data_25038
#######################
# Entry information #
#######################
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 25038
_Entry.Title
;
Structural Investigation of hnRNP L
;
_Entry.Type macromolecule
_Entry.Version_type original
_Entry.Submission_date 2014-06-24
_Entry.Accession_date 2014-06-24
_Entry.Last_release_date 2015-05-04
_Entry.Original_release_date 2015-05-04
_Entry.Origination author
_Entry.NMR_STAR_version 3.1.1.77
_Entry.Original_NMR_STAR_version 3.1
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype 'NMR, 20 STRUCTURES'
_Entry.Details 'First RNA Recognition Motif Domain of hnRNP L'
_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 Markus Blatter . . . 25038
2 Frederic Allain . . . 25038
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 'not applicable' 'not applicable' . 25038
stop_
loop_
_Struct_keywords.Keywords
_Struct_keywords.Text
_Struct_keywords.Entry_ID
Protein . 25038
RRM . 25038
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts 1 25038
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
'13C chemical shifts' 318 25038
'15N chemical shifts' 103 25038
'1H chemical shifts' 677 25038
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 . . 2015-05-04 . original BMRB . 25038
stop_
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
BMRB 25056 'Cyp33RRM90 MLLPHD3 H3K4me3' 25038
PDB 2MQL 'BMRB Entry Tracking System' 25038
stop_
save_
###############
# Citations #
###############
save_citations
_Citation.Sf_category citations
_Citation.Sf_framecode citations
_Citation.Entry_ID 25038
_Citation.ID 1
_Citation.Class 'entry citation'
_Citation.CAS_abstract_code .
_Citation.MEDLINE_UI_code .
_Citation.DOI .
_Citation.PubMed_ID .
_Citation.Full_citation .
_Citation.Title
;
Structural Investigation of hnRNP L
;
_Citation.Status 'in preparation'
_Citation.Type journal
_Citation.Journal_abbrev 'To be Published'
_Citation.Journal_name_full .
_Citation.Journal_volume .
_Citation.Journal_issue .
_Citation.Journal_ASTM .
_Citation.Journal_ISSN .
_Citation.Journal_CSD .
_Citation.Book_title .
_Citation.Book_chapter_title .
_Citation.Book_volume .
_Citation.Book_series .
_Citation.Book_publisher .
_Citation.Book_publisher_city .
_Citation.Book_ISBN .
_Citation.Conference_title .
_Citation.Conference_site .
_Citation.Conference_state_province .
_Citation.Conference_country .
_Citation.Conference_start_date .
_Citation.Conference_end_date .
_Citation.Conference_abstract_number .
_Citation.Thesis_institution .
_Citation.Thesis_institution_city .
_Citation.Thesis_institution_country .
_Citation.WWW_URL .
_Citation.Page_first .
_Citation.Page_last .
_Citation.Year .
_Citation.Details .
loop_
_Citation_author.Ordinal
_Citation_author.Given_name
_Citation_author.Family_name
_Citation_author.First_initial
_Citation_author.Middle_initials
_Citation_author.Family_title
_Citation_author.Entry_ID
_Citation_author.Citation_ID
1 Markus Blatter . . . 25038 1
2 Frederic Allain . . . 25038 1
stop_
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID 25038
_Assembly.ID 1
_Assembly.Name 'hnRNP L'
_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 entity 1 $entity A . yes native no no . . . 25038 1
stop_
save_
####################################
# Biological polymers and ligands #
####################################
save_entity
_Entity.Sf_category entity
_Entity.Sf_framecode entity
_Entity.Entry_ID 25038
_Entity.ID 1
_Entity.BMRB_code .
_Entity.Name entity
_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
;
GENYDDPHKTPASPVVHIRG
LIDGVVEADLVEALQEFGPI
SYVVVMPKKRQALVEFEDVL
GACNAVNYAADNQIYIAGHP
AFVNYSTSQKISRPGDSDDS
RSVNS
;
_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 105
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state .
_Entity.Src_method man
_Entity.Parent_entity_ID .
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight 11386.674
_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 2MQL . "Structural Investigation Of Hnrnp L" . . . . . 100.00 105 100.00 100.00 1.93e-69 . . . . 25038 1
2 no PDB 3R27 . "Crystal Structure Of The First Rrm Domain Of Heterogeneous Nuclear Ribonucleoprotein L (Hnrnp L)" . . . . . 86.67 100 100.00 100.00 1.44e-58 . . . . 25038 1
3 no DBJ BAB18649 . "heterogeneous nuclear ribonucleoprotein L [Homo sapiens]" . . . . . 100.00 589 100.00 100.00 8.66e-64 . . . . 25038 1
4 no DBJ BAC39565 . "unnamed protein product [Mus musculus]" . . . . . 100.00 329 100.00 100.00 3.67e-67 . . . . 25038 1
5 no DBJ BAE02304 . "unnamed protein product [Macaca fascicularis]" . . . . . 57.14 456 100.00 100.00 5.64e-31 . . . . 25038 1
6 no DBJ BAE26011 . "unnamed protein product [Mus musculus]" . . . . . 100.00 592 100.00 100.00 1.47e-63 . . . . 25038 1
7 no DBJ BAF84804 . "unnamed protein product [Homo sapiens]" . . . . . 57.14 456 100.00 100.00 5.70e-31 . . . . 25038 1
8 no EMBL CAA34261 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 558 100.00 100.00 6.29e-64 . . . . 25038 1
9 no GB AAH27206 . "Heterogeneous nuclear ribonucleoprotein L [Mus musculus]" . . . . . 100.00 555 100.00 100.00 6.55e-64 . . . . 25038 1
10 no GB AAH69184 . "HNRNPL protein, partial [Homo sapiens]" . . . . . 100.00 572 100.00 100.00 6.64e-64 . . . . 25038 1
11 no GB AAH99683 . "Hnrpl protein [Mus musculus]" . . . . . 100.00 586 100.00 100.00 8.66e-64 . . . . 25038 1
12 no GB AAI69048 . "Hnrnpl protein [Rattus norvegicus]" . . . . . 100.00 571 100.00 100.00 8.31e-64 . . . . 25038 1
13 no GB EAW56826 . "heterogeneous nuclear ribonucleoprotein L, isoform CRA_a [Homo sapiens]" . . . . . 100.00 557 99.05 99.05 5.93e-63 . . . . 25038 1
14 no PRF 1604358A . "nuclear RNP protein L" . . . . . 100.00 558 100.00 100.00 6.29e-64 . . . . 25038 1
15 no REF NP_001005335 . "heterogeneous nuclear ribonucleoprotein L isoform b [Homo sapiens]" . . . . . 57.14 456 100.00 100.00 5.70e-31 . . . . 25038 1
16 no REF NP_001128232 . "heterogeneous nuclear ribonucleoprotein L isoform a [Rattus norvegicus]" . . . . . 100.00 623 100.00 100.00 1.78e-63 . . . . 25038 1
17 no REF NP_001178959 . "heterogeneous nuclear ribonucleoprotein L [Bos taurus]" . . . . . 100.00 588 100.00 100.00 8.25e-64 . . . . 25038 1
18 no REF NP_001252929 . "heterogeneous nuclear ribonucleoprotein L [Macaca mulatta]" . . . . . 100.00 589 100.00 100.00 9.03e-64 . . . . 25038 1
19 no REF NP_001267082 . "heterogeneous nuclear ribonucleoprotein L [Pan troglodytes]" . . . . . 100.00 558 100.00 100.00 6.70e-64 . . . . 25038 1
20 no SP P14866 . "RecName: Full=Heterogeneous nuclear ribonucleoprotein L; Short=hnRNP L" . . . . . 100.00 589 100.00 100.00 9.03e-64 . . . . 25038 1
21 no SP Q8R081 . "RecName: Full=Heterogeneous nuclear ribonucleoprotein L; Short=hnRNP L" . . . . . 100.00 586 100.00 100.00 8.66e-64 . . . . 25038 1
22 no TPG DAA19831 . "TPA: heterogeneous nuclear ribonucleoprotein L [Bos taurus]" . . . . . 100.00 588 100.00 100.00 8.25e-64 . . . . 25038 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 84 GLY . 25038 1
2 85 GLU . 25038 1
3 86 ASN . 25038 1
4 87 TYR . 25038 1
5 88 ASP . 25038 1
6 89 ASP . 25038 1
7 90 PRO . 25038 1
8 91 HIS . 25038 1
9 92 LYS . 25038 1
10 93 THR . 25038 1
11 94 PRO . 25038 1
12 95 ALA . 25038 1
13 96 SER . 25038 1
14 97 PRO . 25038 1
15 98 VAL . 25038 1
16 99 VAL . 25038 1
17 100 HIS . 25038 1
18 101 ILE . 25038 1
19 102 ARG . 25038 1
20 103 GLY . 25038 1
21 104 LEU . 25038 1
22 105 ILE . 25038 1
23 106 ASP . 25038 1
24 107 GLY . 25038 1
25 108 VAL . 25038 1
26 109 VAL . 25038 1
27 110 GLU . 25038 1
28 111 ALA . 25038 1
29 112 ASP . 25038 1
30 113 LEU . 25038 1
31 114 VAL . 25038 1
32 115 GLU . 25038 1
33 116 ALA . 25038 1
34 117 LEU . 25038 1
35 118 GLN . 25038 1
36 119 GLU . 25038 1
37 120 PHE . 25038 1
38 121 GLY . 25038 1
39 122 PRO . 25038 1
40 123 ILE . 25038 1
41 124 SER . 25038 1
42 125 TYR . 25038 1
43 126 VAL . 25038 1
44 127 VAL . 25038 1
45 128 VAL . 25038 1
46 129 MET . 25038 1
47 130 PRO . 25038 1
48 131 LYS . 25038 1
49 132 LYS . 25038 1
50 133 ARG . 25038 1
51 134 GLN . 25038 1
52 135 ALA . 25038 1
53 136 LEU . 25038 1
54 137 VAL . 25038 1
55 138 GLU . 25038 1
56 139 PHE . 25038 1
57 140 GLU . 25038 1
58 141 ASP . 25038 1
59 142 VAL . 25038 1
60 143 LEU . 25038 1
61 144 GLY . 25038 1
62 145 ALA . 25038 1
63 146 CYS . 25038 1
64 147 ASN . 25038 1
65 148 ALA . 25038 1
66 149 VAL . 25038 1
67 150 ASN . 25038 1
68 151 TYR . 25038 1
69 152 ALA . 25038 1
70 153 ALA . 25038 1
71 154 ASP . 25038 1
72 155 ASN . 25038 1
73 156 GLN . 25038 1
74 157 ILE . 25038 1
75 158 TYR . 25038 1
76 159 ILE . 25038 1
77 160 ALA . 25038 1
78 161 GLY . 25038 1
79 162 HIS . 25038 1
80 163 PRO . 25038 1
81 164 ALA . 25038 1
82 165 PHE . 25038 1
83 166 VAL . 25038 1
84 167 ASN . 25038 1
85 168 TYR . 25038 1
86 169 SER . 25038 1
87 170 THR . 25038 1
88 171 SER . 25038 1
89 172 GLN . 25038 1
90 173 LYS . 25038 1
91 174 ILE . 25038 1
92 175 SER . 25038 1
93 176 ARG . 25038 1
94 177 PRO . 25038 1
95 178 GLY . 25038 1
96 179 ASP . 25038 1
97 180 SER . 25038 1
98 181 ASP . 25038 1
99 182 ASP . 25038 1
100 183 SER . 25038 1
101 184 ARG . 25038 1
102 185 SER . 25038 1
103 186 VAL . 25038 1
104 187 ASN . 25038 1
105 188 SER . 25038 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 25038 1
. GLU 2 2 25038 1
. ASN 3 3 25038 1
. TYR 4 4 25038 1
. ASP 5 5 25038 1
. ASP 6 6 25038 1
. PRO 7 7 25038 1
. HIS 8 8 25038 1
. LYS 9 9 25038 1
. THR 10 10 25038 1
. PRO 11 11 25038 1
. ALA 12 12 25038 1
. SER 13 13 25038 1
. PRO 14 14 25038 1
. VAL 15 15 25038 1
. VAL 16 16 25038 1
. HIS 17 17 25038 1
. ILE 18 18 25038 1
. ARG 19 19 25038 1
. GLY 20 20 25038 1
. LEU 21 21 25038 1
. ILE 22 22 25038 1
. ASP 23 23 25038 1
. GLY 24 24 25038 1
. VAL 25 25 25038 1
. VAL 26 26 25038 1
. GLU 27 27 25038 1
. ALA 28 28 25038 1
. ASP 29 29 25038 1
. LEU 30 30 25038 1
. VAL 31 31 25038 1
. GLU 32 32 25038 1
. ALA 33 33 25038 1
. LEU 34 34 25038 1
. GLN 35 35 25038 1
. GLU 36 36 25038 1
. PHE 37 37 25038 1
. GLY 38 38 25038 1
. PRO 39 39 25038 1
. ILE 40 40 25038 1
. SER 41 41 25038 1
. TYR 42 42 25038 1
. VAL 43 43 25038 1
. VAL 44 44 25038 1
. VAL 45 45 25038 1
. MET 46 46 25038 1
. PRO 47 47 25038 1
. LYS 48 48 25038 1
. LYS 49 49 25038 1
. ARG 50 50 25038 1
. GLN 51 51 25038 1
. ALA 52 52 25038 1
. LEU 53 53 25038 1
. VAL 54 54 25038 1
. GLU 55 55 25038 1
. PHE 56 56 25038 1
. GLU 57 57 25038 1
. ASP 58 58 25038 1
. VAL 59 59 25038 1
. LEU 60 60 25038 1
. GLY 61 61 25038 1
. ALA 62 62 25038 1
. CYS 63 63 25038 1
. ASN 64 64 25038 1
. ALA 65 65 25038 1
. VAL 66 66 25038 1
. ASN 67 67 25038 1
. TYR 68 68 25038 1
. ALA 69 69 25038 1
. ALA 70 70 25038 1
. ASP 71 71 25038 1
. ASN 72 72 25038 1
. GLN 73 73 25038 1
. ILE 74 74 25038 1
. TYR 75 75 25038 1
. ILE 76 76 25038 1
. ALA 77 77 25038 1
. GLY 78 78 25038 1
. HIS 79 79 25038 1
. PRO 80 80 25038 1
. ALA 81 81 25038 1
. PHE 82 82 25038 1
. VAL 83 83 25038 1
. ASN 84 84 25038 1
. TYR 85 85 25038 1
. SER 86 86 25038 1
. THR 87 87 25038 1
. SER 88 88 25038 1
. GLN 89 89 25038 1
. LYS 90 90 25038 1
. ILE 91 91 25038 1
. SER 92 92 25038 1
. ARG 93 93 25038 1
. PRO 94 94 25038 1
. GLY 95 95 25038 1
. ASP 96 96 25038 1
. SER 97 97 25038 1
. ASP 98 98 25038 1
. ASP 99 99 25038 1
. SER 100 100 25038 1
. ARG 101 101 25038 1
. SER 102 102 25038 1
. VAL 103 103 25038 1
. ASN 104 104 25038 1
. SER 105 105 25038 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 25038
_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 . 10116 plasmid . 'Rattus norvegicus' Rat . . Eukaryota Metazoa Rattus norvegicus . . . . . . . . . . . . . 25038 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 25038
_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 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pTYB11 . . . 25038 1
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Sample.Sf_category sample
_Sample.Sf_framecode sample_1
_Sample.Entry_ID 25038
_Sample.ID 1
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details 'pH 6.5'
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '90% H2O/10% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 entity '[U-100% 15N]' . . 1 $entity . . 1-2 . . mM . . . . 25038 1
2 'sodium chloride' 'natural abundance' . . . . . . 60 . . mM . . . . 25038 1
3 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 25038 1
4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25038 1
5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25038 1
6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25038 1
stop_
save_
save_sample_2
_Sample.Sf_category sample
_Sample.Sf_framecode sample_2
_Sample.Entry_ID 25038
_Sample.ID 2
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details .
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '90% H2O/10% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 entity '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 1-2 . . mM . . . . 25038 2
2 'sodium chloride' 'natural abundance' . . . . . . 60 . . mM . . . . 25038 2
3 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 25038 2
4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25038 2
5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25038 2
6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25038 2
stop_
save_
save_sample_3
_Sample.Sf_category sample
_Sample.Sf_framecode sample_3
_Sample.Entry_ID 25038
_Sample.ID 3
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details .
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '100% 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 entity '[U-100% 15N]' . . 1 $entity . . 1-2 . . mM . . . . 25038 3
2 'sodium chloride' 'natural abundance' . . . . . . 60 . . mM . . . . 25038 3
3 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 25038 3
4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25038 3
5 D2O 'natural abundance' . . . . . . 100 . . % . . . . 25038 3
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 25038
_Sample_condition_list.ID 1
_Sample_condition_list.Details .
loop_
_Sample_condition_variable.Type
_Sample_condition_variable.Val
_Sample_condition_variable.Val_err
_Sample_condition_variable.Val_units
_Sample_condition_variable.Entry_ID
_Sample_condition_variable.Sample_condition_list_ID
'ionic strength' 0.1 . M 25038 1
pH 6.5 . pH 25038 1
pressure 1 . atm 25038 1
temperature 310.15 . K 25038 1
stop_
save_
############################
# Computer software used #
############################
save_TOPSPIN
_Software.Sf_category software
_Software.Sf_framecode TOPSPIN
_Software.Entry_ID 25038
_Software.ID 1
_Software.Name TOPSPIN
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Bruker Biospin' . . 25038 1
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
collection 25038 1
processing 25038 1
stop_
save_
save_CYANA
_Software.Sf_category software
_Software.Sf_framecode CYANA
_Software.Entry_ID 25038
_Software.ID 2
_Software.Name CYANA
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Guntert, Mumenthaler and Wuthrich' . . 25038 2
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'structure solution' 25038 2
stop_
save_
save_SPARKY
_Software.Sf_category software
_Software.Sf_framecode SPARKY
_Software.Entry_ID 25038
_Software.ID 3
_Software.Name SPARKY
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
Goddard . . 25038 3
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'chemical shift assignment' 25038 3
stop_
save_
save_AMBER
_Software.Sf_category software
_Software.Sf_framecode AMBER
_Software.Entry_ID 25038
_Software.ID 4
_Software.Name AMBER
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 25038 4
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
refinement 25038 4
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 25038
_NMR_spectrometer.ID 1
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model Avance
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 900
save_
save_spectrometer_2
_NMR_spectrometer.Sf_category NMR_spectrometer
_NMR_spectrometer.Sf_framecode spectrometer_2
_NMR_spectrometer.Entry_ID 25038
_NMR_spectrometer.ID 2
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model Avance
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 700
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 25038
_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 . 900 . . . 25038 1
2 spectrometer_2 Bruker Avance . 700 . . . 25038 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 25038
_Experiment_list.ID 1
_Experiment_list.Details .
loop_
_Experiment.ID
_Experiment.Name
_Experiment.Raw_data_flag
_Experiment.NMR_spec_expt_ID
_Experiment.NMR_spec_expt_label
_Experiment.MS_expt_ID
_Experiment.MS_expt_label
_Experiment.SAXS_expt_ID
_Experiment.SAXS_expt_label
_Experiment.FRET_expt_ID
_Experiment.FRET_expt_label
_Experiment.EMR_expt_ID
_Experiment.EMR_expt_label
_Experiment.Sample_ID
_Experiment.Sample_label
_Experiment.Sample_state
_Experiment.Sample_volume
_Experiment.Sample_volume_units
_Experiment.Sample_condition_list_ID
_Experiment.Sample_condition_list_label
_Experiment.Sample_spinning_rate
_Experiment.Sample_angle
_Experiment.NMR_tube_type
_Experiment.NMR_spectrometer_ID
_Experiment.NMR_spectrometer_label
_Experiment.NMR_spectrometer_probe_ID
_Experiment.NMR_spectrometer_probe_label
_Experiment.NMR_spectral_processing_ID
_Experiment.NMR_spectral_processing_label
_Experiment.Mass_spectrometer_ID
_Experiment.Mass_spectrometer_label
_Experiment.Xray_instrument_ID
_Experiment.Xray_instrument_label
_Experiment.Fluorescence_instrument_ID
_Experiment.Fluorescence_instrument_label
_Experiment.EMR_instrument_ID
_Experiment.EMR_instrument_label
_Experiment.Chromatographic_system_ID
_Experiment.Chromatographic_system_label
_Experiment.Chromatographic_column_ID
_Experiment.Chromatographic_column_label
_Experiment.Entry_ID
_Experiment.Experiment_list_ID
1 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25038 1
2 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25038 1
3 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25038 1
4 '2D 1H-1H NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25038 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 25038
_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 . . . . . . . . . 25038 1
H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 25038 1
N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 25038 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 25038
_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 '3D 1H-15N NOESY' . . . 25038 1
2 '3D 1H-13C NOESY aliphatic' . . . 25038 1
3 '3D 1H-13C NOESY aromatic' . . . 25038 1
4 '2D 1H-1H NOESY' . . . 25038 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
3 $SPARKY . . 25038 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 3.879 0.000 . . . . . A 84 GLY HA2 . 25038 1
2 . 1 1 1 1 GLY HA3 H 1 3.879 0.000 . . . . . A 84 GLY HA3 . 25038 1
3 . 1 1 1 1 GLY CA C 13 43.565 0.000 . . . . . A 84 GLY CA . 25038 1
4 . 1 1 2 2 GLU HA H 1 4.330 0.000 . . . . . A 85 GLU HA . 25038 1
5 . 1 1 2 2 GLU HB2 H 1 2.237 0.000 . . . . . A 85 GLU HB2 . 25038 1
6 . 1 1 2 2 GLU HB3 H 1 2.237 0.000 . . . . . A 85 GLU HB3 . 25038 1
7 . 1 1 2 2 GLU HG2 H 1 1.952 0.000 . . . . . A 85 GLU HG2 . 25038 1
8 . 1 1 2 2 GLU HG3 H 1 1.851 0.000 . . . . . A 85 GLU HG3 . 25038 1
9 . 1 1 2 2 GLU CA C 13 56.443 0.000 . . . . . A 85 GLU CA . 25038 1
10 . 1 1 2 2 GLU CB C 13 36.172 0.000 . . . . . A 85 GLU CB . 25038 1
11 . 1 1 2 2 GLU CG C 13 30.629 0.012 . . . . . A 85 GLU CG . 25038 1
12 . 1 1 3 3 ASN H H 1 8.492 0.000 . . . . . A 86 ASN H . 25038 1
13 . 1 1 3 3 ASN HA H 1 4.698 0.000 . . . . . A 86 ASN HA . 25038 1
14 . 1 1 3 3 ASN HB2 H 1 2.788 0.000 . . . . . A 86 ASN HB2 . 25038 1
15 . 1 1 3 3 ASN HB3 H 1 2.714 0.000 . . . . . A 86 ASN HB3 . 25038 1
16 . 1 1 3 3 ASN HD21 H 1 7.574 0.000 . . . . . A 86 ASN HD21 . 25038 1
17 . 1 1 3 3 ASN HD22 H 1 6.905 0.000 . . . . . A 86 ASN HD22 . 25038 1
18 . 1 1 3 3 ASN CA C 13 53.187 0.000 . . . . . A 86 ASN CA . 25038 1
19 . 1 1 3 3 ASN CB C 13 39.214 0.001 . . . . . A 86 ASN CB . 25038 1
20 . 1 1 3 3 ASN N N 15 119.520 0.000 . . . . . A 86 ASN N . 25038 1
21 . 1 1 3 3 ASN ND2 N 15 113.049 0.001 . . . . . A 86 ASN ND2 . 25038 1
22 . 1 1 4 4 TYR H H 1 8.173 0.000 . . . . . A 87 TYR H . 25038 1
23 . 1 1 4 4 TYR HA H 1 4.577 0.000 . . . . . A 87 TYR HA . 25038 1
24 . 1 1 4 4 TYR HB2 H 1 3.097 0.000 . . . . . A 87 TYR HB2 . 25038 1
25 . 1 1 4 4 TYR HB3 H 1 2.928 0.000 . . . . . A 87 TYR HB3 . 25038 1
26 . 1 1 4 4 TYR HD1 H 1 7.094 0.000 . . . . . A 87 TYR HD1 . 25038 1
27 . 1 1 4 4 TYR HD2 H 1 7.094 0.000 . . . . . A 87 TYR HD2 . 25038 1
28 . 1 1 4 4 TYR HE1 H 1 6.813 0.000 . . . . . A 87 TYR HE1 . 25038 1
29 . 1 1 4 4 TYR HE2 H 1 6.813 0.000 . . . . . A 87 TYR HE2 . 25038 1
30 . 1 1 4 4 TYR CA C 13 57.914 0.000 . . . . . A 87 TYR CA . 25038 1
31 . 1 1 4 4 TYR CB C 13 38.717 0.023 . . . . . A 87 TYR CB . 25038 1
32 . 1 1 4 4 TYR CD1 C 13 133.266 0.000 . . . . . A 87 TYR CD1 . 25038 1
33 . 1 1 4 4 TYR CE1 C 13 118.343 0.000 . . . . . A 87 TYR CE1 . 25038 1
34 . 1 1 4 4 TYR N N 15 121.070 0.000 . . . . . A 87 TYR N . 25038 1
35 . 1 1 5 5 ASP H H 1 8.205 0.000 . . . . . A 88 ASP H . 25038 1
36 . 1 1 5 5 ASP HA H 1 4.590 0.000 . . . . . A 88 ASP HA . 25038 1
37 . 1 1 5 5 ASP HB2 H 1 2.601 0.000 . . . . . A 88 ASP HB2 . 25038 1
38 . 1 1 5 5 ASP HB3 H 1 2.601 0.000 . . . . . A 88 ASP HB3 . 25038 1
39 . 1 1 5 5 ASP CA C 13 54.121 0.000 . . . . . A 88 ASP CA . 25038 1
40 . 1 1 5 5 ASP CB C 13 41.463 0.000 . . . . . A 88 ASP CB . 25038 1
41 . 1 1 5 5 ASP N N 15 121.903 0.000 . . . . . A 88 ASP N . 25038 1
42 . 1 1 6 6 ASP H H 1 8.035 0.000 . . . . . A 89 ASP H . 25038 1
43 . 1 1 6 6 ASP HA H 1 4.835 0.000 . . . . . A 89 ASP HA . 25038 1
44 . 1 1 6 6 ASP HB2 H 1 2.779 0.000 . . . . . A 89 ASP HB2 . 25038 1
45 . 1 1 6 6 ASP HB3 H 1 2.605 0.000 . . . . . A 89 ASP HB3 . 25038 1
46 . 1 1 6 6 ASP CA C 13 52.104 0.000 . . . . . A 89 ASP CA . 25038 1
47 . 1 1 6 6 ASP CB C 13 41.814 0.009 . . . . . A 89 ASP CB . 25038 1
48 . 1 1 6 6 ASP N N 15 121.760 0.000 . . . . . A 89 ASP N . 25038 1
49 . 1 1 7 7 PRO HA H 1 4.448 0.000 . . . . . A 90 PRO HA . 25038 1
50 . 1 1 7 7 PRO HB2 H 1 2.261 0.000 . . . . . A 90 PRO HB2 . 25038 1
51 . 1 1 7 7 PRO HB3 H 1 1.777 0.000 . . . . . A 90 PRO HB3 . 25038 1
52 . 1 1 7 7 PRO HG2 H 1 2.004 0.000 . . . . . A 90 PRO HG2 . 25038 1
53 . 1 1 7 7 PRO HG3 H 1 1.768 0.000 . . . . . A 90 PRO HG3 . 25038 1
54 . 1 1 7 7 PRO HD2 H 1 3.852 0.000 . . . . . A 90 PRO HD2 . 25038 1
55 . 1 1 7 7 PRO HD3 H 1 3.852 0.000 . . . . . A 90 PRO HD3 . 25038 1
56 . 1 1 7 7 PRO CA C 13 63.833 0.000 . . . . . A 90 PRO CA . 25038 1
57 . 1 1 7 7 PRO CB C 13 32.184 0.004 . . . . . A 90 PRO CB . 25038 1
58 . 1 1 7 7 PRO CG C 13 27.003 0.020 . . . . . A 90 PRO CG . 25038 1
59 . 1 1 7 7 PRO CD C 13 50.913 0.000 . . . . . A 90 PRO CD . 25038 1
60 . 1 1 8 8 HIS H H 1 8.467 0.000 . . . . . A 91 HIS H . 25038 1
61 . 1 1 8 8 HIS HA H 1 4.682 0.000 . . . . . A 91 HIS HA . 25038 1
62 . 1 1 8 8 HIS HB2 H 1 3.317 0.000 . . . . . A 91 HIS HB2 . 25038 1
63 . 1 1 8 8 HIS HB3 H 1 3.201 0.000 . . . . . A 91 HIS HB3 . 25038 1
64 . 1 1 8 8 HIS HD2 H 1 7.210 0.000 . . . . . A 91 HIS HD2 . 25038 1
65 . 1 1 8 8 HIS HE1 H 1 8.225 0.000 . . . . . A 91 HIS HE1 . 25038 1
66 . 1 1 8 8 HIS CA C 13 56.221 0.000 . . . . . A 91 HIS CA . 25038 1
67 . 1 1 8 8 HIS CB C 13 29.264 0.002 . . . . . A 91 HIS CB . 25038 1
68 . 1 1 8 8 HIS CD2 C 13 120.264 0.000 . . . . . A 91 HIS CD2 . 25038 1
69 . 1 1 8 8 HIS CE1 C 13 137.411 0.000 . . . . . A 91 HIS CE1 . 25038 1
70 . 1 1 8 8 HIS N N 15 117.637 0.000 . . . . . A 91 HIS N . 25038 1
71 . 1 1 9 9 LYS H H 1 7.923 0.000 . . . . . A 92 LYS H . 25038 1
72 . 1 1 9 9 LYS HA H 1 4.418 0.000 . . . . . A 92 LYS HA . 25038 1
73 . 1 1 9 9 LYS HB2 H 1 1.925 0.000 . . . . . A 92 LYS HB2 . 25038 1
74 . 1 1 9 9 LYS HB3 H 1 1.806 0.000 . . . . . A 92 LYS HB3 . 25038 1
75 . 1 1 9 9 LYS HG2 H 1 1.461 0.000 . . . . . A 92 LYS HG2 . 25038 1
76 . 1 1 9 9 LYS HG3 H 1 1.410 0.000 . . . . . A 92 LYS HG3 . 25038 1
77 . 1 1 9 9 LYS HD2 H 1 1.735 0.000 . . . . . A 92 LYS HD2 . 25038 1
78 . 1 1 9 9 LYS HD3 H 1 1.735 0.000 . . . . . A 92 LYS HD3 . 25038 1
79 . 1 1 9 9 LYS HE2 H 1 3.048 0.000 . . . . . A 92 LYS HE2 . 25038 1
80 . 1 1 9 9 LYS HE3 H 1 3.048 0.000 . . . . . A 92 LYS HE3 . 25038 1
81 . 1 1 9 9 LYS CA C 13 56.110 0.000 . . . . . A 92 LYS CA . 25038 1
82 . 1 1 9 9 LYS CB C 13 33.133 0.001 . . . . . A 92 LYS CB . 25038 1
83 . 1 1 9 9 LYS CG C 13 24.843 0.006 . . . . . A 92 LYS CG . 25038 1
84 . 1 1 9 9 LYS CD C 13 29.077 0.000 . . . . . A 92 LYS CD . 25038 1
85 . 1 1 9 9 LYS CE C 13 42.258 0.000 . . . . . A 92 LYS CE . 25038 1
86 . 1 1 9 9 LYS N N 15 121.067 0.000 . . . . . A 92 LYS N . 25038 1
87 . 1 1 10 10 THR H H 1 8.105 0.000 . . . . . A 93 THR H . 25038 1
88 . 1 1 10 10 THR HA H 1 4.541 0.000 . . . . . A 93 THR HA . 25038 1
89 . 1 1 10 10 THR HB H 1 4.159 0.000 . . . . . A 93 THR HB . 25038 1
90 . 1 1 10 10 THR HG21 H 1 1.316 0.000 . . . . . A 93 THR HG21 . 25038 1
91 . 1 1 10 10 THR HG22 H 1 1.316 0.000 . . . . . A 93 THR HG22 . 25038 1
92 . 1 1 10 10 THR HG23 H 1 1.316 0.000 . . . . . A 93 THR HG23 . 25038 1
93 . 1 1 10 10 THR CA C 13 60.550 0.000 . . . . . A 93 THR CA . 25038 1
94 . 1 1 10 10 THR CB C 13 70.341 0.000 . . . . . A 93 THR CB . 25038 1
95 . 1 1 10 10 THR CG2 C 13 21.960 0.000 . . . . . A 93 THR CG2 . 25038 1
96 . 1 1 10 10 THR N N 15 119.990 0.000 . . . . . A 93 THR N . 25038 1
97 . 1 1 11 11 PRO HA H 1 4.284 0.000 . . . . . A 94 PRO HA . 25038 1
98 . 1 1 11 11 PRO HB2 H 1 2.260 0.000 . . . . . A 94 PRO HB2 . 25038 1
99 . 1 1 11 11 PRO HB3 H 1 2.260 0.000 . . . . . A 94 PRO HB3 . 25038 1
100 . 1 1 11 11 PRO HG2 H 1 1.971 0.000 . . . . . A 94 PRO HG2 . 25038 1
101 . 1 1 11 11 PRO HG3 H 1 1.814 0.000 . . . . . A 94 PRO HG3 . 25038 1
102 . 1 1 11 11 PRO HD2 H 1 3.911 0.000 . . . . . A 94 PRO HD2 . 25038 1
103 . 1 1 11 11 PRO HD3 H 1 3.699 0.000 . . . . . A 94 PRO HD3 . 25038 1
104 . 1 1 11 11 PRO CA C 13 62.477 0.000 . . . . . A 94 PRO CA . 25038 1
105 . 1 1 11 11 PRO CB C 13 32.245 0.000 . . . . . A 94 PRO CB . 25038 1
106 . 1 1 11 11 PRO CG C 13 27.434 0.033 . . . . . A 94 PRO CG . 25038 1
107 . 1 1 11 11 PRO CD C 13 51.165 0.003 . . . . . A 94 PRO CD . 25038 1
108 . 1 1 12 12 ALA H H 1 7.689 0.000 . . . . . A 95 ALA H . 25038 1
109 . 1 1 12 12 ALA HA H 1 1.942 0.000 . . . . . A 95 ALA HA . 25038 1
110 . 1 1 12 12 ALA HB1 H 1 0.829 0.000 . . . . . A 95 ALA HB1 . 25038 1
111 . 1 1 12 12 ALA HB2 H 1 0.829 0.000 . . . . . A 95 ALA HB2 . 25038 1
112 . 1 1 12 12 ALA HB3 H 1 0.829 0.000 . . . . . A 95 ALA HB3 . 25038 1
113 . 1 1 12 12 ALA CA C 13 52.176 0.000 . . . . . A 95 ALA CA . 25038 1
114 . 1 1 12 12 ALA CB C 13 19.077 0.000 . . . . . A 95 ALA CB . 25038 1
115 . 1 1 12 12 ALA N N 15 121.588 0.000 . . . . . A 95 ALA N . 25038 1
116 . 1 1 13 13 SER H H 1 6.513 0.000 . . . . . A 96 SER H . 25038 1
117 . 1 1 13 13 SER HA H 1 4.972 0.000 . . . . . A 96 SER HA . 25038 1
118 . 1 1 13 13 SER HB2 H 1 4.117 0.000 . . . . . A 96 SER HB2 . 25038 1
119 . 1 1 13 13 SER HB3 H 1 3.925 0.000 . . . . . A 96 SER HB3 . 25038 1
120 . 1 1 13 13 SER CA C 13 53.248 0.000 . . . . . A 96 SER CA . 25038 1
121 . 1 1 13 13 SER CB C 13 67.028 0.010 . . . . . A 96 SER CB . 25038 1
122 . 1 1 13 13 SER N N 15 115.382 0.000 . . . . . A 96 SER N . 25038 1
123 . 1 1 14 14 PRO HA H 1 4.618 0.000 . . . . . A 97 PRO HA . 25038 1
124 . 1 1 14 14 PRO HB2 H 1 2.327 0.000 . . . . . A 97 PRO HB2 . 25038 1
125 . 1 1 14 14 PRO HB3 H 1 2.327 0.000 . . . . . A 97 PRO HB3 . 25038 1
126 . 1 1 14 14 PRO HG2 H 1 2.081 0.000 . . . . . A 97 PRO HG2 . 25038 1
127 . 1 1 14 14 PRO HG3 H 1 2.020 0.000 . . . . . A 97 PRO HG3 . 25038 1
128 . 1 1 14 14 PRO HD2 H 1 3.842 0.000 . . . . . A 97 PRO HD2 . 25038 1
129 . 1 1 14 14 PRO HD3 H 1 3.664 0.000 . . . . . A 97 PRO HD3 . 25038 1
130 . 1 1 14 14 PRO CA C 13 64.555 0.000 . . . . . A 97 PRO CA . 25038 1
131 . 1 1 14 14 PRO CB C 13 32.140 0.000 . . . . . A 97 PRO CB . 25038 1
132 . 1 1 14 14 PRO CG C 13 27.491 0.019 . . . . . A 97 PRO CG . 25038 1
133 . 1 1 14 14 PRO CD C 13 50.659 0.023 . . . . . A 97 PRO CD . 25038 1
134 . 1 1 15 15 VAL H H 1 8.573 0.000 . . . . . A 98 VAL H . 25038 1
135 . 1 1 15 15 VAL HA H 1 5.052 0.000 . . . . . A 98 VAL HA . 25038 1
136 . 1 1 15 15 VAL HB H 1 2.168 0.000 . . . . . A 98 VAL HB . 25038 1
137 . 1 1 15 15 VAL HG11 H 1 0.812 0.000 . . . . . A 98 VAL HG11 . 25038 1
138 . 1 1 15 15 VAL HG12 H 1 0.812 0.000 . . . . . A 98 VAL HG12 . 25038 1
139 . 1 1 15 15 VAL HG13 H 1 0.812 0.000 . . . . . A 98 VAL HG13 . 25038 1
140 . 1 1 15 15 VAL HG21 H 1 0.705 0.000 . . . . . A 98 VAL HG21 . 25038 1
141 . 1 1 15 15 VAL HG22 H 1 0.705 0.000 . . . . . A 98 VAL HG22 . 25038 1
142 . 1 1 15 15 VAL HG23 H 1 0.705 0.000 . . . . . A 98 VAL HG23 . 25038 1
143 . 1 1 15 15 VAL CA C 13 60.937 0.000 . . . . . A 98 VAL CA . 25038 1
144 . 1 1 15 15 VAL CB C 13 31.783 0.000 . . . . . A 98 VAL CB . 25038 1
145 . 1 1 15 15 VAL CG1 C 13 23.097 0.000 . . . . . A 98 VAL CG1 . 25038 1
146 . 1 1 15 15 VAL CG2 C 13 21.769 0.000 . . . . . A 98 VAL CG2 . 25038 1
147 . 1 1 15 15 VAL N N 15 119.140 0.000 . . . . . A 98 VAL N . 25038 1
148 . 1 1 16 16 VAL H H 1 9.500 0.000 . . . . . A 99 VAL H . 25038 1
149 . 1 1 16 16 VAL HA H 1 4.972 0.000 . . . . . A 99 VAL HA . 25038 1
150 . 1 1 16 16 VAL HB H 1 2.122 0.000 . . . . . A 99 VAL HB . 25038 1
151 . 1 1 16 16 VAL HG11 H 1 0.954 0.000 . . . . . A 99 VAL HG11 . 25038 1
152 . 1 1 16 16 VAL HG12 H 1 0.954 0.000 . . . . . A 99 VAL HG12 . 25038 1
153 . 1 1 16 16 VAL HG13 H 1 0.954 0.000 . . . . . A 99 VAL HG13 . 25038 1
154 . 1 1 16 16 VAL HG21 H 1 1.141 0.000 . . . . . A 99 VAL HG21 . 25038 1
155 . 1 1 16 16 VAL HG22 H 1 1.141 0.000 . . . . . A 99 VAL HG22 . 25038 1
156 . 1 1 16 16 VAL HG23 H 1 1.141 0.000 . . . . . A 99 VAL HG23 . 25038 1
157 . 1 1 16 16 VAL CA C 13 59.440 0.000 . . . . . A 99 VAL CA . 25038 1
158 . 1 1 16 16 VAL CB C 13 33.979 0.000 . . . . . A 99 VAL CB . 25038 1
159 . 1 1 16 16 VAL CG1 C 13 22.366 0.000 . . . . . A 99 VAL CG1 . 25038 1
160 . 1 1 16 16 VAL CG2 C 13 21.278 0.000 . . . . . A 99 VAL CG2 . 25038 1
161 . 1 1 16 16 VAL N N 15 120.615 0.000 . . . . . A 99 VAL N . 25038 1
162 . 1 1 17 17 HIS H H 1 9.477 0.000 . . . . . A 100 HIS H . 25038 1
163 . 1 1 17 17 HIS HA H 1 5.324 0.000 . . . . . A 100 HIS HA . 25038 1
164 . 1 1 17 17 HIS HB2 H 1 3.108 0.000 . . . . . A 100 HIS HB2 . 25038 1
165 . 1 1 17 17 HIS HB3 H 1 2.691 0.000 . . . . . A 100 HIS HB3 . 25038 1
166 . 1 1 17 17 HIS HD2 H 1 7.022 0.000 . . . . . A 100 HIS HD2 . 25038 1
167 . 1 1 17 17 HIS HE1 H 1 7.694 0.000 . . . . . A 100 HIS HE1 . 25038 1
168 . 1 1 17 17 HIS CA C 13 54.340 0.000 . . . . . A 100 HIS CA . 25038 1
169 . 1 1 17 17 HIS CB C 13 34.115 0.012 . . . . . A 100 HIS CB . 25038 1
170 . 1 1 17 17 HIS CD2 C 13 117.275 0.000 . . . . . A 100 HIS CD2 . 25038 1
171 . 1 1 17 17 HIS CE1 C 13 137.665 0.000 . . . . . A 100 HIS CE1 . 25038 1
172 . 1 1 17 17 HIS N N 15 125.469 0.000 . . . . . A 100 HIS N . 25038 1
173 . 1 1 18 18 ILE H H 1 9.384 0.000 . . . . . A 101 ILE H . 25038 1
174 . 1 1 18 18 ILE HA H 1 5.213 0.000 . . . . . A 101 ILE HA . 25038 1
175 . 1 1 18 18 ILE HB H 1 1.898 0.000 . . . . . A 101 ILE HB . 25038 1
176 . 1 1 18 18 ILE HG12 H 1 1.442 0.000 . . . . . A 101 ILE HG12 . 25038 1
177 . 1 1 18 18 ILE HG13 H 1 1.226 0.000 . . . . . A 101 ILE HG13 . 25038 1
178 . 1 1 18 18 ILE HG21 H 1 0.852 0.000 . . . . . A 101 ILE HG21 . 25038 1
179 . 1 1 18 18 ILE HG22 H 1 0.852 0.000 . . . . . A 101 ILE HG22 . 25038 1
180 . 1 1 18 18 ILE HG23 H 1 0.852 0.000 . . . . . A 101 ILE HG23 . 25038 1
181 . 1 1 18 18 ILE HD11 H 1 0.794 0.000 . . . . . A 101 ILE HD11 . 25038 1
182 . 1 1 18 18 ILE HD12 H 1 0.794 0.000 . . . . . A 101 ILE HD12 . 25038 1
183 . 1 1 18 18 ILE HD13 H 1 0.794 0.000 . . . . . A 101 ILE HD13 . 25038 1
184 . 1 1 18 18 ILE CA C 13 59.309 0.000 . . . . . A 101 ILE CA . 25038 1
185 . 1 1 18 18 ILE CB C 13 38.955 0.000 . . . . . A 101 ILE CB . 25038 1
186 . 1 1 18 18 ILE CG1 C 13 28.349 0.040 . . . . . A 101 ILE CG1 . 25038 1
187 . 1 1 18 18 ILE CG2 C 13 19.359 0.000 . . . . . A 101 ILE CG2 . 25038 1
188 . 1 1 18 18 ILE CD1 C 13 14.654 0.000 . . . . . A 101 ILE CD1 . 25038 1
189 . 1 1 18 18 ILE N N 15 128.404 0.000 . . . . . A 101 ILE N . 25038 1
190 . 1 1 19 19 ARG H H 1 8.972 0.000 . . . . . A 102 ARG H . 25038 1
191 . 1 1 19 19 ARG HA H 1 5.130 0.000 . . . . . A 102 ARG HA . 25038 1
192 . 1 1 19 19 ARG HB2 H 1 1.937 0.000 . . . . . A 102 ARG HB2 . 25038 1
193 . 1 1 19 19 ARG HB3 H 1 1.819 0.000 . . . . . A 102 ARG HB3 . 25038 1
194 . 1 1 19 19 ARG HG2 H 1 1.568 0.000 . . . . . A 102 ARG HG2 . 25038 1
195 . 1 1 19 19 ARG HG3 H 1 1.440 0.000 . . . . . A 102 ARG HG3 . 25038 1
196 . 1 1 19 19 ARG HD2 H 1 3.083 0.000 . . . . . A 102 ARG HD2 . 25038 1
197 . 1 1 19 19 ARG HD3 H 1 3.083 0.000 . . . . . A 102 ARG HD3 . 25038 1
198 . 1 1 19 19 ARG HE H 1 6.898 0.000 . . . . . A 102 ARG HE . 25038 1
199 . 1 1 19 19 ARG CA C 13 54.218 0.000 . . . . . A 102 ARG CA . 25038 1
200 . 1 1 19 19 ARG CB C 13 34.282 0.010 . . . . . A 102 ARG CB . 25038 1
201 . 1 1 19 19 ARG CG C 13 28.038 0.002 . . . . . A 102 ARG CG . 25038 1
202 . 1 1 19 19 ARG CD C 13 43.372 0.000 . . . . . A 102 ARG CD . 25038 1
203 . 1 1 19 19 ARG N N 15 123.920 0.000 . . . . . A 102 ARG N . 25038 1
204 . 1 1 19 19 ARG NE N 15 85.522 0.000 . . . . . A 102 ARG NE . 25038 1
205 . 1 1 20 20 GLY H H 1 9.082 0.000 . . . . . A 103 GLY H . 25038 1
206 . 1 1 20 20 GLY HA2 H 1 4.369 0.000 . . . . . A 103 GLY HA2 . 25038 1
207 . 1 1 20 20 GLY HA3 H 1 3.968 0.000 . . . . . A 103 GLY HA3 . 25038 1
208 . 1 1 20 20 GLY CA C 13 45.876 0.005 . . . . . A 103 GLY CA . 25038 1
209 . 1 1 20 20 GLY N N 15 108.133 0.000 . . . . . A 103 GLY N . 25038 1
210 . 1 1 21 21 LEU H H 1 7.352 0.000 . . . . . A 104 LEU H . 25038 1
211 . 1 1 21 21 LEU HA H 1 4.256 0.000 . . . . . A 104 LEU HA . 25038 1
212 . 1 1 21 21 LEU HB2 H 1 1.472 0.000 . . . . . A 104 LEU HB2 . 25038 1
213 . 1 1 21 21 LEU HB3 H 1 1.294 0.000 . . . . . A 104 LEU HB3 . 25038 1
214 . 1 1 21 21 LEU HG H 1 1.377 0.000 . . . . . A 104 LEU HG . 25038 1
215 . 1 1 21 21 LEU HD11 H 1 0.608 0.000 . . . . . A 104 LEU HD11 . 25038 1
216 . 1 1 21 21 LEU HD12 H 1 0.608 0.000 . . . . . A 104 LEU HD12 . 25038 1
217 . 1 1 21 21 LEU HD13 H 1 0.608 0.000 . . . . . A 104 LEU HD13 . 25038 1
218 . 1 1 21 21 LEU HD21 H 1 0.811 0.000 . . . . . A 104 LEU HD21 . 25038 1
219 . 1 1 21 21 LEU HD22 H 1 0.811 0.000 . . . . . A 104 LEU HD22 . 25038 1
220 . 1 1 21 21 LEU HD23 H 1 0.811 0.000 . . . . . A 104 LEU HD23 . 25038 1
221 . 1 1 21 21 LEU CA C 13 54.576 0.000 . . . . . A 104 LEU CA . 25038 1
222 . 1 1 21 21 LEU CB C 13 42.832 0.004 . . . . . A 104 LEU CB . 25038 1
223 . 1 1 21 21 LEU CG C 13 27.245 0.000 . . . . . A 104 LEU CG . 25038 1
224 . 1 1 21 21 LEU CD1 C 13 25.978 0.000 . . . . . A 104 LEU CD1 . 25038 1
225 . 1 1 21 21 LEU CD2 C 13 23.790 0.000 . . . . . A 104 LEU CD2 . 25038 1
226 . 1 1 21 21 LEU N N 15 116.963 0.000 . . . . . A 104 LEU N . 25038 1
227 . 1 1 22 22 ILE H H 1 7.619 0.000 . . . . . A 105 ILE H . 25038 1
228 . 1 1 22 22 ILE HA H 1 4.291 0.000 . . . . . A 105 ILE HA . 25038 1
229 . 1 1 22 22 ILE HB H 1 1.773 0.000 . . . . . A 105 ILE HB . 25038 1
230 . 1 1 22 22 ILE HG12 H 1 1.244 0.000 . . . . . A 105 ILE HG12 . 25038 1
231 . 1 1 22 22 ILE HG13 H 1 1.059 0.000 . . . . . A 105 ILE HG13 . 25038 1
232 . 1 1 22 22 ILE HG21 H 1 0.624 0.000 . . . . . A 105 ILE HG21 . 25038 1
233 . 1 1 22 22 ILE HG22 H 1 0.624 0.000 . . . . . A 105 ILE HG22 . 25038 1
234 . 1 1 22 22 ILE HG23 H 1 0.624 0.000 . . . . . A 105 ILE HG23 . 25038 1
235 . 1 1 22 22 ILE HD11 H 1 0.732 0.000 . . . . . A 105 ILE HD11 . 25038 1
236 . 1 1 22 22 ILE HD12 H 1 0.732 0.000 . . . . . A 105 ILE HD12 . 25038 1
237 . 1 1 22 22 ILE HD13 H 1 0.732 0.000 . . . . . A 105 ILE HD13 . 25038 1
238 . 1 1 22 22 ILE CA C 13 60.060 0.000 . . . . . A 105 ILE CA . 25038 1
239 . 1 1 22 22 ILE CB C 13 39.592 0.000 . . . . . A 105 ILE CB . 25038 1
240 . 1 1 22 22 ILE CG1 C 13 26.227 0.013 . . . . . A 105 ILE CG1 . 25038 1
241 . 1 1 22 22 ILE CG2 C 13 17.696 0.000 . . . . . A 105 ILE CG2 . 25038 1
242 . 1 1 22 22 ILE CD1 C 13 14.130 0.000 . . . . . A 105 ILE CD1 . 25038 1
243 . 1 1 22 22 ILE N N 15 115.391 0.000 . . . . . A 105 ILE N . 25038 1
244 . 1 1 23 23 ASP H H 1 7.998 0.000 . . . . . A 106 ASP H . 25038 1
245 . 1 1 23 23 ASP HA H 1 4.430 0.000 . . . . . A 106 ASP HA . 25038 1
246 . 1 1 23 23 ASP HB2 H 1 2.614 0.000 . . . . . A 106 ASP HB2 . 25038 1
247 . 1 1 23 23 ASP HB3 H 1 2.511 0.000 . . . . . A 106 ASP HB3 . 25038 1
248 . 1 1 23 23 ASP CA C 13 55.770 0.000 . . . . . A 106 ASP CA . 25038 1
249 . 1 1 23 23 ASP CB C 13 41.147 0.005 . . . . . A 106 ASP CB . 25038 1
250 . 1 1 23 23 ASP N N 15 119.972 0.000 . . . . . A 106 ASP N . 25038 1
251 . 1 1 24 24 GLY H H 1 8.524 0.000 . . . . . A 107 GLY H . 25038 1
252 . 1 1 24 24 GLY HA2 H 1 4.164 0.000 . . . . . A 107 GLY HA2 . 25038 1
253 . 1 1 24 24 GLY HA3 H 1 3.702 0.000 . . . . . A 107 GLY HA3 . 25038 1
254 . 1 1 24 24 GLY CA C 13 45.444 0.006 . . . . . A 107 GLY CA . 25038 1
255 . 1 1 24 24 GLY N N 15 109.601 0.000 . . . . . A 107 GLY N . 25038 1
256 . 1 1 25 25 VAL H H 1 7.024 0.000 . . . . . A 108 VAL H . 25038 1
257 . 1 1 25 25 VAL HA H 1 4.072 0.000 . . . . . A 108 VAL HA . 25038 1
258 . 1 1 25 25 VAL HB H 1 1.981 0.000 . . . . . A 108 VAL HB . 25038 1
259 . 1 1 25 25 VAL HG11 H 1 1.022 0.000 . . . . . A 108 VAL HG11 . 25038 1
260 . 1 1 25 25 VAL HG12 H 1 1.022 0.000 . . . . . A 108 VAL HG12 . 25038 1
261 . 1 1 25 25 VAL HG13 H 1 1.022 0.000 . . . . . A 108 VAL HG13 . 25038 1
262 . 1 1 25 25 VAL HG21 H 1 0.920 0.000 . . . . . A 108 VAL HG21 . 25038 1
263 . 1 1 25 25 VAL HG22 H 1 0.920 0.000 . . . . . A 108 VAL HG22 . 25038 1
264 . 1 1 25 25 VAL HG23 H 1 0.920 0.000 . . . . . A 108 VAL HG23 . 25038 1
265 . 1 1 25 25 VAL CA C 13 63.360 0.000 . . . . . A 108 VAL CA . 25038 1
266 . 1 1 25 25 VAL CB C 13 32.128 0.000 . . . . . A 108 VAL CB . 25038 1
267 . 1 1 25 25 VAL CG1 C 13 23.438 0.000 . . . . . A 108 VAL CG1 . 25038 1
268 . 1 1 25 25 VAL CG2 C 13 22.181 0.000 . . . . . A 108 VAL CG2 . 25038 1
269 . 1 1 25 25 VAL N N 15 120.038 0.000 . . . . . A 108 VAL N . 25038 1
270 . 1 1 26 26 VAL H H 1 8.880 0.000 . . . . . A 109 VAL H . 25038 1
271 . 1 1 26 26 VAL HA H 1 4.799 0.000 . . . . . A 109 VAL HA . 25038 1
272 . 1 1 26 26 VAL HB H 1 2.499 0.000 . . . . . A 109 VAL HB . 25038 1
273 . 1 1 26 26 VAL HG11 H 1 1.011 0.000 . . . . . A 109 VAL HG11 . 25038 1
274 . 1 1 26 26 VAL HG12 H 1 1.011 0.000 . . . . . A 109 VAL HG12 . 25038 1
275 . 1 1 26 26 VAL HG13 H 1 1.011 0.000 . . . . . A 109 VAL HG13 . 25038 1
276 . 1 1 26 26 VAL HG21 H 1 0.966 0.000 . . . . . A 109 VAL HG21 . 25038 1
277 . 1 1 26 26 VAL HG22 H 1 0.966 0.000 . . . . . A 109 VAL HG22 . 25038 1
278 . 1 1 26 26 VAL HG23 H 1 0.966 0.000 . . . . . A 109 VAL HG23 . 25038 1
279 . 1 1 26 26 VAL CA C 13 59.127 0.000 . . . . . A 109 VAL CA . 25038 1
280 . 1 1 26 26 VAL CB C 13 35.660 0.000 . . . . . A 109 VAL CB . 25038 1
281 . 1 1 26 26 VAL CG1 C 13 21.621 0.000 . . . . . A 109 VAL CG1 . 25038 1
282 . 1 1 26 26 VAL CG2 C 13 19.092 0.000 . . . . . A 109 VAL CG2 . 25038 1
283 . 1 1 26 26 VAL N N 15 119.135 0.000 . . . . . A 109 VAL N . 25038 1
284 . 1 1 27 27 GLU H H 1 9.603 0.000 . . . . . A 110 GLU H . 25038 1
285 . 1 1 27 27 GLU HA H 1 3.607 0.000 . . . . . A 110 GLU HA . 25038 1
286 . 1 1 27 27 GLU HB2 H 1 2.103 0.000 . . . . . A 110 GLU HB2 . 25038 1
287 . 1 1 27 27 GLU HB3 H 1 1.885 0.000 . . . . . A 110 GLU HB3 . 25038 1
288 . 1 1 27 27 GLU HG2 H 1 2.340 0.000 . . . . . A 110 GLU HG2 . 25038 1
289 . 1 1 27 27 GLU HG3 H 1 2.070 0.000 . . . . . A 110 GLU HG3 . 25038 1
290 . 1 1 27 27 GLU CA C 13 61.975 0.000 . . . . . A 110 GLU CA . 25038 1
291 . 1 1 27 27 GLU CB C 13 28.929 0.009 . . . . . A 110 GLU CB . 25038 1
292 . 1 1 27 27 GLU CG C 13 37.174 0.007 . . . . . A 110 GLU CG . 25038 1
293 . 1 1 27 27 GLU N N 15 122.627 0.000 . . . . . A 110 GLU N . 25038 1
294 . 1 1 28 28 ALA H H 1 8.604 0.000 . . . . . A 111 ALA H . 25038 1
295 . 1 1 28 28 ALA HA H 1 4.072 0.000 . . . . . A 111 ALA HA . 25038 1
296 . 1 1 28 28 ALA HB1 H 1 1.441 0.000 . . . . . A 111 ALA HB1 . 25038 1
297 . 1 1 28 28 ALA HB2 H 1 1.441 0.000 . . . . . A 111 ALA HB2 . 25038 1
298 . 1 1 28 28 ALA HB3 H 1 1.441 0.000 . . . . . A 111 ALA HB3 . 25038 1
299 . 1 1 28 28 ALA CA C 13 55.422 0.000 . . . . . A 111 ALA CA . 25038 1
300 . 1 1 28 28 ALA CB C 13 18.647 0.000 . . . . . A 111 ALA CB . 25038 1
301 . 1 1 28 28 ALA N N 15 118.291 0.000 . . . . . A 111 ALA N . 25038 1
302 . 1 1 29 29 ASP H H 1 7.612 0.000 . . . . . A 112 ASP H . 25038 1
303 . 1 1 29 29 ASP HA H 1 4.476 0.000 . . . . . A 112 ASP HA . 25038 1
304 . 1 1 29 29 ASP HB2 H 1 3.045 0.000 . . . . . A 112 ASP HB2 . 25038 1
305 . 1 1 29 29 ASP HB3 H 1 2.603 0.000 . . . . . A 112 ASP HB3 . 25038 1
306 . 1 1 29 29 ASP CA C 13 57.490 0.000 . . . . . A 112 ASP CA . 25038 1
307 . 1 1 29 29 ASP CB C 13 42.002 0.010 . . . . . A 112 ASP CB . 25038 1
308 . 1 1 29 29 ASP N N 15 115.647 0.000 . . . . . A 112 ASP N . 25038 1
309 . 1 1 30 30 LEU H H 1 7.319 0.000 . . . . . A 113 LEU H . 25038 1
310 . 1 1 30 30 LEU HA H 1 3.996 0.000 . . . . . A 113 LEU HA . 25038 1
311 . 1 1 30 30 LEU HB2 H 1 2.143 0.000 . . . . . A 113 LEU HB2 . 25038 1
312 . 1 1 30 30 LEU HB3 H 1 1.269 0.000 . . . . . A 113 LEU HB3 . 25038 1
313 . 1 1 30 30 LEU HG H 1 1.490 0.000 . . . . . A 113 LEU HG . 25038 1
314 . 1 1 30 30 LEU HD11 H 1 0.708 0.000 . . . . . A 113 LEU HD11 . 25038 1
315 . 1 1 30 30 LEU HD12 H 1 0.708 0.000 . . . . . A 113 LEU HD12 . 25038 1
316 . 1 1 30 30 LEU HD13 H 1 0.708 0.000 . . . . . A 113 LEU HD13 . 25038 1
317 . 1 1 30 30 LEU HD21 H 1 0.753 0.000 . . . . . A 113 LEU HD21 . 25038 1
318 . 1 1 30 30 LEU HD22 H 1 0.753 0.000 . . . . . A 113 LEU HD22 . 25038 1
319 . 1 1 30 30 LEU HD23 H 1 0.753 0.000 . . . . . A 113 LEU HD23 . 25038 1
320 . 1 1 30 30 LEU CA C 13 57.822 0.000 . . . . . A 113 LEU CA . 25038 1
321 . 1 1 30 30 LEU CB C 13 41.117 0.014 . . . . . A 113 LEU CB . 25038 1
322 . 1 1 30 30 LEU CG C 13 28.339 0.000 . . . . . A 113 LEU CG . 25038 1
323 . 1 1 30 30 LEU CD1 C 13 26.939 0.000 . . . . . A 113 LEU CD1 . 25038 1
324 . 1 1 30 30 LEU CD2 C 13 25.805 0.000 . . . . . A 113 LEU CD2 . 25038 1
325 . 1 1 30 30 LEU N N 15 120.848 0.000 . . . . . A 113 LEU N . 25038 1
326 . 1 1 31 31 VAL H H 1 7.856 0.000 . . . . . A 114 VAL H . 25038 1
327 . 1 1 31 31 VAL HA H 1 3.368 0.000 . . . . . A 114 VAL HA . 25038 1
328 . 1 1 31 31 VAL HB H 1 2.015 0.000 . . . . . A 114 VAL HB . 25038 1
329 . 1 1 31 31 VAL HG11 H 1 0.941 0.000 . . . . . A 114 VAL HG11 . 25038 1
330 . 1 1 31 31 VAL HG12 H 1 0.941 0.000 . . . . . A 114 VAL HG12 . 25038 1
331 . 1 1 31 31 VAL HG13 H 1 0.941 0.000 . . . . . A 114 VAL HG13 . 25038 1
332 . 1 1 31 31 VAL HG21 H 1 0.907 0.000 . . . . . A 114 VAL HG21 . 25038 1
333 . 1 1 31 31 VAL HG22 H 1 0.907 0.000 . . . . . A 114 VAL HG22 . 25038 1
334 . 1 1 31 31 VAL HG23 H 1 0.907 0.000 . . . . . A 114 VAL HG23 . 25038 1
335 . 1 1 31 31 VAL CA C 13 66.945 0.000 . . . . . A 114 VAL CA . 25038 1
336 . 1 1 31 31 VAL CB C 13 31.915 0.000 . . . . . A 114 VAL CB . 25038 1
337 . 1 1 31 31 VAL CG1 C 13 22.726 0.000 . . . . . A 114 VAL CG1 . 25038 1
338 . 1 1 31 31 VAL CG2 C 13 21.338 0.000 . . . . . A 114 VAL CG2 . 25038 1
339 . 1 1 31 31 VAL N N 15 118.911 0.000 . . . . . A 114 VAL N . 25038 1
340 . 1 1 32 32 GLU H H 1 8.067 0.000 . . . . . A 115 GLU H . 25038 1
341 . 1 1 32 32 GLU HA H 1 3.976 0.000 . . . . . A 115 GLU HA . 25038 1
342 . 1 1 32 32 GLU HB2 H 1 2.208 0.000 . . . . . A 115 GLU HB2 . 25038 1
343 . 1 1 32 32 GLU HB3 H 1 2.077 0.000 . . . . . A 115 GLU HB3 . 25038 1
344 . 1 1 32 32 GLU HG2 H 1 2.402 0.000 . . . . . A 115 GLU HG2 . 25038 1
345 . 1 1 32 32 GLU HG3 H 1 2.337 0.000 . . . . . A 115 GLU HG3 . 25038 1
346 . 1 1 32 32 GLU CA C 13 59.362 0.000 . . . . . A 115 GLU CA . 25038 1
347 . 1 1 32 32 GLU CB C 13 29.691 0.005 . . . . . A 115 GLU CB . 25038 1
348 . 1 1 32 32 GLU CG C 13 36.184 0.002 . . . . . A 115 GLU CG . 25038 1
349 . 1 1 32 32 GLU N N 15 117.004 0.000 . . . . . A 115 GLU N . 25038 1
350 . 1 1 33 33 ALA H H 1 7.115 0.000 . . . . . A 116 ALA H . 25038 1
351 . 1 1 33 33 ALA HA H 1 4.478 0.000 . . . . . A 116 ALA HA . 25038 1
352 . 1 1 33 33 ALA HB1 H 1 1.677 0.000 . . . . . A 116 ALA HB1 . 25038 1
353 . 1 1 33 33 ALA HB2 H 1 1.677 0.000 . . . . . A 116 ALA HB2 . 25038 1
354 . 1 1 33 33 ALA HB3 H 1 1.677 0.000 . . . . . A 116 ALA HB3 . 25038 1
355 . 1 1 33 33 ALA CA C 13 54.046 0.000 . . . . . A 116 ALA CA . 25038 1
356 . 1 1 33 33 ALA CB C 13 21.467 0.000 . . . . . A 116 ALA CB . 25038 1
357 . 1 1 33 33 ALA N N 15 116.819 0.000 . . . . . A 116 ALA N . 25038 1
358 . 1 1 34 34 LEU H H 1 7.827 0.000 . . . . . A 117 LEU H . 25038 1
359 . 1 1 34 34 LEU HA H 1 5.046 0.000 . . . . . A 117 LEU HA . 25038 1
360 . 1 1 34 34 LEU HB2 H 1 2.051 0.000 . . . . . A 117 LEU HB2 . 25038 1
361 . 1 1 34 34 LEU HB3 H 1 1.905 0.000 . . . . . A 117 LEU HB3 . 25038 1
362 . 1 1 34 34 LEU HG H 1 1.938 0.000 . . . . . A 117 LEU HG . 25038 1
363 . 1 1 34 34 LEU HD11 H 1 0.924 0.000 . . . . . A 117 LEU HD11 . 25038 1
364 . 1 1 34 34 LEU HD12 H 1 0.924 0.000 . . . . . A 117 LEU HD12 . 25038 1
365 . 1 1 34 34 LEU HD13 H 1 0.924 0.000 . . . . . A 117 LEU HD13 . 25038 1
366 . 1 1 34 34 LEU HD21 H 1 1.115 0.000 . . . . . A 117 LEU HD21 . 25038 1
367 . 1 1 34 34 LEU HD22 H 1 1.115 0.000 . . . . . A 117 LEU HD22 . 25038 1
368 . 1 1 34 34 LEU HD23 H 1 1.115 0.000 . . . . . A 117 LEU HD23 . 25038 1
369 . 1 1 34 34 LEU CA C 13 55.269 0.000 . . . . . A 117 LEU CA . 25038 1
370 . 1 1 34 34 LEU CB C 13 43.448 0.006 . . . . . A 117 LEU CB . 25038 1
371 . 1 1 34 34 LEU CG C 13 27.956 0.000 . . . . . A 117 LEU CG . 25038 1
372 . 1 1 34 34 LEU CD1 C 13 27.052 0.000 . . . . . A 117 LEU CD1 . 25038 1
373 . 1 1 34 34 LEU CD2 C 13 23.470 0.000 . . . . . A 117 LEU CD2 . 25038 1
374 . 1 1 34 34 LEU N N 15 114.158 0.000 . . . . . A 117 LEU N . 25038 1
375 . 1 1 35 35 GLN H H 1 8.506 0.000 . . . . . A 118 GLN H . 25038 1
376 . 1 1 35 35 GLN HA H 1 4.682 0.000 . . . . . A 118 GLN HA . 25038 1
377 . 1 1 35 35 GLN HB2 H 1 2.279 0.000 . . . . . A 118 GLN HB2 . 25038 1
378 . 1 1 35 35 GLN HB3 H 1 2.218 0.000 . . . . . A 118 GLN HB3 . 25038 1
379 . 1 1 35 35 GLN HG2 H 1 2.624 0.000 . . . . . A 118 GLN HG2 . 25038 1
380 . 1 1 35 35 GLN HG3 H 1 2.268 0.000 . . . . . A 118 GLN HG3 . 25038 1
381 . 1 1 35 35 GLN HE21 H 1 7.424 0.000 . . . . . A 118 GLN HE21 . 25038 1
382 . 1 1 35 35 GLN HE22 H 1 6.718 0.000 . . . . . A 118 GLN HE22 . 25038 1
383 . 1 1 35 35 GLN CA C 13 57.942 0.000 . . . . . A 118 GLN CA . 25038 1
384 . 1 1 35 35 GLN CB C 13 26.773 0.000 . . . . . A 118 GLN CB . 25038 1
385 . 1 1 35 35 GLN CG C 13 32.647 0.006 . . . . . A 118 GLN CG . 25038 1
386 . 1 1 35 35 GLN N N 15 118.824 0.000 . . . . . A 118 GLN N . 25038 1
387 . 1 1 35 35 GLN NE2 N 15 110.535 0.000 . . . . . A 118 GLN NE2 . 25038 1
388 . 1 1 36 36 GLU H H 1 7.928 0.000 . . . . . A 119 GLU H . 25038 1
389 . 1 1 36 36 GLU HA H 1 3.995 0.000 . . . . . A 119 GLU HA . 25038 1
390 . 1 1 36 36 GLU HB2 H 1 1.584 0.000 . . . . . A 119 GLU HB2 . 25038 1
391 . 1 1 36 36 GLU HB3 H 1 1.533 0.000 . . . . . A 119 GLU HB3 . 25038 1
392 . 1 1 36 36 GLU HG2 H 1 1.308 0.000 . . . . . A 119 GLU HG2 . 25038 1
393 . 1 1 36 36 GLU HG3 H 1 1.308 0.000 . . . . . A 119 GLU HG3 . 25038 1
394 . 1 1 36 36 GLU CA C 13 57.622 0.000 . . . . . A 119 GLU CA . 25038 1
395 . 1 1 36 36 GLU CB C 13 29.050 0.022 . . . . . A 119 GLU CB . 25038 1
396 . 1 1 36 36 GLU CG C 13 35.380 0.000 . . . . . A 119 GLU CG . 25038 1
397 . 1 1 36 36 GLU N N 15 117.865 0.000 . . . . . A 119 GLU N . 25038 1
398 . 1 1 37 37 PHE H H 1 7.791 0.000 . . . . . A 120 PHE H . 25038 1
399 . 1 1 37 37 PHE HA H 1 4.529 0.000 . . . . . A 120 PHE HA . 25038 1
400 . 1 1 37 37 PHE HB2 H 1 3.569 0.000 . . . . . A 120 PHE HB2 . 25038 1
401 . 1 1 37 37 PHE HB3 H 1 3.145 0.000 . . . . . A 120 PHE HB3 . 25038 1
402 . 1 1 37 37 PHE HD1 H 1 7.118 0.000 . . . . . A 120 PHE HD1 . 25038 1
403 . 1 1 37 37 PHE HD2 H 1 7.118 0.000 . . . . . A 120 PHE HD2 . 25038 1
404 . 1 1 37 37 PHE HE1 H 1 6.997 0.000 . . . . . A 120 PHE HE1 . 25038 1
405 . 1 1 37 37 PHE HE2 H 1 6.997 0.000 . . . . . A 120 PHE HE2 . 25038 1
406 . 1 1 37 37 PHE HZ H 1 6.488 0.000 . . . . . A 120 PHE HZ . 25038 1
407 . 1 1 37 37 PHE CA C 13 59.579 0.000 . . . . . A 120 PHE CA . 25038 1
408 . 1 1 37 37 PHE CB C 13 38.359 0.004 . . . . . A 120 PHE CB . 25038 1
409 . 1 1 37 37 PHE CD2 C 13 128.546 0.000 . . . . . A 120 PHE CD2 . 25038 1
410 . 1 1 37 37 PHE CE2 C 13 131.356 0.000 . . . . . A 120 PHE CE2 . 25038 1
411 . 1 1 37 37 PHE CZ C 13 129.725 0.000 . . . . . A 120 PHE CZ . 25038 1
412 . 1 1 37 37 PHE N N 15 118.581 0.000 . . . . . A 120 PHE N . 25038 1
413 . 1 1 38 38 GLY H H 1 7.475 0.000 . . . . . A 121 GLY H . 25038 1
414 . 1 1 38 38 GLY HA2 H 1 4.390 0.000 . . . . . A 121 GLY HA2 . 25038 1
415 . 1 1 38 38 GLY HA3 H 1 4.148 0.000 . . . . . A 121 GLY HA3 . 25038 1
416 . 1 1 38 38 GLY CA C 13 44.976 0.002 . . . . . A 121 GLY CA . 25038 1
417 . 1 1 38 38 GLY N N 15 107.714 0.000 . . . . . A 121 GLY N . 25038 1
418 . 1 1 39 39 PRO HA H 1 4.595 0.000 . . . . . A 122 PRO HA . 25038 1
419 . 1 1 39 39 PRO HB2 H 1 2.342 0.000 . . . . . A 122 PRO HB2 . 25038 1
420 . 1 1 39 39 PRO HB3 H 1 1.967 0.000 . . . . . A 122 PRO HB3 . 25038 1
421 . 1 1 39 39 PRO HG2 H 1 2.181 0.000 . . . . . A 122 PRO HG2 . 25038 1
422 . 1 1 39 39 PRO HG3 H 1 2.110 0.000 . . . . . A 122 PRO HG3 . 25038 1
423 . 1 1 39 39 PRO HD2 H 1 3.843 0.000 . . . . . A 122 PRO HD2 . 25038 1
424 . 1 1 39 39 PRO HD3 H 1 3.721 0.000 . . . . . A 122 PRO HD3 . 25038 1
425 . 1 1 39 39 PRO CA C 13 63.244 0.000 . . . . . A 122 PRO CA . 25038 1
426 . 1 1 39 39 PRO CB C 13 32.142 0.019 . . . . . A 122 PRO CB . 25038 1
427 . 1 1 39 39 PRO CG C 13 28.273 0.012 . . . . . A 122 PRO CG . 25038 1
428 . 1 1 39 39 PRO CD C 13 49.822 0.002 . . . . . A 122 PRO CD . 25038 1
429 . 1 1 40 40 ILE H H 1 8.653 0.000 . . . . . A 123 ILE H . 25038 1
430 . 1 1 40 40 ILE HA H 1 3.971 0.000 . . . . . A 123 ILE HA . 25038 1
431 . 1 1 40 40 ILE HB H 1 1.581 0.000 . . . . . A 123 ILE HB . 25038 1
432 . 1 1 40 40 ILE HG12 H 1 1.738 0.000 . . . . . A 123 ILE HG12 . 25038 1
433 . 1 1 40 40 ILE HG13 H 1 0.110 0.000 . . . . . A 123 ILE HG13 . 25038 1
434 . 1 1 40 40 ILE HG21 H 1 0.518 0.000 . . . . . A 123 ILE HG21 . 25038 1
435 . 1 1 40 40 ILE HG22 H 1 0.518 0.000 . . . . . A 123 ILE HG22 . 25038 1
436 . 1 1 40 40 ILE HG23 H 1 0.518 0.000 . . . . . A 123 ILE HG23 . 25038 1
437 . 1 1 40 40 ILE HD11 H 1 0.548 0.000 . . . . . A 123 ILE HD11 . 25038 1
438 . 1 1 40 40 ILE HD12 H 1 0.548 0.000 . . . . . A 123 ILE HD12 . 25038 1
439 . 1 1 40 40 ILE HD13 H 1 0.548 0.000 . . . . . A 123 ILE HD13 . 25038 1
440 . 1 1 40 40 ILE CA C 13 61.760 0.000 . . . . . A 123 ILE CA . 25038 1
441 . 1 1 40 40 ILE CB C 13 40.972 0.000 . . . . . A 123 ILE CB . 25038 1
442 . 1 1 40 40 ILE CG1 C 13 28.755 0.007 . . . . . A 123 ILE CG1 . 25038 1
443 . 1 1 40 40 ILE CG2 C 13 18.082 0.000 . . . . . A 123 ILE CG2 . 25038 1
444 . 1 1 40 40 ILE CD1 C 13 14.700 0.000 . . . . . A 123 ILE CD1 . 25038 1
445 . 1 1 40 40 ILE N N 15 125.208 0.000 . . . . . A 123 ILE N . 25038 1
446 . 1 1 41 41 SER H H 1 9.281 0.000 . . . . . A 124 SER H . 25038 1
447 . 1 1 41 41 SER HA H 1 4.651 0.000 . . . . . A 124 SER HA . 25038 1
448 . 1 1 41 41 SER HB2 H 1 3.693 0.000 . . . . . A 124 SER HB2 . 25038 1
449 . 1 1 41 41 SER HB3 H 1 3.640 0.000 . . . . . A 124 SER HB3 . 25038 1
450 . 1 1 41 41 SER CA C 13 59.320 0.000 . . . . . A 124 SER CA . 25038 1
451 . 1 1 41 41 SER CB C 13 64.823 0.007 . . . . . A 124 SER CB . 25038 1
452 . 1 1 41 41 SER N N 15 122.827 0.000 . . . . . A 124 SER N . 25038 1
453 . 1 1 42 42 TYR H H 1 7.947 0.000 . . . . . A 125 TYR H . 25038 1
454 . 1 1 42 42 TYR HA H 1 4.610 0.000 . . . . . A 125 TYR HA . 25038 1
455 . 1 1 42 42 TYR HB2 H 1 3.020 0.000 . . . . . A 125 TYR HB2 . 25038 1
456 . 1 1 42 42 TYR HB3 H 1 2.546 0.000 . . . . . A 125 TYR HB3 . 25038 1
457 . 1 1 42 42 TYR HD1 H 1 6.998 0.000 . . . . . A 125 TYR HD1 . 25038 1
458 . 1 1 42 42 TYR HD2 H 1 6.998 0.000 . . . . . A 125 TYR HD2 . 25038 1
459 . 1 1 42 42 TYR HE1 H 1 6.757 0.000 . . . . . A 125 TYR HE1 . 25038 1
460 . 1 1 42 42 TYR HE2 H 1 6.757 0.000 . . . . . A 125 TYR HE2 . 25038 1
461 . 1 1 42 42 TYR CA C 13 59.112 0.000 . . . . . A 125 TYR CA . 25038 1
462 . 1 1 42 42 TYR CB C 13 42.865 0.002 . . . . . A 125 TYR CB . 25038 1
463 . 1 1 42 42 TYR CD1 C 13 133.019 0.000 . . . . . A 125 TYR CD1 . 25038 1
464 . 1 1 42 42 TYR CE1 C 13 118.237 0.000 . . . . . A 125 TYR CE1 . 25038 1
465 . 1 1 42 42 TYR N N 15 121.148 0.000 . . . . . A 125 TYR N . 25038 1
466 . 1 1 43 43 VAL H H 1 7.443 0.000 . . . . . A 126 VAL H . 25038 1
467 . 1 1 43 43 VAL HA H 1 4.749 0.000 . . . . . A 126 VAL HA . 25038 1
468 . 1 1 43 43 VAL HB H 1 1.773 0.000 . . . . . A 126 VAL HB . 25038 1
469 . 1 1 43 43 VAL HG11 H 1 0.812 0.000 . . . . . A 126 VAL HG11 . 25038 1
470 . 1 1 43 43 VAL HG12 H 1 0.812 0.000 . . . . . A 126 VAL HG12 . 25038 1
471 . 1 1 43 43 VAL HG13 H 1 0.812 0.000 . . . . . A 126 VAL HG13 . 25038 1
472 . 1 1 43 43 VAL HG21 H 1 0.768 0.000 . . . . . A 126 VAL HG21 . 25038 1
473 . 1 1 43 43 VAL HG22 H 1 0.768 0.000 . . . . . A 126 VAL HG22 . 25038 1
474 . 1 1 43 43 VAL HG23 H 1 0.768 0.000 . . . . . A 126 VAL HG23 . 25038 1
475 . 1 1 43 43 VAL CA C 13 60.531 0.000 . . . . . A 126 VAL CA . 25038 1
476 . 1 1 43 43 VAL CB C 13 35.693 0.000 . . . . . A 126 VAL CB . 25038 1
477 . 1 1 43 43 VAL CG1 C 13 22.108 0.000 . . . . . A 126 VAL CG1 . 25038 1
478 . 1 1 43 43 VAL CG2 C 13 22.002 0.000 . . . . . A 126 VAL CG2 . 25038 1
479 . 1 1 43 43 VAL N N 15 123.893 0.000 . . . . . A 126 VAL N . 25038 1
480 . 1 1 44 44 VAL H H 1 8.917 0.000 . . . . . A 127 VAL H . 25038 1
481 . 1 1 44 44 VAL HA H 1 4.454 0.000 . . . . . A 127 VAL HA . 25038 1
482 . 1 1 44 44 VAL HB H 1 2.013 0.000 . . . . . A 127 VAL HB . 25038 1
483 . 1 1 44 44 VAL HG11 H 1 1.095 0.000 . . . . . A 127 VAL HG11 . 25038 1
484 . 1 1 44 44 VAL HG12 H 1 1.095 0.000 . . . . . A 127 VAL HG12 . 25038 1
485 . 1 1 44 44 VAL HG13 H 1 1.095 0.000 . . . . . A 127 VAL HG13 . 25038 1
486 . 1 1 44 44 VAL HG21 H 1 1.039 0.000 . . . . . A 127 VAL HG21 . 25038 1
487 . 1 1 44 44 VAL HG22 H 1 1.039 0.000 . . . . . A 127 VAL HG22 . 25038 1
488 . 1 1 44 44 VAL HG23 H 1 1.039 0.000 . . . . . A 127 VAL HG23 . 25038 1
489 . 1 1 44 44 VAL CA C 13 61.115 0.000 . . . . . A 127 VAL CA . 25038 1
490 . 1 1 44 44 VAL CB C 13 35.840 0.000 . . . . . A 127 VAL CB . 25038 1
491 . 1 1 44 44 VAL CG1 C 13 22.157 0.000 . . . . . A 127 VAL CG1 . 25038 1
492 . 1 1 44 44 VAL CG2 C 13 21.254 0.000 . . . . . A 127 VAL CG2 . 25038 1
493 . 1 1 44 44 VAL N N 15 123.239 0.000 . . . . . A 127 VAL N . 25038 1
494 . 1 1 45 45 VAL H H 1 8.841 0.000 . . . . . A 128 VAL H . 25038 1
495 . 1 1 45 45 VAL HA H 1 4.261 0.000 . . . . . A 128 VAL HA . 25038 1
496 . 1 1 45 45 VAL HB H 1 2.022 0.000 . . . . . A 128 VAL HB . 25038 1
497 . 1 1 45 45 VAL HG11 H 1 0.835 0.000 . . . . . A 128 VAL HG11 . 25038 1
498 . 1 1 45 45 VAL HG12 H 1 0.835 0.000 . . . . . A 128 VAL HG12 . 25038 1
499 . 1 1 45 45 VAL HG13 H 1 0.835 0.000 . . . . . A 128 VAL HG13 . 25038 1
500 . 1 1 45 45 VAL HG21 H 1 0.763 0.000 . . . . . A 128 VAL HG21 . 25038 1
501 . 1 1 45 45 VAL HG22 H 1 0.763 0.000 . . . . . A 128 VAL HG22 . 25038 1
502 . 1 1 45 45 VAL HG23 H 1 0.763 0.000 . . . . . A 128 VAL HG23 . 25038 1
503 . 1 1 45 45 VAL CA C 13 61.668 0.000 . . . . . A 128 VAL CA . 25038 1
504 . 1 1 45 45 VAL CB C 13 33.172 0.000 . . . . . A 128 VAL CB . 25038 1
505 . 1 1 45 45 VAL CG1 C 13 21.683 0.000 . . . . . A 128 VAL CG1 . 25038 1
506 . 1 1 45 45 VAL CG2 C 13 21.743 0.000 . . . . . A 128 VAL CG2 . 25038 1
507 . 1 1 45 45 VAL N N 15 125.271 0.000 . . . . . A 128 VAL N . 25038 1
508 . 1 1 46 46 MET H H 1 8.705 0.000 . . . . . A 129 MET H . 25038 1
509 . 1 1 46 46 MET HB2 H 1 2.688 0.000 . . . . . A 129 MET HB2 . 25038 1
510 . 1 1 46 46 MET HB3 H 1 2.339 0.000 . . . . . A 129 MET HB3 . 25038 1
511 . 1 1 46 46 MET HE1 H 1 2.076 0.000 . . . . . A 129 MET HE1 . 25038 1
512 . 1 1 46 46 MET HE2 H 1 2.076 0.000 . . . . . A 129 MET HE2 . 25038 1
513 . 1 1 46 46 MET HE3 H 1 2.076 0.000 . . . . . A 129 MET HE3 . 25038 1
514 . 1 1 46 46 MET CB C 13 32.578 0.010 . . . . . A 129 MET CB . 25038 1
515 . 1 1 46 46 MET CE C 13 18.062 0.000 . . . . . A 129 MET CE . 25038 1
516 . 1 1 46 46 MET N N 15 125.802 0.000 . . . . . A 129 MET N . 25038 1
517 . 1 1 47 47 PRO HA H 1 4.316 0.000 . . . . . A 130 PRO HA . 25038 1
518 . 1 1 47 47 PRO HB2 H 1 2.545 0.000 . . . . . A 130 PRO HB2 . 25038 1
519 . 1 1 47 47 PRO HB3 H 1 2.085 0.000 . . . . . A 130 PRO HB3 . 25038 1
520 . 1 1 47 47 PRO HD2 H 1 3.965 0.000 . . . . . A 130 PRO HD2 . 25038 1
521 . 1 1 47 47 PRO HD3 H 1 3.796 0.000 . . . . . A 130 PRO HD3 . 25038 1
522 . 1 1 47 47 PRO CA C 13 65.571 0.000 . . . . . A 130 PRO CA . 25038 1
523 . 1 1 47 47 PRO CB C 13 32.551 0.027 . . . . . A 130 PRO CB . 25038 1
524 . 1 1 47 47 PRO CD C 13 51.328 0.008 . . . . . A 130 PRO CD . 25038 1
525 . 1 1 48 48 LYS HA H 1 4.202 0.000 . . . . . A 131 LYS HA . 25038 1
526 . 1 1 48 48 LYS CA C 13 58.686 0.000 . . . . . A 131 LYS CA . 25038 1
527 . 1 1 49 49 LYS H H 1 7.347 0.000 . . . . . A 132 LYS H . 25038 1
528 . 1 1 49 49 LYS HA H 1 4.503 0.000 . . . . . A 132 LYS HA . 25038 1
529 . 1 1 49 49 LYS HG2 H 1 1.584 0.000 . . . . . A 132 LYS HG2 . 25038 1
530 . 1 1 49 49 LYS HG3 H 1 1.501 0.000 . . . . . A 132 LYS HG3 . 25038 1
531 . 1 1 49 49 LYS CA C 13 54.749 0.000 . . . . . A 132 LYS CA . 25038 1
532 . 1 1 49 49 LYS CG C 13 25.684 0.006 . . . . . A 132 LYS CG . 25038 1
533 . 1 1 49 49 LYS N N 15 114.460 0.000 . . . . . A 132 LYS N . 25038 1
534 . 1 1 50 50 ARG H H 1 8.089 0.000 . . . . . A 133 ARG H . 25038 1
535 . 1 1 50 50 ARG HA H 1 3.941 0.000 . . . . . A 133 ARG HA . 25038 1
536 . 1 1 50 50 ARG HB2 H 1 1.591 0.000 . . . . . A 133 ARG HB2 . 25038 1
537 . 1 1 50 50 ARG HB3 H 1 1.522 0.000 . . . . . A 133 ARG HB3 . 25038 1
538 . 1 1 50 50 ARG HG2 H 1 2.361 0.000 . . . . . A 133 ARG HG2 . 25038 1
539 . 1 1 50 50 ARG HG3 H 1 2.107 0.000 . . . . . A 133 ARG HG3 . 25038 1
540 . 1 1 50 50 ARG HD2 H 1 3.299 0.000 . . . . . A 133 ARG HD2 . 25038 1
541 . 1 1 50 50 ARG HD3 H 1 3.201 0.000 . . . . . A 133 ARG HD3 . 25038 1
542 . 1 1 50 50 ARG HE H 1 7.419 0.000 . . . . . A 133 ARG HE . 25038 1
543 . 1 1 50 50 ARG CA C 13 57.509 0.000 . . . . . A 133 ARG CA . 25038 1
544 . 1 1 50 50 ARG CB C 13 27.806 0.003 . . . . . A 133 ARG CB . 25038 1
545 . 1 1 50 50 ARG CG C 13 26.484 0.013 . . . . . A 133 ARG CG . 25038 1
546 . 1 1 50 50 ARG CD C 13 43.549 0.004 . . . . . A 133 ARG CD . 25038 1
547 . 1 1 50 50 ARG N N 15 116.946 0.000 . . . . . A 133 ARG N . 25038 1
548 . 1 1 50 50 ARG NE N 15 86.396 0.000 . . . . . A 133 ARG NE . 25038 1
549 . 1 1 51 51 GLN H H 1 7.355 0.000 . . . . . A 134 GLN H . 25038 1
550 . 1 1 51 51 GLN HA H 1 5.410 0.000 . . . . . A 134 GLN HA . 25038 1
551 . 1 1 51 51 GLN HB2 H 1 2.435 0.000 . . . . . A 134 GLN HB2 . 25038 1
552 . 1 1 51 51 GLN HB3 H 1 1.828 0.000 . . . . . A 134 GLN HB3 . 25038 1
553 . 1 1 51 51 GLN HG2 H 1 2.827 0.000 . . . . . A 134 GLN HG2 . 25038 1
554 . 1 1 51 51 GLN HG3 H 1 2.613 0.000 . . . . . A 134 GLN HG3 . 25038 1
555 . 1 1 51 51 GLN HE21 H 1 7.593 0.000 . . . . . A 134 GLN HE21 . 25038 1
556 . 1 1 51 51 GLN HE22 H 1 6.903 0.000 . . . . . A 134 GLN HE22 . 25038 1
557 . 1 1 51 51 GLN CA C 13 53.558 0.000 . . . . . A 134 GLN CA . 25038 1
558 . 1 1 51 51 GLN CB C 13 35.763 0.057 . . . . . A 134 GLN CB . 25038 1
559 . 1 1 51 51 GLN CG C 13 34.145 0.006 . . . . . A 134 GLN CG . 25038 1
560 . 1 1 51 51 GLN N N 15 113.755 0.000 . . . . . A 134 GLN N . 25038 1
561 . 1 1 51 51 GLN NE2 N 15 112.907 0.000 . . . . . A 134 GLN NE2 . 25038 1
562 . 1 1 52 52 ALA H H 1 8.985 0.000 . . . . . A 135 ALA H . 25038 1
563 . 1 1 52 52 ALA HA H 1 5.095 0.000 . . . . . A 135 ALA HA . 25038 1
564 . 1 1 52 52 ALA HB1 H 1 1.301 0.000 . . . . . A 135 ALA HB1 . 25038 1
565 . 1 1 52 52 ALA HB2 H 1 1.301 0.000 . . . . . A 135 ALA HB2 . 25038 1
566 . 1 1 52 52 ALA HB3 H 1 1.301 0.000 . . . . . A 135 ALA HB3 . 25038 1
567 . 1 1 52 52 ALA CA C 13 51.360 0.000 . . . . . A 135 ALA CA . 25038 1
568 . 1 1 52 52 ALA CB C 13 24.882 0.000 . . . . . A 135 ALA CB . 25038 1
569 . 1 1 52 52 ALA N N 15 119.434 0.000 . . . . . A 135 ALA N . 25038 1
570 . 1 1 53 53 LEU H H 1 9.024 0.000 . . . . . A 136 LEU H . 25038 1
571 . 1 1 53 53 LEU HA H 1 5.473 0.000 . . . . . A 136 LEU HA . 25038 1
572 . 1 1 53 53 LEU HB2 H 1 1.621 0.000 . . . . . A 136 LEU HB2 . 25038 1
573 . 1 1 53 53 LEU HB3 H 1 1.203 0.000 . . . . . A 136 LEU HB3 . 25038 1
574 . 1 1 53 53 LEU HD11 H 1 0.857 0.000 . . . . . A 136 LEU HD11 . 25038 1
575 . 1 1 53 53 LEU HD12 H 1 0.857 0.000 . . . . . A 136 LEU HD12 . 25038 1
576 . 1 1 53 53 LEU HD13 H 1 0.857 0.000 . . . . . A 136 LEU HD13 . 25038 1
577 . 1 1 53 53 LEU HD21 H 1 1.095 0.000 . . . . . A 136 LEU HD21 . 25038 1
578 . 1 1 53 53 LEU HD22 H 1 1.095 0.000 . . . . . A 136 LEU HD22 . 25038 1
579 . 1 1 53 53 LEU HD23 H 1 1.095 0.000 . . . . . A 136 LEU HD23 . 25038 1
580 . 1 1 53 53 LEU CA C 13 53.880 0.000 . . . . . A 136 LEU CA . 25038 1
581 . 1 1 53 53 LEU CB C 13 46.228 0.010 . . . . . A 136 LEU CB . 25038 1
582 . 1 1 53 53 LEU CD1 C 13 26.341 0.000 . . . . . A 136 LEU CD1 . 25038 1
583 . 1 1 53 53 LEU CD2 C 13 22.157 0.000 . . . . . A 136 LEU CD2 . 25038 1
584 . 1 1 53 53 LEU N N 15 119.835 0.000 . . . . . A 136 LEU N . 25038 1
585 . 1 1 54 54 VAL H H 1 8.870 0.000 . . . . . A 137 VAL H . 25038 1
586 . 1 1 54 54 VAL HA H 1 4.418 0.000 . . . . . A 137 VAL HA . 25038 1
587 . 1 1 54 54 VAL HB H 1 1.800 0.000 . . . . . A 137 VAL HB . 25038 1
588 . 1 1 54 54 VAL HG11 H 1 0.768 0.000 . . . . . A 137 VAL HG11 . 25038 1
589 . 1 1 54 54 VAL HG12 H 1 0.768 0.000 . . . . . A 137 VAL HG12 . 25038 1
590 . 1 1 54 54 VAL HG13 H 1 0.768 0.000 . . . . . A 137 VAL HG13 . 25038 1
591 . 1 1 54 54 VAL HG21 H 1 0.348 0.000 . . . . . A 137 VAL HG21 . 25038 1
592 . 1 1 54 54 VAL HG22 H 1 0.348 0.000 . . . . . A 137 VAL HG22 . 25038 1
593 . 1 1 54 54 VAL HG23 H 1 0.348 0.000 . . . . . A 137 VAL HG23 . 25038 1
594 . 1 1 54 54 VAL CA C 13 61.158 0.000 . . . . . A 137 VAL CA . 25038 1
595 . 1 1 54 54 VAL CB C 13 34.897 0.000 . . . . . A 137 VAL CB . 25038 1
596 . 1 1 54 54 VAL CG1 C 13 21.908 0.000 . . . . . A 137 VAL CG1 . 25038 1
597 . 1 1 54 54 VAL CG2 C 13 21.102 0.000 . . . . . A 137 VAL CG2 . 25038 1
598 . 1 1 54 54 VAL N N 15 121.279 0.000 . . . . . A 137 VAL N . 25038 1
599 . 1 1 55 55 GLU H H 1 9.263 0.000 . . . . . A 138 GLU H . 25038 1
600 . 1 1 55 55 GLU HA H 1 5.008 0.000 . . . . . A 138 GLU HA . 25038 1
601 . 1 1 55 55 GLU HB2 H 1 2.167 0.000 . . . . . A 138 GLU HB2 . 25038 1
602 . 1 1 55 55 GLU HB3 H 1 2.006 0.000 . . . . . A 138 GLU HB3 . 25038 1
603 . 1 1 55 55 GLU HG2 H 1 2.186 0.000 . . . . . A 138 GLU HG2 . 25038 1
604 . 1 1 55 55 GLU HG3 H 1 2.046 0.000 . . . . . A 138 GLU HG3 . 25038 1
605 . 1 1 55 55 GLU CA C 13 54.460 0.000 . . . . . A 138 GLU CA . 25038 1
606 . 1 1 55 55 GLU CB C 13 32.984 0.000 . . . . . A 138 GLU CB . 25038 1
607 . 1 1 55 55 GLU CG C 13 36.765 0.000 . . . . . A 138 GLU CG . 25038 1
608 . 1 1 55 55 GLU N N 15 129.089 0.000 . . . . . A 138 GLU N . 25038 1
609 . 1 1 56 56 PHE H H 1 9.440 0.000 . . . . . A 139 PHE H . 25038 1
610 . 1 1 56 56 PHE HA H 1 4.613 0.000 . . . . . A 139 PHE HA . 25038 1
611 . 1 1 56 56 PHE HB2 H 1 3.933 0.000 . . . . . A 139 PHE HB2 . 25038 1
612 . 1 1 56 56 PHE HB3 H 1 3.206 0.000 . . . . . A 139 PHE HB3 . 25038 1
613 . 1 1 56 56 PHE HD1 H 1 7.336 0.000 . . . . . A 139 PHE HD1 . 25038 1
614 . 1 1 56 56 PHE HD2 H 1 7.336 0.000 . . . . . A 139 PHE HD2 . 25038 1
615 . 1 1 56 56 PHE HE1 H 1 7.246 0.000 . . . . . A 139 PHE HE1 . 25038 1
616 . 1 1 56 56 PHE HE2 H 1 7.246 0.000 . . . . . A 139 PHE HE2 . 25038 1
617 . 1 1 56 56 PHE HZ H 1 7.390 0.000 . . . . . A 139 PHE HZ . 25038 1
618 . 1 1 56 56 PHE CA C 13 60.037 0.000 . . . . . A 139 PHE CA . 25038 1
619 . 1 1 56 56 PHE CB C 13 39.579 0.036 . . . . . A 139 PHE CB . 25038 1
620 . 1 1 56 56 PHE CD1 C 13 131.938 0.000 . . . . . A 139 PHE CD1 . 25038 1
621 . 1 1 56 56 PHE CE1 C 13 131.094 0.000 . . . . . A 139 PHE CE1 . 25038 1
622 . 1 1 56 56 PHE CZ C 13 131.232 0.000 . . . . . A 139 PHE CZ . 25038 1
623 . 1 1 56 56 PHE N N 15 129.049 0.000 . . . . . A 139 PHE N . 25038 1
624 . 1 1 57 57 GLU H H 1 8.695 0.000 . . . . . A 140 GLU H . 25038 1
625 . 1 1 57 57 GLU HA H 1 4.042 0.000 . . . . . A 140 GLU HA . 25038 1
626 . 1 1 57 57 GLU HB2 H 1 2.127 0.000 . . . . . A 140 GLU HB2 . 25038 1
627 . 1 1 57 57 GLU HB3 H 1 1.947 0.000 . . . . . A 140 GLU HB3 . 25038 1
628 . 1 1 57 57 GLU HG2 H 1 2.267 0.000 . . . . . A 140 GLU HG2 . 25038 1
629 . 1 1 57 57 GLU HG3 H 1 2.228 0.000 . . . . . A 140 GLU HG3 . 25038 1
630 . 1 1 57 57 GLU CA C 13 59.264 0.000 . . . . . A 140 GLU CA . 25038 1
631 . 1 1 57 57 GLU CB C 13 30.871 0.006 . . . . . A 140 GLU CB . 25038 1
632 . 1 1 57 57 GLU CG C 13 37.157 0.008 . . . . . A 140 GLU CG . 25038 1
633 . 1 1 57 57 GLU N N 15 119.820 0.000 . . . . . A 140 GLU N . 25038 1
634 . 1 1 58 58 ASP H H 1 8.577 0.000 . . . . . A 141 ASP H . 25038 1
635 . 1 1 58 58 ASP HA H 1 4.955 0.000 . . . . . A 141 ASP HA . 25038 1
636 . 1 1 58 58 ASP HB2 H 1 2.879 0.000 . . . . . A 141 ASP HB2 . 25038 1
637 . 1 1 58 58 ASP HB3 H 1 2.804 0.000 . . . . . A 141 ASP HB3 . 25038 1
638 . 1 1 58 58 ASP CA C 13 52.439 0.000 . . . . . A 141 ASP CA . 25038 1
639 . 1 1 58 58 ASP CB C 13 45.696 0.004 . . . . . A 141 ASP CB . 25038 1
640 . 1 1 58 58 ASP N N 15 115.192 0.000 . . . . . A 141 ASP N . 25038 1
641 . 1 1 59 59 VAL H H 1 8.570 0.000 . . . . . A 142 VAL H . 25038 1
642 . 1 1 59 59 VAL HA H 1 3.805 0.000 . . . . . A 142 VAL HA . 25038 1
643 . 1 1 59 59 VAL HB H 1 2.123 0.000 . . . . . A 142 VAL HB . 25038 1
644 . 1 1 59 59 VAL HG11 H 1 0.925 0.000 . . . . . A 142 VAL HG11 . 25038 1
645 . 1 1 59 59 VAL HG12 H 1 0.925 0.000 . . . . . A 142 VAL HG12 . 25038 1
646 . 1 1 59 59 VAL HG13 H 1 0.925 0.000 . . . . . A 142 VAL HG13 . 25038 1
647 . 1 1 59 59 VAL HG21 H 1 0.976 0.000 . . . . . A 142 VAL HG21 . 25038 1
648 . 1 1 59 59 VAL HG22 H 1 0.976 0.000 . . . . . A 142 VAL HG22 . 25038 1
649 . 1 1 59 59 VAL HG23 H 1 0.976 0.000 . . . . . A 142 VAL HG23 . 25038 1
650 . 1 1 59 59 VAL CA C 13 64.988 0.000 . . . . . A 142 VAL CA . 25038 1
651 . 1 1 59 59 VAL CB C 13 32.146 0.000 . . . . . A 142 VAL CB . 25038 1
652 . 1 1 59 59 VAL CG1 C 13 21.999 0.000 . . . . . A 142 VAL CG1 . 25038 1
653 . 1 1 59 59 VAL CG2 C 13 20.244 0.000 . . . . . A 142 VAL CG2 . 25038 1
654 . 1 1 59 59 VAL N N 15 122.159 0.000 . . . . . A 142 VAL N . 25038 1
655 . 1 1 60 60 LEU H H 1 8.495 0.000 . . . . . A 143 LEU H . 25038 1
656 . 1 1 60 60 LEU HA H 1 4.016 0.000 . . . . . A 143 LEU HA . 25038 1
657 . 1 1 60 60 LEU HB2 H 1 1.776 0.000 . . . . . A 143 LEU HB2 . 25038 1
658 . 1 1 60 60 LEU HB3 H 1 1.672 0.000 . . . . . A 143 LEU HB3 . 25038 1
659 . 1 1 60 60 LEU HG H 1 1.772 0.000 . . . . . A 143 LEU HG . 25038 1
660 . 1 1 60 60 LEU HD11 H 1 1.011 0.000 . . . . . A 143 LEU HD11 . 25038 1
661 . 1 1 60 60 LEU HD12 H 1 1.011 0.000 . . . . . A 143 LEU HD12 . 25038 1
662 . 1 1 60 60 LEU HD13 H 1 1.011 0.000 . . . . . A 143 LEU HD13 . 25038 1
663 . 1 1 60 60 LEU HD21 H 1 0.968 0.000 . . . . . A 143 LEU HD21 . 25038 1
664 . 1 1 60 60 LEU HD22 H 1 0.968 0.000 . . . . . A 143 LEU HD22 . 25038 1
665 . 1 1 60 60 LEU HD23 H 1 0.968 0.000 . . . . . A 143 LEU HD23 . 25038 1
666 . 1 1 60 60 LEU CA C 13 58.403 0.000 . . . . . A 143 LEU CA . 25038 1
667 . 1 1 60 60 LEU CB C 13 41.287 0.007 . . . . . A 143 LEU CB . 25038 1
668 . 1 1 60 60 LEU CG C 13 27.255 0.000 . . . . . A 143 LEU CG . 25038 1
669 . 1 1 60 60 LEU CD1 C 13 24.457 0.000 . . . . . A 143 LEU CD1 . 25038 1
670 . 1 1 60 60 LEU CD2 C 13 24.121 0.000 . . . . . A 143 LEU CD2 . 25038 1
671 . 1 1 60 60 LEU N N 15 121.632 0.000 . . . . . A 143 LEU N . 25038 1
672 . 1 1 61 61 GLY H H 1 7.701 0.000 . . . . . A 144 GLY H . 25038 1
673 . 1 1 61 61 GLY HA2 H 1 3.756 0.000 . . . . . A 144 GLY HA2 . 25038 1
674 . 1 1 61 61 GLY HA3 H 1 3.497 0.000 . . . . . A 144 GLY HA3 . 25038 1
675 . 1 1 61 61 GLY CA C 13 47.195 0.004 . . . . . A 144 GLY CA . 25038 1
676 . 1 1 61 61 GLY N N 15 105.889 0.000 . . . . . A 144 GLY N . 25038 1
677 . 1 1 62 62 ALA H H 1 6.226 0.000 . . . . . A 145 ALA H . 25038 1
678 . 1 1 62 62 ALA HA H 1 3.330 0.000 . . . . . A 145 ALA HA . 25038 1
679 . 1 1 62 62 ALA HB1 H 1 1.823 0.000 . . . . . A 145 ALA HB1 . 25038 1
680 . 1 1 62 62 ALA HB2 H 1 1.823 0.000 . . . . . A 145 ALA HB2 . 25038 1
681 . 1 1 62 62 ALA HB3 H 1 1.823 0.000 . . . . . A 145 ALA HB3 . 25038 1
682 . 1 1 62 62 ALA CA C 13 54.949 0.000 . . . . . A 145 ALA CA . 25038 1
683 . 1 1 62 62 ALA CB C 13 20.889 0.000 . . . . . A 145 ALA CB . 25038 1
684 . 1 1 62 62 ALA N N 15 122.148 0.000 . . . . . A 145 ALA N . 25038 1
685 . 1 1 63 63 CYS H H 1 8.716 0.000 . . . . . A 146 CYS H . 25038 1
686 . 1 1 63 63 CYS HA H 1 4.660 0.000 . . . . . A 146 CYS HA . 25038 1
687 . 1 1 63 63 CYS HB2 H 1 3.002 0.000 . . . . . A 146 CYS HB2 . 25038 1
688 . 1 1 63 63 CYS HB3 H 1 2.943 0.000 . . . . . A 146 CYS HB3 . 25038 1
689 . 1 1 63 63 CYS CA C 13 61.174 0.000 . . . . . A 146 CYS CA . 25038 1
690 . 1 1 63 63 CYS CB C 13 26.955 0.002 . . . . . A 146 CYS CB . 25038 1
691 . 1 1 63 63 CYS N N 15 116.215 0.000 . . . . . A 146 CYS N . 25038 1
692 . 1 1 64 64 ASN H H 1 8.351 0.000 . . . . . A 147 ASN H . 25038 1
693 . 1 1 64 64 ASN HA H 1 4.466 0.000 . . . . . A 147 ASN HA . 25038 1
694 . 1 1 64 64 ASN HB2 H 1 3.377 0.000 . . . . . A 147 ASN HB2 . 25038 1
695 . 1 1 64 64 ASN HB3 H 1 3.031 0.000 . . . . . A 147 ASN HB3 . 25038 1
696 . 1 1 64 64 ASN HD21 H 1 7.869 0.000 . . . . . A 147 ASN HD21 . 25038 1
697 . 1 1 64 64 ASN HD22 H 1 6.793 0.000 . . . . . A 147 ASN HD22 . 25038 1
698 . 1 1 64 64 ASN CA C 13 55.710 0.000 . . . . . A 147 ASN CA . 25038 1
699 . 1 1 64 64 ASN CB C 13 37.575 0.021 . . . . . A 147 ASN CB . 25038 1
700 . 1 1 64 64 ASN N N 15 118.561 0.000 . . . . . A 147 ASN N . 25038 1
701 . 1 1 64 64 ASN ND2 N 15 109.985 0.002 . . . . . A 147 ASN ND2 . 25038 1
702 . 1 1 65 65 ALA H H 1 7.462 0.000 . . . . . A 148 ALA H . 25038 1
703 . 1 1 65 65 ALA HA H 1 2.352 0.000 . . . . . A 148 ALA HA . 25038 1
704 . 1 1 65 65 ALA HB1 H 1 1.006 0.000 . . . . . A 148 ALA HB1 . 25038 1
705 . 1 1 65 65 ALA HB2 H 1 1.006 0.000 . . . . . A 148 ALA HB2 . 25038 1
706 . 1 1 65 65 ALA HB3 H 1 1.006 0.000 . . . . . A 148 ALA HB3 . 25038 1
707 . 1 1 65 65 ALA CA C 13 54.906 0.000 . . . . . A 148 ALA CA . 25038 1
708 . 1 1 65 65 ALA CB C 13 18.140 0.000 . . . . . A 148 ALA CB . 25038 1
709 . 1 1 65 65 ALA N N 15 123.316 0.000 . . . . . A 148 ALA N . 25038 1
710 . 1 1 66 66 VAL H H 1 8.345 0.000 . . . . . A 149 VAL H . 25038 1
711 . 1 1 66 66 VAL HA H 1 3.157 0.000 . . . . . A 149 VAL HA . 25038 1
712 . 1 1 66 66 VAL HB H 1 1.753 0.000 . . . . . A 149 VAL HB . 25038 1
713 . 1 1 66 66 VAL HG11 H 1 0.155 0.000 . . . . . A 149 VAL HG11 . 25038 1
714 . 1 1 66 66 VAL HG12 H 1 0.155 0.000 . . . . . A 149 VAL HG12 . 25038 1
715 . 1 1 66 66 VAL HG13 H 1 0.155 0.000 . . . . . A 149 VAL HG13 . 25038 1
716 . 1 1 66 66 VAL HG21 H 1 0.609 0.000 . . . . . A 149 VAL HG21 . 25038 1
717 . 1 1 66 66 VAL HG22 H 1 0.609 0.000 . . . . . A 149 VAL HG22 . 25038 1
718 . 1 1 66 66 VAL HG23 H 1 0.609 0.000 . . . . . A 149 VAL HG23 . 25038 1
719 . 1 1 66 66 VAL CA C 13 67.158 0.000 . . . . . A 149 VAL CA . 25038 1
720 . 1 1 66 66 VAL CB C 13 31.433 0.000 . . . . . A 149 VAL CB . 25038 1
721 . 1 1 66 66 VAL CG1 C 13 23.592 0.000 . . . . . A 149 VAL CG1 . 25038 1
722 . 1 1 66 66 VAL CG2 C 13 20.997 0.000 . . . . . A 149 VAL CG2 . 25038 1
723 . 1 1 66 66 VAL N N 15 117.650 0.000 . . . . . A 149 VAL N . 25038 1
724 . 1 1 67 67 ASN H H 1 8.855 0.000 . . . . . A 150 ASN H . 25038 1
725 . 1 1 67 67 ASN HA H 1 4.518 0.000 . . . . . A 150 ASN HA . 25038 1
726 . 1 1 67 67 ASN HB2 H 1 2.744 0.000 . . . . . A 150 ASN HB2 . 25038 1
727 . 1 1 67 67 ASN HB3 H 1 2.645 0.000 . . . . . A 150 ASN HB3 . 25038 1
728 . 1 1 67 67 ASN CA C 13 56.019 0.000 . . . . . A 150 ASN CA . 25038 1
729 . 1 1 67 67 ASN CB C 13 41.264 0.027 . . . . . A 150 ASN CB . 25038 1
730 . 1 1 67 67 ASN N N 15 117.987 0.000 . . . . . A 150 ASN N . 25038 1
731 . 1 1 68 68 TYR H H 1 8.000 0.000 . . . . . A 151 TYR H . 25038 1
732 . 1 1 68 68 TYR HA H 1 4.195 0.000 . . . . . A 151 TYR HA . 25038 1
733 . 1 1 68 68 TYR HB2 H 1 3.263 0.000 . . . . . A 151 TYR HB2 . 25038 1
734 . 1 1 68 68 TYR HB3 H 1 2.928 0.000 . . . . . A 151 TYR HB3 . 25038 1
735 . 1 1 68 68 TYR HD1 H 1 7.074 0.000 . . . . . A 151 TYR HD1 . 25038 1
736 . 1 1 68 68 TYR HD2 H 1 7.074 0.000 . . . . . A 151 TYR HD2 . 25038 1
737 . 1 1 68 68 TYR HE1 H 1 6.807 0.000 . . . . . A 151 TYR HE1 . 25038 1
738 . 1 1 68 68 TYR HE2 H 1 6.807 0.000 . . . . . A 151 TYR HE2 . 25038 1
739 . 1 1 68 68 TYR CA C 13 62.179 0.000 . . . . . A 151 TYR CA . 25038 1
740 . 1 1 68 68 TYR CB C 13 39.295 0.053 . . . . . A 151 TYR CB . 25038 1
741 . 1 1 68 68 TYR CD2 C 13 133.974 0.000 . . . . . A 151 TYR CD2 . 25038 1
742 . 1 1 68 68 TYR CE2 C 13 118.648 0.000 . . . . . A 151 TYR CE2 . 25038 1
743 . 1 1 68 68 TYR N N 15 122.624 0.000 . . . . . A 151 TYR N . 25038 1
744 . 1 1 69 69 ALA H H 1 8.070 0.000 . . . . . A 152 ALA H . 25038 1
745 . 1 1 69 69 ALA HA H 1 4.540 0.000 . . . . . A 152 ALA HA . 25038 1
746 . 1 1 69 69 ALA HB1 H 1 1.559 0.000 . . . . . A 152 ALA HB1 . 25038 1
747 . 1 1 69 69 ALA HB2 H 1 1.559 0.000 . . . . . A 152 ALA HB2 . 25038 1
748 . 1 1 69 69 ALA HB3 H 1 1.559 0.000 . . . . . A 152 ALA HB3 . 25038 1
749 . 1 1 69 69 ALA CA C 13 52.702 0.000 . . . . . A 152 ALA CA . 25038 1
750 . 1 1 69 69 ALA CB C 13 18.676 0.000 . . . . . A 152 ALA CB . 25038 1
751 . 1 1 69 69 ALA N N 15 120.330 0.000 . . . . . A 152 ALA N . 25038 1
752 . 1 1 70 70 ALA H H 1 7.500 0.000 . . . . . A 153 ALA H . 25038 1
753 . 1 1 70 70 ALA HA H 1 4.138 0.000 . . . . . A 153 ALA HA . 25038 1
754 . 1 1 70 70 ALA HB1 H 1 1.484 0.000 . . . . . A 153 ALA HB1 . 25038 1
755 . 1 1 70 70 ALA HB2 H 1 1.484 0.000 . . . . . A 153 ALA HB2 . 25038 1
756 . 1 1 70 70 ALA HB3 H 1 1.484 0.000 . . . . . A 153 ALA HB3 . 25038 1
757 . 1 1 70 70 ALA CA C 13 55.003 0.000 . . . . . A 153 ALA CA . 25038 1
758 . 1 1 70 70 ALA CB C 13 18.465 0.000 . . . . . A 153 ALA CB . 25038 1
759 . 1 1 70 70 ALA N N 15 120.188 0.000 . . . . . A 153 ALA N . 25038 1
760 . 1 1 71 71 ASP H H 1 7.129 0.000 . . . . . A 154 ASP H . 25038 1
761 . 1 1 71 71 ASP HA H 1 4.919 0.000 . . . . . A 154 ASP HA . 25038 1
762 . 1 1 71 71 ASP CA C 13 54.040 0.000 . . . . . A 154 ASP CA . 25038 1
763 . 1 1 71 71 ASP N N 15 113.070 0.000 . . . . . A 154 ASP N . 25038 1
764 . 1 1 72 72 ASN H H 1 7.713 0.000 . . . . . A 155 ASN H . 25038 1
765 . 1 1 72 72 ASN HA H 1 4.778 0.000 . . . . . A 155 ASN HA . 25038 1
766 . 1 1 72 72 ASN HB2 H 1 2.141 0.000 . . . . . A 155 ASN HB2 . 25038 1
767 . 1 1 72 72 ASN HB3 H 1 1.679 0.000 . . . . . A 155 ASN HB3 . 25038 1
768 . 1 1 72 72 ASN CA C 13 52.150 0.000 . . . . . A 155 ASN CA . 25038 1
769 . 1 1 72 72 ASN CB C 13 42.477 0.002 . . . . . A 155 ASN CB . 25038 1
770 . 1 1 72 72 ASN N N 15 117.983 0.000 . . . . . A 155 ASN N . 25038 1
771 . 1 1 73 73 GLN H H 1 8.176 0.000 . . . . . A 156 GLN H . 25038 1
772 . 1 1 73 73 GLN HA H 1 4.409 0.000 . . . . . A 156 GLN HA . 25038 1
773 . 1 1 73 73 GLN HB2 H 1 1.952 0.000 . . . . . A 156 GLN HB2 . 25038 1
774 . 1 1 73 73 GLN HB3 H 1 1.708 0.000 . . . . . A 156 GLN HB3 . 25038 1
775 . 1 1 73 73 GLN HG2 H 1 2.061 0.000 . . . . . A 156 GLN HG2 . 25038 1
776 . 1 1 73 73 GLN HG3 H 1 1.860 0.000 . . . . . A 156 GLN HG3 . 25038 1
777 . 1 1 73 73 GLN HE21 H 1 7.548 0.000 . . . . . A 156 GLN HE21 . 25038 1
778 . 1 1 73 73 GLN HE22 H 1 6.360 0.000 . . . . . A 156 GLN HE22 . 25038 1
779 . 1 1 73 73 GLN CA C 13 55.410 0.000 . . . . . A 156 GLN CA . 25038 1
780 . 1 1 73 73 GLN CB C 13 30.636 0.005 . . . . . A 156 GLN CB . 25038 1
781 . 1 1 73 73 GLN CG C 13 34.251 0.004 . . . . . A 156 GLN CG . 25038 1
782 . 1 1 73 73 GLN N N 15 117.303 0.000 . . . . . A 156 GLN N . 25038 1
783 . 1 1 73 73 GLN NE2 N 15 114.958 0.001 . . . . . A 156 GLN NE2 . 25038 1
784 . 1 1 74 74 ILE H H 1 8.918 0.000 . . . . . A 157 ILE H . 25038 1
785 . 1 1 74 74 ILE HA H 1 4.413 0.000 . . . . . A 157 ILE HA . 25038 1
786 . 1 1 74 74 ILE HB H 1 1.771 0.000 . . . . . A 157 ILE HB . 25038 1
787 . 1 1 74 74 ILE HG12 H 1 1.797 0.000 . . . . . A 157 ILE HG12 . 25038 1
788 . 1 1 74 74 ILE HG13 H 1 1.368 0.000 . . . . . A 157 ILE HG13 . 25038 1
789 . 1 1 74 74 ILE HG21 H 1 0.872 0.000 . . . . . A 157 ILE HG21 . 25038 1
790 . 1 1 74 74 ILE HG22 H 1 0.872 0.000 . . . . . A 157 ILE HG22 . 25038 1
791 . 1 1 74 74 ILE HG23 H 1 0.872 0.000 . . . . . A 157 ILE HG23 . 25038 1
792 . 1 1 74 74 ILE HD11 H 1 0.685 0.000 . . . . . A 157 ILE HD11 . 25038 1
793 . 1 1 74 74 ILE HD12 H 1 0.685 0.000 . . . . . A 157 ILE HD12 . 25038 1
794 . 1 1 74 74 ILE HD13 H 1 0.685 0.000 . . . . . A 157 ILE HD13 . 25038 1
795 . 1 1 74 74 ILE CA C 13 61.461 0.000 . . . . . A 157 ILE CA . 25038 1
796 . 1 1 74 74 ILE CB C 13 39.105 0.000 . . . . . A 157 ILE CB . 25038 1
797 . 1 1 74 74 ILE CG1 C 13 28.918 0.014 . . . . . A 157 ILE CG1 . 25038 1
798 . 1 1 74 74 ILE CG2 C 13 16.633 0.000 . . . . . A 157 ILE CG2 . 25038 1
799 . 1 1 74 74 ILE CD1 C 13 13.432 0.000 . . . . . A 157 ILE CD1 . 25038 1
800 . 1 1 74 74 ILE N N 15 125.455 0.000 . . . . . A 157 ILE N . 25038 1
801 . 1 1 75 75 TYR H H 1 8.733 0.000 . . . . . A 158 TYR H . 25038 1
802 . 1 1 75 75 TYR HA H 1 4.683 0.000 . . . . . A 158 TYR HA . 25038 1
803 . 1 1 75 75 TYR HB2 H 1 2.891 0.000 . . . . . A 158 TYR HB2 . 25038 1
804 . 1 1 75 75 TYR HB3 H 1 2.366 0.000 . . . . . A 158 TYR HB3 . 25038 1
805 . 1 1 75 75 TYR HD1 H 1 6.737 0.000 . . . . . A 158 TYR HD1 . 25038 1
806 . 1 1 75 75 TYR HD2 H 1 6.737 0.000 . . . . . A 158 TYR HD2 . 25038 1
807 . 1 1 75 75 TYR HE1 H 1 6.738 0.000 . . . . . A 158 TYR HE1 . 25038 1
808 . 1 1 75 75 TYR HE2 H 1 6.738 0.000 . . . . . A 158 TYR HE2 . 25038 1
809 . 1 1 75 75 TYR CA C 13 57.241 0.000 . . . . . A 158 TYR CA . 25038 1
810 . 1 1 75 75 TYR CB C 13 40.645 0.188 . . . . . A 158 TYR CB . 25038 1
811 . 1 1 75 75 TYR CD2 C 13 132.519 0.000 . . . . . A 158 TYR CD2 . 25038 1
812 . 1 1 75 75 TYR CE2 C 13 118.172 0.000 . . . . . A 158 TYR CE2 . 25038 1
813 . 1 1 75 75 TYR N N 15 126.365 0.000 . . . . . A 158 TYR N . 25038 1
814 . 1 1 76 76 ILE H H 1 8.852 0.000 . . . . . A 159 ILE H . 25038 1
815 . 1 1 76 76 ILE HA H 1 4.255 0.000 . . . . . A 159 ILE HA . 25038 1
816 . 1 1 76 76 ILE HB H 1 1.789 0.000 . . . . . A 159 ILE HB . 25038 1
817 . 1 1 76 76 ILE HG12 H 1 1.334 0.000 . . . . . A 159 ILE HG12 . 25038 1
818 . 1 1 76 76 ILE HG13 H 1 1.009 0.000 . . . . . A 159 ILE HG13 . 25038 1
819 . 1 1 76 76 ILE HG21 H 1 0.738 0.000 . . . . . A 159 ILE HG21 . 25038 1
820 . 1 1 76 76 ILE HG22 H 1 0.738 0.000 . . . . . A 159 ILE HG22 . 25038 1
821 . 1 1 76 76 ILE HG23 H 1 0.738 0.000 . . . . . A 159 ILE HG23 . 25038 1
822 . 1 1 76 76 ILE HD11 H 1 0.688 0.000 . . . . . A 159 ILE HD11 . 25038 1
823 . 1 1 76 76 ILE HD12 H 1 0.688 0.000 . . . . . A 159 ILE HD12 . 25038 1
824 . 1 1 76 76 ILE HD13 H 1 0.688 0.000 . . . . . A 159 ILE HD13 . 25038 1
825 . 1 1 76 76 ILE CA C 13 60.130 0.000 . . . . . A 159 ILE CA . 25038 1
826 . 1 1 76 76 ILE CB C 13 38.977 0.000 . . . . . A 159 ILE CB . 25038 1
827 . 1 1 76 76 ILE CG1 C 13 27.261 0.011 . . . . . A 159 ILE CG1 . 25038 1
828 . 1 1 76 76 ILE CG2 C 13 18.031 0.000 . . . . . A 159 ILE CG2 . 25038 1
829 . 1 1 76 76 ILE CD1 C 13 13.339 0.000 . . . . . A 159 ILE CD1 . 25038 1
830 . 1 1 76 76 ILE N N 15 121.220 0.000 . . . . . A 159 ILE N . 25038 1
831 . 1 1 77 77 ALA H H 1 9.677 0.000 . . . . . A 160 ALA H . 25038 1
832 . 1 1 77 77 ALA HA H 1 4.108 0.000 . . . . . A 160 ALA HA . 25038 1
833 . 1 1 77 77 ALA HB1 H 1 1.426 0.000 . . . . . A 160 ALA HB1 . 25038 1
834 . 1 1 77 77 ALA HB2 H 1 1.426 0.000 . . . . . A 160 ALA HB2 . 25038 1
835 . 1 1 77 77 ALA HB3 H 1 1.426 0.000 . . . . . A 160 ALA HB3 . 25038 1
836 . 1 1 77 77 ALA CA C 13 53.085 0.000 . . . . . A 160 ALA CA . 25038 1
837 . 1 1 77 77 ALA CB C 13 17.504 0.000 . . . . . A 160 ALA CB . 25038 1
838 . 1 1 77 77 ALA N N 15 131.890 0.000 . . . . . A 160 ALA N . 25038 1
839 . 1 1 78 78 GLY H H 1 8.674 0.000 . . . . . A 161 GLY H . 25038 1
840 . 1 1 78 78 GLY HA2 H 1 4.193 0.000 . . . . . A 161 GLY HA2 . 25038 1
841 . 1 1 78 78 GLY HA3 H 1 3.607 0.000 . . . . . A 161 GLY HA3 . 25038 1
842 . 1 1 78 78 GLY CA C 13 45.469 0.003 . . . . . A 161 GLY CA . 25038 1
843 . 1 1 78 78 GLY N N 15 101.533 0.000 . . . . . A 161 GLY N . 25038 1
844 . 1 1 79 79 HIS H H 1 7.966 0.000 . . . . . A 162 HIS H . 25038 1
845 . 1 1 79 79 HIS HA H 1 5.189 0.000 . . . . . A 162 HIS HA . 25038 1
846 . 1 1 79 79 HIS HB2 H 1 3.333 0.000 . . . . . A 162 HIS HB2 . 25038 1
847 . 1 1 79 79 HIS HB3 H 1 2.979 0.000 . . . . . A 162 HIS HB3 . 25038 1
848 . 1 1 79 79 HIS HD2 H 1 7.376 0.000 . . . . . A 162 HIS HD2 . 25038 1
849 . 1 1 79 79 HIS HE1 H 1 8.145 0.000 . . . . . A 162 HIS HE1 . 25038 1
850 . 1 1 79 79 HIS CA C 13 53.969 0.000 . . . . . A 162 HIS CA . 25038 1
851 . 1 1 79 79 HIS CB C 13 32.597 0.003 . . . . . A 162 HIS CB . 25038 1
852 . 1 1 79 79 HIS CD2 C 13 122.063 0.000 . . . . . A 162 HIS CD2 . 25038 1
853 . 1 1 79 79 HIS CE1 C 13 138.038 0.000 . . . . . A 162 HIS CE1 . 25038 1
854 . 1 1 79 79 HIS N N 15 120.337 0.000 . . . . . A 162 HIS N . 25038 1
855 . 1 1 80 80 PRO HA H 1 4.268 0.000 . . . . . A 163 PRO HA . 25038 1
856 . 1 1 80 80 PRO HB2 H 1 1.666 0.000 . . . . . A 163 PRO HB2 . 25038 1
857 . 1 1 80 80 PRO HB3 H 1 1.666 0.000 . . . . . A 163 PRO HB3 . 25038 1
858 . 1 1 80 80 PRO HG2 H 1 2.082 0.000 . . . . . A 163 PRO HG2 . 25038 1
859 . 1 1 80 80 PRO HG3 H 1 1.817 0.000 . . . . . A 163 PRO HG3 . 25038 1
860 . 1 1 80 80 PRO HD2 H 1 3.759 0.000 . . . . . A 163 PRO HD2 . 25038 1
861 . 1 1 80 80 PRO HD3 H 1 3.544 0.000 . . . . . A 163 PRO HD3 . 25038 1
862 . 1 1 80 80 PRO CA C 13 63.310 0.000 . . . . . A 163 PRO CA . 25038 1
863 . 1 1 80 80 PRO CB C 13 32.169 0.000 . . . . . A 163 PRO CB . 25038 1
864 . 1 1 80 80 PRO CG C 13 27.416 0.009 . . . . . A 163 PRO CG . 25038 1
865 . 1 1 80 80 PRO CD C 13 50.843 0.025 . . . . . A 163 PRO CD . 25038 1
866 . 1 1 81 81 ALA H H 1 8.036 0.000 . . . . . A 164 ALA H . 25038 1
867 . 1 1 81 81 ALA HA H 1 4.592 0.000 . . . . . A 164 ALA HA . 25038 1
868 . 1 1 81 81 ALA HB1 H 1 1.195 0.000 . . . . . A 164 ALA HB1 . 25038 1
869 . 1 1 81 81 ALA HB2 H 1 1.195 0.000 . . . . . A 164 ALA HB2 . 25038 1
870 . 1 1 81 81 ALA HB3 H 1 1.195 0.000 . . . . . A 164 ALA HB3 . 25038 1
871 . 1 1 81 81 ALA CA C 13 50.294 0.000 . . . . . A 164 ALA CA . 25038 1
872 . 1 1 81 81 ALA CB C 13 22.720 0.000 . . . . . A 164 ALA CB . 25038 1
873 . 1 1 81 81 ALA N N 15 124.745 0.000 . . . . . A 164 ALA N . 25038 1
874 . 1 1 82 82 PHE H H 1 8.223 0.000 . . . . . A 165 PHE H . 25038 1
875 . 1 1 82 82 PHE HA H 1 4.960 0.000 . . . . . A 165 PHE HA . 25038 1
876 . 1 1 82 82 PHE HB2 H 1 3.168 0.000 . . . . . A 165 PHE HB2 . 25038 1
877 . 1 1 82 82 PHE HB3 H 1 2.681 0.000 . . . . . A 165 PHE HB3 . 25038 1
878 . 1 1 82 82 PHE HD1 H 1 7.178 0.000 . . . . . A 165 PHE HD1 . 25038 1
879 . 1 1 82 82 PHE HD2 H 1 7.178 0.000 . . . . . A 165 PHE HD2 . 25038 1
880 . 1 1 82 82 PHE HE1 H 1 7.366 0.000 . . . . . A 165 PHE HE1 . 25038 1
881 . 1 1 82 82 PHE HE2 H 1 7.366 0.000 . . . . . A 165 PHE HE2 . 25038 1
882 . 1 1 82 82 PHE HZ H 1 7.282 0.000 . . . . . A 165 PHE HZ . 25038 1
883 . 1 1 82 82 PHE CA C 13 57.221 0.000 . . . . . A 165 PHE CA . 25038 1
884 . 1 1 82 82 PHE CB C 13 40.963 0.001 . . . . . A 165 PHE CB . 25038 1
885 . 1 1 82 82 PHE CD1 C 13 131.896 0.000 . . . . . A 165 PHE CD1 . 25038 1
886 . 1 1 82 82 PHE CE1 C 13 131.459 0.000 . . . . . A 165 PHE CE1 . 25038 1
887 . 1 1 82 82 PHE CZ C 13 129.835 0.000 . . . . . A 165 PHE CZ . 25038 1
888 . 1 1 82 82 PHE N N 15 118.002 0.000 . . . . . A 165 PHE N . 25038 1
889 . 1 1 83 83 VAL H H 1 8.614 0.000 . . . . . A 166 VAL H . 25038 1
890 . 1 1 83 83 VAL HA H 1 4.895 0.000 . . . . . A 166 VAL HA . 25038 1
891 . 1 1 83 83 VAL HB H 1 1.779 0.000 . . . . . A 166 VAL HB . 25038 1
892 . 1 1 83 83 VAL HG11 H 1 0.797 0.000 . . . . . A 166 VAL HG11 . 25038 1
893 . 1 1 83 83 VAL HG12 H 1 0.797 0.000 . . . . . A 166 VAL HG12 . 25038 1
894 . 1 1 83 83 VAL HG13 H 1 0.797 0.000 . . . . . A 166 VAL HG13 . 25038 1
895 . 1 1 83 83 VAL HG21 H 1 0.681 0.000 . . . . . A 166 VAL HG21 . 25038 1
896 . 1 1 83 83 VAL HG22 H 1 0.681 0.000 . . . . . A 166 VAL HG22 . 25038 1
897 . 1 1 83 83 VAL HG23 H 1 0.681 0.000 . . . . . A 166 VAL HG23 . 25038 1
898 . 1 1 83 83 VAL CA C 13 60.829 0.000 . . . . . A 166 VAL CA . 25038 1
899 . 1 1 83 83 VAL CB C 13 34.855 0.000 . . . . . A 166 VAL CB . 25038 1
900 . 1 1 83 83 VAL CG1 C 13 21.001 0.000 . . . . . A 166 VAL CG1 . 25038 1
901 . 1 1 83 83 VAL CG2 C 13 20.972 0.000 . . . . . A 166 VAL CG2 . 25038 1
902 . 1 1 83 83 VAL N N 15 121.502 0.000 . . . . . A 166 VAL N . 25038 1
903 . 1 1 84 84 ASN H H 1 8.360 0.000 . . . . . A 167 ASN H . 25038 1
904 . 1 1 84 84 ASN HA H 1 4.777 0.000 . . . . . A 167 ASN HA . 25038 1
905 . 1 1 84 84 ASN HB2 H 1 2.934 0.000 . . . . . A 167 ASN HB2 . 25038 1
906 . 1 1 84 84 ASN HB3 H 1 2.750 0.000 . . . . . A 167 ASN HB3 . 25038 1
907 . 1 1 84 84 ASN HD21 H 1 7.628 0.000 . . . . . A 167 ASN HD21 . 25038 1
908 . 1 1 84 84 ASN HD22 H 1 6.983 0.000 . . . . . A 167 ASN HD22 . 25038 1
909 . 1 1 84 84 ASN CA C 13 51.961 0.000 . . . . . A 167 ASN CA . 25038 1
910 . 1 1 84 84 ASN CB C 13 42.575 0.013 . . . . . A 167 ASN CB . 25038 1
911 . 1 1 84 84 ASN N N 15 121.446 0.000 . . . . . A 167 ASN N . 25038 1
912 . 1 1 84 84 ASN ND2 N 15 112.100 0.000 . . . . . A 167 ASN ND2 . 25038 1
913 . 1 1 85 85 TYR H H 1 8.506 0.000 . . . . . A 168 TYR H . 25038 1
914 . 1 1 85 85 TYR HA H 1 4.743 0.000 . . . . . A 168 TYR HA . 25038 1
915 . 1 1 85 85 TYR HB2 H 1 3.297 0.000 . . . . . A 168 TYR HB2 . 25038 1
916 . 1 1 85 85 TYR HB3 H 1 2.610 0.000 . . . . . A 168 TYR HB3 . 25038 1
917 . 1 1 85 85 TYR HD1 H 1 7.299 0.000 . . . . . A 168 TYR HD1 . 25038 1
918 . 1 1 85 85 TYR HD2 H 1 7.299 0.000 . . . . . A 168 TYR HD2 . 25038 1
919 . 1 1 85 85 TYR HE1 H 1 6.744 0.000 . . . . . A 168 TYR HE1 . 25038 1
920 . 1 1 85 85 TYR HE2 H 1 6.744 0.000 . . . . . A 168 TYR HE2 . 25038 1
921 . 1 1 85 85 TYR CA C 13 60.088 0.000 . . . . . A 168 TYR CA . 25038 1
922 . 1 1 85 85 TYR CB C 13 39.235 0.015 . . . . . A 168 TYR CB . 25038 1
923 . 1 1 85 85 TYR CD2 C 13 133.422 0.000 . . . . . A 168 TYR CD2 . 25038 1
924 . 1 1 85 85 TYR CE2 C 13 118.939 0.000 . . . . . A 168 TYR CE2 . 25038 1
925 . 1 1 85 85 TYR N N 15 120.459 0.000 . . . . . A 168 TYR N . 25038 1
926 . 1 1 86 86 SER H H 1 8.918 0.000 . . . . . A 169 SER H . 25038 1
927 . 1 1 86 86 SER HA H 1 4.791 0.000 . . . . . A 169 SER HA . 25038 1
928 . 1 1 86 86 SER HB2 H 1 3.789 0.000 . . . . . A 169 SER HB2 . 25038 1
929 . 1 1 86 86 SER HB3 H 1 3.667 0.000 . . . . . A 169 SER HB3 . 25038 1
930 . 1 1 86 86 SER CA C 13 56.439 0.000 . . . . . A 169 SER CA . 25038 1
931 . 1 1 86 86 SER CB C 13 64.082 0.012 . . . . . A 169 SER CB . 25038 1
932 . 1 1 86 86 SER N N 15 115.466 0.000 . . . . . A 169 SER N . 25038 1
933 . 1 1 87 87 THR HA H 1 4.173 0.000 . . . . . A 170 THR HA . 25038 1
934 . 1 1 87 87 THR HB H 1 4.364 0.000 . . . . . A 170 THR HB . 25038 1
935 . 1 1 87 87 THR HG21 H 1 1.393 0.000 . . . . . A 170 THR HG21 . 25038 1
936 . 1 1 87 87 THR HG22 H 1 1.393 0.000 . . . . . A 170 THR HG22 . 25038 1
937 . 1 1 87 87 THR HG23 H 1 1.393 0.000 . . . . . A 170 THR HG23 . 25038 1
938 . 1 1 87 87 THR CA C 13 63.884 0.000 . . . . . A 170 THR CA . 25038 1
939 . 1 1 87 87 THR CB C 13 69.038 0.000 . . . . . A 170 THR CB . 25038 1
940 . 1 1 87 87 THR CG2 C 13 22.206 0.000 . . . . . A 170 THR CG2 . 25038 1
941 . 1 1 88 88 SER H H 1 8.663 0.000 . . . . . A 171 SER H . 25038 1
942 . 1 1 88 88 SER HA H 1 4.522 0.000 . . . . . A 171 SER HA . 25038 1
943 . 1 1 88 88 SER HB2 H 1 3.836 0.000 . . . . . A 171 SER HB2 . 25038 1
944 . 1 1 88 88 SER HB3 H 1 3.771 0.000 . . . . . A 171 SER HB3 . 25038 1
945 . 1 1 88 88 SER CA C 13 58.398 0.000 . . . . . A 171 SER CA . 25038 1
946 . 1 1 88 88 SER CB C 13 64.162 0.001 . . . . . A 171 SER CB . 25038 1
947 . 1 1 88 88 SER N N 15 119.092 0.000 . . . . . A 171 SER N . 25038 1
948 . 1 1 89 89 GLN H H 1 8.687 0.000 . . . . . A 172 GLN H . 25038 1
949 . 1 1 89 89 GLN HA H 1 4.447 0.000 . . . . . A 172 GLN HA . 25038 1
950 . 1 1 89 89 GLN HB2 H 1 1.845 0.000 . . . . . A 172 GLN HB2 . 25038 1
951 . 1 1 89 89 GLN HB3 H 1 1.845 0.000 . . . . . A 172 GLN HB3 . 25038 1
952 . 1 1 89 89 GLN HG2 H 1 2.482 0.000 . . . . . A 172 GLN HG2 . 25038 1
953 . 1 1 89 89 GLN HG3 H 1 2.422 0.000 . . . . . A 172 GLN HG3 . 25038 1
954 . 1 1 89 89 GLN HE21 H 1 7.379 0.000 . . . . . A 172 GLN HE21 . 25038 1
955 . 1 1 89 89 GLN HE22 H 1 7.049 0.000 . . . . . A 172 GLN HE22 . 25038 1
956 . 1 1 89 89 GLN CA C 13 55.788 0.000 . . . . . A 172 GLN CA . 25038 1
957 . 1 1 89 89 GLN CB C 13 29.287 0.000 . . . . . A 172 GLN CB . 25038 1
958 . 1 1 89 89 GLN CG C 13 33.987 0.004 . . . . . A 172 GLN CG . 25038 1
959 . 1 1 89 89 GLN N N 15 121.211 0.000 . . . . . A 172 GLN N . 25038 1
960 . 1 1 89 89 GLN NE2 N 15 113.043 0.000 . . . . . A 172 GLN NE2 . 25038 1
961 . 1 1 90 90 LYS H H 1 7.513 0.000 . . . . . A 173 LYS H . 25038 1
962 . 1 1 90 90 LYS HA H 1 4.131 0.000 . . . . . A 173 LYS HA . 25038 1
963 . 1 1 90 90 LYS HB2 H 1 1.698 0.000 . . . . . A 173 LYS HB2 . 25038 1
964 . 1 1 90 90 LYS HB3 H 1 1.632 0.000 . . . . . A 173 LYS HB3 . 25038 1
965 . 1 1 90 90 LYS HG2 H 1 1.379 0.000 . . . . . A 173 LYS HG2 . 25038 1
966 . 1 1 90 90 LYS HG3 H 1 1.307 0.000 . . . . . A 173 LYS HG3 . 25038 1
967 . 1 1 90 90 LYS HD2 H 1 1.660 0.000 . . . . . A 173 LYS HD2 . 25038 1
968 . 1 1 90 90 LYS HD3 H 1 1.660 0.000 . . . . . A 173 LYS HD3 . 25038 1
969 . 1 1 90 90 LYS HE2 H 1 2.971 0.000 . . . . . A 173 LYS HE2 . 25038 1
970 . 1 1 90 90 LYS HE3 H 1 2.971 0.000 . . . . . A 173 LYS HE3 . 25038 1
971 . 1 1 90 90 LYS CA C 13 55.751 0.000 . . . . . A 173 LYS CA . 25038 1
972 . 1 1 90 90 LYS CB C 13 35.581 0.002 . . . . . A 173 LYS CB . 25038 1
973 . 1 1 90 90 LYS CG C 13 24.270 0.001 . . . . . A 173 LYS CG . 25038 1
974 . 1 1 90 90 LYS CD C 13 29.090 0.000 . . . . . A 173 LYS CD . 25038 1
975 . 1 1 90 90 LYS CE C 13 42.150 0.000 . . . . . A 173 LYS CE . 25038 1
976 . 1 1 90 90 LYS N N 15 116.453 0.000 . . . . . A 173 LYS N . 25038 1
977 . 1 1 91 91 ILE H H 1 8.701 0.000 . . . . . A 174 ILE H . 25038 1
978 . 1 1 91 91 ILE HA H 1 3.834 0.000 . . . . . A 174 ILE HA . 25038 1
979 . 1 1 91 91 ILE HB H 1 1.674 0.000 . . . . . A 174 ILE HB . 25038 1
980 . 1 1 91 91 ILE HG21 H 1 0.875 0.000 . . . . . A 174 ILE HG21 . 25038 1
981 . 1 1 91 91 ILE HG22 H 1 0.875 0.000 . . . . . A 174 ILE HG22 . 25038 1
982 . 1 1 91 91 ILE HG23 H 1 0.875 0.000 . . . . . A 174 ILE HG23 . 25038 1
983 . 1 1 91 91 ILE HD11 H 1 0.980 0.000 . . . . . A 174 ILE HD11 . 25038 1
984 . 1 1 91 91 ILE HD12 H 1 0.980 0.000 . . . . . A 174 ILE HD12 . 25038 1
985 . 1 1 91 91 ILE HD13 H 1 0.980 0.000 . . . . . A 174 ILE HD13 . 25038 1
986 . 1 1 91 91 ILE CA C 13 63.040 0.000 . . . . . A 174 ILE CA . 25038 1
987 . 1 1 91 91 ILE CB C 13 38.760 0.000 . . . . . A 174 ILE CB . 25038 1
988 . 1 1 91 91 ILE CG2 C 13 16.030 0.000 . . . . . A 174 ILE CG2 . 25038 1
989 . 1 1 91 91 ILE CD1 C 13 13.830 0.000 . . . . . A 174 ILE CD1 . 25038 1
990 . 1 1 91 91 ILE N N 15 124.969 0.000 . . . . . A 174 ILE N . 25038 1
991 . 1 1 92 92 SER H H 1 8.692 0.000 . . . . . A 175 SER H . 25038 1
992 . 1 1 92 92 SER N N 15 124.113 0.000 . . . . . A 175 SER N . 25038 1
993 . 1 1 93 93 ARG H H 1 8.379 0.000 . . . . . A 176 ARG H . 25038 1
994 . 1 1 93 93 ARG HA H 1 4.702 0.000 . . . . . A 176 ARG HA . 25038 1
995 . 1 1 93 93 ARG HB2 H 1 1.675 0.000 . . . . . A 176 ARG HB2 . 25038 1
996 . 1 1 93 93 ARG HB3 H 1 1.675 0.000 . . . . . A 176 ARG HB3 . 25038 1
997 . 1 1 93 93 ARG HG2 H 1 1.384 0.000 . . . . . A 176 ARG HG2 . 25038 1
998 . 1 1 93 93 ARG HG3 H 1 1.342 0.000 . . . . . A 176 ARG HG3 . 25038 1
999 . 1 1 93 93 ARG CA C 13 53.538 0.000 . . . . . A 176 ARG CA . 25038 1
1000 . 1 1 93 93 ARG CB C 13 30.088 0.000 . . . . . A 176 ARG CB . 25038 1
1001 . 1 1 93 93 ARG CG C 13 26.540 0.001 . . . . . A 176 ARG CG . 25038 1
1002 . 1 1 93 93 ARG N N 15 125.524 0.000 . . . . . A 176 ARG N . 25038 1
1003 . 1 1 94 94 PRO HA H 1 4.343 0.000 . . . . . A 177 PRO HA . 25038 1
1004 . 1 1 94 94 PRO HB2 H 1 2.327 0.000 . . . . . A 177 PRO HB2 . 25038 1
1005 . 1 1 94 94 PRO HB3 H 1 1.981 0.000 . . . . . A 177 PRO HB3 . 25038 1
1006 . 1 1 94 94 PRO HG2 H 1 2.160 0.000 . . . . . A 177 PRO HG2 . 25038 1
1007 . 1 1 94 94 PRO HG3 H 1 2.160 0.000 . . . . . A 177 PRO HG3 . 25038 1
1008 . 1 1 94 94 PRO HD2 H 1 4.225 0.000 . . . . . A 177 PRO HD2 . 25038 1
1009 . 1 1 94 94 PRO HD3 H 1 3.700 0.000 . . . . . A 177 PRO HD3 . 25038 1
1010 . 1 1 94 94 PRO CA C 13 63.660 0.000 . . . . . A 177 PRO CA . 25038 1
1011 . 1 1 94 94 PRO CB C 13 32.134 0.006 . . . . . A 177 PRO CB . 25038 1
1012 . 1 1 94 94 PRO CG C 13 27.706 0.000 . . . . . A 177 PRO CG . 25038 1
1013 . 1 1 94 94 PRO CD C 13 50.852 0.001 . . . . . A 177 PRO CD . 25038 1
1014 . 1 1 95 95 GLY H H 1 8.520 0.000 . . . . . A 178 GLY H . 25038 1
1015 . 1 1 95 95 GLY HA2 H 1 3.999 0.000 . . . . . A 178 GLY HA2 . 25038 1
1016 . 1 1 95 95 GLY HA3 H 1 3.999 0.000 . . . . . A 178 GLY HA3 . 25038 1
1017 . 1 1 95 95 GLY CA C 13 45.400 0.000 . . . . . A 178 GLY CA . 25038 1
1018 . 1 1 95 95 GLY N N 15 109.773 0.000 . . . . . A 178 GLY N . 25038 1
1019 . 1 1 96 96 ASP H H 1 8.113 0.000 . . . . . A 179 ASP H . 25038 1
1020 . 1 1 96 96 ASP HA H 1 4.664 0.000 . . . . . A 179 ASP HA . 25038 1
1021 . 1 1 96 96 ASP HB2 H 1 2.760 0.000 . . . . . A 179 ASP HB2 . 25038 1
1022 . 1 1 96 96 ASP HB3 H 1 2.706 0.000 . . . . . A 179 ASP HB3 . 25038 1
1023 . 1 1 96 96 ASP CA C 13 54.630 0.000 . . . . . A 179 ASP CA . 25038 1
1024 . 1 1 96 96 ASP CB C 13 41.275 0.011 . . . . . A 179 ASP CB . 25038 1
1025 . 1 1 96 96 ASP N N 15 120.705 0.000 . . . . . A 179 ASP N . 25038 1
1026 . 1 1 97 97 SER H H 1 8.278 0.000 . . . . . A 180 SER H . 25038 1
1027 . 1 1 97 97 SER HA H 1 4.510 0.000 . . . . . A 180 SER HA . 25038 1
1028 . 1 1 97 97 SER HB2 H 1 3.896 0.000 . . . . . A 180 SER HB2 . 25038 1
1029 . 1 1 97 97 SER HB3 H 1 3.896 0.000 . . . . . A 180 SER HB3 . 25038 1
1030 . 1 1 97 97 SER CA C 13 58.400 0.000 . . . . . A 180 SER CA . 25038 1
1031 . 1 1 97 97 SER CB C 13 64.095 0.000 . . . . . A 180 SER CB . 25038 1
1032 . 1 1 97 97 SER N N 15 115.491 0.000 . . . . . A 180 SER N . 25038 1
1033 . 1 1 98 98 ASP H H 1 8.371 0.000 . . . . . A 181 ASP H . 25038 1
1034 . 1 1 98 98 ASP HA H 1 4.690 0.000 . . . . . A 181 ASP HA . 25038 1
1035 . 1 1 98 98 ASP HB2 H 1 2.779 0.000 . . . . . A 181 ASP HB2 . 25038 1
1036 . 1 1 98 98 ASP HB3 H 1 2.721 0.000 . . . . . A 181 ASP HB3 . 25038 1
1037 . 1 1 98 98 ASP CA C 13 54.614 0.000 . . . . . A 181 ASP CA . 25038 1
1038 . 1 1 98 98 ASP CB C 13 41.303 0.000 . . . . . A 181 ASP CB . 25038 1
1039 . 1 1 98 98 ASP N N 15 122.472 0.000 . . . . . A 181 ASP N . 25038 1
1040 . 1 1 99 99 ASP H H 1 8.323 0.000 . . . . . A 182 ASP H . 25038 1
1041 . 1 1 99 99 ASP HA H 1 4.661 0.000 . . . . . A 182 ASP HA . 25038 1
1042 . 1 1 99 99 ASP HB2 H 1 2.760 0.000 . . . . . A 182 ASP HB2 . 25038 1
1043 . 1 1 99 99 ASP HB3 H 1 2.706 0.000 . . . . . A 182 ASP HB3 . 25038 1
1044 . 1 1 99 99 ASP CA C 13 54.668 0.000 . . . . . A 182 ASP CA . 25038 1
1045 . 1 1 99 99 ASP CB C 13 41.275 0.011 . . . . . A 182 ASP CB . 25038 1
1046 . 1 1 99 99 ASP N N 15 121.277 0.000 . . . . . A 182 ASP N . 25038 1
1047 . 1 1 100 100 SER H H 1 8.321 0.000 . . . . . A 183 SER H . 25038 1
1048 . 1 1 100 100 SER HA H 1 4.426 0.000 . . . . . A 183 SER HA . 25038 1
1049 . 1 1 100 100 SER HB2 H 1 3.945 0.000 . . . . . A 183 SER HB2 . 25038 1
1050 . 1 1 100 100 SER HB3 H 1 3.945 0.000 . . . . . A 183 SER HB3 . 25038 1
1051 . 1 1 100 100 SER CA C 13 59.256 0.000 . . . . . A 183 SER CA . 25038 1
1052 . 1 1 100 100 SER CB C 13 63.865 0.000 . . . . . A 183 SER CB . 25038 1
1053 . 1 1 100 100 SER N N 15 116.407 0.000 . . . . . A 183 SER N . 25038 1
1054 . 1 1 101 101 ARG H H 1 8.161 0.000 . . . . . A 184 ARG H . 25038 1
1055 . 1 1 101 101 ARG HA H 1 4.420 0.000 . . . . . A 184 ARG HA . 25038 1
1056 . 1 1 101 101 ARG HB2 H 1 1.952 0.000 . . . . . A 184 ARG HB2 . 25038 1
1057 . 1 1 101 101 ARG HB3 H 1 1.851 0.000 . . . . . A 184 ARG HB3 . 25038 1
1058 . 1 1 101 101 ARG HG2 H 1 1.702 0.000 . . . . . A 184 ARG HG2 . 25038 1
1059 . 1 1 101 101 ARG HG3 H 1 1.681 0.000 . . . . . A 184 ARG HG3 . 25038 1
1060 . 1 1 101 101 ARG HD2 H 1 3.253 0.000 . . . . . A 184 ARG HD2 . 25038 1
1061 . 1 1 101 101 ARG HD3 H 1 3.253 0.000 . . . . . A 184 ARG HD3 . 25038 1
1062 . 1 1 101 101 ARG CA C 13 56.430 0.000 . . . . . A 184 ARG CA . 25038 1
1063 . 1 1 101 101 ARG CB C 13 30.629 0.012 . . . . . A 184 ARG CB . 25038 1
1064 . 1 1 101 101 ARG CG C 13 27.201 0.004 . . . . . A 184 ARG CG . 25038 1
1065 . 1 1 101 101 ARG CD C 13 43.451 0.000 . . . . . A 184 ARG CD . 25038 1
1066 . 1 1 101 101 ARG N N 15 122.019 0.000 . . . . . A 184 ARG N . 25038 1
1067 . 1 1 102 102 SER H H 1 8.243 0.000 . . . . . A 185 SER H . 25038 1
1068 . 1 1 102 102 SER HA H 1 4.527 0.000 . . . . . A 185 SER HA . 25038 1
1069 . 1 1 102 102 SER HB2 H 1 3.920 0.000 . . . . . A 185 SER HB2 . 25038 1
1070 . 1 1 102 102 SER HB3 H 1 3.920 0.000 . . . . . A 185 SER HB3 . 25038 1
1071 . 1 1 102 102 SER CA C 13 58.450 0.000 . . . . . A 185 SER CA . 25038 1
1072 . 1 1 102 102 SER CB C 13 63.868 0.000 . . . . . A 185 SER CB . 25038 1
1073 . 1 1 102 102 SER N N 15 116.571 0.000 . . . . . A 185 SER N . 25038 1
1074 . 1 1 103 103 VAL H H 1 8.082 0.000 . . . . . A 186 VAL H . 25038 1
1075 . 1 1 103 103 VAL HA H 1 4.230 0.000 . . . . . A 186 VAL HA . 25038 1
1076 . 1 1 103 103 VAL HB H 1 2.170 0.000 . . . . . A 186 VAL HB . 25038 1
1077 . 1 1 103 103 VAL HG11 H 1 0.987 0.000 . . . . . A 186 VAL HG11 . 25038 1
1078 . 1 1 103 103 VAL HG12 H 1 0.987 0.000 . . . . . A 186 VAL HG12 . 25038 1
1079 . 1 1 103 103 VAL HG13 H 1 0.987 0.000 . . . . . A 186 VAL HG13 . 25038 1
1080 . 1 1 103 103 VAL HG21 H 1 0.976 0.000 . . . . . A 186 VAL HG21 . 25038 1
1081 . 1 1 103 103 VAL HG22 H 1 0.976 0.000 . . . . . A 186 VAL HG22 . 25038 1
1082 . 1 1 103 103 VAL HG23 H 1 0.976 0.000 . . . . . A 186 VAL HG23 . 25038 1
1083 . 1 1 103 103 VAL CA C 13 62.440 0.000 . . . . . A 186 VAL CA . 25038 1
1084 . 1 1 103 103 VAL CB C 13 32.801 0.000 . . . . . A 186 VAL CB . 25038 1
1085 . 1 1 103 103 VAL CG1 C 13 21.216 0.000 . . . . . A 186 VAL CG1 . 25038 1
1086 . 1 1 103 103 VAL CG2 C 13 20.244 0.000 . . . . . A 186 VAL CG2 . 25038 1
1087 . 1 1 103 103 VAL N N 15 120.922 0.000 . . . . . A 186 VAL N . 25038 1
1088 . 1 1 104 104 ASN H H 1 8.431 0.000 . . . . . A 187 ASN H . 25038 1
1089 . 1 1 104 104 ASN HA H 1 4.864 0.000 . . . . . A 187 ASN HA . 25038 1
1090 . 1 1 104 104 ASN HB2 H 1 2.910 0.000 . . . . . A 187 ASN HB2 . 25038 1
1091 . 1 1 104 104 ASN HB3 H 1 2.766 0.000 . . . . . A 187 ASN HB3 . 25038 1
1092 . 1 1 104 104 ASN CA C 13 53.390 0.000 . . . . . A 187 ASN CA . 25038 1
1093 . 1 1 104 104 ASN CB C 13 39.361 0.005 . . . . . A 187 ASN CB . 25038 1
1094 . 1 1 104 104 ASN N N 15 122.174 0.000 . . . . . A 187 ASN N . 25038 1
1095 . 1 1 105 105 SER H H 1 7.880 0.000 . . . . . A 188 SER H . 25038 1
1096 . 1 1 105 105 SER HA H 1 4.305 0.000 . . . . . A 188 SER HA . 25038 1
1097 . 1 1 105 105 SER CA C 13 60.120 0.000 . . . . . A 188 SER CA . 25038 1
1098 . 1 1 105 105 SER N N 15 121.742 0.000 . . . . . A 188 SER N . 25038 1
stop_
save_