data_17124
#######################
# Entry information #
#######################
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 17124
_Entry.Title
;
NP_888769.1
;
_Entry.Type macromolecule
_Entry.Version_type original
_Entry.Submission_date 2010-08-11
_Entry.Accession_date 2010-08-11
_Entry.Last_release_date .
_Entry.Original_release_date .
_Entry.Origination author
_Entry.NMR_STAR_version 3.1.1.61
_Entry.Original_NMR_STAR_version 3.0.9.13
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype 'SOLUTION NMR'
_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 Atia-tul Wahab . . . 17124
2 Pedro Serrano . . . 17124
3 Michael Geralt . . . 17124
4 Ian Wilson . . . 17124
5 Kurt Wuthrich . . . 17124
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
1 'PSI, Protein Structure Initiative' 'Joint Center for Structural Genomics' . 17124
stop_
loop_
_Struct_keywords.Keywords
_Struct_keywords.Text
_Struct_keywords.Entry_ID
'Bordetella bronchiseptica' . 17124
JCSG . 17124
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts 1 17124
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
'13C chemical shifts' 565 17124
'15N chemical shifts' 142 17124
'1H chemical shifts' 947 17124
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
2 . . 2011-07-01 2011-08-11 update BMRB 'update entry citation' 17124
1 . . 2011-05-04 2011-08-11 original author 'original release' 17124
stop_
save_
###############
# Citations #
###############
save_entry_citation
_Citation.Sf_category citations
_Citation.Sf_framecode entry_citation
_Citation.Entry_ID 17124
_Citation.ID 1
_Citation.Class 'entry citation'
_Citation.CAS_abstract_code .
_Citation.MEDLINE_UI_code .
_Citation.DOI .
_Citation.PubMed_ID 21520320
_Citation.Full_citation .
_Citation.Title 'NMR structure of the Bordetella bronchiseptica protein NP_888769.1 establishes a new phage-related protein family PF13554.'
_Citation.Status published
_Citation.Type journal
_Citation.Journal_abbrev 'Protein Sci.'
_Citation.Journal_name_full 'Protein science'
_Citation.Journal_volume 20
_Citation.Journal_issue 7
_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 1137
_Citation.Page_last 1144
_Citation.Year 2011
_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 Atia-Tul Wahab . . . 17124 1
2 Pedro Serrano . . . 17124 1
3 Michael Geralt . . . 17124 1
4 Kurt Wuthrich . . . 17124 1
stop_
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID 17124
_Assembly.ID 1
_Assembly.Name NP_888769.1
_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 NP_888769.1 1 $NP_888769.1 A . yes native no no . . . 17124 1
stop_
save_
####################################
# Biological polymers and ligands #
####################################
save_NP_888769.1
_Entity.Sf_category entity
_Entity.Sf_framecode NP_888769.1
_Entity.Entry_ID 17124
_Entity.ID 1
_Entity.BMRB_code .
_Entity.Name NP_888769.1
_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
;
GMSQDLIRAAFEKRLSDWAK
ARTPALPVAWQNTKFTPPAA
GVYLRAYVMPAATISRDAAG
DHRQYRGVFQVNVVMPIGDG
SRSAEQVAAELDALFPVNLV
MQSGGLAVRVRTPISNGQPT
TGDADHTVPISLGYDVQFYP
E
;
_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 141
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state 'not present'
_Entity.Src_method man
_Entity.Parent_entity_ID 1
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight 15260.356
_Entity.Formula_weight_exptl .
_Entity.Formula_weight_exptl_meth .
_Entity.Details .
_Entity.DB_query_date .
_Entity.DB_query_revised_last_date 2015-11-25
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 2L25 . Np_888769.1 . . . . . 100.00 141 100.00 100.00 3.25e-97 . . . . 17124 1
2 no DBJ BAO70052 . "hypothetical protein BBS798_3327 [Bordetella bronchiseptica]" . . . . . 99.29 140 100.00 100.00 2.40e-96 . . . . 17124 1
3 no EMBL CAE32722 . "phage-related conserved hypothetical protein [Bordetella bronchiseptica RB50]" . . . . . 99.29 140 100.00 100.00 2.40e-96 . . . . 17124 1
4 no EMBL CAE33988 . "phage-related conserved hypothetical protein [Bordetella bronchiseptica RB50]" . . . . . 99.29 140 100.00 100.00 2.40e-96 . . . . 17124 1
5 no EMBL CCN17196 . "phage-related conserved hypothetical protein [Bordetella bronchiseptica MO211]" . . . . . 99.29 140 100.00 100.00 2.40e-96 . . . . 17124 1
6 no GB KAK74699 . "hypothetical protein L530_3421 [Bordetella bronchiseptica MO211]" . . . . . 99.29 140 100.00 100.00 2.40e-96 . . . . 17124 1
7 no GB KCV36321 . "hypothetical protein L489_3890 [Bordetella bronchiseptica 00-P-2730]" . . . . . 70.92 114 99.00 100.00 1.05e-63 . . . . 17124 1
8 no GB KCV51124 . "hypothetical protein L491_3590 [Bordetella bronchiseptica 3E44]" . . . . . 99.29 140 100.00 100.00 2.40e-96 . . . . 17124 1
9 no GB KDB85184 . "hypothetical protein L495_3595 [Bordetella bronchiseptica CARE970018BB]" . . . . . 99.29 140 100.00 100.00 2.40e-96 . . . . 17124 1
10 no GB KDB90075 . "hypothetical protein AZ17_2292 [Bordetella bronchiseptica D989]" . . . . . 99.29 140 100.00 100.00 2.40e-96 . . . . 17124 1
11 no REF WP_004566287 . "hypothetical protein [Bordetella bronchiseptica]" . . . . . 99.29 140 100.00 100.00 2.40e-96 . . . . 17124 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 . 17124 1
2 . MET . 17124 1
3 . SER . 17124 1
4 . GLN . 17124 1
5 . ASP . 17124 1
6 . LEU . 17124 1
7 . ILE . 17124 1
8 . ARG . 17124 1
9 . ALA . 17124 1
10 . ALA . 17124 1
11 . PHE . 17124 1
12 . GLU . 17124 1
13 . LYS . 17124 1
14 . ARG . 17124 1
15 . LEU . 17124 1
16 . SER . 17124 1
17 . ASP . 17124 1
18 . TRP . 17124 1
19 . ALA . 17124 1
20 . LYS . 17124 1
21 . ALA . 17124 1
22 . ARG . 17124 1
23 . THR . 17124 1
24 . PRO . 17124 1
25 . ALA . 17124 1
26 . LEU . 17124 1
27 . PRO . 17124 1
28 . VAL . 17124 1
29 . ALA . 17124 1
30 . TRP . 17124 1
31 . GLN . 17124 1
32 . ASN . 17124 1
33 . THR . 17124 1
34 . LYS . 17124 1
35 . PHE . 17124 1
36 . THR . 17124 1
37 . PRO . 17124 1
38 . PRO . 17124 1
39 . ALA . 17124 1
40 . ALA . 17124 1
41 . GLY . 17124 1
42 . VAL . 17124 1
43 . TYR . 17124 1
44 . LEU . 17124 1
45 . ARG . 17124 1
46 . ALA . 17124 1
47 . TYR . 17124 1
48 . VAL . 17124 1
49 . MET . 17124 1
50 . PRO . 17124 1
51 . ALA . 17124 1
52 . ALA . 17124 1
53 . THR . 17124 1
54 . ILE . 17124 1
55 . SER . 17124 1
56 . ARG . 17124 1
57 . ASP . 17124 1
58 . ALA . 17124 1
59 . ALA . 17124 1
60 . GLY . 17124 1
61 . ASP . 17124 1
62 . HIS . 17124 1
63 . ARG . 17124 1
64 . GLN . 17124 1
65 . TYR . 17124 1
66 . ARG . 17124 1
67 . GLY . 17124 1
68 . VAL . 17124 1
69 . PHE . 17124 1
70 . GLN . 17124 1
71 . VAL . 17124 1
72 . ASN . 17124 1
73 . VAL . 17124 1
74 . VAL . 17124 1
75 . MET . 17124 1
76 . PRO . 17124 1
77 . ILE . 17124 1
78 . GLY . 17124 1
79 . ASP . 17124 1
80 . GLY . 17124 1
81 . SER . 17124 1
82 . ARG . 17124 1
83 . SER . 17124 1
84 . ALA . 17124 1
85 . GLU . 17124 1
86 . GLN . 17124 1
87 . VAL . 17124 1
88 . ALA . 17124 1
89 . ALA . 17124 1
90 . GLU . 17124 1
91 . LEU . 17124 1
92 . ASP . 17124 1
93 . ALA . 17124 1
94 . LEU . 17124 1
95 . PHE . 17124 1
96 . PRO . 17124 1
97 . VAL . 17124 1
98 . ASN . 17124 1
99 . LEU . 17124 1
100 . VAL . 17124 1
101 . MET . 17124 1
102 . GLN . 17124 1
103 . SER . 17124 1
104 . GLY . 17124 1
105 . GLY . 17124 1
106 . LEU . 17124 1
107 . ALA . 17124 1
108 . VAL . 17124 1
109 . ARG . 17124 1
110 . VAL . 17124 1
111 . ARG . 17124 1
112 . THR . 17124 1
113 . PRO . 17124 1
114 . ILE . 17124 1
115 . SER . 17124 1
116 . ASN . 17124 1
117 . GLY . 17124 1
118 . GLN . 17124 1
119 . PRO . 17124 1
120 . THR . 17124 1
121 . THR . 17124 1
122 . GLY . 17124 1
123 . ASP . 17124 1
124 . ALA . 17124 1
125 . ASP . 17124 1
126 . HIS . 17124 1
127 . THR . 17124 1
128 . VAL . 17124 1
129 . PRO . 17124 1
130 . ILE . 17124 1
131 . SER . 17124 1
132 . LEU . 17124 1
133 . GLY . 17124 1
134 . TYR . 17124 1
135 . ASP . 17124 1
136 . VAL . 17124 1
137 . GLN . 17124 1
138 . PHE . 17124 1
139 . TYR . 17124 1
140 . PRO . 17124 1
141 . GLU . 17124 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 17124 1
. MET 2 2 17124 1
. SER 3 3 17124 1
. GLN 4 4 17124 1
. ASP 5 5 17124 1
. LEU 6 6 17124 1
. ILE 7 7 17124 1
. ARG 8 8 17124 1
. ALA 9 9 17124 1
. ALA 10 10 17124 1
. PHE 11 11 17124 1
. GLU 12 12 17124 1
. LYS 13 13 17124 1
. ARG 14 14 17124 1
. LEU 15 15 17124 1
. SER 16 16 17124 1
. ASP 17 17 17124 1
. TRP 18 18 17124 1
. ALA 19 19 17124 1
. LYS 20 20 17124 1
. ALA 21 21 17124 1
. ARG 22 22 17124 1
. THR 23 23 17124 1
. PRO 24 24 17124 1
. ALA 25 25 17124 1
. LEU 26 26 17124 1
. PRO 27 27 17124 1
. VAL 28 28 17124 1
. ALA 29 29 17124 1
. TRP 30 30 17124 1
. GLN 31 31 17124 1
. ASN 32 32 17124 1
. THR 33 33 17124 1
. LYS 34 34 17124 1
. PHE 35 35 17124 1
. THR 36 36 17124 1
. PRO 37 37 17124 1
. PRO 38 38 17124 1
. ALA 39 39 17124 1
. ALA 40 40 17124 1
. GLY 41 41 17124 1
. VAL 42 42 17124 1
. TYR 43 43 17124 1
. LEU 44 44 17124 1
. ARG 45 45 17124 1
. ALA 46 46 17124 1
. TYR 47 47 17124 1
. VAL 48 48 17124 1
. MET 49 49 17124 1
. PRO 50 50 17124 1
. ALA 51 51 17124 1
. ALA 52 52 17124 1
. THR 53 53 17124 1
. ILE 54 54 17124 1
. SER 55 55 17124 1
. ARG 56 56 17124 1
. ASP 57 57 17124 1
. ALA 58 58 17124 1
. ALA 59 59 17124 1
. GLY 60 60 17124 1
. ASP 61 61 17124 1
. HIS 62 62 17124 1
. ARG 63 63 17124 1
. GLN 64 64 17124 1
. TYR 65 65 17124 1
. ARG 66 66 17124 1
. GLY 67 67 17124 1
. VAL 68 68 17124 1
. PHE 69 69 17124 1
. GLN 70 70 17124 1
. VAL 71 71 17124 1
. ASN 72 72 17124 1
. VAL 73 73 17124 1
. VAL 74 74 17124 1
. MET 75 75 17124 1
. PRO 76 76 17124 1
. ILE 77 77 17124 1
. GLY 78 78 17124 1
. ASP 79 79 17124 1
. GLY 80 80 17124 1
. SER 81 81 17124 1
. ARG 82 82 17124 1
. SER 83 83 17124 1
. ALA 84 84 17124 1
. GLU 85 85 17124 1
. GLN 86 86 17124 1
. VAL 87 87 17124 1
. ALA 88 88 17124 1
. ALA 89 89 17124 1
. GLU 90 90 17124 1
. LEU 91 91 17124 1
. ASP 92 92 17124 1
. ALA 93 93 17124 1
. LEU 94 94 17124 1
. PHE 95 95 17124 1
. PRO 96 96 17124 1
. VAL 97 97 17124 1
. ASN 98 98 17124 1
. LEU 99 99 17124 1
. VAL 100 100 17124 1
. MET 101 101 17124 1
. GLN 102 102 17124 1
. SER 103 103 17124 1
. GLY 104 104 17124 1
. GLY 105 105 17124 1
. LEU 106 106 17124 1
. ALA 107 107 17124 1
. VAL 108 108 17124 1
. ARG 109 109 17124 1
. VAL 110 110 17124 1
. ARG 111 111 17124 1
. THR 112 112 17124 1
. PRO 113 113 17124 1
. ILE 114 114 17124 1
. SER 115 115 17124 1
. ASN 116 116 17124 1
. GLY 117 117 17124 1
. GLN 118 118 17124 1
. PRO 119 119 17124 1
. THR 120 120 17124 1
. THR 121 121 17124 1
. GLY 122 122 17124 1
. ASP 123 123 17124 1
. ALA 124 124 17124 1
. ASP 125 125 17124 1
. HIS 126 126 17124 1
. THR 127 127 17124 1
. VAL 128 128 17124 1
. PRO 129 129 17124 1
. ILE 130 130 17124 1
. SER 131 131 17124 1
. LEU 132 132 17124 1
. GLY 133 133 17124 1
. TYR 134 134 17124 1
. ASP 135 135 17124 1
. VAL 136 136 17124 1
. GLN 137 137 17124 1
. PHE 138 138 17124 1
. TYR 139 139 17124 1
. PRO 140 140 17124 1
. GLU 141 141 17124 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 17124
_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 $NP_888769.1 . 518 organism . 'Bordetella bronchiseptica' 'B. bronchiseptica' . . Bacteria . Bordetella bronchiseptica . . . . . . . . . . . . . . . . . . . . . 17124 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 17124
_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 $NP_888769.1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pSpeedET . . . . . . 17124 1
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Sample.Sf_category sample
_Sample.Sf_framecode sample_1
_Sample.Entry_ID 17124
_Sample.ID 1
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details .
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '95% H2O/5% 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 NP_888769.1 '[U-98% 13C; U-98% 15N]' . . 1 $NP_888769.1 . . 1.0 . . mM . . . . 17124 1
2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 17124 1
3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 17124 1
4 'sodium azide' 'natural abundance' . . . . . . 4.5 . . mM . . . . 17124 1
5 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17124 1
6 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17124 1
stop_
save_
#######################
# Sample conditions #
#######################
save_sample_conditions_1
_Sample_condition_list.Sf_category sample_conditions
_Sample_condition_list.Sf_framecode sample_conditions_1
_Sample_condition_list.Entry_ID 17124
_Sample_condition_list.ID 1
_Sample_condition_list.Details '20 mM sodium phosphate buffer, 50 mM sodium chloride, pH 6.0, 4.5 mM sodium azide, 5% D2O'
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' 0.11 . M 17124 1
pH 6.0 . pH 17124 1
pressure 1 . atm 17124 1
temperature 298 . K 17124 1
stop_
save_
############################
# Computer software used #
############################
save_UNIO
_Software.Sf_category software
_Software.Sf_framecode UNIO
_Software.Entry_ID 17124
_Software.ID 1
_Software.Name UNIO
_Software.Version 2.0.0
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Torsten Herrmann' 'Centre Europeen de RMN a Tres Hauts Champs, Universite de Lyon/FRE 3008 CNRS/ENS lyon, 5 rue de la Doua, 69100 Villeurbanne, France' torsten.hermann@ens-lyon.fr 17124 1
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'chemical shift assignment' 17124 1
'peak picking' 17124 1
'structure calculation' 17124 1
stop_
save_
save_CYANA
_Software.Sf_category software
_Software.Sf_framecode CYANA
_Software.Entry_ID 17124
_Software.ID 2
_Software.Name CYANA
_Software.Version 3.0
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Guntert, Mumenthaler and Wuthrich'
;
Institute of Biophysical Chemistry, Goethe-University Frankfurt am Main, Max-von-Laue-Str.9
60438 Frankfurt am Main
Germany
;
guentert@em.uni-frankfurt.de
17124
2
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'Structure calculation' 17124 2
stop_
save_
save_TOPSPIN
_Software.Sf_category software
_Software.Sf_framecode TOPSPIN
_Software.Entry_ID 17124
_Software.ID 3
_Software.Name TOPSPIN
_Software.Version 1.3
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Bruker Biospin' . . 17124 3
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data collection' 17124 3
'data processing' 17124 3
stop_
save_
save_Molmol
_Software.Sf_category software
_Software.Sf_framecode Molmol
_Software.Entry_ID 17124
_Software.ID 4
_Software.Name Molmol
_Software.Version 2K.1
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Koradi, Billeter and Wuthrich' . . 17124 4
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'analysis and display of molecule' 17124 4
stop_
save_
save_CARA
_Software.Sf_category software
_Software.Sf_framecode CARA
_Software.Entry_ID 17124
_Software.ID 5
_Software.Name CARA
_Software.Version 1.8.4_linux
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Keller and Wuthrich' . . 17124 5
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'chemical shift assignment' 17124 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 17124
_NMR_spectrometer.ID 1
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model Avance
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 600
save_
save_spectrometer_2
_NMR_spectrometer.Sf_category NMR_spectrometer
_NMR_spectrometer.Sf_framecode spectrometer_2
_NMR_spectrometer.Entry_ID 17124
_NMR_spectrometer.ID 2
_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 17124
_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 . 600 . . . 17124 1
2 spectrometer_2 Bruker Avance . 800 . . . 17124 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 17124
_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 '2D 15N-1H HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17124 1
2 '4D APSY-HACANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17124 1
3 '5D APSY-HACACONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17124 1
4 '5D APSY-CBCACONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17124 1
5 '15N-resolved [1H,1H]-NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17124 1
6 '13C(aliphatic)-resolved [1H,1H]-NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17124 1
7 '13C(aromatic)-resolved [1H,1H]-NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17124 1
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_chemical_shift_reference_1
_Chem_shift_reference.Sf_category chem_shift_reference
_Chem_shift_reference.Sf_framecode chemical_shift_reference_1
_Chem_shift_reference.Entry_ID 17124
_Chem_shift_reference.ID 1
_Chem_shift_reference.Details .
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 0.00 na indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 17124 1
H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . 1 $entry_citation . . 1 $entry_citation 17124 1
N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 17124 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_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 17124
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_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 '2D 15N-1H HSQC' . . . 17124 1
2 '4D APSY-HACANH' . . . 17124 1
3 '5D APSY-HACACONH' . . . 17124 1
4 '5D APSY-CBCACONH' . . . 17124 1
5 '15N-resolved [1H,1H]-NOESY' . . . 17124 1
6 '13C(aliphatic)-resolved [1H,1H]-NOESY' . . . 17124 1
7 '13C(aromatic)-resolved [1H,1H]-NOESY' . . . 17124 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 1 1 GLY HA2 H 1 3.811 0.027 . 2 . . . . 1 GLY QA . 17124 1
2 . 1 1 1 1 GLY HA3 H 1 3.811 0.027 . 2 . . . . 1 GLY QA . 17124 1
3 . 1 1 1 1 GLY CA C 13 43.290 0.15 . 1 . . . . 1 GLY CA . 17124 1
4 . 1 1 2 2 MET HA H 1 4.292 0.027 . 1 . . . . 2 MET HA . 17124 1
5 . 1 1 2 2 MET HB2 H 1 2.086 0.027 . 2 . . . . 2 MET HB2 . 17124 1
6 . 1 1 2 2 MET HE1 H 1 1.673 0.027 . 1 . . . . 2 MET QE . 17124 1
7 . 1 1 2 2 MET HE2 H 1 1.673 0.027 . 1 . . . . 2 MET QE . 17124 1
8 . 1 1 2 2 MET HE3 H 1 1.673 0.027 . 1 . . . . 2 MET QE . 17124 1
9 . 1 1 2 2 MET HG2 H 1 2.288 0.027 . 2 . . . . 2 MET HG2 . 17124 1
10 . 1 1 2 2 MET CA C 13 56.287 0.15 . 1 . . . . 2 MET CA . 17124 1
11 . 1 1 2 2 MET CB C 13 32.858 0.15 . 1 . . . . 2 MET CB . 17124 1
12 . 1 1 2 2 MET CE C 13 16.885 0.15 . 1 . . . . 2 MET CE . 17124 1
13 . 1 1 2 2 MET CG C 13 31.878 0.15 . 1 . . . . 2 MET CG . 17124 1
14 . 1 1 3 3 SER H H 1 8.283 0.027 . 1 . . . . 3 SER H . 17124 1
15 . 1 1 3 3 SER HA H 1 4.231 0.027 . 1 . . . . 3 SER HA . 17124 1
16 . 1 1 3 3 SER HB2 H 1 3.676 0.027 . 2 . . . . 3 SER HB2 . 17124 1
17 . 1 1 3 3 SER HB3 H 1 3.818 0.027 . 2 . . . . 3 SER HB3 . 17124 1
18 . 1 1 3 3 SER CA C 13 59.796 0.15 . 1 . . . . 3 SER CA . 17124 1
19 . 1 1 3 3 SER CB C 13 63.944 0.15 . 1 . . . . 3 SER CB . 17124 1
20 . 1 1 3 3 SER N N 15 117.135 0.20 . 1 . . . . 3 SER N . 17124 1
21 . 1 1 4 4 GLN H H 1 8.529 0.027 . 1 . . . . 4 GLN H . 17124 1
22 . 1 1 4 4 GLN HA H 1 3.998 0.027 . 1 . . . . 4 GLN HA . 17124 1
23 . 1 1 4 4 GLN HB2 H 1 2.072 0.027 . 2 . . . . 4 GLN QB . 17124 1
24 . 1 1 4 4 GLN HB3 H 1 2.072 0.027 . 2 . . . . 4 GLN QB . 17124 1
25 . 1 1 4 4 GLN HE21 H 1 6.450 0.027 . 2 . . . . 4 GLN HE21 . 17124 1
26 . 1 1 4 4 GLN HE22 H 1 7.615 0.027 . 2 . . . . 4 GLN HE22 . 17124 1
27 . 1 1 4 4 GLN HG2 H 1 2.471 0.027 . 2 . . . . 4 GLN QG . 17124 1
28 . 1 1 4 4 GLN HG3 H 1 2.471 0.027 . 2 . . . . 4 GLN QG . 17124 1
29 . 1 1 4 4 GLN CA C 13 58.203 0.15 . 1 . . . . 4 GLN CA . 17124 1
30 . 1 1 4 4 GLN CB C 13 27.646 0.15 . 1 . . . . 4 GLN CB . 17124 1
31 . 1 1 4 4 GLN CG C 13 33.275 0.15 . 1 . . . . 4 GLN CG . 17124 1
32 . 1 1 4 4 GLN N N 15 122.768 0.20 . 1 . . . . 4 GLN N . 17124 1
33 . 1 1 4 4 GLN NE2 N 15 110.719 0.20 . 1 . . . . 4 GLN NE2 . 17124 1
34 . 1 1 5 5 ASP H H 1 8.053 0.027 . 1 . . . . 5 ASP H . 17124 1
35 . 1 1 5 5 ASP HA H 1 4.283 0.027 . 1 . . . . 5 ASP HA . 17124 1
36 . 1 1 5 5 ASP HB2 H 1 2.587 0.027 . 2 . . . . 5 ASP QB . 17124 1
37 . 1 1 5 5 ASP HB3 H 1 2.587 0.027 . 2 . . . . 5 ASP QB . 17124 1
38 . 1 1 5 5 ASP CA C 13 56.876 0.15 . 1 . . . . 5 ASP CA . 17124 1
39 . 1 1 5 5 ASP CB C 13 39.918 0.15 . 1 . . . . 5 ASP CB . 17124 1
40 . 1 1 5 5 ASP N N 15 119.727 0.20 . 1 . . . . 5 ASP N . 17124 1
41 . 1 1 6 6 LEU H H 1 7.798 0.027 . 1 . . . . 6 LEU H . 17124 1
42 . 1 1 6 6 LEU HA H 1 3.900 0.027 . 1 . . . . 6 LEU HA . 17124 1
43 . 1 1 6 6 LEU HB2 H 1 1.864 0.027 . 2 . . . . 6 LEU HB2 . 17124 1
44 . 1 1 6 6 LEU HB3 H 1 1.305 0.027 . 2 . . . . 6 LEU HB3 . 17124 1
45 . 1 1 6 6 LEU HD11 H 1 0.951 0.027 . 1 . . . . 6 LEU QD1 . 17124 1
46 . 1 1 6 6 LEU HD12 H 1 0.951 0.027 . 1 . . . . 6 LEU QD1 . 17124 1
47 . 1 1 6 6 LEU HD13 H 1 0.951 0.027 . 1 . . . . 6 LEU QD1 . 17124 1
48 . 1 1 6 6 LEU HD21 H 1 0.702 0.027 . 1 . . . . 6 LEU QD2 . 17124 1
49 . 1 1 6 6 LEU HD22 H 1 0.702 0.027 . 1 . . . . 6 LEU QD2 . 17124 1
50 . 1 1 6 6 LEU HD23 H 1 0.702 0.027 . 1 . . . . 6 LEU QD2 . 17124 1
51 . 1 1 6 6 LEU HG H 1 1.669 0.027 . 1 . . . . 6 LEU HG . 17124 1
52 . 1 1 6 6 LEU CA C 13 57.185 0.15 . 1 . . . . 6 LEU CA . 17124 1
53 . 1 1 6 6 LEU CB C 13 41.574 0.15 . 1 . . . . 6 LEU CB . 17124 1
54 . 1 1 6 6 LEU CD1 C 13 25.543 0.15 . 2 . . . . 6 LEU CD1 . 17124 1
55 . 1 1 6 6 LEU CD2 C 13 21.900 0.15 . 2 . . . . 6 LEU CD2 . 17124 1
56 . 1 1 6 6 LEU CG C 13 26.816 0.15 . 1 . . . . 6 LEU CG . 17124 1
57 . 1 1 6 6 LEU N N 15 121.234 0.20 . 1 . . . . 6 LEU N . 17124 1
58 . 1 1 7 7 ILE H H 1 7.624 0.027 . 1 . . . . 7 ILE H . 17124 1
59 . 1 1 7 7 ILE HA H 1 3.320 0.027 . 1 . . . . 7 ILE HA . 17124 1
60 . 1 1 7 7 ILE HB H 1 1.818 0.027 . 1 . . . . 7 ILE HB . 17124 1
61 . 1 1 7 7 ILE HD11 H 1 0.791 0.027 . 1 . . . . 7 ILE QD1 . 17124 1
62 . 1 1 7 7 ILE HD12 H 1 0.791 0.027 . 1 . . . . 7 ILE QD1 . 17124 1
63 . 1 1 7 7 ILE HD13 H 1 0.791 0.027 . 1 . . . . 7 ILE QD1 . 17124 1
64 . 1 1 7 7 ILE HG12 H 1 0.640 0.027 . 2 . . . . 7 ILE HG12 . 17124 1
65 . 1 1 7 7 ILE HG13 H 1 1.645 0.027 . 2 . . . . 7 ILE HG13 . 17124 1
66 . 1 1 7 7 ILE HG21 H 1 0.614 0.027 . 1 . . . . 7 ILE QG2 . 17124 1
67 . 1 1 7 7 ILE HG22 H 1 0.614 0.027 . 1 . . . . 7 ILE QG2 . 17124 1
68 . 1 1 7 7 ILE HG23 H 1 0.614 0.027 . 1 . . . . 7 ILE QG2 . 17124 1
69 . 1 1 7 7 ILE CA C 13 65.370 0.15 . 1 . . . . 7 ILE CA . 17124 1
70 . 1 1 7 7 ILE CB C 13 38.110 0.15 . 1 . . . . 7 ILE CB . 17124 1
71 . 1 1 7 7 ILE CD1 C 13 14.908 0.15 . 1 . . . . 7 ILE CD1 . 17124 1
72 . 1 1 7 7 ILE CG1 C 13 29.314 0.15 . 1 . . . . 7 ILE CG1 . 17124 1
73 . 1 1 7 7 ILE CG2 C 13 17.353 0.15 . 1 . . . . 7 ILE CG2 . 17124 1
74 . 1 1 7 7 ILE N N 15 122.421 0.20 . 1 . . . . 7 ILE N . 17124 1
75 . 1 1 8 8 ARG H H 1 7.840 0.027 . 1 . . . . 8 ARG H . 17124 1
76 . 1 1 8 8 ARG HA H 1 3.860 0.027 . 1 . . . . 8 ARG HA . 17124 1
77 . 1 1 8 8 ARG HB2 H 1 1.907 0.027 . 2 . . . . 8 ARG HB2 . 17124 1
78 . 1 1 8 8 ARG HB3 H 1 1.818 0.027 . 2 . . . . 8 ARG HB3 . 17124 1
79 . 1 1 8 8 ARG HD2 H 1 3.019 0.027 . 2 . . . . 8 ARG QD . 17124 1
80 . 1 1 8 8 ARG HD3 H 1 3.019 0.027 . 2 . . . . 8 ARG QD . 17124 1
81 . 1 1 8 8 ARG HG2 H 1 1.914 0.027 . 2 . . . . 8 ARG HG2 . 17124 1
82 . 1 1 8 8 ARG HG3 H 1 1.817 0.027 . 2 . . . . 8 ARG HG3 . 17124 1
83 . 1 1 8 8 ARG CA C 13 59.966 0.15 . 1 . . . . 8 ARG CA . 17124 1
84 . 1 1 8 8 ARG CB C 13 29.073 0.15 . 1 . . . . 8 ARG CB . 17124 1
85 . 1 1 8 8 ARG CD C 13 43.316 0.15 . 1 . . . . 8 ARG CD . 17124 1
86 . 1 1 8 8 ARG CG C 13 28.560 0.15 . 1 . . . . 8 ARG CG . 17124 1
87 . 1 1 8 8 ARG N N 15 117.892 0.20 . 1 . . . . 8 ARG N . 17124 1
88 . 1 1 9 9 ALA H H 1 7.868 0.027 . 1 . . . . 9 ALA H . 17124 1
89 . 1 1 9 9 ALA HA H 1 3.926 0.027 . 1 . . . . 9 ALA HA . 17124 1
90 . 1 1 9 9 ALA HB1 H 1 1.281 0.027 . 1 . . . . 9 ALA QB . 17124 1
91 . 1 1 9 9 ALA HB2 H 1 1.281 0.027 . 1 . . . . 9 ALA QB . 17124 1
92 . 1 1 9 9 ALA HB3 H 1 1.281 0.027 . 1 . . . . 9 ALA QB . 17124 1
93 . 1 1 9 9 ALA CA C 13 54.710 0.15 . 1 . . . . 9 ALA CA . 17124 1
94 . 1 1 9 9 ALA CB C 13 18.130 0.15 . 1 . . . . 9 ALA CB . 17124 1
95 . 1 1 9 9 ALA N N 15 117.979 0.20 . 1 . . . . 9 ALA N . 17124 1
96 . 1 1 10 10 ALA H H 1 7.081 0.027 . 1 . . . . 10 ALA H . 17124 1
97 . 1 1 10 10 ALA HA H 1 3.932 0.027 . 1 . . . . 10 ALA HA . 17124 1
98 . 1 1 10 10 ALA HB1 H 1 1.115 0.027 . 1 . . . . 10 ALA QB . 17124 1
99 . 1 1 10 10 ALA HB2 H 1 1.115 0.027 . 1 . . . . 10 ALA QB . 17124 1
100 . 1 1 10 10 ALA HB3 H 1 1.115 0.027 . 1 . . . . 10 ALA QB . 17124 1
101 . 1 1 10 10 ALA C C 13 179.482 0.15 . 1 . . . . 10 ALA C . 17124 1
102 . 1 1 10 10 ALA CA C 13 54.685 0.15 . 1 . . . . 10 ALA CA . 17124 1
103 . 1 1 10 10 ALA CB C 13 17.083 0.15 . 1 . . . . 10 ALA CB . 17124 1
104 . 1 1 10 10 ALA N N 15 119.876 0.20 . 1 . . . . 10 ALA N . 17124 1
105 . 1 1 11 11 PHE H H 1 6.855 0.027 . 1 . . . . 11 PHE H . 17124 1
106 . 1 1 11 11 PHE HA H 1 3.768 0.027 . 1 . . . . 11 PHE HA . 17124 1
107 . 1 1 11 11 PHE HB2 H 1 2.401 0.027 . 2 . . . . 11 PHE HB2 . 17124 1
108 . 1 1 11 11 PHE HB3 H 1 2.486 0.027 . 2 . . . . 11 PHE HB3 . 17124 1
109 . 1 1 11 11 PHE HD1 H 1 6.299 0.027 . 3 . . . . 11 PHE QD . 17124 1
110 . 1 1 11 11 PHE HD2 H 1 6.299 0.027 . 3 . . . . 11 PHE QD . 17124 1
111 . 1 1 11 11 PHE HE1 H 1 5.935 0.027 . 3 . . . . 11 PHE QE . 17124 1
112 . 1 1 11 11 PHE HE2 H 1 5.935 0.027 . 3 . . . . 11 PHE QE . 17124 1
113 . 1 1 11 11 PHE C C 13 177.464 0.15 . 1 . . . . 11 PHE C . 17124 1
114 . 1 1 11 11 PHE CA C 13 63.090 0.15 . 1 . . . . 11 PHE CA . 17124 1
115 . 1 1 11 11 PHE CB C 13 40.101 0.15 . 1 . . . . 11 PHE CB . 17124 1
116 . 1 1 11 11 PHE CD1 C 13 131.387 0.15 . 3 . . . . 11 PHE CD1 . 17124 1
117 . 1 1 11 11 PHE CD2 C 13 131.350 0.15 . 3 . . . . 11 PHE CD2 . 17124 1
118 . 1 1 11 11 PHE CE1 C 13 130.038 0.15 . 3 . . . . 11 PHE CE1 . 17124 1
119 . 1 1 11 11 PHE CE2 C 13 130.040 0.15 . 3 . . . . 11 PHE CE2 . 17124 1
120 . 1 1 11 11 PHE N N 15 114.672 0.20 . 1 . . . . 11 PHE N . 17124 1
121 . 1 1 12 12 GLU H H 1 8.983 0.027 . 1 . . . . 12 GLU H . 17124 1
122 . 1 1 12 12 GLU HA H 1 3.894 0.027 . 1 . . . . 12 GLU HA . 17124 1
123 . 1 1 12 12 GLU HB2 H 1 1.504 0.027 . 2 . . . . 12 GLU HB2 . 17124 1
124 . 1 1 12 12 GLU HB3 H 1 1.125 0.027 . 2 . . . . 12 GLU HB3 . 17124 1
125 . 1 1 12 12 GLU HG2 H 1 1.591 0.027 . 2 . . . . 12 GLU HG2 . 17124 1
126 . 1 1 12 12 GLU HG3 H 1 1.509 0.027 . 2 . . . . 12 GLU HG3 . 17124 1
127 . 1 1 12 12 GLU C C 13 179.358 0.15 . 1 . . . . 12 GLU C . 17124 1
128 . 1 1 12 12 GLU CA C 13 59.685 0.15 . 1 . . . . 12 GLU CA . 17124 1
129 . 1 1 12 12 GLU CB C 13 29.059 0.15 . 1 . . . . 12 GLU CB . 17124 1
130 . 1 1 12 12 GLU CG C 13 35.044 0.15 . 1 . . . . 12 GLU CG . 17124 1
131 . 1 1 12 12 GLU N N 15 118.995 0.20 . 1 . . . . 12 GLU N . 17124 1
132 . 1 1 13 13 LYS H H 1 7.966 0.027 . 1 . . . . 13 LYS H . 17124 1
133 . 1 1 13 13 LYS HA H 1 3.988 0.027 . 1 . . . . 13 LYS HA . 17124 1
134 . 1 1 13 13 LYS HB2 H 1 1.839 0.027 . 2 . . . . 13 LYS HB2 . 17124 1
135 . 1 1 13 13 LYS HB3 H 1 2.045 0.027 . 2 . . . . 13 LYS HB3 . 17124 1
136 . 1 1 13 13 LYS HD2 H 1 1.684 0.027 . 2 . . . . 13 LYS HD2 . 17124 1
137 . 1 1 13 13 LYS HD3 H 1 1.568 0.027 . 2 . . . . 13 LYS HD3 . 17124 1
138 . 1 1 13 13 LYS HE2 H 1 2.887 0.027 . 2 . . . . 13 LYS QE . 17124 1
139 . 1 1 13 13 LYS HE3 H 1 2.887 0.027 . 2 . . . . 13 LYS QE . 17124 1
140 . 1 1 13 13 LYS HG2 H 1 1.389 0.027 . 2 . . . . 13 LYS HG2 . 17124 1
141 . 1 1 13 13 LYS HG3 H 1 1.294 0.027 . 2 . . . . 13 LYS HG3 . 17124 1
142 . 1 1 13 13 LYS C C 13 177.330 0.15 . 1 . . . . 13 LYS C . 17124 1
143 . 1 1 13 13 LYS CA C 13 59.252 0.15 . 1 . . . . 13 LYS CA . 17124 1
144 . 1 1 13 13 LYS CB C 13 31.827 0.15 . 1 . . . . 13 LYS CB . 17124 1
145 . 1 1 13 13 LYS CD C 13 28.653 0.15 . 1 . . . . 13 LYS CD . 17124 1
146 . 1 1 13 13 LYS CE C 13 42.299 0.15 . 1 . . . . 13 LYS CE . 17124 1
147 . 1 1 13 13 LYS CG C 13 24.724 0.15 . 1 . . . . 13 LYS CG . 17124 1
148 . 1 1 13 13 LYS N N 15 120.329 0.20 . 1 . . . . 13 LYS N . 17124 1
149 . 1 1 14 14 ARG H H 1 7.004 0.027 . 1 . . . . 14 ARG H . 17124 1
150 . 1 1 14 14 ARG HA H 1 4.082 0.027 . 1 . . . . 14 ARG HA . 17124 1
151 . 1 1 14 14 ARG HB2 H 1 1.728 0.027 . 2 . . . . 14 ARG QB . 17124 1
152 . 1 1 14 14 ARG HB3 H 1 1.728 0.027 . 2 . . . . 14 ARG QB . 17124 1
153 . 1 1 14 14 ARG HD2 H 1 2.980 0.027 . 2 . . . . 14 ARG HD2 . 17124 1
154 . 1 1 14 14 ARG HD3 H 1 2.762 0.027 . 2 . . . . 14 ARG HD3 . 17124 1
155 . 1 1 14 14 ARG HG2 H 1 1.507 0.027 . 2 . . . . 14 ARG HG2 . 17124 1
156 . 1 1 14 14 ARG HG3 H 1 1.032 0.027 . 2 . . . . 14 ARG HG3 . 17124 1
157 . 1 1 14 14 ARG C C 13 179.463 0.15 . 1 . . . . 14 ARG C . 17124 1
158 . 1 1 14 14 ARG CA C 13 59.500 0.15 . 1 . . . . 14 ARG CA . 17124 1
159 . 1 1 14 14 ARG CB C 13 30.540 0.15 . 1 . . . . 14 ARG CB . 17124 1
160 . 1 1 14 14 ARG CD C 13 43.571 0.15 . 1 . . . . 14 ARG CD . 17124 1
161 . 1 1 14 14 ARG CG C 13 28.232 0.15 . 1 . . . . 14 ARG CG . 17124 1
162 . 1 1 14 14 ARG N N 15 116.858 0.20 . 1 . . . . 14 ARG N . 17124 1
163 . 1 1 15 15 LEU H H 1 8.838 0.027 . 1 . . . . 15 LEU H . 17124 1
164 . 1 1 15 15 LEU HA H 1 4.474 0.027 . 1 . . . . 15 LEU HA . 17124 1
165 . 1 1 15 15 LEU HB2 H 1 1.962 0.027 . 2 . . . . 15 LEU HB2 . 17124 1
166 . 1 1 15 15 LEU HB3 H 1 2.373 0.027 . 2 . . . . 15 LEU HB3 . 17124 1
167 . 1 1 15 15 LEU HD11 H 1 1.049 0.027 . 1 . . . . 15 LEU QD1 . 17124 1
168 . 1 1 15 15 LEU HD12 H 1 1.049 0.027 . 1 . . . . 15 LEU QD1 . 17124 1
169 . 1 1 15 15 LEU HD13 H 1 1.049 0.027 . 1 . . . . 15 LEU QD1 . 17124 1
170 . 1 1 15 15 LEU HD21 H 1 1.161 0.027 . 1 . . . . 15 LEU QD2 . 17124 1
171 . 1 1 15 15 LEU HD22 H 1 1.161 0.027 . 1 . . . . 15 LEU QD2 . 17124 1
172 . 1 1 15 15 LEU HD23 H 1 1.161 0.027 . 1 . . . . 15 LEU QD2 . 17124 1
173 . 1 1 15 15 LEU HG H 1 2.053 0.027 . 1 . . . . 15 LEU HG . 17124 1
174 . 1 1 15 15 LEU C C 13 178.728 0.15 . 1 . . . . 15 LEU C . 17124 1
175 . 1 1 15 15 LEU CA C 13 58.177 0.15 . 1 . . . . 15 LEU CA . 17124 1
176 . 1 1 15 15 LEU CB C 13 43.477 0.15 . 1 . . . . 15 LEU CB . 17124 1
177 . 1 1 15 15 LEU CD1 C 13 27.304 0.15 . 2 . . . . 15 LEU CD1 . 17124 1
178 . 1 1 15 15 LEU CD2 C 13 25.945 0.15 . 2 . . . . 15 LEU CD2 . 17124 1
179 . 1 1 15 15 LEU CG C 13 27.108 0.15 . 1 . . . . 15 LEU CG . 17124 1
180 . 1 1 15 15 LEU N N 15 117.021 0.20 . 1 . . . . 15 LEU N . 17124 1
181 . 1 1 16 16 SER H H 1 8.799 0.027 . 1 . . . . 16 SER H . 17124 1
182 . 1 1 16 16 SER HA H 1 4.334 0.027 . 1 . . . . 16 SER HA . 17124 1
183 . 1 1 16 16 SER HB2 H 1 4.184 0.027 . 2 . . . . 16 SER HB2 . 17124 1
184 . 1 1 16 16 SER HB3 H 1 4.088 0.027 . 2 . . . . 16 SER HB3 . 17124 1
185 . 1 1 16 16 SER C C 13 176.896 0.15 . 1 . . . . 16 SER C . 17124 1
186 . 1 1 16 16 SER CA C 13 62.424 0.15 . 1 . . . . 16 SER CA . 17124 1
187 . 1 1 16 16 SER CB C 13 63.006 0.15 . 1 . . . . 16 SER CB . 17124 1
188 . 1 1 16 16 SER N N 15 114.153 0.20 . 1 . . . . 16 SER N . 17124 1
189 . 1 1 17 17 ASP H H 1 8.238 0.027 . 1 . . . . 17 ASP H . 17124 1
190 . 1 1 17 17 ASP HA H 1 4.347 0.027 . 1 . . . . 17 ASP HA . 17124 1
191 . 1 1 17 17 ASP HB2 H 1 2.901 0.027 . 2 . . . . 17 ASP HB2 . 17124 1
192 . 1 1 17 17 ASP HB3 H 1 2.601 0.027 . 2 . . . . 17 ASP HB3 . 17124 1
193 . 1 1 17 17 ASP C C 13 178.793 0.15 . 1 . . . . 17 ASP C . 17124 1
194 . 1 1 17 17 ASP CA C 13 57.365 0.15 . 1 . . . . 17 ASP CA . 17124 1
195 . 1 1 17 17 ASP CB C 13 39.846 0.15 . 1 . . . . 17 ASP CB . 17124 1
196 . 1 1 17 17 ASP N N 15 120.574 0.20 . 1 . . . . 17 ASP N . 17124 1
197 . 1 1 18 18 TRP H H 1 7.221 0.027 . 1 . . . . 18 TRP H . 17124 1
198 . 1 1 18 18 TRP HA H 1 4.288 0.027 . 1 . . . . 18 TRP HA . 17124 1
199 . 1 1 18 18 TRP HB2 H 1 3.470 0.027 . 2 . . . . 18 TRP HB2 . 17124 1
200 . 1 1 18 18 TRP HB3 H 1 3.297 0.027 . 2 . . . . 18 TRP HB3 . 17124 1
201 . 1 1 18 18 TRP HD1 H 1 7.247 0.027 . 1 . . . . 18 TRP HD1 . 17124 1
202 . 1 1 18 18 TRP HE1 H 1 10.372 0.027 . 1 . . . . 18 TRP HE1 . 17124 1
203 . 1 1 18 18 TRP HE3 H 1 7.954 0.027 . 1 . . . . 18 TRP HE3 . 17124 1
204 . 1 1 18 18 TRP HH2 H 1 6.784 0.027 . 1 . . . . 18 TRP HH2 . 17124 1
205 . 1 1 18 18 TRP HZ2 H 1 7.408 0.027 . 1 . . . . 18 TRP HZ2 . 17124 1
206 . 1 1 18 18 TRP HZ3 H 1 6.709 0.027 . 1 . . . . 18 TRP HZ3 . 17124 1
207 . 1 1 18 18 TRP C C 13 177.755 0.15 . 1 . . . . 18 TRP C . 17124 1
208 . 1 1 18 18 TRP CA C 13 60.388 0.15 . 1 . . . . 18 TRP CA . 17124 1
209 . 1 1 18 18 TRP CB C 13 29.225 0.15 . 1 . . . . 18 TRP CB . 17124 1
210 . 1 1 18 18 TRP CD1 C 13 127.633 0.15 . 1 . . . . 18 TRP CD1 . 17124 1
211 . 1 1 18 18 TRP CE3 C 13 121.211 0.15 . 1 . . . . 18 TRP CE3 . 17124 1
212 . 1 1 18 18 TRP CH2 C 13 122.933 0.15 . 1 . . . . 18 TRP CH2 . 17124 1
213 . 1 1 18 18 TRP CZ2 C 13 113.395 0.15 . 1 . . . . 18 TRP CZ2 . 17124 1
214 . 1 1 18 18 TRP CZ3 C 13 120.310 0.15 . 1 . . . . 18 TRP CZ3 . 17124 1
215 . 1 1 18 18 TRP N N 15 120.452 0.20 . 1 . . . . 18 TRP N . 17124 1
216 . 1 1 18 18 TRP NE1 N 15 129.962 0.20 . 1 . . . . 18 TRP NE1 . 17124 1
217 . 1 1 19 19 ALA H H 1 8.851 0.027 . 1 . . . . 19 ALA H . 17124 1
218 . 1 1 19 19 ALA HA H 1 2.810 0.027 . 1 . . . . 19 ALA HA . 17124 1
219 . 1 1 19 19 ALA HB1 H 1 1.606 0.027 . 1 . . . . 19 ALA QB . 17124 1
220 . 1 1 19 19 ALA HB2 H 1 1.606 0.027 . 1 . . . . 19 ALA QB . 17124 1
221 . 1 1 19 19 ALA HB3 H 1 1.606 0.027 . 1 . . . . 19 ALA QB . 17124 1
222 . 1 1 19 19 ALA C C 13 179.024 0.15 . 1 . . . . 19 ALA C . 17124 1
223 . 1 1 19 19 ALA CA C 13 55.379 0.15 . 1 . . . . 19 ALA CA . 17124 1
224 . 1 1 19 19 ALA CB C 13 18.211 0.15 . 1 . . . . 19 ALA CB . 17124 1
225 . 1 1 19 19 ALA N N 15 122.537 0.20 . 1 . . . . 19 ALA N . 17124 1
226 . 1 1 20 20 LYS H H 1 7.747 0.027 . 1 . . . . 20 LYS H . 17124 1
227 . 1 1 20 20 LYS HA H 1 4.148 0.027 . 1 . . . . 20 LYS HA . 17124 1
228 . 1 1 20 20 LYS HB2 H 1 1.794 0.027 . 2 . . . . 20 LYS HB2 . 17124 1
229 . 1 1 20 20 LYS HB3 H 1 1.897 0.027 . 2 . . . . 20 LYS HB3 . 17124 1
230 . 1 1 20 20 LYS HD2 H 1 1.646 0.027 . 2 . . . . 20 LYS QD . 17124 1
231 . 1 1 20 20 LYS HD3 H 1 1.646 0.027 . 2 . . . . 20 LYS QD . 17124 1
232 . 1 1 20 20 LYS HE2 H 1 2.957 0.027 . 2 . . . . 20 LYS QE . 17124 1
233 . 1 1 20 20 LYS HE3 H 1 2.957 0.027 . 2 . . . . 20 LYS QE . 17124 1
234 . 1 1 20 20 LYS HG2 H 1 1.574 0.027 . 2 . . . . 20 LYS HG2 . 17124 1
235 . 1 1 20 20 LYS HG3 H 1 1.486 0.027 . 2 . . . . 20 LYS HG3 . 17124 1
236 . 1 1 20 20 LYS C C 13 177.273 0.15 . 1 . . . . 20 LYS C . 17124 1
237 . 1 1 20 20 LYS CA C 13 57.365 0.15 . 1 . . . . 20 LYS CA . 17124 1
238 . 1 1 20 20 LYS CB C 13 32.712 0.15 . 1 . . . . 20 LYS CB . 17124 1
239 . 1 1 20 20 LYS CD C 13 29.545 0.15 . 1 . . . . 20 LYS CD . 17124 1
240 . 1 1 20 20 LYS CE C 13 42.091 0.15 . 1 . . . . 20 LYS CE . 17124 1
241 . 1 1 20 20 LYS CG C 13 24.737 0.15 . 1 . . . . 20 LYS CG . 17124 1
242 . 1 1 20 20 LYS N N 15 112.001 0.20 . 1 . . . . 20 LYS N . 17124 1
243 . 1 1 21 21 ALA H H 1 6.962 0.027 . 1 . . . . 21 ALA H . 17124 1
244 . 1 1 21 21 ALA HA H 1 4.309 0.027 . 1 . . . . 21 ALA HA . 17124 1
245 . 1 1 21 21 ALA HB1 H 1 1.371 0.027 . 1 . . . . 21 ALA QB . 17124 1
246 . 1 1 21 21 ALA HB2 H 1 1.371 0.027 . 1 . . . . 21 ALA QB . 17124 1
247 . 1 1 21 21 ALA HB3 H 1 1.371 0.027 . 1 . . . . 21 ALA QB . 17124 1
248 . 1 1 21 21 ALA C C 13 176.712 0.15 . 1 . . . . 21 ALA C . 17124 1
249 . 1 1 21 21 ALA CA C 13 51.716 0.15 . 1 . . . . 21 ALA CA . 17124 1
250 . 1 1 21 21 ALA CB C 13 19.505 0.15 . 1 . . . . 21 ALA CB . 17124 1
251 . 1 1 21 21 ALA N N 15 120.870 0.20 . 1 . . . . 21 ALA N . 17124 1
252 . 1 1 22 22 ARG H H 1 6.722 0.027 . 1 . . . . 22 ARG H . 17124 1
253 . 1 1 22 22 ARG HA H 1 3.913 0.027 . 1 . . . . 22 ARG HA . 17124 1
254 . 1 1 22 22 ARG HB2 H 1 1.234 0.027 . 2 . . . . 22 ARG HB2 . 17124 1
255 . 1 1 22 22 ARG HB3 H 1 1.177 0.027 . 2 . . . . 22 ARG HB3 . 17124 1
256 . 1 1 22 22 ARG HD2 H 1 2.457 0.027 . 2 . . . . 22 ARG HD2 . 17124 1
257 . 1 1 22 22 ARG HD3 H 1 1.951 0.027 . 2 . . . . 22 ARG HD3 . 17124 1
258 . 1 1 22 22 ARG HG2 H 1 1.179 0.027 . 2 . . . . 22 ARG QG . 17124 1
259 . 1 1 22 22 ARG HG3 H 1 1.179 0.027 . 2 . . . . 22 ARG QG . 17124 1
260 . 1 1 22 22 ARG C C 13 173.916 0.15 . 1 . . . . 22 ARG C . 17124 1
261 . 1 1 22 22 ARG CA C 13 55.524 0.15 . 1 . . . . 22 ARG CA . 17124 1
262 . 1 1 22 22 ARG CB C 13 30.803 0.15 . 1 . . . . 22 ARG CB . 17124 1
263 . 1 1 22 22 ARG CD C 13 43.214 0.15 . 1 . . . . 22 ARG CD . 17124 1
264 . 1 1 22 22 ARG CG C 13 27.125 0.15 . 1 . . . . 22 ARG CG . 17124 1
265 . 1 1 22 22 ARG N N 15 121.054 0.20 . 1 . . . . 22 ARG N . 17124 1
266 . 1 1 23 23 THR H H 1 8.067 0.027 . 1 . . . . 23 THR H . 17124 1
267 . 1 1 23 23 THR HA H 1 4.547 0.027 . 1 . . . . 23 THR HA . 17124 1
268 . 1 1 23 23 THR HB H 1 3.896 0.027 . 1 . . . . 23 THR HB . 17124 1
269 . 1 1 23 23 THR HG21 H 1 1.050 0.027 . 1 . . . . 23 THR QG2 . 17124 1
270 . 1 1 23 23 THR HG22 H 1 1.050 0.027 . 1 . . . . 23 THR QG2 . 17124 1
271 . 1 1 23 23 THR HG23 H 1 1.050 0.027 . 1 . . . . 23 THR QG2 . 17124 1
272 . 1 1 23 23 THR CA C 13 58.011 0.15 . 1 . . . . 23 THR CA . 17124 1
273 . 1 1 23 23 THR CB C 13 70.562 0.15 . 1 . . . . 23 THR CB . 17124 1
274 . 1 1 23 23 THR CG2 C 13 20.591 0.15 . 1 . . . . 23 THR CG2 . 17124 1
275 . 1 1 23 23 THR N N 15 115.637 0.20 . 1 . . . . 23 THR N . 17124 1
276 . 1 1 24 24 PRO HA H 1 4.339 0.027 . 1 . . . . 24 PRO HA . 17124 1
277 . 1 1 24 24 PRO HB2 H 1 2.318 0.027 . 2 . . . . 24 PRO HB2 . 17124 1
278 . 1 1 24 24 PRO HB3 H 1 1.990 0.027 . 2 . . . . 24 PRO HB3 . 17124 1
279 . 1 1 24 24 PRO HD2 H 1 3.494 0.027 . 2 . . . . 24 PRO HD2 . 17124 1
280 . 1 1 24 24 PRO HD3 H 1 3.391 0.027 . 2 . . . . 24 PRO HD3 . 17124 1
281 . 1 1 24 24 PRO HG2 H 1 1.896 0.027 . 2 . . . . 24 PRO HG2 . 17124 1
282 . 1 1 24 24 PRO HG3 H 1 1.669 0.027 . 2 . . . . 24 PRO HG3 . 17124 1
283 . 1 1 24 24 PRO CA C 13 63.255 0.15 . 1 . . . . 24 PRO CA . 17124 1
284 . 1 1 24 24 PRO CB C 13 34.529 0.15 . 1 . . . . 24 PRO CB . 17124 1
285 . 1 1 24 24 PRO CD C 13 49.743 0.15 . 1 . . . . 24 PRO CD . 17124 1
286 . 1 1 24 24 PRO CG C 13 27.147 0.15 . 1 . . . . 24 PRO CG . 17124 1
287 . 1 1 25 25 ALA H H 1 8.183 0.027 . 1 . . . . 25 ALA H . 17124 1
288 . 1 1 25 25 ALA HA H 1 4.057 0.027 . 1 . . . . 25 ALA HA . 17124 1
289 . 1 1 25 25 ALA HB1 H 1 1.291 0.027 . 1 . . . . 25 ALA QB . 17124 1
290 . 1 1 25 25 ALA HB2 H 1 1.291 0.027 . 1 . . . . 25 ALA QB . 17124 1
291 . 1 1 25 25 ALA HB3 H 1 1.291 0.027 . 1 . . . . 25 ALA QB . 17124 1
292 . 1 1 25 25 ALA CA C 13 52.639 0.15 . 1 . . . . 25 ALA CA . 17124 1
293 . 1 1 25 25 ALA CB C 13 18.870 0.15 . 1 . . . . 25 ALA CB . 17124 1
294 . 1 1 25 25 ALA N N 15 123.401 0.20 . 1 . . . . 25 ALA N . 17124 1
295 . 1 1 26 26 LEU H H 1 7.439 0.027 . 1 . . . . 26 LEU H . 17124 1
296 . 1 1 26 26 LEU HA H 1 4.943 0.027 . 1 . . . . 26 LEU HA . 17124 1
297 . 1 1 26 26 LEU HB2 H 1 1.154 0.027 . 2 . . . . 26 LEU HB2 . 17124 1
298 . 1 1 26 26 LEU HB3 H 1 1.380 0.027 . 2 . . . . 26 LEU HB3 . 17124 1
299 . 1 1 26 26 LEU HD11 H 1 0.698 0.027 . 2 . . . . 26 LEU QD1 . 17124 1
300 . 1 1 26 26 LEU HD12 H 1 0.698 0.027 . 2 . . . . 26 LEU QD1 . 17124 1
301 . 1 1 26 26 LEU HD13 H 1 0.698 0.027 . 2 . . . . 26 LEU QD1 . 17124 1
302 . 1 1 26 26 LEU HD21 H 1 0.707 0.027 . 2 . . . . 26 LEU QD2 . 17124 1
303 . 1 1 26 26 LEU HD22 H 1 0.707 0.027 . 2 . . . . 26 LEU QD2 . 17124 1
304 . 1 1 26 26 LEU HD23 H 1 0.707 0.027 . 2 . . . . 26 LEU QD2 . 17124 1
305 . 1 1 26 26 LEU HG H 1 1.475 0.027 . 1 . . . . 26 LEU HG . 17124 1
306 . 1 1 26 26 LEU CA C 13 50.871 0.15 . 1 . . . . 26 LEU CA . 17124 1
307 . 1 1 26 26 LEU CB C 13 44.331 0.15 . 1 . . . . 26 LEU CB . 17124 1
308 . 1 1 26 26 LEU CD1 C 13 24.256 0.15 . 2 . . . . 26 LEU CD1 . 17124 1
309 . 1 1 26 26 LEU CD2 C 13 26.487 0.15 . 2 . . . . 26 LEU CD2 . 17124 1
310 . 1 1 26 26 LEU CG C 13 26.705 0.15 . 1 . . . . 26 LEU CG . 17124 1
311 . 1 1 26 26 LEU N N 15 121.816 0.20 . 1 . . . . 26 LEU N . 17124 1
312 . 1 1 27 27 PRO HA H 1 4.500 0.027 . 1 . . . . 27 PRO HA . 17124 1
313 . 1 1 27 27 PRO HB2 H 1 1.913 0.027 . 2 . . . . 27 PRO HB2 . 17124 1
314 . 1 1 27 27 PRO HB3 H 1 2.521 0.027 . 2 . . . . 27 PRO HB3 . 17124 1
315 . 1 1 27 27 PRO HD2 H 1 3.585 0.027 . 2 . . . . 27 PRO HD2 . 17124 1
316 . 1 1 27 27 PRO HD3 H 1 4.026 0.027 . 2 . . . . 27 PRO HD3 . 17124 1
317 . 1 1 27 27 PRO HG2 H 1 1.903 0.027 . 2 . . . . 27 PRO HG2 . 17124 1
318 . 1 1 27 27 PRO HG3 H 1 2.045 0.027 . 2 . . . . 27 PRO HG3 . 17124 1
319 . 1 1 27 27 PRO CA C 13 62.442 0.15 . 1 . . . . 27 PRO CA . 17124 1
320 . 1 1 27 27 PRO CB C 13 32.477 0.15 . 1 . . . . 27 PRO CB . 17124 1
321 . 1 1 27 27 PRO CD C 13 50.835 0.15 . 1 . . . . 27 PRO CD . 17124 1
322 . 1 1 27 27 PRO CG C 13 27.589 0.15 . 1 . . . . 27 PRO CG . 17124 1
323 . 1 1 28 28 VAL H H 1 8.058 0.027 . 1 . . . . 28 VAL H . 17124 1
324 . 1 1 28 28 VAL HA H 1 4.519 0.027 . 1 . . . . 28 VAL HA . 17124 1
325 . 1 1 28 28 VAL HB H 1 1.867 0.027 . 1 . . . . 28 VAL HB . 17124 1
326 . 1 1 28 28 VAL HG11 H 1 0.816 0.027 . 1 . . . . 28 VAL QG1 . 17124 1
327 . 1 1 28 28 VAL HG12 H 1 0.816 0.027 . 1 . . . . 28 VAL QG1 . 17124 1
328 . 1 1 28 28 VAL HG13 H 1 0.816 0.027 . 1 . . . . 28 VAL QG1 . 17124 1
329 . 1 1 28 28 VAL HG21 H 1 0.259 0.027 . 1 . . . . 28 VAL QG2 . 17124 1
330 . 1 1 28 28 VAL HG22 H 1 0.259 0.027 . 1 . . . . 28 VAL QG2 . 17124 1
331 . 1 1 28 28 VAL HG23 H 1 0.259 0.027 . 1 . . . . 28 VAL QG2 . 17124 1
332 . 1 1 28 28 VAL CA C 13 60.690 0.15 . 1 . . . . 28 VAL CA . 17124 1
333 . 1 1 28 28 VAL CB C 13 34.712 0.15 . 1 . . . . 28 VAL CB . 17124 1
334 . 1 1 28 28 VAL CG1 C 13 21.119 0.15 . 2 . . . . 28 VAL CG1 . 17124 1
335 . 1 1 28 28 VAL CG2 C 13 21.356 0.15 . 2 . . . . 28 VAL CG2 . 17124 1
336 . 1 1 28 28 VAL N N 15 120.319 0.20 . 1 . . . . 28 VAL N . 17124 1
337 . 1 1 29 29 ALA H H 1 8.761 0.027 . 1 . . . . 29 ALA H . 17124 1
338 . 1 1 29 29 ALA HA H 1 4.199 0.027 . 1 . . . . 29 ALA HA . 17124 1
339 . 1 1 29 29 ALA HB1 H 1 0.371 0.027 . 1 . . . . 29 ALA QB . 17124 1
340 . 1 1 29 29 ALA HB2 H 1 0.371 0.027 . 1 . . . . 29 ALA QB . 17124 1
341 . 1 1 29 29 ALA HB3 H 1 0.371 0.027 . 1 . . . . 29 ALA QB . 17124 1
342 . 1 1 29 29 ALA CA C 13 50.007 0.15 . 1 . . . . 29 ALA CA . 17124 1
343 . 1 1 29 29 ALA CB C 13 19.342 0.15 . 1 . . . . 29 ALA CB . 17124 1
344 . 1 1 29 29 ALA N N 15 130.481 0.20 . 1 . . . . 29 ALA N . 17124 1
345 . 1 1 30 30 TRP H H 1 8.543 0.027 . 1 . . . . 30 TRP H . 17124 1
346 . 1 1 30 30 TRP HA H 1 4.607 0.027 . 1 . . . . 30 TRP HA . 17124 1
347 . 1 1 30 30 TRP HB2 H 1 3.269 0.027 . 2 . . . . 30 TRP HB2 . 17124 1
348 . 1 1 30 30 TRP HB3 H 1 2.888 0.027 . 2 . . . . 30 TRP HB3 . 17124 1
349 . 1 1 30 30 TRP HD1 H 1 7.122 0.027 . 1 . . . . 30 TRP HD1 . 17124 1
350 . 1 1 30 30 TRP HE1 H 1 10.167 0.027 . 1 . . . . 30 TRP HE1 . 17124 1
351 . 1 1 30 30 TRP HE3 H 1 7.636 0.027 . 1 . . . . 30 TRP HE3 . 17124 1
352 . 1 1 30 30 TRP HH2 H 1 6.878 0.027 . 1 . . . . 30 TRP HH2 . 17124 1
353 . 1 1 30 30 TRP HZ2 H 1 7.243 0.027 . 1 . . . . 30 TRP HZ2 . 17124 1
354 . 1 1 30 30 TRP HZ3 H 1 6.873 0.027 . 1 . . . . 30 TRP HZ3 . 17124 1
355 . 1 1 30 30 TRP CA C 13 56.544 0.15 . 1 . . . . 30 TRP CA . 17124 1
356 . 1 1 30 30 TRP CB C 13 30.894 0.15 . 1 . . . . 30 TRP CB . 17124 1
357 . 1 1 30 30 TRP CD1 C 13 127.352 0.15 . 1 . . . . 30 TRP CD1 . 17124 1
358 . 1 1 30 30 TRP CE3 C 13 121.294 0.15 . 1 . . . . 30 TRP CE3 . 17124 1
359 . 1 1 30 30 TRP CH2 C 13 123.268 0.15 . 1 . . . . 30 TRP CH2 . 17124 1
360 . 1 1 30 30 TRP CZ2 C 13 113.678 0.15 . 1 . . . . 30 TRP CZ2 . 17124 1
361 . 1 1 30 30 TRP CZ3 C 13 120.690 0.15 . 1 . . . . 30 TRP CZ3 . 17124 1
362 . 1 1 30 30 TRP N N 15 123.762 0.20 . 1 . . . . 30 TRP N . 17124 1
363 . 1 1 30 30 TRP NE1 N 15 129.292 0.20 . 1 . . . . 30 TRP NE1 . 17124 1
364 . 1 1 31 31 GLN H H 1 8.981 0.027 . 1 . . . . 31 GLN H . 17124 1
365 . 1 1 31 31 GLN HA H 1 3.800 0.027 . 1 . . . . 31 GLN HA . 17124 1
366 . 1 1 31 31 GLN HB2 H 1 2.145 0.027 . 2 . . . . 31 GLN QB . 17124 1
367 . 1 1 31 31 GLN HB3 H 1 2.145 0.027 . 2 . . . . 31 GLN QB . 17124 1
368 . 1 1 31 31 GLN HE21 H 1 7.669 0.027 . 2 . . . . 31 GLN HE21 . 17124 1
369 . 1 1 31 31 GLN HE22 H 1 6.950 0.027 . 2 . . . . 31 GLN HE22 . 17124 1
370 . 1 1 31 31 GLN HG2 H 1 2.392 0.027 . 2 . . . . 31 GLN QG . 17124 1
371 . 1 1 31 31 GLN HG3 H 1 2.392 0.027 . 2 . . . . 31 GLN QG . 17124 1
372 . 1 1 31 31 GLN C C 13 175.364 0.15 . 1 . . . . 31 GLN C . 17124 1
373 . 1 1 31 31 GLN CA C 13 57.235 0.15 . 1 . . . . 31 GLN CA . 17124 1
374 . 1 1 31 31 GLN CB C 13 28.440 0.15 . 1 . . . . 31 GLN CB . 17124 1
375 . 1 1 31 31 GLN CG C 13 34.095 0.15 . 1 . . . . 31 GLN CG . 17124 1
376 . 1 1 31 31 GLN N N 15 122.820 0.20 . 1 . . . . 31 GLN N . 17124 1
377 . 1 1 31 31 GLN NE2 N 15 111.584 0.20 . 1 . . . . 31 GLN NE2 . 17124 1
378 . 1 1 32 32 ASN H H 1 8.700 0.027 . 1 . . . . 32 ASN H . 17124 1
379 . 1 1 32 32 ASN HA H 1 4.693 0.027 . 1 . . . . 32 ASN HA . 17124 1
380 . 1 1 32 32 ASN HB2 H 1 2.927 0.027 . 2 . . . . 32 ASN HB2 . 17124 1
381 . 1 1 32 32 ASN HB3 H 1 2.976 0.027 . 2 . . . . 32 ASN HB3 . 17124 1
382 . 1 1 32 32 ASN HD21 H 1 6.977 0.027 . 2 . . . . 32 ASN HD21 . 17124 1
383 . 1 1 32 32 ASN HD22 H 1 7.659 0.027 . 2 . . . . 32 ASN HD22 . 17124 1
384 . 1 1 32 32 ASN C C 13 175.063 0.15 . 1 . . . . 32 ASN C . 17124 1
385 . 1 1 32 32 ASN CA C 13 53.749 0.15 . 1 . . . . 32 ASN CA . 17124 1
386 . 1 1 32 32 ASN CB C 13 37.968 0.15 . 1 . . . . 32 ASN CB . 17124 1
387 . 1 1 32 32 ASN N N 15 117.077 0.20 . 1 . . . . 32 ASN N . 17124 1
388 . 1 1 32 32 ASN ND2 N 15 113.452 0.20 . 1 . . . . 32 ASN ND2 . 17124 1
389 . 1 1 33 33 THR H H 1 7.708 0.027 . 1 . . . . 33 THR H . 17124 1
390 . 1 1 33 33 THR HA H 1 4.336 0.027 . 1 . . . . 33 THR HA . 17124 1
391 . 1 1 33 33 THR HB H 1 4.187 0.027 . 1 . . . . 33 THR HB . 17124 1
392 . 1 1 33 33 THR HG21 H 1 1.326 0.027 . 1 . . . . 33 THR QG2 . 17124 1
393 . 1 1 33 33 THR HG22 H 1 1.326 0.027 . 1 . . . . 33 THR QG2 . 17124 1
394 . 1 1 33 33 THR HG23 H 1 1.326 0.027 . 1 . . . . 33 THR QG2 . 17124 1
395 . 1 1 33 33 THR C C 13 174.307 0.15 . 1 . . . . 33 THR C . 17124 1
396 . 1 1 33 33 THR CA C 13 62.269 0.15 . 1 . . . . 33 THR CA . 17124 1
397 . 1 1 33 33 THR CB C 13 70.651 0.15 . 1 . . . . 33 THR CB . 17124 1
398 . 1 1 33 33 THR CG2 C 13 21.701 0.15 . 1 . . . . 33 THR CG2 . 17124 1
399 . 1 1 33 33 THR N N 15 113.605 0.20 . 1 . . . . 33 THR N . 17124 1
400 . 1 1 34 34 LYS H H 1 8.634 0.027 . 1 . . . . 34 LYS H . 17124 1
401 . 1 1 34 34 LYS HA H 1 4.244 0.027 . 1 . . . . 34 LYS HA . 17124 1
402 . 1 1 34 34 LYS HB2 H 1 1.754 0.027 . 2 . . . . 34 LYS QB . 17124 1
403 . 1 1 34 34 LYS HB3 H 1 1.754 0.027 . 2 . . . . 34 LYS QB . 17124 1
404 . 1 1 34 34 LYS HD2 H 1 1.622 0.027 . 2 . . . . 34 LYS QD . 17124 1
405 . 1 1 34 34 LYS HD3 H 1 1.622 0.027 . 2 . . . . 34 LYS QD . 17124 1
406 . 1 1 34 34 LYS HE2 H 1 2.921 0.027 . 2 . . . . 34 LYS QE . 17124 1
407 . 1 1 34 34 LYS HE3 H 1 2.921 0.027 . 2 . . . . 34 LYS QE . 17124 1
408 . 1 1 34 34 LYS HG2 H 1 1.430 0.027 . 2 . . . . 34 LYS HG2 . 17124 1
409 . 1 1 34 34 LYS HG3 H 1 1.340 0.027 . 2 . . . . 34 LYS HG3 . 17124 1
410 . 1 1 34 34 LYS C C 13 175.732 0.15 . 1 . . . . 34 LYS C . 17124 1
411 . 1 1 34 34 LYS CA C 13 57.038 0.15 . 1 . . . . 34 LYS CA . 17124 1
412 . 1 1 34 34 LYS CB C 13 31.929 0.15 . 1 . . . . 34 LYS CB . 17124 1
413 . 1 1 34 34 LYS CD C 13 29.069 0.15 . 1 . . . . 34 LYS CD . 17124 1
414 . 1 1 34 34 LYS CE C 13 42.117 0.15 . 1 . . . . 34 LYS CE . 17124 1
415 . 1 1 34 34 LYS CG C 13 24.674 0.15 . 1 . . . . 34 LYS CG . 17124 1
416 . 1 1 34 34 LYS N N 15 125.945 0.20 . 1 . . . . 34 LYS N . 17124 1
417 . 1 1 35 35 PHE H H 1 8.368 0.027 . 1 . . . . 35 PHE H . 17124 1
418 . 1 1 35 35 PHE HA H 1 4.649 0.027 . 1 . . . . 35 PHE HA . 17124 1
419 . 1 1 35 35 PHE HB2 H 1 3.048 0.027 . 2 . . . . 35 PHE HB2 . 17124 1
420 . 1 1 35 35 PHE HB3 H 1 2.640 0.027 . 2 . . . . 35 PHE HB3 . 17124 1
421 . 1 1 35 35 PHE HD1 H 1 6.934 0.027 . 3 . . . . 35 PHE QD . 17124 1
422 . 1 1 35 35 PHE HD2 H 1 6.934 0.027 . 3 . . . . 35 PHE QD . 17124 1
423 . 1 1 35 35 PHE HE1 H 1 6.677 0.027 . 3 . . . . 35 PHE QE . 17124 1
424 . 1 1 35 35 PHE HE2 H 1 6.677 0.027 . 3 . . . . 35 PHE QE . 17124 1
425 . 1 1 35 35 PHE C C 13 173.928 0.15 . 1 . . . . 35 PHE C . 17124 1
426 . 1 1 35 35 PHE CA C 13 57.441 0.15 . 1 . . . . 35 PHE CA . 17124 1
427 . 1 1 35 35 PHE CB C 13 42.224 0.15 . 1 . . . . 35 PHE CB . 17124 1
428 . 1 1 35 35 PHE CD1 C 13 131.543 0.15 . 3 . . . . 35 PHE CD1 . 17124 1
429 . 1 1 35 35 PHE CD2 C 13 131.540 0.15 . 3 . . . . 35 PHE CD2 . 17124 1
430 . 1 1 35 35 PHE CE1 C 13 130.947 0.15 . 3 . . . . 35 PHE CE1 . 17124 1
431 . 1 1 35 35 PHE CE2 C 13 130.950 0.15 . 3 . . . . 35 PHE CE2 . 17124 1
432 . 1 1 35 35 PHE N N 15 126.051 0.20 . 1 . . . . 35 PHE N . 17124 1
433 . 1 1 36 36 THR H H 1 7.864 0.027 . 1 . . . . 36 THR H . 17124 1
434 . 1 1 36 36 THR HA H 1 4.329 0.027 . 1 . . . . 36 THR HA . 17124 1
435 . 1 1 36 36 THR HB H 1 3.604 0.027 . 1 . . . . 36 THR HB . 17124 1
436 . 1 1 36 36 THR HG21 H 1 0.970 0.027 . 1 . . . . 36 THR QG2 . 17124 1
437 . 1 1 36 36 THR HG22 H 1 0.970 0.027 . 1 . . . . 36 THR QG2 . 17124 1
438 . 1 1 36 36 THR HG23 H 1 0.970 0.027 . 1 . . . . 36 THR QG2 . 17124 1
439 . 1 1 36 36 THR CA C 13 58.689 0.15 . 1 . . . . 36 THR CA . 17124 1
440 . 1 1 36 36 THR CB C 13 69.890 0.15 . 1 . . . . 36 THR CB . 17124 1
441 . 1 1 36 36 THR CG2 C 13 20.939 0.15 . 1 . . . . 36 THR CG2 . 17124 1
442 . 1 1 36 36 THR N N 15 125.471 0.20 . 1 . . . . 36 THR N . 17124 1
443 . 1 1 37 37 PRO HB2 H 1 2.304 0.027 . 2 . . . . 37 PRO QB . 17124 1
444 . 1 1 37 37 PRO HB3 H 1 2.304 0.027 . 2 . . . . 37 PRO QB . 17124 1
445 . 1 1 37 37 PRO HD2 H 1 3.458 0.027 . 2 . . . . 37 PRO HD2 . 17124 1
446 . 1 1 37 37 PRO HD3 H 1 3.342 0.027 . 2 . . . . 37 PRO HD3 . 17124 1
447 . 1 1 37 37 PRO HG2 H 1 1.908 0.027 . 2 . . . . 37 PRO HG2 . 17124 1
448 . 1 1 37 37 PRO HG3 H 1 1.699 0.027 . 2 . . . . 37 PRO HG3 . 17124 1
449 . 1 1 37 37 PRO CB C 13 34.221 0.15 . 1 . . . . 37 PRO CB . 17124 1
450 . 1 1 37 37 PRO CD C 13 49.400 0.15 . 1 . . . . 37 PRO CD . 17124 1
451 . 1 1 37 37 PRO CG C 13 24.835 0.15 . 1 . . . . 37 PRO CG . 17124 1
452 . 1 1 38 38 PRO HA H 1 4.293 0.027 . 1 . . . . 38 PRO HA . 17124 1
453 . 1 1 38 38 PRO HB2 H 1 2.165 0.027 . 2 . . . . 38 PRO HB2 . 17124 1
454 . 1 1 38 38 PRO HD2 H 1 3.329 0.027 . 2 . . . . 38 PRO HD2 . 17124 1
455 . 1 1 38 38 PRO HD3 H 1 3.264 0.027 . 2 . . . . 38 PRO HD3 . 17124 1
456 . 1 1 38 38 PRO HG2 H 1 1.837 0.027 . 2 . . . . 38 PRO HG2 . 17124 1
457 . 1 1 38 38 PRO C C 13 176.522 0.15 . 1 . . . . 38 PRO C . 17124 1
458 . 1 1 38 38 PRO CA C 13 61.879 0.15 . 1 . . . . 38 PRO CA . 17124 1
459 . 1 1 38 38 PRO CB C 13 31.780 0.15 . 1 . . . . 38 PRO CB . 17124 1
460 . 1 1 38 38 PRO CD C 13 49.397 0.15 . 1 . . . . 38 PRO CD . 17124 1
461 . 1 1 38 38 PRO CG C 13 27.037 0.15 . 1 . . . . 38 PRO CG . 17124 1
462 . 1 1 39 39 ALA H H 1 8.384 0.027 . 1 . . . . 39 ALA H . 17124 1
463 . 1 1 39 39 ALA HA H 1 4.024 0.027 . 1 . . . . 39 ALA HA . 17124 1
464 . 1 1 39 39 ALA HB1 H 1 1.316 0.027 . 1 . . . . 39 ALA QB . 17124 1
465 . 1 1 39 39 ALA HB2 H 1 1.316 0.027 . 1 . . . . 39 ALA QB . 17124 1
466 . 1 1 39 39 ALA HB3 H 1 1.316 0.027 . 1 . . . . 39 ALA QB . 17124 1
467 . 1 1 39 39 ALA C C 13 177.330 0.15 . 1 . . . . 39 ALA C . 17124 1
468 . 1 1 39 39 ALA CA C 13 53.533 0.15 . 1 . . . . 39 ALA CA . 17124 1
469 . 1 1 39 39 ALA CB C 13 18.621 0.15 . 1 . . . . 39 ALA CB . 17124 1
470 . 1 1 39 39 ALA N N 15 123.843 0.20 . 1 . . . . 39 ALA N . 17124 1
471 . 1 1 40 40 ALA H H 1 7.963 0.027 . 1 . . . . 40 ALA H . 17124 1
472 . 1 1 40 40 ALA HA H 1 4.413 0.027 . 1 . . . . 40 ALA HA . 17124 1
473 . 1 1 40 40 ALA HB1 H 1 1.314 0.027 . 1 . . . . 40 ALA QB . 17124 1
474 . 1 1 40 40 ALA HB2 H 1 1.314 0.027 . 1 . . . . 40 ALA QB . 17124 1
475 . 1 1 40 40 ALA HB3 H 1 1.314 0.027 . 1 . . . . 40 ALA QB . 17124 1
476 . 1 1 40 40 ALA C C 13 177.069 0.15 . 1 . . . . 40 ALA C . 17124 1
477 . 1 1 40 40 ALA CA C 13 51.561 0.15 . 1 . . . . 40 ALA CA . 17124 1
478 . 1 1 40 40 ALA CB C 13 20.339 0.15 . 1 . . . . 40 ALA CB . 17124 1
479 . 1 1 40 40 ALA N N 15 118.737 0.20 . 1 . . . . 40 ALA N . 17124 1
480 . 1 1 41 41 GLY H H 1 8.049 0.027 . 1 . . . . 41 GLY H . 17124 1
481 . 1 1 41 41 GLY HA2 H 1 4.060 0.027 . 2 . . . . 41 GLY HA2 . 17124 1
482 . 1 1 41 41 GLY HA3 H 1 4.022 0.027 . 2 . . . . 41 GLY HA3 . 17124 1
483 . 1 1 41 41 GLY C C 13 172.400 0.15 . 1 . . . . 41 GLY C . 17124 1
484 . 1 1 41 41 GLY CA C 13 44.689 0.15 . 1 . . . . 41 GLY CA . 17124 1
485 . 1 1 41 41 GLY N N 15 106.289 0.20 . 1 . . . . 41 GLY N . 17124 1
486 . 1 1 42 42 VAL H H 1 7.899 0.027 . 1 . . . . 42 VAL H . 17124 1
487 . 1 1 42 42 VAL HA H 1 4.631 0.027 . 1 . . . . 42 VAL HA . 17124 1
488 . 1 1 42 42 VAL HB H 1 1.852 0.027 . 1 . . . . 42 VAL HB . 17124 1
489 . 1 1 42 42 VAL HG11 H 1 0.958 0.027 . 1 . . . . 42 VAL QG1 . 17124 1
490 . 1 1 42 42 VAL HG12 H 1 0.958 0.027 . 1 . . . . 42 VAL QG1 . 17124 1
491 . 1 1 42 42 VAL HG13 H 1 0.958 0.027 . 1 . . . . 42 VAL QG1 . 17124 1
492 . 1 1 42 42 VAL HG21 H 1 0.783 0.027 . 1 . . . . 42 VAL QG2 . 17124 1
493 . 1 1 42 42 VAL HG22 H 1 0.783 0.027 . 1 . . . . 42 VAL QG2 . 17124 1
494 . 1 1 42 42 VAL HG23 H 1 0.783 0.027 . 1 . . . . 42 VAL QG2 . 17124 1
495 . 1 1 42 42 VAL C C 13 175.456 0.15 . 1 . . . . 42 VAL C . 17124 1
496 . 1 1 42 42 VAL CA C 13 61.657 0.15 . 1 . . . . 42 VAL CA . 17124 1
497 . 1 1 42 42 VAL CB C 13 32.916 0.15 . 1 . . . . 42 VAL CB . 17124 1
498 . 1 1 42 42 VAL CG1 C 13 22.571 0.15 . 2 . . . . 42 VAL CG1 . 17124 1
499 . 1 1 42 42 VAL CG2 C 13 21.533 0.15 . 2 . . . . 42 VAL CG2 . 17124 1
500 . 1 1 42 42 VAL N N 15 119.332 0.20 . 1 . . . . 42 VAL N . 17124 1
501 . 1 1 43 43 TYR H H 1 8.412 0.027 . 1 . . . . 43 TYR H . 17124 1
502 . 1 1 43 43 TYR HA H 1 4.867 0.027 . 1 . . . . 43 TYR HA . 17124 1
503 . 1 1 43 43 TYR HB2 H 1 2.944 0.027 . 2 . . . . 43 TYR HB2 . 17124 1
504 . 1 1 43 43 TYR HB3 H 1 3.040 0.027 . 2 . . . . 43 TYR HB3 . 17124 1
505 . 1 1 43 43 TYR HD1 H 1 6.872 0.027 . 3 . . . . 43 TYR QD . 17124 1
506 . 1 1 43 43 TYR HD2 H 1 6.872 0.027 . 3 . . . . 43 TYR QD . 17124 1
507 . 1 1 43 43 TYR HE1 H 1 6.609 0.027 . 3 . . . . 43 TYR QE . 17124 1
508 . 1 1 43 43 TYR HE2 H 1 6.609 0.027 . 3 . . . . 43 TYR QE . 17124 1
509 . 1 1 43 43 TYR C C 13 171.017 0.15 . 1 . . . . 43 TYR C . 17124 1
510 . 1 1 43 43 TYR CA C 13 56.162 0.15 . 1 . . . . 43 TYR CA . 17124 1
511 . 1 1 43 43 TYR CB C 13 40.671 0.15 . 1 . . . . 43 TYR CB . 17124 1
512 . 1 1 43 43 TYR CD1 C 13 134.278 0.15 . 3 . . . . 43 TYR CD1 . 17124 1
513 . 1 1 43 43 TYR CD2 C 13 134.280 0.15 . 3 . . . . 43 TYR CD2 . 17124 1
514 . 1 1 43 43 TYR CE1 C 13 117.799 0.15 . 3 . . . . 43 TYR CE1 . 17124 1
515 . 1 1 43 43 TYR CE2 C 13 117.800 0.15 . 3 . . . . 43 TYR CE2 . 17124 1
516 . 1 1 43 43 TYR N N 15 119.313 0.20 . 1 . . . . 43 TYR N . 17124 1
517 . 1 1 44 44 LEU H H 1 8.455 0.027 . 1 . . . . 44 LEU H . 17124 1
518 . 1 1 44 44 LEU HA H 1 5.420 0.027 . 1 . . . . 44 LEU HA . 17124 1
519 . 1 1 44 44 LEU HB2 H 1 1.760 0.027 . 2 . . . . 44 LEU HB2 . 17124 1
520 . 1 1 44 44 LEU HB3 H 1 1.067 0.027 . 2 . . . . 44 LEU HB3 . 17124 1
521 . 1 1 44 44 LEU HD11 H 1 0.807 0.027 . 1 . . . . 44 LEU QD1 . 17124 1
522 . 1 1 44 44 LEU HD12 H 1 0.807 0.027 . 1 . . . . 44 LEU QD1 . 17124 1
523 . 1 1 44 44 LEU HD13 H 1 0.807 0.027 . 1 . . . . 44 LEU QD1 . 17124 1
524 . 1 1 44 44 LEU HD21 H 1 0.974 0.027 . 1 . . . . 44 LEU QD2 . 17124 1
525 . 1 1 44 44 LEU HD22 H 1 0.974 0.027 . 1 . . . . 44 LEU QD2 . 17124 1
526 . 1 1 44 44 LEU HD23 H 1 0.974 0.027 . 1 . . . . 44 LEU QD2 . 17124 1
527 . 1 1 44 44 LEU HG H 1 1.624 0.027 . 1 . . . . 44 LEU HG . 17124 1
528 . 1 1 44 44 LEU C C 13 176.000 0.15 . 1 . . . . 44 LEU C . 17124 1
529 . 1 1 44 44 LEU CA C 13 52.258 0.15 . 1 . . . . 44 LEU CA . 17124 1
530 . 1 1 44 44 LEU CB C 13 44.334 0.15 . 1 . . . . 44 LEU CB . 17124 1
531 . 1 1 44 44 LEU CD1 C 13 24.910 0.15 . 2 . . . . 44 LEU CD1 . 17124 1
532 . 1 1 44 44 LEU CD2 C 13 25.754 0.15 . 2 . . . . 44 LEU CD2 . 17124 1
533 . 1 1 44 44 LEU CG C 13 27.384 0.15 . 1 . . . . 44 LEU CG . 17124 1
534 . 1 1 44 44 LEU N N 15 116.540 0.20 . 1 . . . . 44 LEU N . 17124 1
535 . 1 1 45 45 ARG H H 1 8.585 0.027 . 1 . . . . 45 ARG H . 17124 1
536 . 1 1 45 45 ARG HA H 1 4.872 0.027 . 1 . . . . 45 ARG HA . 17124 1
537 . 1 1 45 45 ARG HB2 H 1 1.439 0.027 . 2 . . . . 45 ARG HB2 . 17124 1
538 . 1 1 45 45 ARG HB3 H 1 1.574 0.027 . 2 . . . . 45 ARG HB3 . 17124 1
539 . 1 1 45 45 ARG HD2 H 1 3.151 0.027 . 2 . . . . 45 ARG QD . 17124 1
540 . 1 1 45 45 ARG HD3 H 1 3.151 0.027 . 2 . . . . 45 ARG QD . 17124 1
541 . 1 1 45 45 ARG HG2 H 1 1.259 0.027 . 2 . . . . 45 ARG HG2 . 17124 1
542 . 1 1 45 45 ARG HG3 H 1 1.353 0.027 . 2 . . . . 45 ARG HG3 . 17124 1
543 . 1 1 45 45 ARG C C 13 173.994 0.15 . 1 . . . . 45 ARG C . 17124 1
544 . 1 1 45 45 ARG CA C 13 54.626 0.15 . 1 . . . . 45 ARG CA . 17124 1
545 . 1 1 45 45 ARG CB C 13 32.588 0.15 . 1 . . . . 45 ARG CB . 17124 1
546 . 1 1 45 45 ARG CD C 13 43.371 0.15 . 1 . . . . 45 ARG CD . 17124 1
547 . 1 1 45 45 ARG CG C 13 27.781 0.15 . 1 . . . . 45 ARG CG . 17124 1
548 . 1 1 45 45 ARG N N 15 120.583 0.20 . 1 . . . . 45 ARG N . 17124 1
549 . 1 1 46 46 ALA H H 1 7.705 0.027 . 1 . . . . 46 ALA H . 17124 1
550 . 1 1 46 46 ALA HA H 1 4.838 0.027 . 1 . . . . 46 ALA HA . 17124 1
551 . 1 1 46 46 ALA HB1 H 1 0.056 0.027 . 1 . . . . 46 ALA QB . 17124 1
552 . 1 1 46 46 ALA HB2 H 1 0.056 0.027 . 1 . . . . 46 ALA QB . 17124 1
553 . 1 1 46 46 ALA HB3 H 1 0.056 0.027 . 1 . . . . 46 ALA QB . 17124 1
554 . 1 1 46 46 ALA C C 13 174.957 0.15 . 1 . . . . 46 ALA C . 17124 1
555 . 1 1 46 46 ALA CA C 13 50.100 0.15 . 1 . . . . 46 ALA CA . 17124 1
556 . 1 1 46 46 ALA CB C 13 21.290 0.15 . 1 . . . . 46 ALA CB . 17124 1
557 . 1 1 46 46 ALA N N 15 127.507 0.20 . 1 . . . . 46 ALA N . 17124 1
558 . 1 1 47 47 TYR H H 1 8.798 0.027 . 1 . . . . 47 TYR H . 17124 1
559 . 1 1 47 47 TYR HA H 1 4.632 0.027 . 1 . . . . 47 TYR HA . 17124 1
560 . 1 1 47 47 TYR HB2 H 1 2.547 0.027 . 2 . . . . 47 TYR HB2 . 17124 1
561 . 1 1 47 47 TYR HB3 H 1 2.818 0.027 . 2 . . . . 47 TYR HB3 . 17124 1
562 . 1 1 47 47 TYR HD1 H 1 6.768 0.027 . 3 . . . . 47 TYR QD . 17124 1
563 . 1 1 47 47 TYR HD2 H 1 6.768 0.027 . 3 . . . . 47 TYR QD . 17124 1
564 . 1 1 47 47 TYR HE1 H 1 6.478 0.027 . 3 . . . . 47 TYR QE . 17124 1
565 . 1 1 47 47 TYR HE2 H 1 6.478 0.027 . 3 . . . . 47 TYR QE . 17124 1
566 . 1 1 47 47 TYR C C 13 174.330 0.15 . 1 . . . . 47 TYR C . 17124 1
567 . 1 1 47 47 TYR CA C 13 56.883 0.15 . 1 . . . . 47 TYR CA . 17124 1
568 . 1 1 47 47 TYR CB C 13 42.286 0.15 . 1 . . . . 47 TYR CB . 17124 1
569 . 1 1 47 47 TYR CD1 C 13 133.151 0.15 . 3 . . . . 47 TYR CD1 . 17124 1
570 . 1 1 47 47 TYR CD2 C 13 133.155 0.15 . 3 . . . . 47 TYR CD2 . 17124 1
571 . 1 1 47 47 TYR CE1 C 13 117.848 0.15 . 3 . . . . 47 TYR CE1 . 17124 1
572 . 1 1 47 47 TYR CE2 C 13 117.848 0.15 . 3 . . . . 47 TYR CE2 . 17124 1
573 . 1 1 47 47 TYR N N 15 117.713 0.20 . 1 . . . . 47 TYR N . 17124 1
574 . 1 1 48 48 VAL H H 1 8.920 0.027 . 1 . . . . 48 VAL H . 17124 1
575 . 1 1 48 48 VAL HA H 1 4.549 0.027 . 1 . . . . 48 VAL HA . 17124 1
576 . 1 1 48 48 VAL HB H 1 2.193 0.027 . 1 . . . . 48 VAL HB . 17124 1
577 . 1 1 48 48 VAL HG11 H 1 1.077 0.027 . 1 . . . . 48 VAL QG1 . 17124 1
578 . 1 1 48 48 VAL HG12 H 1 1.077 0.027 . 1 . . . . 48 VAL QG1 . 17124 1
579 . 1 1 48 48 VAL HG13 H 1 1.077 0.027 . 1 . . . . 48 VAL QG1 . 17124 1
580 . 1 1 48 48 VAL HG21 H 1 0.870 0.027 . 1 . . . . 48 VAL QG2 . 17124 1
581 . 1 1 48 48 VAL HG22 H 1 0.870 0.027 . 1 . . . . 48 VAL QG2 . 17124 1
582 . 1 1 48 48 VAL HG23 H 1 0.870 0.027 . 1 . . . . 48 VAL QG2 . 17124 1
583 . 1 1 48 48 VAL C C 13 175.620 0.15 . 1 . . . . 48 VAL C . 17124 1
584 . 1 1 48 48 VAL CA C 13 62.110 0.15 . 1 . . . . 48 VAL CA . 17124 1
585 . 1 1 48 48 VAL CB C 13 32.772 0.15 . 1 . . . . 48 VAL CB . 17124 1
586 . 1 1 48 48 VAL CG1 C 13 22.116 0.15 . 2 . . . . 48 VAL CG1 . 17124 1
587 . 1 1 48 48 VAL CG2 C 13 22.247 0.15 . 2 . . . . 48 VAL CG2 . 17124 1
588 . 1 1 48 48 VAL N N 15 122.127 0.20 . 1 . . . . 48 VAL N . 17124 1
589 . 1 1 49 49 MET H H 1 9.084 0.027 . 1 . . . . 49 MET H . 17124 1
590 . 1 1 49 49 MET HA H 1 4.966 0.027 . 1 . . . . 49 MET HA . 17124 1
591 . 1 1 49 49 MET HB2 H 1 2.382 0.027 . 2 . . . . 49 MET HB2 . 17124 1
592 . 1 1 49 49 MET HB3 H 1 2.335 0.027 . 2 . . . . 49 MET HB3 . 17124 1
593 . 1 1 49 49 MET HE1 H 1 1.806 0.027 . 1 . . . . 49 MET QE . 17124 1
594 . 1 1 49 49 MET HE2 H 1 1.806 0.027 . 1 . . . . 49 MET QE . 17124 1
595 . 1 1 49 49 MET HE3 H 1 1.806 0.027 . 1 . . . . 49 MET QE . 17124 1
596 . 1 1 49 49 MET HG2 H 1 1.992 0.027 . 2 . . . . 49 MET HG2 . 17124 1
597 . 1 1 49 49 MET HG3 H 1 2.128 0.027 . 2 . . . . 49 MET HG3 . 17124 1
598 . 1 1 49 49 MET CA C 13 52.762 0.15 . 1 . . . . 49 MET CA . 17124 1
599 . 1 1 49 49 MET CB C 13 31.914 0.15 . 1 . . . . 49 MET CB . 17124 1
600 . 1 1 49 49 MET CE C 13 17.158 0.15 . 1 . . . . 49 MET CE . 17124 1
601 . 1 1 49 49 MET CG C 13 32.892 0.15 . 1 . . . . 49 MET CG . 17124 1
602 . 1 1 49 49 MET N N 15 127.147 0.20 . 1 . . . . 49 MET N . 17124 1
603 . 1 1 50 50 PRO HA H 1 4.551 0.027 . 1 . . . . 50 PRO HA . 17124 1
604 . 1 1 50 50 PRO HB2 H 1 2.365 0.027 . 2 . . . . 50 PRO HB2 . 17124 1
605 . 1 1 50 50 PRO HB3 H 1 2.182 0.027 . 2 . . . . 50 PRO HB3 . 17124 1
606 . 1 1 50 50 PRO HD2 H 1 3.824 0.027 . 2 . . . . 50 PRO HD2 . 17124 1
607 . 1 1 50 50 PRO HD3 H 1 3.774 0.027 . 2 . . . . 50 PRO HD3 . 17124 1
608 . 1 1 50 50 PRO HG2 H 1 1.952 0.027 . 2 . . . . 50 PRO HG2 . 17124 1
609 . 1 1 50 50 PRO HG3 H 1 2.060 0.027 . 2 . . . . 50 PRO HG3 . 17124 1
610 . 1 1 50 50 PRO C C 13 176.453 0.15 . 1 . . . . 50 PRO C . 17124 1
611 . 1 1 50 50 PRO CA C 13 62.880 0.15 . 1 . . . . 50 PRO CA . 17124 1
612 . 1 1 50 50 PRO CB C 13 32.387 0.15 . 1 . . . . 50 PRO CB . 17124 1
613 . 1 1 50 50 PRO CD C 13 50.994 0.15 . 1 . . . . 50 PRO CD . 17124 1
614 . 1 1 50 50 PRO CG C 13 27.311 0.15 . 1 . . . . 50 PRO CG . 17124 1
615 . 1 1 51 51 ALA H H 1 8.516 0.027 . 1 . . . . 51 ALA H . 17124 1
616 . 1 1 51 51 ALA HA H 1 4.324 0.027 . 1 . . . . 51 ALA HA . 17124 1
617 . 1 1 51 51 ALA HB1 H 1 1.230 0.027 . 1 . . . . 51 ALA QB . 17124 1
618 . 1 1 51 51 ALA HB2 H 1 1.230 0.027 . 1 . . . . 51 ALA QB . 17124 1
619 . 1 1 51 51 ALA HB3 H 1 1.230 0.027 . 1 . . . . 51 ALA QB . 17124 1
620 . 1 1 51 51 ALA C C 13 177.206 0.15 . 1 . . . . 51 ALA C . 17124 1
621 . 1 1 51 51 ALA CA C 13 51.807 0.15 . 1 . . . . 51 ALA CA . 17124 1
622 . 1 1 51 51 ALA CB C 13 19.490 0.15 . 1 . . . . 51 ALA CB . 17124 1
623 . 1 1 51 51 ALA N N 15 125.667 0.20 . 1 . . . . 51 ALA N . 17124 1
624 . 1 1 52 52 ALA H H 1 8.364 0.027 . 1 . . . . 52 ALA H . 17124 1
625 . 1 1 52 52 ALA HA H 1 4.410 0.027 . 1 . . . . 52 ALA HA . 17124 1
626 . 1 1 52 52 ALA HB1 H 1 1.335 0.027 . 1 . . . . 52 ALA QB . 17124 1
627 . 1 1 52 52 ALA HB2 H 1 1.335 0.027 . 1 . . . . 52 ALA QB . 17124 1
628 . 1 1 52 52 ALA HB3 H 1 1.335 0.027 . 1 . . . . 52 ALA QB . 17124 1
629 . 1 1 52 52 ALA C C 13 177.518 0.15 . 1 . . . . 52 ALA C . 17124 1
630 . 1 1 52 52 ALA CA C 13 52.129 0.15 . 1 . . . . 52 ALA CA . 17124 1
631 . 1 1 52 52 ALA CB C 13 20.066 0.15 . 1 . . . . 52 ALA CB . 17124 1
632 . 1 1 52 52 ALA N N 15 123.686 0.20 . 1 . . . . 52 ALA N . 17124 1
633 . 1 1 53 53 THR H H 1 8.161 0.027 . 1 . . . . 53 THR H . 17124 1
634 . 1 1 53 53 THR HA H 1 4.309 0.027 . 1 . . . . 53 THR HA . 17124 1
635 . 1 1 53 53 THR HB H 1 3.991 0.027 . 1 . . . . 53 THR HB . 17124 1
636 . 1 1 53 53 THR HG21 H 1 1.024 0.027 . 1 . . . . 53 THR QG2 . 17124 1
637 . 1 1 53 53 THR HG22 H 1 1.024 0.027 . 1 . . . . 53 THR QG2 . 17124 1
638 . 1 1 53 53 THR HG23 H 1 1.024 0.027 . 1 . . . . 53 THR QG2 . 17124 1
639 . 1 1 53 53 THR C C 13 174.417 0.15 . 1 . . . . 53 THR C . 17124 1
640 . 1 1 53 53 THR CA C 13 61.536 0.15 . 1 . . . . 53 THR CA . 17124 1
641 . 1 1 53 53 THR CB C 13 69.882 0.15 . 1 . . . . 53 THR CB . 17124 1
642 . 1 1 53 53 THR CG2 C 13 21.505 0.15 . 1 . . . . 53 THR CG2 . 17124 1
643 . 1 1 53 53 THR N N 15 114.415 0.20 . 1 . . . . 53 THR N . 17124 1
644 . 1 1 54 54 ILE H H 1 8.182 0.027 . 1 . . . . 54 ILE H . 17124 1
645 . 1 1 54 54 ILE HA H 1 4.208 0.027 . 1 . . . . 54 ILE HA . 17124 1
646 . 1 1 54 54 ILE HB H 1 1.770 0.027 . 1 . . . . 54 ILE HB . 17124 1
647 . 1 1 54 54 ILE HD11 H 1 0.699 0.027 . 1 . . . . 54 ILE QD1 . 17124 1
648 . 1 1 54 54 ILE HD12 H 1 0.699 0.027 . 1 . . . . 54 ILE QD1 . 17124 1
649 . 1 1 54 54 ILE HD13 H 1 0.699 0.027 . 1 . . . . 54 ILE QD1 . 17124 1
650 . 1 1 54 54 ILE HG12 H 1 1.328 0.027 . 2 . . . . 54 ILE HG12 . 17124 1
651 . 1 1 54 54 ILE HG13 H 1 1.014 0.027 . 2 . . . . 54 ILE HG13 . 17124 1
652 . 1 1 54 54 ILE HG21 H 1 1.332 0.027 . 1 . . . . 54 ILE QG2 . 17124 1
653 . 1 1 54 54 ILE HG22 H 1 1.332 0.027 . 1 . . . . 54 ILE QG2 . 17124 1
654 . 1 1 54 54 ILE HG23 H 1 1.332 0.027 . 1 . . . . 54 ILE QG2 . 17124 1
655 . 1 1 54 54 ILE C C 13 175.951 0.15 . 1 . . . . 54 ILE C . 17124 1
656 . 1 1 54 54 ILE CA C 13 60.771 0.15 . 1 . . . . 54 ILE CA . 17124 1
657 . 1 1 54 54 ILE CB C 13 38.976 0.15 . 1 . . . . 54 ILE CB . 17124 1
658 . 1 1 54 54 ILE CD1 C 13 12.954 0.15 . 1 . . . . 54 ILE CD1 . 17124 1
659 . 1 1 54 54 ILE CG1 C 13 27.068 0.15 . 1 . . . . 54 ILE CG1 . 17124 1
660 . 1 1 54 54 ILE CG2 C 13 18.993 0.15 . 1 . . . . 54 ILE CG2 . 17124 1
661 . 1 1 54 54 ILE N N 15 122.920 0.20 . 1 . . . . 54 ILE N . 17124 1
662 . 1 1 55 55 SER H H 1 8.282 0.027 . 1 . . . . 55 SER H . 17124 1
663 . 1 1 55 55 SER HA H 1 4.416 0.027 . 1 . . . . 55 SER HA . 17124 1
664 . 1 1 55 55 SER HB2 H 1 3.805 0.027 . 2 . . . . 55 SER HB2 . 17124 1
665 . 1 1 55 55 SER HB3 H 1 3.752 0.027 . 2 . . . . 55 SER HB3 . 17124 1
666 . 1 1 55 55 SER C C 13 174.511 0.15 . 1 . . . . 55 SER C . 17124 1
667 . 1 1 55 55 SER CA C 13 57.986 0.15 . 1 . . . . 55 SER CA . 17124 1
668 . 1 1 55 55 SER CB C 13 63.916 0.15 . 1 . . . . 55 SER CB . 17124 1
669 . 1 1 55 55 SER N N 15 119.593 0.20 . 1 . . . . 55 SER N . 17124 1
670 . 1 1 56 56 ARG H H 1 8.450 0.027 . 1 . . . . 56 ARG H . 17124 1
671 . 1 1 56 56 ARG HA H 1 4.268 0.027 . 1 . . . . 56 ARG HA . 17124 1
672 . 1 1 56 56 ARG HB2 H 1 1.691 0.027 . 2 . . . . 56 ARG HB2 . 17124 1
673 . 1 1 56 56 ARG HB3 H 1 1.779 0.027 . 2 . . . . 56 ARG HB3 . 17124 1
674 . 1 1 56 56 ARG HD2 H 1 3.096 0.027 . 2 . . . . 56 ARG QD . 17124 1
675 . 1 1 56 56 ARG HD3 H 1 3.096 0.027 . 2 . . . . 56 ARG QD . 17124 1
676 . 1 1 56 56 ARG HG2 H 1 1.535 0.027 . 2 . . . . 56 ARG HG2 . 17124 1
677 . 1 1 56 56 ARG HG3 H 1 1.617 0.027 . 2 . . . . 56 ARG HG3 . 17124 1
678 . 1 1 56 56 ARG C C 13 176.038 0.15 . 1 . . . . 56 ARG C . 17124 1
679 . 1 1 56 56 ARG CA C 13 56.630 0.15 . 1 . . . . 56 ARG CA . 17124 1
680 . 1 1 56 56 ARG CB C 13 30.683 0.15 . 1 . . . . 56 ARG CB . 17124 1
681 . 1 1 56 56 ARG CD C 13 43.355 0.15 . 1 . . . . 56 ARG CD . 17124 1
682 . 1 1 56 56 ARG CG C 13 27.011 0.15 . 1 . . . . 56 ARG CG . 17124 1
683 . 1 1 56 56 ARG N N 15 123.077 0.20 . 1 . . . . 56 ARG N . 17124 1
684 . 1 1 57 57 ASP H H 1 8.229 0.027 . 1 . . . . 57 ASP H . 17124 1
685 . 1 1 57 57 ASP HA H 1 4.523 0.027 . 1 . . . . 57 ASP HA . 17124 1
686 . 1 1 57 57 ASP HB2 H 1 2.642 0.027 . 2 . . . . 57 ASP HB2 . 17124 1
687 . 1 1 57 57 ASP HB3 H 1 2.732 0.027 . 2 . . . . 57 ASP HB3 . 17124 1
688 . 1 1 57 57 ASP C C 13 176.125 0.15 . 1 . . . . 57 ASP C . 17124 1
689 . 1 1 57 57 ASP CA C 13 54.151 0.15 . 1 . . . . 57 ASP CA . 17124 1
690 . 1 1 57 57 ASP CB C 13 41.062 0.15 . 1 . . . . 57 ASP CB . 17124 1
691 . 1 1 57 57 ASP N N 15 120.297 0.20 . 1 . . . . 57 ASP N . 17124 1
692 . 1 1 58 58 ALA H H 1 8.062 0.027 . 1 . . . . 58 ALA H . 17124 1
693 . 1 1 58 58 ALA HA H 1 4.193 0.027 . 1 . . . . 58 ALA HA . 17124 1
694 . 1 1 58 58 ALA HB1 H 1 1.328 0.027 . 1 . . . . 58 ALA QB . 17124 1
695 . 1 1 58 58 ALA HB2 H 1 1.328 0.027 . 1 . . . . 58 ALA QB . 17124 1
696 . 1 1 58 58 ALA HB3 H 1 1.328 0.027 . 1 . . . . 58 ALA QB . 17124 1
697 . 1 1 58 58 ALA C C 13 177.651 0.15 . 1 . . . . 58 ALA C . 17124 1
698 . 1 1 58 58 ALA CA C 13 52.911 0.15 . 1 . . . . 58 ALA CA . 17124 1
699 . 1 1 58 58 ALA CB C 13 18.954 0.15 . 1 . . . . 58 ALA CB . 17124 1
700 . 1 1 58 58 ALA N N 15 123.700 0.20 . 1 . . . . 58 ALA N . 17124 1
701 . 1 1 59 59 ALA H H 1 8.145 0.027 . 1 . . . . 59 ALA H . 17124 1
702 . 1 1 59 59 ALA HA H 1 4.255 0.027 . 1 . . . . 59 ALA HA . 17124 1
703 . 1 1 59 59 ALA HB1 H 1 1.332 0.027 . 1 . . . . 59 ALA QB . 17124 1
704 . 1 1 59 59 ALA HB2 H 1 1.332 0.027 . 1 . . . . 59 ALA QB . 17124 1
705 . 1 1 59 59 ALA HB3 H 1 1.332 0.027 . 1 . . . . 59 ALA QB . 17124 1
706 . 1 1 59 59 ALA CA C 13 52.473 0.15 . 1 . . . . 59 ALA CA . 17124 1
707 . 1 1 59 59 ALA CB C 13 19.014 0.15 . 1 . . . . 59 ALA CB . 17124 1
708 . 1 1 59 59 ALA N N 15 121.618 0.20 . 1 . . . . 59 ALA N . 17124 1
709 . 1 1 60 60 GLY H H 1 8.120 0.027 . 1 . . . . 60 GLY H . 17124 1
710 . 1 1 60 60 GLY HA2 H 1 3.774 0.027 . 2 . . . . 60 GLY HA2 . 17124 1
711 . 1 1 60 60 GLY HA3 H 1 3.927 0.027 . 2 . . . . 60 GLY HA3 . 17124 1
712 . 1 1 60 60 GLY C C 13 173.701 0.15 . 1 . . . . 60 GLY C . 17124 1
713 . 1 1 60 60 GLY CA C 13 45.285 0.15 . 1 . . . . 60 GLY CA . 17124 1
714 . 1 1 60 60 GLY N N 15 107.640 0.20 . 1 . . . . 60 GLY N . 17124 1
715 . 1 1 61 61 ASP H H 1 8.115 0.027 . 1 . . . . 61 ASP H . 17124 1
716 . 1 1 61 61 ASP HA H 1 4.514 0.027 . 1 . . . . 61 ASP HA . 17124 1
717 . 1 1 61 61 ASP HB2 H 1 2.538 0.027 . 2 . . . . 61 ASP HB2 . 17124 1
718 . 1 1 61 61 ASP HB3 H 1 2.587 0.027 . 2 . . . . 61 ASP HB3 . 17124 1
719 . 1 1 61 61 ASP C C 13 176.331 0.15 . 1 . . . . 61 ASP C . 17124 1
720 . 1 1 61 61 ASP CA C 13 53.981 0.15 . 1 . . . . 61 ASP CA . 17124 1
721 . 1 1 61 61 ASP CB C 13 41.094 0.15 . 1 . . . . 61 ASP CB . 17124 1
722 . 1 1 61 61 ASP N N 15 119.947 0.20 . 1 . . . . 61 ASP N . 17124 1
723 . 1 1 62 62 HIS H H 1 8.403 0.027 . 1 . . . . 62 HIS H . 17124 1
724 . 1 1 62 62 HIS HA H 1 4.595 0.027 . 1 . . . . 62 HIS HA . 17124 1
725 . 1 1 62 62 HIS HB2 H 1 3.210 0.027 . 2 . . . . 62 HIS HB2 . 17124 1
726 . 1 1 62 62 HIS HB3 H 1 3.079 0.027 . 2 . . . . 62 HIS HB3 . 17124 1
727 . 1 1 62 62 HIS HD2 H 1 7.097 0.027 . 1 . . . . 62 HIS HD2 . 17124 1
728 . 1 1 62 62 HIS C C 13 174.868 0.15 . 1 . . . . 62 HIS C . 17124 1
729 . 1 1 62 62 HIS CA C 13 55.491 0.15 . 1 . . . . 62 HIS CA . 17124 1
730 . 1 1 62 62 HIS CB C 13 28.789 0.15 . 1 . . . . 62 HIS CB . 17124 1
731 . 1 1 62 62 HIS CD2 C 13 119.995 0.15 . 1 . . . . 62 HIS CD2 . 17124 1
732 . 1 1 62 62 HIS N N 15 119.035 0.20 . 1 . . . . 62 HIS N . 17124 1
733 . 1 1 63 63 ARG H H 1 8.268 0.027 . 1 . . . . 63 ARG H . 17124 1
734 . 1 1 63 63 ARG HA H 1 4.282 0.027 . 1 . . . . 63 ARG HA . 17124 1
735 . 1 1 63 63 ARG HB2 H 1 1.850 0.027 . 2 . . . . 63 ARG HB2 . 17124 1
736 . 1 1 63 63 ARG HB3 H 1 1.619 0.027 . 2 . . . . 63 ARG HB3 . 17124 1
737 . 1 1 63 63 ARG HD2 H 1 2.596 0.027 . 2 . . . . 63 ARG HD2 . 17124 1
738 . 1 1 63 63 ARG HD3 H 1 2.901 0.027 . 2 . . . . 63 ARG HD3 . 17124 1
739 . 1 1 63 63 ARG HG2 H 1 1.413 0.027 . 2 . . . . 63 ARG HG2 . 17124 1
740 . 1 1 63 63 ARG HG3 H 1 1.860 0.027 . 2 . . . . 63 ARG HG3 . 17124 1
741 . 1 1 63 63 ARG C C 13 175.615 0.15 . 1 . . . . 63 ARG C . 17124 1
742 . 1 1 63 63 ARG CA C 13 56.463 0.15 . 1 . . . . 63 ARG CA . 17124 1
743 . 1 1 63 63 ARG CB C 13 30.740 0.15 . 1 . . . . 63 ARG CB . 17124 1
744 . 1 1 63 63 ARG CD C 13 40.079 0.15 . 1 . . . . 63 ARG CD . 17124 1
745 . 1 1 63 63 ARG CG C 13 27.187 0.15 . 1 . . . . 63 ARG CG . 17124 1
746 . 1 1 63 63 ARG N N 15 121.116 0.20 . 1 . . . . 63 ARG N . 17124 1
747 . 1 1 64 64 GLN H H 1 8.097 0.027 . 1 . . . . 64 GLN H . 17124 1
748 . 1 1 64 64 GLN HA H 1 4.537 0.027 . 1 . . . . 64 GLN HA . 17124 1
749 . 1 1 64 64 GLN HB2 H 1 1.848 0.027 . 2 . . . . 64 GLN HB2 . 17124 1
750 . 1 1 64 64 GLN HB3 H 1 1.946 0.027 . 2 . . . . 64 GLN HB3 . 17124 1
751 . 1 1 64 64 GLN HE21 H 1 7.460 0.027 . 2 . . . . 64 GLN HE21 . 17124 1
752 . 1 1 64 64 GLN HE22 H 1 6.773 0.027 . 2 . . . . 64 GLN HE22 . 17124 1
753 . 1 1 64 64 GLN HG2 H 1 2.202 0.027 . 2 . . . . 64 GLN QG . 17124 1
754 . 1 1 64 64 GLN HG3 H 1 2.202 0.027 . 2 . . . . 64 GLN QG . 17124 1
755 . 1 1 64 64 GLN C C 13 175.083 0.15 . 1 . . . . 64 GLN C . 17124 1
756 . 1 1 64 64 GLN CA C 13 55.268 0.15 . 1 . . . . 64 GLN CA . 17124 1
757 . 1 1 64 64 GLN CB C 13 30.515 0.15 . 1 . . . . 64 GLN CB . 17124 1
758 . 1 1 64 64 GLN CG C 13 33.922 0.15 . 1 . . . . 64 GLN CG . 17124 1
759 . 1 1 64 64 GLN N N 15 119.817 0.20 . 1 . . . . 64 GLN N . 17124 1
760 . 1 1 64 64 GLN NE2 N 15 112.013 0.20 . 1 . . . . 64 GLN NE2 . 17124 1
761 . 1 1 65 65 TYR H H 1 8.670 0.027 . 1 . . . . 65 TYR H . 17124 1
762 . 1 1 65 65 TYR HA H 1 4.722 0.027 . 1 . . . . 65 TYR HA . 17124 1
763 . 1 1 65 65 TYR HB2 H 1 3.056 0.027 . 2 . . . . 65 TYR HB2 . 17124 1
764 . 1 1 65 65 TYR HB3 H 1 2.875 0.027 . 2 . . . . 65 TYR HB3 . 17124 1
765 . 1 1 65 65 TYR HD1 H 1 7.039 0.027 . 3 . . . . 65 TYR QD . 17124 1
766 . 1 1 65 65 TYR HD2 H 1 7.039 0.027 . 3 . . . . 65 TYR QD . 17124 1
767 . 1 1 65 65 TYR HE1 H 1 6.744 0.027 . 3 . . . . 65 TYR QE . 17124 1
768 . 1 1 65 65 TYR HE2 H 1 6.744 0.027 . 3 . . . . 65 TYR QE . 17124 1
769 . 1 1 65 65 TYR C C 13 174.520 0.15 . 1 . . . . 65 TYR C . 17124 1
770 . 1 1 65 65 TYR CA C 13 57.818 0.15 . 1 . . . . 65 TYR CA . 17124 1
771 . 1 1 65 65 TYR CB C 13 39.679 0.15 . 1 . . . . 65 TYR CB . 17124 1
772 . 1 1 65 65 TYR CD1 C 13 133.100 0.15 . 3 . . . . 65 TYR CD1 . 17124 1
773 . 1 1 65 65 TYR CD2 C 13 133.100 0.15 . 3 . . . . 65 TYR CD2 . 17124 1
774 . 1 1 65 65 TYR CE1 C 13 118.122 0.15 . 3 . . . . 65 TYR CE1 . 17124 1
775 . 1 1 65 65 TYR CE2 C 13 118.122 0.15 . 3 . . . . 65 TYR CE2 . 17124 1
776 . 1 1 65 65 TYR N N 15 122.719 0.20 . 1 . . . . 65 TYR N . 17124 1
777 . 1 1 66 66 ARG H H 1 8.180 0.027 . 1 . . . . 66 ARG H . 17124 1
778 . 1 1 66 66 ARG HA H 1 4.977 0.027 . 1 . . . . 66 ARG HA . 17124 1
779 . 1 1 66 66 ARG HB2 H 1 1.690 0.027 . 2 . . . . 66 ARG HB2 . 17124 1
780 . 1 1 66 66 ARG HB3 H 1 1.866 0.027 . 2 . . . . 66 ARG HB3 . 17124 1
781 . 1 1 66 66 ARG HD2 H 1 3.025 0.027 . 2 . . . . 66 ARG QD . 17124 1
782 . 1 1 66 66 ARG HD3 H 1 3.025 0.027 . 2 . . . . 66 ARG QD . 17124 1
783 . 1 1 66 66 ARG HG2 H 1 1.606 0.027 . 2 . . . . 66 ARG HG2 . 17124 1
784 . 1 1 66 66 ARG HG3 H 1 1.489 0.027 . 2 . . . . 66 ARG HG3 . 17124 1
785 . 1 1 66 66 ARG C C 13 175.313 0.15 . 1 . . . . 66 ARG C . 17124 1
786 . 1 1 66 66 ARG CA C 13 54.544 0.15 . 1 . . . . 66 ARG CA . 17124 1
787 . 1 1 66 66 ARG CB C 13 34.148 0.15 . 1 . . . . 66 ARG CB . 17124 1
788 . 1 1 66 66 ARG CD C 13 43.705 0.15 . 1 . . . . 66 ARG CD . 17124 1
789 . 1 1 66 66 ARG CG C 13 27.057 0.15 . 1 . . . . 66 ARG CG . 17124 1
790 . 1 1 66 66 ARG N N 15 119.608 0.20 . 1 . . . . 66 ARG N . 17124 1
791 . 1 1 67 67 GLY H H 1 7.243 0.027 . 1 . . . . 67 GLY H . 17124 1
792 . 1 1 67 67 GLY HA2 H 1 3.573 0.027 . 2 . . . . 67 GLY HA2 . 17124 1
793 . 1 1 67 67 GLY HA3 H 1 4.076 0.027 . 2 . . . . 67 GLY HA3 . 17124 1
794 . 1 1 67 67 GLY C C 13 171.455 0.15 . 1 . . . . 67 GLY C . 17124 1
795 . 1 1 67 67 GLY CA C 13 45.483 0.15 . 1 . . . . 67 GLY CA . 17124 1
796 . 1 1 67 67 GLY N N 15 107.142 0.20 . 1 . . . . 67 GLY N . 17124 1
797 . 1 1 68 68 VAL H H 1 8.028 0.027 . 1 . . . . 68 VAL H . 17124 1
798 . 1 1 68 68 VAL HA H 1 4.870 0.027 . 1 . . . . 68 VAL HA . 17124 1
799 . 1 1 68 68 VAL HB H 1 1.775 0.027 . 1 . . . . 68 VAL HB . 17124 1
800 . 1 1 68 68 VAL HG11 H 1 0.796 0.027 . 1 . . . . 68 VAL QG1 . 17124 1
801 . 1 1 68 68 VAL HG12 H 1 0.796 0.027 . 1 . . . . 68 VAL QG1 . 17124 1
802 . 1 1 68 68 VAL HG13 H 1 0.796 0.027 . 1 . . . . 68 VAL QG1 . 17124 1
803 . 1 1 68 68 VAL HG21 H 1 0.814 0.027 . 1 . . . . 68 VAL QG2 . 17124 1
804 . 1 1 68 68 VAL HG22 H 1 0.814 0.027 . 1 . . . . 68 VAL QG2 . 17124 1
805 . 1 1 68 68 VAL HG23 H 1 0.814 0.027 . 1 . . . . 68 VAL QG2 . 17124 1
806 . 1 1 68 68 VAL C C 13 174.212 0.15 . 1 . . . . 68 VAL C . 17124 1
807 . 1 1 68 68 VAL CA C 13 60.738 0.15 . 1 . . . . 68 VAL CA . 17124 1
808 . 1 1 68 68 VAL CB C 13 36.212 0.15 . 1 . . . . 68 VAL CB . 17124 1
809 . 1 1 68 68 VAL CG1 C 13 21.275 0.15 . 2 . . . . 68 VAL CG1 . 17124 1
810 . 1 1 68 68 VAL CG2 C 13 21.464 0.15 . 2 . . . . 68 VAL CG2 . 17124 1
811 . 1 1 68 68 VAL N N 15 121.075 0.20 . 1 . . . . 68 VAL N . 17124 1
812 . 1 1 69 69 PHE H H 1 8.887 0.027 . 1 . . . . 69 PHE H . 17124 1
813 . 1 1 69 69 PHE HA H 1 5.216 0.027 . 1 . . . . 69 PHE HA . 17124 1
814 . 1 1 69 69 PHE HB2 H 1 2.234 0.027 . 2 . . . . 69 PHE HB2 . 17124 1
815 . 1 1 69 69 PHE HB3 H 1 1.810 0.027 . 2 . . . . 69 PHE HB3 . 17124 1
816 . 1 1 69 69 PHE HD1 H 1 6.441 0.027 . 3 . . . . 69 PHE QD . 17124 1
817 . 1 1 69 69 PHE HD2 H 1 6.441 0.027 . 3 . . . . 69 PHE QD . 17124 1
818 . 1 1 69 69 PHE C C 13 172.153 0.15 . 1 . . . . 69 PHE C . 17124 1
819 . 1 1 69 69 PHE CA C 13 54.278 0.15 . 1 . . . . 69 PHE CA . 17124 1
820 . 1 1 69 69 PHE CB C 13 40.656 0.15 . 1 . . . . 69 PHE CB . 17124 1
821 . 1 1 69 69 PHE CD1 C 13 131.449 0.15 . 3 . . . . 69 PHE CD1 . 17124 1
822 . 1 1 69 69 PHE CD2 C 13 131.449 0.15 . 3 . . . . 69 PHE CD2 . 17124 1
823 . 1 1 69 69 PHE N N 15 128.152 0.20 . 1 . . . . 69 PHE N . 17124 1
824 . 1 1 70 70 GLN H H 1 8.524 0.027 . 1 . . . . 70 GLN H . 17124 1
825 . 1 1 70 70 GLN HA H 1 4.718 0.027 . 1 . . . . 70 GLN HA . 17124 1
826 . 1 1 70 70 GLN HB2 H 1 1.627 0.027 . 2 . . . . 70 GLN HB2 . 17124 1
827 . 1 1 70 70 GLN HB3 H 1 1.495 0.027 . 2 . . . . 70 GLN HB3 . 17124 1
828 . 1 1 70 70 GLN HE21 H 1 6.345 0.027 . 2 . . . . 70 GLN HE21 . 17124 1
829 . 1 1 70 70 GLN HE22 H 1 7.654 0.027 . 2 . . . . 70 GLN HE22 . 17124 1
830 . 1 1 70 70 GLN HG2 H 1 1.900 0.027 . 2 . . . . 70 GLN HG2 . 17124 1
831 . 1 1 70 70 GLN HG3 H 1 1.610 0.027 . 2 . . . . 70 GLN HG3 . 17124 1
832 . 1 1 70 70 GLN CA C 13 53.398 0.15 . 1 . . . . 70 GLN CA . 17124 1
833 . 1 1 70 70 GLN CB C 13 33.142 0.15 . 1 . . . . 70 GLN CB . 17124 1
834 . 1 1 70 70 GLN CG C 13 32.390 0.15 . 1 . . . . 70 GLN CG . 17124 1
835 . 1 1 70 70 GLN N N 15 127.855 0.20 . 1 . . . . 70 GLN N . 17124 1
836 . 1 1 70 70 GLN NE2 N 15 111.788 0.20 . 1 . . . . 70 GLN NE2 . 17124 1
837 . 1 1 71 71 VAL H H 1 8.952 0.027 . 1 . . . . 71 VAL H . 17124 1
838 . 1 1 71 71 VAL HA H 1 4.152 0.027 . 1 . . . . 71 VAL HA . 17124 1
839 . 1 1 71 71 VAL HB H 1 1.428 0.027 . 1 . . . . 71 VAL HB . 17124 1
840 . 1 1 71 71 VAL HG11 H 1 0.526 0.027 . 1 . . . . 71 VAL QG1 . 17124 1
841 . 1 1 71 71 VAL HG12 H 1 0.526 0.027 . 1 . . . . 71 VAL QG1 . 17124 1
842 . 1 1 71 71 VAL HG13 H 1 0.526 0.027 . 1 . . . . 71 VAL QG1 . 17124 1
843 . 1 1 71 71 VAL HG21 H 1 0.162 0.027 . 1 . . . . 71 VAL QG2 . 17124 1
844 . 1 1 71 71 VAL HG22 H 1 0.162 0.027 . 1 . . . . 71 VAL QG2 . 17124 1
845 . 1 1 71 71 VAL HG23 H 1 0.162 0.027 . 1 . . . . 71 VAL QG2 . 17124 1
846 . 1 1 71 71 VAL C C 13 173.445 0.15 . 1 . . . . 71 VAL C . 17124 1
847 . 1 1 71 71 VAL CA C 13 60.132 0.15 . 1 . . . . 71 VAL CA . 17124 1
848 . 1 1 71 71 VAL CB C 13 34.168 0.15 . 1 . . . . 71 VAL CB . 17124 1
849 . 1 1 71 71 VAL CG1 C 13 22.710 0.15 . 2 . . . . 71 VAL CG1 . 17124 1
850 . 1 1 71 71 VAL CG2 C 13 22.161 0.15 . 2 . . . . 71 VAL CG2 . 17124 1
851 . 1 1 71 71 VAL N N 15 124.223 0.20 . 1 . . . . 71 VAL N . 17124 1
852 . 1 1 72 72 ASN H H 1 9.194 0.027 . 1 . . . . 72 ASN H . 17124 1
853 . 1 1 72 72 ASN HA H 1 5.058 0.027 . 1 . . . . 72 ASN HA . 17124 1
854 . 1 1 72 72 ASN HB2 H 1 2.063 0.027 . 2 . . . . 72 ASN HB2 . 17124 1
855 . 1 1 72 72 ASN HB3 H 1 2.607 0.027 . 2 . . . . 72 ASN HB3 . 17124 1
856 . 1 1 72 72 ASN HD21 H 1 6.999 0.027 . 2 . . . . 72 ASN HD21 . 17124 1
857 . 1 1 72 72 ASN HD22 H 1 6.615 0.027 . 2 . . . . 72 ASN HD22 . 17124 1
858 . 1 1 72 72 ASN C C 13 174.218 0.15 . 1 . . . . 72 ASN C . 17124 1
859 . 1 1 72 72 ASN CA C 13 51.045 0.15 . 1 . . . . 72 ASN CA . 17124 1
860 . 1 1 72 72 ASN CB C 13 38.771 0.15 . 1 . . . . 72 ASN CB . 17124 1
861 . 1 1 72 72 ASN N N 15 125.660 0.20 . 1 . . . . 72 ASN N . 17124 1
862 . 1 1 72 72 ASN ND2 N 15 108.605 0.20 . 1 . . . . 72 ASN ND2 . 17124 1
863 . 1 1 73 73 VAL H H 1 8.729 0.027 . 1 . . . . 73 VAL H . 17124 1
864 . 1 1 73 73 VAL HA H 1 3.922 0.027 . 1 . . . . 73 VAL HA . 17124 1
865 . 1 1 73 73 VAL HB H 1 2.113 0.027 . 1 . . . . 73 VAL HB . 17124 1
866 . 1 1 73 73 VAL HG11 H 1 0.788 0.027 . 1 . . . . 73 VAL QG1 . 17124 1
867 . 1 1 73 73 VAL HG12 H 1 0.788 0.027 . 1 . . . . 73 VAL QG1 . 17124 1
868 . 1 1 73 73 VAL HG13 H 1 0.788 0.027 . 1 . . . . 73 VAL QG1 . 17124 1
869 . 1 1 73 73 VAL HG21 H 1 0.658 0.027 . 1 . . . . 73 VAL QG2 . 17124 1
870 . 1 1 73 73 VAL HG22 H 1 0.658 0.027 . 1 . . . . 73 VAL QG2 . 17124 1
871 . 1 1 73 73 VAL HG23 H 1 0.658 0.027 . 1 . . . . 73 VAL QG2 . 17124 1
872 . 1 1 73 73 VAL C C 13 174.110 0.15 . 1 . . . . 73 VAL C . 17124 1
873 . 1 1 73 73 VAL CA C 13 62.098 0.15 . 1 . . . . 73 VAL CA . 17124 1
874 . 1 1 73 73 VAL CB C 13 31.264 0.15 . 1 . . . . 73 VAL CB . 17124 1
875 . 1 1 73 73 VAL CG1 C 13 20.925 0.15 . 2 . . . . 73 VAL CG1 . 17124 1
876 . 1 1 73 73 VAL CG2 C 13 21.293 0.15 . 2 . . . . 73 VAL CG2 . 17124 1
877 . 1 1 73 73 VAL N N 15 125.574 0.20 . 1 . . . . 73 VAL N . 17124 1
878 . 1 1 74 74 VAL H H 1 8.639 0.027 . 1 . . . . 74 VAL H . 17124 1
879 . 1 1 74 74 VAL HA H 1 4.161 0.027 . 1 . . . . 74 VAL HA . 17124 1
880 . 1 1 74 74 VAL HB H 1 0.547 0.027 . 1 . . . . 74 VAL HB . 17124 1
881 . 1 1 74 74 VAL HG11 H 1 0.540 0.027 . 1 . . . . 74 VAL QG1 . 17124 1
882 . 1 1 74 74 VAL HG12 H 1 0.540 0.027 . 1 . . . . 74 VAL QG1 . 17124 1
883 . 1 1 74 74 VAL HG13 H 1 0.540 0.027 . 1 . . . . 74 VAL QG1 . 17124 1
884 . 1 1 74 74 VAL HG21 H 1 0.345 0.027 . 1 . . . . 74 VAL QG2 . 17124 1
885 . 1 1 74 74 VAL HG22 H 1 0.345 0.027 . 1 . . . . 74 VAL QG2 . 17124 1
886 . 1 1 74 74 VAL HG23 H 1 0.345 0.027 . 1 . . . . 74 VAL QG2 . 17124 1
887 . 1 1 74 74 VAL C C 13 175.017 0.15 . 1 . . . . 74 VAL C . 17124 1
888 . 1 1 74 74 VAL CA C 13 62.416 0.15 . 1 . . . . 74 VAL CA . 17124 1
889 . 1 1 74 74 VAL CB C 13 30.828 0.15 . 1 . . . . 74 VAL CB . 17124 1
890 . 1 1 74 74 VAL CG1 C 13 21.635 0.15 . 2 . . . . 74 VAL CG1 . 17124 1
891 . 1 1 74 74 VAL CG2 C 13 19.811 0.15 . 2 . . . . 74 VAL CG2 . 17124 1
892 . 1 1 74 74 VAL N N 15 129.643 0.20 . 1 . . . . 74 VAL N . 17124 1
893 . 1 1 75 75 MET H H 1 8.734 0.027 . 1 . . . . 75 MET H . 17124 1
894 . 1 1 75 75 MET HA H 1 4.951 0.027 . 1 . . . . 75 MET HA . 17124 1
895 . 1 1 75 75 MET HB2 H 1 2.495 0.027 . 2 . . . . 75 MET HB2 . 17124 1
896 . 1 1 75 75 MET HB3 H 1 2.369 0.027 . 2 . . . . 75 MET HB3 . 17124 1
897 . 1 1 75 75 MET HE1 H 1 1.903 0.027 . 1 . . . . 75 MET QE . 17124 1
898 . 1 1 75 75 MET HE2 H 1 1.903 0.027 . 1 . . . . 75 MET QE . 17124 1
899 . 1 1 75 75 MET HE3 H 1 1.903 0.027 . 1 . . . . 75 MET QE . 17124 1
900 . 1 1 75 75 MET HG2 H 1 1.989 0.027 . 2 . . . . 75 MET QG . 17124 1
901 . 1 1 75 75 MET HG3 H 1 1.989 0.027 . 2 . . . . 75 MET QG . 17124 1
902 . 1 1 75 75 MET CA C 13 52.430 0.15 . 1 . . . . 75 MET CA . 17124 1
903 . 1 1 75 75 MET CB C 13 31.518 0.15 . 1 . . . . 75 MET CB . 17124 1
904 . 1 1 75 75 MET CE C 13 17.033 0.15 . 1 . . . . 75 MET CE . 17124 1
905 . 1 1 75 75 MET CG C 13 34.751 0.15 . 1 . . . . 75 MET CG . 17124 1
906 . 1 1 75 75 MET N N 15 124.598 0.20 . 1 . . . . 75 MET N . 17124 1
907 . 1 1 76 76 PRO HA H 1 4.593 0.027 . 1 . . . . 76 PRO HA . 17124 1
908 . 1 1 76 76 PRO HB2 H 1 1.820 0.027 . 2 . . . . 76 PRO HB2 . 17124 1
909 . 1 1 76 76 PRO HB3 H 1 2.392 0.027 . 2 . . . . 76 PRO HB3 . 17124 1
910 . 1 1 76 76 PRO HD2 H 1 3.542 0.027 . 2 . . . . 76 PRO HD2 . 17124 1
911 . 1 1 76 76 PRO HD3 H 1 3.703 0.027 . 2 . . . . 76 PRO HD3 . 17124 1
912 . 1 1 76 76 PRO HG2 H 1 1.937 0.027 . 2 . . . . 76 PRO HG2 . 17124 1
913 . 1 1 76 76 PRO C C 13 177.722 0.15 . 1 . . . . 76 PRO C . 17124 1
914 . 1 1 76 76 PRO CA C 13 62.406 0.15 . 1 . . . . 76 PRO CA . 17124 1
915 . 1 1 76 76 PRO CB C 13 31.958 0.15 . 1 . . . . 76 PRO CB . 17124 1
916 . 1 1 76 76 PRO CD C 13 50.515 0.15 . 1 . . . . 76 PRO CD . 17124 1
917 . 1 1 76 76 PRO CG C 13 27.417 0.15 . 1 . . . . 76 PRO CG . 17124 1
918 . 1 1 77 77 ILE H H 1 7.956 0.027 . 1 . . . . 77 ILE H . 17124 1
919 . 1 1 77 77 ILE HA H 1 3.706 0.027 . 1 . . . . 77 ILE HA . 17124 1
920 . 1 1 77 77 ILE HB H 1 1.527 0.027 . 1 . . . . 77 ILE HB . 17124 1
921 . 1 1 77 77 ILE HD11 H 1 0.692 0.027 . 1 . . . . 77 ILE QD1 . 17124 1
922 . 1 1 77 77 ILE HD12 H 1 0.692 0.027 . 1 . . . . 77 ILE QD1 . 17124 1
923 . 1 1 77 77 ILE HD13 H 1 0.692 0.027 . 1 . . . . 77 ILE QD1 . 17124 1
924 . 1 1 77 77 ILE HG12 H 1 1.239 0.027 . 2 . . . . 77 ILE HG12 . 17124 1
925 . 1 1 77 77 ILE HG13 H 1 0.952 0.027 . 2 . . . . 77 ILE HG13 . 17124 1
926 . 1 1 77 77 ILE HG21 H 1 0.783 0.027 . 1 . . . . 77 ILE QG2 . 17124 1
927 . 1 1 77 77 ILE HG22 H 1 0.783 0.027 . 1 . . . . 77 ILE QG2 . 17124 1
928 . 1 1 77 77 ILE HG23 H 1 0.783 0.027 . 1 . . . . 77 ILE QG2 . 17124 1
929 . 1 1 77 77 ILE C C 13 177.144 0.15 . 1 . . . . 77 ILE C . 17124 1
930 . 1 1 77 77 ILE CA C 13 62.843 0.15 . 1 . . . . 77 ILE CA . 17124 1
931 . 1 1 77 77 ILE CB C 13 38.000 0.15 . 1 . . . . 77 ILE CB . 17124 1
932 . 1 1 77 77 ILE CD1 C 13 12.925 0.15 . 1 . . . . 77 ILE CD1 . 17124 1
933 . 1 1 77 77 ILE CG1 C 13 28.415 0.15 . 1 . . . . 77 ILE CG1 . 17124 1
934 . 1 1 77 77 ILE CG2 C 13 17.137 0.15 . 1 . . . . 77 ILE CG2 . 17124 1
935 . 1 1 77 77 ILE N N 15 121.949 0.20 . 1 . . . . 77 ILE N . 17124 1
936 . 1 1 78 78 GLY H H 1 8.678 0.027 . 1 . . . . 78 GLY H . 17124 1
937 . 1 1 78 78 GLY HA2 H 1 3.766 0.027 . 2 . . . . 78 GLY HA2 . 17124 1
938 . 1 1 78 78 GLY HA3 H 1 3.966 0.027 . 2 . . . . 78 GLY HA3 . 17124 1
939 . 1 1 78 78 GLY C C 13 174.268 0.15 . 1 . . . . 78 GLY C . 17124 1
940 . 1 1 78 78 GLY CA C 13 45.205 0.15 . 1 . . . . 78 GLY CA . 17124 1
941 . 1 1 78 78 GLY N N 15 112.608 0.20 . 1 . . . . 78 GLY N . 17124 1
942 . 1 1 79 79 ASP H H 1 7.677 0.027 . 1 . . . . 79 ASP H . 17124 1
943 . 1 1 79 79 ASP HA H 1 4.530 0.027 . 1 . . . . 79 ASP HA . 17124 1
944 . 1 1 79 79 ASP HB2 H 1 2.629 0.027 . 2 . . . . 79 ASP HB2 . 17124 1
945 . 1 1 79 79 ASP HB3 H 1 2.742 0.027 . 2 . . . . 79 ASP HB3 . 17124 1
946 . 1 1 79 79 ASP C C 13 176.966 0.15 . 1 . . . . 79 ASP C . 17124 1
947 . 1 1 79 79 ASP CA C 13 54.696 0.15 . 1 . . . . 79 ASP CA . 17124 1
948 . 1 1 79 79 ASP CB C 13 42.157 0.15 . 1 . . . . 79 ASP CB . 17124 1
949 . 1 1 79 79 ASP N N 15 120.493 0.20 . 1 . . . . 79 ASP N . 17124 1
950 . 1 1 80 80 GLY H H 1 8.519 0.027 . 1 . . . . 80 GLY H . 17124 1
951 . 1 1 80 80 GLY HA2 H 1 3.804 0.027 . 2 . . . . 80 GLY HA2 . 17124 1
952 . 1 1 80 80 GLY HA3 H 1 4.184 0.027 . 2 . . . . 80 GLY HA3 . 17124 1
953 . 1 1 80 80 GLY C C 13 175.108 0.15 . 1 . . . . 80 GLY C . 17124 1
954 . 1 1 80 80 GLY CA C 13 45.430 0.15 . 1 . . . . 80 GLY CA . 17124 1
955 . 1 1 80 80 GLY N N 15 112.143 0.20 . 1 . . . . 80 GLY N . 17124 1
956 . 1 1 81 81 SER H H 1 8.451 0.027 . 1 . . . . 81 SER H . 17124 1
957 . 1 1 81 81 SER HA H 1 4.401 0.027 . 1 . . . . 81 SER HA . 17124 1
958 . 1 1 81 81 SER HB2 H 1 3.967 0.027 . 2 . . . . 81 SER HB2 . 17124 1
959 . 1 1 81 81 SER HB3 H 1 3.896 0.027 . 2 . . . . 81 SER HB3 . 17124 1
960 . 1 1 81 81 SER C C 13 175.259 0.15 . 1 . . . . 81 SER C . 17124 1
961 . 1 1 81 81 SER CA C 13 59.422 0.15 . 1 . . . . 81 SER CA . 17124 1
962 . 1 1 81 81 SER CB C 13 64.196 0.15 . 1 . . . . 81 SER CB . 17124 1
963 . 1 1 81 81 SER N N 15 116.164 0.20 . 1 . . . . 81 SER N . 17124 1
964 . 1 1 82 82 ARG H H 1 8.504 0.027 . 1 . . . . 82 ARG H . 17124 1
965 . 1 1 82 82 ARG HA H 1 4.303 0.027 . 1 . . . . 82 ARG HA . 17124 1
966 . 1 1 82 82 ARG HB2 H 1 1.820 0.027 . 2 . . . . 82 ARG HB2 . 17124 1
967 . 1 1 82 82 ARG HB3 H 1 1.975 0.027 . 2 . . . . 82 ARG HB3 . 17124 1
968 . 1 1 82 82 ARG HD2 H 1 3.147 0.027 . 2 . . . . 82 ARG HD2 . 17124 1
969 . 1 1 82 82 ARG HD3 H 1 3.020 0.027 . 2 . . . . 82 ARG HD3 . 17124 1
970 . 1 1 82 82 ARG HG2 H 1 1.615 0.027 . 2 . . . . 82 ARG HG2 . 17124 1
971 . 1 1 82 82 ARG HG3 H 1 1.550 0.027 . 2 . . . . 82 ARG HG3 . 17124 1
972 . 1 1 82 82 ARG CA C 13 57.026 0.15 . 1 . . . . 82 ARG CA . 17124 1
973 . 1 1 82 82 ARG CB C 13 28.836 0.15 . 1 . . . . 82 ARG CB . 17124 1
974 . 1 1 82 82 ARG CD C 13 43.360 0.15 . 1 . . . . 82 ARG CD . 17124 1
975 . 1 1 82 82 ARG CG C 13 27.166 0.15 . 1 . . . . 82 ARG CG . 17124 1
976 . 1 1 82 82 ARG N N 15 121.082 0.20 . 1 . . . . 82 ARG N . 17124 1
977 . 1 1 83 83 SER H H 1 8.167 0.027 . 1 . . . . 83 SER H . 17124 1
978 . 1 1 83 83 SER HA H 1 4.233 0.027 . 1 . . . . 83 SER HA . 17124 1
979 . 1 1 83 83 SER HB2 H 1 3.820 0.027 . 2 . . . . 83 SER HB2 . 17124 1
980 . 1 1 83 83 SER HB3 H 1 3.688 0.027 . 2 . . . . 83 SER HB3 . 17124 1
981 . 1 1 83 83 SER C C 13 175.796 0.15 . 1 . . . . 83 SER C . 17124 1
982 . 1 1 83 83 SER CA C 13 62.066 0.15 . 1 . . . . 83 SER CA . 17124 1
983 . 1 1 83 83 SER CB C 13 63.270 0.15 . 1 . . . . 83 SER CB . 17124 1
984 . 1 1 83 83 SER N N 15 114.468 0.20 . 1 . . . . 83 SER N . 17124 1
985 . 1 1 84 84 ALA H H 1 8.204 0.027 . 1 . . . . 84 ALA H . 17124 1
986 . 1 1 84 84 ALA HA H 1 3.969 0.027 . 1 . . . . 84 ALA HA . 17124 1
987 . 1 1 84 84 ALA HB1 H 1 1.328 0.027 . 1 . . . . 84 ALA QB . 17124 1
988 . 1 1 84 84 ALA HB2 H 1 1.328 0.027 . 1 . . . . 84 ALA QB . 17124 1
989 . 1 1 84 84 ALA HB3 H 1 1.328 0.027 . 1 . . . . 84 ALA QB . 17124 1
990 . 1 1 84 84 ALA C C 13 179.027 0.15 . 1 . . . . 84 ALA C . 17124 1
991 . 1 1 84 84 ALA CA C 13 55.345 0.15 . 1 . . . . 84 ALA CA . 17124 1
992 . 1 1 84 84 ALA CB C 13 18.189 0.15 . 1 . . . . 84 ALA CB . 17124 1
993 . 1 1 84 84 ALA N N 15 122.803 0.20 . 1 . . . . 84 ALA N . 17124 1
994 . 1 1 85 85 GLU H H 1 8.260 0.027 . 1 . . . . 85 GLU H . 17124 1
995 . 1 1 85 85 GLU HA H 1 3.912 0.027 . 1 . . . . 85 GLU HA . 17124 1
996 . 1 1 85 85 GLU HB2 H 1 2.136 0.027 . 2 . . . . 85 GLU HB2 . 17124 1
997 . 1 1 85 85 GLU HB3 H 1 1.993 0.027 . 2 . . . . 85 GLU HB3 . 17124 1
998 . 1 1 85 85 GLU HG2 H 1 2.267 0.027 . 2 . . . . 85 GLU HG2 . 17124 1
999 . 1 1 85 85 GLU HG3 H 1 2.341 0.027 . 2 . . . . 85 GLU HG3 . 17124 1
1000 . 1 1 85 85 GLU C C 13 179.477 0.15 . 1 . . . . 85 GLU C . 17124 1
1001 . 1 1 85 85 GLU CA C 13 59.810 0.15 . 1 . . . . 85 GLU CA . 17124 1
1002 . 1 1 85 85 GLU CB C 13 29.040 0.15 . 1 . . . . 85 GLU CB . 17124 1
1003 . 1 1 85 85 GLU CG C 13 36.824 0.15 . 1 . . . . 85 GLU CG . 17124 1
1004 . 1 1 85 85 GLU N N 15 118.695 0.20 . 1 . . . . 85 GLU N . 17124 1
1005 . 1 1 86 86 GLN H H 1 7.882 0.027 . 1 . . . . 86 GLN H . 17124 1
1006 . 1 1 86 86 GLN HA H 1 4.142 0.027 . 1 . . . . 86 GLN HA . 17124 1
1007 . 1 1 86 86 GLN HB2 H 1 2.206 0.027 . 2 . . . . 86 GLN HB2 . 17124 1
1008 . 1 1 86 86 GLN HB3 H 1 2.135 0.027 . 2 . . . . 86 GLN HB3 . 17124 1
1009 . 1 1 86 86 GLN HE21 H 1 6.833 0.027 . 2 . . . . 86 GLN HE21 . 17124 1
1010 . 1 1 86 86 GLN HE22 H 1 7.684 0.027 . 2 . . . . 86 GLN HE22 . 17124 1
1011 . 1 1 86 86 GLN HG2 H 1 2.404 0.027 . 2 . . . . 86 GLN HG2 . 17124 1
1012 . 1 1 86 86 GLN HG3 H 1 2.484 0.027 . 2 . . . . 86 GLN HG3 . 17124 1
1013 . 1 1 86 86 GLN C C 13 178.233 0.15 . 1 . . . . 86 GLN C . 17124 1
1014 . 1 1 86 86 GLN CA C 13 58.673 0.15 . 1 . . . . 86 GLN CA . 17124 1
1015 . 1 1 86 86 GLN CB C 13 28.340 0.15 . 1 . . . . 86 GLN CB . 17124 1
1016 . 1 1 86 86 GLN CG C 13 33.599 0.15 . 1 . . . . 86 GLN CG . 17124 1
1017 . 1 1 86 86 GLN N N 15 120.071 0.20 . 1 . . . . 86 GLN N . 17124 1
1018 . 1 1 86 86 GLN NE2 N 15 112.300 0.20 . 1 . . . . 86 GLN NE2 . 17124 1
1019 . 1 1 87 87 VAL H H 1 8.174 0.027 . 1 . . . . 87 VAL H . 17124 1
1020 . 1 1 87 87 VAL HA H 1 3.718 0.027 . 1 . . . . 87 VAL HA . 17124 1
1021 . 1 1 87 87 VAL HB H 1 2.050 0.027 . 1 . . . . 87 VAL HB . 17124 1
1022 . 1 1 87 87 VAL HG11 H 1 1.043 0.027 . 1 . . . . 87 VAL QG1 . 17124 1
1023 . 1 1 87 87 VAL HG12 H 1 1.043 0.027 . 1 . . . . 87 VAL QG1 . 17124 1
1024 . 1 1 87 87 VAL HG13 H 1 1.043 0.027 . 1 . . . . 87 VAL QG1 . 17124 1
1025 . 1 1 87 87 VAL HG21 H 1 0.870 0.027 . 1 . . . . 87 VAL QG2 . 17124 1
1026 . 1 1 87 87 VAL HG22 H 1 0.870 0.027 . 1 . . . . 87 VAL QG2 . 17124 1
1027 . 1 1 87 87 VAL HG23 H 1 0.870 0.027 . 1 . . . . 87 VAL QG2 . 17124 1
1028 . 1 1 87 87 VAL C C 13 177.647 0.15 . 1 . . . . 87 VAL C . 17124 1
1029 . 1 1 87 87 VAL CA C 13 66.824 0.15 . 1 . . . . 87 VAL CA . 17124 1
1030 . 1 1 87 87 VAL CB C 13 31.482 0.15 . 1 . . . . 87 VAL CB . 17124 1
1031 . 1 1 87 87 VAL CG1 C 13 23.436 0.15 . 2 . . . . 87 VAL CG1 . 17124 1
1032 . 1 1 87 87 VAL CG2 C 13 22.057 0.15 . 2 . . . . 87 VAL CG2 . 17124 1
1033 . 1 1 87 87 VAL N N 15 118.987 0.20 . 1 . . . . 87 VAL N . 17124 1
1034 . 1 1 88 88 ALA H H 1 8.210 0.027 . 1 . . . . 88 ALA H . 17124 1
1035 . 1 1 88 88 ALA HA H 1 3.757 0.027 . 1 . . . . 88 ALA HA . 17124 1
1036 . 1 1 88 88 ALA HB1 H 1 1.387 0.027 . 1 . . . . 88 ALA QB . 17124 1
1037 . 1 1 88 88 ALA HB2 H 1 1.387 0.027 . 1 . . . . 88 ALA QB . 17124 1
1038 . 1 1 88 88 ALA HB3 H 1 1.387 0.027 . 1 . . . . 88 ALA QB . 17124 1
1039 . 1 1 88 88 ALA C C 13 179.064 0.15 . 1 . . . . 88 ALA C . 17124 1
1040 . 1 1 88 88 ALA CA C 13 56.164 0.15 . 1 . . . . 88 ALA CA . 17124 1
1041 . 1 1 88 88 ALA CB C 13 17.828 0.15 . 1 . . . . 88 ALA CB . 17124 1
1042 . 1 1 88 88 ALA N N 15 120.821 0.20 . 1 . . . . 88 ALA N . 17124 1
1043 . 1 1 89 89 ALA H H 1 7.427 0.027 . 1 . . . . 89 ALA H . 17124 1
1044 . 1 1 89 89 ALA HA H 1 4.155 0.027 . 1 . . . . 89 ALA HA . 17124 1
1045 . 1 1 89 89 ALA HB1 H 1 1.520 0.027 . 1 . . . . 89 ALA QB . 17124 1
1046 . 1 1 89 89 ALA HB2 H 1 1.520 0.027 . 1 . . . . 89 ALA QB . 17124 1
1047 . 1 1 89 89 ALA HB3 H 1 1.520 0.027 . 1 . . . . 89 ALA QB . 17124 1
1048 . 1 1 89 89 ALA C C 13 181.496 0.15 . 1 . . . . 89 ALA C . 17124 1
1049 . 1 1 89 89 ALA CA C 13 54.925 0.15 . 1 . . . . 89 ALA CA . 17124 1
1050 . 1 1 89 89 ALA CB C 13 17.831 0.15 . 1 . . . . 89 ALA CB . 17124 1
1051 . 1 1 89 89 ALA N N 15 119.241 0.20 . 1 . . . . 89 ALA N . 17124 1
1052 . 1 1 90 90 GLU H H 1 8.109 0.027 . 1 . . . . 90 GLU H . 17124 1
1053 . 1 1 90 90 GLU HA H 1 3.998 0.027 . 1 . . . . 90 GLU HA . 17124 1
1054 . 1 1 90 90 GLU HB2 H 1 2.277 0.027 . 2 . . . . 90 GLU HB2 . 17124 1
1055 . 1 1 90 90 GLU HB3 H 1 2.373 0.027 . 2 . . . . 90 GLU HB3 . 17124 1
1056 . 1 1 90 90 GLU HG2 H 1 2.742 0.027 . 2 . . . . 90 GLU HG2 . 17124 1
1057 . 1 1 90 90 GLU HG3 H 1 2.359 0.027 . 2 . . . . 90 GLU HG3 . 17124 1
1058 . 1 1 90 90 GLU C C 13 180.185 0.15 . 1 . . . . 90 GLU C . 17124 1
1059 . 1 1 90 90 GLU CA C 13 59.424 0.15 . 1 . . . . 90 GLU CA . 17124 1
1060 . 1 1 90 90 GLU CB C 13 30.227 0.15 . 1 . . . . 90 GLU CB . 17124 1
1061 . 1 1 90 90 GLU CG C 13 37.384 0.15 . 1 . . . . 90 GLU CG . 17124 1
1062 . 1 1 90 90 GLU N N 15 119.694 0.20 . 1 . . . . 90 GLU N . 17124 1
1063 . 1 1 91 91 LEU H H 1 8.696 0.027 . 1 . . . . 91 LEU H . 17124 1
1064 . 1 1 91 91 LEU HA H 1 3.691 0.027 . 1 . . . . 91 LEU HA . 17124 1
1065 . 1 1 91 91 LEU HB2 H 1 1.831 0.027 . 2 . . . . 91 LEU HB2 . 17124 1
1066 . 1 1 91 91 LEU HB3 H 1 1.091 0.027 . 2 . . . . 91 LEU HB3 . 17124 1
1067 . 1 1 91 91 LEU HD11 H 1 0.492 0.027 . 1 . . . . 91 LEU QD1 . 17124 1
1068 . 1 1 91 91 LEU HD12 H 1 0.492 0.027 . 1 . . . . 91 LEU QD1 . 17124 1
1069 . 1 1 91 91 LEU HD13 H 1 0.492 0.027 . 1 . . . . 91 LEU QD1 . 17124 1
1070 . 1 1 91 91 LEU HD21 H 1 0.090 0.027 . 1 . . . . 91 LEU QD2 . 17124 1
1071 . 1 1 91 91 LEU HD22 H 1 0.090 0.027 . 1 . . . . 91 LEU QD2 . 17124 1
1072 . 1 1 91 91 LEU HD23 H 1 0.090 0.027 . 1 . . . . 91 LEU QD2 . 17124 1
1073 . 1 1 91 91 LEU HG H 1 1.537 0.027 . 1 . . . . 91 LEU HG . 17124 1
1074 . 1 1 91 91 LEU C C 13 178.281 0.15 . 1 . . . . 91 LEU C . 17124 1
1075 . 1 1 91 91 LEU CA C 13 57.388 0.15 . 1 . . . . 91 LEU CA . 17124 1
1076 . 1 1 91 91 LEU CB C 13 41.410 0.15 . 1 . . . . 91 LEU CB . 17124 1
1077 . 1 1 91 91 LEU CD1 C 13 26.392 0.15 . 2 . . . . 91 LEU CD1 . 17124 1
1078 . 1 1 91 91 LEU CD2 C 13 22.698 0.15 . 2 . . . . 91 LEU CD2 . 17124 1
1079 . 1 1 91 91 LEU CG C 13 26.530 0.15 . 1 . . . . 91 LEU CG . 17124 1
1080 . 1 1 91 91 LEU N N 15 120.316 0.20 . 1 . . . . 91 LEU N . 17124 1
1081 . 1 1 92 92 ASP H H 1 7.979 0.027 . 1 . . . . 92 ASP H . 17124 1
1082 . 1 1 92 92 ASP HA H 1 4.293 0.027 . 1 . . . . 92 ASP HA . 17124 1
1083 . 1 1 92 92 ASP HB2 H 1 2.678 0.027 . 2 . . . . 92 ASP QB . 17124 1
1084 . 1 1 92 92 ASP HB3 H 1 2.678 0.027 . 2 . . . . 92 ASP QB . 17124 1
1085 . 1 1 92 92 ASP C C 13 177.021 0.15 . 1 . . . . 92 ASP C . 17124 1
1086 . 1 1 92 92 ASP CA C 13 57.109 0.15 . 1 . . . . 92 ASP CA . 17124 1
1087 . 1 1 92 92 ASP CB C 13 42.005 0.15 . 1 . . . . 92 ASP CB . 17124 1
1088 . 1 1 92 92 ASP N N 15 119.928 0.20 . 1 . . . . 92 ASP N . 17124 1
1089 . 1 1 93 93 ALA H H 1 6.870 0.027 . 1 . . . . 93 ALA H . 17124 1
1090 . 1 1 93 93 ALA HA H 1 4.028 0.027 . 1 . . . . 93 ALA HA . 17124 1
1091 . 1 1 93 93 ALA HB1 H 1 1.388 0.027 . 1 . . . . 93 ALA QB . 17124 1
1092 . 1 1 93 93 ALA HB2 H 1 1.388 0.027 . 1 . . . . 93 ALA QB . 17124 1
1093 . 1 1 93 93 ALA HB3 H 1 1.388 0.027 . 1 . . . . 93 ALA QB . 17124 1
1094 . 1 1 93 93 ALA C C 13 179.149 0.15 . 1 . . . . 93 ALA C . 17124 1
1095 . 1 1 93 93 ALA CA C 13 53.391 0.15 . 1 . . . . 93 ALA CA . 17124 1
1096 . 1 1 93 93 ALA CB C 13 18.197 0.15 . 1 . . . . 93 ALA CB . 17124 1
1097 . 1 1 93 93 ALA N N 15 116.457 0.20 . 1 . . . . 93 ALA N . 17124 1
1098 . 1 1 94 94 LEU H H 1 7.419 0.027 . 1 . . . . 94 LEU H . 17124 1
1099 . 1 1 94 94 LEU HA H 1 3.861 0.027 . 1 . . . . 94 LEU HA . 17124 1
1100 . 1 1 94 94 LEU HB2 H 1 1.335 0.027 . 2 . . . . 94 LEU HB2 . 17124 1
1101 . 1 1 94 94 LEU HB3 H 1 0.829 0.027 . 2 . . . . 94 LEU HB3 . 17124 1
1102 . 1 1 94 94 LEU HD11 H 1 0.208 0.027 . 1 . . . . 94 LEU QD1 . 17124 1
1103 . 1 1 94 94 LEU HD12 H 1 0.208 0.027 . 1 . . . . 94 LEU QD1 . 17124 1
1104 . 1 1 94 94 LEU HD13 H 1 0.208 0.027 . 1 . . . . 94 LEU QD1 . 17124 1
1105 . 1 1 94 94 LEU HD21 H 1 0.609 0.027 . 1 . . . . 94 LEU QD2 . 17124 1
1106 . 1 1 94 94 LEU HD22 H 1 0.609 0.027 . 1 . . . . 94 LEU QD2 . 17124 1
1107 . 1 1 94 94 LEU HD23 H 1 0.609 0.027 . 1 . . . . 94 LEU QD2 . 17124 1
1108 . 1 1 94 94 LEU HG H 1 0.302 0.027 . 1 . . . . 94 LEU HG . 17124 1
1109 . 1 1 94 94 LEU C C 13 175.803 0.15 . 1 . . . . 94 LEU C . 17124 1
1110 . 1 1 94 94 LEU CA C 13 55.849 0.15 . 1 . . . . 94 LEU CA . 17124 1
1111 . 1 1 94 94 LEU CB C 13 43.651 0.15 . 1 . . . . 94 LEU CB . 17124 1
1112 . 1 1 94 94 LEU CD1 C 13 25.225 0.15 . 2 . . . . 94 LEU CD1 . 17124 1
1113 . 1 1 94 94 LEU CD2 C 13 22.121 0.15 . 2 . . . . 94 LEU CD2 . 17124 1
1114 . 1 1 94 94 LEU CG C 13 26.004 0.15 . 1 . . . . 94 LEU CG . 17124 1
1115 . 1 1 94 94 LEU N N 15 120.089 0.20 . 1 . . . . 94 LEU N . 17124 1
1116 . 1 1 95 95 PHE H H 1 7.824 0.027 . 1 . . . . 95 PHE H . 17124 1
1117 . 1 1 95 95 PHE HA H 1 4.844 0.027 . 1 . . . . 95 PHE HA . 17124 1
1118 . 1 1 95 95 PHE HB2 H 1 2.825 0.027 . 2 . . . . 95 PHE HB2 . 17124 1
1119 . 1 1 95 95 PHE HB3 H 1 3.105 0.027 . 2 . . . . 95 PHE HB3 . 17124 1
1120 . 1 1 95 95 PHE HD1 H 1 7.089 0.027 . 3 . . . . 95 PHE QD . 17124 1
1121 . 1 1 95 95 PHE HD2 H 1 7.089 0.027 . 3 . . . . 95 PHE QD . 17124 1
1122 . 1 1 95 95 PHE HE1 H 1 7.219 0.027 . 3 . . . . 95 PHE QE . 17124 1
1123 . 1 1 95 95 PHE HE2 H 1 7.219 0.027 . 3 . . . . 95 PHE QE . 17124 1
1124 . 1 1 95 95 PHE CA C 13 54.725 0.15 . 1 . . . . 95 PHE CA . 17124 1
1125 . 1 1 95 95 PHE CB C 13 40.024 0.15 . 1 . . . . 95 PHE CB . 17124 1
1126 . 1 1 95 95 PHE CD1 C 13 131.901 0.15 . 3 . . . . 95 PHE CD1 . 17124 1
1127 . 1 1 95 95 PHE CD2 C 13 131.894 0.15 . 3 . . . . 95 PHE CD2 . 17124 1
1128 . 1 1 95 95 PHE CE1 C 13 131.836 0.15 . 3 . . . . 95 PHE CE1 . 17124 1
1129 . 1 1 95 95 PHE CE2 C 13 131.836 0.15 . 3 . . . . 95 PHE CE2 . 17124 1
1130 . 1 1 95 95 PHE N N 15 116.178 0.20 . 1 . . . . 95 PHE N . 17124 1
1131 . 1 1 96 96 PRO HA H 1 3.660 0.027 . 1 . . . . 96 PRO HA . 17124 1
1132 . 1 1 96 96 PRO HB2 H 1 1.570 0.027 . 2 . . . . 96 PRO HB2 . 17124 1
1133 . 1 1 96 96 PRO HB3 H 1 1.750 0.027 . 2 . . . . 96 PRO HB3 . 17124 1
1134 . 1 1 96 96 PRO HD2 H 1 3.264 0.027 . 2 . . . . 96 PRO HD2 . 17124 1
1135 . 1 1 96 96 PRO HD3 H 1 3.078 0.027 . 2 . . . . 96 PRO HD3 . 17124 1
1136 . 1 1 96 96 PRO HG2 H 1 1.850 0.027 . 2 . . . . 96 PRO HG2 . 17124 1
1137 . 1 1 96 96 PRO CA C 13 60.730 0.15 . 1 . . . . 96 PRO CA . 17124 1
1138 . 1 1 96 96 PRO CB C 13 30.610 0.15 . 1 . . . . 96 PRO CB . 17124 1
1139 . 1 1 96 96 PRO CD C 13 49.530 0.15 . 1 . . . . 96 PRO CD . 17124 1
1140 . 1 1 96 96 PRO CG C 13 27.070 0.15 . 1 . . . . 96 PRO CG . 17124 1
1141 . 1 1 97 97 VAL H H 1 8.210 0.027 . 1 . . . . 97 VAL H . 17124 1
1142 . 1 1 97 97 VAL HA H 1 3.319 0.027 . 1 . . . . 97 VAL HA . 17124 1
1143 . 1 1 97 97 VAL HB H 1 1.771 0.027 . 1 . . . . 97 VAL HB . 17124 1
1144 . 1 1 97 97 VAL HG11 H 1 0.821 0.027 . 2 . . . . 97 VAL QG1 . 17124 1
1145 . 1 1 97 97 VAL HG12 H 1 0.821 0.027 . 2 . . . . 97 VAL QG1 . 17124 1
1146 . 1 1 97 97 VAL HG13 H 1 0.821 0.027 . 2 . . . . 97 VAL QG1 . 17124 1
1147 . 1 1 97 97 VAL HG21 H 1 0.823 0.027 . 2 . . . . 97 VAL QG2 . 17124 1
1148 . 1 1 97 97 VAL HG22 H 1 0.823 0.027 . 2 . . . . 97 VAL QG2 . 17124 1
1149 . 1 1 97 97 VAL HG23 H 1 0.823 0.027 . 2 . . . . 97 VAL QG2 . 17124 1
1150 . 1 1 97 97 VAL CA C 13 64.793 0.15 . 1 . . . . 97 VAL CA . 17124 1
1151 . 1 1 97 97 VAL CB C 13 31.269 0.15 . 1 . . . . 97 VAL CB . 17124 1
1152 . 1 1 97 97 VAL CG1 C 13 22.729 0.15 . 2 . . . . 97 VAL CG1 . 17124 1
1153 . 1 1 97 97 VAL CG2 C 13 20.424 0.15 . 2 . . . . 97 VAL CG2 . 17124 1
1154 . 1 1 97 97 VAL N N 15 118.462 0.20 . 1 . . . . 97 VAL N . 17124 1
1155 . 1 1 98 98 ASN H H 1 8.792 0.027 . 1 . . . . 98 ASN H . 17124 1
1156 . 1 1 98 98 ASN HA H 1 4.142 0.027 . 1 . . . . 98 ASN HA . 17124 1
1157 . 1 1 98 98 ASN HB2 H 1 3.293 0.027 . 2 . . . . 98 ASN HB2 . 17124 1
1158 . 1 1 98 98 ASN HB3 H 1 2.931 0.027 . 2 . . . . 98 ASN HB3 . 17124 1
1159 . 1 1 98 98 ASN HD21 H 1 7.614 0.027 . 2 . . . . 98 ASN HD21 . 17124 1
1160 . 1 1 98 98 ASN HD22 H 1 6.923 0.027 . 2 . . . . 98 ASN HD22 . 17124 1
1161 . 1 1 98 98 ASN CA C 13 55.630 0.15 . 1 . . . . 98 ASN CA . 17124 1
1162 . 1 1 98 98 ASN CB C 13 37.029 0.15 . 1 . . . . 98 ASN CB . 17124 1
1163 . 1 1 98 98 ASN N N 15 118.138 0.20 . 1 . . . . 98 ASN N . 17124 1
1164 . 1 1 98 98 ASN ND2 N 15 114.234 0.20 . 1 . . . . 98 ASN ND2 . 17124 1
1165 . 1 1 99 99 LEU H H 1 8.039 0.027 . 1 . . . . 99 LEU H . 17124 1
1166 . 1 1 99 99 LEU HA H 1 4.110 0.027 . 1 . . . . 99 LEU HA . 17124 1
1167 . 1 1 99 99 LEU HB2 H 1 1.765 0.027 . 2 . . . . 99 LEU HB2 . 17124 1
1168 . 1 1 99 99 LEU HB3 H 1 1.649 0.027 . 2 . . . . 99 LEU HB3 . 17124 1
1169 . 1 1 99 99 LEU HD11 H 1 0.817 0.027 . 1 . . . . 99 LEU QD1 . 17124 1
1170 . 1 1 99 99 LEU HD12 H 1 0.817 0.027 . 1 . . . . 99 LEU QD1 . 17124 1
1171 . 1 1 99 99 LEU HD13 H 1 0.817 0.027 . 1 . . . . 99 LEU QD1 . 17124 1
1172 . 1 1 99 99 LEU HD21 H 1 0.849 0.027 . 1 . . . . 99 LEU QD2 . 17124 1
1173 . 1 1 99 99 LEU HD22 H 1 0.849 0.027 . 1 . . . . 99 LEU QD2 . 17124 1
1174 . 1 1 99 99 LEU HD23 H 1 0.849 0.027 . 1 . . . . 99 LEU QD2 . 17124 1
1175 . 1 1 99 99 LEU HG H 1 0.982 0.027 . 1 . . . . 99 LEU HG . 17124 1
1176 . 1 1 99 99 LEU C C 13 175.271 0.15 . 1 . . . . 99 LEU C . 17124 1
1177 . 1 1 99 99 LEU CA C 13 56.811 0.15 . 1 . . . . 99 LEU CA . 17124 1
1178 . 1 1 99 99 LEU CB C 13 42.683 0.15 . 1 . . . . 99 LEU CB . 17124 1
1179 . 1 1 99 99 LEU CD1 C 13 21.147 0.15 . 2 . . . . 99 LEU CD1 . 17124 1
1180 . 1 1 99 99 LEU CD2 C 13 22.745 0.15 . 2 . . . . 99 LEU CD2 . 17124 1
1181 . 1 1 99 99 LEU CG C 13 27.346 0.15 . 1 . . . . 99 LEU CG . 17124 1
1182 . 1 1 99 99 LEU N N 15 122.842 0.20 . 1 . . . . 99 LEU N . 17124 1
1183 . 1 1 100 100 VAL H H 1 8.199 0.027 . 1 . . . . 100 VAL H . 17124 1
1184 . 1 1 100 100 VAL HA H 1 4.740 0.027 . 1 . . . . 100 VAL HA . 17124 1
1185 . 1 1 100 100 VAL HB H 1 1.779 0.027 . 1 . . . . 100 VAL HB . 17124 1
1186 . 1 1 100 100 VAL HG11 H 1 0.815 0.027 . 1 . . . . 100 VAL QG1 . 17124 1
1187 . 1 1 100 100 VAL HG12 H 1 0.815 0.027 . 1 . . . . 100 VAL QG1 . 17124 1
1188 . 1 1 100 100 VAL HG13 H 1 0.815 0.027 . 1 . . . . 100 VAL QG1 . 17124 1
1189 . 1 1 100 100 VAL HG21 H 1 0.660 0.027 . 1 . . . . 100 VAL QG2 . 17124 1
1190 . 1 1 100 100 VAL HG22 H 1 0.660 0.027 . 1 . . . . 100 VAL QG2 . 17124 1
1191 . 1 1 100 100 VAL HG23 H 1 0.660 0.027 . 1 . . . . 100 VAL QG2 . 17124 1
1192 . 1 1 100 100 VAL C C 13 176.195 0.15 . 1 . . . . 100 VAL C . 17124 1
1193 . 1 1 100 100 VAL CA C 13 61.023 0.15 . 1 . . . . 100 VAL CA . 17124 1
1194 . 1 1 100 100 VAL CB C 13 33.559 0.15 . 1 . . . . 100 VAL CB . 17124 1
1195 . 1 1 100 100 VAL CG1 C 13 21.187 0.15 . 2 . . . . 100 VAL CG1 . 17124 1
1196 . 1 1 100 100 VAL CG2 C 13 21.780 0.15 . 2 . . . . 100 VAL CG2 . 17124 1
1197 . 1 1 100 100 VAL N N 15 125.944 0.20 . 1 . . . . 100 VAL N . 17124 1
1198 . 1 1 101 101 MET H H 1 9.310 0.027 . 1 . . . . 101 MET H . 17124 1
1199 . 1 1 101 101 MET HA H 1 4.372 0.027 . 1 . . . . 101 MET HA . 17124 1
1200 . 1 1 101 101 MET HB2 H 1 1.753 0.027 . 2 . . . . 101 MET HB2 . 17124 1
1201 . 1 1 101 101 MET HB3 H 1 1.644 0.027 . 2 . . . . 101 MET HB3 . 17124 1
1202 . 1 1 101 101 MET HE1 H 1 1.015 0.027 . 1 . . . . 101 MET QE . 17124 1
1203 . 1 1 101 101 MET HE2 H 1 1.015 0.027 . 1 . . . . 101 MET QE . 17124 1
1204 . 1 1 101 101 MET HE3 H 1 1.015 0.027 . 1 . . . . 101 MET QE . 17124 1
1205 . 1 1 101 101 MET HG2 H 1 1.874 0.027 . 2 . . . . 101 MET HG2 . 17124 1
1206 . 1 1 101 101 MET HG3 H 1 2.392 0.027 . 2 . . . . 101 MET HG3 . 17124 1
1207 . 1 1 101 101 MET C C 13 174.535 0.15 . 1 . . . . 101 MET C . 17124 1
1208 . 1 1 101 101 MET CA C 13 53.731 0.15 . 1 . . . . 101 MET CA . 17124 1
1209 . 1 1 101 101 MET CB C 13 35.833 0.15 . 1 . . . . 101 MET CB . 17124 1
1210 . 1 1 101 101 MET CE C 13 15.701 0.15 . 1 . . . . 101 MET CE . 17124 1
1211 . 1 1 101 101 MET CG C 13 31.459 0.15 . 1 . . . . 101 MET CG . 17124 1
1212 . 1 1 101 101 MET N N 15 127.242 0.20 . 1 . . . . 101 MET N . 17124 1
1213 . 1 1 102 102 GLN H H 1 8.657 0.027 . 1 . . . . 102 GLN H . 17124 1
1214 . 1 1 102 102 GLN HA H 1 4.685 0.027 . 1 . . . . 102 GLN HA . 17124 1
1215 . 1 1 102 102 GLN HB2 H 1 1.974 0.027 . 2 . . . . 102 GLN HB2 . 17124 1
1216 . 1 1 102 102 GLN HB3 H 1 1.840 0.027 . 2 . . . . 102 GLN HB3 . 17124 1
1217 . 1 1 102 102 GLN HE21 H 1 7.323 0.027 . 2 . . . . 102 GLN HE21 . 17124 1
1218 . 1 1 102 102 GLN HE22 H 1 6.703 0.027 . 2 . . . . 102 GLN HE22 . 17124 1
1219 . 1 1 102 102 GLN HG2 H 1 2.156 0.027 . 2 . . . . 102 GLN HG2 . 17124 1
1220 . 1 1 102 102 GLN HG3 H 1 2.199 0.027 . 2 . . . . 102 GLN HG3 . 17124 1
1221 . 1 1 102 102 GLN C C 13 176.270 0.15 . 1 . . . . 102 GLN C . 17124 1
1222 . 1 1 102 102 GLN CA C 13 55.308 0.15 . 1 . . . . 102 GLN CA . 17124 1
1223 . 1 1 102 102 GLN CB C 13 29.242 0.15 . 1 . . . . 102 GLN CB . 17124 1
1224 . 1 1 102 102 GLN CG C 13 33.692 0.15 . 1 . . . . 102 GLN CG . 17124 1
1225 . 1 1 102 102 GLN N N 15 123.383 0.20 . 1 . . . . 102 GLN N . 17124 1
1226 . 1 1 102 102 GLN NE2 N 15 111.373 0.20 . 1 . . . . 102 GLN NE2 . 17124 1
1227 . 1 1 103 103 SER H H 1 8.718 0.027 . 1 . . . . 103 SER H . 17124 1
1228 . 1 1 103 103 SER HA H 1 4.463 0.027 . 1 . . . . 103 SER HA . 17124 1
1229 . 1 1 103 103 SER HB2 H 1 3.278 0.027 . 2 . . . . 103 SER HB2 . 17124 1
1230 . 1 1 103 103 SER HB3 H 1 3.548 0.027 . 2 . . . . 103 SER HB3 . 17124 1
1231 . 1 1 103 103 SER C C 13 174.003 0.15 . 1 . . . . 103 SER C . 17124 1
1232 . 1 1 103 103 SER CA C 13 56.026 0.15 . 1 . . . . 103 SER CA . 17124 1
1233 . 1 1 103 103 SER CB C 13 63.567 0.15 . 1 . . . . 103 SER CB . 17124 1
1234 . 1 1 103 103 SER N N 15 120.061 0.20 . 1 . . . . 103 SER N . 17124 1
1235 . 1 1 104 104 GLY H H 1 8.784 0.027 . 1 . . . . 104 GLY H . 17124 1
1236 . 1 1 104 104 GLY HA2 H 1 3.832 0.027 . 2 . . . . 104 GLY HA2 . 17124 1
1237 . 1 1 104 104 GLY HA3 H 1 3.731 0.027 . 2 . . . . 104 GLY HA3 . 17124 1
1238 . 1 1 104 104 GLY C C 13 174.929 0.15 . 1 . . . . 104 GLY C . 17124 1
1239 . 1 1 104 104 GLY CA C 13 47.589 0.15 . 1 . . . . 104 GLY CA . 17124 1
1240 . 1 1 104 104 GLY N N 15 115.086 0.20 . 1 . . . . 104 GLY N . 17124 1
1241 . 1 1 105 105 GLY H H 1 8.354 0.027 . 1 . . . . 105 GLY H . 17124 1
1242 . 1 1 105 105 GLY HA2 H 1 3.871 0.027 . 2 . . . . 105 GLY HA2 . 17124 1
1243 . 1 1 105 105 GLY HA3 H 1 3.929 0.027 . 2 . . . . 105 GLY HA3 . 17124 1
1244 . 1 1 105 105 GLY C C 13 173.178 0.15 . 1 . . . . 105 GLY C . 17124 1
1245 . 1 1 105 105 GLY CA C 13 45.315 0.15 . 1 . . . . 105 GLY CA . 17124 1
1246 . 1 1 105 105 GLY N N 15 110.767 0.20 . 1 . . . . 105 GLY N . 17124 1
1247 . 1 1 106 106 LEU H H 1 7.924 0.027 . 1 . . . . 106 LEU H . 17124 1
1248 . 1 1 106 106 LEU HA H 1 4.749 0.027 . 1 . . . . 106 LEU HA . 17124 1
1249 . 1 1 106 106 LEU HB2 H 1 1.488 0.027 . 2 . . . . 106 LEU HB2 . 17124 1
1250 . 1 1 106 106 LEU HB3 H 1 1.325 0.027 . 2 . . . . 106 LEU HB3 . 17124 1
1251 . 1 1 106 106 LEU HD11 H 1 0.597 0.027 . 2 . . . . 106 LEU QD1 . 17124 1
1252 . 1 1 106 106 LEU HD12 H 1 0.597 0.027 . 2 . . . . 106 LEU QD1 . 17124 1
1253 . 1 1 106 106 LEU HD13 H 1 0.597 0.027 . 2 . . . . 106 LEU QD1 . 17124 1
1254 . 1 1 106 106 LEU HD21 H 1 0.598 0.027 . 2 . . . . 106 LEU QD2 . 17124 1
1255 . 1 1 106 106 LEU HD22 H 1 0.598 0.027 . 2 . . . . 106 LEU QD2 . 17124 1
1256 . 1 1 106 106 LEU HD23 H 1 0.598 0.027 . 2 . . . . 106 LEU QD2 . 17124 1
1257 . 1 1 106 106 LEU HG H 1 1.690 0.027 . 1 . . . . 106 LEU HG . 17124 1
1258 . 1 1 106 106 LEU C C 13 174.386 0.15 . 1 . . . . 106 LEU C . 17124 1
1259 . 1 1 106 106 LEU CA C 13 53.669 0.15 . 1 . . . . 106 LEU CA . 17124 1
1260 . 1 1 106 106 LEU CB C 13 43.848 0.15 . 1 . . . . 106 LEU CB . 17124 1
1261 . 1 1 106 106 LEU CD1 C 13 25.773 0.15 . 2 . . . . 106 LEU CD1 . 17124 1
1262 . 1 1 106 106 LEU CD2 C 13 25.684 0.15 . 2 . . . . 106 LEU CD2 . 17124 1
1263 . 1 1 106 106 LEU CG C 13 26.355 0.15 . 1 . . . . 106 LEU CG . 17124 1
1264 . 1 1 106 106 LEU N N 15 120.125 0.20 . 1 . . . . 106 LEU N . 17124 1
1265 . 1 1 107 107 ALA H H 1 8.499 0.027 . 1 . . . . 107 ALA H . 17124 1
1266 . 1 1 107 107 ALA HA H 1 4.830 0.027 . 1 . . . . 107 ALA HA . 17124 1
1267 . 1 1 107 107 ALA HB1 H 1 1.088 0.027 . 1 . . . . 107 ALA QB . 17124 1
1268 . 1 1 107 107 ALA HB2 H 1 1.088 0.027 . 1 . . . . 107 ALA QB . 17124 1
1269 . 1 1 107 107 ALA HB3 H 1 1.088 0.027 . 1 . . . . 107 ALA QB . 17124 1
1270 . 1 1 107 107 ALA C C 13 175.596 0.15 . 1 . . . . 107 ALA C . 17124 1
1271 . 1 1 107 107 ALA CA C 13 50.365 0.15 . 1 . . . . 107 ALA CA . 17124 1
1272 . 1 1 107 107 ALA CB C 13 20.763 0.15 . 1 . . . . 107 ALA CB . 17124 1
1273 . 1 1 107 107 ALA N N 15 123.603 0.20 . 1 . . . . 107 ALA N . 17124 1
1274 . 1 1 108 108 VAL H H 1 8.798 0.027 . 1 . . . . 108 VAL H . 17124 1
1275 . 1 1 108 108 VAL HA H 1 4.458 0.027 . 1 . . . . 108 VAL HA . 17124 1
1276 . 1 1 108 108 VAL HB H 1 1.635 0.027 . 1 . . . . 108 VAL HB . 17124 1
1277 . 1 1 108 108 VAL HG11 H 1 0.430 0.027 . 1 . . . . 108 VAL QG1 . 17124 1
1278 . 1 1 108 108 VAL HG12 H 1 0.430 0.027 . 1 . . . . 108 VAL QG1 . 17124 1
1279 . 1 1 108 108 VAL HG13 H 1 0.430 0.027 . 1 . . . . 108 VAL QG1 . 17124 1
1280 . 1 1 108 108 VAL HG21 H 1 0.609 0.027 . 1 . . . . 108 VAL QG2 . 17124 1
1281 . 1 1 108 108 VAL HG22 H 1 0.609 0.027 . 1 . . . . 108 VAL QG2 . 17124 1
1282 . 1 1 108 108 VAL HG23 H 1 0.609 0.027 . 1 . . . . 108 VAL QG2 . 17124 1
1283 . 1 1 108 108 VAL C C 13 173.688 0.15 . 1 . . . . 108 VAL C . 17124 1
1284 . 1 1 108 108 VAL CA C 13 61.206 0.15 . 1 . . . . 108 VAL CA . 17124 1
1285 . 1 1 108 108 VAL CB C 13 33.136 0.15 . 1 . . . . 108 VAL CB . 17124 1
1286 . 1 1 108 108 VAL CG1 C 13 22.030 0.15 . 2 . . . . 108 VAL CG1 . 17124 1
1287 . 1 1 108 108 VAL CG2 C 13 21.535 0.15 . 2 . . . . 108 VAL CG2 . 17124 1
1288 . 1 1 108 108 VAL N N 15 124.871 0.20 . 1 . . . . 108 VAL N . 17124 1
1289 . 1 1 109 109 ARG H H 1 9.269 0.027 . 1 . . . . 109 ARG H . 17124 1
1290 . 1 1 109 109 ARG HA H 1 5.669 0.027 . 1 . . . . 109 ARG HA . 17124 1
1291 . 1 1 109 109 ARG HB2 H 1 2.003 0.027 . 2 . . . . 109 ARG HB2 . 17124 1
1292 . 1 1 109 109 ARG HB3 H 1 1.589 0.027 . 2 . . . . 109 ARG HB3 . 17124 1
1293 . 1 1 109 109 ARG HD2 H 1 3.154 0.027 . 2 . . . . 109 ARG HD2 . 17124 1
1294 . 1 1 109 109 ARG HD3 H 1 3.018 0.027 . 2 . . . . 109 ARG HD3 . 17124 1
1295 . 1 1 109 109 ARG HG2 H 1 1.378 0.027 . 2 . . . . 109 ARG HG2 . 17124 1
1296 . 1 1 109 109 ARG HG3 H 1 1.186 0.027 . 2 . . . . 109 ARG HG3 . 17124 1
1297 . 1 1 109 109 ARG C C 13 176.633 0.15 . 1 . . . . 109 ARG C . 17124 1
1298 . 1 1 109 109 ARG CA C 13 53.271 0.15 . 1 . . . . 109 ARG CA . 17124 1
1299 . 1 1 109 109 ARG CB C 13 34.217 0.15 . 1 . . . . 109 ARG CB . 17124 1
1300 . 1 1 109 109 ARG CD C 13 43.290 0.15 . 1 . . . . 109 ARG CD . 17124 1
1301 . 1 1 109 109 ARG CG C 13 26.979 0.15 . 1 . . . . 109 ARG CG . 17124 1
1302 . 1 1 109 109 ARG N N 15 128.240 0.20 . 1 . . . . 109 ARG N . 17124 1
1303 . 1 1 110 110 VAL H H 1 8.557 0.027 . 1 . . . . 110 VAL H . 17124 1
1304 . 1 1 110 110 VAL HA H 1 3.929 0.027 . 1 . . . . 110 VAL HA . 17124 1
1305 . 1 1 110 110 VAL HB H 1 2.396 0.027 . 1 . . . . 110 VAL HB . 17124 1
1306 . 1 1 110 110 VAL HG11 H 1 1.068 0.027 . 1 . . . . 110 VAL QG1 . 17124 1
1307 . 1 1 110 110 VAL HG12 H 1 1.068 0.027 . 1 . . . . 110 VAL QG1 . 17124 1
1308 . 1 1 110 110 VAL HG13 H 1 1.068 0.027 . 1 . . . . 110 VAL QG1 . 17124 1
1309 . 1 1 110 110 VAL C C 13 175.510 0.15 . 1 . . . . 110 VAL C . 17124 1
1310 . 1 1 110 110 VAL CA C 13 64.527 0.15 . 1 . . . . 110 VAL CA . 17124 1
1311 . 1 1 110 110 VAL CB C 13 31.345 0.15 . 1 . . . . 110 VAL CB . 17124 1
1312 . 1 1 110 110 VAL CG1 C 13 22.107 0.15 . 2 . . . . 110 VAL CG1 . 17124 1
1313 . 1 1 110 110 VAL N N 15 125.417 0.20 . 1 . . . . 110 VAL N . 17124 1
1314 . 1 1 111 111 ARG H H 1 9.260 0.027 . 1 . . . . 111 ARG H . 17124 1
1315 . 1 1 111 111 ARG HA H 1 4.547 0.027 . 1 . . . . 111 ARG HA . 17124 1
1316 . 1 1 111 111 ARG HB2 H 1 1.635 0.027 . 2 . . . . 111 ARG HB2 . 17124 1
1317 . 1 1 111 111 ARG HD2 H 1 3.197 0.027 . 2 . . . . 111 ARG HD2 . 17124 1
1318 . 1 1 111 111 ARG HD3 H 1 3.099 0.027 . 2 . . . . 111 ARG HD3 . 17124 1
1319 . 1 1 111 111 ARG HG2 H 1 1.541 0.027 . 2 . . . . 111 ARG HG2 . 17124 1
1320 . 1 1 111 111 ARG HG3 H 1 1.459 0.027 . 2 . . . . 111 ARG HG3 . 17124 1
1321 . 1 1 111 111 ARG C C 13 175.919 0.15 . 1 . . . . 111 ARG C . 17124 1
1322 . 1 1 111 111 ARG CA C 13 55.868 0.15 . 1 . . . . 111 ARG CA . 17124 1
1323 . 1 1 111 111 ARG CB C 13 32.359 0.15 . 1 . . . . 111 ARG CB . 17124 1
1324 . 1 1 111 111 ARG CD C 13 42.054 0.15 . 1 . . . . 111 ARG CD . 17124 1
1325 . 1 1 111 111 ARG CG C 13 27.022 0.15 . 1 . . . . 111 ARG CG . 17124 1
1326 . 1 1 111 111 ARG N N 15 130.319 0.20 . 1 . . . . 111 ARG N . 17124 1
1327 . 1 1 112 112 THR H H 1 7.964 0.027 . 1 . . . . 112 THR H . 17124 1
1328 . 1 1 112 112 THR HA H 1 4.858 0.027 . 1 . . . . 112 THR HA . 17124 1
1329 . 1 1 112 112 THR HB H 1 4.323 0.027 . 1 . . . . 112 THR HB . 17124 1
1330 . 1 1 112 112 THR HG21 H 1 1.109 0.027 . 1 . . . . 112 THR QG2 . 17124 1
1331 . 1 1 112 112 THR HG22 H 1 1.109 0.027 . 1 . . . . 112 THR QG2 . 17124 1
1332 . 1 1 112 112 THR HG23 H 1 1.109 0.027 . 1 . . . . 112 THR QG2 . 17124 1
1333 . 1 1 112 112 THR CA C 13 57.978 0.15 . 1 . . . . 112 THR CA . 17124 1
1334 . 1 1 112 112 THR CB C 13 68.842 0.15 . 1 . . . . 112 THR CB . 17124 1
1335 . 1 1 112 112 THR CG2 C 13 21.369 0.15 . 1 . . . . 112 THR CG2 . 17124 1
1336 . 1 1 112 112 THR N N 15 111.884 0.20 . 1 . . . . 112 THR N . 17124 1
1337 . 1 1 113 113 PRO HA H 1 4.606 0.027 . 1 . . . . 113 PRO HA . 17124 1
1338 . 1 1 113 113 PRO HB2 H 1 2.049 0.027 . 2 . . . . 113 PRO HB2 . 17124 1
1339 . 1 1 113 113 PRO HB3 H 1 2.321 0.027 . 2 . . . . 113 PRO HB3 . 17124 1
1340 . 1 1 113 113 PRO HD2 H 1 3.587 0.027 . 2 . . . . 113 PRO HD2 . 17124 1
1341 . 1 1 113 113 PRO HD3 H 1 3.658 0.027 . 2 . . . . 113 PRO HD3 . 17124 1
1342 . 1 1 113 113 PRO HG2 H 1 1.939 0.027 . 2 . . . . 113 PRO HG2 . 17124 1
1343 . 1 1 113 113 PRO HG3 H 1 1.867 0.027 . 2 . . . . 113 PRO HG3 . 17124 1
1344 . 1 1 113 113 PRO C C 13 177.285 0.15 . 1 . . . . 113 PRO C . 17124 1
1345 . 1 1 113 113 PRO CA C 13 62.035 0.15 . 1 . . . . 113 PRO CA . 17124 1
1346 . 1 1 113 113 PRO CB C 13 33.322 0.15 . 1 . . . . 113 PRO CB . 17124 1
1347 . 1 1 113 113 PRO CD C 13 50.528 0.15 . 1 . . . . 113 PRO CD . 17124 1
1348 . 1 1 113 113 PRO CG C 13 27.122 0.15 . 1 . . . . 113 PRO CG . 17124 1
1349 . 1 1 114 114 ILE H H 1 9.003 0.027 . 1 . . . . 114 ILE H . 17124 1
1350 . 1 1 114 114 ILE HA H 1 4.212 0.027 . 1 . . . . 114 ILE HA . 17124 1
1351 . 1 1 114 114 ILE HB H 1 1.893 0.027 . 1 . . . . 114 ILE HB . 17124 1
1352 . 1 1 114 114 ILE HD11 H 1 0.621 0.027 . 1 . . . . 114 ILE QD1 . 17124 1
1353 . 1 1 114 114 ILE HD12 H 1 0.621 0.027 . 1 . . . . 114 ILE QD1 . 17124 1
1354 . 1 1 114 114 ILE HD13 H 1 0.621 0.027 . 1 . . . . 114 ILE QD1 . 17124 1
1355 . 1 1 114 114 ILE HG12 H 1 1.484 0.027 . 2 . . . . 114 ILE HG12 . 17124 1
1356 . 1 1 114 114 ILE HG13 H 1 1.383 0.027 . 2 . . . . 114 ILE HG13 . 17124 1
1357 . 1 1 114 114 ILE HG21 H 1 0.786 0.027 . 1 . . . . 114 ILE QG2 . 17124 1
1358 . 1 1 114 114 ILE HG22 H 1 0.786 0.027 . 1 . . . . 114 ILE QG2 . 17124 1
1359 . 1 1 114 114 ILE HG23 H 1 0.786 0.027 . 1 . . . . 114 ILE QG2 . 17124 1
1360 . 1 1 114 114 ILE C C 13 176.672 0.15 . 1 . . . . 114 ILE C . 17124 1
1361 . 1 1 114 114 ILE CA C 13 60.468 0.15 . 1 . . . . 114 ILE CA . 17124 1
1362 . 1 1 114 114 ILE CB C 13 37.186 0.15 . 1 . . . . 114 ILE CB . 17124 1
1363 . 1 1 114 114 ILE CD1 C 13 12.009 0.15 . 1 . . . . 114 ILE CD1 . 17124 1
1364 . 1 1 114 114 ILE CG1 C 13 27.098 0.15 . 1 . . . . 114 ILE CG1 . 17124 1
1365 . 1 1 114 114 ILE CG2 C 13 17.232 0.15 . 1 . . . . 114 ILE CG2 . 17124 1
1366 . 1 1 114 114 ILE N N 15 121.378 0.20 . 1 . . . . 114 ILE N . 17124 1
1367 . 1 1 115 115 SER H H 1 8.948 0.027 . 1 . . . . 115 SER H . 17124 1
1368 . 1 1 115 115 SER HA H 1 4.662 0.027 . 1 . . . . 115 SER HA . 17124 1
1369 . 1 1 115 115 SER HB2 H 1 3.675 0.027 . 2 . . . . 115 SER HB2 . 17124 1
1370 . 1 1 115 115 SER C C 13 173.462 0.15 . 1 . . . . 115 SER C . 17124 1
1371 . 1 1 115 115 SER CA C 13 56.951 0.15 . 1 . . . . 115 SER CA . 17124 1
1372 . 1 1 115 115 SER CB C 13 65.238 0.15 . 1 . . . . 115 SER CB . 17124 1
1373 . 1 1 115 115 SER N N 15 120.715 0.20 . 1 . . . . 115 SER N . 17124 1
1374 . 1 1 116 116 ASN H H 1 8.706 0.027 . 1 . . . . 116 ASN H . 17124 1
1375 . 1 1 116 116 ASN HA H 1 4.921 0.027 . 1 . . . . 116 ASN HA . 17124 1
1376 . 1 1 116 116 ASN HB2 H 1 2.582 0.027 . 2 . . . . 116 ASN QB . 17124 1
1377 . 1 1 116 116 ASN HB3 H 1 2.582 0.027 . 2 . . . . 116 ASN QB . 17124 1
1378 . 1 1 116 116 ASN HD21 H 1 7.300 0.027 . 2 . . . . 116 ASN HD21 . 17124 1
1379 . 1 1 116 116 ASN HD22 H 1 6.369 0.027 . 2 . . . . 116 ASN HD22 . 17124 1
1380 . 1 1 116 116 ASN C C 13 175.751 0.15 . 1 . . . . 116 ASN C . 17124 1
1381 . 1 1 116 116 ASN CA C 13 53.162 0.15 . 1 . . . . 116 ASN CA . 17124 1
1382 . 1 1 116 116 ASN CB C 13 39.209 0.15 . 1 . . . . 116 ASN CB . 17124 1
1383 . 1 1 116 116 ASN N N 15 123.404 0.20 . 1 . . . . 116 ASN N . 17124 1
1384 . 1 1 116 116 ASN ND2 N 15 110.300 0.20 . 1 . . . . 116 ASN ND2 . 17124 1
1385 . 1 1 117 117 GLY H H 1 8.501 0.027 . 1 . . . . 117 GLY H . 17124 1
1386 . 1 1 117 117 GLY HA2 H 1 4.348 0.027 . 2 . . . . 117 GLY HA2 . 17124 1
1387 . 1 1 117 117 GLY HA3 H 1 3.482 0.027 . 2 . . . . 117 GLY HA3 . 17124 1
1388 . 1 1 117 117 GLY CA C 13 43.538 0.15 . 1 . . . . 117 GLY CA . 17124 1
1389 . 1 1 117 117 GLY N N 15 111.221 0.20 . 1 . . . . 117 GLY N . 17124 1
1390 . 1 1 118 118 GLN H H 1 8.262 0.027 . 1 . . . . 118 GLN H . 17124 1
1391 . 1 1 118 118 GLN HA H 1 4.465 0.027 . 1 . . . . 118 GLN HA . 17124 1
1392 . 1 1 118 118 GLN HB2 H 1 1.868 0.027 . 2 . . . . 118 GLN HB2 . 17124 1
1393 . 1 1 118 118 GLN HB3 H 1 1.934 0.027 . 2 . . . . 118 GLN HB3 . 17124 1
1394 . 1 1 118 118 GLN HE21 H 1 6.833 0.027 . 2 . . . . 118 GLN HE21 . 17124 1
1395 . 1 1 118 118 GLN HE22 H 1 7.551 0.027 . 2 . . . . 118 GLN HE22 . 17124 1
1396 . 1 1 118 118 GLN HG2 H 1 2.331 0.027 . 2 . . . . 118 GLN QG . 17124 1
1397 . 1 1 118 118 GLN HG3 H 1 2.331 0.027 . 2 . . . . 118 GLN QG . 17124 1
1398 . 1 1 118 118 GLN CA C 13 53.341 0.15 . 1 . . . . 118 GLN CA . 17124 1
1399 . 1 1 118 118 GLN CB C 13 28.926 0.15 . 1 . . . . 118 GLN CB . 17124 1
1400 . 1 1 118 118 GLN CG C 13 33.305 0.15 . 1 . . . . 118 GLN CG . 17124 1
1401 . 1 1 118 118 GLN N N 15 120.084 0.20 . 1 . . . . 118 GLN N . 17124 1
1402 . 1 1 118 118 GLN NE2 N 15 112.891 0.20 . 1 . . . . 118 GLN NE2 . 17124 1
1403 . 1 1 119 119 PRO HA H 1 4.798 0.027 . 1 . . . . 119 PRO HA . 17124 1
1404 . 1 1 119 119 PRO HB2 H 1 2.095 0.027 . 2 . . . . 119 PRO HB2 . 17124 1
1405 . 1 1 119 119 PRO HB3 H 1 1.777 0.027 . 2 . . . . 119 PRO HB3 . 17124 1
1406 . 1 1 119 119 PRO HD2 H 1 3.583 0.027 . 2 . . . . 119 PRO HD2 . 17124 1
1407 . 1 1 119 119 PRO HD3 H 1 4.022 0.027 . 2 . . . . 119 PRO HD3 . 17124 1
1408 . 1 1 119 119 PRO HG2 H 1 1.903 0.027 . 2 . . . . 119 PRO HG2 . 17124 1
1409 . 1 1 119 119 PRO HG3 H 1 2.037 0.027 . 2 . . . . 119 PRO HG3 . 17124 1
1410 . 1 1 119 119 PRO C C 13 177.100 0.15 . 1 . . . . 119 PRO C . 17124 1
1411 . 1 1 119 119 PRO CA C 13 62.618 0.15 . 1 . . . . 119 PRO CA . 17124 1
1412 . 1 1 119 119 PRO CB C 13 33.095 0.15 . 1 . . . . 119 PRO CB . 17124 1
1413 . 1 1 119 119 PRO CD C 13 50.807 0.15 . 1 . . . . 119 PRO CD . 17124 1
1414 . 1 1 119 119 PRO CG C 13 27.249 0.15 . 1 . . . . 119 PRO CG . 17124 1
1415 . 1 1 120 120 THR H H 1 8.659 0.027 . 1 . . . . 120 THR H . 17124 1
1416 . 1 1 120 120 THR HA H 1 4.556 0.027 . 1 . . . . 120 THR HA . 17124 1
1417 . 1 1 120 120 THR HB H 1 4.073 0.027 . 1 . . . . 120 THR HB . 17124 1
1418 . 1 1 120 120 THR HG21 H 1 1.066 0.027 . 1 . . . . 120 THR QG2 . 17124 1
1419 . 1 1 120 120 THR HG22 H 1 1.066 0.027 . 1 . . . . 120 THR QG2 . 17124 1
1420 . 1 1 120 120 THR HG23 H 1 1.066 0.027 . 1 . . . . 120 THR QG2 . 17124 1
1421 . 1 1 120 120 THR C C 13 174.020 0.15 . 1 . . . . 120 THR C . 17124 1
1422 . 1 1 120 120 THR CA C 13 60.633 0.15 . 1 . . . . 120 THR CA . 17124 1
1423 . 1 1 120 120 THR CB C 13 71.009 0.15 . 1 . . . . 120 THR CB . 17124 1
1424 . 1 1 120 120 THR CG2 C 13 21.474 0.15 . 1 . . . . 120 THR CG2 . 17124 1
1425 . 1 1 120 120 THR N N 15 113.937 0.20 . 1 . . . . 120 THR N . 17124 1
1426 . 1 1 121 121 THR H H 1 8.618 0.027 . 1 . . . . 121 THR H . 17124 1
1427 . 1 1 121 121 THR HA H 1 4.720 0.027 . 1 . . . . 121 THR HA . 17124 1
1428 . 1 1 121 121 THR HB H 1 4.069 0.027 . 1 . . . . 121 THR HB . 17124 1
1429 . 1 1 121 121 THR HG21 H 1 1.258 0.027 . 1 . . . . 121 THR QG2 . 17124 1
1430 . 1 1 121 121 THR HG22 H 1 1.258 0.027 . 1 . . . . 121 THR QG2 . 17124 1
1431 . 1 1 121 121 THR HG23 H 1 1.258 0.027 . 1 . . . . 121 THR QG2 . 17124 1
1432 . 1 1 121 121 THR C C 13 174.372 0.15 . 1 . . . . 121 THR C . 17124 1
1433 . 1 1 121 121 THR CA C 13 62.382 0.15 . 1 . . . . 121 THR CA . 17124 1
1434 . 1 1 121 121 THR CB C 13 70.822 0.15 . 1 . . . . 121 THR CB . 17124 1
1435 . 1 1 121 121 THR CG2 C 13 21.971 0.15 . 1 . . . . 121 THR CG2 . 17124 1
1436 . 1 1 121 121 THR N N 15 119.278 0.20 . 1 . . . . 121 THR N . 17124 1
1437 . 1 1 122 122 GLY H H 1 8.502 0.027 . 1 . . . . 122 GLY H . 17124 1
1438 . 1 1 122 122 GLY HA2 H 1 3.866 0.027 . 2 . . . . 122 GLY HA2 . 17124 1
1439 . 1 1 122 122 GLY HA3 H 1 4.379 0.027 . 2 . . . . 122 GLY HA3 . 17124 1
1440 . 1 1 122 122 GLY C C 13 173.184 0.15 . 1 . . . . 122 GLY C . 17124 1
1441 . 1 1 122 122 GLY CA C 13 44.192 0.15 . 1 . . . . 122 GLY CA . 17124 1
1442 . 1 1 122 122 GLY N N 15 115.832 0.20 . 1 . . . . 122 GLY N . 17124 1
1443 . 1 1 123 123 ASP H H 1 8.308 0.027 . 1 . . . . 123 ASP H . 17124 1
1444 . 1 1 123 123 ASP HA H 1 4.371 0.027 . 1 . . . . 123 ASP HA . 17124 1
1445 . 1 1 123 123 ASP HB2 H 1 2.610 0.027 . 2 . . . . 123 ASP HB2 . 17124 1
1446 . 1 1 123 123 ASP HB3 H 1 2.529 0.027 . 2 . . . . 123 ASP HB3 . 17124 1
1447 . 1 1 123 123 ASP C C 13 176.933 0.15 . 1 . . . . 123 ASP C . 17124 1
1448 . 1 1 123 123 ASP CA C 13 55.963 0.15 . 1 . . . . 123 ASP CA . 17124 1
1449 . 1 1 123 123 ASP CB C 13 40.746 0.15 . 1 . . . . 123 ASP CB . 17124 1
1450 . 1 1 123 123 ASP N N 15 119.551 0.20 . 1 . . . . 123 ASP N . 17124 1
1451 . 1 1 124 124 ALA H H 1 8.510 0.027 . 1 . . . . 124 ALA H . 17124 1
1452 . 1 1 124 124 ALA HA H 1 4.440 0.027 . 1 . . . . 124 ALA HA . 17124 1
1453 . 1 1 124 124 ALA HB1 H 1 1.318 0.027 . 1 . . . . 124 ALA QB . 17124 1
1454 . 1 1 124 124 ALA HB2 H 1 1.318 0.027 . 1 . . . . 124 ALA QB . 17124 1
1455 . 1 1 124 124 ALA HB3 H 1 1.318 0.027 . 1 . . . . 124 ALA QB . 17124 1
1456 . 1 1 124 124 ALA C C 13 176.756 0.15 . 1 . . . . 124 ALA C . 17124 1
1457 . 1 1 124 124 ALA CA C 13 51.864 0.15 . 1 . . . . 124 ALA CA . 17124 1
1458 . 1 1 124 124 ALA CB C 13 20.314 0.15 . 1 . . . . 124 ALA CB . 17124 1
1459 . 1 1 124 124 ALA N N 15 119.758 0.20 . 1 . . . . 124 ALA N . 17124 1
1460 . 1 1 125 125 ASP H H 1 7.558 0.027 . 1 . . . . 125 ASP H . 17124 1
1461 . 1 1 125 125 ASP HA H 1 4.904 0.027 . 1 . . . . 125 ASP HA . 17124 1
1462 . 1 1 125 125 ASP HB2 H 1 2.536 0.027 . 2 . . . . 125 ASP HB2 . 17124 1
1463 . 1 1 125 125 ASP HB3 H 1 2.489 0.027 . 2 . . . . 125 ASP HB3 . 17124 1
1464 . 1 1 125 125 ASP C C 13 173.964 0.15 . 1 . . . . 125 ASP C . 17124 1
1465 . 1 1 125 125 ASP CA C 13 53.144 0.15 . 1 . . . . 125 ASP CA . 17124 1
1466 . 1 1 125 125 ASP CB C 13 43.681 0.15 . 1 . . . . 125 ASP CB . 17124 1
1467 . 1 1 125 125 ASP N N 15 116.881 0.20 . 1 . . . . 125 ASP N . 17124 1
1468 . 1 1 126 126 HIS H H 1 8.912 0.027 . 1 . . . . 126 HIS H . 17124 1
1469 . 1 1 126 126 HIS HA H 1 5.134 0.027 . 1 . . . . 126 HIS HA . 17124 1
1470 . 1 1 126 126 HIS HB2 H 1 3.127 0.027 . 2 . . . . 126 HIS HB2 . 17124 1
1471 . 1 1 126 126 HIS HB3 H 1 2.983 0.027 . 2 . . . . 126 HIS HB3 . 17124 1
1472 . 1 1 126 126 HIS HD2 H 1 7.093 0.027 . 1 . . . . 126 HIS HD2 . 17124 1
1473 . 1 1 126 126 HIS HE1 H 1 8.509 0.027 . 1 . . . . 126 HIS HE1 . 17124 1
1474 . 1 1 126 126 HIS CA C 13 55.037 0.15 . 1 . . . . 126 HIS CA . 17124 1
1475 . 1 1 126 126 HIS CB C 13 31.275 0.15 . 1 . . . . 126 HIS CB . 17124 1
1476 . 1 1 126 126 HIS CD2 C 13 120.131 0.15 . 1 . . . . 126 HIS CD2 . 17124 1
1477 . 1 1 126 126 HIS N N 15 118.411 0.20 . 1 . . . . 126 HIS N . 17124 1
1478 . 1 1 127 127 THR H H 1 8.513 0.027 . 1 . . . . 127 THR H . 17124 1
1479 . 1 1 127 127 THR HA H 1 5.228 0.027 . 1 . . . . 127 THR HA . 17124 1
1480 . 1 1 127 127 THR HB H 1 3.718 0.027 . 1 . . . . 127 THR HB . 17124 1
1481 . 1 1 127 127 THR HG21 H 1 0.770 0.027 . 1 . . . . 127 THR QG2 . 17124 1
1482 . 1 1 127 127 THR HG22 H 1 0.770 0.027 . 1 . . . . 127 THR QG2 . 17124 1
1483 . 1 1 127 127 THR HG23 H 1 0.770 0.027 . 1 . . . . 127 THR QG2 . 17124 1
1484 . 1 1 127 127 THR CA C 13 61.512 0.15 . 1 . . . . 127 THR CA . 17124 1
1485 . 1 1 127 127 THR CB C 13 70.849 0.15 . 1 . . . . 127 THR CB . 17124 1
1486 . 1 1 127 127 THR CG2 C 13 21.378 0.15 . 1 . . . . 127 THR CG2 . 17124 1
1487 . 1 1 127 127 THR N N 15 119.920 0.20 . 1 . . . . 127 THR N . 17124 1
1488 . 1 1 128 128 VAL H H 1 8.606 0.027 . 1 . . . . 128 VAL H . 17124 1
1489 . 1 1 128 128 VAL HA H 1 4.305 0.027 . 1 . . . . 128 VAL HA . 17124 1
1490 . 1 1 128 128 VAL HB H 1 1.763 0.027 . 1 . . . . 128 VAL HB . 17124 1
1491 . 1 1 128 128 VAL HG11 H 1 0.750 0.027 . 2 . . . . 128 VAL QG1 . 17124 1
1492 . 1 1 128 128 VAL HG12 H 1 0.750 0.027 . 2 . . . . 128 VAL QG1 . 17124 1
1493 . 1 1 128 128 VAL HG13 H 1 0.750 0.027 . 2 . . . . 128 VAL QG1 . 17124 1
1494 . 1 1 128 128 VAL HG21 H 1 0.739 0.027 . 2 . . . . 128 VAL QG2 . 17124 1
1495 . 1 1 128 128 VAL HG22 H 1 0.739 0.027 . 2 . . . . 128 VAL QG2 . 17124 1
1496 . 1 1 128 128 VAL HG23 H 1 0.739 0.027 . 2 . . . . 128 VAL QG2 . 17124 1
1497 . 1 1 128 128 VAL CA C 13 59.084 0.15 . 1 . . . . 128 VAL CA . 17124 1
1498 . 1 1 128 128 VAL CB C 13 34.898 0.15 . 1 . . . . 128 VAL CB . 17124 1
1499 . 1 1 128 128 VAL CG1 C 13 20.288 0.15 . 2 . . . . 128 VAL CG1 . 17124 1
1500 . 1 1 128 128 VAL CG2 C 13 21.486 0.15 . 2 . . . . 128 VAL CG2 . 17124 1
1501 . 1 1 128 128 VAL N N 15 125.704 0.20 . 1 . . . . 128 VAL N . 17124 1
1502 . 1 1 129 129 PRO HA H 1 4.998 0.027 . 1 . . . . 129 PRO HA . 17124 1
1503 . 1 1 129 129 PRO HB2 H 1 1.890 0.027 . 2 . . . . 129 PRO HB2 . 17124 1
1504 . 1 1 129 129 PRO HB3 H 1 1.601 0.027 . 2 . . . . 129 PRO HB3 . 17124 1
1505 . 1 1 129 129 PRO HD2 H 1 3.597 0.027 . 2 . . . . 129 PRO HD2 . 17124 1
1506 . 1 1 129 129 PRO HD3 H 1 3.334 0.027 . 2 . . . . 129 PRO HD3 . 17124 1
1507 . 1 1 129 129 PRO HG2 H 1 1.890 0.027 . 2 . . . . 129 PRO QG . 17124 1
1508 . 1 1 129 129 PRO HG3 H 1 1.890 0.027 . 2 . . . . 129 PRO QG . 17124 1
1509 . 1 1 129 129 PRO C C 13 176.353 0.15 . 1 . . . . 129 PRO C . 17124 1
1510 . 1 1 129 129 PRO CA C 13 61.591 0.15 . 1 . . . . 129 PRO CA . 17124 1
1511 . 1 1 129 129 PRO CB C 13 32.054 0.15 . 1 . . . . 129 PRO CB . 17124 1
1512 . 1 1 129 129 PRO CD C 13 51.247 0.15 . 1 . . . . 129 PRO CD . 17124 1
1513 . 1 1 129 129 PRO CG C 13 27.083 0.15 . 1 . . . . 129 PRO CG . 17124 1
1514 . 1 1 130 130 ILE H H 1 8.843 0.027 . 1 . . . . 130 ILE H . 17124 1
1515 . 1 1 130 130 ILE HA H 1 4.744 0.027 . 1 . . . . 130 ILE HA . 17124 1
1516 . 1 1 130 130 ILE HB H 1 1.793 0.027 . 1 . . . . 130 ILE HB . 17124 1
1517 . 1 1 130 130 ILE HD11 H 1 0.613 0.027 . 1 . . . . 130 ILE QD1 . 17124 1
1518 . 1 1 130 130 ILE HD12 H 1 0.613 0.027 . 1 . . . . 130 ILE QD1 . 17124 1
1519 . 1 1 130 130 ILE HD13 H 1 0.613 0.027 . 1 . . . . 130 ILE QD1 . 17124 1
1520 . 1 1 130 130 ILE HG12 H 1 1.450 0.027 . 2 . . . . 130 ILE HG12 . 17124 1
1521 . 1 1 130 130 ILE HG13 H 1 1.000 0.027 . 2 . . . . 130 ILE HG13 . 17124 1
1522 . 1 1 130 130 ILE HG21 H 1 0.727 0.027 . 1 . . . . 130 ILE QG2 . 17124 1
1523 . 1 1 130 130 ILE HG22 H 1 0.727 0.027 . 1 . . . . 130 ILE QG2 . 17124 1
1524 . 1 1 130 130 ILE HG23 H 1 0.727 0.027 . 1 . . . . 130 ILE QG2 . 17124 1
1525 . 1 1 130 130 ILE C C 13 174.914 0.15 . 1 . . . . 130 ILE C . 17124 1
1526 . 1 1 130 130 ILE CA C 13 60.031 0.15 . 1 . . . . 130 ILE CA . 17124 1
1527 . 1 1 130 130 ILE CB C 13 39.838 0.15 . 1 . . . . 130 ILE CB . 17124 1
1528 . 1 1 130 130 ILE CD1 C 13 14.311 0.15 . 1 . . . . 130 ILE CD1 . 17124 1
1529 . 1 1 130 130 ILE CG1 C 13 26.880 0.15 . 1 . . . . 130 ILE CG1 . 17124 1
1530 . 1 1 130 130 ILE CG2 C 13 18.902 0.15 . 1 . . . . 130 ILE CG2 . 17124 1
1531 . 1 1 130 130 ILE N N 15 125.155 0.20 . 1 . . . . 130 ILE N . 17124 1
1532 . 1 1 131 131 SER H H 1 8.638 0.027 . 1 . . . . 131 SER H . 17124 1
1533 . 1 1 131 131 SER HA H 1 5.561 0.027 . 1 . . . . 131 SER HA . 17124 1
1534 . 1 1 131 131 SER HB2 H 1 3.591 0.027 . 2 . . . . 131 SER HB2 . 17124 1
1535 . 1 1 131 131 SER HB3 H 1 3.519 0.027 . 2 . . . . 131 SER HB3 . 17124 1
1536 . 1 1 131 131 SER C C 13 172.116 0.15 . 1 . . . . 131 SER C . 17124 1
1537 . 1 1 131 131 SER CA C 13 56.879 0.15 . 1 . . . . 131 SER CA . 17124 1
1538 . 1 1 131 131 SER CB C 13 67.163 0.15 . 1 . . . . 131 SER CB . 17124 1
1539 . 1 1 131 131 SER N N 15 117.913 0.20 . 1 . . . . 131 SER N . 17124 1
1540 . 1 1 132 132 LEU H H 1 8.913 0.027 . 1 . . . . 132 LEU H . 17124 1
1541 . 1 1 132 132 LEU HA H 1 4.559 0.027 . 1 . . . . 132 LEU HA . 17124 1
1542 . 1 1 132 132 LEU HB2 H 1 2.177 0.027 . 2 . . . . 132 LEU HB2 . 17124 1
1543 . 1 1 132 132 LEU HB3 H 1 1.632 0.027 . 2 . . . . 132 LEU HB3 . 17124 1
1544 . 1 1 132 132 LEU HD11 H 1 0.775 0.027 . 1 . . . . 132 LEU QD1 . 17124 1
1545 . 1 1 132 132 LEU HD12 H 1 0.775 0.027 . 1 . . . . 132 LEU QD1 . 17124 1
1546 . 1 1 132 132 LEU HD13 H 1 0.775 0.027 . 1 . . . . 132 LEU QD1 . 17124 1
1547 . 1 1 132 132 LEU HD21 H 1 1.012 0.027 . 1 . . . . 132 LEU QD2 . 17124 1
1548 . 1 1 132 132 LEU HD22 H 1 1.012 0.027 . 1 . . . . 132 LEU QD2 . 17124 1
1549 . 1 1 132 132 LEU HD23 H 1 1.012 0.027 . 1 . . . . 132 LEU QD2 . 17124 1
1550 . 1 1 132 132 LEU HG H 1 1.903 0.027 . 1 . . . . 132 LEU HG . 17124 1
1551 . 1 1 132 132 LEU C C 13 174.935 0.15 . 1 . . . . 132 LEU C . 17124 1
1552 . 1 1 132 132 LEU CA C 13 54.167 0.15 . 1 . . . . 132 LEU CA . 17124 1
1553 . 1 1 132 132 LEU CB C 13 44.411 0.15 . 1 . . . . 132 LEU CB . 17124 1
1554 . 1 1 132 132 LEU CD1 C 13 27.917 0.15 . 2 . . . . 132 LEU CD1 . 17124 1
1555 . 1 1 132 132 LEU CD2 C 13 25.572 0.15 . 2 . . . . 132 LEU CD2 . 17124 1
1556 . 1 1 132 132 LEU CG C 13 24.955 0.15 . 1 . . . . 132 LEU CG . 17124 1
1557 . 1 1 132 132 LEU N N 15 117.076 0.20 . 1 . . . . 132 LEU N . 17124 1
1558 . 1 1 133 133 GLY H H 1 8.179 0.027 . 1 . . . . 133 GLY H . 17124 1
1559 . 1 1 133 133 GLY HA2 H 1 3.580 0.027 . 2 . . . . 133 GLY HA2 . 17124 1
1560 . 1 1 133 133 GLY HA3 H 1 5.008 0.027 . 2 . . . . 133 GLY HA3 . 17124 1
1561 . 1 1 133 133 GLY C C 13 172.746 0.15 . 1 . . . . 133 GLY C . 17124 1
1562 . 1 1 133 133 GLY CA C 13 44.021 0.15 . 1 . . . . 133 GLY CA . 17124 1
1563 . 1 1 133 133 GLY N N 15 108.976 0.20 . 1 . . . . 133 GLY N . 17124 1
1564 . 1 1 134 134 TYR H H 1 8.498 0.027 . 1 . . . . 134 TYR H . 17124 1
1565 . 1 1 134 134 TYR HA H 1 5.947 0.027 . 1 . . . . 134 TYR HA . 17124 1
1566 . 1 1 134 134 TYR HB2 H 1 3.315 0.027 . 2 . . . . 134 TYR HB2 . 17124 1
1567 . 1 1 134 134 TYR HB3 H 1 2.456 0.027 . 2 . . . . 134 TYR HB3 . 17124 1
1568 . 1 1 134 134 TYR HD1 H 1 6.304 0.027 . 3 . . . . 134 TYR QD . 17124 1
1569 . 1 1 134 134 TYR HD2 H 1 6.304 0.027 . 3 . . . . 134 TYR QD . 17124 1
1570 . 1 1 134 134 TYR HE1 H 1 6.700 0.027 . 3 . . . . 134 TYR QE . 17124 1
1571 . 1 1 134 134 TYR HE2 H 1 6.700 0.027 . 3 . . . . 134 TYR QE . 17124 1
1572 . 1 1 134 134 TYR C C 13 174.075 0.15 . 1 . . . . 134 TYR C . 17124 1
1573 . 1 1 134 134 TYR CA C 13 55.397 0.15 . 1 . . . . 134 TYR CA . 17124 1
1574 . 1 1 134 134 TYR CB C 13 43.181 0.15 . 1 . . . . 134 TYR CB . 17124 1
1575 . 1 1 134 134 TYR CD1 C 13 128.482 0.15 . 3 . . . . 134 TYR CD1 . 17124 1
1576 . 1 1 134 134 TYR CD2 C 13 128.482 0.15 . 3 . . . . 134 TYR CD2 . 17124 1
1577 . 1 1 134 134 TYR CE1 C 13 118.188 0.15 . 3 . . . . 134 TYR CE1 . 17124 1
1578 . 1 1 134 134 TYR CE2 C 13 118.188 0.15 . 3 . . . . 134 TYR CE2 . 17124 1
1579 . 1 1 134 134 TYR N N 15 121.568 0.20 . 1 . . . . 134 TYR N . 17124 1
1580 . 1 1 135 135 ASP H H 1 9.529 0.027 . 1 . . . . 135 ASP H . 17124 1
1581 . 1 1 135 135 ASP HA H 1 5.339 0.027 . 1 . . . . 135 ASP HA . 17124 1
1582 . 1 1 135 135 ASP HB2 H 1 2.914 0.027 . 2 . . . . 135 ASP HB2 . 17124 1
1583 . 1 1 135 135 ASP HB3 H 1 2.672 0.027 . 2 . . . . 135 ASP HB3 . 17124 1
1584 . 1 1 135 135 ASP C C 13 174.690 0.15 . 1 . . . . 135 ASP C . 17124 1
1585 . 1 1 135 135 ASP CA C 13 53.003 0.15 . 1 . . . . 135 ASP CA . 17124 1
1586 . 1 1 135 135 ASP CB C 13 44.414 0.15 . 1 . . . . 135 ASP CB . 17124 1
1587 . 1 1 135 135 ASP N N 15 121.050 0.20 . 1 . . . . 135 ASP N . 17124 1
1588 . 1 1 136 136 VAL H H 1 8.091 0.027 . 1 . . . . 136 VAL H . 17124 1
1589 . 1 1 136 136 VAL HA H 1 5.071 0.027 . 1 . . . . 136 VAL HA . 17124 1
1590 . 1 1 136 136 VAL HB H 1 1.925 0.027 . 1 . . . . 136 VAL HB . 17124 1
1591 . 1 1 136 136 VAL HG11 H 1 0.974 0.027 . 1 . . . . 136 VAL QG1 . 17124 1
1592 . 1 1 136 136 VAL HG12 H 1 0.974 0.027 . 1 . . . . 136 VAL QG1 . 17124 1
1593 . 1 1 136 136 VAL HG13 H 1 0.974 0.027 . 1 . . . . 136 VAL QG1 . 17124 1
1594 . 1 1 136 136 VAL HG21 H 1 0.640 0.027 . 1 . . . . 136 VAL QG2 . 17124 1
1595 . 1 1 136 136 VAL HG22 H 1 0.640 0.027 . 1 . . . . 136 VAL QG2 . 17124 1
1596 . 1 1 136 136 VAL HG23 H 1 0.640 0.027 . 1 . . . . 136 VAL QG2 . 17124 1
1597 . 1 1 136 136 VAL CA C 13 60.858 0.15 . 1 . . . . 136 VAL CA . 17124 1
1598 . 1 1 136 136 VAL CB C 13 35.243 0.15 . 1 . . . . 136 VAL CB . 17124 1
1599 . 1 1 136 136 VAL CG1 C 13 22.202 0.15 . 2 . . . . 136 VAL CG1 . 17124 1
1600 . 1 1 136 136 VAL CG2 C 13 22.438 0.15 . 2 . . . . 136 VAL CG2 . 17124 1
1601 . 1 1 136 136 VAL N N 15 117.484 0.20 . 1 . . . . 136 VAL N . 17124 1
1602 . 1 1 137 137 GLN H H 1 8.691 0.027 . 1 . . . . 137 GLN H . 17124 1
1603 . 1 1 137 137 GLN HA H 1 4.558 0.027 . 1 . . . . 137 GLN HA . 17124 1
1604 . 1 1 137 137 GLN HB2 H 1 1.906 0.027 . 2 . . . . 137 GLN HB2 . 17124 1
1605 . 1 1 137 137 GLN HB3 H 1 1.813 0.027 . 2 . . . . 137 GLN HB3 . 17124 1
1606 . 1 1 137 137 GLN HE21 H 1 7.210 0.027 . 2 . . . . 137 GLN HE21 . 17124 1
1607 . 1 1 137 137 GLN HE22 H 1 6.507 0.027 . 2 . . . . 137 GLN HE22 . 17124 1
1608 . 1 1 137 137 GLN HG2 H 1 2.163 0.027 . 2 . . . . 137 GLN QG . 17124 1
1609 . 1 1 137 137 GLN HG3 H 1 2.163 0.027 . 2 . . . . 137 GLN QG . 17124 1
1610 . 1 1 137 137 GLN CA C 13 54.397 0.15 . 1 . . . . 137 GLN CA . 17124 1
1611 . 1 1 137 137 GLN CB C 13 32.048 0.15 . 1 . . . . 137 GLN CB . 17124 1
1612 . 1 1 137 137 GLN CG C 13 33.588 0.15 . 1 . . . . 137 GLN CG . 17124 1
1613 . 1 1 137 137 GLN N N 15 125.392 0.20 . 1 . . . . 137 GLN N . 17124 1
1614 . 1 1 137 137 GLN NE2 N 15 110.700 0.20 . 1 . . . . 137 GLN NE2 . 17124 1
1615 . 1 1 138 138 PHE H H 1 8.541 0.027 . 1 . . . . 138 PHE H . 17124 1
1616 . 1 1 138 138 PHE HA H 1 4.626 0.027 . 1 . . . . 138 PHE HA . 17124 1
1617 . 1 1 138 138 PHE HB2 H 1 2.829 0.027 . 2 . . . . 138 PHE HB2 . 17124 1
1618 . 1 1 138 138 PHE HB3 H 1 2.977 0.027 . 2 . . . . 138 PHE HB3 . 17124 1
1619 . 1 1 138 138 PHE HD1 H 1 7.129 0.027 . 3 . . . . 138 PHE QD . 17124 1
1620 . 1 1 138 138 PHE HD2 H 1 7.129 0.027 . 3 . . . . 138 PHE QD . 17124 1
1621 . 1 1 138 138 PHE HE1 H 1 6.973 0.027 . 3 . . . . 138 PHE QE . 17124 1
1622 . 1 1 138 138 PHE HE2 H 1 6.973 0.027 . 3 . . . . 138 PHE QE . 17124 1
1623 . 1 1 138 138 PHE CA C 13 57.858 0.15 . 1 . . . . 138 PHE CA . 17124 1
1624 . 1 1 138 138 PHE CB C 13 39.993 0.15 . 1 . . . . 138 PHE CB . 17124 1
1625 . 1 1 138 138 PHE CD1 C 13 131.675 0.15 . 3 . . . . 138 PHE CD1 . 17124 1
1626 . 1 1 138 138 PHE CD2 C 13 131.675 0.15 . 3 . . . . 138 PHE CD2 . 17124 1
1627 . 1 1 138 138 PHE CE1 C 13 129.330 0.15 . 3 . . . . 138 PHE CE1 . 17124 1
1628 . 1 1 138 138 PHE CE2 C 13 129.330 0.15 . 3 . . . . 138 PHE CE2 . 17124 1
1629 . 1 1 138 138 PHE N N 15 121.457 0.20 . 1 . . . . 138 PHE N . 17124 1
1630 . 1 1 139 139 TYR H H 1 8.203 0.027 . 1 . . . . 139 TYR H . 17124 1
1631 . 1 1 139 139 TYR HB2 H 1 2.692 0.027 . 2 . . . . 139 TYR HB2 . 17124 1
1632 . 1 1 139 139 TYR HB3 H 1 2.950 0.027 . 2 . . . . 139 TYR HB3 . 17124 1
1633 . 1 1 139 139 TYR HD1 H 1 6.955 0.027 . 3 . . . . 139 TYR QD . 17124 1
1634 . 1 1 139 139 TYR HD2 H 1 6.955 0.027 . 3 . . . . 139 TYR QD . 17124 1
1635 . 1 1 139 139 TYR HE1 H 1 6.640 0.027 . 3 . . . . 139 TYR QE . 17124 1
1636 . 1 1 139 139 TYR HE2 H 1 6.640 0.027 . 3 . . . . 139 TYR QE . 17124 1
1637 . 1 1 139 139 TYR CB C 13 38.354 0.15 . 1 . . . . 139 TYR CB . 17124 1
1638 . 1 1 139 139 TYR CD1 C 13 133.156 0.15 . 3 . . . . 139 TYR CD1 . 17124 1
1639 . 1 1 139 139 TYR CD2 C 13 133.156 0.15 . 3 . . . . 139 TYR CD2 . 17124 1
1640 . 1 1 139 139 TYR CE1 C 13 117.954 0.15 . 3 . . . . 139 TYR CE1 . 17124 1
1641 . 1 1 139 139 TYR CE2 C 13 117.954 0.15 . 3 . . . . 139 TYR CE2 . 17124 1
1642 . 1 1 139 139 TYR N N 15 122.969 0.20 . 1 . . . . 139 TYR N . 17124 1
1643 . 1 1 140 140 PRO HA H 1 4.332 0.027 . 1 . . . . 140 PRO HA . 17124 1
1644 . 1 1 140 140 PRO CA C 13 63.526 0.15 . 1 . . . . 140 PRO CA . 17124 1
1645 . 1 1 141 141 GLU H H 1 7.909 0.027 . 1 . . . . 141 GLU H . 17124 1
1646 . 1 1 141 141 GLU HA H 1 4.048 0.027 . 1 . . . . 141 GLU HA . 17124 1
1647 . 1 1 141 141 GLU HB2 H 1 1.987 0.027 . 2 . . . . 141 GLU QB . 17124 1
1648 . 1 1 141 141 GLU HB3 H 1 1.987 0.027 . 2 . . . . 141 GLU QB . 17124 1
1649 . 1 1 141 141 GLU HG2 H 1 2.178 0.027 . 2 . . . . 141 GLU QG . 17124 1
1650 . 1 1 141 141 GLU HG3 H 1 2.178 0.027 . 2 . . . . 141 GLU QG . 17124 1
1651 . 1 1 141 141 GLU CA C 13 57.962 0.15 . 1 . . . . 141 GLU CA . 17124 1
1652 . 1 1 141 141 GLU CB C 13 31.173 0.15 . 1 . . . . 141 GLU CB . 17124 1
1653 . 1 1 141 141 GLU CG C 13 36.703 0.15 . 1 . . . . 141 GLU CG . 17124 1
1654 . 1 1 141 141 GLU N N 15 126.557 0.20 . 1 . . . . 141 GLU N . 17124 1
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