1
129 . 1 1 16 16 CYS HA H 1 3.588 0.030 . 1 . . . . 16 CYS HA . 11085 1
130 . 1 1 16 16 CYS HB2 H 1 3.421 0.030 . 2 . . . . 16 CYS HB2 . 11085 1
131 . 1 1 16 16 CYS HB3 H 1 2.728 0.030 . 2 . . . . 16 CYS HB3 . 11085 1
132 . 1 1 16 16 CYS C C 13 176.392 0.300 . 1 . . . . 16 CYS C . 11085 1
133 . 1 1 16 16 CYS CA C 13 62.855 0.300 . 1 . . . . 16 CYS CA . 11085 1
134 . 1 1 16 16 CYS CB C 13 25.480 0.300 . 1 . . . . 16 CYS CB . 11085 1
135 . 1 1 16 16 CYS N N 15 116.596 0.300 . 1 . . . . 16 CYS N . 11085 1
136 . 1 1 17 17 GLN H H 1 8.671 0.030 . 1 . . . . 17 GLN H . 11085 1
137 . 1 1 17 17 GLN HA H 1 3.502 0.030 . 1 . . . . 17 GLN HA . 11085 1
138 . 1 1 17 17 GLN HB2 H 1 2.415 0.030 . 2 . . . . 17 GLN HB2 . 11085 1
139 . 1 1 17 17 GLN HB3 H 1 1.788 0.030 . 2 . . . . 17 GLN HB3 . 11085 1
140 . 1 1 17 17 GLN HE21 H 1 7.285 0.030 . 2 . . . . 17 GLN HE21 . 11085 1
141 . 1 1 17 17 GLN HE22 H 1 6.690 0.030 . 2 . . . . 17 GLN HE22 . 11085 1
142 . 1 1 17 17 GLN HG2 H 1 2.259 0.030 . 2 . . . . 17 GLN HG2 . 11085 1
143 . 1 1 17 17 GLN HG3 H 1 2.439 0.030 . 2 . . . . 17 GLN HG3 . 11085 1
144 . 1 1 17 17 GLN C C 13 175.363 0.300 . 1 . . . . 17 GLN C . 11085 1
145 . 1 1 17 17 GLN CA C 13 57.375 0.300 . 1 . . . . 17 GLN CA . 11085 1
146 . 1 1 17 17 GLN CB C 13 25.620 0.300 . 1 . . . . 17 GLN CB . 11085 1
147 . 1 1 17 17 GLN CG C 13 31.984 0.300 . 1 . . . . 17 GLN CG . 11085 1
148 . 1 1 17 17 GLN N N 15 120.481 0.300 . 1 . . . . 17 GLN N . 11085 1
149 . 1 1 17 17 GLN NE2 N 15 109.410 0.300 . 1 . . . . 17 GLN NE2 . 11085 1
150 . 1 1 18 18 GLU H H 1 8.077 0.030 . 1 . . . . 18 GLU H . 11085 1
151 . 1 1 18 18 GLU HA H 1 3.845 0.030 . 1 . . . . 18 GLU HA . 11085 1
152 . 1 1 18 18 GLU HB2 H 1 1.895 0.030 . 2 . . . . 18 GLU HB2 . 11085 1
153 . 1 1 18 18 GLU HB3 H 1 2.035 0.030 . 2 . . . . 18 GLU HB3 . 11085 1
154 . 1 1 18 18 GLU HG2 H 1 2.319 0.030 . 2 . . . . 18 GLU HG2 . 11085 1
155 . 1 1 18 18 GLU HG3 H 1 2.028 0.030 . 2 . . . . 18 GLU HG3 . 11085 1
156 . 1 1 18 18 GLU C C 13 177.356 0.300 . 1 . . . . 18 GLU C . 11085 1
157 . 1 1 18 18 GLU CA C 13 56.859 0.300 . 1 . . . . 18 GLU CA . 11085 1
158 . 1 1 18 18 GLU CB C 13 27.074 0.300 . 1 . . . . 18 GLU CB . 11085 1
159 . 1 1 18 18 GLU CG C 13 34.090 0.300 . 1 . . . . 18 GLU CG . 11085 1
160 . 1 1 18 18 GLU N N 15 119.366 0.300 . 1 . . . . 18 GLU N . 11085 1
161 . 1 1 19 19 GLN H H 1 7.901 0.030 . 1 . . . . 19 GLN H . 11085 1
162 . 1 1 19 19 GLN HA H 1 3.744 0.030 . 1 . . . . 19 GLN HA . 11085 1
163 . 1 1 19 19 GLN HB2 H 1 1.591 0.030 . 2 . . . . 19 GLN HB2 . 11085 1
164 . 1 1 19 19 GLN HB3 H 1 1.033 0.030 . 2 . . . . 19 GLN HB3 . 11085 1
165 . 1 1 19 19 GLN HE21 H 1 5.618 0.030 . 2 . . . . 19 GLN HE21 . 11085 1
166 . 1 1 19 19 GLN HE22 H 1 6.520 0.030 . 2 . . . . 19 GLN HE22 . 11085 1
167 . 1 1 19 19 GLN HG2 H 1 0.448 0.030 . 2 . . . . 19 GLN HG2 . 11085 1
168 . 1 1 19 19 GLN HG3 H 1 1.117 0.030 . 2 . . . . 19 GLN HG3 . 11085 1
169 . 1 1 19 19 GLN C C 13 174.949 0.300 . 1 . . . . 19 GLN C . 11085 1
170 . 1 1 19 19 GLN CA C 13 54.303 0.300 . 1 . . . . 19 GLN CA . 11085 1
171 . 1 1 19 19 GLN CB C 13 26.383 0.300 . 1 . . . . 19 GLN CB . 11085 1
172 . 1 1 19 19 GLN CG C 13 28.908 0.300 . 1 . . . . 19 GLN CG . 11085 1
173 . 1 1 19 19 GLN N N 15 113.526 0.300 . 1 . . . . 19 GLN N . 11085 1
174 . 1 1 19 19 GLN NE2 N 15 111.094 0.300 . 1 . . . . 19 GLN NE2 . 11085 1
175 . 1 1 20 20 THR H H 1 6.945 0.030 . 1 . . . . 20 THR H . 11085 1
176 . 1 1 20 20 THR HA H 1 3.887 0.030 . 1 . . . . 20 THR HA . 11085 1
177 . 1 1 20 20 THR HB H 1 4.058 0.030 . 1 . . . . 20 THR HB . 11085 1
178 . 1 1 20 20 THR HG21 H 1 0.867 0.030 . 1 . . . . 20 THR HG2 . 11085 1
179 . 1 1 20 20 THR HG22 H 1 0.867 0.030 . 1 . . . . 20 THR HG2 . 11085 1
180 . 1 1 20 20 THR HG23 H 1 0.867 0.030 . 1 . . . . 20 THR HG2 . 11085 1
181 . 1 1 20 20 THR C C 13 171.447 0.300 . 1 . . . . 20 THR C . 11085 1
182 . 1 1 20 20 THR CA C 13 59.415 0.300 . 1 . . . . 20 THR CA . 11085 1
183 . 1 1 20 20 THR CB C 13 67.953 0.300 . 1 . . . . 20 THR CB . 11085 1
184 . 1 1 20 20 THR CG2 C 13 18.925 0.300 . 1 . . . . 20 THR CG2 . 11085 1
185 . 1 1 20 20 THR N N 15 102.489 0.300 . 1 . . . . 20 THR N . 11085 1
186 . 1 1 21 21 ALA H H 1 6.785 0.030 . 1 . . . . 21 ALA H . 11085 1
187 . 1 1 21 21 ALA HA H 1 3.997 0.030 . 1 . . . . 21 ALA HA . 11085 1
188 . 1 1 21 21 ALA HB1 H 1 1.293 0.030 . 1 . . . . 21 ALA HB . 11085 1
189 . 1 1 21 21 ALA HB2 H 1 1.293 0.030 . 1 . . . . 21 ALA HB . 11085 1
190 . 1 1 21 21 ALA HB3 H 1 1.293 0.030 . 1 . . . . 21 ALA HB . 11085 1
191 . 1 1 21 21 ALA C C 13 176.870 0.300 . 1 . . . . 21 ALA C . 11085 1
192 . 1 1 21 21 ALA CA C 13 51.456 0.300 . 1 . . . . 21 ALA CA . 11085 1
193 . 1 1 21 21 ALA CB C 13 16.172 0.300 . 1 . . . . 21 ALA CB . 11085 1
194 . 1 1 21 21 ALA N N 15 123.574 0.300 . 1 . . . . 21 ALA N . 11085 1
195 . 1 1 22 22 GLY H H 1 8.646 0.030 . 1 . . . . 22 GLY H . 11085 1
196 . 1 1 22 22 GLY HA2 H 1 4.040 0.030 . 2 . . . . 22 GLY HA2 . 11085 1
197 . 1 1 22 22 GLY HA3 H 1 3.564 0.030 . 2 . . . . 22 GLY HA3 . 11085 1
198 . 1 1 22 22 GLY C C 13 171.661 0.300 . 1 . . . . 22 GLY C . 11085 1
199 . 1 1 22 22 GLY CA C 13 43.073 0.300 . 1 . . . . 22 GLY CA . 11085 1
200 . 1 1 22 22 GLY N N 15 110.843 0.300 . 1 . . . . 22 GLY N . 11085 1
201 . 1 1 23 23 TYR H H 1 7.781 0.030 . 1 . . . . 23 TYR H . 11085 1
202 . 1 1 23 23 TYR HA H 1 4.389 0.030 . 1 . . . . 23 TYR HA . 11085 1
203 . 1 1 23 23 TYR HB2 H 1 2.707 0.030 . 2 . . . . 23 TYR HB2 . 11085 1
204 . 1 1 23 23 TYR HB3 H 1 2.564 0.030 . 2 . . . . 23 TYR HB3 . 11085 1
205 . 1 1 23 23 TYR HD1 H 1 6.812 0.030 . 1 . . . . 23 TYR HD1 . 11085 1
206 . 1 1 23 23 TYR HD2 H 1 6.812 0.030 . 1 . . . . 23 TYR HD2 . 11085 1
207 . 1 1 23 23 TYR HE1 H 1 6.402 0.030 . 1 . . . . 23 TYR HE1 . 11085 1
208 . 1 1 23 23 TYR HE2 H 1 6.402 0.030 . 1 . . . . 23 TYR HE2 . 11085 1
209 . 1 1 23 23 TYR C C 13 171.986 0.300 . 1 . . . . 23 TYR C . 11085 1
210 . 1 1 23 23 TYR CA C 13 54.341 0.300 . 1 . . . . 23 TYR CA . 11085 1
211 . 1 1 23 23 TYR CB C 13 36.691 0.300 . 1 . . . . 23 TYR CB . 11085 1
212 . 1 1 23 23 TYR CD1 C 13 131.216 0.300 . 1 . . . . 23 TYR CD1 . 11085 1
213 . 1 1 23 23 TYR CD2 C 13 131.216 0.300 . 1 . . . . 23 TYR CD2 . 11085 1
214 . 1 1 23 23 TYR CE1 C 13 115.586 0.300 . 1 . . . . 23 TYR CE1 . 11085 1
215 . 1 1 23 23 TYR CE2 C 13 115.586 0.300 . 1 . . . . 23 TYR CE2 . 11085 1
216 . 1 1 23 23 TYR N N 15 125.518 0.300 . 1 . . . . 23 TYR N . 11085 1
217 . 1 1 24 24 PRO HA H 1 4.042 0.030 . 1 . . . . 24 PRO HA . 11085 1
218 . 1 1 24 24 PRO HB2 H 1 1.957 0.030 . 2 . . . . 24 PRO HB2 . 11085 1
219 . 1 1 24 24 PRO HB3 H 1 1.615 0.030 . 2 . . . . 24 PRO HB3 . 11085 1
220 . 1 1 24 24 PRO HD2 H 1 3.371 0.030 . 2 . . . . 24 PRO HD2 . 11085 1
221 . 1 1 24 24 PRO HD3 H 1 2.259 0.030 . 2 . . . . 24 PRO HD3 . 11085 1
222 . 1 1 24 24 PRO HG2 H 1 1.595 0.030 . 1 . . . . 24 PRO HG2 . 11085 1
223 . 1 1 24 24 PRO HG3 H 1 1.595 0.030 . 1 . . . . 24 PRO HG3 . 11085 1
224 . 1 1 24 24 PRO C C 13 174.715 0.300 . 1 . . . . 24 PRO C . 11085 1
225 . 1 1 24 24 PRO CA C 13 61.714 0.300 . 1 . . . . 24 PRO CA . 11085 1
226 . 1 1 24 24 PRO CB C 13 29.032 0.300 . 1 . . . . 24 PRO CB . 11085 1
227 . 1 1 24 24 PRO CD C 13 47.997 0.300 . 1 . . . . 24 PRO CD . 11085 1
228 . 1 1 24 24 PRO CG C 13 25.154 0.300 . 1 . . . . 24 PRO CG . 11085 1
229 . 1 1 25 25 GLY H H 1 8.435 0.030 . 1 . . . . 25 GLY H . 11085 1
230 . 1 1 25 25 GLY HA2 H 1 3.978 0.030 . 2 . . . . 25 GLY HA2 . 11085 1
231 . 1 1 25 25 GLY HA3 H 1 3.520 0.030 . 2 . . . . 25 GLY HA3 . 11085 1
232 . 1 1 25 25 GLY C C 13 171.772 0.300 . 1 . . . . 25 GLY C . 11085 1
233 . 1 1 25 25 GLY CA C 13 42.972 0.300 . 1 . . . . 25 GLY CA . 11085 1
234 . 1 1 25 25 GLY N N 15 109.151 0.300 . 1 . . . . 25 GLY N . 11085 1
235 . 1 1 26 26 VAL H H 1 7.347 0.030 . 1 . . . . 26 VAL H . 11085 1
236 . 1 1 26 26 VAL HA H 1 3.778 0.030 . 1 . . . . 26 VAL HA . 11085 1
237 . 1 1 26 26 VAL HB H 1 1.865 0.030 . 1 . . . . 26 VAL HB . 11085 1
238 . 1 1 26 26 VAL HG11 H 1 0.566 0.030 . 1 . . . . 26 VAL HG1 . 11085 1
239 . 1 1 26 26 VAL HG12 H 1 0.566 0.030 . 1 . . . . 26 VAL HG1 . 11085 1
240 . 1 1 26 26 VAL HG13 H 1 0.566 0.030 . 1 . . . . 26 VAL HG1 . 11085 1
241 . 1 1 26 26 VAL HG21 H 1 0.574 0.030 . 1 . . . . 26 VAL HG2 . 11085 1
242 . 1 1 26 26 VAL HG22 H 1 0.574 0.030 . 1 . . . . 26 VAL HG2 . 11085 1
243 . 1 1 26 26 VAL HG23 H 1 0.574 0.030 . 1 . . . . 26 VAL HG2 . 11085 1
244 . 1 1 26 26 VAL C C 13 172.647 0.300 . 1 . . . . 26 VAL C . 11085 1
245 . 1 1 26 26 VAL CA C 13 59.468 0.300 . 1 . . . . 26 VAL CA . 11085 1
246 . 1 1 26 26 VAL CB C 13 31.161 0.300 . 1 . . . . 26 VAL CB . 11085 1
247 . 1 1 26 26 VAL CG1 C 13 19.005 0.300 . 2 . . . . 26 VAL CG1 . 11085 1
248 . 1 1 26 26 VAL CG2 C 13 21.066 0.300 . 2 . . . . 26 VAL CG2 . 11085 1
249 . 1 1 26 26 VAL N N 15 119.687 0.300 . 1 . . . . 26 VAL N . 11085 1
250 . 1 1 27 27 HIS H H 1 8.731 0.030 . 1 . . . . 27 HIS H . 11085 1
251 . 1 1 27 27 HIS HA H 1 4.391 0.030 . 1 . . . . 27 HIS HA . 11085 1
252 . 1 1 27 27 HIS HB2 H 1 2.864 0.030 . 1 . . . . 27 HIS HB2 . 11085 1
253 . 1 1 27 27 HIS HB3 H 1 2.864 0.030 . 1 . . . . 27 HIS HB3 . 11085 1
254 . 1 1 27 27 HIS HD2 H 1 6.761 0.030 . 1 . . . . 27 HIS HD2 . 11085 1
255 . 1 1 27 27 HIS HE1 H 1 7.823 0.030 . 1 . . . . 27 HIS HE1 . 11085 1
256 . 1 1 27 27 HIS C C 13 171.052 0.300 . 1 . . . . 27 HIS C . 11085 1
257 . 1 1 27 27 HIS CA C 13 53.432 0.300 . 1 . . . . 27 HIS CA . 11085 1
258 . 1 1 27 27 HIS CB C 13 27.989 0.300 . 1 . . . . 27 HIS CB . 11085 1
259 . 1 1 27 27 HIS CD2 C 13 117.865 0.300 . 1 . . . . 27 HIS CD2 . 11085 1
260 . 1 1 27 27 HIS CE1 C 13 135.179 0.300 . 1 . . . . 27 HIS CE1 . 11085 1
261 . 1 1 27 27 HIS N N 15 126.796 0.300 . 1 . . . . 27 HIS N . 11085 1
262 . 1 1 28 28 VAL H H 1 8.700 0.030 . 1 . . . . 28 VAL H . 11085 1
263 . 1 1 28 28 VAL HA H 1 3.494 0.030 . 1 . . . . 28 VAL HA . 11085 1
264 . 1 1 28 28 VAL HB H 1 1.572 0.030 . 1 . . . . 28 VAL HB . 11085 1
265 . 1 1 28 28 VAL HG11 H 1 0.830 0.030 . 1 . . . . 28 VAL HG1 . 11085 1
266 . 1 1 28 28 VAL HG12 H 1 0.830 0.030 . 1 . . . . 28 VAL HG1 . 11085 1
267 . 1 1 28 28 VAL HG13 H 1 0.830 0.030 . 1 . . . . 28 VAL HG1 . 11085 1
268 . 1 1 28 28 VAL HG21 H 1 0.072 0.030 . 1 . . . . 28 VAL HG2 . 11085 1
269 . 1 1 28 28 VAL HG22 H 1 0.072 0.030 . 1 . . . . 28 VAL HG2 . 11085 1
270 . 1 1 28 28 VAL HG23 H 1 0.072 0.030 . 1 . . . . 28 VAL HG2 . 11085 1
271 . 1 1 28 28 VAL C C 13 172.808 0.300 . 1 . . . . 28 VAL C . 11085 1
272 . 1 1 28 28 VAL CA C 13 61.290 0.300 . 1 . . . . 28 VAL CA . 11085 1
273 . 1 1 28 28 VAL CB C 13 29.053 0.300 . 1 . . . . 28 VAL CB . 11085 1
274 . 1 1 28 28 VAL CG1 C 13 19.967 0.300 . 2 . . . . 28 VAL CG1 . 11085 1
275 . 1 1 28 28 VAL CG2 C 13 19.658 0.300 . 2 . . . . 28 VAL CG2 . 11085 1
276 . 1 1 28 28 VAL N N 15 125.965 0.300 . 1 . . . . 28 VAL N . 11085 1
277 . 1 1 29 29 SER H H 1 8.345 0.030 . 1 . . . . 29 SER H . 11085 1
278 . 1 1 29 29 SER HA H 1 4.348 0.030 . 1 . . . . 29 SER HA . 11085 1
279 . 1 1 29 29 SER HB2 H 1 3.861 0.030 . 2 . . . . 29 SER HB2 . 11085 1
280 . 1 1 29 29 SER HB3 H 1 3.429 0.030 . 2 . . . . 29 SER HB3 . 11085 1
281 . 1 1 29 29 SER C C 13 170.332 0.300 . 1 . . . . 29 SER C . 11085 1
282 . 1 1 29 29 SER CA C 13 54.927 0.300 . 1 . . . . 29 SER CA . 11085 1
283 . 1 1 29 29 SER CB C 13 62.543 0.300 . 1 . . . . 29 SER CB . 11085 1
284 . 1 1 29 29 SER N N 15 121.558 0.300 . 1 . . . . 29 SER N . 11085 1
285 . 1 1 30 30 ASP H H 1 7.882 0.030 . 1 . . . . 30 ASP H . 11085 1
286 . 1 1 30 30 ASP HA H 1 4.481 0.030 . 1 . . . . 30 ASP HA . 11085 1
287 . 1 1 30 30 ASP HB2 H 1 3.049 0.030 . 2 . . . . 30 ASP HB2 . 11085 1
288 . 1 1 30 30 ASP HB3 H 1 2.944 0.030 . 2 . . . . 30 ASP HB3 . 11085 1
289 . 1 1 30 30 ASP C C 13 172.339 0.300 . 1 . . . . 30 ASP C . 11085 1
290 . 1 1 30 30 ASP CA C 13 50.819 0.300 . 1 . . . . 30 ASP CA . 11085 1
291 . 1 1 30 30 ASP CB C 13 39.496 0.300 . 1 . . . . 30 ASP CB . 11085 1
292 . 1 1 30 30 ASP N N 15 120.212 0.300 . 1 . . . . 30 ASP N . 11085 1
293 . 1 1 31 31 LEU H H 1 8.147 0.030 . 1 . . . . 31 LEU H . 11085 1
294 . 1 1 31 31 LEU HA H 1 4.752 0.030 . 1 . . . . 31 LEU HA . 11085 1
295 . 1 1 31 31 LEU HB2 H 1 1.638 0.030 . 2 . . . . 31 LEU HB2 . 11085 1
296 . 1 1 31 31 LEU HB3 H 1 1.483 0.030 . 2 . . . . 31 LEU HB3 . 11085 1
297 . 1 1 31 31 LEU HD11 H 1 0.868 0.030 . 1 . . . . 31 LEU HD1 . 11085 1
298 . 1 1 31 31 LEU HD12 H 1 0.868 0.030 . 1 . . . . 31 LEU HD1 . 11085 1
299 . 1 1 31 31 LEU HD13 H 1 0.868 0.030 . 1 . . . . 31 LEU HD1 . 11085 1
300 . 1 1 31 31 LEU HD21 H 1 0.668 0.030 . 1 . . . . 31 LEU HD2 . 11085 1
301 . 1 1 31 31 LEU HD22 H 1 0.668 0.030 . 1 . . . . 31 LEU HD2 . 11085 1
302 . 1 1 31 31 LEU HD23 H 1 0.668 0.030 . 1 . . . . 31 LEU HD2 . 11085 1
303 . 1 1 31 31 LEU HG H 1 1.537 0.030 . 1 . . . . 31 LEU HG . 11085 1
304 . 1 1 31 31 LEU C C 13 172.735 0.300 . 1 . . . . 31 LEU C . 11085 1
305 . 1 1 31 31 LEU CA C 13 51.156 0.300 . 1 . . . . 31 LEU CA . 11085 1
306 . 1 1 31 31 LEU CB C 13 38.583 0.300 . 1 . . . . 31 LEU CB . 11085 1
307 . 1 1 31 31 LEU CD1 C 13 24.144 0.300 . 2 . . . . 31 LEU CD1 . 11085 1
308 . 1 1 31 31 LEU CD2 C 13 20.969 0.300 . 2 . . . . 31 LEU CD2 . 11085 1
309 . 1 1 31 31 LEU CG C 13 24.267 0.300 . 1 . . . . 31 LEU CG . 11085 1
310 . 1 1 31 31 LEU N N 15 115.938 0.300 . 1 . . . . 31 LEU N . 11085 1
311 . 1 1 32 32 SER H H 1 8.538 0.030 . 1 . . . . 32 SER H . 11085 1
312 . 1 1 32 32 SER HA H 1 4.486 0.030 . 1 . . . . 32 SER HA . 11085 1
313 . 1 1 32 32 SER HB2 H 1 3.831 0.030 . 2 . . . . 32 SER HB2 . 11085 1
314 . 1 1 32 32 SER HB3 H 1 3.732 0.030 . 2 . . . . 32 SER HB3 . 11085 1
315 . 1 1 32 32 SER C C 13 173.823 0.300 . 1 . . . . 32 SER C . 11085 1
316 . 1 1 32 32 SER CA C 13 55.736 0.300 . 1 . . . . 32 SER CA . 11085 1
317 . 1 1 32 32 SER CB C 13 60.675 0.300 . 1 . . . . 32 SER CB . 11085 1
318 . 1 1 32 32 SER N N 15 110.475 0.300 . 1 . . . . 32 SER N . 11085 1
319 . 1 1 33 33 SER H H 1 8.906 0.030 . 1 . . . . 33 SER H . 11085 1
320 . 1 1 33 33 SER HA H 1 4.337 0.030 . 1 . . . . 33 SER HA . 11085 1
321 . 1 1 33 33 SER HB2 H 1 4.000 0.030 . 1 . . . . 33 SER HB2 . 11085 1
322 . 1 1 33 33 SER HB3 H 1 4.000 0.030 . 1 . . . . 33 SER HB3 . 11085 1
323 . 1 1 33 33 SER C C 13 174.883 0.300 . 1 . . . . 33 SER C . 11085 1
324 . 1 1 33 33 SER CA C 13 60.246 0.300 . 1 . . . . 33 SER CA . 11085 1
325 . 1 1 33 33 SER CB C 13 60.800 0.300 . 1 . . . . 33 SER CB . 11085 1
326 . 1 1 33 33 SER N N 15 126.161 0.300 . 1 . . . . 33 SER N . 11085 1
327 . 1 1 34 34 SER H H 1 10.630 0.030 . 1 . . . . 34 SER H . 11085 1
328 . 1 1 34 34 SER HA H 1 4.318 0.030 . 1 . . . . 34 SER HA . 11085 1
329 . 1 1 34 34 SER HB2 H 1 3.724 0.030 . 2 . . . . 34 SER HB2 . 11085 1
330 . 1 1 34 34 SER HB3 H 1 3.690 0.030 . 2 . . . . 34 SER HB3 . 11085 1
331 . 1 1 34 34 SER C C 13 171.224 0.300 . 1 . . . . 34 SER C . 11085 1
332 . 1 1 34 34 SER CA C 13 58.701 0.300 . 1 . . . . 34 SER CA . 11085 1
333 . 1 1 34 34 SER CB C 13 61.414 0.300 . 1 . . . . 34 SER CB . 11085 1
334 . 1 1 34 34 SER N N 15 120.870 0.300 . 1 . . . . 34 SER N . 11085 1
335 . 1 1 35 35 TRP H H 1 7.840 0.030 . 1 . . . . 35 TRP H . 11085 1
336 . 1 1 35 35 TRP HA H 1 4.357 0.030 . 1 . . . . 35 TRP HA . 11085 1
337 . 1 1 35 35 TRP HB2 H 1 3.388 0.030 . 2 . . . . 35 TRP HB2 . 11085 1
338 . 1 1 35 35 TRP HB3 H 1 2.853 0.030 . 2 . . . . 35 TRP HB3 . 11085 1
339 . 1 1 35 35 TRP HD1 H 1 6.852 0.030 . 1 . . . . 35 TRP HD1 . 11085 1
340 . 1 1 35 35 TRP HE1 H 1 10.188 0.030 . 1 . . . . 35 TRP HE1 . 11085 1
341 . 1 1 35 35 TRP HE3 H 1 7.467 0.030 . 1 . . . . 35 TRP HE3 . 11085 1
342 . 1 1 35 35 TRP HH2 H 1 6.521 0.030 . 1 . . . . 35 TRP HH2 . 11085 1
343 . 1 1 35 35 TRP HZ2 H 1 6.951 0.030 . 1 . . . . 35 TRP HZ2 . 11085 1
344 . 1 1 35 35 TRP HZ3 H 1 6.425 0.030 . 1 . . . . 35 TRP HZ3 . 11085 1
345 . 1 1 35 35 TRP C C 13 173.798 0.300 . 1 . . . . 35 TRP C . 11085 1
346 . 1 1 35 35 TRP CA C 13 54.564 0.300 . 1 . . . . 35 TRP CA . 11085 1
347 . 1 1 35 35 TRP CB C 13 26.992 0.300 . 1 . . . . 35 TRP CB . 11085 1
348 . 1 1 35 35 TRP CD1 C 13 125.151 0.300 . 1 . . . . 35 TRP CD1 . 11085 1
349 . 1 1 35 35 TRP CE3 C 13 118.448 0.300 . 1 . . . . 35 TRP CE3 . 11085 1
350 . 1 1 35 35 TRP CH2 C 13 119.555 0.300 . 1 . . . . 35 TRP CH2 . 11085 1
351 . 1 1 35 35 TRP CZ2 C 13 111.878 0.300 . 1 . . . . 35 TRP CZ2 . 11085 1
352 . 1 1 35 35 TRP CZ3 C 13 119.574 0.300 . 1 . . . . 35 TRP CZ3 . 11085 1
353 . 1 1 35 35 TRP N N 15 119.677 0.300 . 1 . . . . 35 TRP N . 11085 1
354 . 1 1 35 35 TRP NE1 N 15 127.272 0.300 . 1 . . . . 35 TRP NE1 . 11085 1
355 . 1 1 36 36 ALA H H 1 7.120 0.030 . 1 . . . . 36 ALA H . 11085 1
356 . 1 1 36 36 ALA HA H 1 4.262 0.030 . 1 . . . . 36 ALA HA . 11085 1
357 . 1 1 36 36 ALA HB1 H 1 1.541 0.030 . 1 . . . . 36 ALA HB . 11085 1
358 . 1 1 36 36 ALA HB2 H 1 1.541 0.030 . 1 . . . . 36 ALA HB . 11085 1
359 . 1 1 36 36 ALA HB3 H 1 1.541 0.030 . 1 . . . . 36 ALA HB . 11085 1
360 . 1 1 36 36 ALA C C 13 174.712 0.300 . 1 . . . . 36 ALA C . 11085 1
361 . 1 1 36 36 ALA CA C 13 52.045 0.300 . 1 . . . . 36 ALA CA . 11085 1
362 . 1 1 36 36 ALA CB C 13 17.439 0.300 . 1 . . . . 36 ALA CB . 11085 1
363 . 1 1 36 36 ALA N N 15 120.455 0.300 . 1 . . . . 36 ALA N . 11085 1
364 . 1 1 37 37 ASP H H 1 7.515 0.030 . 1 . . . . 37 ASP H . 11085 1
365 . 1 1 37 37 ASP HA H 1 4.752 0.030 . 1 . . . . 37 ASP HA . 11085 1
366 . 1 1 37 37 ASP HB2 H 1 2.449 0.030 . 2 . . . . 37 ASP HB2 . 11085 1
367 . 1 1 37 37 ASP HB3 H 1 3.114 0.030 . 2 . . . . 37 ASP HB3 . 11085 1
368 . 1 1 37 37 ASP C C 13 174.258 0.300 . 1 . . . . 37 ASP C . 11085 1
369 . 1 1 37 37 ASP CA C 13 50.041 0.300 . 1 . . . . 37 ASP CA . 11085 1
370 . 1 1 37 37 ASP CB C 13 38.005 0.300 . 1 . . . . 37 ASP CB . 11085 1
371 . 1 1 37 37 ASP N N 15 112.275 0.300 . 1 . . . . 37 ASP N . 11085 1
372 . 1 1 38 38 GLY H H 1 7.303 0.030 . 1 . . . . 38 GLY H . 11085 1
373 . 1 1 38 38 GLY HA2 H 1 4.161 0.030 . 2 . . . . 38 GLY HA2 . 11085 1
374 . 1 1 38 38 GLY HA3 H 1 3.749 0.030 . 2 . . . . 38 GLY HA3 . 11085 1
375 . 1 1 38 38 GLY C C 13 172.609 0.300 . 1 . . . . 38 GLY C . 11085 1
376 . 1 1 38 38 GLY CA C 13 45.654 0.300 . 1 . . . . 38 GLY CA . 11085 1
377 . 1 1 38 38 GLY N N 15 106.016 0.300 . 1 . . . . 38 GLY N . 11085 1
378 . 1 1 39 39 LEU H H 1 7.560 0.030 . 1 . . . . 39 LEU H . 11085 1
379 . 1 1 39 39 LEU HA H 1 3.820 0.030 . 1 . . . . 39 LEU HA . 11085 1
380 . 1 1 39 39 LEU HB2 H 1 1.670 0.030 . 2 . . . . 39 LEU HB2 . 11085 1
381 . 1 1 39 39 LEU HB3 H 1 1.123 0.030 . 2 . . . . 39 LEU HB3 . 11085 1
382 . 1 1 39 39 LEU HD11 H 1 0.801 0.030 . 1 . . . . 39 LEU HD1 . 11085 1
383 . 1 1 39 39 LEU HD12 H 1 0.801 0.030 . 1 . . . . 39 LEU HD1 . 11085 1
384 . 1 1 39 39 LEU HD13 H 1 0.801 0.030 . 1 . . . . 39 LEU HD1 . 11085 1
385 . 1 1 39 39 LEU HD21 H 1 0.711 0.030 . 1 . . . . 39 LEU HD2 . 11085 1
386 . 1 1 39 39 LEU HD22 H 1 0.711 0.030 . 1 . . . . 39 LEU HD2 . 11085 1
387 . 1 1 39 39 LEU HD23 H 1 0.711 0.030 . 1 . . . . 39 LEU HD2 . 11085 1
388 . 1 1 39 39 LEU HG H 1 1.405 0.030 . 1 . . . . 39 LEU HG . 11085 1
389 . 1 1 39 39 LEU C C 13 176.562 0.300 . 1 . . . . 39 LEU C . 11085 1
390 . 1 1 39 39 LEU CA C 13 55.799 0.300 . 1 . . . . 39 LEU CA . 11085 1
391 . 1 1 39 39 LEU CB C 13 38.995 0.300 . 1 . . . . 39 LEU CB . 11085 1
392 . 1 1 39 39 LEU CD1 C 13 22.797 0.300 . 2 . . . . 39 LEU CD1 . 11085 1
393 . 1 1 39 39 LEU CD2 C 13 19.980 0.300 . 2 . . . . 39 LEU CD2 . 11085 1
394 . 1 1 39 39 LEU CG C 13 24.586 0.300 . 1 . . . . 39 LEU CG . 11085 1
395 . 1 1 39 39 LEU N N 15 119.439 0.300 . 1 . . . . 39 LEU N . 11085 1
396 . 1 1 40 40 ALA H H 1 8.721 0.030 . 1 . . . . 40 ALA H . 11085 1
397 . 1 1 40 40 ALA HA H 1 3.484 0.030 . 1 . . . . 40 ALA HA . 11085 1
398 . 1 1 40 40 ALA HB1 H 1 0.265 0.030 . 1 . . . . 40 ALA HB . 11085 1
399 . 1 1 40 40 ALA HB2 H 1 0.265 0.030 . 1 . . . . 40 ALA HB . 11085 1
400 . 1 1 40 40 ALA HB3 H 1 0.265 0.030 . 1 . . . . 40 ALA HB . 11085 1
401 . 1 1 40 40 ALA C C 13 176.524 0.300 . 1 . . . . 40 ALA C . 11085 1
402 . 1 1 40 40 ALA CA C 13 53.154 0.300 . 1 . . . . 40 ALA CA . 11085 1
403 . 1 1 40 40 ALA CB C 13 15.297 0.300 . 1 . . . . 40 ALA CB . 11085 1
404 . 1 1 40 40 ALA N N 15 121.280 0.300 . 1 . . . . 40 ALA N . 11085 1
405 . 1 1 41 41 LEU H H 1 8.443 0.030 . 1 . . . . 41 LEU H . 11085 1
406 . 1 1 41 41 LEU HA H 1 4.066 0.030 . 1 . . . . 41 LEU HA . 11085 1
407 . 1 1 41 41 LEU HB2 H 1 1.959 0.030 . 2 . . . . 41 LEU HB2 . 11085 1
408 . 1 1 41 41 LEU HB3 H 1 1.470 0.030 . 2 . . . . 41 LEU HB3 . 11085 1
409 . 1 1 41 41 LEU HD11 H 1 1.085 0.030 . 1 . . . . 41 LEU HD1 . 11085 1
410 . 1 1 41 41 LEU HD12 H 1 1.085 0.030 . 1 . . . . 41 LEU HD1 . 11085 1
411 . 1 1 41 41 LEU HD13 H 1 1.085 0.030 . 1 . . . . 41 LEU HD1 . 11085 1
412 . 1 1 41 41 LEU HD21 H 1 0.940 0.030 . 1 . . . . 41 LEU HD2 . 11085 1
413 . 1 1 41 41 LEU HD22 H 1 0.940 0.030 . 1 . . . . 41 LEU HD2 . 11085 1
414 . 1 1 41 41 LEU HD23 H 1 0.940 0.030 . 1 . . . . 41 LEU HD2 . 11085 1
415 . 1 1 41 41 LEU HG H 1 2.101 0.030 . 1 . . . . 41 LEU HG . 11085 1
416 . 1 1 41 41 LEU C C 13 176.629 0.300 . 1 . . . . 41 LEU C . 11085 1
417 . 1 1 41 41 LEU CA C 13 55.910 0.300 . 1 . . . . 41 LEU CA . 11085 1
418 . 1 1 41 41 LEU CB C 13 40.182 0.300 . 1 . . . . 41 LEU CB . 11085 1
419 . 1 1 41 41 LEU CD1 C 13 23.870 0.300 . 2 . . . . 41 LEU CD1 . 11085 1
420 . 1 1 41 41 LEU CD2 C 13 22.137 0.300 . 2 . . . . 41 LEU CD2 . 11085 1
421 . 1 1 41 41 LEU CG C 13 25.546 0.300 . 1 . . . . 41 LEU CG . 11085 1
422 . 1 1 41 41 LEU N N 15 118.211 0.300 . 1 . . . . 41 LEU N . 11085 1
423 . 1 1 42 42 CYS H H 1 7.498 0.030 . 1 . . . . 42 CYS H . 11085 1
424 . 1 1 42 42 CYS HA H 1 3.995 0.030 . 1 . . . . 42 CYS HA . 11085 1
425 . 1 1 42 42 CYS HB2 H 1 3.137 0.030 . 2 . . . . 42 CYS HB2 . 11085 1
426 . 1 1 42 42 CYS HB3 H 1 2.420 0.030 . 2 . . . . 42 CYS HB3 . 11085 1
427 . 1 1 42 42 CYS C C 13 173.466 0.300 . 1 . . . . 42 CYS C . 11085 1
428 . 1 1 42 42 CYS CA C 13 62.671 0.300 . 1 . . . . 42 CYS CA . 11085 1
429 . 1 1 42 42 CYS CB C 13 24.105 0.300 . 1 . . . . 42 CYS CB . 11085 1
430 . 1 1 42 42 CYS N N 15 115.802 0.300 . 1 . . . . 42 CYS N . 11085 1
431 . 1 1 43 43 ALA H H 1 8.210 0.030 . 1 . . . . 43 ALA H . 11085 1
432 . 1 1 43 43 ALA HA H 1 3.096 0.030 . 1 . . . . 43 ALA HA . 11085 1
433 . 1 1 43 43 ALA HB1 H 1 0.702 0.030 . 1 . . . . 43 ALA HB . 11085 1
434 . 1 1 43 43 ALA HB2 H 1 0.702 0.030 . 1 . . . . 43 ALA HB . 11085 1
435 . 1 1 43 43 ALA HB3 H 1 0.702 0.030 . 1 . . . . 43 ALA HB . 11085 1
436 . 1 1 43 43 ALA C C 13 176.613 0.300 . 1 . . . . 43 ALA C . 11085 1
437 . 1 1 43 43 ALA CA C 13 52.588 0.300 . 1 . . . . 43 ALA CA . 11085 1
438 . 1 1 43 43 ALA CB C 13 16.136 0.300 . 1 . . . . 43 ALA CB . 11085 1
439 . 1 1 43 43 ALA N N 15 121.261 0.300 . 1 . . . . 43 ALA N . 11085 1
440 . 1 1 44 44 LEU H H 1 7.850 0.030 . 1 . . . . 44 LEU H . 11085 1
441 . 1 1 44 44 LEU HA H 1 3.487 0.030 . 1 . . . . 44 LEU HA . 11085 1
442 . 1 1 44 44 LEU HB2 H 1 1.591 0.030 . 2 . . . . 44 LEU HB2 . 11085 1
443 . 1 1 44 44 LEU HB3 H 1 1.301 0.030 . 2 . . . . 44 LEU HB3 . 11085 1
444 . 1 1 44 44 LEU HD11 H 1 0.416 0.030 . 1 . . . . 44 LEU HD1 . 11085 1
445 . 1 1 44 44 LEU HD12 H 1 0.416 0.030 . 1 . . . . 44 LEU HD1 . 11085 1
446 . 1 1 44 44 LEU HD13 H 1 0.416 0.030 . 1 . . . . 44 LEU HD1 . 11085 1
447 . 1 1 44 44 LEU HD21 H 1 0.125 0.030 . 1 . . . . 44 LEU HD2 . 11085 1
448 . 1 1 44 44 LEU HD22 H 1 0.125 0.030 . 1 . . . . 44 LEU HD2 . 11085 1
449 . 1 1 44 44 LEU HD23 H 1 0.125 0.030 . 1 . . . . 44 LEU HD2 . 11085 1
450 . 1 1 44 44 LEU HG H 1 1.135 0.030 . 1 . . . . 44 LEU HG . 11085 1
451 . 1 1 44 44 LEU C C 13 175.293 0.300 . 1 . . . . 44 LEU C . 11085 1
452 . 1 1 44 44 LEU CA C 13 55.683 0.300 . 1 . . . . 44 LEU CA . 11085 1
453 . 1 1 44 44 LEU CB C 13 40.231 0.300 . 1 . . . . 44 LEU CB . 11085 1
454 . 1 1 44 44 LEU CD1 C 13 21.898 0.300 . 2 . . . . 44 LEU CD1 . 11085 1
455 . 1 1 44 44 LEU CD2 C 13 22.591 0.300 . 2 . . . . 44 LEU CD2 . 11085 1
456 . 1 1 44 44 LEU CG C 13 24.033 0.300 . 1 . . . . 44 LEU CG . 11085 1
457 . 1 1 44 44 LEU N N 15 118.456 0.300 . 1 . . . . 44 LEU N . 11085 1
458 . 1 1 45 45 VAL H H 1 7.594 0.030 . 1 . . . . 45 VAL H . 11085 1
459 . 1 1 45 45 VAL HA H 1 3.334 0.030 . 1 . . . . 45 VAL HA . 11085 1
460 . 1 1 45 45 VAL HB H 1 2.040 0.030 . 1 . . . . 45 VAL HB . 11085 1
461 . 1 1 45 45 VAL HG11 H 1 0.718 0.030 . 1 . . . . 45 VAL HG1 . 11085 1
462 . 1 1 45 45 VAL HG12 H 1 0.718 0.030 . 1 . . . . 45 VAL HG1 . 11085 1
463 . 1 1 45 45 VAL HG13 H 1 0.718 0.030 . 1 . . . . 45 VAL HG1 . 11085 1
464 . 1 1 45 45 VAL HG21 H 1 1.032 0.030 . 1 . . . . 45 VAL HG2 . 11085 1
465 . 1 1 45 45 VAL HG22 H 1 1.032 0.030 . 1 . . . . 45 VAL HG2 . 11085 1
466 . 1 1 45 45 VAL HG23 H 1 1.032 0.030 . 1 . . . . 45 VAL HG2 . 11085 1
467 . 1 1 45 45 VAL C C 13 174.610 0.300 . 1 . . . . 45 VAL C . 11085 1
468 . 1 1 45 45 VAL CA C 13 64.616 0.300 . 1 . . . . 45 VAL CA . 11085 1
469 . 1 1 45 45 VAL CB C 13 29.225 0.300 . 1 . . . . 45 VAL CB . 11085 1
470 . 1 1 45 45 VAL CG1 C 13 19.694 0.300 . 2 . . . . 45 VAL CG1 . 11085 1
471 . 1 1 45 45 VAL CG2 C 13 20.308 0.300 . 2 . . . . 45 VAL CG2 . 11085 1
472 . 1 1 45 45 VAL N N 15 114.508 0.300 . 1 . . . . 45 VAL N . 11085 1
473 . 1 1 46 46 TYR H H 1 8.229 0.030 . 1 . . . . 46 TYR H . 11085 1
474 . 1 1 46 46 TYR HA H 1 4.111 0.030 . 1 . . . . 46 TYR HA . 11085 1
475 . 1 1 46 46 TYR HB2 H 1 3.027 0.030 . 1 . . . . 46 TYR HB2 . 11085 1
476 . 1 1 46 46 TYR HB3 H 1 3.027 0.030 . 1 . . . . 46 TYR HB3 . 11085 1
477 . 1 1 46 46 TYR HD1 H 1 7.193 0.030 . 1 . . . . 46 TYR HD1 . 11085 1
478 . 1 1 46 46 TYR HD2 H 1 7.193 0.030 . 1 . . . . 46 TYR HD2 . 11085 1
479 . 1 1 46 46 TYR HE1 H 1 6.778 0.030 . 1 . . . . 46 TYR HE1 . 11085 1
480 . 1 1 46 46 TYR HE2 H 1 6.778 0.030 . 1 . . . . 46 TYR HE2 . 11085 1
481 . 1 1 46 46 TYR C C 13 175.546 0.300 . 1 . . . . 46 TYR C . 11085 1
482 . 1 1 46 46 TYR CA C 13 58.980 0.300 . 1 . . . . 46 TYR CA . 11085 1
483 . 1 1 46 46 TYR CB C 13 36.109 0.300 . 1 . . . . 46 TYR CB . 11085 1
484 . 1 1 46 46 TYR CD1 C 13 131.194 0.300 . 1 . . . . 46 TYR CD1 . 11085 1
485 . 1 1 46 46 TYR CD2 C 13 131.194 0.300 . 1 . . . . 46 TYR CD2 . 11085 1
486 . 1 1 46 46 TYR CE1 C 13 115.592 0.300 . 1 . . . . 46 TYR CE1 . 11085 1
487 . 1 1 46 46 TYR CE2 C 13 115.592 0.300 . 1 . . . . 46 TYR CE2 . 11085 1
488 . 1 1 46 46 TYR N N 15 117.164 0.300 . 1 . . . . 46 TYR N . 11085 1
489 . 1 1 47 47 ARG H H 1 7.954 0.030 . 1 . . . . 47 ARG H . 11085 1
490 . 1 1 47 47 ARG HA H 1 3.914 0.030 . 1 . . . . 47 ARG HA . 11085 1
491 . 1 1 47 47 ARG HB2 H 1 2.014 0.030 . 2 . . . . 47 ARG HB2 . 11085 1
492 . 1 1 47 47 ARG HB3 H 1 1.761 0.030 . 2 . . . . 47 ARG HB3 . 11085 1
493 . 1 1 47 47 ARG HD2 H 1 3.215 0.030 . 1 . . . . 47 ARG HD2 . 11085 1
494 . 1 1 47 47 ARG HD3 H 1 3.215 0.030 . 1 . . . . 47 ARG HD3 . 11085 1
495 . 1 1 47 47 ARG HE H 1 7.344 0.030 . 1 . . . . 47 ARG HE . 11085 1
496 . 1 1 47 47 ARG HG2 H 1 1.532 0.030 . 2 . . . . 47 ARG HG2 . 11085 1
497 . 1 1 47 47 ARG HG3 H 1 1.806 0.030 . 2 . . . . 47 ARG HG3 . 11085 1
498 . 1 1 47 47 ARG C C 13 176.085 0.300 . 1 . . . . 47 ARG C . 11085 1
499 . 1 1 47 47 ARG CA C 13 54.679 0.300 . 1 . . . . 47 ARG CA . 11085 1
500 . 1 1 47 47 ARG CB C 13 27.042 0.300 . 1 . . . . 47 ARG CB . 11085 1
501 . 1 1 47 47 ARG CD C 13 40.373 0.300 . 1 . . . . 47 ARG CD . 11085 1
502 . 1 1 47 47 ARG CG C 13 25.018 0.300 . 1 . . . . 47 ARG CG . 11085 1
503 . 1 1 47 47 ARG N N 15 117.270 0.300 . 1 . . . . 47 ARG N . 11085 1
504 . 1 1 47 47 ARG NE N 15 85.021 0.300 . 1 . . . . 47 ARG NE . 11085 1
505 . 1 1 48 48 LEU H H 1 7.416 0.030 . 1 . . . . 48 LEU H . 11085 1
506 . 1 1 48 48 LEU HA H 1 4.013 0.030 . 1 . . . . 48 LEU HA . 11085 1
507 . 1 1 48 48 LEU HB2 H 1 1.483 0.030 . 2 . . . . 48 LEU HB2 . 11085 1
508 . 1 1 48 48 LEU HB3 H 1 0.899 0.030 . 2 . . . . 48 LEU HB3 . 11085 1
509 . 1 1 48 48 LEU HD11 H 1 0.589 0.030 . 1 . . . . 48 LEU HD1 . 11085 1
510 . 1 1 48 48 LEU HD12 H 1 0.589 0.030 . 1 . . . . 48 LEU HD1 . 11085 1
511 . 1 1 48 48 LEU HD13 H 1 0.589 0.030 . 1 . . . . 48 LEU HD1 . 11085 1
512 . 1 1 48 48 LEU HD21 H 1 0.614 0.030 . 1 . . . . 48 LEU HD2 . 11085 1
513 . 1 1 48 48 LEU HD22 H 1 0.614 0.030 . 1 . . . . 48 LEU HD2 . 11085 1
514 . 1 1 48 48 LEU HD23 H 1 0.614 0.030 . 1 . . . . 48 LEU HD2 . 11085 1
515 . 1 1 48 48 LEU HG H 1 1.707 0.030 . 1 . . . . 48 LEU HG . 11085 1
516 . 1 1 48 48 LEU C C 13 174.579 0.300 . 1 . . . . 48 LEU C . 11085 1
517 . 1 1 48 48 LEU CA C 13 53.596 0.300 . 1 . . . . 48 LEU CA . 11085 1
518 . 1 1 48 48 LEU CB C 13 39.777 0.300 . 1 . . . . 48 LEU CB . 11085 1
519 . 1 1 48 48 LEU CD1 C 13 24.115 0.300 . 2 . . . . 48 LEU CD1 . 11085 1
520 . 1 1 48 48 LEU CD2 C 13 19.745 0.300 . 2 . . . . 48 LEU CD2 . 11085 1
521 . 1 1 48 48 LEU CG C 13 24.257 0.300 . 1 . . . . 48 LEU CG . 11085 1
522 . 1 1 48 48 LEU N N 15 117.031 0.300 . 1 . . . . 48 LEU N . 11085 1
523 . 1 1 49 49 GLN H H 1 7.790 0.030 . 1 . . . . 49 GLN H . 11085 1
524 . 1 1 49 49 GLN HA H 1 4.699 0.030 . 1 . . . . 49 GLN HA . 11085 1
525 . 1 1 49 49 GLN HB2 H 1 2.065 0.030 . 2 . . . . 49 GLN HB2 . 11085 1
526 . 1 1 49 49 GLN HB3 H 1 1.642 0.030 . 2 . . . . 49 GLN HB3 . 11085 1
527 . 1 1 49 49 GLN HE21 H 1 7.353 0.030 . 2 . . . . 49 GLN HE21 . 11085 1
528 . 1 1 49 49 GLN HE22 H 1 6.584 0.030 . 2 . . . . 49 GLN HE22 . 11085 1
529 . 1 1 49 49 GLN HG2 H 1 2.037 0.030 . 2 . . . . 49 GLN HG2 . 11085 1
530 . 1 1 49 49 GLN HG3 H 1 2.084 0.030 . 2 . . . . 49 GLN HG3 . 11085 1
531 . 1 1 49 49 GLN C C 13 169.047 0.300 . 1 . . . . 49 GLN C . 11085 1
532 . 1 1 49 49 GLN CA C 13 50.572 0.300 . 1 . . . . 49 GLN CA . 11085 1
533 . 1 1 49 49 GLN CB C 13 27.367 0.300 . 1 . . . . 49 GLN CB . 11085 1
534 . 1 1 49 49 GLN CG C 13 31.937 0.300 . 1 . . . . 49 GLN CG . 11085 1
535 . 1 1 49 49 GLN N N 15 119.393 0.300 . 1 . . . . 49 GLN N . 11085 1
536 . 1 1 49 49 GLN NE2 N 15 111.131 0.300 . 1 . . . . 49 GLN NE2 . 11085 1
537 . 1 1 50 50 PRO HA H 1 4.318 0.030 . 1 . . . . 50 PRO HA . 11085 1
538 . 1 1 50 50 PRO HB2 H 1 2.075 0.030 . 2 . . . . 50 PRO HB2 . 11085 1
539 . 1 1 50 50 PRO HB3 H 1 1.782 0.030 . 2 . . . . 50 PRO HB3 . 11085 1
540 . 1 1 50 50 PRO HD2 H 1 3.523 0.030 . 2 . . . . 50 PRO HD2 . 11085 1
541 . 1 1 50 50 PRO HD3 H 1 3.370 0.030 . 2 . . . . 50 PRO HD3 . 11085 1
542 . 1 1 50 50 PRO HG2 H 1 1.867 0.030 . 1 . . . . 50 PRO HG2 . 11085 1
543 . 1 1 50 50 PRO HG3 H 1 1.867 0.030 . 1 . . . . 50 PRO HG3 . 11085 1
544 . 1 1 50 50 PRO C C 13 175.692 0.300 . 1 . . . . 50 PRO C . 11085 1
545 . 1 1 50 50 PRO CA C 13 61.573 0.300 . 1 . . . . 50 PRO CA . 11085 1
546 . 1 1 50 50 PRO CB C 13 29.556 0.300 . 1 . . . . 50 PRO CB . 11085 1
547 . 1 1 50 50 PRO CD C 13 47.977 0.300 . 1 . . . . 50 PRO CD . 11085 1
548 . 1 1 50 50 PRO CG C 13 24.857 0.300 . 1 . . . . 50 PRO CG . 11085 1
549 . 1 1 51 51 GLY H H 1 8.329 0.030 . 1 . . . . 51 GLY H . 11085 1
550 . 1 1 51 51 GLY HA2 H 1 3.898 0.030 . 2 . . . . 51 GLY HA2 . 11085 1
551 . 1 1 51 51 GLY HA3 H 1 3.830 0.030 . 2 . . . . 51 GLY HA3 . 11085 1
552 . 1 1 51 51 GLY C C 13 172.504 0.300 . 1 . . . . 51 GLY C . 11085 1
553 . 1 1 51 51 GLY CA C 13 43.126 0.300 . 1 . . . . 51 GLY CA . 11085 1
554 . 1 1 51 51 GLY N N 15 108.269 0.300 . 1 . . . . 51 GLY N . 11085 1
555 . 1 1 52 52 LEU H H 1 7.948 0.030 . 1 . . . . 52 LEU H . 11085 1
556 . 1 1 52 52 LEU HA H 1 4.371 0.030 . 1 . . . . 52 LEU HA . 11085 1
557 . 1 1 52 52 LEU HB2 H 1 1.830 0.030 . 2 . . . . 52 LEU HB2 . 11085 1
558 . 1 1 52 52 LEU HB3 H 1 1.633 0.030 . 2 . . . . 52 LEU HB3 . 11085 1
559 . 1 1 52 52 LEU HD11 H 1 0.769 0.030 . 1 . . . . 52 LEU HD1 . 11085 1
560 . 1 1 52 52 LEU HD12 H 1 0.769 0.030 . 1 . . . . 52 LEU HD1 . 11085 1
561 . 1 1 52 52 LEU HD13 H 1 0.769 0.030 . 1 . . . . 52 LEU HD1 . 11085 1
562 . 1 1 52 52 LEU HD21 H 1 0.759 0.030 . 1 . . . . 52 LEU HD2 . 11085 1
563 . 1 1 52 52 LEU HD22 H 1 0.759 0.030 . 1 . . . . 52 LEU HD2 . 11085 1
564 . 1 1 52 52 LEU HD23 H 1 0.759 0.030 . 1 . . . . 52 LEU HD2 . 11085 1
565 . 1 1 52 52 LEU HG H 1 1.635 0.030 . 1 . . . . 52 LEU HG . 11085 1
566 . 1 1 52 52 LEU C C 13 174.099 0.300 . 1 . . . . 52 LEU C . 11085 1
567 . 1 1 52 52 LEU CA C 13 52.818 0.300 . 1 . . . . 52 LEU CA . 11085 1
568 . 1 1 52 52 LEU CB C 13 40.684 0.300 . 1 . . . . 52 LEU CB . 11085 1
569 . 1 1 52 52 LEU CD1 C 13 23.374 0.300 . 2 . . . . 52 LEU CD1 . 11085 1
570 . 1 1 52 52 LEU CD2 C 13 21.230 0.300 . 2 . . . . 52 LEU CD2 . 11085 1
571 . 1 1 52 52 LEU CG C 13 24.391 0.300 . 1 . . . . 52 LEU CG . 11085 1
572 . 1 1 52 52 LEU N N 15 121.007 0.300 . 1 . . . . 52 LEU N . 11085 1
573 . 1 1 53 53 LEU H H 1 7.911 0.030 . 1 . . . . 53 LEU H . 11085 1
574 . 1 1 53 53 LEU HA H 1 4.283 0.030 . 1 . . . . 53 LEU HA . 11085 1
575 . 1 1 53 53 LEU HB2 H 1 1.441 0.030 . 2 . . . . 53 LEU HB2 . 11085 1
576 . 1 1 53 53 LEU HB3 H 1 1.512 0.030 . 2 . . . . 53 LEU HB3 . 11085 1
577 . 1 1 53 53 LEU HD11 H 1 0.702 0.030 . 1 . . . . 53 LEU HD1 . 11085 1
578 . 1 1 53 53 LEU HD12 H 1 0.702 0.030 . 1 . . . . 53 LEU HD1 . 11085 1
579 . 1 1 53 53 LEU HD13 H 1 0.702 0.030 . 1 . . . . 53 LEU HD1 . 11085 1
580 . 1 1 53 53 LEU HD21 H 1 0.652 0.030 . 1 . . . . 53 LEU HD2 . 11085 1
581 . 1 1 53 53 LEU HD22 H 1 0.652 0.030 . 1 . . . . 53 LEU HD2 . 11085 1
582 . 1 1 53 53 LEU HD23 H 1 0.652 0.030 . 1 . . . . 53 LEU HD2 . 11085 1
583 . 1 1 53 53 LEU HG H 1 1.487 0.030 . 1 . . . . 53 LEU HG . 11085 1
584 . 1 1 53 53 LEU C C 13 173.510 0.300 . 1 . . . . 53 LEU C . 11085 1
585 . 1 1 53 53 LEU CA C 13 52.225 0.300 . 1 . . . . 53 LEU CA . 11085 1
586 . 1 1 53 53 LEU CB C 13 40.560 0.300 . 1 . . . . 53 LEU CB . 11085 1
587 . 1 1 53 53 LEU CD1 C 13 22.772 0.300 . 2 . . . . 53 LEU CD1 . 11085 1
588 . 1 1 53 53 LEU CD2 C 13 21.771 0.300 . 2 . . . . 53 LEU CD2 . 11085 1
589 . 1 1 53 53 LEU CG C 13 24.633 0.300 . 1 . . . . 53 LEU CG . 11085 1
590 . 1 1 53 53 LEU N N 15 120.156 0.300 . 1 . . . . 53 LEU N . 11085 1
591 . 1 1 54 54 GLU H H 1 8.456 0.030 . 1 . . . . 54 GLU H . 11085 1
592 . 1 1 54 54 GLU HA H 1 4.262 0.030 . 1 . . . . 54 GLU HA . 11085 1
593 . 1 1 54 54 GLU HB2 H 1 1.823 0.030 . 2 . . . . 54 GLU HB2 . 11085 1
594 . 1 1 54 54 GLU HB3 H 1 1.709 0.030 . 2 . . . . 54 GLU HB3 . 11085 1
595 . 1 1 54 54 GLU HG2 H 1 2.034 0.030 . 1 . . . . 54 GLU HG2 . 11085 1
596 . 1 1 54 54 GLU HG3 H 1 2.034 0.030 . 1 . . . . 54 GLU HG3 . 11085 1
597 . 1 1 54 54 GLU C C 13 173.030 0.300 . 1 . . . . 54 GLU C . 11085 1
598 . 1 1 54 54 GLU CA C 13 51.790 0.300 . 1 . . . . 54 GLU CA . 11085 1
599 . 1 1 54 54 GLU CB C 13 27.432 0.300 . 1 . . . . 54 GLU CB . 11085 1
600 . 1 1 54 54 GLU CG C 13 33.656 0.300 . 1 . . . . 54 GLU CG . 11085 1
601 . 1 1 54 54 GLU N N 15 123.488 0.300 . 1 . . . . 54 GLU N . 11085 1
602 . 1 1 55 55 PRO HA H 1 4.047 0.030 . 1 . . . . 55 PRO HA . 11085 1
603 . 1 1 55 55 PRO HB2 H 1 1.862 0.030 . 2 . . . . 55 PRO HB2 . 11085 1
604 . 1 1 55 55 PRO HB3 H 1 1.561 0.030 . 2 . . . . 55 PRO HB3 . 11085 1
605 . 1 1 55 55 PRO HD2 H 1 3.336 0.030 . 2 . . . . 55 PRO HD2 . 11085 1
606 . 1 1 55 55 PRO HD3 H 1 3.558 0.030 . 2 . . . . 55 PRO HD3 . 11085 1
607 . 1 1 55 55 PRO HG2 H 1 1.325 0.030 . 2 . . . . 55 PRO HG2 . 11085 1
608 . 1 1 55 55 PRO HG3 H 1 1.474 0.030 . 2 . . . . 55 PRO HG3 . 11085 1
609 . 1 1 55 55 PRO C C 13 176.265 0.300 . 1 . . . . 55 PRO C . 11085 1
610 . 1 1 55 55 PRO CA C 13 61.997 0.300 . 1 . . . . 55 PRO CA . 11085 1
611 . 1 1 55 55 PRO CB C 13 29.314 0.300 . 1 . . . . 55 PRO CB . 11085 1
612 . 1 1 55 55 PRO CD C 13 48.119 0.300 . 1 . . . . 55 PRO CD . 11085 1
613 . 1 1 55 55 PRO CG C 13 24.775 0.300 . 1 . . . . 55 PRO CG . 11085 1
614 . 1 1 56 56 SER H H 1 8.402 0.030 . 1 . . . . 56 SER H . 11085 1
615 . 1 1 56 56 SER HA H 1 3.981 0.030 . 1 . . . . 56 SER HA . 11085 1
616 . 1 1 56 56 SER HB2 H 1 3.755 0.030 . 1 . . . . 56 SER HB2 . 11085 1
617 . 1 1 56 56 SER HB3 H 1 3.755 0.030 . 1 . . . . 56 SER HB3 . 11085 1
618 . 1 1 56 56 SER C C 13 173.909 0.300 . 1 . . . . 56 SER C . 11085 1
619 . 1 1 56 56 SER CA C 13 58.425 0.300 . 1 . . . . 56 SER CA . 11085 1
620 . 1 1 56 56 SER CB C 13 60.094 0.300 . 1 . . . . 56 SER CB . 11085 1
621 . 1 1 56 56 SER N N 15 115.065 0.300 . 1 . . . . 56 SER N . 11085 1
622 . 1 1 57 57 GLU H H 1 8.224 0.030 . 1 . . . . 57 GLU H . 11085 1
623 . 1 1 57 57 GLU HA H 1 4.046 0.030 . 1 . . . . 57 GLU HA . 11085 1
624 . 1 1 57 57 GLU HB2 H 1 1.904 0.030 . 2 . . . . 57 GLU HB2 . 11085 1
625 . 1 1 57 57 GLU HB3 H 1 2.055 0.030 . 2 . . . . 57 GLU HB3 . 11085 1
626 . 1 1 57 57 GLU HG2 H 1 2.158 0.030 . 2 . . . . 57 GLU HG2 . 11085 1
627 . 1 1 57 57 GLU HG3 H 1 2.084 0.030 . 2 . . . . 57 GLU HG3 . 11085 1
628 . 1 1 57 57 GLU C C 13 175.029 0.300 . 1 . . . . 57 GLU C . 11085 1
629 . 1 1 57 57 GLU CA C 13 55.312 0.300 . 1 . . . . 57 GLU CA . 11085 1
630 . 1 1 57 57 GLU CB C 13 26.877 0.300 . 1 . . . . 57 GLU CB . 11085 1
631 . 1 1 57 57 GLU CG C 13 34.363 0.300 . 1 . . . . 57 GLU CG . 11085 1
632 . 1 1 57 57 GLU N N 15 120.240 0.300 . 1 . . . . 57 GLU N . 11085 1
633 . 1 1 58 58 LEU H H 1 7.195 0.030 . 1 . . . . 58 LEU H . 11085 1
634 . 1 1 58 58 LEU HA H 1 3.905 0.030 . 1 . . . . 58 LEU HA . 11085 1
635 . 1 1 58 58 LEU HB2 H 1 1.402 0.030 . 1 . . . . 58 LEU HB2 . 11085 1
636 . 1 1 58 58 LEU HB3 H 1 1.402 0.030 . 1 . . . . 58 LEU HB3 . 11085 1
637 . 1 1 58 58 LEU HD11 H 1 0.241 0.030 . 1 . . . . 58 LEU HD1 . 11085 1
638 . 1 1 58 58 LEU HD12 H 1 0.241 0.030 . 1 . . . . 58 LEU HD1 . 11085 1
639 . 1 1 58 58 LEU HD13 H 1 0.241 0.030 . 1 . . . . 58 LEU HD1 . 11085 1
640 . 1 1 58 58 LEU HD21 H 1 0.488 0.030 . 1 . . . . 58 LEU HD2 . 11085 1
641 . 1 1 58 58 LEU HD22 H 1 0.488 0.030 . 1 . . . . 58 LEU HD2 . 11085 1
642 . 1 1 58 58 LEU HD23 H 1 0.488 0.030 . 1 . . . . 58 LEU HD2 . 11085 1
643 . 1 1 58 58 LEU HG H 1 1.247 0.030 . 1 . . . . 58 LEU HG . 11085 1
644 . 1 1 58 58 LEU C C 13 175.721 0.300 . 1 . . . . 58 LEU C . 11085 1
645 . 1 1 58 58 LEU CA C 13 53.455 0.300 . 1 . . . . 58 LEU CA . 11085 1
646 . 1 1 58 58 LEU CB C 13 39.612 0.300 . 1 . . . . 58 LEU CB . 11085 1
647 . 1 1 58 58 LEU CD1 C 13 20.951 0.300 . 2 . . . . 58 LEU CD1 . 11085 1
648 . 1 1 58 58 LEU CD2 C 13 22.785 0.300 . 2 . . . . 58 LEU CD2 . 11085 1
649 . 1 1 58 58 LEU CG C 13 24.607 0.300 . 1 . . . . 58 LEU CG . 11085 1
650 . 1 1 58 58 LEU N N 15 118.866 0.300 . 1 . . . . 58 LEU N . 11085 1
651 . 1 1 59 59 GLN H H 1 7.412 0.030 . 1 . . . . 59 GLN H . 11085 1
652 . 1 1 59 59 GLN HA H 1 3.873 0.030 . 1 . . . . 59 GLN HA . 11085 1
653 . 1 1 59 59 GLN HB2 H 1 1.920 0.030 . 1 . . . . 59 GLN HB2 . 11085 1
654 . 1 1 59 59 GLN HB3 H 1 1.920 0.030 . 1 . . . . 59 GLN HB3 . 11085 1
655 . 1 1 59 59 GLN HE21 H 1 7.408 0.030 . 2 . . . . 59 GLN HE21 . 11085 1
656 . 1 1 59 59 GLN HE22 H 1 6.679 0.030 . 2 . . . . 59 GLN HE22 . 11085 1
657 . 1 1 59 59 GLN HG2 H 1 2.256 0.030 . 1 . . . . 59 GLN HG2 . 11085 1
658 . 1 1 59 59 GLN HG3 H 1 2.256 0.030 . 1 . . . . 59 GLN HG3 . 11085 1
659 . 1 1 59 59 GLN C C 13 174.502 0.300 . 1 . . . . 59 GLN C . 11085 1
660 . 1 1 59 59 GLN CA C 13 55.418 0.300 . 1 . . . . 59 GLN CA . 11085 1
661 . 1 1 59 59 GLN CB C 13 25.929 0.300 . 1 . . . . 59 GLN CB . 11085 1
662 . 1 1 59 59 GLN CG C 13 31.445 0.300 . 1 . . . . 59 GLN CG . 11085 1
663 . 1 1 59 59 GLN N N 15 116.459 0.300 . 1 . . . . 59 GLN N . 11085 1
664 . 1 1 59 59 GLN NE2 N 15 111.682 0.300 . 1 . . . . 59 GLN NE2 . 11085 1
665 . 1 1 60 60 GLY H H 1 8.193 0.030 . 1 . . . . 60 GLY H . 11085 1
666 . 1 1 60 60 GLY HA2 H 1 3.899 0.030 . 2 . . . . 60 GLY HA2 . 11085 1
667 . 1 1 60 60 GLY HA3 H 1 3.756 0.030 . 2 . . . . 60 GLY HA3 . 11085 1
668 . 1 1 60 60 GLY C C 13 172.282 0.300 . 1 . . . . 60 GLY C . 11085 1
669 . 1 1 60 60 GLY CA C 13 42.790 0.300 . 1 . . . . 60 GLY CA . 11085 1
670 . 1 1 60 60 GLY N N 15 108.350 0.300 . 1 . . . . 60 GLY N . 11085 1
671 . 1 1 61 61 LEU H H 1 7.322 0.030 . 1 . . . . 61 LEU H . 11085 1
672 . 1 1 61 61 LEU HA H 1 4.240 0.030 . 1 . . . . 61 LEU HA . 11085 1
673 . 1 1 61 61 LEU HB2 H 1 1.721 0.030 . 2 . . . . 61 LEU HB2 . 11085 1
674 . 1 1 61 61 LEU HB3 H 1 1.428 0.030 . 2 . . . . 61 LEU HB3 . 11085 1
675 . 1 1 61 61 LEU HD11 H 1 0.658 0.030 . 1 . . . . 61 LEU HD1 . 11085 1
676 . 1 1 61 61 LEU HD12 H 1 0.658 0.030 . 1 . . . . 61 LEU HD1 . 11085 1
677 . 1 1 61 61 LEU HD13 H 1 0.658 0.030 . 1 . . . . 61 LEU HD1 . 11085 1
678 . 1 1 61 61 LEU HD21 H 1 0.662 0.030 . 1 . . . . 61 LEU HD2 . 11085 1
679 . 1 1 61 61 LEU HD22 H 1 0.662 0.030 . 1 . . . . 61 LEU HD2 . 11085 1
680 . 1 1 61 61 LEU HD23 H 1 0.662 0.030 . 1 . . . . 61 LEU HD2 . 11085 1
681 . 1 1 61 61 LEU HG H 1 1.612 0.030 . 1 . . . . 61 LEU HG . 11085 1
682 . 1 1 61 61 LEU C C 13 175.897 0.300 . 1 . . . . 61 LEU C . 11085 1
683 . 1 1 61 61 LEU CA C 13 52.730 0.300 . 1 . . . . 61 LEU CA . 11085 1
684 . 1 1 61 61 LEU CB C 13 40.548 0.300 . 1 . . . . 61 LEU CB . 11085 1
685 . 1 1 61 61 LEU CD1 C 13 23.071 0.300 . 2 . . . . 61 LEU CD1 . 11085 1
686 . 1 1 61 61 LEU CD2 C 13 20.080 0.300 . 2 . . . . 61 LEU CD2 . 11085 1
687 . 1 1 61 61 LEU CG C 13 24.306 0.300 . 1 . . . . 61 LEU CG . 11085 1
688 . 1 1 61 61 LEU N N 15 120.215 0.300 . 1 . . . . 61 LEU N . 11085 1
689 . 1 1 62 62 GLY H H 1 8.322 0.030 . 1 . . . . 62 GLY H . 11085 1
690 . 1 1 62 62 GLY HA2 H 1 4.062 0.030 . 2 . . . . 62 GLY HA2 . 11085 1
691 . 1 1 62 62 GLY HA3 H 1 3.987 0.030 . 2 . . . . 62 GLY HA3 . 11085 1
692 . 1 1 62 62 GLY C C 13 170.906 0.300 . 1 . . . . 62 GLY C . 11085 1
693 . 1 1 62 62 GLY CA C 13 41.852 0.300 . 1 . . . . 62 GLY CA . 11085 1
694 . 1 1 62 62 GLY N N 15 108.527 0.300 . 1 . . . . 62 GLY N . 11085 1
695 . 1 1 63 63 ALA H H 1 8.215 0.030 . 1 . . . . 63 ALA H . 11085 1
696 . 1 1 63 63 ALA HA H 1 4.021 0.030 . 1 . . . . 63 ALA HA . 11085 1
697 . 1 1 63 63 ALA HB1 H 1 1.474 0.030 . 1 . . . . 63 ALA HB . 11085 1
698 . 1 1 63 63 ALA HB2 H 1 1.474 0.030 . 1 . . . . 63 ALA HB . 11085 1
699 . 1 1 63 63 ALA HB3 H 1 1.474 0.030 . 1 . . . . 63 ALA HB . 11085 1
700 . 1 1 63 63 ALA C C 13 178.516 0.300 . 1 . . . . 63 ALA C . 11085 1
701 . 1 1 63 63 ALA CA C 13 53.526 0.300 . 1 . . . . 63 ALA CA . 11085 1
702 . 1 1 63 63 ALA CB C 13 17.645 0.300 . 1 . . . . 63 ALA CB . 11085 1
703 . 1 1 63 63 ALA N N 15 121.446 0.300 . 1 . . . . 63 ALA N . 11085 1
704 . 1 1 64 64 LEU H H 1 8.617 0.030 . 1 . . . . 64 LEU H . 11085 1
705 . 1 1 64 64 LEU HA H 1 3.859 0.030 . 1 . . . . 64 LEU HA . 11085 1
706 . 1 1 64 64 LEU HB2 H 1 1.613 0.030 . 2 . . . . 64 LEU HB2 . 11085 1
707 . 1 1 64 64 LEU HB3 H 1 1.548 0.030 . 2 . . . . 64 LEU HB3 . 11085 1
708 . 1 1 64 64 LEU HD11 H 1 0.803 0.030 . 1 . . . . 64 LEU HD1 . 11085 1
709 . 1 1 64 64 LEU HD12 H 1 0.803 0.030 . 1 . . . . 64 LEU HD1 . 11085 1
710 . 1 1 64 64 LEU HD13 H 1 0.803 0.030 . 1 . . . . 64 LEU HD1 . 11085 1
711 . 1 1 64 64 LEU HD21 H 1 0.819 0.030 . 1 . . . . 64 LEU HD2 . 11085 1
712 . 1 1 64 64 LEU HD22 H 1 0.819 0.030 . 1 . . . . 64 LEU HD2 . 11085 1
713 . 1 1 64 64 LEU HD23 H 1 0.819 0.030 . 1 . . . . 64 LEU HD2 . 11085 1
714 . 1 1 64 64 LEU HG H 1 1.544 0.030 . 1 . . . . 64 LEU HG . 11085 1
715 . 1 1 64 64 LEU C C 13 176.150 0.300 . 1 . . . . 64 LEU C . 11085 1
716 . 1 1 64 64 LEU CA C 13 56.178 0.300 . 1 . . . . 64 LEU CA . 11085 1
717 . 1 1 64 64 LEU CB C 13 39.220 0.300 . 1 . . . . 64 LEU CB . 11085 1
718 . 1 1 64 64 LEU CD1 C 13 21.646 0.300 . 2 . . . . 64 LEU CD1 . 11085 1
719 . 1 1 64 64 LEU CD2 C 13 22.551 0.300 . 2 . . . . 64 LEU CD2 . 11085 1
720 . 1 1 64 64 LEU CG C 13 24.732 0.300 . 1 . . . . 64 LEU CG . 11085 1
721 . 1 1 64 64 LEU N N 15 119.709 0.300 . 1 . . . . 64 LEU N . 11085 1
722 . 1 1 65 65 GLU H H 1 8.229 0.030 . 1 . . . . 65 GLU H . 11085 1
723 . 1 1 65 65 GLU HA H 1 3.961 0.030 . 1 . . . . 65 GLU HA . 11085 1
724 . 1 1 65 65 GLU HB2 H 1 2.054 0.030 . 2 . . . . 65 GLU HB2 . 11085 1
725 . 1 1 65 65 GLU HB3 H 1 1.903 0.030 . 2 . . . . 65 GLU HB3 . 11085 1
726 . 1 1 65 65 GLU HG2 H 1 2.379 0.030 . 2 . . . . 65 GLU HG2 . 11085 1
727 . 1 1 65 65 GLU HG3 H 1 2.236 0.030 . 2 . . . . 65 GLU HG3 . 11085 1
728 . 1 1 65 65 GLU C C 13 177.567 0.300 . 1 . . . . 65 GLU C . 11085 1
729 . 1 1 65 65 GLU CA C 13 57.823 0.300 . 1 . . . . 65 GLU CA . 11085 1
730 . 1 1 65 65 GLU CB C 13 27.279 0.300 . 1 . . . . 65 GLU CB . 11085 1
731 . 1 1 65 65 GLU CG C 13 35.054 0.300 . 1 . . . . 65 GLU CG . 11085 1
732 . 1 1 65 65 GLU N N 15 118.243 0.300 . 1 . . . . 65 GLU N . 11085 1
733 . 1 1 66 66 ALA H H 1 8.973 0.030 . 1 . . . . 66 ALA H . 11085 1
734 . 1 1 66 66 ALA HA H 1 3.985 0.030 . 1 . . . . 66 ALA HA . 11085 1
735 . 1 1 66 66 ALA HB1 H 1 1.375 0.030 . 1 . . . . 66 ALA HB . 11085 1
736 . 1 1 66 66 ALA HB2 H 1 1.375 0.030 . 1 . . . . 66 ALA HB . 11085 1
737 . 1 1 66 66 ALA HB3 H 1 1.375 0.030 . 1 . . . . 66 ALA HB . 11085 1
738 . 1 1 66 66 ALA C C 13 176.231 0.300 . 1 . . . . 66 ALA C . 11085 1
739 . 1 1 66 66 ALA CA C 13 53.437 0.300 . 1 . . . . 66 ALA CA . 11085 1
740 . 1 1 66 66 ALA CB C 13 15.419 0.300 . 1 . . . . 66 ALA CB . 11085 1
741 . 1 1 66 66 ALA N N 15 123.718 0.300 . 1 . . . . 66 ALA N . 11085 1
742 . 1 1 67 67 THR H H 1 7.929 0.030 . 1 . . . . 67 THR H . 11085 1
743 . 1 1 67 67 THR HA H 1 4.178 0.030 . 1 . . . . 67 THR HA . 11085 1
744 . 1 1 67 67 THR HB H 1 3.753 0.030 . 1 . . . . 67 THR HB . 11085 1
745 . 1 1 67 67 THR HG21 H 1 1.204 0.030 . 1 . . . . 67 THR HG2 . 11085 1
746 . 1 1 67 67 THR HG22 H 1 1.204 0.030 . 1 . . . . 67 THR HG2 . 11085 1
747 . 1 1 67 67 THR HG23 H 1 1.204 0.030 . 1 . . . . 67 THR HG2 . 11085 1
748 . 1 1 67 67 THR C C 13 173.666 0.300 . 1 . . . . 67 THR C . 11085 1
749 . 1 1 67 67 THR CA C 13 65.793 0.300 . 1 . . . . 67 THR CA . 11085 1
750 . 1 1 67 67 THR CB C 13 65.765 0.300 . 1 . . . . 67 THR CB . 11085 1
751 . 1 1 67 67 THR CG2 C 13 19.747 0.300 . 1 . . . . 67 THR CG2 . 11085 1
752 . 1 1 67 67 THR N N 15 113.966 0.300 . 1 . . . . 67 THR N . 11085 1
753 . 1 1 68 68 ALA H H 1 8.593 0.030 . 1 . . . . 68 ALA H . 11085 1
754 . 1 1 68 68 ALA HA H 1 3.901 0.030 . 1 . . . . 68 ALA HA . 11085 1
755 . 1 1 68 68 ALA HB1 H 1 1.416 0.030 . 1 . . . . 68 ALA HB . 11085 1
756 . 1 1 68 68 ALA HB2 H 1 1.416 0.030 . 1 . . . . 68 ALA HB . 11085 1
757 . 1 1 68 68 ALA HB3 H 1 1.416 0.030 . 1 . . . . 68 ALA HB . 11085 1
758 . 1 1 68 68 ALA C C 13 178.079 0.300 . 1 . . . . 68 ALA C . 11085 1
759 . 1 1 68 68 ALA CA C 13 53.242 0.300 . 1 . . . . 68 ALA CA . 11085 1
760 . 1 1 68 68 ALA CB C 13 15.913 0.300 . 1 . . . . 68 ALA CB . 11085 1
761 . 1 1 68 68 ALA N N 15 121.146 0.300 . 1 . . . . 68 ALA N . 11085 1
762 . 1 1 69 69 TRP H H 1 8.108 0.030 . 1 . . . . 69 TRP H . 11085 1
763 . 1 1 69 69 TRP HA H 1 4.186 0.030 . 1 . . . . 69 TRP HA . 11085 1
764 . 1 1 69 69 TRP HB2 H 1 3.253 0.030 . 2 . . . . 69 TRP HB2 . 11085 1
765 . 1 1 69 69 TRP HB3 H 1 3.519 0.030 . 2 . . . . 69 TRP HB3 . 11085 1
766 . 1 1 69 69 TRP HD1 H 1 7.127 0.030 . 1 . . . . 69 TRP HD1 . 11085 1
767 . 1 1 69 69 TRP HE1 H 1 10.167 0.030 . 1 . . . . 69 TRP HE1 . 11085 1
768 . 1 1 69 69 TRP HE3 H 1 7.642 0.030 . 1 . . . . 69 TRP HE3 . 11085 1
769 . 1 1 69 69 TRP HH2 H 1 7.042 0.030 . 1 . . . . 69 TRP HH2 . 11085 1
770 . 1 1 69 69 TRP HZ2 H 1 7.380 0.030 . 1 . . . . 69 TRP HZ2 . 11085 1
771 . 1 1 69 69 TRP HZ3 H 1 6.909 0.030 . 1 . . . . 69 TRP HZ3 . 11085 1
772 . 1 1 69 69 TRP C C 13 174.901 0.300 . 1 . . . . 69 TRP C . 11085 1
773 . 1 1 69 69 TRP CA C 13 58.920 0.300 . 1 . . . . 69 TRP CA . 11085 1
774 . 1 1 69 69 TRP CB C 13 26.176 0.300 . 1 . . . . 69 TRP CB . 11085 1
775 . 1 1 69 69 TRP CD1 C 13 123.637 0.300 . 1 . . . . 69 TRP CD1 . 11085 1
776 . 1 1 69 69 TRP CE3 C 13 119.034 0.300 . 1 . . . . 69 TRP CE3 . 11085 1
777 . 1 1 69 69 TRP CH2 C 13 121.938 0.300 . 1 . . . . 69 TRP CH2 . 11085 1
778 . 1 1 69 69 TRP CZ2 C 13 112.066 0.300 . 1 . . . . 69 TRP CZ2 . 11085 1
779 . 1 1 69 69 TRP CZ3 C 13 118.872 0.300 . 1 . . . . 69 TRP CZ3 . 11085 1
780 . 1 1 69 69 TRP N N 15 120.027 0.300 . 1 . . . . 69 TRP N . 11085 1
781 . 1 1 69 69 TRP NE1 N 15 128.095 0.300 . 1 . . . . 69 TRP NE1 . 11085 1
782 . 1 1 70 70 ALA H H 1 8.114 0.030 . 1 . . . . 70 ALA H . 11085 1
783 . 1 1 70 70 ALA HA H 1 3.664 0.030 . 1 . . . . 70 ALA HA . 11085 1
784 . 1 1 70 70 ALA HB1 H 1 1.666 0.030 . 1 . . . . 70 ALA HB . 11085 1
785 . 1 1 70 70 ALA HB2 H 1 1.666 0.030 . 1 . . . . 70 ALA HB . 11085 1
786 . 1 1 70 70 ALA HB3 H 1 1.666 0.030 . 1 . . . . 70 ALA HB . 11085 1
787 . 1 1 70 70 ALA C C 13 177.279 0.300 . 1 . . . . 70 ALA C . 11085 1
788 . 1 1 70 70 ALA CA C 13 53.684 0.300 . 1 . . . . 70 ALA CA . 11085 1
789 . 1 1 70 70 ALA CB C 13 16.413 0.300 . 1 . . . . 70 ALA CB . 11085 1
790 . 1 1 70 70 ALA N N 15 121.065 0.300 . 1 . . . . 70 ALA N . 11085 1
791 . 1 1 71 71 LEU H H 1 8.377 0.030 . 1 . . . . 71 LEU H . 11085 1
792 . 1 1 71 71 LEU HA H 1 4.089 0.030 . 1 . . . . 71 LEU HA . 11085 1
793 . 1 1 71 71 LEU HB2 H 1 1.742 0.030 . 2 . . . . 71 LEU HB2 . 11085 1
794 . 1 1 71 71 LEU HB3 H 1 1.427 0.030 . 2 . . . . 71 LEU HB3 . 11085 1
795 . 1 1 71 71 LEU HD11 H 1 0.728 0.030 . 1 . . . . 71 LEU HD1 . 11085 1
796 . 1 1 71 71 LEU HD12 H 1 0.728 0.030 . 1 . . . . 71 LEU HD1 . 11085 1
797 . 1 1 71 71 LEU HD13 H 1 0.728 0.030 . 1 . . . . 71 LEU HD1 . 11085 1
798 . 1 1 71 71 LEU HD21 H 1 0.579 0.030 . 1 . . . . 71 LEU HD2 . 11085 1
799 . 1 1 71 71 LEU HD22 H 1 0.579 0.030 . 1 . . . . 71 LEU HD2 . 11085 1
800 . 1 1 71 71 LEU HD23 H 1 0.579 0.030 . 1 . . . . 71 LEU HD2 . 11085 1
801 . 1 1 71 71 LEU HG H 1 1.828 0.030 . 1 . . . . 71 LEU HG . 11085 1
802 . 1 1 71 71 LEU C C 13 179.366 0.300 . 1 . . . . 71 LEU C . 11085 1
803 . 1 1 71 71 LEU CA C 13 55.627 0.300 . 1 . . . . 71 LEU CA . 11085 1
804 . 1 1 71 71 LEU CB C 13 39.874 0.300 . 1 . . . . 71 LEU CB . 11085 1
805 . 1 1 71 71 LEU CD1 C 13 22.858 0.300 . 2 . . . . 71 LEU CD1 . 11085 1
806 . 1 1 71 71 LEU CD2 C 13 21.807 0.300 . 2 . . . . 71 LEU CD2 . 11085 1
807 . 1 1 71 71 LEU CG C 13 25.669 0.300 . 1 . . . . 71 LEU CG . 11085 1
808 . 1 1 71 71 LEU N N 15 115.492 0.300 . 1 . . . . 71 LEU N . 11085 1
809 . 1 1 72 72 LYS H H 1 7.801 0.030 . 1 . . . . 72 LYS H . 11085 1
810 . 1 1 72 72 LYS HA H 1 4.160 0.030 . 1 . . . . 72 LYS HA . 11085 1
811 . 1 1 72 72 LYS HB2 H 1 1.884 0.030 . 2 . . . . 72 LYS HB2 . 11085 1
812 . 1 1 72 72 LYS HB3 H 1 1.817 0.030 . 2 . . . . 72 LYS HB3 . 11085 1
813 . 1 1 72 72 LYS HD2 H 1 1.586 0.030 . 1 . . . . 72 LYS HD2 . 11085 1
814 . 1 1 72 72 LYS HD3 H 1 1.586 0.030 . 1 . . . . 72 LYS HD3 . 11085 1
815 . 1 1 72 72 LYS HE2 H 1 2.824 0.030 . 1 . . . . 72 LYS HE2 . 11085 1
816 . 1 1 72 72 LYS HE3 H 1 2.824 0.030 . 1 . . . . 72 LYS HE3 . 11085 1
817 . 1 1 72 72 LYS HG2 H 1 1.223 0.030 . 2 . . . . 72 LYS HG2 . 11085 1
818 . 1 1 72 72 LYS HG3 H 1 1.393 0.030 . 2 . . . . 72 LYS HG3 . 11085 1
819 . 1 1 72 72 LYS C C 13 176.119 0.300 . 1 . . . . 72 LYS C . 11085 1
820 . 1 1 72 72 LYS CA C 13 56.817 0.300 . 1 . . . . 72 LYS CA . 11085 1
821 . 1 1 72 72 LYS CB C 13 29.646 0.300 . 1 . . . . 72 LYS CB . 11085 1
822 . 1 1 72 72 LYS CD C 13 26.658 0.300 . 1 . . . . 72 LYS CD . 11085 1
823 . 1 1 72 72 LYS CE C 13 39.571 0.300 . 1 . . . . 72 LYS CE . 11085 1
824 . 1 1 72 72 LYS CG C 13 22.059 0.300 . 1 . . . . 72 LYS CG . 11085 1
825 . 1 1 72 72 LYS N N 15 121.913 0.300 . 1 . . . . 72 LYS N . 11085 1
826 . 1 1 73 73 VAL H H 1 8.314 0.030 . 1 . . . . 73 VAL H . 11085 1
827 . 1 1 73 73 VAL HA H 1 3.530 0.030 . 1 . . . . 73 VAL HA . 11085 1
828 . 1 1 73 73 VAL HB H 1 1.459 0.030 . 1 . . . . 73 VAL HB . 11085 1
829 . 1 1 73 73 VAL HG11 H 1 0.519 0.030 . 1 . . . . 73 VAL HG1 . 11085 1
830 . 1 1 73 73 VAL HG12 H 1 0.519 0.030 . 1 . . . . 73 VAL HG1 . 11085 1
831 . 1 1 73 73 VAL HG13 H 1 0.519 0.030 . 1 . . . . 73 VAL HG1 . 11085 1
832 . 1 1 73 73 VAL HG21 H 1 0.220 0.030 . 1 . . . . 73 VAL HG2 . 11085 1
833 . 1 1 73 73 VAL HG22 H 1 0.220 0.030 . 1 . . . . 73 VAL HG2 . 11085 1
834 . 1 1 73 73 VAL HG23 H 1 0.220 0.030 . 1 . . . . 73 VAL HG2 . 11085 1
835 . 1 1 73 73 VAL C C 13 176.706 0.300 . 1 . . . . 73 VAL C . 11085 1
836 . 1 1 73 73 VAL CA C 13 63.985 0.300 . 1 . . . . 73 VAL CA . 11085 1
837 . 1 1 73 73 VAL CB C 13 29.291 0.300 . 1 . . . . 73 VAL CB . 11085 1
838 . 1 1 73 73 VAL CG1 C 13 19.692 0.300 . 2 . . . . 73 VAL CG1 . 11085 1
839 . 1 1 73 73 VAL CG2 C 13 19.273 0.300 . 2 . . . . 73 VAL CG2 . 11085 1
840 . 1 1 73 73 VAL N N 15 120.352 0.300 . 1 . . . . 73 VAL N . 11085 1
841 . 1 1 74 74 ALA H H 1 8.849 0.030 . 1 . . . . 74 ALA H . 11085 1
842 . 1 1 74 74 ALA HA H 1 3.859 0.030 . 1 . . . . 74 ALA HA . 11085 1
843 . 1 1 74 74 ALA HB1 H 1 1.561 0.030 . 1 . . . . 74 ALA HB . 11085 1
844 . 1 1 74 74 ALA HB2 H 1 1.561 0.030 . 1 . . . . 74 ALA HB . 11085 1
845 . 1 1 74 74 ALA HB3 H 1 1.561 0.030 . 1 . . . . 74 ALA HB . 11085 1
846 . 1 1 74 74 ALA C C 13 177.417 0.300 . 1 . . . . 74 ALA C . 11085 1
847 . 1 1 74 74 ALA CA C 13 52.959 0.300 . 1 . . . . 74 ALA CA . 11085 1
848 . 1 1 74 74 ALA CB C 13 16.367 0.300 . 1 . . . . 74 ALA CB . 11085 1
849 . 1 1 74 74 ALA N N 15 121.287 0.300 . 1 . . . . 74 ALA N . 11085 1
850 . 1 1 75 75 GLU H H 1 7.434 0.030 . 1 . . . . 75 GLU H . 11085 1
851 . 1 1 75 75 GLU HA H 1 3.940 0.030 . 1 . . . . 75 GLU HA . 11085 1
852 . 1 1 75 75 GLU HB2 H 1 2.114 0.030 . 2 . . . . 75 GLU HB2 . 11085 1
853 . 1 1 75 75 GLU HB3 H 1 1.857 0.030 . 2 . . . . 75 GLU HB3 . 11085 1
854 . 1 1 75 75 GLU HG2 H 1 1.933 0.030 . 2 . . . . 75 GLU HG2 . 11085 1
855 . 1 1 75 75 GLU HG3 H 1 2.030 0.030 . 2 . . . . 75 GLU HG3 . 11085 1
856 . 1 1 75 75 GLU C C 13 175.950 0.300 . 1 . . . . 75 GLU C . 11085 1
857 . 1 1 75 75 GLU CA C 13 57.126 0.300 . 1 . . . . 75 GLU CA . 11085 1
858 . 1 1 75 75 GLU CB C 13 27.892 0.300 . 1 . . . . 75 GLU CB . 11085 1
859 . 1 1 75 75 GLU CG C 13 33.513 0.300 . 1 . . . . 75 GLU CG . 11085 1
860 . 1 1 75 75 GLU N N 15 117.838 0.300 . 1 . . . . 75 GLU N . 11085 1
861 . 1 1 76 76 ASN H H 1 8.438 0.030 . 1 . . . . 76 ASN H . 11085 1
862 . 1 1 76 76 ASN HA H 1 4.282 0.030 . 1 . . . . 76 ASN HA . 11085 1
863 . 1 1 76 76 ASN HB2 H 1 2.717 0.030 . 1 . . . . 76 ASN HB2 . 11085 1
864 . 1 1 76 76 ASN HB3 H 1 2.717 0.030 . 1 . . . . 76 ASN HB3 . 11085 1
865 . 1 1 76 76 ASN HD21 H 1 7.538 0.030 . 2 . . . . 76 ASN HD21 . 11085 1
866 . 1 1 76 76 ASN HD22 H 1 6.857 0.030 . 2 . . . . 76 ASN HD22 . 11085 1
867 . 1 1 76 76 ASN C C 13 174.525 0.300 . 1 . . . . 76 ASN C . 11085 1
868 . 1 1 76 76 ASN CA C 13 53.808 0.300 . 1 . . . . 76 ASN CA . 11085 1
869 . 1 1 76 76 ASN CB C 13 36.779 0.300 . 1 . . . . 76 ASN CB . 11085 1
870 . 1 1 76 76 ASN N N 15 116.514 0.300 . 1 . . . . 76 ASN N . 11085 1
871 . 1 1 76 76 ASN ND2 N 15 111.626 0.300 . 1 . . . . 76 ASN ND2 . 11085 1
872 . 1 1 77 77 GLU H H 1 8.877 0.030 . 1 . . . . 77 GLU H . 11085 1
873 . 1 1 77 77 GLU HA H 1 4.538 0.030 . 1 . . . . 77 GLU HA . 11085 1
874 . 1 1 77 77 GLU HB2 H 1 2.024 0.030 . 2 . . . . 77 GLU HB2 . 11085 1
875 . 1 1 77 77 GLU HB3 H 1 1.743 0.030 . 2 . . . . 77 GLU HB3 . 11085 1
876 . 1 1 77 77 GLU HG2 H 1 2.175 0.030 . 1 . . . . 77 GLU HG2 . 11085 1
877 . 1 1 77 77 GLU HG3 H 1 2.175 0.030 . 1 . . . . 77 GLU HG3 . 11085 1
878 . 1 1 77 77 GLU C C 13 175.473 0.300 . 1 . . . . 77 GLU C . 11085 1
879 . 1 1 77 77 GLU CA C 13 54.180 0.300 . 1 . . . . 77 GLU CA . 11085 1
880 . 1 1 77 77 GLU CB C 13 27.487 0.300 . 1 . . . . 77 GLU CB . 11085 1
881 . 1 1 77 77 GLU CG C 13 33.430 0.300 . 1 . . . . 77 GLU CG . 11085 1
882 . 1 1 77 77 GLU N N 15 113.762 0.300 . 1 . . . . 77 GLU N . 11085 1
883 . 1 1 78 78 LEU H H 1 6.750 0.030 . 1 . . . . 78 LEU H . 11085 1
884 . 1 1 78 78 LEU HA H 1 4.659 0.030 . 1 . . . . 78 LEU HA . 11085 1
885 . 1 1 78 78 LEU HB2 H 1 2.221 0.030 . 2 . . . . 78 LEU HB2 . 11085 1
886 . 1 1 78 78 LEU HB3 H 1 1.749 0.030 . 2 . . . . 78 LEU HB3 . 11085 1
887 . 1 1 78 78 LEU HD11 H 1 0.825 0.030 . 1 . . . . 78 LEU HD1 . 11085 1
888 . 1 1 78 78 LEU HD12 H 1 0.825 0.030 . 1 . . . . 78 LEU HD1 . 11085 1
889 . 1 1 78 78 LEU HD13 H 1 0.825 0.030 . 1 . . . . 78 LEU HD1 . 11085 1
890 . 1 1 78 78 LEU HD21 H 1 0.756 0.030 . 1 . . . . 78 LEU HD2 . 11085 1
891 . 1 1 78 78 LEU HD22 H 1 0.756 0.030 . 1 . . . . 78 LEU HD2 . 11085 1
892 . 1 1 78 78 LEU HD23 H 1 0.756 0.030 . 1 . . . . 78 LEU HD2 . 11085 1
893 . 1 1 78 78 LEU HG H 1 1.450 0.030 . 1 . . . . 78 LEU HG . 11085 1
894 . 1 1 78 78 LEU C C 13 174.607 0.300 . 1 . . . . 78 LEU C . 11085 1
895 . 1 1 78 78 LEU CA C 13 52.252 0.300 . 1 . . . . 78 LEU CA . 11085 1
896 . 1 1 78 78 LEU CB C 13 40.303 0.300 . 1 . . . . 78 LEU CB . 11085 1
897 . 1 1 78 78 LEU CD1 C 13 24.302 0.300 . 2 . . . . 78 LEU CD1 . 11085 1
898 . 1 1 78 78 LEU CD2 C 13 21.253 0.300 . 2 . . . . 78 LEU CD2 . 11085 1
899 . 1 1 78 78 LEU CG C 13 25.378 0.300 . 1 . . . . 78 LEU CG . 11085 1
900 . 1 1 78 78 LEU N N 15 114.217 0.300 . 1 . . . . 78 LEU N . 11085 1
901 . 1 1 79 79 GLY H H 1 7.027 0.030 . 1 . . . . 79 GLY H . 11085 1
902 . 1 1 79 79 GLY HA2 H 1 3.773 0.030 . 2 . . . . 79 GLY HA2 . 11085 1
903 . 1 1 79 79 GLY HA3 H 1 3.850 0.030 . 2 . . . . 79 GLY HA3 . 11085 1
904 . 1 1 79 79 GLY C C 13 172.010 0.300 . 1 . . . . 79 GLY C . 11085 1
905 . 1 1 79 79 GLY CA C 13 44.147 0.300 . 1 . . . . 79 GLY CA . 11085 1
906 . 1 1 79 79 GLY N N 15 106.869 0.300 . 1 . . . . 79 GLY N . 11085 1
907 . 1 1 80 80 ILE H H 1 7.735 0.030 . 1 . . . . 80 ILE H . 11085 1
908 . 1 1 80 80 ILE HA H 1 3.859 0.030 . 1 . . . . 80 ILE HA . 11085 1
909 . 1 1 80 80 ILE HB H 1 1.210 0.030 . 1 . . . . 80 ILE HB . 11085 1
910 . 1 1 80 80 ILE HD11 H 1 -0.077 0.030 . 1 . . . . 80 ILE HD1 . 11085 1
911 . 1 1 80 80 ILE HD12 H 1 -0.077 0.030 . 1 . . . . 80 ILE HD1 . 11085 1
912 . 1 1 80 80 ILE HD13 H 1 -0.077 0.030 . 1 . . . . 80 ILE HD1 . 11085 1
913 . 1 1 80 80 ILE HG12 H 1 0.730 0.030 . 2 . . . . 80 ILE HG12 . 11085 1
914 . 1 1 80 80 ILE HG13 H 1 0.371 0.030 . 2 . . . . 80 ILE HG13 . 11085 1
915 . 1 1 80 80 ILE HG21 H 1 0.098 0.030 . 1 . . . . 80 ILE HG2 . 11085 1
916 . 1 1 80 80 ILE HG22 H 1 0.098 0.030 . 1 . . . . 80 ILE HG2 . 11085 1
917 . 1 1 80 80 ILE HG23 H 1 0.098 0.030 . 1 . . . . 80 ILE HG2 . 11085 1
918 . 1 1 80 80 ILE C C 13 173.036 0.300 . 1 . . . . 80 ILE C . 11085 1
919 . 1 1 80 80 ILE CA C 13 56.214 0.300 . 1 . . . . 80 ILE CA . 11085 1
920 . 1 1 80 80 ILE CB C 13 34.125 0.300 . 1 . . . . 80 ILE CB . 11085 1
921 . 1 1 80 80 ILE CD1 C 13 7.325 0.300 . 1 . . . . 80 ILE CD1 . 11085 1
922 . 1 1 80 80 ILE CG1 C 13 22.879 0.300 . 1 . . . . 80 ILE CG1 . 11085 1
923 . 1 1 80 80 ILE CG2 C 13 14.638 0.300 . 1 . . . . 80 ILE CG2 . 11085 1
924 . 1 1 80 80 ILE N N 15 121.160 0.300 . 1 . . . . 80 ILE N . 11085 1
925 . 1 1 81 81 THR H H 1 8.081 0.030 . 1 . . . . 81 THR H . 11085 1
926 . 1 1 81 81 THR HA H 1 4.116 0.030 . 1 . . . . 81 THR HA . 11085 1
927 . 1 1 81 81 THR HB H 1 3.881 0.030 . 1 . . . . 81 THR HB . 11085 1
928 . 1 1 81 81 THR HG21 H 1 1.109 0.030 . 1 . . . . 81 THR HG2 . 11085 1
929 . 1 1 81 81 THR HG22 H 1 1.109 0.030 . 1 . . . . 81 THR HG2 . 11085 1
930 . 1 1 81 81 THR HG23 H 1 1.109 0.030 . 1 . . . . 81 THR HG2 . 11085 1
931 . 1 1 81 81 THR C C 13 170.553 0.300 . 1 . . . . 81 THR C . 11085 1
932 . 1 1 81 81 THR CA C 13 58.955 0.300 . 1 . . . . 81 THR CA . 11085 1
933 . 1 1 81 81 THR CB C 13 67.256 0.300 . 1 . . . . 81 THR CB . 11085 1
934 . 1 1 81 81 THR CG2 C 13 18.955 0.300 . 1 . . . . 81 THR CG2 . 11085 1
935 . 1 1 81 81 THR N N 15 126.378 0.300 . 1 . . . . 81 THR N . 11085 1
936 . 1 1 82 82 PRO HA H 1 4.443 0.030 . 1 . . . . 82 PRO HA . 11085 1
937 . 1 1 82 82 PRO HB2 H 1 1.966 0.030 . 2 . . . . 82 PRO HB2 . 11085 1
938 . 1 1 82 82 PRO HB3 H 1 1.857 0.030 . 2 . . . . 82 PRO HB3 . 11085 1
939 . 1 1 82 82 PRO HD2 H 1 3.609 0.030 . 1 . . . . 82 PRO HD2 . 11085 1
940 . 1 1 82 82 PRO HD3 H 1 3.609 0.030 . 1 . . . . 82 PRO HD3 . 11085 1
941 . 1 1 82 82 PRO HG2 H 1 2.002 0.030 . 2 . . . . 82 PRO HG2 . 11085 1
942 . 1 1 82 82 PRO C C 13 174.396 0.300 . 1 . . . . 82 PRO C . 11085 1
943 . 1 1 82 82 PRO CA C 13 60.936 0.300 . 1 . . . . 82 PRO CA . 11085 1
944 . 1 1 82 82 PRO CB C 13 28.407 0.300 . 1 . . . . 82 PRO CB . 11085 1
945 . 1 1 82 82 PRO CD C 13 48.949 0.300 . 1 . . . . 82 PRO CD . 11085 1
946 . 1 1 82 82 PRO CG C 13 25.434 0.300 . 1 . . . . 82 PRO CG . 11085 1
947 . 1 1 83 83 VAL H H 1 7.095 0.030 . 1 . . . . 83 VAL H . 11085 1
948 . 1 1 83 83 VAL HA H 1 4.026 0.030 . 1 . . . . 83 VAL HA . 11085 1
949 . 1 1 83 83 VAL HB H 1 2.034 0.030 . 1 . . . . 83 VAL HB . 11085 1
950 . 1 1 83 83 VAL HG11 H 1 0.902 0.030 . 1 . . . . 83 VAL HG1 . 11085 1
951 . 1 1 83 83 VAL HG12 H 1 0.902 0.030 . 1 . . . . 83 VAL HG1 . 11085 1
952 . 1 1 83 83 VAL HG13 H 1 0.902 0.030 . 1 . . . . 83 VAL HG1 . 11085 1
953 . 1 1 83 83 VAL HG21 H 1 0.877 0.030 . 1 . . . . 83 VAL HG2 . 11085 1
954 . 1 1 83 83 VAL HG22 H 1 0.877 0.030 . 1 . . . . 83 VAL HG2 . 11085 1
955 . 1 1 83 83 VAL HG23 H 1 0.877 0.030 . 1 . . . . 83 VAL HG2 . 11085 1
956 . 1 1 83 83 VAL C C 13 171.741 0.300 . 1 . . . . 83 VAL C . 11085 1
957 . 1 1 83 83 VAL CA C 13 60.158 0.300 . 1 . . . . 83 VAL CA . 11085 1
958 . 1 1 83 83 VAL CB C 13 30.678 0.300 . 1 . . . . 83 VAL CB . 11085 1
959 . 1 1 83 83 VAL CG1 C 13 17.686 0.300 . 2 . . . . 83 VAL CG1 . 11085 1
960 . 1 1 83 83 VAL CG2 C 13 19.252 0.300 . 2 . . . . 83 VAL CG2 . 11085 1
961 . 1 1 83 83 VAL N N 15 118.770 0.300 . 1 . . . . 83 VAL N . 11085 1
962 . 1 1 84 84 VAL H H 1 6.832 0.030 . 1 . . . . 84 VAL H . 11085 1
963 . 1 1 84 84 VAL HA H 1 4.415 0.030 . 1 . . . . 84 VAL HA . 11085 1
964 . 1 1 84 84 VAL HB H 1 1.650 0.030 . 1 . . . . 84 VAL HB . 11085 1
965 . 1 1 84 84 VAL HG11 H 1 0.613 0.030 . 1 . . . . 84 VAL HG1 . 11085 1
966 . 1 1 84 84 VAL HG12 H 1 0.613 0.030 . 1 . . . . 84 VAL HG1 . 11085 1
967 . 1 1 84 84 VAL HG13 H 1 0.613 0.030 . 1 . . . . 84 VAL HG1 . 11085 1
968 . 1 1 84 84 VAL HG21 H 1 0.444 0.030 . 1 . . . . 84 VAL HG2 . 11085 1
969 . 1 1 84 84 VAL HG22 H 1 0.444 0.030 . 1 . . . . 84 VAL HG2 . 11085 1
970 . 1 1 84 84 VAL HG23 H 1 0.444 0.030 . 1 . . . . 84 VAL HG2 . 11085 1
971 . 1 1 84 84 VAL C C 13 170.912 0.300 . 1 . . . . 84 VAL C . 11085 1
972 . 1 1 84 84 VAL CA C 13 55.624 0.300 . 1 . . . . 84 VAL CA . 11085 1
973 . 1 1 84 84 VAL CB C 13 32.442 0.300 . 1 . . . . 84 VAL CB . 11085 1
974 . 1 1 84 84 VAL CG1 C 13 17.642 0.300 . 2 . . . . 84 VAL CG1 . 11085 1
975 . 1 1 84 84 VAL CG2 C 13 18.446 0.300 . 2 . . . . 84 VAL CG2 . 11085 1
976 . 1 1 84 84 VAL N N 15 114.186 0.300 . 1 . . . . 84 VAL N . 11085 1
977 . 1 1 85 85 SER H H 1 8.082 0.030 . 1 . . . . 85 SER H . 11085 1
978 . 1 1 85 85 SER HA H 1 4.327 0.030 . 1 . . . . 85 SER HA . 11085 1
979 . 1 1 85 85 SER HB2 H 1 4.134 0.030 . 2 . . . . 85 SER HB2 . 11085 1
980 . 1 1 85 85 SER HB3 H 1 3.800 0.030 . 2 . . . . 85 SER HB3 . 11085 1
981 . 1 1 85 85 SER C C 13 172.245 0.300 . 1 . . . . 85 SER C . 11085 1
982 . 1 1 85 85 SER CA C 13 54.144 0.300 . 1 . . . . 85 SER CA . 11085 1
983 . 1 1 85 85 SER CB C 13 62.981 0.300 . 1 . . . . 85 SER CB . 11085 1
984 . 1 1 85 85 SER N N 15 118.284 0.300 . 1 . . . . 85 SER N . 11085 1
985 . 1 1 86 86 ALA H H 1 8.802 0.030 . 1 . . . . 86 ALA H . 11085 1
986 . 1 1 86 86 ALA HA H 1 3.820 0.030 . 1 . . . . 86 ALA HA . 11085 1
987 . 1 1 86 86 ALA HB1 H 1 1.294 0.030 . 1 . . . . 86 ALA HB . 11085 1
988 . 1 1 86 86 ALA HB2 H 1 1.294 0.030 . 1 . . . . 86 ALA HB . 11085 1
989 . 1 1 86 86 ALA HB3 H 1 1.294 0.030 . 1 . . . . 86 ALA HB . 11085 1
990 . 1 1 86 86 ALA C C 13 176.675 0.300 . 1 . . . . 86 ALA C . 11085 1
991 . 1 1 86 86 ALA CA C 13 53.031 0.300 . 1 . . . . 86 ALA CA . 11085 1
992 . 1 1 86 86 ALA CB C 13 15.460 0.300 . 1 . . . . 86 ALA CB . 11085 1
993 . 1 1 86 86 ALA N N 15 123.273 0.300 . 1 . . . . 86 ALA N . 11085 1
994 . 1 1 87 87 GLN H H 1 8.374 0.030 . 1 . . . . 87 GLN H . 11085 1
995 . 1 1 87 87 GLN HA H 1 3.731 0.030 . 1 . . . . 87 GLN HA . 11085 1
996 . 1 1 87 87 GLN HB2 H 1 1.973 0.030 . 2 . . . . 87 GLN HB2 . 11085 1
997 . 1 1 87 87 GLN HB3 H 1 1.817 0.030 . 2 . . . . 87 GLN HB3 . 11085 1
998 . 1 1 87 87 GLN HE21 H 1 7.327 0.030 . 2 . . . . 87 GLN HE21 . 11085 1
999 . 1 1 87 87 GLN HE22 H 1 6.816 0.030 . 2 . . . . 87 GLN HE22 . 11085 1
1000 . 1 1 87 87 GLN HG2 H 1 2.386 0.030 . 2 . . . . 87 GLN HG2 . 11085 1
1001 . 1 1 87 87 GLN HG3 H 1 2.300 0.030 . 2 . . . . 87 GLN HG3 . 11085 1
1002 . 1 1 87 87 GLN C C 13 175.526 0.300 . 1 . . . . 87 GLN C . 11085 1
1003 . 1 1 87 87 GLN CA C 13 56.621 0.300 . 1 . . . . 87 GLN CA . 11085 1
1004 . 1 1 87 87 GLN CB C 13 25.434 0.300 . 1 . . . . 87 GLN CB . 11085 1
1005 . 1 1 87 87 GLN CG C 13 31.534 0.300 . 1 . . . . 87 GLN CG . 11085 1
1006 . 1 1 87 87 GLN N N 15 114.115 0.300 . 1 . . . . 87 GLN N . 11085 1
1007 . 1 1 87 87 GLN NE2 N 15 111.301 0.300 . 1 . . . . 87 GLN NE2 . 11085 1
1008 . 1 1 88 88 ALA H H 1 7.669 0.030 . 1 . . . . 88 ALA H . 11085 1
1009 . 1 1 88 88 ALA HA H 1 4.182 0.030 . 1 . . . . 88 ALA HA . 11085 1
1010 . 1 1 88 88 ALA HB1 H 1 1.325 0.030 . 1 . . . . 88 ALA HB . 11085 1
1011 . 1 1 88 88 ALA HB2 H 1 1.325 0.030 . 1 . . . . 88 ALA HB . 11085 1
1012 . 1 1 88 88 ALA HB3 H 1 1.325 0.030 . 1 . . . . 88 ALA HB . 11085 1
1013 . 1 1 88 88 ALA C C 13 179.284 0.300 . 1 . . . . 88 ALA C . 11085 1
1014 . 1 1 88 88 ALA CA C 13 52.177 0.300 . 1 . . . . 88 ALA CA . 11085 1
1015 . 1 1 88 88 ALA CB C 13 16.861 0.300 . 1 . . . . 88 ALA CB . 11085 1
1016 . 1 1 88 88 ALA N N 15 121.134 0.300 . 1 . . . . 88 ALA N . 11085 1
1017 . 1 1 89 89 VAL H H 1 7.809 0.030 . 1 . . . . 89 VAL H . 11085 1
1018 . 1 1 89 89 VAL HA H 1 3.313 0.030 . 1 . . . . 89 VAL HA . 11085 1
1019 . 1 1 89 89 VAL HB H 1 2.292 0.030 . 1 . . . . 89 VAL HB . 11085 1
1020 . 1 1 89 89 VAL HG11 H 1 0.956 0.030 . 1 . . . . 89 VAL HG1 . 11085 1
1021 . 1 1 89 89 VAL HG12 H 1 0.956 0.030 . 1 . . . . 89 VAL HG1 . 11085 1
1022 . 1 1 89 89 VAL HG13 H 1 0.956 0.030 . 1 . . . . 89 VAL HG1 . 11085 1
1023 . 1 1 89 89 VAL HG21 H 1 0.853 0.030 . 1 . . . . 89 VAL HG2 . 11085 1
1024 . 1 1 89 89 VAL HG22 H 1 0.853 0.030 . 1 . . . . 89 VAL HG2 . 11085 1
1025 . 1 1 89 89 VAL HG23 H 1 0.853 0.030 . 1 . . . . 89 VAL HG2 . 11085 1
1026 . 1 1 89 89 VAL C C 13 175.982 0.300 . 1 . . . . 89 VAL C . 11085 1
1027 . 1 1 89 89 VAL CA C 13 65.381 0.300 . 1 . . . . 89 VAL CA . 11085 1
1028 . 1 1 89 89 VAL CB C 13 29.680 0.300 . 1 . . . . 89 VAL CB . 11085 1
1029 . 1 1 89 89 VAL CG1 C 13 19.748 0.300 . 2 . . . . 89 VAL CG1 . 11085 1
1030 . 1 1 89 89 VAL CG2 C 13 21.235 0.300 . 2 . . . . 89 VAL CG2 . 11085 1
1031 . 1 1 89 89 VAL N N 15 120.396 0.300 . 1 . . . . 89 VAL N . 11085 1
1032 . 1 1 90 90 VAL H H 1 7.546 0.030 . 1 . . . . 90 VAL H . 11085 1
1033 . 1 1 90 90 VAL HA H 1 4.349 0.030 . 1 . . . . 90 VAL HA . 11085 1
1034 . 1 1 90 90 VAL HB H 1 1.994 0.030 . 1 . . . . 90 VAL HB . 11085 1
1035 . 1 1 90 90 VAL HG11 H 1 0.885 0.030 . 1 . . . . 90 VAL HG1 . 11085 1
1036 . 1 1 90 90 VAL HG12 H 1 0.885 0.030 . 1 . . . . 90 VAL HG1 . 11085 1
1037 . 1 1 90 90 VAL HG13 H 1 0.885 0.030 . 1 . . . . 90 VAL HG1 . 11085 1
1038 . 1 1 90 90 VAL HG21 H 1 0.948 0.030 . 1 . . . . 90 VAL HG2 . 11085 1
1039 . 1 1 90 90 VAL HG22 H 1 0.948 0.030 . 1 . . . . 90 VAL HG2 . 11085 1
1040 . 1 1 90 90 VAL HG23 H 1 0.948 0.030 . 1 . . . . 90 VAL HG2 . 11085 1
1041 . 1 1 90 90 VAL C C 13 175.865 0.300 . 1 . . . . 90 VAL C . 11085 1
1042 . 1 1 90 90 VAL CA C 13 62.369 0.300 . 1 . . . . 90 VAL CA . 11085 1
1043 . 1 1 90 90 VAL CB C 13 29.867 0.300 . 1 . . . . 90 VAL CB . 11085 1
1044 . 1 1 90 90 VAL CG1 C 13 18.878 0.300 . 2 . . . . 90 VAL CG1 . 11085 1
1045 . 1 1 90 90 VAL CG2 C 13 19.745 0.300 . 2 . . . . 90 VAL CG2 . 11085 1
1046 . 1 1 90 90 VAL N N 15 117.016 0.300 . 1 . . . . 90 VAL N . 11085 1
1047 . 1 1 91 91 ALA H H 1 7.985 0.030 . 1 . . . . 91 ALA H . 11085 1
1048 . 1 1 91 91 ALA HA H 1 4.273 0.030 . 1 . . . . 91 ALA HA . 11085 1
1049 . 1 1 91 91 ALA HB1 H 1 1.396 0.030 . 1 . . . . 91 ALA HB . 11085 1
1050 . 1 1 91 91 ALA HB2 H 1 1.396 0.030 . 1 . . . . 91 ALA HB . 11085 1
1051 . 1 1 91 91 ALA HB3 H 1 1.396 0.030 . 1 . . . . 91 ALA HB . 11085 1
1052 . 1 1 91 91 ALA C C 13 176.365 0.300 . 1 . . . . 91 ALA C . 11085 1
1053 . 1 1 91 91 ALA CA C 13 50.071 0.300 . 1 . . . . 91 ALA CA . 11085 1
1054 . 1 1 91 91 ALA CB C 13 17.136 0.300 . 1 . . . . 91 ALA CB . 11085 1
1055 . 1 1 91 91 ALA N N 15 118.117 0.300 . 1 . . . . 91 ALA N . 11085 1
1056 . 1 1 92 92 GLY H H 1 7.773 0.030 . 1 . . . . 92 GLY H . 11085 1
1057 . 1 1 92 92 GLY HA2 H 1 3.900 0.030 . 1 . . . . 92 GLY HA2 . 11085 1
1058 . 1 1 92 92 GLY HA3 H 1 3.900 0.030 . 1 . . . . 92 GLY HA3 . 11085 1
1059 . 1 1 92 92 GLY C C 13 173.635 0.300 . 1 . . . . 92 GLY C . 11085 1
1060 . 1 1 92 92 GLY CA C 13 44.364 0.300 . 1 . . . . 92 GLY CA . 11085 1
1061 . 1 1 92 92 GLY N N 15 108.145 0.300 . 1 . . . . 92 GLY N . 11085 1
1062 . 1 1 93 93 SER H H 1 7.859 0.030 . 1 . . . . 93 SER H . 11085 1
1063 . 1 1 93 93 SER HA H 1 4.293 0.030 . 1 . . . . 93 SER HA . 11085 1
1064 . 1 1 93 93 SER HB2 H 1 3.516 0.030 . 2 . . . . 93 SER HB2 . 11085 1
1065 . 1 1 93 93 SER HB3 H 1 4.061 0.030 . 2 . . . . 93 SER HB3 . 11085 1
1066 . 1 1 93 93 SER C C 13 171.909 0.300 . 1 . . . . 93 SER C . 11085 1
1067 . 1 1 93 93 SER CA C 13 56.287 0.300 . 1 . . . . 93 SER CA . 11085 1
1068 . 1 1 93 93 SER CB C 13 61.976 0.300 . 1 . . . . 93 SER CB . 11085 1
1069 . 1 1 93 93 SER N N 15 110.476 0.300 . 1 . . . . 93 SER N . 11085 1
1070 . 1 1 94 94 ASP H H 1 8.715 0.030 . 1 . . . . 94 ASP H . 11085 1
1071 . 1 1 94 94 ASP HA H 1 4.975 0.030 . 1 . . . . 94 ASP HA . 11085 1
1072 . 1 1 94 94 ASP HB2 H 1 2.678 0.030 . 2 . . . . 94 ASP HB2 . 11085 1
1073 . 1 1 94 94 ASP HB3 H 1 2.239 0.030 . 2 . . . . 94 ASP HB3 . 11085 1
1074 . 1 1 94 94 ASP C C 13 169.921 0.300 . 1 . . . . 94 ASP C . 11085 1
1075 . 1 1 94 94 ASP CA C 13 49.334 0.300 . 1 . . . . 94 ASP CA . 11085 1
1076 . 1 1 94 94 ASP CB C 13 38.571 0.300 . 1 . . . . 94 ASP CB . 11085 1
1077 . 1 1 94 94 ASP N N 15 121.379 0.300 . 1 . . . . 94 ASP N . 11085 1
1078 . 1 1 95 95 PRO HA H 1 4.196 0.030 . 1 . . . . 95 PRO HA . 11085 1
1079 . 1 1 95 95 PRO HB2 H 1 2.240 0.030 . 2 . . . . 95 PRO HB2 . 11085 1
1080 . 1 1 95 95 PRO HB3 H 1 1.873 0.030 . 2 . . . . 95 PRO HB3 . 11085 1
1081 . 1 1 95 95 PRO HD2 H 1 3.728 0.030 . 2 . . . . 95 PRO HD2 . 11085 1
1082 . 1 1 95 95 PRO HD3 H 1 3.236 0.030 . 2 . . . . 95 PRO HD3 . 11085 1
1083 . 1 1 95 95 PRO HG2 H 1 1.966 0.030 . 1 . . . . 95 PRO HG2 . 11085 1
1084 . 1 1 95 95 PRO HG3 H 1 1.966 0.030 . 1 . . . . 95 PRO HG3 . 11085 1
1085 . 1 1 95 95 PRO C C 13 178.248 0.300 . 1 . . . . 95 PRO C . 11085 1
1086 . 1 1 95 95 PRO CA C 13 62.387 0.300 . 1 . . . . 95 PRO CA . 11085 1
1087 . 1 1 95 95 PRO CB C 13 29.671 0.300 . 1 . . . . 95 PRO CB . 11085 1
1088 . 1 1 95 95 PRO CD C 13 47.879 0.300 . 1 . . . . 95 PRO CD . 11085 1
1089 . 1 1 95 95 PRO CG C 13 25.187 0.300 . 1 . . . . 95 PRO CG . 11085 1
1090 . 1 1 96 96 LEU H H 1 8.495 0.030 . 1 . . . . 96 LEU H . 11085 1
1091 . 1 1 96 96 LEU HA H 1 4.017 0.030 . 1 . . . . 96 LEU HA . 11085 1
1092 . 1 1 96 96 LEU HB2 H 1 1.796 0.030 . 2 . . . . 96 LEU HB2 . 11085 1
1093 . 1 1 96 96 LEU HB3 H 1 1.345 0.030 . 2 . . . . 96 LEU HB3 . 11085 1
1094 . 1 1 96 96 LEU HD11 H 1 0.756 0.030 . 1 . . . . 96 LEU HD1 . 11085 1
1095 . 1 1 96 96 LEU HD12 H 1 0.756 0.030 . 1 . . . . 96 LEU HD1 . 11085 1
1096 . 1 1 96 96 LEU HD13 H 1 0.756 0.030 . 1 . . . . 96 LEU HD1 . 11085 1
1097 . 1 1 96 96 LEU HD21 H 1 0.818 0.030 . 1 . . . . 96 LEU HD2 . 11085 1
1098 . 1 1 96 96 LEU HD22 H 1 0.818 0.030 . 1 . . . . 96 LEU HD2 . 11085 1
1099 . 1 1 96 96 LEU HD23 H 1 0.818 0.030 . 1 . . . . 96 LEU HD2 . 11085 1
1100 . 1 1 96 96 LEU HG H 1 1.633 0.030 . 1 . . . . 96 LEU HG . 11085 1
1101 . 1 1 96 96 LEU C C 13 178.185 0.300 . 1 . . . . 96 LEU C . 11085 1
1102 . 1 1 96 96 LEU CA C 13 55.330 0.300 . 1 . . . . 96 LEU CA . 11085 1
1103 . 1 1 96 96 LEU CB C 13 37.817 0.300 . 1 . . . . 96 LEU CB . 11085 1
1104 . 1 1 96 96 LEU CD1 C 13 20.324 0.300 . 2 . . . . 96 LEU CD1 . 11085 1
1105 . 1 1 96 96 LEU CD2 C 13 22.560 0.300 . 2 . . . . 96 LEU CD2 . 11085 1
1106 . 1 1 96 96 LEU CG C 13 25.105 0.300 . 1 . . . . 96 LEU CG . 11085 1
1107 . 1 1 96 96 LEU N N 15 116.849 0.300 . 1 . . . . 96 LEU N . 11085 1
1108 . 1 1 97 97 GLY H H 1 7.708 0.030 . 1 . . . . 97 GLY H . 11085 1
1109 . 1 1 97 97 GLY HA2 H 1 3.732 0.030 . 2 . . . . 97 GLY HA2 . 11085 1
1110 . 1 1 97 97 GLY HA3 H 1 3.557 0.030 . 2 . . . . 97 GLY HA3 . 11085 1
1111 . 1 1 97 97 GLY C C 13 173.307 0.300 . 1 . . . . 97 GLY C . 11085 1
1112 . 1 1 97 97 GLY CA C 13 44.811 0.300 . 1 . . . . 97 GLY CA . 11085 1
1113 . 1 1 97 97 GLY N N 15 112.076 0.300 . 1 . . . . 97 GLY N . 11085 1
1114 . 1 1 98 98 LEU H H 1 7.915 0.030 . 1 . . . . 98 LEU H . 11085 1
1115 . 1 1 98 98 LEU HA H 1 4.008 0.030 . 1 . . . . 98 LEU HA . 11085 1
1116 . 1 1 98 98 LEU HB2 H 1 1.917 0.030 . 2 . . . . 98 LEU HB2 . 11085 1
1117 . 1 1 98 98 LEU HB3 H 1 1.209 0.030 . 2 . . . . 98 LEU HB3 . 11085 1
1118 . 1 1 98 98 LEU HD11 H 1 0.756 0.030 . 1 . . . . 98 LEU HD1 . 11085 1
1119 . 1 1 98 98 LEU HD12 H 1 0.756 0.030 . 1 . . . . 98 LEU HD1 . 11085 1
1120 . 1 1 98 98 LEU HD13 H 1 0.756 0.030 . 1 . . . . 98 LEU HD1 . 11085 1
1121 . 1 1 98 98 LEU HD21 H 1 0.845 0.030 . 1 . . . . 98 LEU HD2 . 11085 1
1122 . 1 1 98 98 LEU HD22 H 1 0.845 0.030 . 1 . . . . 98 LEU HD2 . 11085 1
1123 . 1 1 98 98 LEU HD23 H 1 0.845 0.030 . 1 . . . . 98 LEU HD2 . 11085 1
1124 . 1 1 98 98 LEU HG H 1 1.224 0.030 . 1 . . . . 98 LEU HG . 11085 1
1125 . 1 1 98 98 LEU C C 13 175.761 0.300 . 1 . . . . 98 LEU C . 11085 1
1126 . 1 1 98 98 LEU CA C 13 55.772 0.300 . 1 . . . . 98 LEU CA . 11085 1
1127 . 1 1 98 98 LEU CB C 13 38.706 0.300 . 1 . . . . 98 LEU CB . 11085 1
1128 . 1 1 98 98 LEU CD1 C 13 20.333 0.300 . 2 . . . . 98 LEU CD1 . 11085 1
1129 . 1 1 98 98 LEU CD2 C 13 24.314 0.300 . 2 . . . . 98 LEU CD2 . 11085 1
1130 . 1 1 98 98 LEU CG C 13 24.902 0.300 . 1 . . . . 98 LEU CG . 11085 1
1131 . 1 1 98 98 LEU N N 15 121.896 0.300 . 1 . . . . 98 LEU N . 11085 1
1132 . 1 1 99 99 ILE H H 1 7.533 0.030 . 1 . . . . 99 ILE H . 11085 1
1133 . 1 1 99 99 ILE HA H 1 3.290 0.030 . 1 . . . . 99 ILE HA . 11085 1
1134 . 1 1 99 99 ILE HB H 1 1.665 0.030 . 1 . . . . 99 ILE HB . 11085 1
1135 . 1 1 99 99 ILE HD11 H 1 0.747 0.030 . 1 . . . . 99 ILE HD1 . 11085 1
1136 . 1 1 99 99 ILE HD12 H 1 0.747 0.030 . 1 . . . . 99 ILE HD1 . 11085 1
1137 . 1 1 99 99 ILE HD13 H 1 0.747 0.030 . 1 . . . . 99 ILE HD1 . 11085 1
1138 . 1 1 99 99 ILE HG12 H 1 1.744 0.030 . 2 . . . . 99 ILE HG12 . 11085 1
1139 . 1 1 99 99 ILE HG13 H 1 0.852 0.030 . 2 . . . . 99 ILE HG13 . 11085 1
1140 . 1 1 99 99 ILE HG21 H 1 0.697 0.030 . 1 . . . . 99 ILE HG2 . 11085 1
1141 . 1 1 99 99 ILE HG22 H 1 0.697 0.030 . 1 . . . . 99 ILE HG2 . 11085 1
1142 . 1 1 99 99 ILE HG23 H 1 0.697 0.030 . 1 . . . . 99 ILE HG2 . 11085 1
1143 . 1 1 99 99 ILE C C 13 175.781 0.300 . 1 . . . . 99 ILE C . 11085 1
1144 . 1 1 99 99 ILE CA C 13 64.209 0.300 . 1 . . . . 99 ILE CA . 11085 1
1145 . 1 1 99 99 ILE CB C 13 35.665 0.300 . 1 . . . . 99 ILE CB . 11085 1
1146 . 1 1 99 99 ILE CD1 C 13 11.211 0.300 . 1 . . . . 99 ILE CD1 . 11085 1
1147 . 1 1 99 99 ILE CG1 C 13 29.059 0.300 . 1 . . . . 99 ILE CG1 . 11085 1
1148 . 1 1 99 99 ILE CG2 C 13 14.583 0.300 . 1 . . . . 99 ILE CG2 . 11085 1
1149 . 1 1 99 99 ILE N N 15 118.057 0.300 . 1 . . . . 99 ILE N . 11085 1
1150 . 1 1 100 100 ALA H H 1 7.931 0.030 . 1 . . . . 100 ALA H . 11085 1
1151 . 1 1 100 100 ALA HA H 1 3.866 0.030 . 1 . . . . 100 ALA HA . 11085 1
1152 . 1 1 100 100 ALA HB1 H 1 1.388 0.030 . 1 . . . . 100 ALA HB . 11085 1
1153 . 1 1 100 100 ALA HB2 H 1 1.388 0.030 . 1 . . . . 100 ALA HB . 11085 1
1154 . 1 1 100 100 ALA HB3 H 1 1.388 0.030 . 1 . . . . 100 ALA HB . 11085 1
1155 . 1 1 100 100 ALA C C 13 177.574 0.300 . 1 . . . . 100 ALA C . 11085 1
1156 . 1 1 100 100 ALA CA C 13 52.889 0.300 . 1 . . . . 100 ALA CA . 11085 1
1157 . 1 1 100 100 ALA CB C 13 15.378 0.300 . 1 . . . . 100 ALA CB . 11085 1
1158 . 1 1 100 100 ALA N N 15 123.223 0.300 . 1 . . . . 100 ALA N . 11085 1
1159 . 1 1 101 101 TYR H H 1 8.263 0.030 . 1 . . . . 101 TYR H . 11085 1
1160 . 1 1 101 101 TYR HA H 1 4.049 0.030 . 1 . . . . 101 TYR HA . 11085 1
1161 . 1 1 101 101 TYR HB2 H 1 3.144 0.030 . 2 . . . . 101 TYR HB2 . 11085 1
1162 . 1 1 101 101 TYR HB3 H 1 2.982 0.030 . 2 . . . . 101 TYR HB3 . 11085 1
1163 . 1 1 101 101 TYR HD1 H 1 6.874 0.030 . 1 . . . . 101 TYR HD1 . 11085 1
1164 . 1 1 101 101 TYR HD2 H 1 6.874 0.030 . 1 . . . . 101 TYR HD2 . 11085 1
1165 . 1 1 101 101 TYR HE1 H 1 6.592 0.030 . 1 . . . . 101 TYR HE1 . 11085 1
1166 . 1 1 101 101 TYR HE2 H 1 6.592 0.030 . 1 . . . . 101 TYR HE2 . 11085 1
1167 . 1 1 101 101 TYR C C 13 175.156 0.300 . 1 . . . . 101 TYR C . 11085 1
1168 . 1 1 101 101 TYR CA C 13 58.743 0.300 . 1 . . . . 101 TYR CA . 11085 1
1169 . 1 1 101 101 TYR CB C 13 36.769 0.300 . 1 . . . . 101 TYR CB . 11085 1
1170 . 1 1 101 101 TYR CD1 C 13 129.103 0.300 . 1 . . . . 101 TYR CD1 . 11085 1
1171 . 1 1 101 101 TYR CD2 C 13 129.103 0.300 . 1 . . . . 101 TYR CD2 . 11085 1
1172 . 1 1 101 101 TYR CE1 C 13 117.146 0.300 . 1 . . . . 101 TYR CE1 . 11085 1
1173 . 1 1 101 101 TYR CE2 C 13 117.146 0.300 . 1 . . . . 101 TYR CE2 . 11085 1
1174 . 1 1 101 101 TYR N N 15 119.694 0.300 . 1 . . . . 101 TYR N . 11085 1
1175 . 1 1 102 102 LEU H H 1 8.479 0.030 . 1 . . . . 102 LEU H . 11085 1
1176 . 1 1 102 102 LEU HA H 1 3.848 0.030 . 1 . . . . 102 LEU HA . 11085 1
1177 . 1 1 102 102 LEU HB2 H 1 1.633 0.030 . 2 . . . . 102 LEU HB2 . 11085 1
1178 . 1 1 102 102 LEU HB3 H 1 0.870 0.030 . 2 . . . . 102 LEU HB3 . 11085 1
1179 . 1 1 102 102 LEU HD11 H 1 -0.409 0.030 . 1 . . . . 102 LEU HD1 . 11085 1
1180 . 1 1 102 102 LEU HD12 H 1 -0.409 0.030 . 1 . . . . 102 LEU HD1 . 11085 1
1181 . 1 1 102 102 LEU HD13 H 1 -0.409 0.030 . 1 . . . . 102 LEU HD1 . 11085 1
1182 . 1 1 102 102 LEU HD21 H 1 -0.173 0.030 . 1 . . . . 102 LEU HD2 . 11085 1
1183 . 1 1 102 102 LEU HD22 H 1 -0.173 0.030 . 1 . . . . 102 LEU HD2 . 11085 1
1184 . 1 1 102 102 LEU HD23 H 1 -0.173 0.030 . 1 . . . . 102 LEU HD2 . 11085 1
1185 . 1 1 102 102 LEU HG H 1 1.380 0.030 . 1 . . . . 102 LEU HG . 11085 1
1186 . 1 1 102 102 LEU C C 13 177.303 0.300 . 1 . . . . 102 LEU C . 11085 1
1187 . 1 1 102 102 LEU CA C 13 55.612 0.300 . 1 . . . . 102 LEU CA . 11085 1
1188 . 1 1 102 102 LEU CB C 13 39.531 0.300 . 1 . . . . 102 LEU CB . 11085 1
1189 . 1 1 102 102 LEU CD1 C 13 22.195 0.300 . 2 . . . . 102 LEU CD1 . 11085 1
1190 . 1 1 102 102 LEU CD2 C 13 18.384 0.300 . 2 . . . . 102 LEU CD2 . 11085 1
1191 . 1 1 102 102 LEU CG C 13 23.952 0.300 . 1 . . . . 102 LEU CG . 11085 1
1192 . 1 1 102 102 LEU N N 15 117.139 0.300 . 1 . . . . 102 LEU N . 11085 1
1193 . 1 1 103 103 SER H H 1 8.555 0.030 . 1 . . . . 103 SER H . 11085 1
1194 . 1 1 103 103 SER HA H 1 4.094 0.030 . 1 . . . . 103 SER HA . 11085 1
1195 . 1 1 103 103 SER HB2 H 1 3.834 0.030 . 2 . . . . 103 SER HB2 . 11085 1
1196 . 1 1 103 103 SER HB3 H 1 4.013 0.030 . 2 . . . . 103 SER HB3 . 11085 1
1197 . 1 1 103 103 SER C C 13 174.142 0.300 . 1 . . . . 103 SER C . 11085 1
1198 . 1 1 103 103 SER CA C 13 59.729 0.300 . 1 . . . . 103 SER CA . 11085 1
1199 . 1 1 103 103 SER CB C 13 60.246 0.300 . 1 . . . . 103 SER CB . 11085 1
1200 . 1 1 103 103 SER N N 15 114.498 0.300 . 1 . . . . 103 SER N . 11085 1
1201 . 1 1 104 104 HIS H H 1 7.918 0.030 . 1 . . . . 104 HIS H . 11085 1
1202 . 1 1 104 104 HIS HA H 1 4.392 0.030 . 1 . . . . 104 HIS HA . 11085 1
1203 . 1 1 104 104 HIS HB2 H 1 3.238 0.030 . 2 . . . . 104 HIS HB2 . 11085 1
1204 . 1 1 104 104 HIS HB3 H 1 2.931 0.030 . 2 . . . . 104 HIS HB3 . 11085 1
1205 . 1 1 104 104 HIS HD2 H 1 6.908 0.030 . 1 . . . . 104 HIS HD2 . 11085 1
1206 . 1 1 104 104 HIS HE1 H 1 7.808 0.030 . 1 . . . . 104 HIS HE1 . 11085 1
1207 . 1 1 104 104 HIS C C 13 176.461 0.300 . 1 . . . . 104 HIS C . 11085 1
1208 . 1 1 104 104 HIS CA C 13 55.984 0.300 . 1 . . . . 104 HIS CA . 11085 1
1209 . 1 1 104 104 HIS CB C 13 27.396 0.300 . 1 . . . . 104 HIS CB . 11085 1
1210 . 1 1 104 104 HIS CD2 C 13 117.755 0.300 . 1 . . . . 104 HIS CD2 . 11085 1
1211 . 1 1 104 104 HIS CE1 C 13 135.500 0.300 . 1 . . . . 104 HIS CE1 . 11085 1
1212 . 1 1 104 104 HIS N N 15 122.682 0.300 . 1 . . . . 104 HIS N . 11085 1
1213 . 1 1 105 105 PHE H H 1 7.582 0.030 . 1 . . . . 105 PHE H . 11085 1
1214 . 1 1 105 105 PHE HA H 1 3.988 0.030 . 1 . . . . 105 PHE HA . 11085 1
1215 . 1 1 105 105 PHE HB2 H 1 3.356 0.030 . 2 . . . . 105 PHE HB2 . 11085 1
1216 . 1 1 105 105 PHE HB3 H 1 3.099 0.030 . 2 . . . . 105 PHE HB3 . 11085 1
1217 . 1 1 105 105 PHE HD1 H 1 7.020 0.030 . 1 . . . . 105 PHE HD1 . 11085 1
1218 . 1 1 105 105 PHE HD2 H 1 7.020 0.030 . 1 . . . . 105 PHE HD2 . 11085 1
1219 . 1 1 105 105 PHE HE1 H 1 6.476 0.030 . 1 . . . . 105 PHE HE1 . 11085 1
1220 . 1 1 105 105 PHE HE2 H 1 6.476 0.030 . 1 . . . . 105 PHE HE2 . 11085 1
1221 . 1 1 105 105 PHE HZ H 1 6.856 0.030 . 1 . . . . 105 PHE HZ . 11085 1
1222 . 1 1 105 105 PHE C C 13 174.564 0.300 . 1 . . . . 105 PHE C . 11085 1
1223 . 1 1 105 105 PHE CA C 13 60.030 0.300 . 1 . . . . 105 PHE CA . 11085 1
1224 . 1 1 105 105 PHE CB C 13 36.948 0.300 . 1 . . . . 105 PHE CB . 11085 1
1225 . 1 1 105 105 PHE CD1 C 13 128.983 0.300 . 1 . . . . 105 PHE CD1 . 11085 1
1226 . 1 1 105 105 PHE CD2 C 13 128.983 0.300 . 1 . . . . 105 PHE CD2 . 11085 1
1227 . 1 1 105 105 PHE CE1 C 13 128.856 0.300 . 1 . . . . 105 PHE CE1 . 11085 1
1228 . 1 1 105 105 PHE CE2 C 13 128.856 0.300 . 1 . . . . 105 PHE CE2 . 11085 1
1229 . 1 1 105 105 PHE CZ C 13 126.948 0.300 . 1 . . . . 105 PHE CZ . 11085 1
1230 . 1 1 105 105 PHE N N 15 119.263 0.300 . 1 . . . . 105 PHE N . 11085 1
1231 . 1 1 106 106 HIS H H 1 7.618 0.030 . 1 . . . . 106 HIS H . 11085 1
1232 . 1 1 106 106 HIS HA H 1 2.312 0.030 . 1 . . . . 106 HIS HA . 11085 1
1233 . 1 1 106 106 HIS HB2 H 1 2.265 0.030 . 2 . . . . 106 HIS HB2 . 11085 1
1234 . 1 1 106 106 HIS HB3 H 1 2.742 0.030 . 2 . . . . 106 HIS HB3 . 11085 1
1235 . 1 1 106 106 HIS HD2 H 1 5.144 0.030 . 1 . . . . 106 HIS HD2 . 11085 1
1236 . 1 1 106 106 HIS HE1 H 1 7.298 0.030 . 1 . . . . 106 HIS HE1 . 11085 1
1237 . 1 1 106 106 HIS C C 13 174.180 0.300 . 1 . . . . 106 HIS C . 11085 1
1238 . 1 1 106 106 HIS CA C 13 55.841 0.300 . 1 . . . . 106 HIS CA . 11085 1
1239 . 1 1 106 106 HIS CB C 13 29.534 0.300 . 1 . . . . 106 HIS CB . 11085 1
1240 . 1 1 106 106 HIS CD2 C 13 116.247 0.300 . 1 . . . . 106 HIS CD2 . 11085 1
1241 . 1 1 106 106 HIS CE1 C 13 134.332 0.300 . 1 . . . . 106 HIS CE1 . 11085 1
1242 . 1 1 106 106 HIS N N 15 118.173 0.300 . 1 . . . . 106 HIS N . 11085 1
1243 . 1 1 107 107 SER H H 1 8.168 0.030 . 1 . . . . 107 SER H . 11085 1
1244 . 1 1 107 107 SER HA H 1 3.606 0.030 . 1 . . . . 107 SER HA . 11085 1
1245 . 1 1 107 107 SER HB2 H 1 3.688 0.030 . 2 . . . . 107 SER HB2 . 11085 1
1246 . 1 1 107 107 SER HB3 H 1 3.749 0.030 . 2 . . . . 107 SER HB3 . 11085 1
1247 . 1 1 107 107 SER C C 13 173.911 0.300 . 1 . . . . 107 SER C . 11085 1
1248 . 1 1 107 107 SER CA C 13 58.946 0.300 . 1 . . . . 107 SER CA . 11085 1
1249 . 1 1 107 107 SER CB C 13 60.673 0.300 . 1 . . . . 107 SER CB . 11085 1
1250 . 1 1 107 107 SER N N 15 110.826 0.300 . 1 . . . . 107 SER N . 11085 1
1251 . 1 1 108 108 ALA H H 1 7.395 0.030 . 1 . . . . 108 ALA H . 11085 1
1252 . 1 1 108 108 ALA HA H 1 3.911 0.030 . 1 . . . . 108 ALA HA . 11085 1
1253 . 1 1 108 108 ALA HB1 H 1 0.939 0.030 . 1 . . . . 108 ALA HB . 11085 1
1254 . 1 1 108 108 ALA HB2 H 1 0.939 0.030 . 1 . . . . 108 ALA HB . 11085 1
1255 . 1 1 108 108 ALA HB3 H 1 0.939 0.030 . 1 . . . . 108 ALA HB . 11085 1
1256 . 1 1 108 108 ALA C C 13 176.792 0.300 . 1 . . . . 108 ALA C . 11085 1
1257 . 1 1 108 108 ALA CA C 13 51.651 0.300 . 1 . . . . 108 ALA CA . 11085 1
1258 . 1 1 108 108 ALA CB C 13 16.779 0.300 . 1 . . . . 108 ALA CB . 11085 1
1259 . 1 1 108 108 ALA N N 15 120.707 0.300 . 1 . . . . 108 ALA N . 11085 1
1260 . 1 1 109 109 PHE H H 1 7.795 0.030 . 1 . . . . 109 PHE H . 11085 1
1261 . 1 1 109 109 PHE HA H 1 4.725 0.030 . 1 . . . . 109 PHE HA . 11085 1
1262 . 1 1 109 109 PHE HB2 H 1 3.594 0.030 . 2 . . . . 109 PHE HB2 . 11085 1
1263 . 1 1 109 109 PHE HB3 H 1 3.045 0.030 . 2 . . . . 109 PHE HB3 . 11085 1
1264 . 1 1 109 109 PHE HD1 H 1 7.549 0.030 . 1 . . . . 109 PHE HD1 . 11085 1
1265 . 1 1 109 109 PHE HD2 H 1 7.549 0.030 . 1 . . . . 109 PHE HD2 . 11085 1
1266 . 1 1 109 109 PHE HE1 H 1 7.261 0.030 . 1 . . . . 109 PHE HE1 . 11085 1
1267 . 1 1 109 109 PHE HE2 H 1 7.261 0.030 . 1 . . . . 109 PHE HE2 . 11085 1
1268 . 1 1 109 109 PHE HZ H 1 7.365 0.030 . 1 . . . . 109 PHE HZ . 11085 1
1269 . 1 1 109 109 PHE C C 13 174.271 0.300 . 1 . . . . 109 PHE C . 11085 1
1270 . 1 1 109 109 PHE CA C 13 56.161 0.300 . 1 . . . . 109 PHE CA . 11085 1
1271 . 1 1 109 109 PHE CB C 13 37.863 0.300 . 1 . . . . 109 PHE CB . 11085 1
1272 . 1 1 109 109 PHE CD1 C 13 130.508 0.300 . 1 . . . . 109 PHE CD1 . 11085 1
1273 . 1 1 109 109 PHE CD2 C 13 130.508 0.300 . 1 . . . . 109 PHE CD2 . 11085 1
1274 . 1 1 109 109 PHE CE1 C 13 128.774 0.300 . 1 . . . . 109 PHE CE1 . 11085 1
1275 . 1 1 109 109 PHE CE2 C 13 128.774 0.300 . 1 . . . . 109 PHE CE2 . 11085 1
1276 . 1 1 109 109 PHE CZ C 13 128.256 0.300 . 1 . . . . 109 PHE CZ . 11085 1
1277 . 1 1 109 109 PHE N N 15 113.942 0.300 . 1 . . . . 109 PHE N . 11085 1
1278 . 1 1 110 110 LYS H H 1 7.651 0.030 . 1 . . . . 110 LYS H . 11085 1
1279 . 1 1 110 110 LYS HA H 1 4.098 0.030 . 1 . . . . 110 LYS HA . 11085 1
1280 . 1 1 110 110 LYS HB2 H 1 1.317 0.030 . 2 . . . . 110 LYS HB2 . 11085 1
1281 . 1 1 110 110 LYS HB3 H 1 1.453 0.030 . 2 . . . . 110 LYS HB3 . 11085 1
1282 . 1 1 110 110 LYS HD2 H 1 0.992 0.030 . 2 . . . . 110 LYS HD2 . 11085 1
1283 . 1 1 110 110 LYS HD3 H 1 1.172 0.030 . 2 . . . . 110 LYS HD3 . 11085 1
1284 . 1 1 110 110 LYS HE2 H 1 2.636 0.030 . 2 . . . . 110 LYS HE2 . 11085 1
1285 . 1 1 110 110 LYS HE3 H 1 2.587 0.030 . 2 . . . . 110 LYS HE3 . 11085 1
1286 . 1 1 110 110 LYS HG2 H 1 0.993 0.030 . 2 . . . . 110 LYS HG2 . 11085 1
1287 . 1 1 110 110 LYS HG3 H 1 1.119 0.030 . 2 . . . . 110 LYS HG3 . 11085 1
1288 . 1 1 110 110 LYS C C 13 174.655 0.300 . 1 . . . . 110 LYS C . 11085 1
1289 . 1 1 110 110 LYS CA C 13 55.968 0.300 . 1 . . . . 110 LYS CA . 11085 1
1290 . 1 1 110 110 LYS CB C 13 29.267 0.300 . 1 . . . . 110 LYS CB . 11085 1
1291 . 1 1 110 110 LYS CD C 13 26.721 0.300 . 1 . . . . 110 LYS CD . 11085 1
1292 . 1 1 110 110 LYS CE C 13 39.545 0.300 . 1 . . . . 110 LYS CE . 11085 1
1293 . 1 1 110 110 LYS CG C 13 21.524 0.300 . 1 . . . . 110 LYS CG . 11085 1
1294 . 1 1 110 110 LYS N N 15 121.764 0.300 . 1 . . . . 110 LYS N . 11085 1
1295 . 1 1 111 111 SER H H 1 8.350 0.030 . 1 . . . . 111 SER H . 11085 1
1296 . 1 1 111 111 SER HA H 1 4.473 0.030 . 1 . . . . 111 SER HA . 11085 1
1297 . 1 1 111 111 SER HB2 H 1 3.846 0.030 . 2 . . . . 111 SER HB2 . 11085 1
1298 . 1 1 111 111 SER C C 13 172.268 0.300 . 1 . . . . 111 SER C . 11085 1
1299 . 1 1 111 111 SER CA C 13 55.984 0.300 . 1 . . . . 111 SER CA . 11085 1
1300 . 1 1 111 111 SER CB C 13 61.498 0.300 . 1 . . . . 111 SER CB . 11085 1
1301 . 1 1 111 111 SER N N 15 115.251 0.300 . 1 . . . . 111 SER N . 11085 1
1302 . 1 1 112 112 GLY H H 1 8.112 0.030 . 1 . . . . 112 GLY H . 11085 1
1303 . 1 1 112 112 GLY HA2 H 1 4.172 0.030 . 2 . . . . 112 GLY HA2 . 11085 1
1304 . 1 1 112 112 GLY HA3 H 1 4.023 0.030 . 2 . . . . 112 GLY HA3 . 11085 1
1305 . 1 1 112 112 GLY C C 13 169.314 0.300 . 1 . . . . 112 GLY C . 11085 1
1306 . 1 1 112 112 GLY CA C 13 42.297 0.300 . 1 . . . . 112 GLY CA . 11085 1
1307 . 1 1 112 112 GLY N N 15 110.117 0.300 . 1 . . . . 112 GLY N . 11085 1
1308 . 1 1 113 113 PRO HA H 1 4.446 0.030 . 1 . . . . 113 PRO HA . 11085 1
1309 . 1 1 113 113 PRO HB2 H 1 2.265 0.030 . 2 . . . . 113 PRO HB2 . 11085 1
1310 . 1 1 113 113 PRO HB3 H 1 1.908 0.030 . 2 . . . . 113 PRO HB3 . 11085 1
1311 . 1 1 113 113 PRO HD2 H 1 3.605 0.030 . 2 . . . . 113 PRO HD2 . 11085 1
1312 . 1 1 113 113 PRO HD3 H 1 3.569 0.030 . 2 . . . . 113 PRO HD3 . 11085 1
1313 . 1 1 113 113 PRO HG2 H 1 1.958 0.030 . 1 . . . . 113 PRO HG2 . 11085 1
1314 . 1 1 113 113 PRO HG3 H 1 1.958 0.030 . 1 . . . . 113 PRO HG3 . 11085 1
1315 . 1 1 113 113 PRO C C 13 175.042 0.300 . 1 . . . . 113 PRO C . 11085 1
1316 . 1 1 113 113 PRO CA C 13 60.894 0.300 . 1 . . . . 113 PRO CA . 11085 1
1317 . 1 1 113 113 PRO CB C 13 29.940 0.300 . 1 . . . . 113 PRO CB . 11085 1
1318 . 1 1 113 113 PRO CD C 13 47.499 0.300 . 1 . . . . 113 PRO CD . 11085 1
1319 . 1 1 113 113 PRO CG C 13 24.883 0.300 . 1 . . . . 113 PRO CG . 11085 1
1320 . 1 1 114 114 SER H H 1 8.514 0.030 . 1 . . . . 114 SER H . 11085 1
1321 . 1 1 114 114 SER C C 13 172.350 0.300 . 1 . . . . 114 SER C . 11085 1
1322 . 1 1 114 114 SER CA C 13 56.055 0.300 . 1 . . . . 114 SER CA . 11085 1
1323 . 1 1 114 114 SER CB C 13 61.622 0.300 . 1 . . . . 114 SER CB . 11085 1
1324 . 1 1 114 114 SER N N 15 116.094 0.300 . 1 . . . . 114 SER N . 11085 1
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