data_52980
#######################
# Entry information #
#######################
save_entry_information_1
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information_1
_Entry.ID 52980
_Entry.Title
;
Peptidylprolyl Isomerase Like 1 (PPIL1)
;
_Entry.Type macromolecule
_Entry.Version_type original
_Entry.Submission_date 2025-03-24
_Entry.Accession_date 2025-03-24
_Entry.Last_release_date 2025-03-26
_Entry.Original_release_date 2025-03-26
_Entry.Origination author
_Entry.Format_name .
_Entry.NMR_STAR_version 3.2.14.0
_Entry.NMR_STAR_dict_location .
_Entry.Original_NMR_STAR_version 3.1
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Source_data_format .
_Entry.Source_data_format_version .
_Entry.Generated_software_name .
_Entry.Generated_software_version .
_Entry.Generated_software_ID .
_Entry.Generated_software_label .
_Entry.Generated_date .
_Entry.DOI .
_Entry.UUID .
_Entry.Related_coordinate_file_name .
_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.ORCID
_Entry_author.Entry_ID
1 George Parra . L. Jr. 0000-0002-3822-8583 52980
2 Xu Xiaoping . . . . 52980
3 David Libich . S. . . 52980
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts 1 52980
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
'13C chemical shifts' 411 52980
'15N chemical shifts' 150 52980
'1H chemical shifts' 151 52980
stop_
loop_
_Release.Release_number
_Release.Format_type
_Release.Format_version
_Release.Date
_Release.Submission_date
_Release.Type
_Release.Author
_Release.Detail
_Release.Entry_ID
1 . . 2025-04-02 . original BMRB . 52980
stop_
save_
###############
# Citations #
###############
save_citations_1
_Citation.Sf_category citations
_Citation.Sf_framecode citations_1
_Citation.Entry_ID 52980
_Citation.ID 1
_Citation.Name .
_Citation.Class 'entry citation'
_Citation.CAS_abstract_code .
_Citation.MEDLINE_UI_code .
_Citation.PubMed_ID .
_Citation.DOI .
_Citation.Full_citation .
_Citation.Title
;
The spliceosomal peptidyl prolyl isomerase L1 interacts with the low-complexity domain of the RNA binding protein EWS modulating its phase separation behavior.
;
_Citation.Status 'in preparation'
_Citation.Type journal
_Citation.Journal_abbrev Biochemistry
_Citation.Journal_name_full .
_Citation.Journal_volume .
_Citation.Journal_issue .
_Citation.Journal_ASTM .
_Citation.Journal_ISSN .
_Citation.Journal_CSD .
_Citation.Book_title .
_Citation.Book_chapter_title .
_Citation.Book_volume .
_Citation.Book_series .
_Citation.Book_publisher .
_Citation.Book_publisher_city .
_Citation.Book_ISBN .
_Citation.Conference_title .
_Citation.Conference_site .
_Citation.Conference_state_province .
_Citation.Conference_country .
_Citation.Conference_start_date .
_Citation.Conference_end_date .
_Citation.Conference_abstract_number .
_Citation.Thesis_institution .
_Citation.Thesis_institution_city .
_Citation.Thesis_institution_country .
_Citation.WWW_URL .
_Citation.Page_first .
_Citation.Page_last .
_Citation.Year .
_Citation.Details .
loop_
_Citation_author.Ordinal
_Citation_author.Given_name
_Citation_author.Family_name
_Citation_author.First_initial
_Citation_author.Middle_initials
_Citation_author.Family_title
_Citation_author.ORCID
_Citation_author.Entry_ID
_Citation_author.Citation_ID
1 George Parra . L. Jr. . 52980 1
2 Erich Sohn . . . . 52980 1
3 Xu Xiaoping . . . . 52980 1
4 David Libich . S. . . 52980 1
stop_
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_assembly_1
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly_1
_Assembly.Entry_ID 52980
_Assembly.ID 1
_Assembly.Name PPIL1
_Assembly.BMRB_code .
_Assembly.Number_of_components 1
_Assembly.Organic_ligands 0
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds no
_Assembly.Ambiguous_conformational_states no
_Assembly.Ambiguous_chem_comp_sites .
_Assembly.Molecules_in_chemical_exchange no
_Assembly.Paramagnetic no
_Assembly.Thiol_state .
_Assembly.Molecular_mass 18236.83
_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 PPIL1 1 $entity_1 . . yes native no no . . . 52980 1
stop_
save_
####################################
# Biological polymers and ligands #
####################################
save_entity_1
_Entity.Sf_category entity
_Entity.Sf_framecode entity_1
_Entity.Entry_ID 52980
_Entity.ID 1
_Entity.BMRB_code .
_Entity.Name entity_1
_Entity.Type polymer
_Entity.Polymer_common_type .
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_type_details .
_Entity.Polymer_strand_ID .
_Entity.Polymer_seq_one_letter_code_can .
_Entity.Polymer_seq_one_letter_code
;
MAAIPPDSWQPPNVYLETSM
GIIVLELYWKHAPKTCKNFA
ELARRGYYNGTKFHRIIKDF
MIQGGDPTGTGRGGASIYGK
QFEDELHPDLKFTGAGILAM
ANAGPDTNGSQFFVTLAPTQ
WLDGKHTIFGRVCQGIGMVN
RVGMVETNSQDRPVDDVKII
KAYPSG
;
_Entity.Target_identifier .
_Entity.Polymer_author_defined_seq .
_Entity.Polymer_author_seq_details .
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites yes
_Entity.Nstd_monomer no
_Entity.Nstd_chirality no
_Entity.Nstd_linkage no
_Entity.Nonpolymer_comp_ID .
_Entity.Nonpolymer_comp_label .
_Entity.Number_of_monomers 166
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state 'all free'
_Entity.Src_method .
_Entity.Parent_entity_ID 1
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight .
_Entity.Formula_weight_exptl .
_Entity.Formula_weight_exptl_meth .
_Entity.Details .
_Entity.DB_query_date .
_Entity.DB_query_revised_last_date .
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 . MET . 52980 1
2 . ALA . 52980 1
3 . ALA . 52980 1
4 . ILE . 52980 1
5 . PRO . 52980 1
6 . PRO . 52980 1
7 . ASP . 52980 1
8 . SER . 52980 1
9 . TRP . 52980 1
10 . GLN . 52980 1
11 . PRO . 52980 1
12 . PRO . 52980 1
13 . ASN . 52980 1
14 . VAL . 52980 1
15 . TYR . 52980 1
16 . LEU . 52980 1
17 . GLU . 52980 1
18 . THR . 52980 1
19 . SER . 52980 1
20 . MET . 52980 1
21 . GLY . 52980 1
22 . ILE . 52980 1
23 . ILE . 52980 1
24 . VAL . 52980 1
25 . LEU . 52980 1
26 . GLU . 52980 1
27 . LEU . 52980 1
28 . TYR . 52980 1
29 . TRP . 52980 1
30 . LYS . 52980 1
31 . HIS . 52980 1
32 . ALA . 52980 1
33 . PRO . 52980 1
34 . LYS . 52980 1
35 . THR . 52980 1
36 . CYS . 52980 1
37 . LYS . 52980 1
38 . ASN . 52980 1
39 . PHE . 52980 1
40 . ALA . 52980 1
41 . GLU . 52980 1
42 . LEU . 52980 1
43 . ALA . 52980 1
44 . ARG . 52980 1
45 . ARG . 52980 1
46 . GLY . 52980 1
47 . TYR . 52980 1
48 . TYR . 52980 1
49 . ASN . 52980 1
50 . GLY . 52980 1
51 . THR . 52980 1
52 . LYS . 52980 1
53 . PHE . 52980 1
54 . HIS . 52980 1
55 . ARG . 52980 1
56 . ILE . 52980 1
57 . ILE . 52980 1
58 . LYS . 52980 1
59 . ASP . 52980 1
60 . PHE . 52980 1
61 . MET . 52980 1
62 . ILE . 52980 1
63 . GLN . 52980 1
64 . GLY . 52980 1
65 . GLY . 52980 1
66 . ASP . 52980 1
67 . PRO . 52980 1
68 . THR . 52980 1
69 . GLY . 52980 1
70 . THR . 52980 1
71 . GLY . 52980 1
72 . ARG . 52980 1
73 . GLY . 52980 1
74 . GLY . 52980 1
75 . ALA . 52980 1
76 . SER . 52980 1
77 . ILE . 52980 1
78 . TYR . 52980 1
79 . GLY . 52980 1
80 . LYS . 52980 1
81 . GLN . 52980 1
82 . PHE . 52980 1
83 . GLU . 52980 1
84 . ASP . 52980 1
85 . GLU . 52980 1
86 . LEU . 52980 1
87 . HIS . 52980 1
88 . PRO . 52980 1
89 . ASP . 52980 1
90 . LEU . 52980 1
91 . LYS . 52980 1
92 . PHE . 52980 1
93 . THR . 52980 1
94 . GLY . 52980 1
95 . ALA . 52980 1
96 . GLY . 52980 1
97 . ILE . 52980 1
98 . LEU . 52980 1
99 . ALA . 52980 1
100 . MET . 52980 1
101 . ALA . 52980 1
102 . ASN . 52980 1
103 . ALA . 52980 1
104 . GLY . 52980 1
105 . PRO . 52980 1
106 . ASP . 52980 1
107 . THR . 52980 1
108 . ASN . 52980 1
109 . GLY . 52980 1
110 . SER . 52980 1
111 . GLN . 52980 1
112 . PHE . 52980 1
113 . PHE . 52980 1
114 . VAL . 52980 1
115 . THR . 52980 1
116 . LEU . 52980 1
117 . ALA . 52980 1
118 . PRO . 52980 1
119 . THR . 52980 1
120 . GLN . 52980 1
121 . TRP . 52980 1
122 . LEU . 52980 1
123 . ASP . 52980 1
124 . GLY . 52980 1
125 . LYS . 52980 1
126 . HIS . 52980 1
127 . THR . 52980 1
128 . ILE . 52980 1
129 . PHE . 52980 1
130 . GLY . 52980 1
131 . ARG . 52980 1
132 . VAL . 52980 1
133 . CYS . 52980 1
134 . GLN . 52980 1
135 . GLY . 52980 1
136 . ILE . 52980 1
137 . GLY . 52980 1
138 . MET . 52980 1
139 . VAL . 52980 1
140 . ASN . 52980 1
141 . ARG . 52980 1
142 . VAL . 52980 1
143 . GLY . 52980 1
144 . MET . 52980 1
145 . VAL . 52980 1
146 . GLU . 52980 1
147 . THR . 52980 1
148 . ASN . 52980 1
149 . SER . 52980 1
150 . GLN . 52980 1
151 . ASP . 52980 1
152 . ARG . 52980 1
153 . PRO . 52980 1
154 . VAL . 52980 1
155 . ASP . 52980 1
156 . ASP . 52980 1
157 . VAL . 52980 1
158 . LYS . 52980 1
159 . ILE . 52980 1
160 . ILE . 52980 1
161 . LYS . 52980 1
162 . ALA . 52980 1
163 . TYR . 52980 1
164 . PRO . 52980 1
165 . SER . 52980 1
166 . GLY . 52980 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
. MET 1 1 52980 1
. ALA 2 2 52980 1
. ALA 3 3 52980 1
. ILE 4 4 52980 1
. PRO 5 5 52980 1
. PRO 6 6 52980 1
. ASP 7 7 52980 1
. SER 8 8 52980 1
. TRP 9 9 52980 1
. GLN 10 10 52980 1
. PRO 11 11 52980 1
. PRO 12 12 52980 1
. ASN 13 13 52980 1
. VAL 14 14 52980 1
. TYR 15 15 52980 1
. LEU 16 16 52980 1
. GLU 17 17 52980 1
. THR 18 18 52980 1
. SER 19 19 52980 1
. MET 20 20 52980 1
. GLY 21 21 52980 1
. ILE 22 22 52980 1
. ILE 23 23 52980 1
. VAL 24 24 52980 1
. LEU 25 25 52980 1
. GLU 26 26 52980 1
. LEU 27 27 52980 1
. TYR 28 28 52980 1
. TRP 29 29 52980 1
. LYS 30 30 52980 1
. HIS 31 31 52980 1
. ALA 32 32 52980 1
. PRO 33 33 52980 1
. LYS 34 34 52980 1
. THR 35 35 52980 1
. CYS 36 36 52980 1
. LYS 37 37 52980 1
. ASN 38 38 52980 1
. PHE 39 39 52980 1
. ALA 40 40 52980 1
. GLU 41 41 52980 1
. LEU 42 42 52980 1
. ALA 43 43 52980 1
. ARG 44 44 52980 1
. ARG 45 45 52980 1
. GLY 46 46 52980 1
. TYR 47 47 52980 1
. TYR 48 48 52980 1
. ASN 49 49 52980 1
. GLY 50 50 52980 1
. THR 51 51 52980 1
. LYS 52 52 52980 1
. PHE 53 53 52980 1
. HIS 54 54 52980 1
. ARG 55 55 52980 1
. ILE 56 56 52980 1
. ILE 57 57 52980 1
. LYS 58 58 52980 1
. ASP 59 59 52980 1
. PHE 60 60 52980 1
. MET 61 61 52980 1
. ILE 62 62 52980 1
. GLN 63 63 52980 1
. GLY 64 64 52980 1
. GLY 65 65 52980 1
. ASP 66 66 52980 1
. PRO 67 67 52980 1
. THR 68 68 52980 1
. GLY 69 69 52980 1
. THR 70 70 52980 1
. GLY 71 71 52980 1
. ARG 72 72 52980 1
. GLY 73 73 52980 1
. GLY 74 74 52980 1
. ALA 75 75 52980 1
. SER 76 76 52980 1
. ILE 77 77 52980 1
. TYR 78 78 52980 1
. GLY 79 79 52980 1
. LYS 80 80 52980 1
. GLN 81 81 52980 1
. PHE 82 82 52980 1
. GLU 83 83 52980 1
. ASP 84 84 52980 1
. GLU 85 85 52980 1
. LEU 86 86 52980 1
. HIS 87 87 52980 1
. PRO 88 88 52980 1
. ASP 89 89 52980 1
. LEU 90 90 52980 1
. LYS 91 91 52980 1
. PHE 92 92 52980 1
. THR 93 93 52980 1
. GLY 94 94 52980 1
. ALA 95 95 52980 1
. GLY 96 96 52980 1
. ILE 97 97 52980 1
. LEU 98 98 52980 1
. ALA 99 99 52980 1
. MET 100 100 52980 1
. ALA 101 101 52980 1
. ASN 102 102 52980 1
. ALA 103 103 52980 1
. GLY 104 104 52980 1
. PRO 105 105 52980 1
. ASP 106 106 52980 1
. THR 107 107 52980 1
. ASN 108 108 52980 1
. GLY 109 109 52980 1
. SER 110 110 52980 1
. GLN 111 111 52980 1
. PHE 112 112 52980 1
. PHE 113 113 52980 1
. VAL 114 114 52980 1
. THR 115 115 52980 1
. LEU 116 116 52980 1
. ALA 117 117 52980 1
. PRO 118 118 52980 1
. THR 119 119 52980 1
. GLN 120 120 52980 1
. TRP 121 121 52980 1
. LEU 122 122 52980 1
. ASP 123 123 52980 1
. GLY 124 124 52980 1
. LYS 125 125 52980 1
. HIS 126 126 52980 1
. THR 127 127 52980 1
. ILE 128 128 52980 1
. PHE 129 129 52980 1
. GLY 130 130 52980 1
. ARG 131 131 52980 1
. VAL 132 132 52980 1
. CYS 133 133 52980 1
. GLN 134 134 52980 1
. GLY 135 135 52980 1
. ILE 136 136 52980 1
. GLY 137 137 52980 1
. MET 138 138 52980 1
. VAL 139 139 52980 1
. ASN 140 140 52980 1
. ARG 141 141 52980 1
. VAL 142 142 52980 1
. GLY 143 143 52980 1
. MET 144 144 52980 1
. VAL 145 145 52980 1
. GLU 146 146 52980 1
. THR 147 147 52980 1
. ASN 148 148 52980 1
. SER 149 149 52980 1
. GLN 150 150 52980 1
. ASP 151 151 52980 1
. ARG 152 152 52980 1
. PRO 153 153 52980 1
. VAL 154 154 52980 1
. ASP 155 155 52980 1
. ASP 156 156 52980 1
. VAL 157 157 52980 1
. LYS 158 158 52980 1
. ILE 159 159 52980 1
. ILE 160 160 52980 1
. LYS 161 161 52980 1
. ALA 162 162 52980 1
. TYR 163 163 52980 1
. PRO 164 164 52980 1
. SER 165 165 52980 1
. GLY 166 166 52980 1
stop_
save_
####################
# Natural source #
####################
save_natural_source_1
_Entity_natural_src_list.Sf_category natural_source
_Entity_natural_src_list.Sf_framecode natural_source_1
_Entity_natural_src_list.Entry_ID 52980
_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.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.Secretion
_Entity_natural_src.Plasmid
_Entity_natural_src.Gene_mnemonic
_Entity_natural_src.Details
_Entity_natural_src.Entry_ID
_Entity_natural_src.Entity_natural_src_list_ID
1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 52980 1
stop_
save_
#########################
# Experimental source #
#########################
save_experimental_source_1
_Entity_experimental_src_list.Sf_category experimental_source
_Entity_experimental_src_list.Sf_framecode experimental_source_1
_Entity_experimental_src_list.Entry_ID 52980
_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_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.Details
_Entity_experimental_src.Entry_ID
_Entity_experimental_src.Entity_experimental_src_list_ID
1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pAG8Ha . . . 52980 1
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Sample.Sf_category sample
_Sample.Sf_framecode sample_1
_Sample.Entry_ID 52980
_Sample.ID 1
_Sample.Name 15N-13C-PPIL1
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details '100 uM 15N, 13C -labeled PPIL1 in 20 mM, 20 mM MES pH 6.3, 1 mM PMSF, 1mM TCEP, 5% D2O'
_Sample.Aggregate_sample_number 1
_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 'Peptidylprolyl Isomerase Like-1' '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 100 . . uM . . . . 52980 1
2 D2O '[U-99% 2H]' . . . . . . 5 . . % . . . . 52980 1
3 PMSF 'natural abundance' . . . . . . 1 . . mM . . . . 52980 1
4 TCEP 'natural abundance' . . . . . . 1 . . mM . . . . 52980 1
5 MES 'natural abundance' . . . . . . 20 . . mM . . . . 52980 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 52980
_Sample_condition_list.ID 1
_Sample_condition_list.Name 'Assignment Conditions'
_Sample_condition_list.Details .
loop_
_Sample_condition_variable.Type
_Sample_condition_variable.Val
_Sample_condition_variable.Val_err
_Sample_condition_variable.Val_units
_Sample_condition_variable.Entry_ID
_Sample_condition_variable.Sample_condition_list_ID
pH 6.5 . pH 52980 1
pressure 1 . atm 52980 1
temperature 298 . K 52980 1
stop_
save_
############################
# Computer software used #
############################
save_software_1
_Software.Sf_category software
_Software.Sf_framecode software_1
_Software.Entry_ID 52980
_Software.ID 1
_Software.Type .
_Software.Name CcpNMR
_Software.Version .
_Software.DOI .
_Software.Details .
loop_
_Task.Task
_Task.Software_module
_Task.Entry_ID
_Task.Software_ID
'chemical shift assignment' . 52980 1
stop_
save_
save_software_2
_Software.Sf_category software
_Software.Sf_framecode software_2
_Software.Entry_ID 52980
_Software.ID 2
_Software.Type .
_Software.Name TOPSPIN
_Software.Version .
_Software.DOI .
_Software.Details .
loop_
_Task.Task
_Task.Software_module
_Task.Entry_ID
_Task.Software_ID
collection . 52980 2
stop_
save_
save_software_3
_Software.Sf_category software
_Software.Sf_framecode software_3
_Software.Entry_ID 52980
_Software.ID 3
_Software.Type .
_Software.Name NMRDraw
_Software.Version .
_Software.DOI .
_Software.Details .
loop_
_Task.Task
_Task.Software_module
_Task.Entry_ID
_Task.Software_ID
refinement . 52980 3
stop_
save_
save_software_4
_Software.Sf_category software
_Software.Sf_framecode software_4
_Software.Entry_ID 52980
_Software.ID 4
_Software.Type .
_Software.Name NMRPipe
_Software.Version .
_Software.DOI .
_Software.Details .
loop_
_Task.Task
_Task.Software_module
_Task.Entry_ID
_Task.Software_ID
processing . 52980 4
stop_
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_NMR_spectrometer_1
_NMR_spectrometer.Sf_category NMR_spectrometer
_NMR_spectrometer.Sf_framecode NMR_spectrometer_1
_NMR_spectrometer.Entry_ID 52980
_NMR_spectrometer.ID 1
_NMR_spectrometer.Name 'Bruker Avance 700 MHz'
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model Avance
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 700
save_
#############################
# NMR applied experiments #
#############################
save_experiment_list_1
_Experiment_list.Sf_category experiment_list
_Experiment_list.Sf_framecode experiment_list_1
_Experiment_list.Entry_ID 52980
_Experiment_list.ID 1
_Experiment_list.Details .
loop_
_Experiment.ID
_Experiment.Name
_Experiment.Raw_data_flag
_Experiment.NUS_flag
_Experiment.Interleaved_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.Details
_Experiment.Entry_ID
_Experiment.Experiment_list_ID
1 '2D 1H-15N HSQC' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52980 1
2 '3D HNCO' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52980 1
3 '3D CBCACONH' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52980 1
4 '3D HNCACB' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52980 1
5 '3D HNCACO' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52980 1
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_chem_shift_reference_1
_Chem_shift_reference.Sf_category chem_shift_reference
_Chem_shift_reference.Sf_framecode chem_shift_reference_1
_Chem_shift_reference.Entry_ID 52980
_Chem_shift_reference.ID 1
_Chem_shift_reference.Name chemical_shift_reference
_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.Ref_correction_type
_Chem_shift_ref.Correction_val
_Chem_shift_ref.Entry_ID
_Chem_shift_ref.Chem_shift_reference_ID
C 13 water protons . . . . ppm 8.210 internal indirect . . . . . . 52980 1
H 1 water protons . . . . ppm 42.928 internal direct 1 . . . . . 52980 1
N 15 water protons . . . . ppm 118.771 internal indirect . . . . . . 52980 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_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 52980
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name assigned_chemical_shifts
_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 $chem_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
2 '3D HNCO' . . . 52980 1
3 '3D CBCACONH' . . . 52980 1
4 '3D HNCACB' . . . 52980 1
5 '3D HNCACO' . . . 52980 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 52980 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID
_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 MET H H 1 8.343135192 . . 1 . . . . . 1 MET H . 52980 1
2 . 1 . 1 1 1 MET C C 13 172.9670846 . . 1 . . . . . 1 MET C . 52980 1
3 . 1 . 1 1 1 MET CA C 13 52.5494942 . . 1 . . . . . 1 MET CA . 52980 1
4 . 1 . 1 1 1 MET CB C 13 30.46755433 . . 1 . . . . . 1 MET CB . 52980 1
5 . 1 . 1 1 1 MET N N 15 120.2049273 . . 1 . . . . . 1 MET N . 52980 1
6 . 1 . 1 2 2 ALA H H 1 8.188519475 0.00044198 . 1 . . . . . 2 ALA H . 52980 1
7 . 1 . 1 2 2 ALA C C 13 173.9913922 . . 1 . . . . . 2 ALA C . 52980 1
8 . 1 . 1 2 2 ALA CA C 13 49.42757567 . . 1 . . . . . 2 ALA CA . 52980 1
9 . 1 . 1 2 2 ALA CB C 13 16.38736334 . . 1 . . . . . 2 ALA CB . 52980 1
10 . 1 . 1 2 2 ALA N N 15 125.9528098 0.000084667 . 1 . . . . . 2 ALA N . 52980 1
11 . 1 . 1 3 3 ALA H H 1 7.749812833 . . 1 . . . . . 3 ALA H . 52980 1
12 . 1 . 1 3 3 ALA C C 13 179.7373363 . . 1 . . . . . 3 ALA C . 52980 1
13 . 1 . 1 3 3 ALA CA C 13 50.98215451 . . 1 . . . . . 3 ALA CA . 52980 1
14 . 1 . 1 3 3 ALA CB C 13 17.51751771 . . 1 . . . . . 3 ALA CB . 52980 1
15 . 1 . 1 3 3 ALA N N 15 129.2116427 . . 1 . . . . . 3 ALA N . 52980 1
16 . 1 . 1 7 7 ASP H H 1 8.964364737 . . 1 . . . . . 7 ASP H . 52980 1
17 . 1 . 1 7 7 ASP C C 13 173.0535946 . . 1 . . . . . 7 ASP C . 52980 1
18 . 1 . 1 7 7 ASP CA C 13 53.94561066 . . 1 . . . . . 7 ASP CA . 52980 1
19 . 1 . 1 8 8 SER H H 1 7.437489057 . . 1 . . . . . 8 SER H . 52980 1
20 . 1 . 1 8 8 SER C C 13 171.2449665 . . 1 . . . . . 8 SER C . 52980 1
21 . 1 . 1 8 8 SER CA C 13 55.75392023 . . 1 . . . . . 8 SER CA . 52980 1
22 . 1 . 1 8 8 SER CB C 13 60.09022098 . . 1 . . . . . 8 SER CB . 52980 1
23 . 1 . 1 8 8 SER N N 15 109.7315093 . . 1 . . . . . 8 SER N . 52980 1
24 . 1 . 1 9 9 TRP H H 1 7.420390804 . . 1 . . . . . 9 TRP H . 52980 1
25 . 1 . 1 9 9 TRP C C 13 181.3196604 . . 1 . . . . . 9 TRP C . 52980 1
26 . 1 . 1 9 9 TRP CB C 13 24.19338888 . . 1 . . . . . 9 TRP CB . 52980 1
27 . 1 . 1 9 9 TRP N N 15 126.3711167 . . 1 . . . . . 9 TRP N . 52980 1
28 . 1 . 1 10 10 GLN H H 1 7.557158257 . . 1 . . . . . 10 GLN H . 52980 1
29 . 1 . 1 10 10 GLN C C 13 180.8224365 . . 1 . . . . . 10 GLN C . 52980 1
30 . 1 . 1 10 10 GLN CA C 13 48.74071837 . . 1 . . . . . 10 GLN CA . 52980 1
31 . 1 . 1 10 10 GLN CB C 13 25.97575358 . . 1 . . . . . 10 GLN CB . 52980 1
32 . 1 . 1 10 10 GLN N N 15 123.4949071 . . 1 . . . . . 10 GLN N . 52980 1
33 . 1 . 1 13 13 ASN H H 1 7.590230424 . . 1 . . . . . 13 ASN H . 52980 1
34 . 1 . 1 13 13 ASN C C 13 171.6341848 . . 1 . . . . . 13 ASN C . 52980 1
35 . 1 . 1 13 13 ASN CA C 13 48.7348529 . . 1 . . . . . 13 ASN CA . 52980 1
36 . 1 . 1 13 13 ASN CB C 13 41.59070267 . . 1 . . . . . 13 ASN CB . 52980 1
37 . 1 . 1 13 13 ASN N N 15 110.161248 . . 1 . . . . . 13 ASN N . 52980 1
38 . 1 . 1 14 14 VAL H H 1 8.003495617 . . 1 . . . . . 14 VAL H . 52980 1
39 . 1 . 1 14 14 VAL C C 13 170.3989066 . . 1 . . . . . 14 VAL C . 52980 1
40 . 1 . 1 14 14 VAL CA C 13 59.12239779 . . 1 . . . . . 14 VAL CA . 52980 1
41 . 1 . 1 14 14 VAL CB C 13 33.85052194 . . 1 . . . . . 14 VAL CB . 52980 1
42 . 1 . 1 14 14 VAL N N 15 116.7430075 . . 1 . . . . . 14 VAL N . 52980 1
43 . 1 . 1 15 15 TYR H H 1 8.774734426 . . 1 . . . . . 15 TYR H . 52980 1
44 . 1 . 1 15 15 TYR C C 13 171.6455507 . . 1 . . . . . 15 TYR C . 52980 1
45 . 1 . 1 15 15 TYR CA C 13 54.77550041 . . 1 . . . . . 15 TYR CA . 52980 1
46 . 1 . 1 15 15 TYR CB C 13 37.14174453 . . 1 . . . . . 15 TYR CB . 52980 1
47 . 1 . 1 15 15 TYR N N 15 128.0665952 . . 1 . . . . . 15 TYR N . 52980 1
48 . 1 . 1 16 16 LEU H H 1 9.089057383 . . 1 . . . . . 16 LEU H . 52980 1
49 . 1 . 1 16 16 LEU C C 13 172.4109267 . . 1 . . . . . 16 LEU C . 52980 1
50 . 1 . 1 16 16 LEU CA C 13 50.3430613 . . 1 . . . . . 16 LEU CA . 52980 1
51 . 1 . 1 16 16 LEU CB C 13 40.47680042 . . 1 . . . . . 16 LEU CB . 52980 1
52 . 1 . 1 16 16 LEU N N 15 119.0398833 . . 1 . . . . . 16 LEU N . 52980 1
53 . 1 . 1 17 17 GLU H H 1 9.302695484 . . 1 . . . . . 17 GLU H . 52980 1
54 . 1 . 1 17 17 GLU C C 13 173.1731061 . . 1 . . . . . 17 GLU C . 52980 1
55 . 1 . 1 17 17 GLU CA C 13 53.57680401 . . 1 . . . . . 17 GLU CA . 52980 1
56 . 1 . 1 17 17 GLU CB C 13 25.73065014 . . 1 . . . . . 17 GLU CB . 52980 1
57 . 1 . 1 17 17 GLU N N 15 123.9390396 . . 1 . . . . . 17 GLU N . 52980 1
58 . 1 . 1 18 18 THR H H 1 7.974406915 . . 1 . . . . . 18 THR H . 52980 1
59 . 1 . 1 18 18 THR C C 13 174.2078222 . . 1 . . . . . 18 THR C . 52980 1
60 . 1 . 1 18 18 THR CA C 13 57.83800514 . . 1 . . . . . 18 THR CA . 52980 1
61 . 1 . 1 18 18 THR CB C 13 70.4697335 . . 1 . . . . . 18 THR CB . 52980 1
62 . 1 . 1 18 18 THR N N 15 115.3262293 . . 1 . . . . . 18 THR N . 52980 1
63 . 1 . 1 19 19 SER H H 1 9.40584853 . . 1 . . . . . 19 SER H . 52980 1
64 . 1 . 1 19 19 SER CA C 13 58.11160001 . . 1 . . . . . 19 SER CA . 52980 1
65 . 1 . 1 19 19 SER N N 15 115.7326016 . . 1 . . . . . 19 SER N . 52980 1
66 . 1 . 1 20 20 MET H H 1 8.140516341 . . 1 . . . . . 20 MET H . 52980 1
67 . 1 . 1 20 20 MET CA C 13 52.74754609 . . 1 . . . . . 20 MET CA . 52980 1
68 . 1 . 1 20 20 MET CB C 13 31.52444654 . . 1 . . . . . 20 MET CB . 52980 1
69 . 1 . 1 20 20 MET N N 15 118.5588011 . . 1 . . . . . 20 MET N . 52980 1
70 . 1 . 1 21 21 GLY H H 1 7.102051779 . . 1 . . . . . 21 GLY H . 52980 1
71 . 1 . 1 21 21 GLY C C 13 172.1553409 . . 1 . . . . . 21 GLY C . 52980 1
72 . 1 . 1 21 21 GLY CA C 13 41.27390133 . . 1 . . . . . 21 GLY CA . 52980 1
73 . 1 . 1 21 21 GLY N N 15 106.1685737 . . 1 . . . . . 21 GLY N . 52980 1
74 . 1 . 1 22 22 ILE H H 1 8.66877498 . . 1 . . . . . 22 ILE H . 52980 1
75 . 1 . 1 22 22 ILE C C 13 172.0131127 . . 1 . . . . . 22 ILE C . 52980 1
76 . 1 . 1 22 22 ILE CA C 13 59.42528425 . . 1 . . . . . 22 ILE CA . 52980 1
77 . 1 . 1 22 22 ILE CB C 13 36.33638835 . . 1 . . . . . 22 ILE CB . 52980 1
78 . 1 . 1 22 22 ILE N N 15 123.2325863 . . 1 . . . . . 22 ILE N . 52980 1
79 . 1 . 1 23 23 ILE H H 1 8.852670691 . . 1 . . . . . 23 ILE H . 52980 1
80 . 1 . 1 23 23 ILE C C 13 171.0932783 . . 1 . . . . . 23 ILE C . 52980 1
81 . 1 . 1 23 23 ILE CA C 13 57.60534662 . . 1 . . . . . 23 ILE CA . 52980 1
82 . 1 . 1 23 23 ILE CB C 13 39.49105438 . . 1 . . . . . 23 ILE CB . 52980 1
83 . 1 . 1 23 23 ILE N N 15 127.4976882 . . 1 . . . . . 23 ILE N . 52980 1
84 . 1 . 1 24 24 VAL H H 1 8.539554595 . . 1 . . . . . 24 VAL H . 52980 1
85 . 1 . 1 24 24 VAL C C 13 171.8722457 . . 1 . . . . . 24 VAL C . 52980 1
86 . 1 . 1 24 24 VAL CA C 13 58.81722313 . . 1 . . . . . 24 VAL CA . 52980 1
87 . 1 . 1 24 24 VAL CB C 13 29.59416 . . 1 . . . . . 24 VAL CB . 52980 1
88 . 1 . 1 24 24 VAL N N 15 125.403641 . . 1 . . . . . 24 VAL N . 52980 1
89 . 1 . 1 25 25 LEU H H 1 8.874928024 . . 1 . . . . . 25 LEU H . 52980 1
90 . 1 . 1 25 25 LEU C C 13 173.4825546 . . 1 . . . . . 25 LEU C . 52980 1
91 . 1 . 1 25 25 LEU CA C 13 49.9073739 . . 1 . . . . . 25 LEU CA . 52980 1
92 . 1 . 1 25 25 LEU CB C 13 40.15952923 . . 1 . . . . . 25 LEU CB . 52980 1
93 . 1 . 1 25 25 LEU N N 15 127.2915908 . . 1 . . . . . 25 LEU N . 52980 1
94 . 1 . 1 26 26 GLU H H 1 9.22301089 . . 1 . . . . . 26 GLU H . 52980 1
95 . 1 . 1 26 26 GLU C C 13 171.5779017 . . 1 . . . . . 26 GLU C . 52980 1
96 . 1 . 1 26 26 GLU CA C 13 51.77153554 . . 1 . . . . . 26 GLU CA . 52980 1
97 . 1 . 1 26 26 GLU CB C 13 29.62745669 . . 1 . . . . . 26 GLU CB . 52980 1
98 . 1 . 1 26 26 GLU N N 15 124.9761169 . . 1 . . . . . 26 GLU N . 52980 1
99 . 1 . 1 27 27 LEU H H 1 7.455483726 . . 1 . . . . . 27 LEU H . 52980 1
100 . 1 . 1 27 27 LEU C C 13 174.6118844 . . 1 . . . . . 27 LEU C . 52980 1
101 . 1 . 1 27 27 LEU CA C 13 51.07644066 . . 1 . . . . . 27 LEU CA . 52980 1
102 . 1 . 1 27 27 LEU CB C 13 39.45821042 . . 1 . . . . . 27 LEU CB . 52980 1
103 . 1 . 1 27 27 LEU N N 15 122.8535261 . . 1 . . . . . 27 LEU N . 52980 1
104 . 1 . 1 28 28 TYR H H 1 8.417390409 . . 1 . . . . . 28 TYR H . 52980 1
105 . 1 . 1 28 28 TYR C C 13 173.4688234 . . 1 . . . . . 28 TYR C . 52980 1
106 . 1 . 1 28 28 TYR CB C 13 32.35986344 . . 1 . . . . . 28 TYR CB . 52980 1
107 . 1 . 1 28 28 TYR N N 15 125.188533 . . 1 . . . . . 28 TYR N . 52980 1
108 . 1 . 1 29 29 TRP H H 1 7.270984148 . . 1 . . . . . 29 TRP H . 52980 1
109 . 1 . 1 29 29 TRP C C 13 175.4124111 . . 1 . . . . . 29 TRP C . 52980 1
110 . 1 . 1 29 29 TRP CA C 13 58.61625315 . . 1 . . . . . 29 TRP CA . 52980 1
111 . 1 . 1 29 29 TRP CB C 13 27.41947469 . . 1 . . . . . 29 TRP CB . 52980 1
112 . 1 . 1 29 29 TRP N N 15 123.6487302 . . 1 . . . . . 29 TRP N . 52980 1
113 . 1 . 1 30 30 LYS H H 1 8.636206261 . . 1 . . . . . 30 LYS H . 52980 1
114 . 1 . 1 30 30 LYS C C 13 174.9798078 . . 1 . . . . . 30 LYS C . 52980 1
115 . 1 . 1 30 30 LYS CA C 13 55.00441611 . . 1 . . . . . 30 LYS CA . 52980 1
116 . 1 . 1 30 30 LYS CB C 13 28.82577345 . . 1 . . . . . 30 LYS CB . 52980 1
117 . 1 . 1 30 30 LYS N N 15 114.2738825 . . 1 . . . . . 30 LYS N . 52980 1
118 . 1 . 1 31 31 HIS H H 1 7.079311508 . . 1 . . . . . 31 HIS H . 52980 1
119 . 1 . 1 31 31 HIS C C 13 172.0566345 . . 1 . . . . . 31 HIS C . 52980 1
120 . 1 . 1 31 31 HIS CA C 13 56.05743205 . . 1 . . . . . 31 HIS CA . 52980 1
121 . 1 . 1 31 31 HIS CB C 13 30.38355777 . . 1 . . . . . 31 HIS CB . 52980 1
122 . 1 . 1 31 31 HIS N N 15 115.9609362 . . 1 . . . . . 31 HIS N . 52980 1
123 . 1 . 1 32 32 ALA H H 1 7.69763288 . . 1 . . . . . 32 ALA H . 52980 1
124 . 1 . 1 32 32 ALA C C 13 170.8579578 . . 1 . . . . . 32 ALA C . 52980 1
125 . 1 . 1 32 32 ALA CA C 13 47.69971078 . . 1 . . . . . 32 ALA CA . 52980 1
126 . 1 . 1 32 32 ALA CB C 13 16.37663975 . . 1 . . . . . 32 ALA CB . 52980 1
127 . 1 . 1 32 32 ALA N N 15 118.8583012 . . 1 . . . . . 32 ALA N . 52980 1
128 . 1 . 1 34 34 LYS H H 1 10.32108764 . . 1 . . . . . 34 LYS H . 52980 1
129 . 1 . 1 34 34 LYS C C 13 178.8457404 . . 1 . . . . . 34 LYS C . 52980 1
130 . 1 . 1 34 34 LYS CA C 13 57.45739722 . . 1 . . . . . 34 LYS CA . 52980 1
131 . 1 . 1 34 34 LYS CB C 13 29.39953698 . . 1 . . . . . 34 LYS CB . 52980 1
132 . 1 . 1 34 34 LYS N N 15 124.0483551 . . 1 . . . . . 34 LYS N . 52980 1
133 . 1 . 1 35 35 THR H H 1 9.927439584 . . 1 . . . . . 35 THR H . 52980 1
134 . 1 . 1 35 35 THR C C 13 175.5755213 . . 1 . . . . . 35 THR C . 52980 1
135 . 1 . 1 35 35 THR CA C 13 63.89652357 . . 1 . . . . . 35 THR CA . 52980 1
136 . 1 . 1 35 35 THR CB C 13 65.03872722 . . 1 . . . . . 35 THR CB . 52980 1
137 . 1 . 1 35 35 THR N N 15 123.3769657 . . 1 . . . . . 35 THR N . 52980 1
138 . 1 . 1 36 36 CYS H H 1 8.608138772 . . 1 . . . . . 36 CYS H . 52980 1
139 . 1 . 1 36 36 CYS C C 13 172.1321735 . . 1 . . . . . 36 CYS C . 52980 1
140 . 1 . 1 36 36 CYS CA C 13 62.68249467 . . 1 . . . . . 36 CYS CA . 52980 1
141 . 1 . 1 36 36 CYS CB C 13 21.55161305 . . 1 . . . . . 36 CYS CB . 52980 1
142 . 1 . 1 36 36 CYS N N 15 123.7169716 . . 1 . . . . . 36 CYS N . 52980 1
143 . 1 . 1 37 37 LYS H H 1 7.891926659 . . 1 . . . . . 37 LYS H . 52980 1
144 . 1 . 1 37 37 LYS C C 13 174.4825254 0 . 1 . . . . . 37 LYS C . 52980 1
145 . 1 . 1 37 37 LYS CA C 13 58.23219962 . . 1 . . . . . 37 LYS CA . 52980 1
146 . 1 . 1 37 37 LYS CB C 13 28.42848078 . . 1 . . . . . 37 LYS CB . 52980 1
147 . 1 . 1 37 37 LYS N N 15 119.5420763 . . 1 . . . . . 37 LYS N . 52980 1
148 . 1 . 1 38 38 ASN H H 1 7.111625795 . . 1 . . . . . 38 ASN H . 52980 1
149 . 1 . 1 38 38 ASN C C 13 171.8364526 . . 1 . . . . . 38 ASN C . 52980 1
150 . 1 . 1 38 38 ASN CA C 13 54.40997107 . . 1 . . . . . 38 ASN CA . 52980 1
151 . 1 . 1 38 38 ASN CB C 13 37.71462624 . . 1 . . . . . 38 ASN CB . 52980 1
152 . 1 . 1 38 38 ASN N N 15 113.6036961 . . 1 . . . . . 38 ASN N . 52980 1
153 . 1 . 1 39 39 PHE H H 1 7.608430573 . . 1 . . . . . 39 PHE H . 52980 1
154 . 1 . 1 39 39 PHE C C 13 174.1924824 . . 1 . . . . . 39 PHE C . 52980 1
155 . 1 . 1 39 39 PHE CA C 13 59.02901372 . . 1 . . . . . 39 PHE CA . 52980 1
156 . 1 . 1 39 39 PHE CB C 13 38.85689636 . . 1 . . . . . 39 PHE CB . 52980 1
157 . 1 . 1 39 39 PHE N N 15 117.7766914 . . 1 . . . . . 39 PHE N . 52980 1
158 . 1 . 1 40 40 ALA H H 1 8.759173216 . . 1 . . . . . 40 ALA H . 52980 1
159 . 1 . 1 40 40 ALA C C 13 176.8455419 . . 1 . . . . . 40 ALA C . 52980 1
160 . 1 . 1 40 40 ALA CA C 13 52.76821578 . . 1 . . . . . 40 ALA CA . 52980 1
161 . 1 . 1 40 40 ALA CB C 13 15.85259685 . . 1 . . . . . 40 ALA CB . 52980 1
162 . 1 . 1 40 40 ALA N N 15 117.9041184 . . 1 . . . . . 40 ALA N . 52980 1
163 . 1 . 1 41 41 GLU H H 1 8.664237374 . . 1 . . . . . 41 GLU H . 52980 1
164 . 1 . 1 41 41 GLU C C 13 176.0022957 . . 1 . . . . . 41 GLU C . 52980 1
165 . 1 . 1 41 41 GLU CA C 13 55.09365343 . . 1 . . . . . 41 GLU CA . 52980 1
166 . 1 . 1 41 41 GLU CB C 13 25.660435 . . 1 . . . . . 41 GLU CB . 52980 1
167 . 1 . 1 41 41 GLU N N 15 119.1238492 . . 1 . . . . . 41 GLU N . 52980 1
168 . 1 . 1 42 42 LEU H H 1 8.534499031 . . 1 . . . . . 42 LEU H . 52980 1
169 . 1 . 1 42 42 LEU C C 13 176.8341402 . . 1 . . . . . 42 LEU C . 52980 1
170 . 1 . 1 42 42 LEU CA C 13 55.84175018 . . 1 . . . . . 42 LEU CA . 52980 1
171 . 1 . 1 42 42 LEU CB C 13 38.0528919 . . 1 . . . . . 42 LEU CB . 52980 1
172 . 1 . 1 42 42 LEU N N 15 121.7843698 . . 1 . . . . . 42 LEU N . 52980 1
173 . 1 . 1 43 43 ALA H H 1 8.073 . . 1 . . . . . 43 ALA H . 52980 1
174 . 1 . 1 43 43 ALA C C 13 178.035 . . 1 . . . . . 43 ALA C . 52980 1
175 . 1 . 1 43 43 ALA CA C 13 51.702 . . 1 . . . . . 43 ALA CA . 52980 1
176 . 1 . 1 43 43 ALA CB C 13 13.769 . . 1 . . . . . 43 ALA CB . 52980 1
177 . 1 . 1 43 43 ALA N N 15 118.437 . . 1 . . . . . 43 ALA N . 52980 1
178 . 1 . 1 44 44 ARG H H 1 8.711872562 . . 1 . . . . . 44 ARG H . 52980 1
179 . 1 . 1 44 44 ARG C C 13 178.0913037 0 . 1 . . . . . 44 ARG C . 52980 1
180 . 1 . 1 44 44 ARG CA C 13 57.34711032 . . 1 . . . . . 44 ARG CA . 52980 1
181 . 1 . 1 44 44 ARG CB C 13 27.84128519 . . 1 . . . . . 44 ARG CB . 52980 1
182 . 1 . 1 44 44 ARG N N 15 120.8685523 . . 1 . . . . . 44 ARG N . 52980 1
183 . 1 . 1 45 45 ARG H H 1 8.53565607 . . 1 . . . . . 45 ARG H . 52980 1
184 . 1 . 1 45 45 ARG C C 13 174.9860802 0.832 . 1 . . . . . 45 ARG C . 52980 1
185 . 1 . 1 45 45 ARG CA C 13 55.0874846 . . 1 . . . . . 45 ARG CA . 52980 1
186 . 1 . 1 45 45 ARG CB C 13 28.87965519 . . 1 . . . . . 45 ARG CB . 52980 1
187 . 1 . 1 45 45 ARG N N 15 115.7710768 . . 1 . . . . . 45 ARG N . 52980 1
188 . 1 . 1 46 46 GLY H H 1 8.101941467 . . 1 . . . . . 46 GLY H . 52980 1
189 . 1 . 1 46 46 GLY C C 13 173.8569891 . . 1 . . . . . 46 GLY C . 52980 1
190 . 1 . 1 46 46 GLY CA C 13 42.94528823 . . 1 . . . . . 46 GLY CA . 52980 1
191 . 1 . 1 46 46 GLY N N 15 107.9931844 . . 1 . . . . . 46 GLY N . 52980 1
192 . 1 . 1 47 47 TYR H H 1 7.899152543 . . 1 . . . . . 47 TYR H . 52980 1
193 . 1 . 1 47 47 TYR C C 13 172.8948079 . . 1 . . . . . 47 TYR C . 52980 1
194 . 1 . 1 47 47 TYR CA C 13 58.06471135 . . 1 . . . . . 47 TYR CA . 52980 1
195 . 1 . 1 47 47 TYR CB C 13 38.45619987 . . 1 . . . . . 47 TYR CB . 52980 1
196 . 1 . 1 47 47 TYR N N 15 121.9490227 . . 1 . . . . . 47 TYR N . 52980 1
197 . 1 . 1 48 48 TYR H H 1 7.735044524 . . 1 . . . . . 48 TYR H . 52980 1
198 . 1 . 1 48 48 TYR C C 13 174.8146907 . . 1 . . . . . 48 TYR C . 52980 1
199 . 1 . 1 48 48 TYR CA C 13 53.25973752 . . 1 . . . . . 48 TYR CA . 52980 1
200 . 1 . 1 48 48 TYR CB C 13 35.12059481 . . 1 . . . . . 48 TYR CB . 52980 1
201 . 1 . 1 48 48 TYR N N 15 108.4104347 . . 1 . . . . . 48 TYR N . 52980 1
202 . 1 . 1 49 49 ASN H H 1 7.63618984 . . 1 . . . . . 49 ASN H . 52980 1
203 . 1 . 1 49 49 ASN C C 13 173.42696 . . 1 . . . . . 49 ASN C . 52980 1
204 . 1 . 1 49 49 ASN CA C 13 52.38278244 . . 1 . . . . . 49 ASN CA . 52980 1
205 . 1 . 1 49 49 ASN CB C 13 33.40035138 . . 1 . . . . . 49 ASN CB . 52980 1
206 . 1 . 1 49 49 ASN N N 15 124.651739 . . 1 . . . . . 49 ASN N . 52980 1
207 . 1 . 1 50 50 GLY H H 1 9.031664465 . . 1 . . . . . 50 GLY H . 52980 1
208 . 1 . 1 50 50 GLY CA C 13 43.37986351 . . 1 . . . . . 50 GLY CA . 52980 1
209 . 1 . 1 50 50 GLY N N 15 114.2867266 . . 1 . . . . . 50 GLY N . 52980 1
210 . 1 . 1 51 51 THR H H 1 7.577353235 . . 1 . . . . . 51 THR H . 52980 1
211 . 1 . 1 51 51 THR C C 13 169.9603018 . . 1 . . . . . 51 THR C . 52980 1
212 . 1 . 1 51 51 THR CA C 13 58.43709549 . . 1 . . . . . 51 THR CA . 52980 1
213 . 1 . 1 51 51 THR CB C 13 68.29839365 . . 1 . . . . . 51 THR CB . 52980 1
214 . 1 . 1 51 51 THR N N 15 109.7224723 . . 1 . . . . . 51 THR N . 52980 1
215 . 1 . 1 52 52 LYS H H 1 9.138467795 . . 1 . . . . . 52 LYS H . 52980 1
216 . 1 . 1 52 52 LYS C C 13 175.6936909 . . 1 . . . . . 52 LYS C . 52980 1
217 . 1 . 1 52 52 LYS CA C 13 52.09153683 . . 1 . . . . . 52 LYS CA . 52980 1
218 . 1 . 1 52 52 LYS CB C 13 32.17637343 . . 1 . . . . . 52 LYS CB . 52980 1
219 . 1 . 1 52 52 LYS N N 15 117.4182576 . . 1 . . . . . 52 LYS N . 52980 1
220 . 1 . 1 53 53 PHE H H 1 8.19096209 . . 1 . . . . . 53 PHE H . 52980 1
221 . 1 . 1 53 53 PHE C C 13 172.651635 . . 1 . . . . . 53 PHE C . 52980 1
222 . 1 . 1 53 53 PHE CA C 13 56.11357207 . . 1 . . . . . 53 PHE CA . 52980 1
223 . 1 . 1 53 53 PHE CB C 13 35.2138397 . . 1 . . . . . 53 PHE CB . 52980 1
224 . 1 . 1 53 53 PHE N N 15 121.0843984 . . 1 . . . . . 53 PHE N . 52980 1
225 . 1 . 1 54 54 HIS H H 1 7.733711994 . . 1 . . . . . 54 HIS H . 52980 1
226 . 1 . 1 54 54 HIS C C 13 171.0998916 . . 1 . . . . . 54 HIS C . 52980 1
227 . 1 . 1 54 54 HIS CA C 13 54.72537766 . . 1 . . . . . 54 HIS CA . 52980 1
228 . 1 . 1 54 54 HIS CB C 13 29.1680289 . . 1 . . . . . 54 HIS CB . 52980 1
229 . 1 . 1 54 54 HIS N N 15 121.2326494 . . 1 . . . . . 54 HIS N . 52980 1
230 . 1 . 1 55 55 ARG H H 1 6.86673322 . . 1 . . . . . 55 ARG H . 52980 1
231 . 1 . 1 55 55 ARG C C 13 170.343559 . . 1 . . . . . 55 ARG C . 52980 1
232 . 1 . 1 55 55 ARG CA C 13 52.63743437 . . 1 . . . . . 55 ARG CA . 52980 1
233 . 1 . 1 55 55 ARG CB C 13 30.68158139 . . 1 . . . . . 55 ARG CB . 52980 1
234 . 1 . 1 55 55 ARG N N 15 121.5969645 . . 1 . . . . . 55 ARG N . 52980 1
235 . 1 . 1 56 56 ILE H H 1 8.678337193 . . 1 . . . . . 56 ILE H . 52980 1
236 . 1 . 1 56 56 ILE C C 13 171.193996 . . 1 . . . . . 56 ILE C . 52980 1
237 . 1 . 1 56 56 ILE CA C 13 58.71864006 . . 1 . . . . . 56 ILE CA . 52980 1
238 . 1 . 1 56 56 ILE CB C 13 39.48235819 . . 1 . . . . . 56 ILE CB . 52980 1
239 . 1 . 1 56 56 ILE N N 15 126.7030627 . . 1 . . . . . 56 ILE N . 52980 1
240 . 1 . 1 57 57 ILE H H 1 8.523529409 . . 1 . . . . . 57 ILE H . 52980 1
241 . 1 . 1 57 57 ILE C C 13 171.7735078 . . 1 . . . . . 57 ILE C . 52980 1
242 . 1 . 1 57 57 ILE CA C 13 57.70246523 . . 1 . . . . . 57 ILE CA . 52980 1
243 . 1 . 1 57 57 ILE CB C 13 37.8100875 . . 1 . . . . . 57 ILE CB . 52980 1
244 . 1 . 1 57 57 ILE N N 15 126.0464524 . . 1 . . . . . 57 ILE N . 52980 1
245 . 1 . 1 58 58 LYS H H 1 8.740547013 . . 1 . . . . . 58 LYS H . 52980 1
246 . 1 . 1 58 58 LYS C C 13 173.126782 . . 1 . . . . . 58 LYS C . 52980 1
247 . 1 . 1 58 58 LYS CA C 13 55.65400656 . . 1 . . . . . 58 LYS CA . 52980 1
248 . 1 . 1 58 58 LYS CB C 13 29.55447404 . . 1 . . . . . 58 LYS CB . 52980 1
249 . 1 . 1 58 58 LYS N N 15 129.5678648 . . 1 . . . . . 58 LYS N . 52980 1
250 . 1 . 1 60 60 PHE H H 1 8.121846411 . . 1 . . . . . 60 PHE H . 52980 1
251 . 1 . 1 60 60 PHE C C 13 171.5826737 . . 1 . . . . . 60 PHE C . 52980 1
252 . 1 . 1 60 60 PHE CA C 13 54.78505284 . . 1 . . . . . 60 PHE CA . 52980 1
253 . 1 . 1 60 60 PHE CB C 13 36.17822713 . . 1 . . . . . 60 PHE CB . 52980 1
254 . 1 . 1 60 60 PHE N N 15 114.784032 . . 1 . . . . . 60 PHE N . 52980 1
255 . 1 . 1 61 61 MET H H 1 8.240102784 . . 1 . . . . . 61 MET H . 52980 1
256 . 1 . 1 61 61 MET C C 13 169.7715888 . . 1 . . . . . 61 MET C . 52980 1
257 . 1 . 1 61 61 MET CA C 13 52.78657462 . . 1 . . . . . 61 MET CA . 52980 1
258 . 1 . 1 61 61 MET CB C 13 32.46291467 . . 1 . . . . . 61 MET CB . 52980 1
259 . 1 . 1 61 61 MET N N 15 114.8725826 . . 1 . . . . . 61 MET N . 52980 1
260 . 1 . 1 62 62 ILE H H 1 8.227462615 . . 1 . . . . . 62 ILE H . 52980 1
261 . 1 . 1 62 62 ILE C C 13 170.4382048 . . 1 . . . . . 62 ILE C . 52980 1
262 . 1 . 1 62 62 ILE CA C 13 57.37726059 . . 1 . . . . . 62 ILE CA . 52980 1
263 . 1 . 1 62 62 ILE CB C 13 37.72840079 . . 1 . . . . . 62 ILE CB . 52980 1
264 . 1 . 1 62 62 ILE N N 15 114.1779536 . . 1 . . . . . 62 ILE N . 52980 1
265 . 1 . 1 63 63 GLN H H 1 8.876630884 . . 1 . . . . . 63 GLN H . 52980 1
266 . 1 . 1 63 63 GLN C C 13 171.7489178 . . 1 . . . . . 63 GLN C . 52980 1
267 . 1 . 1 63 63 GLN CA C 13 51.49344051 . . 1 . . . . . 63 GLN CA . 52980 1
268 . 1 . 1 63 63 GLN CB C 13 29.12420749 . . 1 . . . . . 63 GLN CB . 52980 1
269 . 1 . 1 63 63 GLN N N 15 125.4913729 . . 1 . . . . . 63 GLN N . 52980 1
270 . 1 . 1 64 64 GLY H H 1 7.909856703 . . 1 . . . . . 64 GLY H . 52980 1
271 . 1 . 1 64 64 GLY C C 13 170.4837255 . . 1 . . . . . 64 GLY C . 52980 1
272 . 1 . 1 64 64 GLY CA C 13 42.36894378 . . 1 . . . . . 64 GLY CA . 52980 1
273 . 1 . 1 64 64 GLY N N 15 110.3526678 . . 1 . . . . . 64 GLY N . 52980 1
274 . 1 . 1 65 65 GLY H H 1 9.568253689 . . 1 . . . . . 65 GLY H . 52980 1
275 . 1 . 1 65 65 GLY CA C 13 43.86368505 . . 1 . . . . . 65 GLY CA . 52980 1
276 . 1 . 1 65 65 GLY N N 15 107.3668264 . . 1 . . . . . 65 GLY N . 52980 1
277 . 1 . 1 66 66 ASP H H 1 9.556792616 . . 1 . . . . . 66 ASP H . 52980 1
278 . 1 . 1 66 66 ASP C C 13 173.3071179 . . 1 . . . . . 66 ASP C . 52980 1
279 . 1 . 1 66 66 ASP CB C 13 39.13726628 . . 1 . . . . . 66 ASP CB . 52980 1
280 . 1 . 1 66 66 ASP N N 15 121.2840768 . . 1 . . . . . 66 ASP N . 52980 1
281 . 1 . 1 68 68 THR H H 1 8.552398311 . . 1 . . . . . 68 THR H . 52980 1
282 . 1 . 1 68 68 THR C C 13 174.4340534 . . 1 . . . . . 68 THR C . 52980 1
283 . 1 . 1 68 68 THR CA C 13 60.00502469 . . 1 . . . . . 68 THR CA . 52980 1
284 . 1 . 1 68 68 THR CB C 13 68.07498689 . . 1 . . . . . 68 THR CB . 52980 1
285 . 1 . 1 68 68 THR N N 15 108.0923002 . . 1 . . . . . 68 THR N . 52980 1
286 . 1 . 1 69 69 GLY H H 1 7.665121238 . . 1 . . . . . 69 GLY H . 52980 1
287 . 1 . 1 69 69 GLY C C 13 170.6587523 . . 1 . . . . . 69 GLY C . 52980 1
288 . 1 . 1 69 69 GLY CA C 13 43.33424886 . . 1 . . . . . 69 GLY CA . 52980 1
289 . 1 . 1 69 69 GLY N N 15 107.8961993 . . 1 . . . . . 69 GLY N . 52980 1
290 . 1 . 1 70 70 THR H H 1 7.492530458 . . 1 . . . . . 70 THR H . 52980 1
291 . 1 . 1 70 70 THR C C 13 173.4269314 . . 1 . . . . . 70 THR C . 52980 1
292 . 1 . 1 70 70 THR CA C 13 60.50023513 . . 1 . . . . . 70 THR CA . 52980 1
293 . 1 . 1 70 70 THR CB C 13 69.10931044 . . 1 . . . . . 70 THR CB . 52980 1
294 . 1 . 1 70 70 THR N N 15 108.6011342 . . 1 . . . . . 70 THR N . 52980 1
295 . 1 . 1 71 71 GLY H H 1 8.65728798 . . 1 . . . . . 71 GLY H . 52980 1
296 . 1 . 1 71 71 GLY C C 13 172.229126 . . 1 . . . . . 71 GLY C . 52980 1
297 . 1 . 1 71 71 GLY CA C 13 42.68793178 . . 1 . . . . . 71 GLY CA . 52980 1
298 . 1 . 1 71 71 GLY N N 15 111.8060802 . . 1 . . . . . 71 GLY N . 52980 1
299 . 1 . 1 72 72 ARG H H 1 8.013973787 . . 1 . . . . . 72 ARG H . 52980 1
300 . 1 . 1 72 72 ARG C C 13 174.2717215 . . 1 . . . . . 72 ARG C . 52980 1
301 . 1 . 1 72 72 ARG CA C 13 52.50738912 . . 1 . . . . . 72 ARG CA . 52980 1
302 . 1 . 1 72 72 ARG CB C 13 28.74120507 . . 1 . . . . . 72 ARG CB . 52980 1
303 . 1 . 1 72 72 ARG N N 15 119.8342902 . . 1 . . . . . 72 ARG N . 52980 1
304 . 1 . 1 73 73 GLY H H 1 8.581709133 . . 1 . . . . . 73 GLY H . 52980 1
305 . 1 . 1 73 73 GLY C C 13 171.9486267 . . 1 . . . . . 73 GLY C . 52980 1
306 . 1 . 1 73 73 GLY CA C 13 42.24619957 . . 1 . . . . . 73 GLY CA . 52980 1
307 . 1 . 1 73 73 GLY N N 15 110.3652706 . . 1 . . . . . 73 GLY N . 52980 1
308 . 1 . 1 74 74 GLY H H 1 8.271261386 . . 1 . . . . . 74 GLY H . 52980 1
309 . 1 . 1 74 74 GLY C C 13 170.8005442 . . 1 . . . . . 74 GLY C . 52980 1
310 . 1 . 1 74 74 GLY CA C 13 41.81607671 . . 1 . . . . . 74 GLY CA . 52980 1
311 . 1 . 1 74 74 GLY N N 15 106.8758484 . . 1 . . . . . 74 GLY N . 52980 1
312 . 1 . 1 75 75 ALA H H 1 7.892230623 . . 1 . . . . . 75 ALA H . 52980 1
313 . 1 . 1 75 75 ALA C C 13 172.4209785 . . 1 . . . . . 75 ALA C . 52980 1
314 . 1 . 1 75 75 ALA CA C 13 48.50588777 . . 1 . . . . . 75 ALA CA . 52980 1
315 . 1 . 1 75 75 ALA CB C 13 19.86012728 . . 1 . . . . . 75 ALA CB . 52980 1
316 . 1 . 1 75 75 ALA N N 15 124.1104559 . . 1 . . . . . 75 ALA N . 52980 1
317 . 1 . 1 76 76 SER H H 1 8.731500823 . . 1 . . . . . 76 SER H . 52980 1
318 . 1 . 1 76 76 SER C C 13 174.1222906 . . 1 . . . . . 76 SER C . 52980 1
319 . 1 . 1 76 76 SER CA C 13 55.00236508 . . 1 . . . . . 76 SER CA . 52980 1
320 . 1 . 1 76 76 SER CB C 13 65.39847304 . . 1 . . . . . 76 SER CB . 52980 1
321 . 1 . 1 76 76 SER N N 15 115.0953405 . . 1 . . . . . 76 SER N . 52980 1
322 . 1 . 1 77 77 ILE H H 1 8.799483262 . . 1 . . . . . 77 ILE H . 52980 1
323 . 1 . 1 77 77 ILE C C 13 173.4644092 . . 1 . . . . . 77 ILE C . 52980 1
324 . 1 . 1 77 77 ILE CA C 13 60.46019705 0 . 1 . . . . . 77 ILE CA . 52980 1
325 . 1 . 1 77 77 ILE CB C 13 35.20910384 . . 1 . . . . . 77 ILE CB . 52980 1
326 . 1 . 1 77 77 ILE N N 15 112.3622262 . . 1 . . . . . 77 ILE N . 52980 1
327 . 1 . 1 78 78 TYR H H 1 7.544233471 . . 1 . . . . . 78 TYR H . 52980 1
328 . 1 . 1 78 78 TYR C C 13 173.0982502 . . 1 . . . . . 78 TYR C . 52980 1
329 . 1 . 1 78 78 TYR CA C 13 55.52267655 . . 1 . . . . . 78 TYR CA . 52980 1
330 . 1 . 1 78 78 TYR CB C 13 35.61615451 . . 1 . . . . . 78 TYR CB . 52980 1
331 . 1 . 1 78 78 TYR N N 15 117.8171122 . . 1 . . . . . 78 TYR N . 52980 1
332 . 1 . 1 79 79 GLY H H 1 7.355333275 . . 1 . . . . . 79 GLY H . 52980 1
333 . 1 . 1 79 79 GLY C C 13 169.9845326 . . 1 . . . . . 79 GLY C . 52980 1
334 . 1 . 1 79 79 GLY CA C 13 42.78123572 . . 1 . . . . . 79 GLY CA . 52980 1
335 . 1 . 1 79 79 GLY N N 15 107.3083129 . . 1 . . . . . 79 GLY N . 52980 1
336 . 1 . 1 80 80 LYS H H 1 7.602738444 . . 1 . . . . . 80 LYS H . 52980 1
337 . 1 . 1 80 80 LYS C C 13 173.0979612 . . 1 . . . . . 80 LYS C . 52980 1
338 . 1 . 1 80 80 LYS CA C 13 52.8986921 . . 1 . . . . . 80 LYS CA . 52980 1
339 . 1 . 1 80 80 LYS CB C 13 31.00348215 . . 1 . . . . . 80 LYS CB . 52980 1
340 . 1 . 1 80 80 LYS N N 15 116.8455068 . . 1 . . . . . 80 LYS N . 52980 1
341 . 1 . 1 81 81 GLN H H 1 8.377529634 . . 1 . . . . . 81 GLN H . 52980 1
342 . 1 . 1 81 81 GLN C C 13 173.2993985 . . 1 . . . . . 81 GLN C . 52980 1
343 . 1 . 1 81 81 GLN CB C 13 26.50203646 . . 1 . . . . . 81 GLN CB . 52980 1
344 . 1 . 1 81 81 GLN N N 15 119.5247002 . . 1 . . . . . 81 GLN N . 52980 1
345 . 1 . 1 82 82 PHE H H 1 8.622653423 . . 1 . . . . . 82 PHE H . 52980 1
346 . 1 . 1 82 82 PHE C C 13 171.5792385 . . 1 . . . . . 82 PHE C . 52980 1
347 . 1 . 1 82 82 PHE CA C 13 52.75566926 . . 1 . . . . . 82 PHE CA . 52980 1
348 . 1 . 1 82 82 PHE CB C 13 39.25297831 . . 1 . . . . . 82 PHE CB . 52980 1
349 . 1 . 1 82 82 PHE N N 15 117.9226133 . . 1 . . . . . 82 PHE N . 52980 1
350 . 1 . 1 83 83 GLU H H 1 9.550733832 . . 1 . . . . . 83 GLU H . 52980 1
351 . 1 . 1 83 83 GLU C C 13 173.6318845 . . 1 . . . . . 83 GLU C . 52980 1
352 . 1 . 1 83 83 GLU CA C 13 54.4224347 . . 1 . . . . . 83 GLU CA . 52980 1
353 . 1 . 1 83 83 GLU CB C 13 27.34940521 . . 1 . . . . . 83 GLU CB . 52980 1
354 . 1 . 1 83 83 GLU N N 15 120.4825606 . . 1 . . . . . 83 GLU N . 52980 1
355 . 1 . 1 84 84 ASP H H 1 8.753379119 . . 1 . . . . . 84 ASP H . 52980 1
356 . 1 . 1 84 84 ASP C C 13 173.1992501 . . 1 . . . . . 84 ASP C . 52980 1
357 . 1 . 1 84 84 ASP N N 15 117.7340248 . . 1 . . . . . 84 ASP N . 52980 1
358 . 1 . 1 86 86 LEU H H 1 8.358005468 . . 1 . . . . . 86 LEU H . 52980 1
359 . 1 . 1 86 86 LEU C C 13 174.1705362 . . 1 . . . . . 86 LEU C . 52980 1
360 . 1 . 1 86 86 LEU CA C 13 51.53858275 . . 1 . . . . . 86 LEU CA . 52980 1
361 . 1 . 1 86 86 LEU CB C 13 38.91347224 . . 1 . . . . . 86 LEU CB . 52980 1
362 . 1 . 1 86 86 LEU N N 15 121.8347615 . . 1 . . . . . 86 LEU N . 52980 1
363 . 1 . 1 87 87 HIS H H 1 8.418557122 . . 1 . . . . . 87 HIS H . 52980 1
364 . 1 . 1 87 87 HIS C C 13 172.2888592 . . 1 . . . . . 87 HIS C . 52980 1
365 . 1 . 1 87 87 HIS CA C 13 52.84469816 . . 1 . . . . . 87 HIS CA . 52980 1
366 . 1 . 1 87 87 HIS CB C 13 31.77876188 . . 1 . . . . . 87 HIS CB . 52980 1
367 . 1 . 1 87 87 HIS N N 15 123.4273521 . . 1 . . . . . 87 HIS N . 52980 1
368 . 1 . 1 89 89 ASP H H 1 10.04040768 . . 1 . . . . . 89 ASP H . 52980 1
369 . 1 . 1 89 89 ASP C C 13 173.7998793 . . 1 . . . . . 89 ASP C . 52980 1
370 . 1 . 1 89 89 ASP CA C 13 52.39894819 . . 1 . . . . . 89 ASP CA . 52980 1
371 . 1 . 1 89 89 ASP CB C 13 37.92280729 . . 1 . . . . . 89 ASP CB . 52980 1
372 . 1 . 1 89 89 ASP N N 15 117.2547174 . . 1 . . . . . 89 ASP N . 52980 1
373 . 1 . 1 90 90 LEU H H 1 7.556302667 . . 1 . . . . . 90 LEU H . 52980 1
374 . 1 . 1 90 90 LEU C C 13 171.1507971 . . 1 . . . . . 90 LEU C . 52980 1
375 . 1 . 1 90 90 LEU CA C 13 51.46440924 . . 1 . . . . . 90 LEU CA . 52980 1
376 . 1 . 1 90 90 LEU CB C 13 39.25615883 . . 1 . . . . . 90 LEU CB . 52980 1
377 . 1 . 1 90 90 LEU N N 15 121.243514 . . 1 . . . . . 90 LEU N . 52980 1
378 . 1 . 1 91 91 LYS H H 1 7.717543435 . . 1 . . . . . 91 LYS H . 52980 1
379 . 1 . 1 91 91 LYS C C 13 173.8151642 . . 1 . . . . . 91 LYS C . 52980 1
380 . 1 . 1 91 91 LYS CB C 13 34.55653921 . . 1 . . . . . 91 LYS CB . 52980 1
381 . 1 . 1 91 91 LYS N N 15 122.817707 . . 1 . . . . . 91 LYS N . 52980 1
382 . 1 . 1 92 92 PHE H H 1 10.1888167 . . 1 . . . . . 92 PHE H . 52980 1
383 . 1 . 1 92 92 PHE C C 13 175.4041125 . . 1 . . . . . 92 PHE C . 52980 1
384 . 1 . 1 92 92 PHE CA C 13 56.11500109 . . 1 . . . . . 92 PHE CA . 52980 1
385 . 1 . 1 92 92 PHE N N 15 123.3800526 . . 1 . . . . . 92 PHE N . 52980 1
386 . 1 . 1 93 93 THR H H 1 7.672482949 . . 1 . . . . . 93 THR H . 52980 1
387 . 1 . 1 93 93 THR C C 13 172.5827233 . . 1 . . . . . 93 THR C . 52980 1
388 . 1 . 1 93 93 THR CA C 13 59.38415352 . . 1 . . . . . 93 THR CA . 52980 1
389 . 1 . 1 93 93 THR CB C 13 66.77475488 . . 1 . . . . . 93 THR CB . 52980 1
390 . 1 . 1 93 93 THR N N 15 109.3021512 . . 1 . . . . . 93 THR N . 52980 1
391 . 1 . 1 94 94 GLY H H 1 7.153946729 . . 1 . . . . . 94 GLY H . 52980 1
392 . 1 . 1 94 94 GLY C C 13 179.6972867 . . 1 . . . . . 94 GLY C . 52980 1
393 . 1 . 1 94 94 GLY CA C 13 42.29445133 . . 1 . . . . . 94 GLY CA . 52980 1
394 . 1 . 1 94 94 GLY N N 15 106.5709959 . . 1 . . . . . 94 GLY N . 52980 1
395 . 1 . 1 95 95 ALA H H 1 8.327844861 . . 1 . . . . . 95 ALA H . 52980 1
396 . 1 . 1 95 95 ALA C C 13 175.2490679 . . 1 . . . . . 95 ALA C . 52980 1
397 . 1 . 1 95 95 ALA CA C 13 49.78417459 . . 1 . . . . . 95 ALA CA . 52980 1
398 . 1 . 1 95 95 ALA CB C 13 17.0923177 . . 1 . . . . . 95 ALA CB . 52980 1
399 . 1 . 1 95 95 ALA N N 15 119.204344 . . 1 . . . . . 95 ALA N . 52980 1
400 . 1 . 1 96 96 GLY H H 1 8.707948497 . . 1 . . . . . 96 GLY H . 52980 1
401 . 1 . 1 96 96 GLY C C 13 169.8815048 . . 1 . . . . . 96 GLY C . 52980 1
402 . 1 . 1 96 96 GLY CA C 13 42.73911294 . . 1 . . . . . 96 GLY CA . 52980 1
403 . 1 . 1 96 96 GLY N N 15 107.6607526 . . 1 . . . . . 96 GLY N . 52980 1
404 . 1 . 1 97 97 ILE H H 1 7.690178683 . . 1 . . . . . 97 ILE H . 52980 1
405 . 1 . 1 97 97 ILE C C 13 170.1386988 . . 1 . . . . . 97 ILE C . 52980 1
406 . 1 . 1 97 97 ILE CA C 13 59.71024687 . . 1 . . . . . 97 ILE CA . 52980 1
407 . 1 . 1 97 97 ILE CB C 13 34.8406948 . . 1 . . . . . 97 ILE CB . 52980 1
408 . 1 . 1 97 97 ILE N N 15 121.9241244 . . 1 . . . . . 97 ILE N . 52980 1
409 . 1 . 1 98 98 LEU H H 1 7.421561194 . . 1 . . . . . 98 LEU H . 52980 1
410 . 1 . 1 98 98 LEU CA C 13 50.38185953 . . 1 . . . . . 98 LEU CA . 52980 1
411 . 1 . 1 98 98 LEU CB C 13 41.29423246 . . 1 . . . . . 98 LEU CB . 52980 1
412 . 1 . 1 98 98 LEU N N 15 128.7864794 . . 1 . . . . . 98 LEU N . 52980 1
413 . 1 . 1 99 99 ALA H H 1 8.456514587 . . 1 . . . . . 99 ALA H . 52980 1
414 . 1 . 1 99 99 ALA C C 13 173.2630034 . . 1 . . . . . 99 ALA C . 52980 1
415 . 1 . 1 99 99 ALA CA C 13 47.00132285 . . 1 . . . . . 99 ALA CA . 52980 1
416 . 1 . 1 99 99 ALA CB C 13 22.02893902 . . 1 . . . . . 99 ALA CB . 52980 1
417 . 1 . 1 99 99 ALA N N 15 128.331577 . . 1 . . . . . 99 ALA N . 52980 1
418 . 1 . 1 100 100 MET H H 1 8.065042364 . . 1 . . . . . 100 MET H . 52980 1
419 . 1 . 1 100 100 MET C C 13 175.2471443 . . 1 . . . . . 100 MET C . 52980 1
420 . 1 . 1 100 100 MET CA C 13 50.27051759 . . 1 . . . . . 100 MET CA . 52980 1
421 . 1 . 1 100 100 MET CB C 13 28.98639905 . . 1 . . . . . 100 MET CB . 52980 1
422 . 1 . 1 100 100 MET N N 15 116.1204298 . . 1 . . . . . 100 MET N . 52980 1
423 . 1 . 1 101 101 ALA H H 1 8.027845875 . . 1 . . . . . 101 ALA H . 52980 1
424 . 1 . 1 101 101 ALA C C 13 172.7468056 . . 1 . . . . . 101 ALA C . 52980 1
425 . 1 . 1 101 101 ALA CA C 13 48.6717925 . . 1 . . . . . 101 ALA CA . 52980 1
426 . 1 . 1 101 101 ALA CB C 13 17.46945049 . . 1 . . . . . 101 ALA CB . 52980 1
427 . 1 . 1 101 101 ALA N N 15 125.4462835 . . 1 . . . . . 101 ALA N . 52980 1
428 . 1 . 1 102 102 ASN H H 1 8.444651646 . . 1 . . . . . 102 ASN H . 52980 1
429 . 1 . 1 102 102 ASN C C 13 171.4043596 . . 1 . . . . . 102 ASN C . 52980 1
430 . 1 . 1 102 102 ASN CA C 13 51.30294709 . . 1 . . . . . 102 ASN CA . 52980 1
431 . 1 . 1 102 102 ASN CB C 13 37.72133046 . . 1 . . . . . 102 ASN CB . 52980 1
432 . 1 . 1 102 102 ASN N N 15 114.0381892 . . 1 . . . . . 102 ASN N . 52980 1
433 . 1 . 1 103 103 ALA C C 13 174.262053 . . 1 . . . . . 103 ALA C . 52980 1
434 . 1 . 1 104 104 GLY H H 1 7.95954612 . . 1 . . . . . 104 GLY H . 52980 1
435 . 1 . 1 104 104 GLY C C 13 169.0750076 0 . 1 . . . . . 104 GLY C . 52980 1
436 . 1 . 1 104 104 GLY CA C 13 40.75120675 . . 1 . . . . . 104 GLY CA . 52980 1
437 . 1 . 1 104 104 GLY N N 15 109.4200685 . . 1 . . . . . 104 GLY N . 52980 1
438 . 1 . 1 106 106 ASP H H 1 8.418014591 . . 1 . . . . . 106 ASP H . 52980 1
439 . 1 . 1 106 106 ASP C C 13 172.6198455 . . 1 . . . . . 106 ASP C . 52980 1
440 . 1 . 1 106 106 ASP CA C 13 52.76171628 . . 1 . . . . . 106 ASP CA . 52980 1
441 . 1 . 1 106 106 ASP CB C 13 36.53806595 . . 1 . . . . . 106 ASP CB . 52980 1
442 . 1 . 1 106 106 ASP N N 15 120.4706879 . . 1 . . . . . 106 ASP N . 52980 1
443 . 1 . 1 107 107 THR H H 1 9.523935024 . . 1 . . . . . 107 THR H . 52980 1
444 . 1 . 1 107 107 THR C C 13 171.1830376 . . 1 . . . . . 107 THR C . 52980 1
445 . 1 . 1 107 107 THR CA C 13 57.30922933 . . 1 . . . . . 107 THR CA . 52980 1
446 . 1 . 1 107 107 THR CB C 13 66.14635131 . . 1 . . . . . 107 THR CB . 52980 1
447 . 1 . 1 107 107 THR N N 15 109.3129435 . . 1 . . . . . 107 THR N . 52980 1
448 . 1 . 1 108 108 ASN H H 1 7.227003501 . . 1 . . . . . 108 ASN H . 52980 1
449 . 1 . 1 108 108 ASN C C 13 171.4300637 . . 1 . . . . . 108 ASN C . 52980 1
450 . 1 . 1 108 108 ASN CA C 13 53.51856855 . . 1 . . . . . 108 ASN CA . 52980 1
451 . 1 . 1 108 108 ASN CB C 13 36.64814815 . . 1 . . . . . 108 ASN CB . 52980 1
452 . 1 . 1 108 108 ASN N N 15 120.4239693 . . 1 . . . . . 108 ASN N . 52980 1
453 . 1 . 1 109 109 GLY H H 1 8.812719752 . . 1 . . . . . 109 GLY H . 52980 1
454 . 1 . 1 109 109 GLY C C 13 168.4202303 0 . 1 . . . . . 109 GLY C . 52980 1
455 . 1 . 1 109 109 GLY CA C 13 43.10968323 . . 1 . . . . . 109 GLY CA . 52980 1
456 . 1 . 1 109 109 GLY N N 15 110.7525286 . . 1 . . . . . 109 GLY N . 52980 1
457 . 1 . 1 110 110 SER H H 1 8.987970852 . . 1 . . . . . 110 SER H . 52980 1
458 . 1 . 1 110 110 SER C C 13 173.0884815 . . 1 . . . . . 110 SER C . 52980 1
459 . 1 . 1 110 110 SER CA C 13 55.61685584 . . 1 . . . . . 110 SER CA . 52980 1
460 . 1 . 1 110 110 SER CB C 13 64.61325361 . . 1 . . . . . 110 SER CB . 52980 1
461 . 1 . 1 110 110 SER N N 15 118.7465442 . . 1 . . . . . 110 SER N . 52980 1
462 . 1 . 1 111 111 GLN H H 1 8.291050627 . . 1 . . . . . 111 GLN H . 52980 1
463 . 1 . 1 111 111 GLN C C 13 172.4227368 . . 1 . . . . . 111 GLN C . 52980 1
464 . 1 . 1 111 111 GLN CA C 13 55.16130971 . . 1 . . . . . 111 GLN CA . 52980 1
465 . 1 . 1 111 111 GLN CB C 13 29.69760491 . . 1 . . . . . 111 GLN CB . 52980 1
466 . 1 . 1 111 111 GLN N N 15 124.391135 . . 1 . . . . . 111 GLN N . 52980 1
467 . 1 . 1 112 112 PHE H H 1 8.085128216 . . 1 . . . . . 112 PHE H . 52980 1
468 . 1 . 1 112 112 PHE C C 13 169.0847935 . . 1 . . . . . 112 PHE C . 52980 1
469 . 1 . 1 112 112 PHE CA C 13 52.52050253 . . 1 . . . . . 112 PHE CA . 52980 1
470 . 1 . 1 112 112 PHE CB C 13 40.21828139 . . 1 . . . . . 112 PHE CB . 52980 1
471 . 1 . 1 112 112 PHE N N 15 117.6707916 . . 1 . . . . . 112 PHE N . 52980 1
472 . 1 . 1 113 113 PHE H H 1 9.579292772 . . 1 . . . . . 113 PHE H . 52980 1
473 . 1 . 1 113 113 PHE C C 13 169.6180152 . . 1 . . . . . 113 PHE C . 52980 1
474 . 1 . 1 113 113 PHE CB C 13 41.42682082 . . 1 . . . . . 113 PHE CB . 52980 1
475 . 1 . 1 113 113 PHE N N 15 115.7567813 . . 1 . . . . . 113 PHE N . 52980 1
476 . 1 . 1 114 114 VAL H H 1 8.662121617 . . 1 . . . . . 114 VAL H . 52980 1
477 . 1 . 1 114 114 VAL C C 13 174.4752005 . . 1 . . . . . 114 VAL C . 52980 1
478 . 1 . 1 114 114 VAL CA C 13 56.40880753 . . 1 . . . . . 114 VAL CA . 52980 1
479 . 1 . 1 114 114 VAL CB C 13 31.93350211 . . 1 . . . . . 114 VAL CB . 52980 1
480 . 1 . 1 114 114 VAL N N 15 117.2800697 . . 1 . . . . . 114 VAL N . 52980 1
481 . 1 . 1 115 115 THR H H 1 8.912313548 . . 1 . . . . . 115 THR H . 52980 1
482 . 1 . 1 115 115 THR C C 13 173.6450129 . . 1 . . . . . 115 THR C . 52980 1
483 . 1 . 1 115 115 THR CA C 13 59.60292216 0.022458548 . 1 . . . . . 115 THR CA . 52980 1
484 . 1 . 1 115 115 THR CB C 13 68.86914258 0.014186347 . 1 . . . . . 115 THR CB . 52980 1
485 . 1 . 1 115 115 THR N N 15 116.2661784 . . 1 . . . . . 115 THR N . 52980 1
486 . 1 . 1 116 116 LEU H H 1 8.074689323 . . 1 . . . . . 116 LEU H . 52980 1
487 . 1 . 1 116 116 LEU C C 13 172.8737201 . . 1 . . . . . 116 LEU C . 52980 1
488 . 1 . 1 116 116 LEU CA C 13 51.03456916 . . 1 . . . . . 116 LEU CA . 52980 1
489 . 1 . 1 116 116 LEU N N 15 118.4390571 . . 1 . . . . . 116 LEU N . 52980 1
490 . 1 . 1 117 117 ALA H H 1 7.904533743 . . 1 . . . . . 117 ALA H . 52980 1
491 . 1 . 1 117 117 ALA C C 13 181.9859636 . . 1 . . . . . 117 ALA C . 52980 1
492 . 1 . 1 117 117 ALA CA C 13 47.99056665 . . 1 . . . . . 117 ALA CA . 52980 1
493 . 1 . 1 117 117 ALA CB C 13 17.00257648 . . 1 . . . . . 117 ALA CB . 52980 1
494 . 1 . 1 117 117 ALA N N 15 122.9920251 . . 1 . . . . . 117 ALA N . 52980 1
495 . 1 . 1 119 119 THR H H 1 7.518572547 . . 1 . . . . . 119 THR H . 52980 1
496 . 1 . 1 119 119 THR C C 13 174.4494911 . . 1 . . . . . 119 THR C . 52980 1
497 . 1 . 1 119 119 THR CA C 13 54.89518227 . . 1 . . . . . 119 THR CA . 52980 1
498 . 1 . 1 119 119 THR CB C 13 67.20725994 . . 1 . . . . . 119 THR CB . 52980 1
499 . 1 . 1 119 119 THR N N 15 115.7893528 . . 1 . . . . . 119 THR N . 52980 1
500 . 1 . 1 120 120 GLN H H 1 9.267903141 . . 1 . . . . . 120 GLN H . 52980 1
501 . 1 . 1 120 120 GLN C C 13 174.3566436 . . 1 . . . . . 120 GLN C . 52980 1
502 . 1 . 1 120 120 GLN CA C 13 57.41581967 . . 1 . . . . . 120 GLN CA . 52980 1
503 . 1 . 1 120 120 GLN CB C 13 26.08848518 . . 1 . . . . . 120 GLN CB . 52980 1
504 . 1 . 1 120 120 GLN N N 15 123.4925764 . . 1 . . . . . 120 GLN N . 52980 1
505 . 1 . 1 121 121 TRP H H 1 7.199091768 . . 1 . . . . . 121 TRP H . 52980 1
506 . 1 . 1 121 121 TRP C C 13 174.1538898 . . 1 . . . . . 121 TRP C . 52980 1
507 . 1 . 1 121 121 TRP CA C 13 57.77794178 . . 1 . . . . . 121 TRP CA . 52980 1
508 . 1 . 1 121 121 TRP CB C 13 24.00004136 . . 1 . . . . . 121 TRP CB . 52980 1
509 . 1 . 1 121 121 TRP N N 15 117.0487233 . . 1 . . . . . 121 TRP N . 52980 1
510 . 1 . 1 122 122 LEU H H 1 7.360252239 . . 1 . . . . . 122 LEU H . 52980 1
511 . 1 . 1 122 122 LEU C C 13 173.9818346 . . 1 . . . . . 122 LEU C . 52980 1
512 . 1 . 1 122 122 LEU CA C 13 51.59846009 . . 1 . . . . . 122 LEU CA . 52980 1
513 . 1 . 1 122 122 LEU CB C 13 39.63180748 . . 1 . . . . . 122 LEU CB . 52980 1
514 . 1 . 1 122 122 LEU N N 15 120.5302301 . . 1 . . . . . 122 LEU N . 52980 1
515 . 1 . 1 123 123 ASP H H 1 7.649360933 . . 1 . . . . . 123 ASP H . 52980 1
516 . 1 . 1 123 123 ASP C C 13 175.8601514 . . 1 . . . . . 123 ASP C . 52980 1
517 . 1 . 1 123 123 ASP CA C 13 54.58238122 . . 1 . . . . . 123 ASP CA . 52980 1
518 . 1 . 1 123 123 ASP CB C 13 37.43095093 . . 1 . . . . . 123 ASP CB . 52980 1
519 . 1 . 1 123 123 ASP N N 15 121.2319469 . . 1 . . . . . 123 ASP N . 52980 1
520 . 1 . 1 124 124 GLY H H 1 9.324539437 . . 1 . . . . . 124 GLY H . 52980 1
521 . 1 . 1 124 124 GLY C C 13 172.0007227 . . 1 . . . . . 124 GLY C . 52980 1
522 . 1 . 1 124 124 GLY CA C 13 43.12025133 . . 1 . . . . . 124 GLY CA . 52980 1
523 . 1 . 1 124 124 GLY N N 15 111.4641377 . . 1 . . . . . 124 GLY N . 52980 1
524 . 1 . 1 125 125 LYS H H 1 8.264779645 . . 1 . . . . . 125 LYS H . 52980 1
525 . 1 . 1 125 125 LYS C C 13 173.0896177 . . 1 . . . . . 125 LYS C . 52980 1
526 . 1 . 1 125 125 LYS CA C 13 53.29764606 . . 1 . . . . . 125 LYS CA . 52980 1
527 . 1 . 1 125 125 LYS CB C 13 31.87558131 . . 1 . . . . . 125 LYS CB . 52980 1
528 . 1 . 1 125 125 LYS N N 15 115.4126475 . . 1 . . . . . 125 LYS N . 52980 1
529 . 1 . 1 126 126 HIS H H 1 7.013534022 . . 1 . . . . . 126 HIS H . 52980 1
530 . 1 . 1 126 126 HIS C C 13 171.2609787 . . 1 . . . . . 126 HIS C . 52980 1
531 . 1 . 1 126 126 HIS CA C 13 51.52684443 . . 1 . . . . . 126 HIS CA . 52980 1
532 . 1 . 1 126 126 HIS CB C 13 31.32694517 . . 1 . . . . . 126 HIS CB . 52980 1
533 . 1 . 1 126 126 HIS N N 15 114.3386555 . . 1 . . . . . 126 HIS N . 52980 1
534 . 1 . 1 127 127 THR H H 1 9.61951904 . . 1 . . . . . 127 THR H . 52980 1
535 . 1 . 1 127 127 THR C C 13 171.8235998 . . 1 . . . . . 127 THR C . 52980 1
536 . 1 . 1 127 127 THR CA C 13 61.96879097 . . 1 . . . . . 127 THR CA . 52980 1
537 . 1 . 1 127 127 THR CB C 13 67.49786781 . . 1 . . . . . 127 THR CB . 52980 1
538 . 1 . 1 127 127 THR N N 15 121.6254956 . . 1 . . . . . 127 THR N . 52980 1
539 . 1 . 1 128 128 ILE H H 1 8.390129946 . . 1 . . . . . 128 ILE H . 52980 1
540 . 1 . 1 128 128 ILE C C 13 172.9523757 . . 1 . . . . . 128 ILE C . 52980 1
541 . 1 . 1 128 128 ILE CA C 13 59.46950137 . . 1 . . . . . 128 ILE CA . 52980 1
542 . 1 . 1 128 128 ILE CB C 13 36.21555106 . . 1 . . . . . 128 ILE CB . 52980 1
543 . 1 . 1 128 128 ILE N N 15 131.6966359 . . 1 . . . . . 128 ILE N . 52980 1
544 . 1 . 1 129 129 PHE H H 1 8.477138908 . . 1 . . . . . 129 PHE H . 52980 1
545 . 1 . 1 129 129 PHE C C 13 180.6258334 . . 1 . . . . . 129 PHE C . 52980 1
546 . 1 . 1 129 129 PHE CA C 13 52.59280784 . . 1 . . . . . 129 PHE CA . 52980 1
547 . 1 . 1 129 129 PHE CB C 13 36.88647257 . . 1 . . . . . 129 PHE CB . 52980 1
548 . 1 . 1 129 129 PHE N N 15 120.4265789 . . 1 . . . . . 129 PHE N . 52980 1
549 . 1 . 1 130 130 GLY H H 1 6.893597426 . . 1 . . . . . 130 GLY H . 52980 1
550 . 1 . 1 130 130 GLY C C 13 168.220606 . . 1 . . . . . 130 GLY C . 52980 1
551 . 1 . 1 130 130 GLY CA C 13 43.38146772 . . 1 . . . . . 130 GLY CA . 52980 1
552 . 1 . 1 130 130 GLY N N 15 109.7465501 . . 1 . . . . . 130 GLY N . 52980 1
553 . 1 . 1 131 131 ARG H H 1 8.024912451 . . 1 . . . . . 131 ARG H . 52980 1
554 . 1 . 1 131 131 ARG C C 13 172.2287297 . . 1 . . . . . 131 ARG C . 52980 1
555 . 1 . 1 131 131 ARG CA C 13 51.14819112 . . 1 . . . . . 131 ARG CA . 52980 1
556 . 1 . 1 131 131 ARG N N 15 113.4586553 . . 1 . . . . . 131 ARG N . 52980 1
557 . 1 . 1 132 132 VAL H H 1 9.023264322 . . 1 . . . . . 132 VAL H . 52980 1
558 . 1 . 1 132 132 VAL C C 13 172.9659591 . . 1 . . . . . 132 VAL C . 52980 1
559 . 1 . 1 132 132 VAL CA C 13 60.35108208 . . 1 . . . . . 132 VAL CA . 52980 1
560 . 1 . 1 132 132 VAL CB C 13 29.39043925 . . 1 . . . . . 132 VAL CB . 52980 1
561 . 1 . 1 132 132 VAL N N 15 122.0183928 . . 1 . . . . . 132 VAL N . 52980 1
562 . 1 . 1 133 133 CYS H H 1 9.197693 0.002464979 . 1 . . . . . 133 CYS H . 52980 1
563 . 1 . 1 133 133 CYS C C 13 171.2828721 . . 1 . . . . . 133 CYS C . 52980 1
564 . 1 . 1 133 133 CYS CA C 13 53.84736024 . . 1 . . . . . 133 CYS CA . 52980 1
565 . 1 . 1 133 133 CYS CB C 13 26.87484281 . . 1 . . . . . 133 CYS CB . 52980 1
566 . 1 . 1 133 133 CYS N N 15 125.530698 0.039226164 . 1 . . . . . 133 CYS N . 52980 1
567 . 1 . 1 134 134 GLN H H 1 7.668671878 . . 1 . . . . . 134 GLN H . 52980 1
568 . 1 . 1 134 134 GLN C C 13 172.0200615 . . 1 . . . . . 134 GLN C . 52980 1
569 . 1 . 1 134 134 GLN CA C 13 54.28326613 . . 1 . . . . . 134 GLN CA . 52980 1
570 . 1 . 1 134 134 GLN CB C 13 29.2545598 . . 1 . . . . . 134 GLN CB . 52980 1
571 . 1 . 1 134 134 GLN N N 15 123.1442583 . . 1 . . . . . 134 GLN N . 52980 1
572 . 1 . 1 135 135 GLY H H 1 8.845062288 . . 1 . . . . . 135 GLY H . 52980 1
573 . 1 . 1 135 135 GLY C C 13 173.9685854 . . 1 . . . . . 135 GLY C . 52980 1
574 . 1 . 1 135 135 GLY CA C 13 43.26188962 . . 1 . . . . . 135 GLY CA . 52980 1
575 . 1 . 1 135 135 GLY N N 15 111.0680768 . . 1 . . . . . 135 GLY N . 52980 1
576 . 1 . 1 136 136 ILE H H 1 8.630365341 . . 1 . . . . . 136 ILE H . 52980 1
577 . 1 . 1 136 136 ILE C C 13 173.6118915 . . 1 . . . . . 136 ILE C . 52980 1
578 . 1 . 1 136 136 ILE CA C 13 59.16320867 . . 1 . . . . . 136 ILE CA . 52980 1
579 . 1 . 1 136 136 ILE CB C 13 34.83668723 . . 1 . . . . . 136 ILE CB . 52980 1
580 . 1 . 1 136 136 ILE N N 15 123.3570293 . . 1 . . . . . 136 ILE N . 52980 1
581 . 1 . 1 137 137 GLY H H 1 8.808426518 . . 1 . . . . . 137 GLY H . 52980 1
582 . 1 . 1 137 137 GLY C C 13 174.0734906 . . 1 . . . . . 137 GLY C . 52980 1
583 . 1 . 1 137 137 GLY CA C 13 43.97025373 . . 1 . . . . . 137 GLY CA . 52980 1
584 . 1 . 1 137 137 GLY N N 15 109.1983811 . . 1 . . . . . 137 GLY N . 52980 1
585 . 1 . 1 138 138 MET H H 1 7.458437078 . . 1 . . . . . 138 MET H . 52980 1
586 . 1 . 1 138 138 MET C C 13 175.4338109 . . 1 . . . . . 138 MET C . 52980 1
587 . 1 . 1 138 138 MET CA C 13 55.35507059 . . 1 . . . . . 138 MET CA . 52980 1
588 . 1 . 1 138 138 MET CB C 13 28.72391111 . . 1 . . . . . 138 MET CB . 52980 1
589 . 1 . 1 138 138 MET N N 15 121.2380374 . . 1 . . . . . 138 MET N . 52980 1
590 . 1 . 1 139 139 VAL H H 1 7.482906261 0.000546489 . 1 . . . . . 139 VAL H . 52980 1
591 . 1 . 1 139 139 VAL C C 13 174.3789869 . . 1 . . . . . 139 VAL C . 52980 1
592 . 1 . 1 139 139 VAL CA C 13 64.07081841 . . 1 . . . . . 139 VAL CA . 52980 1
593 . 1 . 1 139 139 VAL N N 15 120.0868824 0.020187375 . 1 . . . . . 139 VAL N . 52980 1
594 . 1 . 1 140 140 ASN H H 1 8.032210312 . . 1 . . . . . 140 ASN H . 52980 1
595 . 1 . 1 140 140 ASN C C 13 174.9512452 . . 1 . . . . . 140 ASN C . 52980 1
596 . 1 . 1 140 140 ASN CA C 13 53.32045929 . . 1 . . . . . 140 ASN CA . 52980 1
597 . 1 . 1 140 140 ASN CB C 13 35.47885502 . . 1 . . . . . 140 ASN CB . 52980 1
598 . 1 . 1 140 140 ASN N N 15 115.5955737 . . 1 . . . . . 140 ASN N . 52980 1
599 . 1 . 1 141 141 ARG H H 1 7.334150363 . . 1 . . . . . 141 ARG H . 52980 1
600 . 1 . 1 141 141 ARG C C 13 177.2703857 . . 1 . . . . . 141 ARG C . 52980 1
601 . 1 . 1 141 141 ARG CA C 13 56.77959926 . . 1 . . . . . 141 ARG CA . 52980 1
602 . 1 . 1 141 141 ARG CB C 13 27.3931696 . . 1 . . . . . 141 ARG CB . 52980 1
603 . 1 . 1 141 141 ARG N N 15 118.4924427 . . 1 . . . . . 141 ARG N . 52980 1
604 . 1 . 1 142 142 VAL H H 1 8.163554966 . . 1 . . . . . 142 VAL H . 52980 1
605 . 1 . 1 142 142 VAL C C 13 173.917625 . . 1 . . . . . 142 VAL C . 52980 1
606 . 1 . 1 142 142 VAL CA C 13 63.84127383 . . 1 . . . . . 142 VAL CA . 52980 1
607 . 1 . 1 142 142 VAL CB C 13 28.3773508 . . 1 . . . . . 142 VAL CB . 52980 1
608 . 1 . 1 142 142 VAL N N 15 122.7877772 . . 1 . . . . . 142 VAL N . 52980 1
609 . 1 . 1 143 143 GLY H H 1 7.815997798 . . 1 . . . . . 143 GLY H . 52980 1
610 . 1 . 1 143 143 GLY C C 13 170.7318803 . . 1 . . . . . 143 GLY C . 52980 1
611 . 1 . 1 143 143 GLY CA C 13 43.99516522 . . 1 . . . . . 143 GLY CA . 52980 1
612 . 1 . 1 143 143 GLY N N 15 101.283 . . 1 . . . . . 143 GLY N . 52980 1
613 . 1 . 1 144 144 MET H H 1 7.04704598 . . 1 . . . . . 144 MET H . 52980 1
614 . 1 . 1 144 144 MET C C 13 174.3683305 . . 1 . . . . . 144 MET C . 52980 1
615 . 1 . 1 144 144 MET CA C 13 51.90418492 . . 1 . . . . . 144 MET CA . 52980 1
616 . 1 . 1 144 144 MET CB C 13 30.76402789 . . 1 . . . . . 144 MET CB . 52980 1
617 . 1 . 1 144 144 MET N N 15 115.3927253 . . 1 . . . . . 144 MET N . 52980 1
618 . 1 . 1 145 145 VAL H H 1 7.212598556 . . 1 . . . . . 145 VAL H . 52980 1
619 . 1 . 1 145 145 VAL C C 13 172.535684 . . 1 . . . . . 145 VAL C . 52980 1
620 . 1 . 1 145 145 VAL CA C 13 59.77399964 . . 1 . . . . . 145 VAL CA . 52980 1
621 . 1 . 1 145 145 VAL CB C 13 30.11984618 . . 1 . . . . . 145 VAL CB . 52980 1
622 . 1 . 1 145 145 VAL N N 15 116.2531358 . . 1 . . . . . 145 VAL N . 52980 1
623 . 1 . 1 146 146 GLU H H 1 8.326723036 . . 1 . . . . . 146 GLU H . 52980 1
624 . 1 . 1 146 146 GLU C C 13 175.0340202 . . 1 . . . . . 146 GLU C . 52980 1
625 . 1 . 1 146 146 GLU CA C 13 54.69010532 . . 1 . . . . . 146 GLU CA . 52980 1
626 . 1 . 1 146 146 GLU CB C 13 27.04420003 . . 1 . . . . . 146 GLU CB . 52980 1
627 . 1 . 1 146 146 GLU N N 15 121.2622198 . . 1 . . . . . 146 GLU N . 52980 1
628 . 1 . 1 147 147 THR H H 1 8.461823424 . . 1 . . . . . 147 THR H . 52980 1
629 . 1 . 1 147 147 THR C C 13 171.9469627 . . 1 . . . . . 147 THR C . 52980 1
630 . 1 . 1 147 147 THR CA C 13 56.44024215 . . 1 . . . . . 147 THR CA . 52980 1
631 . 1 . 1 147 147 THR CB C 13 69.70050252 . . 1 . . . . . 147 THR CB . 52980 1
632 . 1 . 1 147 147 THR N N 15 116.0805032 . . 1 . . . . . 147 THR N . 52980 1
633 . 1 . 1 148 148 ASN H H 1 8.396015173 . . 1 . . . . . 148 ASN H . 52980 1
634 . 1 . 1 148 148 ASN C C 13 174.9005015 . . 1 . . . . . 148 ASN C . 52980 1
635 . 1 . 1 148 148 ASN CA C 13 47.92556174 . . 1 . . . . . 148 ASN CA . 52980 1
636 . 1 . 1 148 148 ASN CB C 13 36.34157693 . . 1 . . . . . 148 ASN CB . 52980 1
637 . 1 . 1 148 148 ASN N N 15 118.4695892 . . 1 . . . . . 148 ASN N . 52980 1
638 . 1 . 1 149 149 SER H H 1 8.326544643 . . 1 . . . . . 149 SER H . 52980 1
639 . 1 . 1 149 149 SER CA C 13 58.20685607 . . 1 . . . . . 149 SER CA . 52980 1
640 . 1 . 1 149 149 SER CB C 13 60.15551518 0 . 1 . . . . . 149 SER CB . 52980 1
641 . 1 . 1 149 149 SER N N 15 112.867044 . . 1 . . . . . 149 SER N . 52980 1
642 . 1 . 1 150 150 GLN H H 1 7.723290321 . . 1 . . . . . 150 GLN H . 52980 1
643 . 1 . 1 150 150 GLN CA C 13 52.75395112 . . 1 . . . . . 150 GLN CA . 52980 1
644 . 1 . 1 150 150 GLN CB C 13 25.83378011 . . 1 . . . . . 150 GLN CB . 52980 1
645 . 1 . 1 150 150 GLN N N 15 119.8448474 . . 1 . . . . . 150 GLN N . 52980 1
646 . 1 . 1 151 151 ASP H H 1 8.316065311 . . 1 . . . . . 151 ASP H . 52980 1
647 . 1 . 1 151 151 ASP C C 13 182.044282 . . 1 . . . . . 151 ASP C . 52980 1
648 . 1 . 1 151 151 ASP CA C 13 53.64984964 . . 1 . . . . . 151 ASP CA . 52980 1
649 . 1 . 1 151 151 ASP CB C 13 36.76203714 . . 1 . . . . . 151 ASP CB . 52980 1
650 . 1 . 1 151 151 ASP N N 15 113.6899516 . . 1 . . . . . 151 ASP N . 52980 1
651 . 1 . 1 152 152 ARG H H 1 7.611804368 . . 1 . . . . . 152 ARG H . 52980 1
652 . 1 . 1 152 152 ARG C C 13 172.3972662 . . 1 . . . . . 152 ARG C . 52980 1
653 . 1 . 1 152 152 ARG CA C 13 49.97463257 . . 1 . . . . . 152 ARG CA . 52980 1
654 . 1 . 1 152 152 ARG CB C 13 28.97682498 . . 1 . . . . . 152 ARG CB . 52980 1
655 . 1 . 1 152 152 ARG N N 15 118.5071859 . . 1 . . . . . 152 ARG N . 52980 1
656 . 1 . 1 154 154 VAL H H 1 8.156355783 . . 1 . . . . . 154 VAL H . 52980 1
657 . 1 . 1 154 154 VAL C C 13 173.3331862 . . 1 . . . . . 154 VAL C . 52980 1
658 . 1 . 1 154 154 VAL CA C 13 62.86854354 . . 1 . . . . . 154 VAL CA . 52980 1
659 . 1 . 1 154 154 VAL N N 15 125.0731905 . . 1 . . . . . 154 VAL N . 52980 1
660 . 1 . 1 155 155 ASP H H 1 8.078146316 . . 1 . . . . . 155 ASP H . 52980 1
661 . 1 . 1 155 155 ASP C C 13 172.2216671 0 . 1 . . . . . 155 ASP C . 52980 1
662 . 1 . 1 155 155 ASP CA C 13 49.77922811 . . 1 . . . . . 155 ASP CA . 52980 1
663 . 1 . 1 155 155 ASP CB C 13 39.65401052 . . 1 . . . . . 155 ASP CB . 52980 1
664 . 1 . 1 155 155 ASP N N 15 119.9593409 . . 1 . . . . . 155 ASP N . 52980 1
665 . 1 . 1 156 156 ASP H H 1 8.288477665 . . 1 . . . . . 156 ASP H . 52980 1
666 . 1 . 1 156 156 ASP C C 13 173.7332919 . . 1 . . . . . 156 ASP C . 52980 1
667 . 1 . 1 156 156 ASP CA C 13 52.52762578 . . 1 . . . . . 156 ASP CA . 52980 1
668 . 1 . 1 156 156 ASP CB C 13 38.54953137 . . 1 . . . . . 156 ASP CB . 52980 1
669 . 1 . 1 156 156 ASP N N 15 120.0572242 . . 1 . . . . . 156 ASP N . 52980 1
670 . 1 . 1 157 157 VAL H H 1 9.292780355 . . 1 . . . . . 157 VAL H . 52980 1
671 . 1 . 1 157 157 VAL C C 13 172.1936936 . . 1 . . . . . 157 VAL C . 52980 1
672 . 1 . 1 157 157 VAL CA C 13 59.72443182 . . 1 . . . . . 157 VAL CA . 52980 1
673 . 1 . 1 157 157 VAL CB C 13 29.74207397 . . 1 . . . . . 157 VAL CB . 52980 1
674 . 1 . 1 157 157 VAL N N 15 124.7073016 . . 1 . . . . . 157 VAL N . 52980 1
675 . 1 . 1 158 158 LYS H H 1 8.126657798 . . 1 . . . . . 158 LYS H . 52980 1
676 . 1 . 1 158 158 LYS C C 13 174.1751257 . . 1 . . . . . 158 LYS C . 52980 1
677 . 1 . 1 158 158 LYS CA C 13 52.52324225 . . 1 . . . . . 158 LYS CA . 52980 1
678 . 1 . 1 158 158 LYS CB C 13 33.40620133 . . 1 . . . . . 158 LYS CB . 52980 1
679 . 1 . 1 158 158 LYS N N 15 123.7041132 . . 1 . . . . . 158 LYS N . 52980 1
680 . 1 . 1 159 159 ILE H H 1 8.88717542 . . 1 . . . . . 159 ILE H . 52980 1
681 . 1 . 1 159 159 ILE C C 13 172.0958327 . . 1 . . . . . 159 ILE C . 52980 1
682 . 1 . 1 159 159 ILE CA C 13 60.08870731 . . 1 . . . . . 159 ILE CA . 52980 1
683 . 1 . 1 159 159 ILE CB C 13 34.82605418 . . 1 . . . . . 159 ILE CB . 52980 1
684 . 1 . 1 159 159 ILE N N 15 121.6358928 . . 1 . . . . . 159 ILE N . 52980 1
685 . 1 . 1 160 160 ILE H H 1 9.180640036 . . 1 . . . . . 160 ILE H . 52980 1
686 . 1 . 1 160 160 ILE C C 13 174.6828189 . . 1 . . . . . 160 ILE C . 52980 1
687 . 1 . 1 160 160 ILE CA C 13 61.16127058 . . 1 . . . . . 160 ILE CA . 52980 1
688 . 1 . 1 160 160 ILE N N 15 130.1886363 . . 1 . . . . . 160 ILE N . 52980 1
689 . 1 . 1 161 161 LYS H H 1 7.627700694 . . 1 . . . . . 161 LYS H . 52980 1
690 . 1 . 1 161 161 LYS C C 13 170.2578896 . . 1 . . . . . 161 LYS C . 52980 1
691 . 1 . 1 161 161 LYS CA C 13 52.50358233 . . 1 . . . . . 161 LYS CA . 52980 1
692 . 1 . 1 161 161 LYS CB C 13 34.47761606 . . 1 . . . . . 161 LYS CB . 52980 1
693 . 1 . 1 161 161 LYS N N 15 115.2224717 . . 1 . . . . . 161 LYS N . 52980 1
694 . 1 . 1 162 162 ALA H H 1 8.227079515 . . 1 . . . . . 162 ALA H . 52980 1
695 . 1 . 1 162 162 ALA C C 13 173.2013426 . . 1 . . . . . 162 ALA C . 52980 1
696 . 1 . 1 162 162 ALA CA C 13 47.33282918 . . 1 . . . . . 162 ALA CA . 52980 1
697 . 1 . 1 162 162 ALA CB C 13 19.96962684 . . 1 . . . . . 162 ALA CB . 52980 1
698 . 1 . 1 162 162 ALA N N 15 124.5263773 . . 1 . . . . . 162 ALA N . 52980 1
699 . 1 . 1 163 163 TYR H H 1 7.873659564 . . 1 . . . . . 163 TYR H . 52980 1
700 . 1 . 1 163 163 TYR C C 13 169.0258558 . . 1 . . . . . 163 TYR C . 52980 1
701 . 1 . 1 163 163 TYR CA C 13 51.71649641 . . 1 . . . . . 163 TYR CA . 52980 1
702 . 1 . 1 163 163 TYR CB C 13 33.66413057 . . 1 . . . . . 163 TYR CB . 52980 1
703 . 1 . 1 163 163 TYR N N 15 112.7010086 . . 1 . . . . . 163 TYR N . 52980 1
704 . 1 . 1 165 165 SER H H 1 8.528825669 . . 1 . . . . . 165 SER H . 52980 1
705 . 1 . 1 165 165 SER C C 13 170.0100918 . . 1 . . . . . 165 SER C . 52980 1
706 . 1 . 1 165 165 SER CA C 13 56.3619666 . . 1 . . . . . 165 SER CA . 52980 1
707 . 1 . 1 165 165 SER CB C 13 62.49063325 . . 1 . . . . . 165 SER CB . 52980 1
708 . 1 . 1 165 165 SER N N 15 114.2076117 . . 1 . . . . . 165 SER N . 52980 1
709 . 1 . 1 166 166 GLY H H 1 7.889214776 . . 1 . . . . . 166 GLY H . 52980 1
710 . 1 . 1 166 166 GLY C C 13 176.3923149 . . 1 . . . . . 166 GLY C . 52980 1
711 . 1 . 1 166 166 GLY CA C 13 43.46158565 . . 1 . . . . . 166 GLY CA . 52980 1
712 . 1 . 1 166 166 GLY N N 15 116.2500758 . . 1 . . . . . 166 GLY N . 52980 1
stop_
save_