data_36787 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36787 _Entry.Title ; Solution structure of the complex between the UBA-like domain of mouse HBS1L and ubiquitin ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2025-09-09 _Entry.Accession_date 2026-03-03 _Entry.Last_release_date 2026-03-03 _Entry.Original_release_date 2026-03-03 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.2.0.16 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 F. He F. . . . 36787 2 M. Takahashi M. . . . 36787 3 K. Tsuda K. . . . 36787 4 T. Nagata T. . . . 36787 5 A. Tanaka A. . . . 36787 6 N. Kobayashi N. . . . 36787 7 T. Kigawa T. . . . 36787 8 P. Guntert P. . . . 36787 9 M. Shirouzu M. . . . 36787 10 N. Nameki N. . . . 36787 11 S. Yokoyama S. . . . 36787 12 K. Kuwasako K. . . . 36787 13 Y. Muto Y. . . . 36787 14 RIKEN 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . . . . 36787 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'PSI, Protein Structure Initiative' 'RIKEN Structural Genomics/Proteomics Initiative' RSGI 36787 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID HBS1L . 36787 PSI-2 . 36787 'Protein Structure Initiative' . 36787 'RIKEN Structural Genomics/Proteomics Initiative' . 36787 RSGI . 36787 'Structural Genomics' . 36787 TRANSLATION . 36787 Ubiqutin . 36787 'ribosome-associated quality control trigger' . 36787 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36787 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 681 36787 '15N chemical shifts' 155 36787 '1H chemical shifts' 1088 36787 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 . . 2026-05-07 . original BMRB . 36787 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 36786 'Solution structure of N-terminal domain of mouse HBS1L protein' 36787 PDB 9WPS 'BMRB Entry Tracking System' 36787 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36787 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Solution structure of mouse HBS1L/SKI7-specific UBA domain in complex with ubiquitin: Implications for stalled ribosome recognition. ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Plos One' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _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 2026 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 F. He F. . . . 36787 1 2 N. Nameki N. . . . 36787 1 3 K. Tsuda K. . . . 36787 1 4 M. Takahashi M. . . . 36787 1 5 T. Nagata T. . . . 36787 1 6 N. Kobayashi N. . . . 36787 1 7 M. Shirouzu M. . . . 36787 1 8 T. Kigawa T. . . . 36787 1 9 P. Guntert P. . . . 36787 1 10 S. Yokoyama S. . . . 36787 1 11 Y. Muto Y. . . . 36787 1 12 K. Kuwasako K. . . . 36787 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36787 _Assembly.ID 1 _Assembly.Name 'HBS1-like protein (E.C.3.6.5.-), Ubiquitin-ribosomal protein eS31 fusion protein' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 'all free' _Assembly.Molecular_mass 18072.059 _Assembly.Enzyme_commission_number 3.6.5.- _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 1 $entity_1 A A yes . . . . . . 36787 1 2 entity_2 2 $entity_2 B B yes . . . . . . 36787 1 stop_ loop_ _Chem_comp_assembly.Assembly_chem_comp_ID _Chem_comp_assembly.Entity_assembly_ID _Chem_comp_assembly.Entity_ID _Chem_comp_assembly.Comp_index_ID _Chem_comp_assembly.Comp_ID _Chem_comp_assembly.Seq_ID _Chem_comp_assembly.Auth_entity_assembly_ID _Chem_comp_assembly.Auth_asym_ID _Chem_comp_assembly.Auth_seq_ID _Chem_comp_assembly.Auth_comp_ID _Chem_comp_assembly.Auth_variant_ID _Chem_comp_assembly.Sequence_linking _Chem_comp_assembly.Cis_residue _Chem_comp_assembly.NEF_index _Chem_comp_assembly.Entry_ID _Chem_comp_assembly.Assembly_ID . 1 1 1 GLY 1 . A 1 GLY . start no . 36787 1 . 1 1 10 GLY 10 . A 10 GLY . middle no . 36787 1 . 1 1 11 TYR 11 . A 11 TYR . middle . . 36787 1 . 1 1 12 GLU 12 . A 12 GLU . middle . . 36787 1 . 1 1 13 ASP 13 . A 13 ASP . middle . . 36787 1 . 1 1 14 LEU 14 . A 14 LEU . middle . . 36787 1 . 1 1 15 ARG 15 . A 15 ARG . middle . . 36787 1 . 1 1 16 GLU 16 . A 16 GLU . middle . . 36787 1 . 1 1 17 SER 17 . A 17 SER . middle . . 36787 1 . 1 1 18 SER 18 . A 18 SER . middle . . 36787 1 . 1 1 19 ASN 19 . A 19 ASN . middle . . 36787 1 . 1 1 2 SER 2 . A 2 SER . middle . . 36787 1 . 1 1 20 SER 20 . A 20 SER . middle . . 36787 1 . 1 1 21 LEU 21 . A 21 LEU . middle . . 36787 1 . 1 1 22 LEU 22 . A 22 LEU . middle . . 36787 1 . 1 1 23 ASN 23 . A 23 ASN . middle . . 36787 1 . 1 1 24 HIS 24 . A 24 HIS . middle . . 36787 1 . 1 1 25 GLN 25 . A 25 GLN . middle . . 36787 1 . 1 1 26 LEU 26 . A 26 LEU . middle . . 36787 1 . 1 1 27 SER 27 . A 27 SER . middle . . 36787 1 . 1 1 28 GLU 28 . A 28 GLU . middle . . 36787 1 . 1 1 29 ILE 29 . A 29 ILE . middle . . 36787 1 . 1 1 3 SER 3 . A 3 SER . middle . . 36787 1 . 1 1 30 ASP 30 . A 30 ASP . middle . . 36787 1 . 1 1 31 GLN 31 . A 31 GLN . middle . . 36787 1 . 1 1 32 ALA 32 . A 32 ALA . middle . . 36787 1 . 1 1 33 ARG 33 . A 33 ARG . middle . . 36787 1 . 1 1 34 LEU 34 . A 34 LEU . middle . . 36787 1 . 1 1 35 TYR 35 . A 35 TYR . middle . . 36787 1 . 1 1 36 SER 36 . A 36 SER . middle . . 36787 1 . 1 1 37 CYS 37 . A 37 CYS . middle . . 36787 1 . 1 1 38 LEU 38 . A 38 LEU . middle . . 36787 1 . 1 1 39 ASP 39 . A 39 ASP . middle . . 36787 1 . 1 1 4 GLY 4 . A 4 GLY . middle no . 36787 1 . 1 1 40 HIS 40 . A 40 HIS . middle . . 36787 1 . 1 1 41 MET 41 . A 41 MET . middle . . 36787 1 . 1 1 42 ARG 42 . A 42 ARG . middle . . 36787 1 . 1 1 43 GLU 43 . A 43 GLU . middle . . 36787 1 . 1 1 44 VAL 44 . A 44 VAL . middle . . 36787 1 . 1 1 45 LEU 45 . A 45 LEU . middle . . 36787 1 . 1 1 46 GLY 46 . A 46 GLY . middle no . 36787 1 . 1 1 47 ASP 47 . A 47 ASP . middle . . 36787 1 . 1 1 48 ALA 48 . A 48 ALA . middle . . 36787 1 . 1 1 49 VAL 49 . A 49 VAL . middle . . 36787 1 . 1 1 5 SER 5 . A 5 SER . middle . . 36787 1 . 1 1 50 PRO 50 . A 50 PRO . middle no . 36787 1 . 1 1 51 ASP 51 . A 51 ASP . middle . . 36787 1 . 1 1 52 ASP 52 . A 52 ASP . middle . . 36787 1 . 1 1 53 ILE 53 . A 53 ILE . middle . . 36787 1 . 1 1 54 LEU 54 . A 54 LEU . middle . . 36787 1 . 1 1 55 THR 55 . A 55 THR . middle . . 36787 1 . 1 1 56 GLU 56 . A 56 GLU . middle . . 36787 1 . 1 1 57 ALA 57 . A 57 ALA . middle . . 36787 1 . 1 1 58 ILE 58 . A 58 ILE . middle . . 36787 1 . 1 1 59 LEU 59 . A 59 LEU . middle . . 36787 1 . 1 1 6 SER 6 . A 6 SER . middle . . 36787 1 . 1 1 60 LYS 60 . A 60 LYS . middle . . 36787 1 . 1 1 61 HIS 61 . A 61 HIS . middle . . 36787 1 . 1 1 62 LYS 62 . A 62 LYS . middle . . 36787 1 . 1 1 63 PHE 63 . A 63 PHE . middle . . 36787 1 . 1 1 64 ASP 64 . A 64 ASP . middle . . 36787 1 . 1 1 65 VAL 65 . A 65 VAL . middle . . 36787 1 . 1 1 66 GLN 66 . A 66 GLN . middle . . 36787 1 . 1 1 67 LYS 67 . A 67 LYS . middle . . 36787 1 . 1 1 68 ALA 68 . A 68 ALA . middle . . 36787 1 . 1 1 69 LEU 69 . A 69 LEU . middle . . 36787 1 . 1 1 7 GLY 7 . A 7 GLY . middle no . 36787 1 . 1 1 70 SER 70 . A 70 SER . middle . . 36787 1 . 1 1 71 VAL 71 . A 71 VAL . middle . . 36787 1 . 1 1 72 VAL 72 . A 72 VAL . middle . . 36787 1 . 1 1 73 LEU 73 . A 73 LEU . middle . . 36787 1 . 1 1 74 GLU 74 . A 74 GLU . middle . . 36787 1 . 1 1 75 GLN 75 . A 75 GLN . middle . . 36787 1 . 1 1 76 ASP 76 . A 76 ASP . middle . . 36787 1 . 1 1 77 GLY 77 . A 77 GLY . middle no . 36787 1 . 1 1 78 SER 78 . A 78 SER . middle . . 36787 1 . 1 1 79 GLY 79 . A 79 GLY . middle no . 36787 1 . 1 1 8 GLU 8 . A 8 GLU . middle . . 36787 1 . 1 1 80 PRO 80 . A 80 PRO . middle no . 36787 1 . 1 1 81 SER 81 . A 81 SER . middle . . 36787 1 . 1 1 82 SER 82 . A 82 SER . middle . . 36787 1 . 1 1 83 GLY 83 . A 83 GLY . end no . 36787 1 . 1 1 9 TYR 9 . A 9 TYR . middle . . 36787 1 . 2 2 1 GLY 1 . B 84 GLY . start no . 36787 1 . 2 2 10 ILE 10 . B 93 ILE . middle . . 36787 1 . 2 2 11 PHE 11 . B 94 PHE . middle . . 36787 1 . 2 2 12 VAL 12 . B 95 VAL . middle . . 36787 1 . 2 2 13 LYS 13 . B 96 LYS . middle . . 36787 1 . 2 2 14 THR 14 . B 97 THR . middle . . 36787 1 . 2 2 15 LEU 15 . B 98 LEU . middle . . 36787 1 . 2 2 16 THR 16 . B 99 THR . middle . . 36787 1 . 2 2 17 GLY 17 . B 100 GLY . middle no . 36787 1 . 2 2 18 LYS 18 . B 101 LYS . middle . . 36787 1 . 2 2 19 THR 19 . B 102 THR . middle . . 36787 1 . 2 2 2 SER 2 . B 85 SER . middle . . 36787 1 . 2 2 20 ILE 20 . B 103 ILE . middle . . 36787 1 . 2 2 21 THR 21 . B 104 THR . middle . . 36787 1 . 2 2 22 LEU 22 . B 105 LEU . middle . . 36787 1 . 2 2 23 GLU 23 . B 106 GLU . middle . . 36787 1 . 2 2 24 VAL 24 . B 107 VAL . middle . . 36787 1 . 2 2 25 GLU 25 . B 108 GLU . middle . . 36787 1 . 2 2 26 PRO 26 . B 109 PRO . middle no . 36787 1 . 2 2 27 SER 27 . B 110 SER . middle . . 36787 1 . 2 2 28 ASP 28 . B 111 ASP . middle . . 36787 1 . 2 2 29 THR 29 . B 112 THR . middle . . 36787 1 . 2 2 3 SER 3 . B 86 SER . middle . . 36787 1 . 2 2 30 ILE 30 . B 113 ILE . middle . . 36787 1 . 2 2 31 GLU 31 . B 114 GLU . middle . . 36787 1 . 2 2 32 ASN 32 . B 115 ASN . middle . . 36787 1 . 2 2 33 VAL 33 . B 116 VAL . middle . . 36787 1 . 2 2 34 LYS 34 . B 117 LYS . middle . . 36787 1 . 2 2 35 ALA 35 . B 118 ALA . middle . . 36787 1 . 2 2 36 LYS 36 . B 119 LYS . middle . . 36787 1 . 2 2 37 ILE 37 . B 120 ILE . middle . . 36787 1 . 2 2 38 GLN 38 . B 121 GLN . middle . . 36787 1 . 2 2 39 ASP 39 . B 122 ASP . middle . . 36787 1 . 2 2 4 GLY 4 . B 87 GLY . middle no . 36787 1 . 2 2 40 LYS 40 . B 123 LYS . middle . . 36787 1 . 2 2 41 GLU 41 . B 124 GLU . middle . . 36787 1 . 2 2 42 GLY 42 . B 125 GLY . middle no . 36787 1 . 2 2 43 ILE 43 . B 126 ILE . middle . . 36787 1 . 2 2 44 PRO 44 . B 127 PRO . middle no . 36787 1 . 2 2 45 PRO 45 . B 128 PRO . middle no . 36787 1 . 2 2 46 ASP 46 . B 129 ASP . middle . . 36787 1 . 2 2 47 GLN 47 . B 130 GLN . middle . . 36787 1 . 2 2 48 GLN 48 . B 131 GLN . middle . . 36787 1 . 2 2 49 ARG 49 . B 132 ARG . middle . . 36787 1 . 2 2 5 SER 5 . B 88 SER . middle . . 36787 1 . 2 2 50 LEU 50 . B 133 LEU . middle . . 36787 1 . 2 2 51 ILE 51 . B 134 ILE . middle . . 36787 1 . 2 2 52 PHE 52 . B 135 PHE . middle . . 36787 1 . 2 2 53 ALA 53 . B 136 ALA . middle . . 36787 1 . 2 2 54 GLY 54 . B 137 GLY . middle no . 36787 1 . 2 2 55 LYS 55 . B 138 LYS . middle . . 36787 1 . 2 2 56 GLN 56 . B 139 GLN . middle . . 36787 1 . 2 2 57 LEU 57 . B 140 LEU . middle . . 36787 1 . 2 2 58 GLU 58 . B 141 GLU . middle . . 36787 1 . 2 2 59 ASP 59 . B 142 ASP . middle . . 36787 1 . 2 2 6 SER 6 . B 89 SER . middle . . 36787 1 . 2 2 60 GLY 60 . B 143 GLY . middle no . 36787 1 . 2 2 61 ARG 61 . B 144 ARG . middle . . 36787 1 . 2 2 62 THR 62 . B 145 THR . middle . . 36787 1 . 2 2 63 LEU 63 . B 146 LEU . middle . . 36787 1 . 2 2 64 SER 64 . B 147 SER . middle . . 36787 1 . 2 2 65 ASP 65 . B 148 ASP . middle . . 36787 1 . 2 2 66 TYR 66 . B 149 TYR . middle . . 36787 1 . 2 2 67 ASN 67 . B 150 ASN . middle . . 36787 1 . 2 2 68 ILE 68 . B 151 ILE . middle . . 36787 1 . 2 2 69 GLN 69 . B 152 GLN . middle . . 36787 1 . 2 2 7 GLY 7 . B 90 GLY . middle no . 36787 1 . 2 2 70 LYS 70 . B 153 LYS . middle . . 36787 1 . 2 2 71 GLU 71 . B 154 GLU . middle . . 36787 1 . 2 2 72 SER 72 . B 155 SER . middle . . 36787 1 . 2 2 73 THR 73 . B 156 THR . middle . . 36787 1 . 2 2 74 LEU 74 . B 157 LEU . middle . . 36787 1 . 2 2 75 HIS 75 . B 158 HIS . middle . . 36787 1 . 2 2 76 LEU 76 . B 159 LEU . middle . . 36787 1 . 2 2 77 VAL 77 . B 160 VAL . middle . . 36787 1 . 2 2 78 LEU 78 . B 161 LEU . middle . . 36787 1 . 2 2 79 ARG 79 . B 162 ARG . middle . . 36787 1 . 2 2 8 MET 8 . B 91 MET . middle . . 36787 1 . 2 2 80 LEU 80 . B 163 LEU . middle . . 36787 1 . 2 2 81 ARG 81 . B 164 ARG . middle . . 36787 1 . 2 2 82 GLY 82 . B 165 GLY . middle no . 36787 1 . 2 2 83 GLY 83 . B 166 GLY . end no . 36787 1 . 2 2 9 GLN 9 . B 92 GLN . middle . . 36787 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36787 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'HBS1-like protein' _Entity.Type polymer _Entity.Polymer_common_type protein _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 ; GSSGSSGEYGYEDLRESSNS LLNHQLSEIDQARLYSCLDH MREVLGDAVPDDILTEAILK HKFDVQKALSVVLEQDGSGP SSG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 83 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 3.6.5.- _Entity.Calc_isoelectric_point . _Entity.Formula_weight 8975.762 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 GLY . 36787 1 2 2 SER . 36787 1 3 3 SER . 36787 1 4 4 GLY . 36787 1 5 5 SER . 36787 1 6 6 SER . 36787 1 7 7 GLY . 36787 1 8 8 GLU . 36787 1 9 9 TYR . 36787 1 10 10 GLY . 36787 1 11 11 TYR . 36787 1 12 12 GLU . 36787 1 13 13 ASP . 36787 1 14 14 LEU . 36787 1 15 15 ARG . 36787 1 16 16 GLU . 36787 1 17 17 SER . 36787 1 18 18 SER . 36787 1 19 19 ASN . 36787 1 20 20 SER . 36787 1 21 21 LEU . 36787 1 22 22 LEU . 36787 1 23 23 ASN . 36787 1 24 24 HIS . 36787 1 25 25 GLN . 36787 1 26 26 LEU . 36787 1 27 27 SER . 36787 1 28 28 GLU . 36787 1 29 29 ILE . 36787 1 30 30 ASP . 36787 1 31 31 GLN . 36787 1 32 32 ALA . 36787 1 33 33 ARG . 36787 1 34 34 LEU . 36787 1 35 35 TYR . 36787 1 36 36 SER . 36787 1 37 37 CYS . 36787 1 38 38 LEU . 36787 1 39 39 ASP . 36787 1 40 40 HIS . 36787 1 41 41 MET . 36787 1 42 42 ARG . 36787 1 43 43 GLU . 36787 1 44 44 VAL . 36787 1 45 45 LEU . 36787 1 46 46 GLY . 36787 1 47 47 ASP . 36787 1 48 48 ALA . 36787 1 49 49 VAL . 36787 1 50 50 PRO . 36787 1 51 51 ASP . 36787 1 52 52 ASP . 36787 1 53 53 ILE . 36787 1 54 54 LEU . 36787 1 55 55 THR . 36787 1 56 56 GLU . 36787 1 57 57 ALA . 36787 1 58 58 ILE . 36787 1 59 59 LEU . 36787 1 60 60 LYS . 36787 1 61 61 HIS . 36787 1 62 62 LYS . 36787 1 63 63 PHE . 36787 1 64 64 ASP . 36787 1 65 65 VAL . 36787 1 66 66 GLN . 36787 1 67 67 LYS . 36787 1 68 68 ALA . 36787 1 69 69 LEU . 36787 1 70 70 SER . 36787 1 71 71 VAL . 36787 1 72 72 VAL . 36787 1 73 73 LEU . 36787 1 74 74 GLU . 36787 1 75 75 GLN . 36787 1 76 76 ASP . 36787 1 77 77 GLY . 36787 1 78 78 SER . 36787 1 79 79 GLY . 36787 1 80 80 PRO . 36787 1 81 81 SER . 36787 1 82 82 SER . 36787 1 83 83 GLY . 36787 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 36787 1 . SER 2 2 36787 1 . SER 3 3 36787 1 . GLY 4 4 36787 1 . SER 5 5 36787 1 . SER 6 6 36787 1 . GLY 7 7 36787 1 . GLU 8 8 36787 1 . TYR 9 9 36787 1 . GLY 10 10 36787 1 . TYR 11 11 36787 1 . GLU 12 12 36787 1 . ASP 13 13 36787 1 . LEU 14 14 36787 1 . ARG 15 15 36787 1 . GLU 16 16 36787 1 . SER 17 17 36787 1 . SER 18 18 36787 1 . ASN 19 19 36787 1 . SER 20 20 36787 1 . LEU 21 21 36787 1 . LEU 22 22 36787 1 . ASN 23 23 36787 1 . HIS 24 24 36787 1 . GLN 25 25 36787 1 . LEU 26 26 36787 1 . SER 27 27 36787 1 . GLU 28 28 36787 1 . ILE 29 29 36787 1 . ASP 30 30 36787 1 . GLN 31 31 36787 1 . ALA 32 32 36787 1 . ARG 33 33 36787 1 . LEU 34 34 36787 1 . TYR 35 35 36787 1 . SER 36 36 36787 1 . CYS 37 37 36787 1 . LEU 38 38 36787 1 . ASP 39 39 36787 1 . HIS 40 40 36787 1 . MET 41 41 36787 1 . ARG 42 42 36787 1 . GLU 43 43 36787 1 . VAL 44 44 36787 1 . LEU 45 45 36787 1 . GLY 46 46 36787 1 . ASP 47 47 36787 1 . ALA 48 48 36787 1 . VAL 49 49 36787 1 . PRO 50 50 36787 1 . ASP 51 51 36787 1 . ASP 52 52 36787 1 . ILE 53 53 36787 1 . LEU 54 54 36787 1 . THR 55 55 36787 1 . GLU 56 56 36787 1 . ALA 57 57 36787 1 . ILE 58 58 36787 1 . LEU 59 59 36787 1 . LYS 60 60 36787 1 . HIS 61 61 36787 1 . LYS 62 62 36787 1 . PHE 63 63 36787 1 . ASP 64 64 36787 1 . VAL 65 65 36787 1 . GLN 66 66 36787 1 . LYS 67 67 36787 1 . ALA 68 68 36787 1 . LEU 69 69 36787 1 . SER 70 70 36787 1 . VAL 71 71 36787 1 . VAL 72 72 36787 1 . LEU 73 73 36787 1 . GLU 74 74 36787 1 . GLN 75 75 36787 1 . ASP 76 76 36787 1 . GLY 77 77 36787 1 . SER 78 78 36787 1 . GLY 79 79 36787 1 . PRO 80 80 36787 1 . SER 81 81 36787 1 . SER 82 82 36787 1 . GLY 83 83 36787 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 36787 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name 'Ubiquitin-ribosomal protein eS31 fusion protein' _Entity.Type polymer _Entity.Polymer_common_type protein _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGMQIFVKTLTGKTI TLEVEPSDTIENVKAKIQDK EGIPPDQQRLIFAGKQLEDG RTLSDYNIQKESTLHLVLRL RGG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 83 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 9096.297 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 84 GLY . 36787 2 2 85 SER . 36787 2 3 86 SER . 36787 2 4 87 GLY . 36787 2 5 88 SER . 36787 2 6 89 SER . 36787 2 7 90 GLY . 36787 2 8 91 MET . 36787 2 9 92 GLN . 36787 2 10 93 ILE . 36787 2 11 94 PHE . 36787 2 12 95 VAL . 36787 2 13 96 LYS . 36787 2 14 97 THR . 36787 2 15 98 LEU . 36787 2 16 99 THR . 36787 2 17 100 GLY . 36787 2 18 101 LYS . 36787 2 19 102 THR . 36787 2 20 103 ILE . 36787 2 21 104 THR . 36787 2 22 105 LEU . 36787 2 23 106 GLU . 36787 2 24 107 VAL . 36787 2 25 108 GLU . 36787 2 26 109 PRO . 36787 2 27 110 SER . 36787 2 28 111 ASP . 36787 2 29 112 THR . 36787 2 30 113 ILE . 36787 2 31 114 GLU . 36787 2 32 115 ASN . 36787 2 33 116 VAL . 36787 2 34 117 LYS . 36787 2 35 118 ALA . 36787 2 36 119 LYS . 36787 2 37 120 ILE . 36787 2 38 121 GLN . 36787 2 39 122 ASP . 36787 2 40 123 LYS . 36787 2 41 124 GLU . 36787 2 42 125 GLY . 36787 2 43 126 ILE . 36787 2 44 127 PRO . 36787 2 45 128 PRO . 36787 2 46 129 ASP . 36787 2 47 130 GLN . 36787 2 48 131 GLN . 36787 2 49 132 ARG . 36787 2 50 133 LEU . 36787 2 51 134 ILE . 36787 2 52 135 PHE . 36787 2 53 136 ALA . 36787 2 54 137 GLY . 36787 2 55 138 LYS . 36787 2 56 139 GLN . 36787 2 57 140 LEU . 36787 2 58 141 GLU . 36787 2 59 142 ASP . 36787 2 60 143 GLY . 36787 2 61 144 ARG . 36787 2 62 145 THR . 36787 2 63 146 LEU . 36787 2 64 147 SER . 36787 2 65 148 ASP . 36787 2 66 149 TYR . 36787 2 67 150 ASN . 36787 2 68 151 ILE . 36787 2 69 152 GLN . 36787 2 70 153 LYS . 36787 2 71 154 GLU . 36787 2 72 155 SER . 36787 2 73 156 THR . 36787 2 74 157 LEU . 36787 2 75 158 HIS . 36787 2 76 159 LEU . 36787 2 77 160 VAL . 36787 2 78 161 LEU . 36787 2 79 162 ARG . 36787 2 80 163 LEU . 36787 2 81 164 ARG . 36787 2 82 165 GLY . 36787 2 83 166 GLY . 36787 2 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 36787 2 . SER 2 2 36787 2 . SER 3 3 36787 2 . GLY 4 4 36787 2 . SER 5 5 36787 2 . SER 6 6 36787 2 . GLY 7 7 36787 2 . MET 8 8 36787 2 . GLN 9 9 36787 2 . ILE 10 10 36787 2 . PHE 11 11 36787 2 . VAL 12 12 36787 2 . LYS 13 13 36787 2 . THR 14 14 36787 2 . LEU 15 15 36787 2 . THR 16 16 36787 2 . GLY 17 17 36787 2 . LYS 18 18 36787 2 . THR 19 19 36787 2 . ILE 20 20 36787 2 . THR 21 21 36787 2 . LEU 22 22 36787 2 . GLU 23 23 36787 2 . VAL 24 24 36787 2 . GLU 25 25 36787 2 . PRO 26 26 36787 2 . SER 27 27 36787 2 . ASP 28 28 36787 2 . THR 29 29 36787 2 . ILE 30 30 36787 2 . GLU 31 31 36787 2 . ASN 32 32 36787 2 . VAL 33 33 36787 2 . LYS 34 34 36787 2 . ALA 35 35 36787 2 . LYS 36 36 36787 2 . ILE 37 37 36787 2 . GLN 38 38 36787 2 . ASP 39 39 36787 2 . LYS 40 40 36787 2 . GLU 41 41 36787 2 . GLY 42 42 36787 2 . ILE 43 43 36787 2 . PRO 44 44 36787 2 . PRO 45 45 36787 2 . ASP 46 46 36787 2 . GLN 47 47 36787 2 . GLN 48 48 36787 2 . ARG 49 49 36787 2 . LEU 50 50 36787 2 . ILE 51 51 36787 2 . PHE 52 52 36787 2 . ALA 53 53 36787 2 . GLY 54 54 36787 2 . LYS 55 55 36787 2 . GLN 56 56 36787 2 . LEU 57 57 36787 2 . GLU 58 58 36787 2 . ASP 59 59 36787 2 . GLY 60 60 36787 2 . ARG 61 61 36787 2 . THR 62 62 36787 2 . LEU 63 63 36787 2 . SER 64 64 36787 2 . ASP 65 65 36787 2 . TYR 66 66 36787 2 . ASN 67 67 36787 2 . ILE 68 68 36787 2 . GLN 69 69 36787 2 . LYS 70 70 36787 2 . GLU 71 71 36787 2 . SER 72 72 36787 2 . THR 73 73 36787 2 . LEU 74 74 36787 2 . HIS 75 75 36787 2 . LEU 76 76 36787 2 . VAL 77 77 36787 2 . LEU 78 78 36787 2 . ARG 79 79 36787 2 . LEU 80 80 36787 2 . ARG 81 81 36787 2 . GLY 82 82 36787 2 . GLY 83 83 36787 2 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 36787 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 10090 organism . 'Mus musculus' 'house mouse' . . . Metazoa Mus musculus . . . . . . . . . . . 'Hbs1l, Hbs1, Kiaa1038' . 36787 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' human . . . Metazoa Homo sapiens . . . . . . . . . . . AGOR_G00100470 . 36787 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 36787 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Cell-free gateway cloning vector N-term 8xHis pCellFree_G01' . . 1508209 . 'Cell-free gateway cloning vector N-term 8xHis pCellFree_G01' . . . . . . . . . . 36787 1 2 2 $entity_2 . 'recombinant technology' 'Cell-free gateway cloning vector N-term 8xHis pCellFree_G01' . . 1508209 . 'Cell-free gateway cloning vector N-term 8xHis pCellFree_G01' . . . . . . . . . . 36787 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 36787 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.0 mM [U-99% 13C; U-99% 15N] mouse HBS1L N-terminal domain, 1.0 mM [U-99% 13C; U-99% 15N] Ubiquitin, 20 mM non sodium phosphate, 100 mM non NaCL, 0.02 % non NaN3, 90% H2O/10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'mouse HBS1L N-terminal domain' '[U-99% 13C; U-99% 15N]' 1 $assembly 1 $entity_1 . protein 1.0 . . mM . . . . 36787 1 2 Ubiquitin '[U-99% 13C; U-99% 15N]' 1 $assembly 2 $entity_2 . protein 1.0 . . mM . . . . 36787 1 3 NaN3 'natural abundance' . . . . . cytocide 0.02 . . % . . . . 36787 1 4 NaCL 'natural abundance' . . . . . salt 100 . . mM . . . . 36787 1 5 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 36787 1 6 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 36787 1 7 D2O [U-2H] . . . . . solvent 10 . . % . . . . 36787 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 36787 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 120 . mM 36787 1 pH 6.0 . pH 36787 1 pressure 1 . atm 36787 1 temperature 298 . K 36787 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36787 _Software.ID 1 _Software.Type . _Software.Name Amber _Software.Version 24 _Software.DOI . _Software.Details 'simulated annealing' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 36787 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 36787 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36787 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version 2.1 _Software.DOI . _Software.Details 'Torsion angle dynamics' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 36787 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 36787 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 36787 _Software.ID 3 _Software.Type . _Software.Name KUJIRA _Software.Version 0.863 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'N. Kobayashi, T. Kigawa, S. Yokoyama' . . 36787 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 36787 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 36787 _Software.ID 4 _Software.Type . _Software.Name NMRView _Software.Version 5.0.4 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 36787 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 36787 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 36787 _Software.ID 5 _Software.Type . _Software.Name NMRPipe _Software.Version 2007 _Software.DOI . _Software.Details '3D data transformation' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 36787 5 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 36787 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 36787 _Software.ID 6 _Software.Type . _Software.Name TALOS _Software.Version 2007 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 36787 6 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'geometry optimization' . 36787 6 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 36787 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 36787 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list_1 _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list_1 _NMR_spectrometer_list.Entry_ID 36787 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . 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 NMR_spectrometer_1 Bruker AVANCE . 600 . . . 36787 1 2 NMR_spectrometer_2 Bruker AVANCE . 800 . . . 36787 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 36787 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 3D_13C,15N-SEPARATED_NOESY . . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36787 1 2 '3D CBCA(CO)NH,HNCACB' . . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36787 1 3 '3D HCCH-COSY,TOCSY' . . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36787 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 36787 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.821ppm at 298K) and then those of 15N and 13C were calculated based on their gyro-magnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.251449530 . . . . . 36787 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 36787 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 36787 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_HBS1-UBQ _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode HBS1-UBQ _Assigned_chem_shift_list.Entry_ID 36787 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '3D CBCA(CO)NH,HNCACB' 1 $sample_1 isotropic 36787 1 3 '3D HCCH-COSY,TOCSY' 1 $sample_1 isotropic 36787 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 $software_3 . . 36787 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 3 3 SER HA H 1 4.459 0.030 . 1 . . . . A 3 SER HA . 36787 1 2 . 1 . 1 3 3 SER HB2 H 1 3.857 0.030 . 1 . . . . A 3 SER HB2 . 36787 1 3 . 1 . 1 3 3 SER HB3 H 1 3.857 0.030 . 1 . . . . A 3 SER HB3 . 36787 1 4 . 1 . 1 3 3 SER C C 13 173.943 0.300 . 1 . . . . A 3 SER C . 36787 1 5 . 1 . 1 3 3 SER CA C 13 58.445 0.300 . 1 . . . . A 3 SER CA . 36787 1 6 . 1 . 1 3 3 SER CB C 13 63.921 0.300 . 1 . . . . A 3 SER CB . 36787 1 7 . 1 . 1 4 4 GLY H H 1 8.042 0.030 . 1 . . . . A 4 GLY H . 36787 1 8 . 1 . 1 4 4 GLY C C 13 173.916 0.300 . 1 . . . . A 4 GLY C . 36787 1 9 . 1 . 1 4 4 GLY CA C 13 46.233 0.300 . 1 . . . . A 4 GLY CA . 36787 1 10 . 1 . 1 4 4 GLY N N 15 116.858 0.300 . 1 . . . . A 4 GLY N . 36787 1 11 . 1 . 1 7 7 GLY HA2 H 1 3.891 0.030 . 1 . . . . A 7 GLY HA2 . 36787 1 12 . 1 . 1 7 7 GLY HA3 H 1 3.891 0.030 . 1 . . . . A 7 GLY HA3 . 36787 1 13 . 1 . 1 7 7 GLY C C 13 174.073 0.300 . 1 . . . . A 7 GLY C . 36787 1 14 . 1 . 1 7 7 GLY CA C 13 45.290 0.300 . 1 . . . . A 7 GLY CA . 36787 1 15 . 1 . 1 8 8 GLU H H 1 8.183 0.030 . 1 . . . . A 8 GLU H . 36787 1 16 . 1 . 1 8 8 GLU HA H 1 4.154 0.030 . 1 . . . . A 8 GLU HA . 36787 1 17 . 1 . 1 8 8 GLU HB2 H 1 1.829 0.030 . 1 . . . . A 8 GLU HB2 . 36787 1 18 . 1 . 1 8 8 GLU HB3 H 1 1.829 0.030 . 1 . . . . A 8 GLU HB3 . 36787 1 19 . 1 . 1 8 8 GLU HG2 H 1 2.093 0.030 . 1 . . . . A 8 GLU HG2 . 36787 1 20 . 1 . 1 8 8 GLU HG3 H 1 2.093 0.030 . 1 . . . . A 8 GLU HG3 . 36787 1 21 . 1 . 1 8 8 GLU C C 13 176.199 0.300 . 1 . . . . A 8 GLU C . 36787 1 22 . 1 . 1 8 8 GLU CA C 13 56.750 0.300 . 1 . . . . A 8 GLU CA . 36787 1 23 . 1 . 1 8 8 GLU CB C 13 30.188 0.300 . 1 . . . . A 8 GLU CB . 36787 1 24 . 1 . 1 8 8 GLU CG C 13 36.191 0.300 . 1 . . . . A 8 GLU CG . 36787 1 25 . 1 . 1 8 8 GLU N N 15 120.619 0.300 . 1 . . . . A 8 GLU N . 36787 1 26 . 1 . 1 9 9 TYR H H 1 8.257 0.030 . 1 . . . . A 9 TYR H . 36787 1 27 . 1 . 1 9 9 TYR HA H 1 4.518 0.030 . 1 . . . . A 9 TYR HA . 36787 1 28 . 1 . 1 9 9 TYR HB2 H 1 2.872 0.030 . 2 . . . . A 9 TYR HB2 . 36787 1 29 . 1 . 1 9 9 TYR HB3 H 1 3.042 0.030 . 2 . . . . A 9 TYR HB3 . 36787 1 30 . 1 . 1 9 9 TYR HD1 H 1 7.081 0.030 . 1 . . . . A 9 TYR HD1 . 36787 1 31 . 1 . 1 9 9 TYR HD2 H 1 7.081 0.030 . 1 . . . . A 9 TYR HD2 . 36787 1 32 . 1 . 1 9 9 TYR HE1 H 1 6.812 0.030 . 1 . . . . A 9 TYR HE1 . 36787 1 33 . 1 . 1 9 9 TYR HE2 H 1 6.812 0.030 . 1 . . . . A 9 TYR HE2 . 36787 1 34 . 1 . 1 9 9 TYR C C 13 176.215 0.300 . 1 . . . . A 9 TYR C . 36787 1 35 . 1 . 1 9 9 TYR CA C 13 58.230 0.300 . 1 . . . . A 9 TYR CA . 36787 1 36 . 1 . 1 9 9 TYR CB C 13 38.741 0.300 . 1 . . . . A 9 TYR CB . 36787 1 37 . 1 . 1 9 9 TYR CD1 C 13 133.205 0.300 . 1 . . . . A 9 TYR CD1 . 36787 1 38 . 1 . 1 9 9 TYR CD2 C 13 133.205 0.300 . 1 . . . . A 9 TYR CD2 . 36787 1 39 . 1 . 1 9 9 TYR CE1 C 13 118.257 0.300 . 1 . . . . A 9 TYR CE1 . 36787 1 40 . 1 . 1 9 9 TYR CE2 C 13 118.257 0.300 . 1 . . . . A 9 TYR CE2 . 36787 1 41 . 1 . 1 9 9 TYR N N 15 120.758 0.300 . 1 . . . . A 9 TYR N . 36787 1 42 . 1 . 1 10 10 GLY H H 1 8.297 0.030 . 1 . . . . A 10 GLY H . 36787 1 43 . 1 . 1 10 10 GLY HA2 H 1 3.854 0.030 . 1 . . . . A 10 GLY HA2 . 36787 1 44 . 1 . 1 10 10 GLY HA3 H 1 3.854 0.030 . 1 . . . . A 10 GLY HA3 . 36787 1 45 . 1 . 1 10 10 GLY C C 13 173.851 0.300 . 1 . . . . A 10 GLY C . 36787 1 46 . 1 . 1 10 10 GLY CA C 13 45.208 0.300 . 1 . . . . A 10 GLY CA . 36787 1 47 . 1 . 1 10 10 GLY N N 15 110.694 0.300 . 1 . . . . A 10 GLY N . 36787 1 48 . 1 . 1 11 11 TYR H H 1 7.903 0.030 . 1 . . . . A 11 TYR H . 36787 1 49 . 1 . 1 11 11 TYR HA H 1 4.518 0.030 . 1 . . . . A 11 TYR HA . 36787 1 50 . 1 . 1 11 11 TYR HB2 H 1 2.946 0.030 . 2 . . . . A 11 TYR HB2 . 36787 1 51 . 1 . 1 11 11 TYR HB3 H 1 3.042 0.030 . 2 . . . . A 11 TYR HB3 . 36787 1 52 . 1 . 1 11 11 TYR HD1 H 1 7.084 0.030 . 1 . . . . A 11 TYR HD1 . 36787 1 53 . 1 . 1 11 11 TYR HD2 H 1 7.084 0.030 . 1 . . . . A 11 TYR HD2 . 36787 1 54 . 1 . 1 11 11 TYR HE1 H 1 6.808 0.030 . 1 . . . . A 11 TYR HE1 . 36787 1 55 . 1 . 1 11 11 TYR HE2 H 1 6.808 0.030 . 1 . . . . A 11 TYR HE2 . 36787 1 56 . 1 . 1 11 11 TYR C C 13 175.964 0.300 . 1 . . . . A 11 TYR C . 36787 1 57 . 1 . 1 11 11 TYR CA C 13 58.196 0.300 . 1 . . . . A 11 TYR CA . 36787 1 58 . 1 . 1 11 11 TYR CB C 13 38.734 0.300 . 1 . . . . A 11 TYR CB . 36787 1 59 . 1 . 1 11 11 TYR CD1 C 13 133.205 0.300 . 1 . . . . A 11 TYR CD1 . 36787 1 60 . 1 . 1 11 11 TYR CD2 C 13 133.205 0.300 . 1 . . . . A 11 TYR CD2 . 36787 1 61 . 1 . 1 11 11 TYR CE1 C 13 118.140 0.300 . 1 . . . . A 11 TYR CE1 . 36787 1 62 . 1 . 1 11 11 TYR CE2 C 13 118.140 0.300 . 1 . . . . A 11 TYR CE2 . 36787 1 63 . 1 . 1 11 11 TYR N N 15 119.715 0.300 . 1 . . . . A 11 TYR N . 36787 1 64 . 1 . 1 12 12 GLU H H 1 8.435 0.030 . 1 . . . . A 12 GLU H . 36787 1 65 . 1 . 1 12 12 GLU HA H 1 4.171 0.030 . 1 . . . . A 12 GLU HA . 36787 1 66 . 1 . 1 12 12 GLU HB2 H 1 1.882 0.030 . 2 . . . . A 12 GLU HB2 . 36787 1 67 . 1 . 1 12 12 GLU HB3 H 1 1.975 0.030 . 2 . . . . A 12 GLU HB3 . 36787 1 68 . 1 . 1 12 12 GLU HG2 H 1 2.188 0.030 . 1 . . . . A 12 GLU HG2 . 36787 1 69 . 1 . 1 12 12 GLU HG3 H 1 2.188 0.030 . 1 . . . . A 12 GLU HG3 . 36787 1 70 . 1 . 1 12 12 GLU C C 13 175.902 0.300 . 1 . . . . A 12 GLU C . 36787 1 71 . 1 . 1 12 12 GLU CA C 13 56.807 0.300 . 1 . . . . A 12 GLU CA . 36787 1 72 . 1 . 1 12 12 GLU CB C 13 30.383 0.300 . 1 . . . . A 12 GLU CB . 36787 1 73 . 1 . 1 12 12 GLU CG C 13 33.889 0.300 . 1 . . . . A 12 GLU CG . 36787 1 74 . 1 . 1 12 12 GLU N N 15 122.267 0.300 . 1 . . . . A 12 GLU N . 36787 1 75 . 1 . 1 13 13 ASP H H 1 8.270 0.030 . 1 . . . . A 13 ASP H . 36787 1 76 . 1 . 1 13 13 ASP HA H 1 4.513 0.030 . 1 . . . . A 13 ASP HA . 36787 1 77 . 1 . 1 13 13 ASP HB2 H 1 2.679 0.030 . 2 . . . . A 13 ASP HB2 . 36787 1 78 . 1 . 1 13 13 ASP HB3 H 1 2.564 0.030 . 2 . . . . A 13 ASP HB3 . 36787 1 79 . 1 . 1 13 13 ASP C C 13 176.314 0.300 . 1 . . . . A 13 ASP C . 36787 1 80 . 1 . 1 13 13 ASP CA C 13 54.120 0.300 . 1 . . . . A 13 ASP CA . 36787 1 81 . 1 . 1 13 13 ASP CB C 13 41.043 0.300 . 1 . . . . A 13 ASP CB . 36787 1 82 . 1 . 1 13 13 ASP N N 15 121.128 0.300 . 1 . . . . A 13 ASP N . 36787 1 83 . 1 . 1 14 14 LEU H H 1 8.163 0.030 . 1 . . . . A 14 LEU H . 36787 1 84 . 1 . 1 14 14 LEU HA H 1 4.301 0.030 . 1 . . . . A 14 LEU HA . 36787 1 85 . 1 . 1 14 14 LEU HB2 H 1 1.621 0.030 . 1 . . . . A 14 LEU HB2 . 36787 1 86 . 1 . 1 14 14 LEU HB3 H 1 1.621 0.030 . 1 . . . . A 14 LEU HB3 . 36787 1 87 . 1 . 1 14 14 LEU HD11 H 1 0.833 0.030 . 2 . . . . A 14 LEU HD11 . 36787 1 88 . 1 . 1 14 14 LEU HD12 H 1 0.833 0.030 . 2 . . . . A 14 LEU HD12 . 36787 1 89 . 1 . 1 14 14 LEU HD13 H 1 0.833 0.030 . 2 . . . . A 14 LEU HD13 . 36787 1 90 . 1 . 1 14 14 LEU HD21 H 1 0.833 0.030 . 2 . . . . A 14 LEU HD21 . 36787 1 91 . 1 . 1 14 14 LEU HD22 H 1 0.833 0.030 . 2 . . . . A 14 LEU HD22 . 36787 1 92 . 1 . 1 14 14 LEU HD23 H 1 0.833 0.030 . 2 . . . . A 14 LEU HD23 . 36787 1 93 . 1 . 1 14 14 LEU HG H 1 1.598 0.030 . 1 . . . . A 14 LEU HG . 36787 1 94 . 1 . 1 14 14 LEU C C 13 177.646 0.300 . 1 . . . . A 14 LEU C . 36787 1 95 . 1 . 1 14 14 LEU CA C 13 55.380 0.300 . 1 . . . . A 14 LEU CA . 36787 1 96 . 1 . 1 14 14 LEU CB C 13 41.818 0.300 . 1 . . . . A 14 LEU CB . 36787 1 97 . 1 . 1 14 14 LEU CD1 C 13 25.090 0.300 . 2 . . . . A 14 LEU CD1 . 36787 1 98 . 1 . 1 14 14 LEU CD2 C 13 23.363 0.300 . 2 . . . . A 14 LEU CD2 . 36787 1 99 . 1 . 1 14 14 LEU CG C 13 26.899 0.300 . 1 . . . . A 14 LEU CG . 36787 1 100 . 1 . 1 14 14 LEU N N 15 123.013 0.300 . 1 . . . . A 14 LEU N . 36787 1 101 . 1 . 1 15 15 ARG H H 1 8.218 0.030 . 1 . . . . A 15 ARG H . 36787 1 102 . 1 . 1 15 15 ARG HA H 1 4.200 0.030 . 1 . . . . A 15 ARG HA . 36787 1 103 . 1 . 1 15 15 ARG HB2 H 1 1.777 0.030 . 1 . . . . A 15 ARG HB2 . 36787 1 104 . 1 . 1 15 15 ARG HB3 H 1 1.777 0.030 . 1 . . . . A 15 ARG HB3 . 36787 1 105 . 1 . 1 15 15 ARG HD2 H 1 3.117 0.030 . 1 . . . . A 15 ARG HD2 . 36787 1 106 . 1 . 1 15 15 ARG HD3 H 1 3.117 0.030 . 1 . . . . A 15 ARG HD3 . 36787 1 107 . 1 . 1 15 15 ARG HG2 H 1 1.581 0.030 . 1 . . . . A 15 ARG HG2 . 36787 1 108 . 1 . 1 15 15 ARG HG3 H 1 1.581 0.030 . 1 . . . . A 15 ARG HG3 . 36787 1 109 . 1 . 1 15 15 ARG C C 13 176.729 0.300 . 1 . . . . A 15 ARG C . 36787 1 110 . 1 . 1 15 15 ARG CA C 13 56.728 0.300 . 1 . . . . A 15 ARG CA . 36787 1 111 . 1 . 1 15 15 ARG CB C 13 30.492 0.300 . 1 . . . . A 15 ARG CB . 36787 1 112 . 1 . 1 15 15 ARG CD C 13 43.346 0.300 . 1 . . . . A 15 ARG CD . 36787 1 113 . 1 . 1 15 15 ARG CG C 13 26.899 0.300 . 1 . . . . A 15 ARG CG . 36787 1 114 . 1 . 1 15 15 ARG N N 15 121.161 0.300 . 1 . . . . A 15 ARG N . 36787 1 115 . 1 . 1 16 16 GLU H H 1 8.355 0.030 . 1 . . . . A 16 GLU H . 36787 1 116 . 1 . 1 16 16 GLU HA H 1 4.249 0.030 . 1 . . . . A 16 GLU HA . 36787 1 117 . 1 . 1 16 16 GLU HB2 H 1 1.983 0.030 . 1 . . . . A 16 GLU HB2 . 36787 1 118 . 1 . 1 16 16 GLU HB3 H 1 1.983 0.030 . 1 . . . . A 16 GLU HB3 . 36787 1 119 . 1 . 1 16 16 GLU HG2 H 1 2.236 0.030 . 1 . . . . A 16 GLU HG2 . 36787 1 120 . 1 . 1 16 16 GLU HG3 H 1 2.236 0.030 . 1 . . . . A 16 GLU HG3 . 36787 1 121 . 1 . 1 16 16 GLU C C 13 176.754 0.300 . 1 . . . . A 16 GLU C . 36787 1 122 . 1 . 1 16 16 GLU CA C 13 56.964 0.300 . 1 . . . . A 16 GLU CA . 36787 1 123 . 1 . 1 16 16 GLU CB C 13 30.032 0.300 . 1 . . . . A 16 GLU CB . 36787 1 124 . 1 . 1 16 16 GLU CG C 13 36.274 0.300 . 1 . . . . A 16 GLU CG . 36787 1 125 . 1 . 1 16 16 GLU N N 15 121.071 0.300 . 1 . . . . A 16 GLU N . 36787 1 126 . 1 . 1 17 17 SER H H 1 8.295 0.030 . 1 . . . . A 17 SER H . 36787 1 127 . 1 . 1 17 17 SER HA H 1 4.452 0.030 . 1 . . . . A 17 SER HA . 36787 1 128 . 1 . 1 17 17 SER HB2 H 1 3.876 0.030 . 1 . . . . A 17 SER HB2 . 36787 1 129 . 1 . 1 17 17 SER HB3 H 1 3.876 0.030 . 1 . . . . A 17 SER HB3 . 36787 1 130 . 1 . 1 17 17 SER C C 13 174.771 0.300 . 1 . . . . A 17 SER C . 36787 1 131 . 1 . 1 17 17 SER CA C 13 58.559 0.300 . 1 . . . . A 17 SER CA . 36787 1 132 . 1 . 1 17 17 SER CB C 13 63.740 0.300 . 1 . . . . A 17 SER CB . 36787 1 133 . 1 . 1 17 17 SER N N 15 116.408 0.300 . 1 . . . . A 17 SER N . 36787 1 134 . 1 . 1 18 18 SER H H 1 8.348 0.030 . 1 . . . . A 18 SER H . 36787 1 135 . 1 . 1 18 18 SER HA H 1 4.372 0.030 . 1 . . . . A 18 SER HA . 36787 1 136 . 1 . 1 18 18 SER HB2 H 1 3.862 0.030 . 1 . . . . A 18 SER HB2 . 36787 1 137 . 1 . 1 18 18 SER HB3 H 1 3.862 0.030 . 1 . . . . A 18 SER HB3 . 36787 1 138 . 1 . 1 18 18 SER C C 13 174.909 0.300 . 1 . . . . A 18 SER C . 36787 1 139 . 1 . 1 18 18 SER CA C 13 59.084 0.300 . 1 . . . . A 18 SER CA . 36787 1 140 . 1 . 1 18 18 SER CB C 13 63.631 0.300 . 1 . . . . A 18 SER CB . 36787 1 141 . 1 . 1 18 18 SER N N 15 117.953 0.300 . 1 . . . . A 18 SER N . 36787 1 142 . 1 . 1 19 19 ASN H H 1 8.229 0.030 . 1 . . . . A 19 ASN H . 36787 1 143 . 1 . 1 19 19 ASN HA H 1 4.679 0.030 . 1 . . . . A 19 ASN HA . 36787 1 144 . 1 . 1 19 19 ASN HB2 H 1 2.778 0.030 . 2 . . . . A 19 ASN HB2 . 36787 1 145 . 1 . 1 19 19 ASN HB3 H 1 2.851 0.030 . 2 . . . . A 19 ASN HB3 . 36787 1 146 . 1 . 1 19 19 ASN HD21 H 1 7.613 0.030 . 2 . . . . A 19 ASN HD21 . 36787 1 147 . 1 . 1 19 19 ASN HD22 H 1 6.901 0.030 . 2 . . . . A 19 ASN HD22 . 36787 1 148 . 1 . 1 19 19 ASN C C 13 175.475 0.300 . 1 . . . . A 19 ASN C . 36787 1 149 . 1 . 1 19 19 ASN CA C 13 53.543 0.300 . 1 . . . . A 19 ASN CA . 36787 1 150 . 1 . 1 19 19 ASN CB C 13 38.823 0.300 . 1 . . . . A 19 ASN CB . 36787 1 151 . 1 . 1 19 19 ASN N N 15 123.300 0.300 . 1 . . . . A 19 ASN N . 36787 1 152 . 1 . 1 19 19 ASN ND2 N 15 112.676 0.300 . 1 . . . . A 19 ASN ND2 . 36787 1 153 . 1 . 1 20 20 SER H H 1 8.244 0.030 . 1 . . . . A 20 SER H . 36787 1 154 . 1 . 1 20 20 SER C C 13 174.880 0.300 . 1 . . . . A 20 SER C . 36787 1 155 . 1 . 1 20 20 SER CA C 13 59.052 0.300 . 1 . . . . A 20 SER CA . 36787 1 156 . 1 . 1 20 20 SER CB C 13 63.575 0.300 . 1 . . . . A 20 SER CB . 36787 1 157 . 1 . 1 20 20 SER N N 15 116.454 0.300 . 1 . . . . A 20 SER N . 36787 1 158 . 1 . 1 21 21 LEU HA H 1 4.240 0.030 . 1 . . . . A 21 LEU HA . 36787 1 159 . 1 . 1 21 21 LEU HB2 H 1 1.576 0.030 . 1 . . . . A 21 LEU HB2 . 36787 1 160 . 1 . 1 21 21 LEU HB3 H 1 1.576 0.030 . 1 . . . . A 21 LEU HB3 . 36787 1 161 . 1 . 1 21 21 LEU HD11 H 1 0.817 0.030 . 2 . . . . A 21 LEU HD11 . 36787 1 162 . 1 . 1 21 21 LEU HD12 H 1 0.817 0.030 . 2 . . . . A 21 LEU HD12 . 36787 1 163 . 1 . 1 21 21 LEU HD13 H 1 0.817 0.030 . 2 . . . . A 21 LEU HD13 . 36787 1 164 . 1 . 1 21 21 LEU HD21 H 1 0.817 0.030 . 2 . . . . A 21 LEU HD21 . 36787 1 165 . 1 . 1 21 21 LEU HD22 H 1 0.817 0.030 . 2 . . . . A 21 LEU HD22 . 36787 1 166 . 1 . 1 21 21 LEU HD23 H 1 0.817 0.030 . 2 . . . . A 21 LEU HD23 . 36787 1 167 . 1 . 1 21 21 LEU HG H 1 1.581 0.030 . 1 . . . . A 21 LEU HG . 36787 1 168 . 1 . 1 21 21 LEU C C 13 177.496 0.300 . 1 . . . . A 21 LEU C . 36787 1 169 . 1 . 1 21 21 LEU CA C 13 55.516 0.300 . 1 . . . . A 21 LEU CA . 36787 1 170 . 1 . 1 21 21 LEU CB C 13 42.030 0.300 . 1 . . . . A 21 LEU CB . 36787 1 171 . 1 . 1 21 21 LEU CD1 C 13 25.172 0.300 . 2 . . . . A 21 LEU CD1 . 36787 1 172 . 1 . 1 21 21 LEU CD2 C 13 23.445 0.300 . 2 . . . . A 21 LEU CD2 . 36787 1 173 . 1 . 1 21 21 LEU CG C 13 26.981 0.300 . 1 . . . . A 21 LEU CG . 36787 1 174 . 1 . 1 22 22 LEU H H 1 7.939 0.030 . 1 . . . . A 22 LEU H . 36787 1 175 . 1 . 1 22 22 LEU HA H 1 4.183 0.030 . 1 . . . . A 22 LEU HA . 36787 1 176 . 1 . 1 22 22 LEU HB2 H 1 1.512 0.030 . 1 . . . . A 22 LEU HB2 . 36787 1 177 . 1 . 1 22 22 LEU HB3 H 1 1.512 0.030 . 1 . . . . A 22 LEU HB3 . 36787 1 178 . 1 . 1 22 22 LEU HD11 H 1 0.842 0.030 . 2 . . . . A 22 LEU HD11 . 36787 1 179 . 1 . 1 22 22 LEU HD12 H 1 0.842 0.030 . 2 . . . . A 22 LEU HD12 . 36787 1 180 . 1 . 1 22 22 LEU HD13 H 1 0.842 0.030 . 2 . . . . A 22 LEU HD13 . 36787 1 181 . 1 . 1 22 22 LEU HD21 H 1 0.842 0.030 . 2 . . . . A 22 LEU HD21 . 36787 1 182 . 1 . 1 22 22 LEU HD22 H 1 0.842 0.030 . 2 . . . . A 22 LEU HD22 . 36787 1 183 . 1 . 1 22 22 LEU HD23 H 1 0.842 0.030 . 2 . . . . A 22 LEU HD23 . 36787 1 184 . 1 . 1 22 22 LEU HG H 1 1.514 0.030 . 1 . . . . A 22 LEU HG . 36787 1 185 . 1 . 1 22 22 LEU C C 13 177.337 0.300 . 1 . . . . A 22 LEU C . 36787 1 186 . 1 . 1 22 22 LEU CA C 13 55.360 0.300 . 1 . . . . A 22 LEU CA . 36787 1 187 . 1 . 1 22 22 LEU CB C 13 41.955 0.300 . 1 . . . . A 22 LEU CB . 36787 1 188 . 1 . 1 22 22 LEU CD1 C 13 25.008 0.300 . 2 . . . . A 22 LEU CD1 . 36787 1 189 . 1 . 1 22 22 LEU CD2 C 13 23.445 0.300 . 2 . . . . A 22 LEU CD2 . 36787 1 190 . 1 . 1 22 22 LEU CG C 13 26.981 0.300 . 1 . . . . A 22 LEU CG . 36787 1 191 . 1 . 1 22 22 LEU N N 15 120.319 0.300 . 1 . . . . A 22 LEU N . 36787 1 192 . 1 . 1 23 23 ASN H H 1 8.185 0.030 . 1 . . . . A 23 ASN H . 36787 1 193 . 1 . 1 23 23 ASN HA H 1 4.565 0.030 . 1 . . . . A 23 ASN HA . 36787 1 194 . 1 . 1 23 23 ASN HB2 H 1 2.700 0.030 . 2 . . . . A 23 ASN HB2 . 36787 1 195 . 1 . 1 23 23 ASN HB3 H 1 2.766 0.030 . 2 . . . . A 23 ASN HB3 . 36787 1 196 . 1 . 1 23 23 ASN C C 13 174.978 0.300 . 1 . . . . A 23 ASN C . 36787 1 197 . 1 . 1 23 23 ASN CA C 13 53.661 0.300 . 1 . . . . A 23 ASN CA . 36787 1 198 . 1 . 1 23 23 ASN CB C 13 38.502 0.300 . 1 . . . . A 23 ASN CB . 36787 1 199 . 1 . 1 23 23 ASN N N 15 117.737 0.300 . 1 . . . . A 23 ASN N . 36787 1 200 . 1 . 1 24 24 HIS H H 1 7.947 0.030 . 1 . . . . A 24 HIS H . 36787 1 201 . 1 . 1 24 24 HIS HA H 1 4.554 0.030 . 1 . . . . A 24 HIS HA . 36787 1 202 . 1 . 1 24 24 HIS HB2 H 1 3.058 0.030 . 2 . . . . A 24 HIS HB2 . 36787 1 203 . 1 . 1 24 24 HIS HB3 H 1 3.132 0.030 . 2 . . . . A 24 HIS HB3 . 36787 1 204 . 1 . 1 24 24 HIS HD2 H 1 7.020 0.030 . 1 . . . . A 24 HIS HD2 . 36787 1 205 . 1 . 1 24 24 HIS C C 13 177.338 0.300 . 1 . . . . A 24 HIS C . 36787 1 206 . 1 . 1 24 24 HIS CA C 13 56.330 0.300 . 1 . . . . A 24 HIS CA . 36787 1 207 . 1 . 1 24 24 HIS CB C 13 30.549 0.300 . 1 . . . . A 24 HIS CB . 36787 1 208 . 1 . 1 24 24 HIS CD2 C 13 119.995 0.300 . 1 . . . . A 24 HIS CD2 . 36787 1 209 . 1 . 1 24 24 HIS N N 15 118.022 0.300 . 1 . . . . A 24 HIS N . 36787 1 210 . 1 . 1 25 25 GLN H H 1 8.258 0.030 . 1 . . . . A 25 GLN H . 36787 1 211 . 1 . 1 25 25 GLN HA H 1 4.270 0.030 . 1 . . . . A 25 GLN HA . 36787 1 212 . 1 . 1 25 25 GLN HB2 H 1 1.976 0.030 . 1 . . . . A 25 GLN HB2 . 36787 1 213 . 1 . 1 25 25 GLN HB3 H 1 1.976 0.030 . 1 . . . . A 25 GLN HB3 . 36787 1 214 . 1 . 1 25 25 GLN HG2 H 1 2.236 0.030 . 1 . . . . A 25 GLN HG2 . 36787 1 215 . 1 . 1 25 25 GLN HG3 H 1 2.236 0.030 . 1 . . . . A 25 GLN HG3 . 36787 1 216 . 1 . 1 25 25 GLN C C 13 175.624 0.300 . 1 . . . . A 25 GLN C . 36787 1 217 . 1 . 1 25 25 GLN CA C 13 55.521 0.300 . 1 . . . . A 25 GLN CA . 36787 1 218 . 1 . 1 25 25 GLN CB C 13 28.950 0.300 . 1 . . . . A 25 GLN CB . 36787 1 219 . 1 . 1 25 25 GLN CG C 13 33.807 0.300 . 1 . . . . A 25 GLN CG . 36787 1 220 . 1 . 1 25 25 GLN N N 15 121.000 0.300 . 1 . . . . A 25 GLN N . 36787 1 221 . 1 . 1 26 26 LEU H H 1 8.285 0.030 . 1 . . . . A 26 LEU H . 36787 1 222 . 1 . 1 26 26 LEU HA H 1 4.626 0.030 . 1 . . . . A 26 LEU HA . 36787 1 223 . 1 . 1 26 26 LEU HB2 H 1 1.731 0.030 . 2 . . . . A 26 LEU HB2 . 36787 1 224 . 1 . 1 26 26 LEU HB3 H 1 1.545 0.030 . 2 . . . . A 26 LEU HB3 . 36787 1 225 . 1 . 1 26 26 LEU HD11 H 1 0.881 0.030 . 2 . . . . A 26 LEU HD11 . 36787 1 226 . 1 . 1 26 26 LEU HD12 H 1 0.881 0.030 . 2 . . . . A 26 LEU HD12 . 36787 1 227 . 1 . 1 26 26 LEU HD13 H 1 0.881 0.030 . 2 . . . . A 26 LEU HD13 . 36787 1 228 . 1 . 1 26 26 LEU HD21 H 1 0.945 0.030 . 2 . . . . A 26 LEU HD21 . 36787 1 229 . 1 . 1 26 26 LEU HD22 H 1 0.945 0.030 . 2 . . . . A 26 LEU HD22 . 36787 1 230 . 1 . 1 26 26 LEU HD23 H 1 0.945 0.030 . 2 . . . . A 26 LEU HD23 . 36787 1 231 . 1 . 1 26 26 LEU HG H 1 1.753 0.030 . 1 . . . . A 26 LEU HG . 36787 1 232 . 1 . 1 26 26 LEU C C 13 177.992 0.300 . 1 . . . . A 26 LEU C . 36787 1 233 . 1 . 1 26 26 LEU CA C 13 54.382 0.300 . 1 . . . . A 26 LEU CA . 36787 1 234 . 1 . 1 26 26 LEU CB C 13 43.721 0.300 . 1 . . . . A 26 LEU CB . 36787 1 235 . 1 . 1 26 26 LEU CD1 C 13 26.363 0.300 . 2 . . . . A 26 LEU CD1 . 36787 1 236 . 1 . 1 26 26 LEU CD2 C 13 23.470 0.300 . 2 . . . . A 26 LEU CD2 . 36787 1 237 . 1 . 1 26 26 LEU CG C 13 27.015 0.300 . 1 . . . . A 26 LEU CG . 36787 1 238 . 1 . 1 26 26 LEU N N 15 123.272 0.300 . 1 . . . . A 26 LEU N . 36787 1 239 . 1 . 1 27 27 SER H H 1 9.238 0.030 . 1 . . . . A 27 SER H . 36787 1 240 . 1 . 1 27 27 SER HA H 1 4.436 0.030 . 1 . . . . A 27 SER HA . 36787 1 241 . 1 . 1 27 27 SER HB2 H 1 4.302 0.030 . 2 . . . . A 27 SER HB2 . 36787 1 242 . 1 . 1 27 27 SER HB3 H 1 4.094 0.030 . 2 . . . . A 27 SER HB3 . 36787 1 243 . 1 . 1 27 27 SER C C 13 174.248 0.300 . 1 . . . . A 27 SER C . 36787 1 244 . 1 . 1 27 27 SER CA C 13 57.414 0.300 . 1 . . . . A 27 SER CA . 36787 1 245 . 1 . 1 27 27 SER CB C 13 64.656 0.300 . 1 . . . . A 27 SER CB . 36787 1 246 . 1 . 1 27 27 SER N N 15 119.150 0.300 . 1 . . . . A 27 SER N . 36787 1 247 . 1 . 1 28 28 GLU H H 1 8.977 0.030 . 1 . . . . A 28 GLU H . 36787 1 248 . 1 . 1 28 28 GLU HA H 1 3.984 0.030 . 1 . . . . A 28 GLU HA . 36787 1 249 . 1 . 1 28 28 GLU HB2 H 1 2.059 0.030 . 1 . . . . A 28 GLU HB2 . 36787 1 250 . 1 . 1 28 28 GLU HB3 H 1 2.059 0.030 . 1 . . . . A 28 GLU HB3 . 36787 1 251 . 1 . 1 28 28 GLU HG2 H 1 2.302 0.030 . 2 . . . . A 28 GLU HG2 . 36787 1 252 . 1 . 1 28 28 GLU HG3 H 1 2.395 0.030 . 2 . . . . A 28 GLU HG3 . 36787 1 253 . 1 . 1 28 28 GLU C C 13 179.468 0.300 . 1 . . . . A 28 GLU C . 36787 1 254 . 1 . 1 28 28 GLU CA C 13 60.354 0.300 . 1 . . . . A 28 GLU CA . 36787 1 255 . 1 . 1 28 28 GLU CB C 13 29.370 0.300 . 1 . . . . A 28 GLU CB . 36787 1 256 . 1 . 1 28 28 GLU CG C 13 36.808 0.300 . 1 . . . . A 28 GLU CG . 36787 1 257 . 1 . 1 28 28 GLU N N 15 121.307 0.300 . 1 . . . . A 28 GLU N . 36787 1 258 . 1 . 1 29 29 ILE H H 1 7.959 0.030 . 1 . . . . A 29 ILE H . 36787 1 259 . 1 . 1 29 29 ILE HA H 1 3.896 0.030 . 1 . . . . A 29 ILE HA . 36787 1 260 . 1 . 1 29 29 ILE HB H 1 1.706 0.030 . 1 . . . . A 29 ILE HB . 36787 1 261 . 1 . 1 29 29 ILE HD11 H 1 0.838 0.030 . 1 . . . . A 29 ILE HD11 . 36787 1 262 . 1 . 1 29 29 ILE HD12 H 1 0.838 0.030 . 1 . . . . A 29 ILE HD12 . 36787 1 263 . 1 . 1 29 29 ILE HD13 H 1 0.838 0.030 . 1 . . . . A 29 ILE HD13 . 36787 1 264 . 1 . 1 29 29 ILE HG12 H 1 1.193 0.030 . 2 . . . . A 29 ILE HG12 . 36787 1 265 . 1 . 1 29 29 ILE HG13 H 1 1.531 0.030 . 2 . . . . A 29 ILE HG13 . 36787 1 266 . 1 . 1 29 29 ILE HG21 H 1 0.832 0.030 . 1 . . . . A 29 ILE HG21 . 36787 1 267 . 1 . 1 29 29 ILE HG22 H 1 0.832 0.030 . 1 . . . . A 29 ILE HG22 . 36787 1 268 . 1 . 1 29 29 ILE HG23 H 1 0.832 0.030 . 1 . . . . A 29 ILE HG23 . 36787 1 269 . 1 . 1 29 29 ILE C C 13 177.670 0.300 . 1 . . . . A 29 ILE C . 36787 1 270 . 1 . 1 29 29 ILE CA C 13 63.692 0.300 . 1 . . . . A 29 ILE CA . 36787 1 271 . 1 . 1 29 29 ILE CB C 13 38.161 0.300 . 1 . . . . A 29 ILE CB . 36787 1 272 . 1 . 1 29 29 ILE CD1 C 13 12.840 0.300 . 1 . . . . A 29 ILE CD1 . 36787 1 273 . 1 . 1 29 29 ILE CG1 C 13 28.869 0.300 . 1 . . . . A 29 ILE CG1 . 36787 1 274 . 1 . 1 29 29 ILE CG2 C 13 17.113 0.300 . 1 . . . . A 29 ILE CG2 . 36787 1 275 . 1 . 1 29 29 ILE N N 15 118.834 0.300 . 1 . . . . A 29 ILE N . 36787 1 276 . 1 . 1 30 30 ASP H H 1 7.639 0.030 . 1 . . . . A 30 ASP H . 36787 1 277 . 1 . 1 30 30 ASP HA H 1 4.210 0.030 . 1 . . . . A 30 ASP HA . 36787 1 278 . 1 . 1 30 30 ASP HB2 H 1 2.582 0.030 . 2 . . . . A 30 ASP HB2 . 36787 1 279 . 1 . 1 30 30 ASP HB3 H 1 2.776 0.030 . 2 . . . . A 30 ASP HB3 . 36787 1 280 . 1 . 1 30 30 ASP C C 13 177.959 0.300 . 1 . . . . A 30 ASP C . 36787 1 281 . 1 . 1 30 30 ASP CA C 13 57.131 0.300 . 1 . . . . A 30 ASP CA . 36787 1 282 . 1 . 1 30 30 ASP CB C 13 40.259 0.300 . 1 . . . . A 30 ASP CB . 36787 1 283 . 1 . 1 30 30 ASP N N 15 123.350 0.300 . 1 . . . . A 30 ASP N . 36787 1 284 . 1 . 1 31 31 GLN H H 1 8.822 0.030 . 1 . . . . A 31 GLN H . 36787 1 285 . 1 . 1 31 31 GLN HA H 1 3.751 0.030 . 1 . . . . A 31 GLN HA . 36787 1 286 . 1 . 1 31 31 GLN HB2 H 1 2.087 0.030 . 1 . . . . A 31 GLN HB2 . 36787 1 287 . 1 . 1 31 31 GLN HB3 H 1 2.087 0.030 . 1 . . . . A 31 GLN HB3 . 36787 1 288 . 1 . 1 31 31 GLN HE21 H 1 6.769 0.030 . 2 . . . . A 31 GLN HE21 . 36787 1 289 . 1 . 1 31 31 GLN HE22 H 1 6.904 0.030 . 2 . . . . A 31 GLN HE22 . 36787 1 290 . 1 . 1 31 31 GLN HG2 H 1 2.238 0.030 . 1 . . . . A 31 GLN HG2 . 36787 1 291 . 1 . 1 31 31 GLN HG3 H 1 2.238 0.030 . 1 . . . . A 31 GLN HG3 . 36787 1 292 . 1 . 1 31 31 GLN C C 13 177.218 0.300 . 1 . . . . A 31 GLN C . 36787 1 293 . 1 . 1 31 31 GLN CA C 13 59.226 0.300 . 1 . . . . A 31 GLN CA . 36787 1 294 . 1 . 1 31 31 GLN CB C 13 28.726 0.300 . 1 . . . . A 31 GLN CB . 36787 1 295 . 1 . 1 31 31 GLN CG C 13 34.533 0.300 . 1 . . . . A 31 GLN CG . 36787 1 296 . 1 . 1 31 31 GLN N N 15 121.929 0.300 . 1 . . . . A 31 GLN N . 36787 1 297 . 1 . 1 31 31 GLN NE2 N 15 111.828 0.300 . 1 . . . . A 31 GLN NE2 . 36787 1 298 . 1 . 1 32 32 ALA H H 1 7.570 0.030 . 1 . . . . A 32 ALA H . 36787 1 299 . 1 . 1 32 32 ALA HA H 1 4.177 0.030 . 1 . . . . A 32 ALA HA . 36787 1 300 . 1 . 1 32 32 ALA HB1 H 1 1.502 0.030 . 1 . . . . A 32 ALA HB1 . 36787 1 301 . 1 . 1 32 32 ALA HB2 H 1 1.502 0.030 . 1 . . . . A 32 ALA HB2 . 36787 1 302 . 1 . 1 32 32 ALA HB3 H 1 1.502 0.030 . 1 . . . . A 32 ALA HB3 . 36787 1 303 . 1 . 1 32 32 ALA C C 13 175.860 0.300 . 1 . . . . A 32 ALA C . 36787 1 304 . 1 . 1 32 32 ALA CA C 13 55.174 0.300 . 1 . . . . A 32 ALA CA . 36787 1 305 . 1 . 1 32 32 ALA CB C 13 17.860 0.300 . 1 . . . . A 32 ALA CB . 36787 1 306 . 1 . 1 32 32 ALA N N 15 120.286 0.300 . 1 . . . . A 32 ALA N . 36787 1 307 . 1 . 1 33 33 ARG H H 1 7.871 0.030 . 1 . . . . A 33 ARG H . 36787 1 308 . 1 . 1 33 33 ARG HA H 1 3.929 0.030 . 1 . . . . A 33 ARG HA . 36787 1 309 . 1 . 1 33 33 ARG HB2 H 1 1.290 0.030 . 1 . . . . A 33 ARG HB2 . 36787 1 310 . 1 . 1 33 33 ARG HB3 H 1 1.290 0.030 . 1 . . . . A 33 ARG HB3 . 36787 1 311 . 1 . 1 33 33 ARG HD2 H 1 2.535 0.030 . 2 . . . . A 33 ARG HD2 . 36787 1 312 . 1 . 1 33 33 ARG HD3 H 1 2.756 0.030 . 2 . . . . A 33 ARG HD3 . 36787 1 313 . 1 . 1 33 33 ARG HG2 H 1 1.228 0.030 . 2 . . . . A 33 ARG HG2 . 36787 1 314 . 1 . 1 33 33 ARG HG3 H 1 1.721 0.030 . 2 . . . . A 33 ARG HG3 . 36787 1 315 . 1 . 1 33 33 ARG C C 13 178.775 0.300 . 1 . . . . A 33 ARG C . 36787 1 316 . 1 . 1 33 33 ARG CA C 13 59.628 0.300 . 1 . . . . A 33 ARG CA . 36787 1 317 . 1 . 1 33 33 ARG CB C 13 30.145 0.300 . 1 . . . . A 33 ARG CB . 36787 1 318 . 1 . 1 33 33 ARG CD C 13 43.927 0.300 . 1 . . . . A 33 ARG CD . 36787 1 319 . 1 . 1 33 33 ARG CG C 13 27.084 0.300 . 1 . . . . A 33 ARG CG . 36787 1 320 . 1 . 1 33 33 ARG N N 15 119.517 0.300 . 1 . . . . A 33 ARG N . 36787 1 321 . 1 . 1 34 34 LEU H H 1 8.557 0.030 . 1 . . . . A 34 LEU H . 36787 1 322 . 1 . 1 34 34 LEU HA H 1 4.062 0.030 . 1 . . . . A 34 LEU HA . 36787 1 323 . 1 . 1 34 34 LEU HB2 H 1 2.175 0.030 . 2 . . . . A 34 LEU HB2 . 36787 1 324 . 1 . 1 34 34 LEU HB3 H 1 1.585 0.030 . 2 . . . . A 34 LEU HB3 . 36787 1 325 . 1 . 1 34 34 LEU HD11 H 1 0.836 0.030 . 2 . . . . A 34 LEU HD11 . 36787 1 326 . 1 . 1 34 34 LEU HD12 H 1 0.836 0.030 . 2 . . . . A 34 LEU HD12 . 36787 1 327 . 1 . 1 34 34 LEU HD13 H 1 0.836 0.030 . 2 . . . . A 34 LEU HD13 . 36787 1 328 . 1 . 1 34 34 LEU HD21 H 1 0.947 0.030 . 2 . . . . A 34 LEU HD21 . 36787 1 329 . 1 . 1 34 34 LEU HD22 H 1 0.947 0.030 . 2 . . . . A 34 LEU HD22 . 36787 1 330 . 1 . 1 34 34 LEU HD23 H 1 0.947 0.030 . 2 . . . . A 34 LEU HD23 . 36787 1 331 . 1 . 1 34 34 LEU HG H 1 1.406 0.030 . 1 . . . . A 34 LEU HG . 36787 1 332 . 1 . 1 34 34 LEU C C 13 178.146 0.300 . 1 . . . . A 34 LEU C . 36787 1 333 . 1 . 1 34 34 LEU CA C 13 59.321 0.300 . 1 . . . . A 34 LEU CA . 36787 1 334 . 1 . 1 34 34 LEU CB C 13 41.427 0.300 . 1 . . . . A 34 LEU CB . 36787 1 335 . 1 . 1 34 34 LEU CD1 C 13 26.063 0.300 . 2 . . . . A 34 LEU CD1 . 36787 1 336 . 1 . 1 34 34 LEU CD2 C 13 24.091 0.300 . 2 . . . . A 34 LEU CD2 . 36787 1 337 . 1 . 1 34 34 LEU CG C 13 27.446 0.300 . 1 . . . . A 34 LEU CG . 36787 1 338 . 1 . 1 34 34 LEU N N 15 122.611 0.300 . 1 . . . . A 34 LEU N . 36787 1 339 . 1 . 1 35 35 TYR H H 1 8.209 0.030 . 1 . . . . A 35 TYR H . 36787 1 340 . 1 . 1 35 35 TYR HA H 1 4.342 0.030 . 1 . . . . A 35 TYR HA . 36787 1 341 . 1 . 1 35 35 TYR HB2 H 1 3.266 0.030 . 2 . . . . A 35 TYR HB2 . 36787 1 342 . 1 . 1 35 35 TYR HB3 H 1 2.986 0.030 . 2 . . . . A 35 TYR HB3 . 36787 1 343 . 1 . 1 35 35 TYR HD1 H 1 7.163 0.030 . 1 . . . . A 35 TYR HD1 . 36787 1 344 . 1 . 1 35 35 TYR HD2 H 1 7.163 0.030 . 1 . . . . A 35 TYR HD2 . 36787 1 345 . 1 . 1 35 35 TYR HE1 H 1 6.810 0.030 . 1 . . . . A 35 TYR HE1 . 36787 1 346 . 1 . 1 35 35 TYR HE2 H 1 6.810 0.030 . 1 . . . . A 35 TYR HE2 . 36787 1 347 . 1 . 1 35 35 TYR C C 13 178.525 0.300 . 1 . . . . A 35 TYR C . 36787 1 348 . 1 . 1 35 35 TYR CA C 13 60.865 0.300 . 1 . . . . A 35 TYR CA . 36787 1 349 . 1 . 1 35 35 TYR CB C 13 36.920 0.300 . 1 . . . . A 35 TYR CB . 36787 1 350 . 1 . 1 35 35 TYR CD1 C 13 132.475 0.300 . 1 . . . . A 35 TYR CD1 . 36787 1 351 . 1 . 1 35 35 TYR CD2 C 13 132.475 0.300 . 1 . . . . A 35 TYR CD2 . 36787 1 352 . 1 . 1 35 35 TYR CE1 C 13 118.050 0.300 . 1 . . . . A 35 TYR CE1 . 36787 1 353 . 1 . 1 35 35 TYR CE2 C 13 118.050 0.300 . 1 . . . . A 35 TYR CE2 . 36787 1 354 . 1 . 1 35 35 TYR N N 15 117.435 0.300 . 1 . . . . A 35 TYR N . 36787 1 355 . 1 . 1 36 36 SER H H 1 8.143 0.030 . 1 . . . . A 36 SER H . 36787 1 356 . 1 . 1 36 36 SER HA H 1 4.365 0.030 . 1 . . . . A 36 SER HA . 36787 1 357 . 1 . 1 36 36 SER HB2 H 1 4.054 0.030 . 2 . . . . A 36 SER HB2 . 36787 1 358 . 1 . 1 36 36 SER HB3 H 1 4.078 0.030 . 2 . . . . A 36 SER HB3 . 36787 1 359 . 1 . 1 36 36 SER C C 13 178.016 0.300 . 1 . . . . A 36 SER C . 36787 1 360 . 1 . 1 36 36 SER CA C 13 61.684 0.300 . 1 . . . . A 36 SER CA . 36787 1 361 . 1 . 1 36 36 SER CB C 13 62.951 0.300 . 1 . . . . A 36 SER CB . 36787 1 362 . 1 . 1 36 36 SER N N 15 114.825 0.300 . 1 . . . . A 36 SER N . 36787 1 363 . 1 . 1 37 37 CYS H H 1 8.445 0.030 . 1 . . . . A 37 CYS H . 36787 1 364 . 1 . 1 37 37 CYS HA H 1 4.211 0.030 . 1 . . . . A 37 CYS HA . 36787 1 365 . 1 . 1 37 37 CYS HB2 H 1 3.409 0.030 . 2 . . . . A 37 CYS HB2 . 36787 1 366 . 1 . 1 37 37 CYS HB3 H 1 2.540 0.030 . 2 . . . . A 37 CYS HB3 . 36787 1 367 . 1 . 1 37 37 CYS C C 13 176.888 0.300 . 1 . . . . A 37 CYS C . 36787 1 368 . 1 . 1 37 37 CYS CA C 13 64.548 0.300 . 1 . . . . A 37 CYS CA . 36787 1 369 . 1 . 1 37 37 CYS CB C 13 28.133 0.300 . 1 . . . . A 37 CYS CB . 36787 1 370 . 1 . 1 37 37 CYS N N 15 120.479 0.300 . 1 . . . . A 37 CYS N . 36787 1 371 . 1 . 1 38 38 LEU H H 1 8.835 0.030 . 1 . . . . A 38 LEU H . 36787 1 372 . 1 . 1 38 38 LEU HA H 1 3.856 0.030 . 1 . . . . A 38 LEU HA . 36787 1 373 . 1 . 1 38 38 LEU HB2 H 1 1.582 0.030 . 2 . . . . A 38 LEU HB2 . 36787 1 374 . 1 . 1 38 38 LEU HB3 H 1 1.847 0.030 . 2 . . . . A 38 LEU HB3 . 36787 1 375 . 1 . 1 38 38 LEU HD11 H 1 0.822 0.030 . 2 . . . . A 38 LEU HD11 . 36787 1 376 . 1 . 1 38 38 LEU HD12 H 1 0.822 0.030 . 2 . . . . A 38 LEU HD12 . 36787 1 377 . 1 . 1 38 38 LEU HD13 H 1 0.822 0.030 . 2 . . . . A 38 LEU HD13 . 36787 1 378 . 1 . 1 38 38 LEU HD21 H 1 0.791 0.030 . 2 . . . . A 38 LEU HD21 . 36787 1 379 . 1 . 1 38 38 LEU HD22 H 1 0.791 0.030 . 2 . . . . A 38 LEU HD22 . 36787 1 380 . 1 . 1 38 38 LEU HD23 H 1 0.791 0.030 . 2 . . . . A 38 LEU HD23 . 36787 1 381 . 1 . 1 38 38 LEU HG H 1 1.616 0.030 . 1 . . . . A 38 LEU HG . 36787 1 382 . 1 . 1 38 38 LEU C C 13 178.360 0.300 . 1 . . . . A 38 LEU C . 36787 1 383 . 1 . 1 38 38 LEU CA C 13 58.881 0.300 . 1 . . . . A 38 LEU CA . 36787 1 384 . 1 . 1 38 38 LEU CB C 13 42.028 0.300 . 1 . . . . A 38 LEU CB . 36787 1 385 . 1 . 1 38 38 LEU CD1 C 13 24.927 0.300 . 2 . . . . A 38 LEU CD1 . 36787 1 386 . 1 . 1 38 38 LEU CD2 C 13 25.008 0.300 . 2 . . . . A 38 LEU CD2 . 36787 1 387 . 1 . 1 38 38 LEU CG C 13 27.270 0.300 . 1 . . . . A 38 LEU CG . 36787 1 388 . 1 . 1 38 38 LEU N N 15 122.367 0.300 . 1 . . . . A 38 LEU N . 36787 1 389 . 1 . 1 39 39 ASP H H 1 8.069 0.030 . 1 . . . . A 39 ASP H . 36787 1 390 . 1 . 1 39 39 ASP HA H 1 4.377 0.030 . 1 . . . . A 39 ASP HA . 36787 1 391 . 1 . 1 39 39 ASP HB2 H 1 2.716 0.030 . 2 . . . . A 39 ASP HB2 . 36787 1 392 . 1 . 1 39 39 ASP HB3 H 1 2.819 0.030 . 2 . . . . A 39 ASP HB3 . 36787 1 393 . 1 . 1 39 39 ASP C C 13 179.183 0.300 . 1 . . . . A 39 ASP C . 36787 1 394 . 1 . 1 39 39 ASP CA C 13 57.767 0.300 . 1 . . . . A 39 ASP CA . 36787 1 395 . 1 . 1 39 39 ASP CB C 13 40.374 0.300 . 1 . . . . A 39 ASP CB . 36787 1 396 . 1 . 1 39 39 ASP N N 15 118.661 0.300 . 1 . . . . A 39 ASP N . 36787 1 397 . 1 . 1 40 40 HIS H H 1 7.716 0.030 . 1 . . . . A 40 HIS H . 36787 1 398 . 1 . 1 40 40 HIS HA H 1 4.495 0.030 . 1 . . . . A 40 HIS HA . 36787 1 399 . 1 . 1 40 40 HIS HB2 H 1 3.300 0.030 . 1 . . . . A 40 HIS HB2 . 36787 1 400 . 1 . 1 40 40 HIS HB3 H 1 3.300 0.030 . 1 . . . . A 40 HIS HB3 . 36787 1 401 . 1 . 1 40 40 HIS HD2 H 1 6.910 0.030 . 1 . . . . A 40 HIS HD2 . 36787 1 402 . 1 . 1 40 40 HIS C C 13 178.052 0.300 . 1 . . . . A 40 HIS C . 36787 1 403 . 1 . 1 40 40 HIS CA C 13 58.920 0.300 . 1 . . . . A 40 HIS CA . 36787 1 404 . 1 . 1 40 40 HIS CB C 13 30.488 0.300 . 1 . . . . A 40 HIS CB . 36787 1 405 . 1 . 1 40 40 HIS CD2 C 13 120.109 0.300 . 1 . . . . A 40 HIS CD2 . 36787 1 406 . 1 . 1 40 40 HIS N N 15 118.600 0.300 . 1 . . . . A 40 HIS N . 36787 1 407 . 1 . 1 41 41 MET H H 1 8.554 0.030 . 1 . . . . A 41 MET H . 36787 1 408 . 1 . 1 41 41 MET HA H 1 3.858 0.030 . 1 . . . . A 41 MET HA . 36787 1 409 . 1 . 1 41 41 MET HB2 H 1 2.059 0.030 . 2 . . . . A 41 MET HB2 . 36787 1 410 . 1 . 1 41 41 MET HB3 H 1 2.221 0.030 . 2 . . . . A 41 MET HB3 . 36787 1 411 . 1 . 1 41 41 MET HE1 H 1 1.863 0.030 . 1 . . . . A 41 MET HE1 . 36787 1 412 . 1 . 1 41 41 MET HE2 H 1 1.863 0.030 . 1 . . . . A 41 MET HE2 . 36787 1 413 . 1 . 1 41 41 MET HE3 H 1 1.863 0.030 . 1 . . . . A 41 MET HE3 . 36787 1 414 . 1 . 1 41 41 MET HG2 H 1 2.212 0.030 . 1 . . . . A 41 MET HG2 . 36787 1 415 . 1 . 1 41 41 MET HG3 H 1 2.212 0.030 . 1 . . . . A 41 MET HG3 . 36787 1 416 . 1 . 1 41 41 MET C C 13 178.230 0.300 . 1 . . . . A 41 MET C . 36787 1 417 . 1 . 1 41 41 MET CA C 13 60.571 0.300 . 1 . . . . A 41 MET CA . 36787 1 418 . 1 . 1 41 41 MET CB C 13 34.053 0.300 . 1 . . . . A 41 MET CB . 36787 1 419 . 1 . 1 41 41 MET CE C 13 17.750 0.300 . 1 . . . . A 41 MET CE . 36787 1 420 . 1 . 1 41 41 MET CG C 13 33.724 0.300 . 1 . . . . A 41 MET CG . 36787 1 421 . 1 . 1 41 41 MET N N 15 116.696 0.300 . 1 . . . . A 41 MET N . 36787 1 422 . 1 . 1 42 42 ARG H H 1 8.741 0.030 . 1 . . . . A 42 ARG H . 36787 1 423 . 1 . 1 42 42 ARG HA H 1 4.068 0.030 . 1 . . . . A 42 ARG HA . 36787 1 424 . 1 . 1 42 42 ARG HB2 H 1 1.826 0.030 . 2 . . . . A 42 ARG HB2 . 36787 1 425 . 1 . 1 42 42 ARG HB3 H 1 1.965 0.030 . 2 . . . . A 42 ARG HB3 . 36787 1 426 . 1 . 1 42 42 ARG HD2 H 1 3.117 0.030 . 2 . . . . A 42 ARG HD2 . 36787 1 427 . 1 . 1 42 42 ARG HD3 H 1 3.273 0.030 . 2 . . . . A 42 ARG HD3 . 36787 1 428 . 1 . 1 42 42 ARG HG2 H 1 1.646 0.030 . 2 . . . . A 42 ARG HG2 . 36787 1 429 . 1 . 1 42 42 ARG HG3 H 1 1.839 0.030 . 2 . . . . A 42 ARG HG3 . 36787 1 430 . 1 . 1 42 42 ARG C C 13 179.413 0.300 . 1 . . . . A 42 ARG C . 36787 1 431 . 1 . 1 42 42 ARG CA C 13 59.298 0.300 . 1 . . . . A 42 ARG CA . 36787 1 432 . 1 . 1 42 42 ARG CB C 13 29.859 0.300 . 1 . . . . A 42 ARG CB . 36787 1 433 . 1 . 1 42 42 ARG CD C 13 43.144 0.300 . 1 . . . . A 42 ARG CD . 36787 1 434 . 1 . 1 42 42 ARG CG C 13 28.133 0.300 . 1 . . . . A 42 ARG CG . 36787 1 435 . 1 . 1 42 42 ARG N N 15 118.295 0.300 . 1 . . . . A 42 ARG N . 36787 1 436 . 1 . 1 43 43 GLU H H 1 7.691 0.030 . 1 . . . . A 43 GLU H . 36787 1 437 . 1 . 1 43 43 GLU HA H 1 3.990 0.030 . 1 . . . . A 43 GLU HA . 36787 1 438 . 1 . 1 43 43 GLU HB2 H 1 2.178 0.030 . 2 . . . . A 43 GLU HB2 . 36787 1 439 . 1 . 1 43 43 GLU HB3 H 1 2.232 0.030 . 2 . . . . A 43 GLU HB3 . 36787 1 440 . 1 . 1 43 43 GLU HG2 H 1 2.236 0.030 . 2 . . . . A 43 GLU HG2 . 36787 1 441 . 1 . 1 43 43 GLU HG3 H 1 2.437 0.030 . 2 . . . . A 43 GLU HG3 . 36787 1 442 . 1 . 1 43 43 GLU C C 13 177.664 0.300 . 1 . . . . A 43 GLU C . 36787 1 443 . 1 . 1 43 43 GLU CA C 13 59.441 0.300 . 1 . . . . A 43 GLU CA . 36787 1 444 . 1 . 1 43 43 GLU CB C 13 29.301 0.300 . 1 . . . . A 43 GLU CB . 36787 1 445 . 1 . 1 43 43 GLU CG C 13 36.327 0.300 . 1 . . . . A 43 GLU CG . 36787 1 446 . 1 . 1 43 43 GLU N N 15 120.869 0.300 . 1 . . . . A 43 GLU N . 36787 1 447 . 1 . 1 44 44 VAL H H 1 7.097 0.030 . 1 . . . . A 44 VAL H . 36787 1 448 . 1 . 1 44 44 VAL HA H 1 3.846 0.030 . 1 . . . . A 44 VAL HA . 36787 1 449 . 1 . 1 44 44 VAL HB H 1 1.933 0.030 . 1 . . . . A 44 VAL HB . 36787 1 450 . 1 . 1 44 44 VAL HG11 H 1 0.791 0.030 . 2 . . . . A 44 VAL HG11 . 36787 1 451 . 1 . 1 44 44 VAL HG12 H 1 0.791 0.030 . 2 . . . . A 44 VAL HG12 . 36787 1 452 . 1 . 1 44 44 VAL HG13 H 1 0.791 0.030 . 2 . . . . A 44 VAL HG13 . 36787 1 453 . 1 . 1 44 44 VAL HG21 H 1 0.797 0.030 . 2 . . . . A 44 VAL HG21 . 36787 1 454 . 1 . 1 44 44 VAL HG22 H 1 0.797 0.030 . 2 . . . . A 44 VAL HG22 . 36787 1 455 . 1 . 1 44 44 VAL HG23 H 1 0.797 0.030 . 2 . . . . A 44 VAL HG23 . 36787 1 456 . 1 . 1 44 44 VAL C C 13 177.266 0.300 . 1 . . . . A 44 VAL C . 36787 1 457 . 1 . 1 44 44 VAL CA C 13 64.398 0.300 . 1 . . . . A 44 VAL CA . 36787 1 458 . 1 . 1 44 44 VAL CB C 13 32.844 0.300 . 1 . . . . A 44 VAL CB . 36787 1 459 . 1 . 1 44 44 VAL CG1 C 13 21.472 0.300 . 2 . . . . A 44 VAL CG1 . 36787 1 460 . 1 . 1 44 44 VAL CG2 C 13 21.594 0.300 . 2 . . . . A 44 VAL CG2 . 36787 1 461 . 1 . 1 44 44 VAL N N 15 115.743 0.300 . 1 . . . . A 44 VAL N . 36787 1 462 . 1 . 1 45 45 LEU H H 1 8.360 0.030 . 1 . . . . A 45 LEU H . 36787 1 463 . 1 . 1 45 45 LEU HA H 1 4.243 0.030 . 1 . . . . A 45 LEU HA . 36787 1 464 . 1 . 1 45 45 LEU HB2 H 1 1.512 0.030 . 2 . . . . A 45 LEU HB2 . 36787 1 465 . 1 . 1 45 45 LEU HB3 H 1 1.801 0.030 . 2 . . . . A 45 LEU HB3 . 36787 1 466 . 1 . 1 45 45 LEU HD11 H 1 0.791 0.030 . 2 . . . . A 45 LEU HD11 . 36787 1 467 . 1 . 1 45 45 LEU HD12 H 1 0.791 0.030 . 2 . . . . A 45 LEU HD12 . 36787 1 468 . 1 . 1 45 45 LEU HD13 H 1 0.791 0.030 . 2 . . . . A 45 LEU HD13 . 36787 1 469 . 1 . 1 45 45 LEU HD21 H 1 0.780 0.030 . 2 . . . . A 45 LEU HD21 . 36787 1 470 . 1 . 1 45 45 LEU HD22 H 1 0.780 0.030 . 2 . . . . A 45 LEU HD22 . 36787 1 471 . 1 . 1 45 45 LEU HD23 H 1 0.780 0.030 . 2 . . . . A 45 LEU HD23 . 36787 1 472 . 1 . 1 45 45 LEU HG H 1 1.639 0.030 . 1 . . . . A 45 LEU HG . 36787 1 473 . 1 . 1 45 45 LEU C C 13 174.795 0.300 . 1 . . . . A 45 LEU C . 36787 1 474 . 1 . 1 45 45 LEU CA C 13 55.368 0.300 . 1 . . . . A 45 LEU CA . 36787 1 475 . 1 . 1 45 45 LEU CB C 13 43.675 0.300 . 1 . . . . A 45 LEU CB . 36787 1 476 . 1 . 1 45 45 LEU CD1 C 13 27.274 0.300 . 2 . . . . A 45 LEU CD1 . 36787 1 477 . 1 . 1 45 45 LEU CD2 C 13 22.748 0.300 . 2 . . . . A 45 LEU CD2 . 36787 1 478 . 1 . 1 45 45 LEU CG C 13 27.146 0.300 . 1 . . . . A 45 LEU CG . 36787 1 479 . 1 . 1 45 45 LEU N N 15 115.972 0.300 . 1 . . . . A 45 LEU N . 36787 1 480 . 1 . 1 46 46 GLY H H 1 8.311 0.030 . 1 . . . . A 46 GLY H . 36787 1 481 . 1 . 1 46 46 GLY HA2 H 1 4.052 0.030 . 2 . . . . A 46 GLY HA2 . 36787 1 482 . 1 . 1 46 46 GLY HA3 H 1 3.887 0.030 . 2 . . . . A 46 GLY HA3 . 36787 1 483 . 1 . 1 46 46 GLY C C 13 171.755 0.300 . 1 . . . . A 46 GLY C . 36787 1 484 . 1 . 1 46 46 GLY CA C 13 45.336 0.300 . 1 . . . . A 46 GLY CA . 36787 1 485 . 1 . 1 46 46 GLY N N 15 110.387 0.300 . 1 . . . . A 46 GLY N . 36787 1 486 . 1 . 1 47 47 ASP H H 1 8.318 0.030 . 1 . . . . A 47 ASP H . 36787 1 487 . 1 . 1 47 47 ASP HA H 1 4.635 0.030 . 1 . . . . A 47 ASP HA . 36787 1 488 . 1 . 1 47 47 ASP HB2 H 1 2.661 0.030 . 2 . . . . A 47 ASP HB2 . 36787 1 489 . 1 . 1 47 47 ASP HB3 H 1 2.726 0.030 . 2 . . . . A 47 ASP HB3 . 36787 1 490 . 1 . 1 47 47 ASP C C 13 176.937 0.300 . 1 . . . . A 47 ASP C . 36787 1 491 . 1 . 1 47 47 ASP CA C 13 53.941 0.300 . 1 . . . . A 47 ASP CA . 36787 1 492 . 1 . 1 47 47 ASP CB C 13 40.894 0.300 . 1 . . . . A 47 ASP CB . 36787 1 493 . 1 . 1 47 47 ASP N N 15 121.510 0.300 . 1 . . . . A 47 ASP N . 36787 1 494 . 1 . 1 48 48 ALA H H 1 7.713 0.030 . 1 . . . . A 48 ALA H . 36787 1 495 . 1 . 1 48 48 ALA HA H 1 4.110 0.030 . 1 . . . . A 48 ALA HA . 36787 1 496 . 1 . 1 48 48 ALA HB1 H 1 1.496 0.030 . 1 . . . . A 48 ALA HB1 . 36787 1 497 . 1 . 1 48 48 ALA HB2 H 1 1.496 0.030 . 1 . . . . A 48 ALA HB2 . 36787 1 498 . 1 . 1 48 48 ALA HB3 H 1 1.496 0.030 . 1 . . . . A 48 ALA HB3 . 36787 1 499 . 1 . 1 48 48 ALA C C 13 177.928 0.300 . 1 . . . . A 48 ALA C . 36787 1 500 . 1 . 1 48 48 ALA CA C 13 54.833 0.300 . 1 . . . . A 48 ALA CA . 36787 1 501 . 1 . 1 48 48 ALA CB C 13 19.990 0.300 . 1 . . . . A 48 ALA CB . 36787 1 502 . 1 . 1 48 48 ALA N N 15 121.058 0.300 . 1 . . . . A 48 ALA N . 36787 1 503 . 1 . 1 49 49 VAL H H 1 8.085 0.030 . 1 . . . . A 49 VAL H . 36787 1 504 . 1 . 1 49 49 VAL HA H 1 4.538 0.030 . 1 . . . . A 49 VAL HA . 36787 1 505 . 1 . 1 49 49 VAL HB H 1 1.901 0.030 . 1 . . . . A 49 VAL HB . 36787 1 506 . 1 . 1 49 49 VAL HG11 H 1 1.020 0.030 . 2 . . . . A 49 VAL HG11 . 36787 1 507 . 1 . 1 49 49 VAL HG12 H 1 1.020 0.030 . 2 . . . . A 49 VAL HG12 . 36787 1 508 . 1 . 1 49 49 VAL HG13 H 1 1.020 0.030 . 2 . . . . A 49 VAL HG13 . 36787 1 509 . 1 . 1 49 49 VAL HG21 H 1 0.873 0.030 . 2 . . . . A 49 VAL HG21 . 36787 1 510 . 1 . 1 49 49 VAL HG22 H 1 0.873 0.030 . 2 . . . . A 49 VAL HG22 . 36787 1 511 . 1 . 1 49 49 VAL HG23 H 1 0.873 0.030 . 2 . . . . A 49 VAL HG23 . 36787 1 512 . 1 . 1 49 49 VAL C C 13 173.914 0.300 . 1 . . . . A 49 VAL C . 36787 1 513 . 1 . 1 49 49 VAL CA C 13 59.106 0.300 . 1 . . . . A 49 VAL CA . 36787 1 514 . 1 . 1 49 49 VAL CB C 13 33.929 0.300 . 1 . . . . A 49 VAL CB . 36787 1 515 . 1 . 1 49 49 VAL CG1 C 13 21.205 0.300 . 2 . . . . A 49 VAL CG1 . 36787 1 516 . 1 . 1 49 49 VAL CG2 C 13 21.184 0.300 . 2 . . . . A 49 VAL CG2 . 36787 1 517 . 1 . 1 49 49 VAL N N 15 118.072 0.300 . 1 . . . . A 49 VAL N . 36787 1 518 . 1 . 1 50 50 PRO HA H 1 4.486 0.030 . 1 . . . . A 50 PRO HA . 36787 1 519 . 1 . 1 50 50 PRO HB2 H 1 2.482 0.030 . 2 . . . . A 50 PRO HB2 . 36787 1 520 . 1 . 1 50 50 PRO HB3 H 1 2.165 0.030 . 2 . . . . A 50 PRO HB3 . 36787 1 521 . 1 . 1 50 50 PRO HD2 H 1 3.674 0.030 . 2 . . . . A 50 PRO HD2 . 36787 1 522 . 1 . 1 50 50 PRO HD3 H 1 3.982 0.030 . 2 . . . . A 50 PRO HD3 . 36787 1 523 . 1 . 1 50 50 PRO HG2 H 1 2.076 0.030 . 2 . . . . A 50 PRO HG2 . 36787 1 524 . 1 . 1 50 50 PRO HG3 H 1 2.104 0.030 . 2 . . . . A 50 PRO HG3 . 36787 1 525 . 1 . 1 50 50 PRO C C 13 177.122 0.300 . 1 . . . . A 50 PRO C . 36787 1 526 . 1 . 1 50 50 PRO CA C 13 63.224 0.300 . 1 . . . . A 50 PRO CA . 36787 1 527 . 1 . 1 50 50 PRO CB C 13 33.335 0.300 . 1 . . . . A 50 PRO CB . 36787 1 528 . 1 . 1 50 50 PRO CD C 13 51.810 0.300 . 1 . . . . A 50 PRO CD . 36787 1 529 . 1 . 1 50 50 PRO CG C 13 27.721 0.300 . 1 . . . . A 50 PRO CG . 36787 1 530 . 1 . 1 51 51 ASP H H 1 8.862 0.030 . 1 . . . . A 51 ASP H . 36787 1 531 . 1 . 1 51 51 ASP HA H 1 4.244 0.030 . 1 . . . . A 51 ASP HA . 36787 1 532 . 1 . 1 51 51 ASP HB2 H 1 2.597 0.030 . 2 . . . . A 51 ASP HB2 . 36787 1 533 . 1 . 1 51 51 ASP HB3 H 1 2.684 0.030 . 2 . . . . A 51 ASP HB3 . 36787 1 534 . 1 . 1 51 51 ASP C C 13 178.754 0.300 . 1 . . . . A 51 ASP C . 36787 1 535 . 1 . 1 51 51 ASP CA C 13 57.720 0.300 . 1 . . . . A 51 ASP CA . 36787 1 536 . 1 . 1 51 51 ASP CB C 13 40.680 0.300 . 1 . . . . A 51 ASP CB . 36787 1 537 . 1 . 1 51 51 ASP N N 15 121.152 0.300 . 1 . . . . A 51 ASP N . 36787 1 538 . 1 . 1 52 52 ASP H H 1 9.078 0.030 . 1 . . . . A 52 ASP H . 36787 1 539 . 1 . 1 52 52 ASP HA H 1 4.314 0.030 . 1 . . . . A 52 ASP HA . 36787 1 540 . 1 . 1 52 52 ASP HB2 H 1 2.602 0.030 . 2 . . . . A 52 ASP HB2 . 36787 1 541 . 1 . 1 52 52 ASP HB3 H 1 2.738 0.030 . 2 . . . . A 52 ASP HB3 . 36787 1 542 . 1 . 1 52 52 ASP C C 13 178.382 0.300 . 1 . . . . A 52 ASP C . 36787 1 543 . 1 . 1 52 52 ASP CA C 13 57.408 0.300 . 1 . . . . A 52 ASP CA . 36787 1 544 . 1 . 1 52 52 ASP CB C 13 39.022 0.300 . 1 . . . . A 52 ASP CB . 36787 1 545 . 1 . 1 52 52 ASP N N 15 119.466 0.300 . 1 . . . . A 52 ASP N . 36787 1 546 . 1 . 1 53 53 ILE H H 1 7.212 0.030 . 1 . . . . A 53 ILE H . 36787 1 547 . 1 . 1 53 53 ILE HA H 1 3.833 0.030 . 1 . . . . A 53 ILE HA . 36787 1 548 . 1 . 1 53 53 ILE HB H 1 1.942 0.030 . 1 . . . . A 53 ILE HB . 36787 1 549 . 1 . 1 53 53 ILE HD11 H 1 0.849 0.030 . 1 . . . . A 53 ILE HD11 . 36787 1 550 . 1 . 1 53 53 ILE HD12 H 1 0.849 0.030 . 1 . . . . A 53 ILE HD12 . 36787 1 551 . 1 . 1 53 53 ILE HD13 H 1 0.849 0.030 . 1 . . . . A 53 ILE HD13 . 36787 1 552 . 1 . 1 53 53 ILE HG12 H 1 1.307 0.030 . 2 . . . . A 53 ILE HG12 . 36787 1 553 . 1 . 1 53 53 ILE HG13 H 1 1.590 0.030 . 2 . . . . A 53 ILE HG13 . 36787 1 554 . 1 . 1 53 53 ILE HG21 H 1 0.860 0.030 . 1 . . . . A 53 ILE HG21 . 36787 1 555 . 1 . 1 53 53 ILE HG22 H 1 0.860 0.030 . 1 . . . . A 53 ILE HG22 . 36787 1 556 . 1 . 1 53 53 ILE HG23 H 1 0.860 0.030 . 1 . . . . A 53 ILE HG23 . 36787 1 557 . 1 . 1 53 53 ILE C C 13 179.063 0.300 . 1 . . . . A 53 ILE C . 36787 1 558 . 1 . 1 53 53 ILE CA C 13 63.254 0.300 . 1 . . . . A 53 ILE CA . 36787 1 559 . 1 . 1 53 53 ILE CB C 13 37.327 0.300 . 1 . . . . A 53 ILE CB . 36787 1 560 . 1 . 1 53 53 ILE CD1 C 13 11.395 0.300 . 1 . . . . A 53 ILE CD1 . 36787 1 561 . 1 . 1 53 53 ILE CG1 C 13 28.103 0.300 . 1 . . . . A 53 ILE CG1 . 36787 1 562 . 1 . 1 53 53 ILE CG2 C 13 17.162 0.300 . 1 . . . . A 53 ILE CG2 . 36787 1 563 . 1 . 1 53 53 ILE N N 15 122.316 0.300 . 1 . . . . A 53 ILE N . 36787 1 564 . 1 . 1 54 54 LEU H H 1 7.511 0.030 . 1 . . . . A 54 LEU H . 36787 1 565 . 1 . 1 54 54 LEU HA H 1 3.783 0.030 . 1 . . . . A 54 LEU HA . 36787 1 566 . 1 . 1 54 54 LEU HB2 H 1 1.958 0.030 . 2 . . . . A 54 LEU HB2 . 36787 1 567 . 1 . 1 54 54 LEU HB3 H 1 1.403 0.030 . 2 . . . . A 54 LEU HB3 . 36787 1 568 . 1 . 1 54 54 LEU HD11 H 1 0.903 0.030 . 2 . . . . A 54 LEU HD11 . 36787 1 569 . 1 . 1 54 54 LEU HD12 H 1 0.903 0.030 . 2 . . . . A 54 LEU HD12 . 36787 1 570 . 1 . 1 54 54 LEU HD13 H 1 0.903 0.030 . 2 . . . . A 54 LEU HD13 . 36787 1 571 . 1 . 1 54 54 LEU HD21 H 1 0.760 0.030 . 2 . . . . A 54 LEU HD21 . 36787 1 572 . 1 . 1 54 54 LEU HD22 H 1 0.760 0.030 . 2 . . . . A 54 LEU HD22 . 36787 1 573 . 1 . 1 54 54 LEU HD23 H 1 0.760 0.030 . 2 . . . . A 54 LEU HD23 . 36787 1 574 . 1 . 1 54 54 LEU HG H 1 1.782 0.030 . 1 . . . . A 54 LEU HG . 36787 1 575 . 1 . 1 54 54 LEU C C 13 178.292 0.300 . 1 . . . . A 54 LEU C . 36787 1 576 . 1 . 1 54 54 LEU CA C 13 58.341 0.300 . 1 . . . . A 54 LEU CA . 36787 1 577 . 1 . 1 54 54 LEU CB C 13 41.849 0.300 . 1 . . . . A 54 LEU CB . 36787 1 578 . 1 . 1 54 54 LEU CD1 C 13 25.452 0.300 . 2 . . . . A 54 LEU CD1 . 36787 1 579 . 1 . 1 54 54 LEU CD2 C 13 23.465 0.300 . 2 . . . . A 54 LEU CD2 . 36787 1 580 . 1 . 1 54 54 LEU CG C 13 26.069 0.300 . 1 . . . . A 54 LEU CG . 36787 1 581 . 1 . 1 54 54 LEU N N 15 118.581 0.300 . 1 . . . . A 54 LEU N . 36787 1 582 . 1 . 1 55 55 THR H H 1 8.657 0.030 . 1 . . . . A 55 THR H . 36787 1 583 . 1 . 1 55 55 THR HA H 1 3.607 0.030 . 1 . . . . A 55 THR HA . 36787 1 584 . 1 . 1 55 55 THR HB H 1 4.227 0.030 . 1 . . . . A 55 THR HB . 36787 1 585 . 1 . 1 55 55 THR HG21 H 1 1.172 0.030 . 1 . . . . A 55 THR HG21 . 36787 1 586 . 1 . 1 55 55 THR HG22 H 1 1.172 0.030 . 1 . . . . A 55 THR HG22 . 36787 1 587 . 1 . 1 55 55 THR HG23 H 1 1.172 0.030 . 1 . . . . A 55 THR HG23 . 36787 1 588 . 1 . 1 55 55 THR C C 13 175.222 0.300 . 1 . . . . A 55 THR C . 36787 1 589 . 1 . 1 55 55 THR CA C 13 67.539 0.300 . 1 . . . . A 55 THR CA . 36787 1 590 . 1 . 1 55 55 THR CB C 13 68.876 0.300 . 1 . . . . A 55 THR CB . 36787 1 591 . 1 . 1 55 55 THR CG2 C 13 21.408 0.300 . 1 . . . . A 55 THR CG2 . 36787 1 592 . 1 . 1 55 55 THR N N 15 113.976 0.300 . 1 . . . . A 55 THR N . 36787 1 593 . 1 . 1 56 56 GLU H H 1 7.484 0.030 . 1 . . . . A 56 GLU H . 36787 1 594 . 1 . 1 56 56 GLU HA H 1 3.869 0.030 . 1 . . . . A 56 GLU HA . 36787 1 595 . 1 . 1 56 56 GLU HB2 H 1 2.066 0.030 . 1 . . . . A 56 GLU HB2 . 36787 1 596 . 1 . 1 56 56 GLU HB3 H 1 2.066 0.030 . 1 . . . . A 56 GLU HB3 . 36787 1 597 . 1 . 1 56 56 GLU HG2 H 1 2.232 0.030 . 2 . . . . A 56 GLU HG2 . 36787 1 598 . 1 . 1 56 56 GLU HG3 H 1 2.344 0.030 . 2 . . . . A 56 GLU HG3 . 36787 1 599 . 1 . 1 56 56 GLU C C 13 178.304 0.300 . 1 . . . . A 56 GLU C . 36787 1 600 . 1 . 1 56 56 GLU CA C 13 59.727 0.300 . 1 . . . . A 56 GLU CA . 36787 1 601 . 1 . 1 56 56 GLU CB C 13 29.219 0.300 . 1 . . . . A 56 GLU CB . 36787 1 602 . 1 . 1 56 56 GLU CG C 13 36.109 0.300 . 1 . . . . A 56 GLU CG . 36787 1 603 . 1 . 1 56 56 GLU N N 15 119.673 0.300 . 1 . . . . A 56 GLU N . 36787 1 604 . 1 . 1 57 57 ALA H H 1 7.421 0.030 . 1 . . . . A 57 ALA H . 36787 1 605 . 1 . 1 57 57 ALA HA H 1 4.144 0.030 . 1 . . . . A 57 ALA HA . 36787 1 606 . 1 . 1 57 57 ALA HB1 H 1 1.463 0.030 . 1 . . . . A 57 ALA HB1 . 36787 1 607 . 1 . 1 57 57 ALA HB2 H 1 1.463 0.030 . 1 . . . . A 57 ALA HB2 . 36787 1 608 . 1 . 1 57 57 ALA HB3 H 1 1.463 0.030 . 1 . . . . A 57 ALA HB3 . 36787 1 609 . 1 . 1 57 57 ALA C C 13 179.339 0.300 . 1 . . . . A 57 ALA C . 36787 1 610 . 1 . 1 57 57 ALA CA C 13 55.352 0.300 . 1 . . . . A 57 ALA CA . 36787 1 611 . 1 . 1 57 57 ALA CB C 13 18.322 0.300 . 1 . . . . A 57 ALA CB . 36787 1 612 . 1 . 1 57 57 ALA N N 15 120.309 0.300 . 1 . . . . A 57 ALA N . 36787 1 613 . 1 . 1 58 58 ILE H H 1 8.290 0.030 . 1 . . . . A 58 ILE H . 36787 1 614 . 1 . 1 58 58 ILE HA H 1 3.224 0.030 . 1 . . . . A 58 ILE HA . 36787 1 615 . 1 . 1 58 58 ILE HB H 1 1.707 0.030 . 1 . . . . A 58 ILE HB . 36787 1 616 . 1 . 1 58 58 ILE HD11 H 1 0.781 0.030 . 1 . . . . A 58 ILE HD11 . 36787 1 617 . 1 . 1 58 58 ILE HD12 H 1 0.781 0.030 . 1 . . . . A 58 ILE HD12 . 36787 1 618 . 1 . 1 58 58 ILE HD13 H 1 0.781 0.030 . 1 . . . . A 58 ILE HD13 . 36787 1 619 . 1 . 1 58 58 ILE HG12 H 1 0.683 0.030 . 2 . . . . A 58 ILE HG12 . 36787 1 620 . 1 . 1 58 58 ILE HG13 H 1 1.766 0.030 . 2 . . . . A 58 ILE HG13 . 36787 1 621 . 1 . 1 58 58 ILE HG21 H 1 0.784 0.030 . 1 . . . . A 58 ILE HG21 . 36787 1 622 . 1 . 1 58 58 ILE HG22 H 1 0.784 0.030 . 1 . . . . A 58 ILE HG22 . 36787 1 623 . 1 . 1 58 58 ILE HG23 H 1 0.784 0.030 . 1 . . . . A 58 ILE HG23 . 36787 1 624 . 1 . 1 58 58 ILE C C 13 177.226 0.300 . 1 . . . . A 58 ILE C . 36787 1 625 . 1 . 1 58 58 ILE CA C 13 65.100 0.300 . 1 . . . . A 58 ILE CA . 36787 1 626 . 1 . 1 58 58 ILE CB C 13 38.021 0.300 . 1 . . . . A 58 ILE CB . 36787 1 627 . 1 . 1 58 58 ILE CD1 C 13 14.923 0.300 . 1 . . . . A 58 ILE CD1 . 36787 1 628 . 1 . 1 58 58 ILE CG1 C 13 31.086 0.300 . 1 . . . . A 58 ILE CG1 . 36787 1 629 . 1 . 1 58 58 ILE CG2 C 13 20.781 0.300 . 1 . . . . A 58 ILE CG2 . 36787 1 630 . 1 . 1 58 58 ILE N N 15 118.021 0.300 . 1 . . . . A 58 ILE N . 36787 1 631 . 1 . 1 59 59 LEU H H 1 7.983 0.030 . 1 . . . . A 59 LEU H . 36787 1 632 . 1 . 1 59 59 LEU HA H 1 3.481 0.030 . 1 . . . . A 59 LEU HA . 36787 1 633 . 1 . 1 59 59 LEU HB2 H 1 1.179 0.030 . 2 . . . . A 59 LEU HB2 . 36787 1 634 . 1 . 1 59 59 LEU HB3 H 1 1.674 0.030 . 2 . . . . A 59 LEU HB3 . 36787 1 635 . 1 . 1 59 59 LEU HD11 H 1 0.676 0.030 . 2 . . . . A 59 LEU HD11 . 36787 1 636 . 1 . 1 59 59 LEU HD12 H 1 0.676 0.030 . 2 . . . . A 59 LEU HD12 . 36787 1 637 . 1 . 1 59 59 LEU HD13 H 1 0.676 0.030 . 2 . . . . A 59 LEU HD13 . 36787 1 638 . 1 . 1 59 59 LEU HD21 H 1 0.638 0.030 . 2 . . . . A 59 LEU HD21 . 36787 1 639 . 1 . 1 59 59 LEU HD22 H 1 0.638 0.030 . 2 . . . . A 59 LEU HD22 . 36787 1 640 . 1 . 1 59 59 LEU HD23 H 1 0.638 0.030 . 2 . . . . A 59 LEU HD23 . 36787 1 641 . 1 . 1 59 59 LEU HG H 1 1.706 0.030 . 1 . . . . A 59 LEU HG . 36787 1 642 . 1 . 1 59 59 LEU C C 13 181.317 0.300 . 1 . . . . A 59 LEU C . 36787 1 643 . 1 . 1 59 59 LEU CA C 13 57.363 0.300 . 1 . . . . A 59 LEU CA . 36787 1 644 . 1 . 1 59 59 LEU CB C 13 40.955 0.300 . 1 . . . . A 59 LEU CB . 36787 1 645 . 1 . 1 59 59 LEU CD1 C 13 25.589 0.300 . 2 . . . . A 59 LEU CD1 . 36787 1 646 . 1 . 1 59 59 LEU CD2 C 13 23.254 0.300 . 2 . . . . A 59 LEU CD2 . 36787 1 647 . 1 . 1 59 59 LEU CG C 13 26.600 0.300 . 1 . . . . A 59 LEU CG . 36787 1 648 . 1 . 1 59 59 LEU N N 15 117.973 0.300 . 1 . . . . A 59 LEU N . 36787 1 649 . 1 . 1 60 60 LYS H H 1 8.319 0.030 . 1 . . . . A 60 LYS H . 36787 1 650 . 1 . 1 60 60 LYS HA H 1 3.790 0.030 . 1 . . . . A 60 LYS HA . 36787 1 651 . 1 . 1 60 60 LYS HB2 H 1 1.795 0.030 . 2 . . . . A 60 LYS HB2 . 36787 1 652 . 1 . 1 60 60 LYS HB3 H 1 1.462 0.030 . 2 . . . . A 60 LYS HB3 . 36787 1 653 . 1 . 1 60 60 LYS HD2 H 1 1.497 0.030 . 2 . . . . A 60 LYS HD2 . 36787 1 654 . 1 . 1 60 60 LYS HD3 H 1 1.525 0.030 . 2 . . . . A 60 LYS HD3 . 36787 1 655 . 1 . 1 60 60 LYS HE2 H 1 2.830 0.030 . 1 . . . . A 60 LYS HE2 . 36787 1 656 . 1 . 1 60 60 LYS HE3 H 1 2.830 0.030 . 1 . . . . A 60 LYS HE3 . 36787 1 657 . 1 . 1 60 60 LYS HG2 H 1 0.817 0.030 . 2 . . . . A 60 LYS HG2 . 36787 1 658 . 1 . 1 60 60 LYS HG3 H 1 1.090 0.030 . 2 . . . . A 60 LYS HG3 . 36787 1 659 . 1 . 1 60 60 LYS C C 13 177.541 0.300 . 1 . . . . A 60 LYS C . 36787 1 660 . 1 . 1 60 60 LYS CA C 13 59.055 0.300 . 1 . . . . A 60 LYS CA . 36787 1 661 . 1 . 1 60 60 LYS CB C 13 32.273 0.300 . 1 . . . . A 60 LYS CB . 36787 1 662 . 1 . 1 60 60 LYS CD C 13 29.119 0.300 . 1 . . . . A 60 LYS CD . 36787 1 663 . 1 . 1 60 60 LYS CE C 13 41.948 0.300 . 1 . . . . A 60 LYS CE . 36787 1 664 . 1 . 1 60 60 LYS CG C 13 24.818 0.300 . 1 . . . . A 60 LYS CG . 36787 1 665 . 1 . 1 60 60 LYS N N 15 121.558 0.300 . 1 . . . . A 60 LYS N . 36787 1 666 . 1 . 1 61 61 HIS H H 1 7.162 0.030 . 1 . . . . A 61 HIS H . 36787 1 667 . 1 . 1 61 61 HIS HA H 1 4.630 0.030 . 1 . . . . A 61 HIS HA . 36787 1 668 . 1 . 1 61 61 HIS HB2 H 1 3.426 0.030 . 2 . . . . A 61 HIS HB2 . 36787 1 669 . 1 . 1 61 61 HIS HB3 H 1 2.669 0.030 . 2 . . . . A 61 HIS HB3 . 36787 1 670 . 1 . 1 61 61 HIS HD2 H 1 6.990 0.030 . 1 . . . . A 61 HIS HD2 . 36787 1 671 . 1 . 1 61 61 HIS C C 13 174.675 0.300 . 1 . . . . A 61 HIS C . 36787 1 672 . 1 . 1 61 61 HIS CA C 13 56.245 0.300 . 1 . . . . A 61 HIS CA . 36787 1 673 . 1 . 1 61 61 HIS CB C 13 28.657 0.300 . 1 . . . . A 61 HIS CB . 36787 1 674 . 1 . 1 61 61 HIS N N 15 113.146 0.300 . 1 . . . . A 61 HIS N . 36787 1 675 . 1 . 1 62 62 LYS H H 1 7.602 0.030 . 1 . . . . A 62 LYS H . 36787 1 676 . 1 . 1 62 62 LYS HA H 1 4.273 0.030 . 1 . . . . A 62 LYS HA . 36787 1 677 . 1 . 1 62 62 LYS HB2 H 1 1.697 0.030 . 1 . . . . A 62 LYS HB2 . 36787 1 678 . 1 . 1 62 62 LYS HB3 H 1 1.697 0.030 . 1 . . . . A 62 LYS HB3 . 36787 1 679 . 1 . 1 62 62 LYS HD2 H 1 1.698 0.030 . 1 . . . . A 62 LYS HD2 . 36787 1 680 . 1 . 1 62 62 LYS HD3 H 1 1.698 0.030 . 1 . . . . A 62 LYS HD3 . 36787 1 681 . 1 . 1 62 62 LYS HE2 H 1 2.975 0.030 . 1 . . . . A 62 LYS HE2 . 36787 1 682 . 1 . 1 62 62 LYS HE3 H 1 2.975 0.030 . 1 . . . . A 62 LYS HE3 . 36787 1 683 . 1 . 1 62 62 LYS HG2 H 1 1.328 0.030 . 1 . . . . A 62 LYS HG2 . 36787 1 684 . 1 . 1 62 62 LYS HG3 H 1 1.328 0.030 . 1 . . . . A 62 LYS HG3 . 36787 1 685 . 1 . 1 62 62 LYS C C 13 175.861 0.300 . 1 . . . . A 62 LYS C . 36787 1 686 . 1 . 1 62 62 LYS CA C 13 57.079 0.300 . 1 . . . . A 62 LYS CA . 36787 1 687 . 1 . 1 62 62 LYS CB C 13 29.083 0.300 . 1 . . . . A 62 LYS CB . 36787 1 688 . 1 . 1 62 62 LYS CD C 13 29.202 0.300 . 1 . . . . A 62 LYS CD . 36787 1 689 . 1 . 1 62 62 LYS CE C 13 42.195 0.300 . 1 . . . . A 62 LYS CE . 36787 1 690 . 1 . 1 62 62 LYS CG C 13 25.008 0.300 . 1 . . . . A 62 LYS CG . 36787 1 691 . 1 . 1 62 62 LYS N N 15 117.843 0.300 . 1 . . . . A 62 LYS N . 36787 1 692 . 1 . 1 63 63 PHE H H 1 8.223 0.030 . 1 . . . . A 63 PHE H . 36787 1 693 . 1 . 1 63 63 PHE HA H 1 3.706 0.030 . 1 . . . . A 63 PHE HA . 36787 1 694 . 1 . 1 63 63 PHE HB2 H 1 3.268 0.030 . 2 . . . . A 63 PHE HB2 . 36787 1 695 . 1 . 1 63 63 PHE HB3 H 1 3.414 0.030 . 2 . . . . A 63 PHE HB3 . 36787 1 696 . 1 . 1 63 63 PHE HD1 H 1 6.953 0.030 . 1 . . . . A 63 PHE HD1 . 36787 1 697 . 1 . 1 63 63 PHE HD2 H 1 6.953 0.030 . 1 . . . . A 63 PHE HD2 . 36787 1 698 . 1 . 1 63 63 PHE HE1 H 1 7.080 0.030 . 1 . . . . A 63 PHE HE1 . 36787 1 699 . 1 . 1 63 63 PHE HE2 H 1 7.080 0.030 . 1 . . . . A 63 PHE HE2 . 36787 1 700 . 1 . 1 63 63 PHE C C 13 173.160 0.300 . 1 . . . . A 63 PHE C . 36787 1 701 . 1 . 1 63 63 PHE CA C 13 60.085 0.300 . 1 . . . . A 63 PHE CA . 36787 1 702 . 1 . 1 63 63 PHE CB C 13 34.991 0.300 . 1 . . . . A 63 PHE CB . 36787 1 703 . 1 . 1 63 63 PHE CD1 C 13 131.253 0.300 . 1 . . . . A 63 PHE CD1 . 36787 1 704 . 1 . 1 63 63 PHE CD2 C 13 131.253 0.300 . 1 . . . . A 63 PHE CD2 . 36787 1 705 . 1 . 1 63 63 PHE CE1 C 13 131.048 0.300 . 1 . . . . A 63 PHE CE1 . 36787 1 706 . 1 . 1 63 63 PHE CE2 C 13 131.048 0.300 . 1 . . . . A 63 PHE CE2 . 36787 1 707 . 1 . 1 63 63 PHE N N 15 106.402 0.300 . 1 . . . . A 63 PHE N . 36787 1 708 . 1 . 1 64 64 ASP H H 1 7.454 0.030 . 1 . . . . A 64 ASP H . 36787 1 709 . 1 . 1 64 64 ASP HA H 1 4.801 0.030 . 1 . . . . A 64 ASP HA . 36787 1 710 . 1 . 1 64 64 ASP HB2 H 1 3.212 0.030 . 2 . . . . A 64 ASP HB2 . 36787 1 711 . 1 . 1 64 64 ASP HB3 H 1 2.609 0.030 . 2 . . . . A 64 ASP HB3 . 36787 1 712 . 1 . 1 64 64 ASP C C 13 175.940 0.300 . 1 . . . . A 64 ASP C . 36787 1 713 . 1 . 1 64 64 ASP CA C 13 53.049 0.300 . 1 . . . . A 64 ASP CA . 36787 1 714 . 1 . 1 64 64 ASP CB C 13 40.773 0.300 . 1 . . . . A 64 ASP CB . 36787 1 715 . 1 . 1 64 64 ASP N N 15 118.915 0.300 . 1 . . . . A 64 ASP N . 36787 1 716 . 1 . 1 65 65 VAL H H 1 8.312 0.030 . 1 . . . . A 65 VAL H . 36787 1 717 . 1 . 1 65 65 VAL HA H 1 3.592 0.030 . 1 . . . . A 65 VAL HA . 36787 1 718 . 1 . 1 65 65 VAL HB H 1 2.130 0.030 . 1 . . . . A 65 VAL HB . 36787 1 719 . 1 . 1 65 65 VAL HG11 H 1 1.111 0.030 . 2 . . . . A 65 VAL HG11 . 36787 1 720 . 1 . 1 65 65 VAL HG12 H 1 1.111 0.030 . 2 . . . . A 65 VAL HG12 . 36787 1 721 . 1 . 1 65 65 VAL HG13 H 1 1.111 0.030 . 2 . . . . A 65 VAL HG13 . 36787 1 722 . 1 . 1 65 65 VAL HG21 H 1 0.877 0.030 . 2 . . . . A 65 VAL HG21 . 36787 1 723 . 1 . 1 65 65 VAL HG22 H 1 0.877 0.030 . 2 . . . . A 65 VAL HG22 . 36787 1 724 . 1 . 1 65 65 VAL HG23 H 1 0.877 0.030 . 2 . . . . A 65 VAL HG23 . 36787 1 725 . 1 . 1 65 65 VAL C C 13 176.515 0.300 . 1 . . . . A 65 VAL C . 36787 1 726 . 1 . 1 65 65 VAL CA C 13 66.044 0.300 . 1 . . . . A 65 VAL CA . 36787 1 727 . 1 . 1 65 65 VAL CB C 13 32.208 0.300 . 1 . . . . A 65 VAL CB . 36787 1 728 . 1 . 1 65 65 VAL CG1 C 13 23.363 0.300 . 2 . . . . A 65 VAL CG1 . 36787 1 729 . 1 . 1 65 65 VAL CG2 C 13 21.198 0.300 . 2 . . . . A 65 VAL CG2 . 36787 1 730 . 1 . 1 65 65 VAL N N 15 125.809 0.300 . 1 . . . . A 65 VAL N . 36787 1 731 . 1 . 1 66 66 GLN H H 1 8.079 0.030 . 1 . . . . A 66 GLN H . 36787 1 732 . 1 . 1 66 66 GLN HA H 1 3.983 0.030 . 1 . . . . A 66 GLN HA . 36787 1 733 . 1 . 1 66 66 GLN HB2 H 1 2.178 0.030 . 1 . . . . A 66 GLN HB2 . 36787 1 734 . 1 . 1 66 66 GLN HB3 H 1 2.178 0.030 . 1 . . . . A 66 GLN HB3 . 36787 1 735 . 1 . 1 66 66 GLN HE21 H 1 6.890 0.030 . 2 . . . . A 66 GLN HE21 . 36787 1 736 . 1 . 1 66 66 GLN HE22 H 1 7.551 0.030 . 2 . . . . A 66 GLN HE22 . 36787 1 737 . 1 . 1 66 66 GLN HG2 H 1 2.369 0.030 . 2 . . . . A 66 GLN HG2 . 36787 1 738 . 1 . 1 66 66 GLN HG3 H 1 2.434 0.030 . 2 . . . . A 66 GLN HG3 . 36787 1 739 . 1 . 1 66 66 GLN C C 13 179.114 0.300 . 1 . . . . A 66 GLN C . 36787 1 740 . 1 . 1 66 66 GLN CA C 13 59.457 0.300 . 1 . . . . A 66 GLN CA . 36787 1 741 . 1 . 1 66 66 GLN CB C 13 27.894 0.300 . 1 . . . . A 66 GLN CB . 36787 1 742 . 1 . 1 66 66 GLN CG C 13 34.313 0.300 . 1 . . . . A 66 GLN CG . 36787 1 743 . 1 . 1 66 66 GLN N N 15 119.729 0.300 . 1 . . . . A 66 GLN N . 36787 1 744 . 1 . 1 66 66 GLN NE2 N 15 112.231 0.300 . 1 . . . . A 66 GLN NE2 . 36787 1 745 . 1 . 1 67 67 LYS H H 1 7.848 0.030 . 1 . . . . A 67 LYS H . 36787 1 746 . 1 . 1 67 67 LYS HA H 1 3.879 0.030 . 1 . . . . A 67 LYS HA . 36787 1 747 . 1 . 1 67 67 LYS HB2 H 1 1.461 0.030 . 2 . . . . A 67 LYS HB2 . 36787 1 748 . 1 . 1 67 67 LYS HB3 H 1 1.664 0.030 . 2 . . . . A 67 LYS HB3 . 36787 1 749 . 1 . 1 67 67 LYS HD2 H 1 1.610 0.030 . 1 . . . . A 67 LYS HD2 . 36787 1 750 . 1 . 1 67 67 LYS HD3 H 1 1.610 0.030 . 1 . . . . A 67 LYS HD3 . 36787 1 751 . 1 . 1 67 67 LYS HE2 H 1 2.782 0.030 . 1 . . . . A 67 LYS HE2 . 36787 1 752 . 1 . 1 67 67 LYS HE3 H 1 2.782 0.030 . 1 . . . . A 67 LYS HE3 . 36787 1 753 . 1 . 1 67 67 LYS HG2 H 1 1.265 0.030 . 2 . . . . A 67 LYS HG2 . 36787 1 754 . 1 . 1 67 67 LYS HG3 H 1 1.065 0.030 . 2 . . . . A 67 LYS HG3 . 36787 1 755 . 1 . 1 67 67 LYS C C 13 178.648 0.300 . 1 . . . . A 67 LYS C . 36787 1 756 . 1 . 1 67 67 LYS CA C 13 58.349 0.300 . 1 . . . . A 67 LYS CA . 36787 1 757 . 1 . 1 67 67 LYS CB C 13 32.095 0.300 . 1 . . . . A 67 LYS CB . 36787 1 758 . 1 . 1 67 67 LYS CD C 13 28.877 0.300 . 1 . . . . A 67 LYS CD . 36787 1 759 . 1 . 1 67 67 LYS CE C 13 42.030 0.300 . 1 . . . . A 67 LYS CE . 36787 1 760 . 1 . 1 67 67 LYS CG C 13 25.410 0.300 . 1 . . . . A 67 LYS CG . 36787 1 761 . 1 . 1 67 67 LYS N N 15 121.102 0.300 . 1 . . . . A 67 LYS N . 36787 1 762 . 1 . 1 68 68 ALA H H 1 8.422 0.030 . 1 . . . . A 68 ALA H . 36787 1 763 . 1 . 1 68 68 ALA HA H 1 3.680 0.030 . 1 . . . . A 68 ALA HA . 36787 1 764 . 1 . 1 68 68 ALA HB1 H 1 1.256 0.030 . 1 . . . . A 68 ALA HB1 . 36787 1 765 . 1 . 1 68 68 ALA HB2 H 1 1.256 0.030 . 1 . . . . A 68 ALA HB2 . 36787 1 766 . 1 . 1 68 68 ALA HB3 H 1 1.256 0.030 . 1 . . . . A 68 ALA HB3 . 36787 1 767 . 1 . 1 68 68 ALA C C 13 178.759 0.300 . 1 . . . . A 68 ALA C . 36787 1 768 . 1 . 1 68 68 ALA CA C 13 55.430 0.300 . 1 . . . . A 68 ALA CA . 36787 1 769 . 1 . 1 68 68 ALA CB C 13 18.297 0.300 . 1 . . . . A 68 ALA CB . 36787 1 770 . 1 . 1 68 68 ALA N N 15 120.696 0.300 . 1 . . . . A 68 ALA N . 36787 1 771 . 1 . 1 69 69 LEU H H 1 8.555 0.030 . 1 . . . . A 69 LEU H . 36787 1 772 . 1 . 1 69 69 LEU HA H 1 3.785 0.030 . 1 . . . . A 69 LEU HA . 36787 1 773 . 1 . 1 69 69 LEU HB2 H 1 1.452 0.030 . 2 . . . . A 69 LEU HB2 . 36787 1 774 . 1 . 1 69 69 LEU HB3 H 1 1.938 0.030 . 2 . . . . A 69 LEU HB3 . 36787 1 775 . 1 . 1 69 69 LEU HD11 H 1 0.838 0.030 . 2 . . . . A 69 LEU HD11 . 36787 1 776 . 1 . 1 69 69 LEU HD12 H 1 0.838 0.030 . 2 . . . . A 69 LEU HD12 . 36787 1 777 . 1 . 1 69 69 LEU HD13 H 1 0.838 0.030 . 2 . . . . A 69 LEU HD13 . 36787 1 778 . 1 . 1 69 69 LEU HD21 H 1 0.833 0.030 . 2 . . . . A 69 LEU HD21 . 36787 1 779 . 1 . 1 69 69 LEU HD22 H 1 0.833 0.030 . 2 . . . . A 69 LEU HD22 . 36787 1 780 . 1 . 1 69 69 LEU HD23 H 1 0.833 0.030 . 2 . . . . A 69 LEU HD23 . 36787 1 781 . 1 . 1 69 69 LEU HG H 1 1.732 0.030 . 1 . . . . A 69 LEU HG . 36787 1 782 . 1 . 1 69 69 LEU C C 13 177.963 0.300 . 1 . . . . A 69 LEU C . 36787 1 783 . 1 . 1 69 69 LEU CA C 13 57.995 0.300 . 1 . . . . A 69 LEU CA . 36787 1 784 . 1 . 1 69 69 LEU CB C 13 42.205 0.300 . 1 . . . . A 69 LEU CB . 36787 1 785 . 1 . 1 69 69 LEU CD1 C 13 26.064 0.300 . 2 . . . . A 69 LEU CD1 . 36787 1 786 . 1 . 1 69 69 LEU CD2 C 13 25.172 0.300 . 2 . . . . A 69 LEU CD2 . 36787 1 787 . 1 . 1 69 69 LEU CG C 13 27.639 0.300 . 1 . . . . A 69 LEU CG . 36787 1 788 . 1 . 1 69 69 LEU N N 15 116.754 0.300 . 1 . . . . A 69 LEU N . 36787 1 789 . 1 . 1 70 70 SER H H 1 7.516 0.030 . 1 . . . . A 70 SER H . 36787 1 790 . 1 . 1 70 70 SER HA H 1 4.023 0.030 . 1 . . . . A 70 SER HA . 36787 1 791 . 1 . 1 70 70 SER HB2 H 1 3.932 0.030 . 1 . . . . A 70 SER HB2 . 36787 1 792 . 1 . 1 70 70 SER HB3 H 1 3.932 0.030 . 1 . . . . A 70 SER HB3 . 36787 1 793 . 1 . 1 70 70 SER C C 13 176.185 0.300 . 1 . . . . A 70 SER C . 36787 1 794 . 1 . 1 70 70 SER CA C 13 62.095 0.300 . 1 . . . . A 70 SER CA . 36787 1 795 . 1 . 1 70 70 SER CB C 13 62.973 0.300 . 1 . . . . A 70 SER CB . 36787 1 796 . 1 . 1 70 70 SER N N 15 112.910 0.300 . 1 . . . . A 70 SER N . 36787 1 797 . 1 . 1 71 71 VAL H H 1 7.553 0.030 . 1 . . . . A 71 VAL H . 36787 1 798 . 1 . 1 71 71 VAL HA H 1 3.897 0.030 . 1 . . . . A 71 VAL HA . 36787 1 799 . 1 . 1 71 71 VAL HB H 1 2.164 0.030 . 1 . . . . A 71 VAL HB . 36787 1 800 . 1 . 1 71 71 VAL HG11 H 1 0.948 0.030 . 2 . . . . A 71 VAL HG11 . 36787 1 801 . 1 . 1 71 71 VAL HG12 H 1 0.948 0.030 . 2 . . . . A 71 VAL HG12 . 36787 1 802 . 1 . 1 71 71 VAL HG13 H 1 0.948 0.030 . 2 . . . . A 71 VAL HG13 . 36787 1 803 . 1 . 1 71 71 VAL HG21 H 1 0.938 0.030 . 2 . . . . A 71 VAL HG21 . 36787 1 804 . 1 . 1 71 71 VAL HG22 H 1 0.938 0.030 . 2 . . . . A 71 VAL HG22 . 36787 1 805 . 1 . 1 71 71 VAL HG23 H 1 0.938 0.030 . 2 . . . . A 71 VAL HG23 . 36787 1 806 . 1 . 1 71 71 VAL C C 13 178.616 0.300 . 1 . . . . A 71 VAL C . 36787 1 807 . 1 . 1 71 71 VAL CA C 13 65.192 0.300 . 1 . . . . A 71 VAL CA . 36787 1 808 . 1 . 1 71 71 VAL CB C 13 31.688 0.300 . 1 . . . . A 71 VAL CB . 36787 1 809 . 1 . 1 71 71 VAL CG1 C 13 21.916 0.300 . 2 . . . . A 71 VAL CG1 . 36787 1 810 . 1 . 1 71 71 VAL CG2 C 13 21.050 0.300 . 2 . . . . A 71 VAL CG2 . 36787 1 811 . 1 . 1 71 71 VAL N N 15 118.213 0.300 . 1 . . . . A 71 VAL N . 36787 1 812 . 1 . 1 72 72 VAL H H 1 7.663 0.030 . 1 . . . . A 72 VAL H . 36787 1 813 . 1 . 1 72 72 VAL HA H 1 3.862 0.030 . 1 . . . . A 72 VAL HA . 36787 1 814 . 1 . 1 72 72 VAL HB H 1 2.111 0.030 . 1 . . . . A 72 VAL HB . 36787 1 815 . 1 . 1 72 72 VAL HG11 H 1 0.892 0.030 . 2 . . . . A 72 VAL HG11 . 36787 1 816 . 1 . 1 72 72 VAL HG12 H 1 0.892 0.030 . 2 . . . . A 72 VAL HG12 . 36787 1 817 . 1 . 1 72 72 VAL HG13 H 1 0.892 0.030 . 2 . . . . A 72 VAL HG13 . 36787 1 818 . 1 . 1 72 72 VAL HG21 H 1 0.875 0.030 . 2 . . . . A 72 VAL HG21 . 36787 1 819 . 1 . 1 72 72 VAL HG22 H 1 0.875 0.030 . 2 . . . . A 72 VAL HG22 . 36787 1 820 . 1 . 1 72 72 VAL HG23 H 1 0.875 0.030 . 2 . . . . A 72 VAL HG23 . 36787 1 821 . 1 . 1 72 72 VAL C C 13 177.848 0.300 . 1 . . . . A 72 VAL C . 36787 1 822 . 1 . 1 72 72 VAL CA C 13 65.116 0.300 . 1 . . . . A 72 VAL CA . 36787 1 823 . 1 . 1 72 72 VAL CB C 13 31.719 0.300 . 1 . . . . A 72 VAL CB . 36787 1 824 . 1 . 1 72 72 VAL CG1 C 13 22.047 0.300 . 2 . . . . A 72 VAL CG1 . 36787 1 825 . 1 . 1 72 72 VAL CG2 C 13 22.047 0.300 . 2 . . . . A 72 VAL CG2 . 36787 1 826 . 1 . 1 72 72 VAL N N 15 118.320 0.300 . 1 . . . . A 72 VAL N . 36787 1 827 . 1 . 1 73 73 LEU H H 1 7.970 0.030 . 1 . . . . A 73 LEU H . 36787 1 828 . 1 . 1 73 73 LEU HA H 1 4.167 0.030 . 1 . . . . A 73 LEU HA . 36787 1 829 . 1 . 1 73 73 LEU HB2 H 1 1.358 0.030 . 2 . . . . A 73 LEU HB2 . 36787 1 830 . 1 . 1 73 73 LEU HB3 H 1 1.696 0.030 . 2 . . . . A 73 LEU HB3 . 36787 1 831 . 1 . 1 73 73 LEU HD11 H 1 0.722 0.030 . 2 . . . . A 73 LEU HD11 . 36787 1 832 . 1 . 1 73 73 LEU HD12 H 1 0.722 0.030 . 2 . . . . A 73 LEU HD12 . 36787 1 833 . 1 . 1 73 73 LEU HD13 H 1 0.722 0.030 . 2 . . . . A 73 LEU HD13 . 36787 1 834 . 1 . 1 73 73 LEU HD21 H 1 0.766 0.030 . 2 . . . . A 73 LEU HD21 . 36787 1 835 . 1 . 1 73 73 LEU HD22 H 1 0.766 0.030 . 2 . . . . A 73 LEU HD22 . 36787 1 836 . 1 . 1 73 73 LEU HD23 H 1 0.766 0.030 . 2 . . . . A 73 LEU HD23 . 36787 1 837 . 1 . 1 73 73 LEU HG H 1 1.670 0.030 . 1 . . . . A 73 LEU HG . 36787 1 838 . 1 . 1 73 73 LEU C C 13 177.879 0.300 . 1 . . . . A 73 LEU C . 36787 1 839 . 1 . 1 73 73 LEU CA C 13 56.225 0.300 . 1 . . . . A 73 LEU CA . 36787 1 840 . 1 . 1 73 73 LEU CB C 13 42.028 0.300 . 1 . . . . A 73 LEU CB . 36787 1 841 . 1 . 1 73 73 LEU CD1 C 13 25.684 0.300 . 2 . . . . A 73 LEU CD1 . 36787 1 842 . 1 . 1 73 73 LEU CD2 C 13 22.746 0.300 . 2 . . . . A 73 LEU CD2 . 36787 1 843 . 1 . 1 73 73 LEU CG C 13 27.146 0.300 . 1 . . . . A 73 LEU CG . 36787 1 844 . 1 . 1 73 73 LEU N N 15 119.066 0.300 . 1 . . . . A 73 LEU N . 36787 1 845 . 1 . 1 74 74 GLU H H 1 7.683 0.030 . 1 . . . . A 74 GLU H . 36787 1 846 . 1 . 1 74 74 GLU HA H 1 4.205 0.030 . 1 . . . . A 74 GLU HA . 36787 1 847 . 1 . 1 74 74 GLU HB2 H 1 2.080 0.030 . 1 . . . . A 74 GLU HB2 . 36787 1 848 . 1 . 1 74 74 GLU HB3 H 1 2.080 0.030 . 1 . . . . A 74 GLU HB3 . 36787 1 849 . 1 . 1 74 74 GLU HG2 H 1 2.283 0.030 . 2 . . . . A 74 GLU HG2 . 36787 1 850 . 1 . 1 74 74 GLU HG3 H 1 2.348 0.030 . 2 . . . . A 74 GLU HG3 . 36787 1 851 . 1 . 1 74 74 GLU C C 13 176.964 0.300 . 1 . . . . A 74 GLU C . 36787 1 852 . 1 . 1 74 74 GLU CA C 13 56.997 0.300 . 1 . . . . A 74 GLU CA . 36787 1 853 . 1 . 1 74 74 GLU CB C 13 29.679 0.300 . 1 . . . . A 74 GLU CB . 36787 1 854 . 1 . 1 74 74 GLU CG C 13 36.356 0.300 . 1 . . . . A 74 GLU CG . 36787 1 855 . 1 . 1 74 74 GLU N N 15 118.589 0.300 . 1 . . . . A 74 GLU N . 36787 1 856 . 1 . 1 75 75 GLN H H 1 7.958 0.030 . 1 . . . . A 75 GLN H . 36787 1 857 . 1 . 1 75 75 GLN HA H 1 4.308 0.030 . 1 . . . . A 75 GLN HA . 36787 1 858 . 1 . 1 75 75 GLN HB2 H 1 2.060 0.030 . 2 . . . . A 75 GLN HB2 . 36787 1 859 . 1 . 1 75 75 GLN HB3 H 1 2.158 0.030 . 2 . . . . A 75 GLN HB3 . 36787 1 860 . 1 . 1 75 75 GLN HE21 H 1 7.513 0.030 . 2 . . . . A 75 GLN HE21 . 36787 1 861 . 1 . 1 75 75 GLN HE22 H 1 6.777 0.030 . 2 . . . . A 75 GLN HE22 . 36787 1 862 . 1 . 1 75 75 GLN HG2 H 1 2.417 0.030 . 1 . . . . A 75 GLN HG2 . 36787 1 863 . 1 . 1 75 75 GLN HG3 H 1 2.417 0.030 . 1 . . . . A 75 GLN HG3 . 36787 1 864 . 1 . 1 75 75 GLN C C 13 176.036 0.300 . 1 . . . . A 75 GLN C . 36787 1 865 . 1 . 1 75 75 GLN CA C 13 56.242 0.300 . 1 . . . . A 75 GLN CA . 36787 1 866 . 1 . 1 75 75 GLN CB C 13 29.176 0.300 . 1 . . . . A 75 GLN CB . 36787 1 867 . 1 . 1 75 75 GLN CG C 13 33.842 0.300 . 1 . . . . A 75 GLN CG . 36787 1 868 . 1 . 1 75 75 GLN N N 15 119.370 0.300 . 1 . . . . A 75 GLN N . 36787 1 869 . 1 . 1 75 75 GLN NE2 N 15 111.744 0.300 . 1 . . . . A 75 GLN NE2 . 36787 1 870 . 1 . 1 76 76 ASP H H 1 8.294 0.030 . 1 . . . . A 76 ASP H . 36787 1 871 . 1 . 1 76 76 ASP HA H 1 4.602 0.030 . 1 . . . . A 76 ASP HA . 36787 1 872 . 1 . 1 76 76 ASP HB2 H 1 2.714 0.030 . 1 . . . . A 76 ASP HB2 . 36787 1 873 . 1 . 1 76 76 ASP HB3 H 1 2.714 0.030 . 1 . . . . A 76 ASP HB3 . 36787 1 874 . 1 . 1 76 76 ASP C C 13 176.870 0.300 . 1 . . . . A 76 ASP C . 36787 1 875 . 1 . 1 76 76 ASP CA C 13 54.637 0.300 . 1 . . . . A 76 ASP CA . 36787 1 876 . 1 . 1 76 76 ASP CB C 13 41.290 0.300 . 1 . . . . A 76 ASP CB . 36787 1 877 . 1 . 1 76 76 ASP N N 15 121.309 0.300 . 1 . . . . A 76 ASP N . 36787 1 878 . 1 . 1 77 77 GLY H H 1 8.361 0.030 . 1 . . . . A 77 GLY H . 36787 1 879 . 1 . 1 77 77 GLY HA2 H 1 4.007 0.030 . 1 . . . . A 77 GLY HA2 . 36787 1 880 . 1 . 1 77 77 GLY HA3 H 1 4.007 0.030 . 1 . . . . A 77 GLY HA3 . 36787 1 881 . 1 . 1 77 77 GLY C C 13 174.572 0.300 . 1 . . . . A 77 GLY C . 36787 1 882 . 1 . 1 77 77 GLY CA C 13 45.505 0.300 . 1 . . . . A 77 GLY CA . 36787 1 883 . 1 . 1 77 77 GLY N N 15 109.762 0.300 . 1 . . . . A 77 GLY N . 36787 1 884 . 1 . 1 78 78 SER H H 1 8.258 0.030 . 1 . . . . A 78 SER H . 36787 1 885 . 1 . 1 78 78 SER HA H 1 4.461 0.030 . 1 . . . . A 78 SER HA . 36787 1 886 . 1 . 1 78 78 SER HB2 H 1 3.882 0.030 . 1 . . . . A 78 SER HB2 . 36787 1 887 . 1 . 1 78 78 SER HB3 H 1 3.882 0.030 . 1 . . . . A 78 SER HB3 . 36787 1 888 . 1 . 1 78 78 SER C C 13 174.687 0.300 . 1 . . . . A 78 SER C . 36787 1 889 . 1 . 1 78 78 SER CA C 13 58.514 0.300 . 1 . . . . A 78 SER CA . 36787 1 890 . 1 . 1 78 78 SER CB C 13 63.864 0.300 . 1 . . . . A 78 SER CB . 36787 1 891 . 1 . 1 78 78 SER N N 15 115.759 0.300 . 1 . . . . A 78 SER N . 36787 1 892 . 1 . 1 79 79 GLY H H 1 8.293 0.030 . 1 . . . . A 79 GLY H . 36787 1 893 . 1 . 1 79 79 GLY HA2 H 1 4.160 0.030 . 2 . . . . A 79 GLY HA2 . 36787 1 894 . 1 . 1 79 79 GLY HA3 H 1 4.089 0.030 . 2 . . . . A 79 GLY HA3 . 36787 1 895 . 1 . 1 79 79 GLY CA C 13 44.723 0.300 . 1 . . . . A 79 GLY CA . 36787 1 896 . 1 . 1 79 79 GLY N N 15 110.510 0.300 . 1 . . . . A 79 GLY N . 36787 1 897 . 1 . 1 80 80 PRO HA H 1 4.487 0.030 . 1 . . . . A 80 PRO HA . 36787 1 898 . 1 . 1 80 80 PRO HB2 H 1 1.971 0.030 . 1 . . . . A 80 PRO HB2 . 36787 1 899 . 1 . 1 80 80 PRO HB3 H 1 1.971 0.030 . 1 . . . . A 80 PRO HB3 . 36787 1 900 . 1 . 1 80 80 PRO HD2 H 1 3.634 0.030 . 1 . . . . A 80 PRO HD2 . 36787 1 901 . 1 . 1 80 80 PRO HD3 H 1 3.634 0.030 . 1 . . . . A 80 PRO HD3 . 36787 1 902 . 1 . 1 80 80 PRO HG2 H 1 2.016 0.030 . 1 . . . . A 80 PRO HG2 . 36787 1 903 . 1 . 1 80 80 PRO HG3 H 1 2.016 0.030 . 1 . . . . A 80 PRO HG3 . 36787 1 904 . 1 . 1 80 80 PRO C C 13 177.363 0.300 . 1 . . . . A 80 PRO C . 36787 1 905 . 1 . 1 80 80 PRO CA C 13 63.245 0.300 . 1 . . . . A 80 PRO CA . 36787 1 906 . 1 . 1 80 80 PRO CB C 13 32.183 0.300 . 1 . . . . A 80 PRO CB . 36787 1 907 . 1 . 1 80 80 PRO CD C 13 49.831 0.300 . 1 . . . . A 80 PRO CD . 36787 1 908 . 1 . 1 80 80 PRO CG C 13 27.189 0.300 . 1 . . . . A 80 PRO CG . 36787 1 909 . 1 . 1 81 81 SER H H 1 8.529 0.030 . 1 . . . . A 81 SER H . 36787 1 910 . 1 . 1 81 81 SER HA H 1 4.474 0.030 . 1 . . . . A 81 SER HA . 36787 1 911 . 1 . 1 81 81 SER HB2 H 1 3.851 0.030 . 1 . . . . A 81 SER HB2 . 36787 1 912 . 1 . 1 81 81 SER HB3 H 1 3.851 0.030 . 1 . . . . A 81 SER HB3 . 36787 1 913 . 1 . 1 81 81 SER C C 13 177.400 0.300 . 1 . . . . A 81 SER C . 36787 1 914 . 1 . 1 81 81 SER CA C 13 58.341 0.300 . 1 . . . . A 81 SER CA . 36787 1 915 . 1 . 1 81 81 SER CB C 13 63.863 0.300 . 1 . . . . A 81 SER CB . 36787 1 916 . 1 . 1 81 81 SER N N 15 116.494 0.300 . 1 . . . . A 81 SER N . 36787 1 917 . 2 . 2 5 5 SER HA H 1 4.518 0.030 . 1 . . . . B 88 SER HA . 36787 1 918 . 2 . 2 5 5 SER HB2 H 1 3.844 0.030 . 1 . . . . B 88 SER HB2 . 36787 1 919 . 2 . 2 5 5 SER HB3 H 1 3.844 0.030 . 1 . . . . B 88 SER HB3 . 36787 1 920 . 2 . 2 5 5 SER C C 13 174.793 0.300 . 1 . . . . B 88 SER C . 36787 1 921 . 2 . 2 5 5 SER CA C 13 58.148 0.300 . 1 . . . . B 88 SER CA . 36787 1 922 . 2 . 2 5 5 SER CB C 13 63.986 0.300 . 1 . . . . B 88 SER CB . 36787 1 923 . 2 . 2 6 6 SER H H 1 8.642 0.030 . 1 . . . . B 89 SER H . 36787 1 924 . 2 . 2 6 6 SER C C 13 174.782 0.300 . 1 . . . . B 89 SER C . 36787 1 925 . 2 . 2 6 6 SER CA C 13 58.559 0.300 . 1 . . . . B 89 SER CA . 36787 1 926 . 2 . 2 6 6 SER CB C 13 63.986 0.300 . 1 . . . . B 89 SER CB . 36787 1 927 . 2 . 2 6 6 SER N N 15 118.439 0.300 . 1 . . . . B 89 SER N . 36787 1 928 . 2 . 2 7 7 GLY HA2 H 1 3.890 0.030 . 2 . . . . B 90 GLY HA2 . 36787 1 929 . 2 . 2 7 7 GLY HA3 H 1 4.052 0.030 . 2 . . . . B 90 GLY HA3 . 36787 1 930 . 2 . 2 7 7 GLY C C 13 173.144 0.300 . 1 . . . . B 90 GLY C . 36787 1 931 . 2 . 2 7 7 GLY CA C 13 45.427 0.300 . 1 . . . . B 90 GLY CA . 36787 1 932 . 2 . 2 8 8 MET H H 1 8.842 0.030 . 1 . . . . B 91 MET H . 36787 1 933 . 2 . 2 8 8 MET HA H 1 4.537 0.030 . 1 . . . . B 91 MET HA . 36787 1 934 . 2 . 2 8 8 MET HB2 H 1 2.051 0.030 . 2 . . . . B 91 MET HB2 . 36787 1 935 . 2 . 2 8 8 MET HB3 H 1 1.824 0.030 . 2 . . . . B 91 MET HB3 . 36787 1 936 . 2 . 2 8 8 MET HE1 H 1 1.615 0.030 . 1 . . . . B 91 MET HE1 . 36787 1 937 . 2 . 2 8 8 MET HE2 H 1 1.615 0.030 . 1 . . . . B 91 MET HE2 . 36787 1 938 . 2 . 2 8 8 MET HE3 H 1 1.615 0.030 . 1 . . . . B 91 MET HE3 . 36787 1 939 . 2 . 2 8 8 MET HG2 H 1 2.234 0.030 . 2 . . . . B 91 MET HG2 . 36787 1 940 . 2 . 2 8 8 MET HG3 H 1 2.049 0.030 . 2 . . . . B 91 MET HG3 . 36787 1 941 . 2 . 2 8 8 MET C C 13 173.025 0.300 . 1 . . . . B 91 MET C . 36787 1 942 . 2 . 2 8 8 MET CA C 13 55.130 0.300 . 1 . . . . B 91 MET CA . 36787 1 943 . 2 . 2 8 8 MET CB C 13 34.472 0.300 . 1 . . . . B 91 MET CB . 36787 1 944 . 2 . 2 8 8 MET CE C 13 17.867 0.300 . 1 . . . . B 91 MET CE . 36787 1 945 . 2 . 2 8 8 MET CG C 13 32.258 0.300 . 1 . . . . B 91 MET CG . 36787 1 946 . 2 . 2 8 8 MET N N 15 120.136 0.300 . 1 . . . . B 91 MET N . 36787 1 947 . 2 . 2 9 9 GLN H H 1 8.203 0.030 . 1 . . . . B 92 GLN H . 36787 1 948 . 2 . 2 9 9 GLN HA H 1 5.382 0.030 . 1 . . . . B 92 GLN HA . 36787 1 949 . 2 . 2 9 9 GLN HB2 H 1 1.594 0.030 . 2 . . . . B 92 GLN HB2 . 36787 1 950 . 2 . 2 9 9 GLN HB3 H 1 1.765 0.030 . 2 . . . . B 92 GLN HB3 . 36787 1 951 . 2 . 2 9 9 GLN HE21 H 1 6.685 0.030 . 2 . . . . B 92 GLN HE21 . 36787 1 952 . 2 . 2 9 9 GLN HE22 H 1 7.732 0.030 . 2 . . . . B 92 GLN HE22 . 36787 1 953 . 2 . 2 9 9 GLN HG2 H 1 1.978 0.030 . 2 . . . . B 92 GLN HG2 . 36787 1 954 . 2 . 2 9 9 GLN HG3 H 1 2.185 0.030 . 2 . . . . B 92 GLN HG3 . 36787 1 955 . 2 . 2 9 9 GLN C C 13 175.863 0.300 . 1 . . . . B 92 GLN C . 36787 1 956 . 2 . 2 9 9 GLN CA C 13 54.170 0.300 . 1 . . . . B 92 GLN CA . 36787 1 957 . 2 . 2 9 9 GLN CB C 13 31.011 0.300 . 1 . . . . B 92 GLN CB . 36787 1 958 . 2 . 2 9 9 GLN CG C 13 34.276 0.300 . 1 . . . . B 92 GLN CG . 36787 1 959 . 2 . 2 9 9 GLN N N 15 121.716 0.300 . 1 . . . . B 92 GLN N . 36787 1 960 . 2 . 2 9 9 GLN NE2 N 15 112.101 0.300 . 1 . . . . B 92 GLN NE2 . 36787 1 961 . 2 . 2 10 10 ILE H H 1 8.300 0.030 . 1 . . . . B 93 ILE H . 36787 1 962 . 2 . 2 10 10 ILE HA H 1 4.182 0.030 . 1 . . . . B 93 ILE HA . 36787 1 963 . 2 . 2 10 10 ILE HB H 1 1.748 0.030 . 1 . . . . B 93 ILE HB . 36787 1 964 . 2 . 2 10 10 ILE HD11 H 1 0.587 0.030 . 1 . . . . B 93 ILE HD11 . 36787 1 965 . 2 . 2 10 10 ILE HD12 H 1 0.587 0.030 . 1 . . . . B 93 ILE HD12 . 36787 1 966 . 2 . 2 10 10 ILE HD13 H 1 0.587 0.030 . 1 . . . . B 93 ILE HD13 . 36787 1 967 . 2 . 2 10 10 ILE HG12 H 1 0.838 0.030 . 2 . . . . B 93 ILE HG12 . 36787 1 968 . 2 . 2 10 10 ILE HG13 H 1 1.056 0.030 . 2 . . . . B 93 ILE HG13 . 36787 1 969 . 2 . 2 10 10 ILE HG21 H 1 0.614 0.030 . 1 . . . . B 93 ILE HG21 . 36787 1 970 . 2 . 2 10 10 ILE HG22 H 1 0.614 0.030 . 1 . . . . B 93 ILE HG22 . 36787 1 971 . 2 . 2 10 10 ILE HG23 H 1 0.614 0.030 . 1 . . . . B 93 ILE HG23 . 36787 1 972 . 2 . 2 10 10 ILE C C 13 172.338 0.300 . 1 . . . . B 93 ILE C . 36787 1 973 . 2 . 2 10 10 ILE CA C 13 59.370 0.300 . 1 . . . . B 93 ILE CA . 36787 1 974 . 2 . 2 10 10 ILE CB C 13 42.062 0.300 . 1 . . . . B 93 ILE CB . 36787 1 975 . 2 . 2 10 10 ILE CD1 C 13 14.216 0.300 . 1 . . . . B 93 ILE CD1 . 36787 1 976 . 2 . 2 10 10 ILE CG1 C 13 24.761 0.300 . 1 . . . . B 93 ILE CG1 . 36787 1 977 . 2 . 2 10 10 ILE CG2 C 13 17.926 0.300 . 1 . . . . B 93 ILE CG2 . 36787 1 978 . 2 . 2 10 10 ILE N N 15 114.004 0.300 . 1 . . . . B 93 ILE N . 36787 1 979 . 2 . 2 11 11 PHE H H 1 8.593 0.030 . 1 . . . . B 94 PHE H . 36787 1 980 . 2 . 2 11 11 PHE HA H 1 5.585 0.030 . 1 . . . . B 94 PHE HA . 36787 1 981 . 2 . 2 11 11 PHE HB2 H 1 2.836 0.030 . 2 . . . . B 94 PHE HB2 . 36787 1 982 . 2 . 2 11 11 PHE HB3 H 1 3.024 0.030 . 2 . . . . B 94 PHE HB3 . 36787 1 983 . 2 . 2 11 11 PHE HD1 H 1 7.057 0.030 . 1 . . . . B 94 PHE HD1 . 36787 1 984 . 2 . 2 11 11 PHE HD2 H 1 7.057 0.030 . 1 . . . . B 94 PHE HD2 . 36787 1 985 . 2 . 2 11 11 PHE HE1 H 1 7.229 0.030 . 1 . . . . B 94 PHE HE1 . 36787 1 986 . 2 . 2 11 11 PHE HE2 H 1 7.229 0.030 . 1 . . . . B 94 PHE HE2 . 36787 1 987 . 2 . 2 11 11 PHE C C 13 174.970 0.300 . 1 . . . . B 94 PHE C . 36787 1 988 . 2 . 2 11 11 PHE CA C 13 55.107 0.300 . 1 . . . . B 94 PHE CA . 36787 1 989 . 2 . 2 11 11 PHE CB C 13 41.052 0.300 . 1 . . . . B 94 PHE CB . 36787 1 990 . 2 . 2 11 11 PHE CD1 C 13 132.062 0.300 . 1 . . . . B 94 PHE CD1 . 36787 1 991 . 2 . 2 11 11 PHE CD2 C 13 132.062 0.300 . 1 . . . . B 94 PHE CD2 . 36787 1 992 . 2 . 2 11 11 PHE CE1 C 13 131.018 0.300 . 1 . . . . B 94 PHE CE1 . 36787 1 993 . 2 . 2 11 11 PHE CE2 C 13 131.018 0.300 . 1 . . . . B 94 PHE CE2 . 36787 1 994 . 2 . 2 11 11 PHE N N 15 118.696 0.300 . 1 . . . . B 94 PHE N . 36787 1 995 . 2 . 2 12 12 VAL H H 1 9.327 0.030 . 1 . . . . B 95 VAL H . 36787 1 996 . 2 . 2 12 12 VAL HA H 1 4.769 0.030 . 1 . . . . B 95 VAL HA . 36787 1 997 . 2 . 2 12 12 VAL HB H 1 1.895 0.030 . 1 . . . . B 95 VAL HB . 36787 1 998 . 2 . 2 12 12 VAL HG11 H 1 0.676 0.030 . 2 . . . . B 95 VAL HG11 . 36787 1 999 . 2 . 2 12 12 VAL HG12 H 1 0.676 0.030 . 2 . . . . B 95 VAL HG12 . 36787 1 1000 . 2 . 2 12 12 VAL HG13 H 1 0.676 0.030 . 2 . . . . B 95 VAL HG13 . 36787 1 1001 . 2 . 2 12 12 VAL HG21 H 1 0.717 0.030 . 2 . . . . B 95 VAL HG21 . 36787 1 1002 . 2 . 2 12 12 VAL HG22 H 1 0.717 0.030 . 2 . . . . B 95 VAL HG22 . 36787 1 1003 . 2 . 2 12 12 VAL HG23 H 1 0.717 0.030 . 2 . . . . B 95 VAL HG23 . 36787 1 1004 . 2 . 2 12 12 VAL C C 13 174.629 0.300 . 1 . . . . B 95 VAL C . 36787 1 1005 . 2 . 2 12 12 VAL CA C 13 60.471 0.300 . 1 . . . . B 95 VAL CA . 36787 1 1006 . 2 . 2 12 12 VAL CB C 13 33.889 0.300 . 1 . . . . B 95 VAL CB . 36787 1 1007 . 2 . 2 12 12 VAL CG1 C 13 22.562 0.300 . 2 . . . . B 95 VAL CG1 . 36787 1 1008 . 2 . 2 12 12 VAL CG2 C 13 20.780 0.300 . 2 . . . . B 95 VAL CG2 . 36787 1 1009 . 2 . 2 12 12 VAL N N 15 121.714 0.300 . 1 . . . . B 95 VAL N . 36787 1 1010 . 2 . 2 13 13 LYS H H 1 9.040 0.030 . 1 . . . . B 96 LYS H . 36787 1 1011 . 2 . 2 13 13 LYS HA H 1 5.305 0.030 . 1 . . . . B 96 LYS HA . 36787 1 1012 . 2 . 2 13 13 LYS HB2 H 1 1.342 0.030 . 2 . . . . B 96 LYS HB2 . 36787 1 1013 . 2 . 2 13 13 LYS HB3 H 1 1.675 0.030 . 2 . . . . B 96 LYS HB3 . 36787 1 1014 . 2 . 2 13 13 LYS HD2 H 1 1.575 0.030 . 1 . . . . B 96 LYS HD2 . 36787 1 1015 . 2 . 2 13 13 LYS HD3 H 1 1.575 0.030 . 1 . . . . B 96 LYS HD3 . 36787 1 1016 . 2 . 2 13 13 LYS HE2 H 1 2.886 0.030 . 1 . . . . B 96 LYS HE2 . 36787 1 1017 . 2 . 2 13 13 LYS HE3 H 1 2.886 0.030 . 1 . . . . B 96 LYS HE3 . 36787 1 1018 . 2 . 2 13 13 LYS HG2 H 1 1.256 0.030 . 2 . . . . B 96 LYS HG2 . 36787 1 1019 . 2 . 2 13 13 LYS HG3 H 1 1.494 0.030 . 2 . . . . B 96 LYS HG3 . 36787 1 1020 . 2 . 2 13 13 LYS C C 13 177.031 0.300 . 1 . . . . B 96 LYS C . 36787 1 1021 . 2 . 2 13 13 LYS CA C 13 54.731 0.300 . 1 . . . . B 96 LYS CA . 36787 1 1022 . 2 . 2 13 13 LYS CB C 13 34.837 0.300 . 1 . . . . B 96 LYS CB . 36787 1 1023 . 2 . 2 13 13 LYS CD C 13 29.423 0.300 . 1 . . . . B 96 LYS CD . 36787 1 1024 . 2 . 2 13 13 LYS CE C 13 41.948 0.300 . 1 . . . . B 96 LYS CE . 36787 1 1025 . 2 . 2 13 13 LYS CG C 13 25.086 0.300 . 1 . . . . B 96 LYS CG . 36787 1 1026 . 2 . 2 13 13 LYS N N 15 128.411 0.300 . 1 . . . . B 96 LYS N . 36787 1 1027 . 2 . 2 14 14 THR H H 1 8.759 0.030 . 1 . . . . B 97 THR H . 36787 1 1028 . 2 . 2 14 14 THR HA H 1 5.037 0.030 . 1 . . . . B 97 THR HA . 36787 1 1029 . 2 . 2 14 14 THR HB H 1 4.781 0.030 . 1 . . . . B 97 THR HB . 36787 1 1030 . 2 . 2 14 14 THR HG21 H 1 1.176 0.030 . 1 . . . . B 97 THR HG21 . 36787 1 1031 . 2 . 2 14 14 THR HG22 H 1 1.176 0.030 . 1 . . . . B 97 THR HG22 . 36787 1 1032 . 2 . 2 14 14 THR HG23 H 1 1.176 0.030 . 1 . . . . B 97 THR HG23 . 36787 1 1033 . 2 . 2 14 14 THR C C 13 176.836 0.300 . 1 . . . . B 97 THR C . 36787 1 1034 . 2 . 2 14 14 THR CA C 13 60.383 0.300 . 1 . . . . B 97 THR CA . 36787 1 1035 . 2 . 2 14 14 THR CB C 13 70.318 0.300 . 1 . . . . B 97 THR CB . 36787 1 1036 . 2 . 2 14 14 THR CG2 C 13 21.389 0.300 . 1 . . . . B 97 THR CG2 . 36787 1 1037 . 2 . 2 14 14 THR N N 15 115.561 0.300 . 1 . . . . B 97 THR N . 36787 1 1038 . 2 . 2 15 15 LEU H H 1 9.246 0.030 . 1 . . . . B 98 LEU H . 36787 1 1039 . 2 . 2 15 15 LEU HA H 1 4.351 0.030 . 1 . . . . B 98 LEU HA . 36787 1 1040 . 2 . 2 15 15 LEU HB2 H 1 1.747 0.030 . 2 . . . . B 98 LEU HB2 . 36787 1 1041 . 2 . 2 15 15 LEU HB3 H 1 1.904 0.030 . 2 . . . . B 98 LEU HB3 . 36787 1 1042 . 2 . 2 15 15 LEU HD11 H 1 1.004 0.030 . 2 . . . . B 98 LEU HD11 . 36787 1 1043 . 2 . 2 15 15 LEU HD12 H 1 1.004 0.030 . 2 . . . . B 98 LEU HD12 . 36787 1 1044 . 2 . 2 15 15 LEU HD13 H 1 1.004 0.030 . 2 . . . . B 98 LEU HD13 . 36787 1 1045 . 2 . 2 15 15 LEU HD21 H 1 0.952 0.030 . 2 . . . . B 98 LEU HD21 . 36787 1 1046 . 2 . 2 15 15 LEU HD22 H 1 0.952 0.030 . 2 . . . . B 98 LEU HD22 . 36787 1 1047 . 2 . 2 15 15 LEU HD23 H 1 0.952 0.030 . 2 . . . . B 98 LEU HD23 . 36787 1 1048 . 2 . 2 15 15 LEU HG H 1 1.907 0.030 . 1 . . . . B 98 LEU HG . 36787 1 1049 . 2 . 2 15 15 LEU C C 13 178.488 0.300 . 1 . . . . B 98 LEU C . 36787 1 1050 . 2 . 2 15 15 LEU CA C 13 57.146 0.300 . 1 . . . . B 98 LEU CA . 36787 1 1051 . 2 . 2 15 15 LEU CB C 13 41.584 0.300 . 1 . . . . B 98 LEU CB . 36787 1 1052 . 2 . 2 15 15 LEU CD1 C 13 25.653 0.300 . 2 . . . . B 98 LEU CD1 . 36787 1 1053 . 2 . 2 15 15 LEU CD2 C 13 23.460 0.300 . 2 . . . . B 98 LEU CD2 . 36787 1 1054 . 2 . 2 15 15 LEU CG C 13 27.377 0.300 . 1 . . . . B 98 LEU CG . 36787 1 1055 . 2 . 2 15 15 LEU N N 15 121.234 0.300 . 1 . . . . B 98 LEU N . 36787 1 1056 . 2 . 2 16 16 THR H H 1 7.678 0.030 . 1 . . . . B 99 THR H . 36787 1 1057 . 2 . 2 16 16 THR HA H 1 4.422 0.030 . 1 . . . . B 99 THR HA . 36787 1 1058 . 2 . 2 16 16 THR HB H 1 4.585 0.030 . 1 . . . . B 99 THR HB . 36787 1 1059 . 2 . 2 16 16 THR HG21 H 1 1.242 0.030 . 1 . . . . B 99 THR HG21 . 36787 1 1060 . 2 . 2 16 16 THR HG22 H 1 1.242 0.030 . 1 . . . . B 99 THR HG22 . 36787 1 1061 . 2 . 2 16 16 THR HG23 H 1 1.242 0.030 . 1 . . . . B 99 THR HG23 . 36787 1 1062 . 2 . 2 16 16 THR C C 13 175.377 0.300 . 1 . . . . B 99 THR C . 36787 1 1063 . 2 . 2 16 16 THR CA C 13 61.418 0.300 . 1 . . . . B 99 THR CA . 36787 1 1064 . 2 . 2 16 16 THR CB C 13 69.066 0.300 . 1 . . . . B 99 THR CB . 36787 1 1065 . 2 . 2 16 16 THR CG2 C 13 21.906 0.300 . 1 . . . . B 99 THR CG2 . 36787 1 1066 . 2 . 2 16 16 THR N N 15 106.028 0.300 . 1 . . . . B 99 THR N . 36787 1 1067 . 2 . 2 17 17 GLY H H 1 7.821 0.030 . 1 . . . . B 100 GLY H . 36787 1 1068 . 2 . 2 17 17 GLY HA2 H 1 3.621 0.030 . 2 . . . . B 100 GLY HA2 . 36787 1 1069 . 2 . 2 17 17 GLY HA3 H 1 4.309 0.030 . 2 . . . . B 100 GLY HA3 . 36787 1 1070 . 2 . 2 17 17 GLY C C 13 173.899 0.300 . 1 . . . . B 100 GLY C . 36787 1 1071 . 2 . 2 17 17 GLY CA C 13 45.478 0.300 . 1 . . . . B 100 GLY CA . 36787 1 1072 . 2 . 2 17 17 GLY N N 15 109.336 0.300 . 1 . . . . B 100 GLY N . 36787 1 1073 . 2 . 2 18 18 LYS H H 1 7.333 0.030 . 1 . . . . B 101 LYS H . 36787 1 1074 . 2 . 2 18 18 LYS HA H 1 4.366 0.030 . 1 . . . . B 101 LYS HA . 36787 1 1075 . 2 . 2 18 18 LYS HB2 H 1 1.688 0.030 . 2 . . . . B 101 LYS HB2 . 36787 1 1076 . 2 . 2 18 18 LYS HB3 H 1 1.791 0.030 . 2 . . . . B 101 LYS HB3 . 36787 1 1077 . 2 . 2 18 18 LYS HD2 H 1 1.606 0.030 . 1 . . . . B 101 LYS HD2 . 36787 1 1078 . 2 . 2 18 18 LYS HD3 H 1 1.606 0.030 . 1 . . . . B 101 LYS HD3 . 36787 1 1079 . 2 . 2 18 18 LYS HE2 H 1 2.874 0.030 . 1 . . . . B 101 LYS HE2 . 36787 1 1080 . 2 . 2 18 18 LYS HE3 H 1 2.874 0.030 . 1 . . . . B 101 LYS HE3 . 36787 1 1081 . 2 . 2 18 18 LYS HG2 H 1 1.215 0.030 . 2 . . . . B 101 LYS HG2 . 36787 1 1082 . 2 . 2 18 18 LYS HG3 H 1 1.380 0.030 . 2 . . . . B 101 LYS HG3 . 36787 1 1083 . 2 . 2 18 18 LYS C C 13 175.656 0.300 . 1 . . . . B 101 LYS C . 36787 1 1084 . 2 . 2 18 18 LYS CA C 13 56.318 0.300 . 1 . . . . B 101 LYS CA . 36787 1 1085 . 2 . 2 18 18 LYS CB C 13 33.549 0.300 . 1 . . . . B 101 LYS CB . 36787 1 1086 . 2 . 2 18 18 LYS CD C 13 29.366 0.300 . 1 . . . . B 101 LYS CD . 36787 1 1087 . 2 . 2 18 18 LYS CE C 13 41.881 0.300 . 1 . . . . B 101 LYS CE . 36787 1 1088 . 2 . 2 18 18 LYS CG C 13 25.150 0.300 . 1 . . . . B 101 LYS CG . 36787 1 1089 . 2 . 2 18 18 LYS N N 15 122.150 0.300 . 1 . . . . B 101 LYS N . 36787 1 1090 . 2 . 2 19 19 THR H H 1 8.637 0.030 . 1 . . . . B 102 THR H . 36787 1 1091 . 2 . 2 19 19 THR HA H 1 5.044 0.030 . 1 . . . . B 102 THR HA . 36787 1 1092 . 2 . 2 19 19 THR HB H 1 3.914 0.030 . 1 . . . . B 102 THR HB . 36787 1 1093 . 2 . 2 19 19 THR HG21 H 1 1.047 0.030 . 1 . . . . B 102 THR HG21 . 36787 1 1094 . 2 . 2 19 19 THR HG22 H 1 1.047 0.030 . 1 . . . . B 102 THR HG22 . 36787 1 1095 . 2 . 2 19 19 THR HG23 H 1 1.047 0.030 . 1 . . . . B 102 THR HG23 . 36787 1 1096 . 2 . 2 19 19 THR C C 13 174.094 0.300 . 1 . . . . B 102 THR C . 36787 1 1097 . 2 . 2 19 19 THR CA C 13 62.321 0.300 . 1 . . . . B 102 THR CA . 36787 1 1098 . 2 . 2 19 19 THR CB C 13 69.898 0.300 . 1 . . . . B 102 THR CB . 36787 1 1099 . 2 . 2 19 19 THR CG2 C 13 21.917 0.300 . 1 . . . . B 102 THR CG2 . 36787 1 1100 . 2 . 2 19 19 THR N N 15 120.838 0.300 . 1 . . . . B 102 THR N . 36787 1 1101 . 2 . 2 20 20 ILE H H 1 9.620 0.030 . 1 . . . . B 103 ILE H . 36787 1 1102 . 2 . 2 20 20 ILE HA H 1 4.446 0.030 . 1 . . . . B 103 ILE HA . 36787 1 1103 . 2 . 2 20 20 ILE HB H 1 1.847 0.030 . 1 . . . . B 103 ILE HB . 36787 1 1104 . 2 . 2 20 20 ILE HD11 H 1 0.701 0.030 . 1 . . . . B 103 ILE HD11 . 36787 1 1105 . 2 . 2 20 20 ILE HD12 H 1 0.701 0.030 . 1 . . . . B 103 ILE HD12 . 36787 1 1106 . 2 . 2 20 20 ILE HD13 H 1 0.701 0.030 . 1 . . . . B 103 ILE HD13 . 36787 1 1107 . 2 . 2 20 20 ILE HG12 H 1 1.070 0.030 . 2 . . . . B 103 ILE HG12 . 36787 1 1108 . 2 . 2 20 20 ILE HG13 H 1 1.441 0.030 . 2 . . . . B 103 ILE HG13 . 36787 1 1109 . 2 . 2 20 20 ILE HG21 H 1 0.858 0.030 . 1 . . . . B 103 ILE HG21 . 36787 1 1110 . 2 . 2 20 20 ILE HG22 H 1 0.858 0.030 . 1 . . . . B 103 ILE HG22 . 36787 1 1111 . 2 . 2 20 20 ILE HG23 H 1 0.858 0.030 . 1 . . . . B 103 ILE HG23 . 36787 1 1112 . 2 . 2 20 20 ILE C C 13 175.106 0.300 . 1 . . . . B 103 ILE C . 36787 1 1113 . 2 . 2 20 20 ILE CA C 13 60.117 0.300 . 1 . . . . B 103 ILE CA . 36787 1 1114 . 2 . 2 20 20 ILE CB C 13 40.903 0.300 . 1 . . . . B 103 ILE CB . 36787 1 1115 . 2 . 2 20 20 ILE CD1 C 13 14.529 0.300 . 1 . . . . B 103 ILE CD1 . 36787 1 1116 . 2 . 2 20 20 ILE CG1 C 13 26.999 0.300 . 1 . . . . B 103 ILE CG1 . 36787 1 1117 . 2 . 2 20 20 ILE CG2 C 13 17.771 0.300 . 1 . . . . B 103 ILE CG2 . 36787 1 1118 . 2 . 2 20 20 ILE N N 15 128.637 0.300 . 1 . . . . B 103 ILE N . 36787 1 1119 . 2 . 2 21 21 THR H H 1 8.780 0.030 . 1 . . . . B 104 THR H . 36787 1 1120 . 2 . 2 21 21 THR HA H 1 4.925 0.030 . 1 . . . . B 104 THR HA . 36787 1 1121 . 2 . 2 21 21 THR HB H 1 4.013 0.030 . 1 . . . . B 104 THR HB . 36787 1 1122 . 2 . 2 21 21 THR HG21 H 1 1.087 0.030 . 1 . . . . B 104 THR HG21 . 36787 1 1123 . 2 . 2 21 21 THR HG22 H 1 1.087 0.030 . 1 . . . . B 104 THR HG22 . 36787 1 1124 . 2 . 2 21 21 THR HG23 H 1 1.087 0.030 . 1 . . . . B 104 THR HG23 . 36787 1 1125 . 2 . 2 21 21 THR C C 13 173.650 0.300 . 1 . . . . B 104 THR C . 36787 1 1126 . 2 . 2 21 21 THR CA C 13 62.311 0.300 . 1 . . . . B 104 THR CA . 36787 1 1127 . 2 . 2 21 21 THR CB C 13 69.575 0.300 . 1 . . . . B 104 THR CB . 36787 1 1128 . 2 . 2 21 21 THR CG2 C 13 21.759 0.300 . 1 . . . . B 104 THR CG2 . 36787 1 1129 . 2 . 2 21 21 THR N N 15 122.618 0.300 . 1 . . . . B 104 THR N . 36787 1 1130 . 2 . 2 22 22 LEU H H 1 8.798 0.030 . 1 . . . . B 105 LEU H . 36787 1 1131 . 2 . 2 22 22 LEU HA H 1 4.770 0.030 . 1 . . . . B 105 LEU HA . 36787 1 1132 . 2 . 2 22 22 LEU HB2 H 1 1.200 0.030 . 2 . . . . B 105 LEU HB2 . 36787 1 1133 . 2 . 2 22 22 LEU HB3 H 1 1.354 0.030 . 2 . . . . B 105 LEU HB3 . 36787 1 1134 . 2 . 2 22 22 LEU HD11 H 1 0.703 0.030 . 2 . . . . B 105 LEU HD11 . 36787 1 1135 . 2 . 2 22 22 LEU HD12 H 1 0.703 0.030 . 2 . . . . B 105 LEU HD12 . 36787 1 1136 . 2 . 2 22 22 LEU HD13 H 1 0.703 0.030 . 2 . . . . B 105 LEU HD13 . 36787 1 1137 . 2 . 2 22 22 LEU HD21 H 1 0.744 0.030 . 2 . . . . B 105 LEU HD21 . 36787 1 1138 . 2 . 2 22 22 LEU HD22 H 1 0.744 0.030 . 2 . . . . B 105 LEU HD22 . 36787 1 1139 . 2 . 2 22 22 LEU HD23 H 1 0.744 0.030 . 2 . . . . B 105 LEU HD23 . 36787 1 1140 . 2 . 2 22 22 LEU HG H 1 1.451 0.030 . 1 . . . . B 105 LEU HG . 36787 1 1141 . 2 . 2 22 22 LEU C C 13 174.870 0.300 . 1 . . . . B 105 LEU C . 36787 1 1142 . 2 . 2 22 22 LEU CA C 13 52.556 0.300 . 1 . . . . B 105 LEU CA . 36787 1 1143 . 2 . 2 22 22 LEU CB C 13 46.621 0.300 . 1 . . . . B 105 LEU CB . 36787 1 1144 . 2 . 2 22 22 LEU CD1 C 13 27.132 0.300 . 2 . . . . B 105 LEU CD1 . 36787 1 1145 . 2 . 2 22 22 LEU CD2 C 13 24.185 0.300 . 2 . . . . B 105 LEU CD2 . 36787 1 1146 . 2 . 2 22 22 LEU CG C 13 27.310 0.300 . 1 . . . . B 105 LEU CG . 36787 1 1147 . 2 . 2 22 22 LEU N N 15 125.483 0.300 . 1 . . . . B 105 LEU N . 36787 1 1148 . 2 . 2 23 23 GLU H H 1 8.171 0.030 . 1 . . . . B 106 GLU H . 36787 1 1149 . 2 . 2 23 23 GLU HA H 1 4.758 0.030 . 1 . . . . B 106 GLU HA . 36787 1 1150 . 2 . 2 23 23 GLU HB2 H 1 1.889 0.030 . 2 . . . . B 106 GLU HB2 . 36787 1 1151 . 2 . 2 23 23 GLU HB3 H 1 1.963 0.030 . 2 . . . . B 106 GLU HB3 . 36787 1 1152 . 2 . 2 23 23 GLU HG2 H 1 2.167 0.030 . 1 . . . . B 106 GLU HG2 . 36787 1 1153 . 2 . 2 23 23 GLU HG3 H 1 2.167 0.030 . 1 . . . . B 106 GLU HG3 . 36787 1 1154 . 2 . 2 23 23 GLU C C 13 175.822 0.300 . 1 . . . . B 106 GLU C . 36787 1 1155 . 2 . 2 23 23 GLU CA C 13 55.591 0.300 . 1 . . . . B 106 GLU CA . 36787 1 1156 . 2 . 2 23 23 GLU CB C 13 29.831 0.300 . 1 . . . . B 106 GLU CB . 36787 1 1157 . 2 . 2 23 23 GLU CG C 13 36.392 0.300 . 1 . . . . B 106 GLU CG . 36787 1 1158 . 2 . 2 23 23 GLU N N 15 122.217 0.300 . 1 . . . . B 106 GLU N . 36787 1 1159 . 2 . 2 24 24 VAL H H 1 8.597 0.030 . 1 . . . . B 107 VAL H . 36787 1 1160 . 2 . 2 24 24 VAL HA H 1 4.698 0.030 . 1 . . . . B 107 VAL HA . 36787 1 1161 . 2 . 2 24 24 VAL HB H 1 2.347 0.030 . 1 . . . . B 107 VAL HB . 36787 1 1162 . 2 . 2 24 24 VAL HG11 H 1 0.677 0.030 . 2 . . . . B 107 VAL HG11 . 36787 1 1163 . 2 . 2 24 24 VAL HG12 H 1 0.677 0.030 . 2 . . . . B 107 VAL HG12 . 36787 1 1164 . 2 . 2 24 24 VAL HG13 H 1 0.677 0.030 . 2 . . . . B 107 VAL HG13 . 36787 1 1165 . 2 . 2 24 24 VAL HG21 H 1 0.429 0.030 . 2 . . . . B 107 VAL HG21 . 36787 1 1166 . 2 . 2 24 24 VAL HG22 H 1 0.429 0.030 . 2 . . . . B 107 VAL HG22 . 36787 1 1167 . 2 . 2 24 24 VAL HG23 H 1 0.429 0.030 . 2 . . . . B 107 VAL HG23 . 36787 1 1168 . 2 . 2 24 24 VAL C C 13 173.684 0.300 . 1 . . . . B 107 VAL C . 36787 1 1169 . 2 . 2 24 24 VAL CA C 13 58.559 0.300 . 1 . . . . B 107 VAL CA . 36787 1 1170 . 2 . 2 24 24 VAL CB C 13 36.356 0.300 . 1 . . . . B 107 VAL CB . 36787 1 1171 . 2 . 2 24 24 VAL CG1 C 13 22.167 0.300 . 2 . . . . B 107 VAL CG1 . 36787 1 1172 . 2 . 2 24 24 VAL CG2 C 13 19.001 0.300 . 2 . . . . B 107 VAL CG2 . 36787 1 1173 . 2 . 2 24 24 VAL N N 15 116.541 0.300 . 1 . . . . B 107 VAL N . 36787 1 1174 . 2 . 2 25 25 GLU H H 1 8.490 0.030 . 1 . . . . B 108 GLU H . 36787 1 1175 . 2 . 2 25 25 GLU HA H 1 4.921 0.030 . 1 . . . . B 108 GLU HA . 36787 1 1176 . 2 . 2 25 25 GLU HB2 H 1 1.632 0.030 . 2 . . . . B 108 GLU HB2 . 36787 1 1177 . 2 . 2 25 25 GLU HB3 H 1 2.098 0.030 . 2 . . . . B 108 GLU HB3 . 36787 1 1178 . 2 . 2 25 25 GLU HG2 H 1 2.174 0.030 . 2 . . . . B 108 GLU HG2 . 36787 1 1179 . 2 . 2 25 25 GLU HG3 H 1 2.278 0.030 . 2 . . . . B 108 GLU HG3 . 36787 1 1180 . 2 . 2 25 25 GLU C C 13 175.902 0.300 . 1 . . . . B 108 GLU C . 36787 1 1181 . 2 . 2 25 25 GLU CA C 13 53.299 0.300 . 1 . . . . B 108 GLU CA . 36787 1 1182 . 2 . 2 25 25 GLU CB C 13 31.249 0.300 . 1 . . . . B 108 GLU CB . 36787 1 1183 . 2 . 2 25 25 GLU CG C 13 35.818 0.300 . 1 . . . . B 108 GLU CG . 36787 1 1184 . 2 . 2 25 25 GLU N N 15 118.019 0.300 . 1 . . . . B 108 GLU N . 36787 1 1185 . 2 . 2 26 26 PRO HA H 1 4.104 0.030 . 1 . . . . B 109 PRO HA . 36787 1 1186 . 2 . 2 26 26 PRO HB2 H 1 2.405 0.030 . 2 . . . . B 109 PRO HB2 . 36787 1 1187 . 2 . 2 26 26 PRO HB3 H 1 1.981 0.030 . 2 . . . . B 109 PRO HB3 . 36787 1 1188 . 2 . 2 26 26 PRO HD2 H 1 3.801 0.030 . 2 . . . . B 109 PRO HD2 . 36787 1 1189 . 2 . 2 26 26 PRO HD3 H 1 3.933 0.030 . 2 . . . . B 109 PRO HD3 . 36787 1 1190 . 2 . 2 26 26 PRO HG2 H 1 2.484 0.030 . 2 . . . . B 109 PRO HG2 . 36787 1 1191 . 2 . 2 26 26 PRO HG3 H 1 1.974 0.030 . 2 . . . . B 109 PRO HG3 . 36787 1 1192 . 2 . 2 26 26 PRO C C 13 175.303 0.300 . 1 . . . . B 109 PRO C . 36787 1 1193 . 2 . 2 26 26 PRO CA C 13 65.446 0.300 . 1 . . . . B 109 PRO CA . 36787 1 1194 . 2 . 2 26 26 PRO CB C 13 31.862 0.300 . 1 . . . . B 109 PRO CB . 36787 1 1195 . 2 . 2 26 26 PRO CD C 13 50.552 0.300 . 1 . . . . B 109 PRO CD . 36787 1 1196 . 2 . 2 26 26 PRO CG C 13 27.752 0.300 . 1 . . . . B 109 PRO CG . 36787 1 1197 . 2 . 2 27 27 SER H H 1 7.085 0.030 . 1 . . . . B 110 SER H . 36787 1 1198 . 2 . 2 27 27 SER HA H 1 4.358 0.030 . 1 . . . . B 110 SER HA . 36787 1 1199 . 2 . 2 27 27 SER HB2 H 1 3.779 0.030 . 2 . . . . B 110 SER HB2 . 36787 1 1200 . 2 . 2 27 27 SER HB3 H 1 4.136 0.030 . 2 . . . . B 110 SER HB3 . 36787 1 1201 . 2 . 2 27 27 SER C C 13 174.572 0.300 . 1 . . . . B 110 SER C . 36787 1 1202 . 2 . 2 27 27 SER CA C 13 57.429 0.300 . 1 . . . . B 110 SER CA . 36787 1 1203 . 2 . 2 27 27 SER CB C 13 63.467 0.300 . 1 . . . . B 110 SER CB . 36787 1 1204 . 2 . 2 27 27 SER N N 15 103.694 0.300 . 1 . . . . B 110 SER N . 36787 1 1205 . 2 . 2 28 28 ASP H H 1 8.052 0.030 . 1 . . . . B 111 ASP H . 36787 1 1206 . 2 . 2 28 28 ASP HA H 1 4.662 0.030 . 1 . . . . B 111 ASP HA . 36787 1 1207 . 2 . 2 28 28 ASP HB2 H 1 2.929 0.030 . 2 . . . . B 111 ASP HB2 . 36787 1 1208 . 2 . 2 28 28 ASP HB3 H 1 2.481 0.030 . 2 . . . . B 111 ASP HB3 . 36787 1 1209 . 2 . 2 28 28 ASP C C 13 176.312 0.300 . 1 . . . . B 111 ASP C . 36787 1 1210 . 2 . 2 28 28 ASP CA C 13 56.059 0.300 . 1 . . . . B 111 ASP CA . 36787 1 1211 . 2 . 2 28 28 ASP CB C 13 40.937 0.300 . 1 . . . . B 111 ASP CB . 36787 1 1212 . 2 . 2 28 28 ASP N N 15 123.988 0.300 . 1 . . . . B 111 ASP N . 36787 1 1213 . 2 . 2 29 29 THR H H 1 7.849 0.030 . 1 . . . . B 112 THR H . 36787 1 1214 . 2 . 2 29 29 THR HA H 1 4.904 0.030 . 1 . . . . B 112 THR HA . 36787 1 1215 . 2 . 2 29 29 THR HB H 1 4.772 0.030 . 1 . . . . B 112 THR HB . 36787 1 1216 . 2 . 2 29 29 THR HG21 H 1 1.245 0.030 . 1 . . . . B 112 THR HG21 . 36787 1 1217 . 2 . 2 29 29 THR HG22 H 1 1.245 0.030 . 1 . . . . B 112 THR HG22 . 36787 1 1218 . 2 . 2 29 29 THR HG23 H 1 1.245 0.030 . 1 . . . . B 112 THR HG23 . 36787 1 1219 . 2 . 2 29 29 THR C C 13 176.584 0.300 . 1 . . . . B 112 THR C . 36787 1 1220 . 2 . 2 29 29 THR CA C 13 59.580 0.300 . 1 . . . . B 112 THR CA . 36787 1 1221 . 2 . 2 29 29 THR CB C 13 71.141 0.300 . 1 . . . . B 112 THR CB . 36787 1 1222 . 2 . 2 29 29 THR CG2 C 13 22.256 0.300 . 1 . . . . B 112 THR CG2 . 36787 1 1223 . 2 . 2 29 29 THR N N 15 109.198 0.300 . 1 . . . . B 112 THR N . 36787 1 1224 . 2 . 2 30 30 ILE H H 1 8.545 0.030 . 1 . . . . B 113 ILE H . 36787 1 1225 . 2 . 2 30 30 ILE HA H 1 3.640 0.030 . 1 . . . . B 113 ILE HA . 36787 1 1226 . 2 . 2 30 30 ILE HB H 1 2.541 0.030 . 1 . . . . B 113 ILE HB . 36787 1 1227 . 2 . 2 30 30 ILE HD11 H 1 0.552 0.030 . 1 . . . . B 113 ILE HD11 . 36787 1 1228 . 2 . 2 30 30 ILE HD12 H 1 0.552 0.030 . 1 . . . . B 113 ILE HD12 . 36787 1 1229 . 2 . 2 30 30 ILE HD13 H 1 0.552 0.030 . 1 . . . . B 113 ILE HD13 . 36787 1 1230 . 2 . 2 30 30 ILE HG12 H 1 1.289 0.030 . 2 . . . . B 113 ILE HG12 . 36787 1 1231 . 2 . 2 30 30 ILE HG13 H 1 1.907 0.030 . 2 . . . . B 113 ILE HG13 . 36787 1 1232 . 2 . 2 30 30 ILE HG21 H 1 0.775 0.030 . 1 . . . . B 113 ILE HG21 . 36787 1 1233 . 2 . 2 30 30 ILE HG22 H 1 0.775 0.030 . 1 . . . . B 113 ILE HG22 . 36787 1 1234 . 2 . 2 30 30 ILE HG23 H 1 0.775 0.030 . 1 . . . . B 113 ILE HG23 . 36787 1 1235 . 2 . 2 30 30 ILE C C 13 178.843 0.300 . 1 . . . . B 113 ILE C . 36787 1 1236 . 2 . 2 30 30 ILE CA C 13 62.318 0.300 . 1 . . . . B 113 ILE CA . 36787 1 1237 . 2 . 2 30 30 ILE CB C 13 34.465 0.300 . 1 . . . . B 113 ILE CB . 36787 1 1238 . 2 . 2 30 30 ILE CD1 C 13 9.243 0.300 . 1 . . . . B 113 ILE CD1 . 36787 1 1239 . 2 . 2 30 30 ILE CG1 C 13 27.732 0.300 . 1 . . . . B 113 ILE CG1 . 36787 1 1240 . 2 . 2 30 30 ILE CG2 C 13 18.069 0.300 . 1 . . . . B 113 ILE CG2 . 36787 1 1241 . 2 . 2 30 30 ILE N N 15 121.617 0.300 . 1 . . . . B 113 ILE N . 36787 1 1242 . 2 . 2 31 31 GLU H H 1 9.911 0.030 . 1 . . . . B 114 GLU H . 36787 1 1243 . 2 . 2 31 31 GLU HA H 1 3.834 0.030 . 1 . . . . B 114 GLU HA . 36787 1 1244 . 2 . 2 31 31 GLU HB2 H 1 2.016 0.030 . 1 . . . . B 114 GLU HB2 . 36787 1 1245 . 2 . 2 31 31 GLU HB3 H 1 2.016 0.030 . 1 . . . . B 114 GLU HB3 . 36787 1 1246 . 2 . 2 31 31 GLU HG2 H 1 2.279 0.030 . 1 . . . . B 114 GLU HG2 . 36787 1 1247 . 2 . 2 31 31 GLU HG3 H 1 2.279 0.030 . 1 . . . . B 114 GLU HG3 . 36787 1 1248 . 2 . 2 31 31 GLU C C 13 178.831 0.300 . 1 . . . . B 114 GLU C . 36787 1 1249 . 2 . 2 31 31 GLU CA C 13 60.286 0.300 . 1 . . . . B 114 GLU CA . 36787 1 1250 . 2 . 2 31 31 GLU CB C 13 28.955 0.300 . 1 . . . . B 114 GLU CB . 36787 1 1251 . 2 . 2 31 31 GLU CG C 13 36.109 0.300 . 1 . . . . B 114 GLU CG . 36787 1 1252 . 2 . 2 32 32 ASN H H 1 7.947 0.030 . 1 . . . . B 115 ASN H . 36787 1 1253 . 2 . 2 32 32 ASN HA H 1 4.533 0.030 . 1 . . . . B 115 ASN HA . 36787 1 1254 . 2 . 2 32 32 ASN HB2 H 1 3.224 0.030 . 2 . . . . B 115 ASN HB2 . 36787 1 1255 . 2 . 2 32 32 ASN HB3 H 1 2.823 0.030 . 2 . . . . B 115 ASN HB3 . 36787 1 1256 . 2 . 2 32 32 ASN HD21 H 1 6.904 0.030 . 2 . . . . B 115 ASN HD21 . 36787 1 1257 . 2 . 2 32 32 ASN HD22 H 1 7.886 0.030 . 2 . . . . B 115 ASN HD22 . 36787 1 1258 . 2 . 2 32 32 ASN C C 13 178.278 0.300 . 1 . . . . B 115 ASN C . 36787 1 1259 . 2 . 2 32 32 ASN CA C 13 55.845 0.300 . 1 . . . . B 115 ASN CA . 36787 1 1260 . 2 . 2 32 32 ASN CB C 13 38.330 0.300 . 1 . . . . B 115 ASN CB . 36787 1 1261 . 2 . 2 32 32 ASN N N 15 121.250 0.300 . 1 . . . . B 115 ASN N . 36787 1 1262 . 2 . 2 32 32 ASN ND2 N 15 109.875 0.300 . 1 . . . . B 115 ASN ND2 . 36787 1 1263 . 2 . 2 33 33 VAL H H 1 8.151 0.030 . 1 . . . . B 116 VAL H . 36787 1 1264 . 2 . 2 33 33 VAL HA H 1 3.379 0.030 . 1 . . . . B 116 VAL HA . 36787 1 1265 . 2 . 2 33 33 VAL HB H 1 2.330 0.030 . 1 . . . . B 116 VAL HB . 36787 1 1266 . 2 . 2 33 33 VAL HG11 H 1 0.964 0.030 . 2 . . . . B 116 VAL HG11 . 36787 1 1267 . 2 . 2 33 33 VAL HG12 H 1 0.964 0.030 . 2 . . . . B 116 VAL HG12 . 36787 1 1268 . 2 . 2 33 33 VAL HG13 H 1 0.964 0.030 . 2 . . . . B 116 VAL HG13 . 36787 1 1269 . 2 . 2 33 33 VAL HG21 H 1 0.685 0.030 . 2 . . . . B 116 VAL HG21 . 36787 1 1270 . 2 . 2 33 33 VAL HG22 H 1 0.685 0.030 . 2 . . . . B 116 VAL HG22 . 36787 1 1271 . 2 . 2 33 33 VAL HG23 H 1 0.685 0.030 . 2 . . . . B 116 VAL HG23 . 36787 1 1272 . 2 . 2 33 33 VAL C C 13 177.732 0.300 . 1 . . . . B 116 VAL C . 36787 1 1273 . 2 . 2 33 33 VAL CA C 13 67.705 0.300 . 1 . . . . B 116 VAL CA . 36787 1 1274 . 2 . 2 33 33 VAL CB C 13 30.806 0.300 . 1 . . . . B 116 VAL CB . 36787 1 1275 . 2 . 2 33 33 VAL CG1 C 13 23.610 0.300 . 2 . . . . B 116 VAL CG1 . 36787 1 1276 . 2 . 2 33 33 VAL CG2 C 13 21.554 0.300 . 2 . . . . B 116 VAL CG2 . 36787 1 1277 . 2 . 2 33 33 VAL N N 15 122.358 0.300 . 1 . . . . B 116 VAL N . 36787 1 1278 . 2 . 2 34 34 LYS H H 1 8.548 0.030 . 1 . . . . B 117 LYS H . 36787 1 1279 . 2 . 2 34 34 LYS HA H 1 4.581 0.030 . 1 . . . . B 117 LYS HA . 36787 1 1280 . 2 . 2 34 34 LYS HB2 H 1 1.432 0.030 . 2 . . . . B 117 LYS HB2 . 36787 1 1281 . 2 . 2 34 34 LYS HB3 H 1 1.991 0.030 . 2 . . . . B 117 LYS HB3 . 36787 1 1282 . 2 . 2 34 34 LYS HD2 H 1 1.633 0.030 . 2 . . . . B 117 LYS HD2 . 36787 1 1283 . 2 . 2 34 34 LYS HD3 H 1 1.694 0.030 . 2 . . . . B 117 LYS HD3 . 36787 1 1284 . 2 . 2 34 34 LYS HE2 H 1 2.594 0.030 . 2 . . . . B 117 LYS HE2 . 36787 1 1285 . 2 . 2 34 34 LYS HE3 H 1 2.622 0.030 . 2 . . . . B 117 LYS HE3 . 36787 1 1286 . 2 . 2 34 34 LYS HG2 H 1 1.393 0.030 . 2 . . . . B 117 LYS HG2 . 36787 1 1287 . 2 . 2 34 34 LYS HG3 H 1 1.544 0.030 . 2 . . . . B 117 LYS HG3 . 36787 1 1288 . 2 . 2 34 34 LYS C C 13 180.418 0.300 . 1 . . . . B 117 LYS C . 36787 1 1289 . 2 . 2 34 34 LYS CA C 13 59.244 0.300 . 1 . . . . B 117 LYS CA . 36787 1 1290 . 2 . 2 34 34 LYS CB C 13 33.625 0.300 . 1 . . . . B 117 LYS CB . 36787 1 1291 . 2 . 2 34 34 LYS CD C 13 30.369 0.300 . 1 . . . . B 117 LYS CD . 36787 1 1292 . 2 . 2 34 34 LYS CE C 13 42.490 0.300 . 1 . . . . B 117 LYS CE . 36787 1 1293 . 2 . 2 34 34 LYS CG C 13 26.231 0.300 . 1 . . . . B 117 LYS CG . 36787 1 1294 . 2 . 2 34 34 LYS N N 15 119.197 0.300 . 1 . . . . B 117 LYS N . 36787 1 1295 . 2 . 2 35 35 ALA H H 1 7.989 0.030 . 1 . . . . B 118 ALA H . 36787 1 1296 . 2 . 2 35 35 ALA HA H 1 4.141 0.030 . 1 . . . . B 118 ALA HA . 36787 1 1297 . 2 . 2 35 35 ALA HB1 H 1 1.617 0.030 . 1 . . . . B 118 ALA HB1 . 36787 1 1298 . 2 . 2 35 35 ALA HB2 H 1 1.617 0.030 . 1 . . . . B 118 ALA HB2 . 36787 1 1299 . 2 . 2 35 35 ALA HB3 H 1 1.617 0.030 . 1 . . . . B 118 ALA HB3 . 36787 1 1300 . 2 . 2 35 35 ALA C C 13 180.173 0.300 . 1 . . . . B 118 ALA C . 36787 1 1301 . 2 . 2 35 35 ALA CA C 13 55.464 0.300 . 1 . . . . B 118 ALA CA . 36787 1 1302 . 2 . 2 35 35 ALA CB C 13 17.713 0.300 . 1 . . . . B 118 ALA CB . 36787 1 1303 . 2 . 2 35 35 ALA N N 15 123.534 0.300 . 1 . . . . B 118 ALA N . 36787 1 1304 . 2 . 2 36 36 LYS H H 1 7.927 0.030 . 1 . . . . B 119 LYS H . 36787 1 1305 . 2 . 2 36 36 LYS HA H 1 4.186 0.030 . 1 . . . . B 119 LYS HA . 36787 1 1306 . 2 . 2 36 36 LYS HB2 H 1 2.143 0.030 . 2 . . . . B 119 LYS HB2 . 36787 1 1307 . 2 . 2 36 36 LYS HB3 H 1 1.933 0.030 . 2 . . . . B 119 LYS HB3 . 36787 1 1308 . 2 . 2 36 36 LYS HD2 H 1 1.790 0.030 . 2 . . . . B 119 LYS HD2 . 36787 1 1309 . 2 . 2 36 36 LYS HD3 H 1 1.427 0.030 . 2 . . . . B 119 LYS HD3 . 36787 1 1310 . 2 . 2 36 36 LYS HE2 H 1 2.942 0.030 . 2 . . . . B 119 LYS HE2 . 36787 1 1311 . 2 . 2 36 36 LYS HE3 H 1 3.185 0.030 . 2 . . . . B 119 LYS HE3 . 36787 1 1312 . 2 . 2 36 36 LYS HG2 H 1 1.595 0.030 . 2 . . . . B 119 LYS HG2 . 36787 1 1313 . 2 . 2 36 36 LYS HG3 H 1 1.787 0.030 . 2 . . . . B 119 LYS HG3 . 36787 1 1314 . 2 . 2 36 36 LYS C C 13 175.928 0.300 . 1 . . . . B 119 LYS C . 36787 1 1315 . 2 . 2 36 36 LYS CA C 13 59.836 0.300 . 1 . . . . B 119 LYS CA . 36787 1 1316 . 2 . 2 36 36 LYS CB C 13 33.478 0.300 . 1 . . . . B 119 LYS CB . 36787 1 1317 . 2 . 2 36 36 LYS CD C 13 30.365 0.300 . 1 . . . . B 119 LYS CD . 36787 1 1318 . 2 . 2 36 36 LYS CE C 13 42.441 0.300 . 1 . . . . B 119 LYS CE . 36787 1 1319 . 2 . 2 36 36 LYS CG C 13 26.537 0.300 . 1 . . . . B 119 LYS CG . 36787 1 1320 . 2 . 2 36 36 LYS N N 15 120.607 0.300 . 1 . . . . B 119 LYS N . 36787 1 1321 . 2 . 2 37 37 ILE H H 1 8.295 0.030 . 1 . . . . B 120 ILE H . 36787 1 1322 . 2 . 2 37 37 ILE HA H 1 3.486 0.030 . 1 . . . . B 120 ILE HA . 36787 1 1323 . 2 . 2 37 37 ILE HB H 1 2.338 0.030 . 1 . . . . B 120 ILE HB . 36787 1 1324 . 2 . 2 37 37 ILE HD11 H 1 0.882 0.030 . 1 . . . . B 120 ILE HD11 . 36787 1 1325 . 2 . 2 37 37 ILE HD12 H 1 0.882 0.030 . 1 . . . . B 120 ILE HD12 . 36787 1 1326 . 2 . 2 37 37 ILE HD13 H 1 0.882 0.030 . 1 . . . . B 120 ILE HD13 . 36787 1 1327 . 2 . 2 37 37 ILE HG12 H 1 0.677 0.030 . 2 . . . . B 120 ILE HG12 . 36787 1 1328 . 2 . 2 37 37 ILE HG13 H 1 2.002 0.030 . 2 . . . . B 120 ILE HG13 . 36787 1 1329 . 2 . 2 37 37 ILE HG21 H 1 0.679 0.030 . 1 . . . . B 120 ILE HG21 . 36787 1 1330 . 2 . 2 37 37 ILE HG22 H 1 0.679 0.030 . 1 . . . . B 120 ILE HG22 . 36787 1 1331 . 2 . 2 37 37 ILE HG23 H 1 0.679 0.030 . 1 . . . . B 120 ILE HG23 . 36787 1 1332 . 2 . 2 37 37 ILE C C 13 178.093 0.300 . 1 . . . . B 120 ILE C . 36787 1 1333 . 2 . 2 37 37 ILE CA C 13 66.171 0.300 . 1 . . . . B 120 ILE CA . 36787 1 1334 . 2 . 2 37 37 ILE CB C 13 36.813 0.300 . 1 . . . . B 120 ILE CB . 36787 1 1335 . 2 . 2 37 37 ILE CD1 C 13 15.156 0.300 . 1 . . . . B 120 ILE CD1 . 36787 1 1336 . 2 . 2 37 37 ILE CG1 C 13 31.172 0.300 . 1 . . . . B 120 ILE CG1 . 36787 1 1337 . 2 . 2 37 37 ILE CG2 C 13 17.053 0.300 . 1 . . . . B 120 ILE CG2 . 36787 1 1338 . 2 . 2 37 37 ILE N N 15 121.513 0.300 . 1 . . . . B 120 ILE N . 36787 1 1339 . 2 . 2 38 38 GLN H H 1 8.520 0.030 . 1 . . . . B 121 GLN H . 36787 1 1340 . 2 . 2 38 38 GLN HA H 1 3.812 0.030 . 1 . . . . B 121 GLN HA . 36787 1 1341 . 2 . 2 38 38 GLN HB2 H 1 1.973 0.030 . 2 . . . . B 121 GLN HB2 . 36787 1 1342 . 2 . 2 38 38 GLN HB3 H 1 2.484 0.030 . 2 . . . . B 121 GLN HB3 . 36787 1 1343 . 2 . 2 38 38 GLN HE21 H 1 6.820 0.030 . 2 . . . . B 121 GLN HE21 . 36787 1 1344 . 2 . 2 38 38 GLN HE22 H 1 7.668 0.030 . 2 . . . . B 121 GLN HE22 . 36787 1 1345 . 2 . 2 38 38 GLN HG2 H 1 1.915 0.030 . 2 . . . . B 121 GLN HG2 . 36787 1 1346 . 2 . 2 38 38 GLN HG3 H 1 2.261 0.030 . 2 . . . . B 121 GLN HG3 . 36787 1 1347 . 2 . 2 38 38 GLN C C 13 178.852 0.300 . 1 . . . . B 121 GLN C . 36787 1 1348 . 2 . 2 38 38 GLN CA C 13 60.080 0.300 . 1 . . . . B 121 GLN CA . 36787 1 1349 . 2 . 2 38 38 GLN CB C 13 27.663 0.300 . 1 . . . . B 121 GLN CB . 36787 1 1350 . 2 . 2 38 38 GLN CG C 13 33.971 0.300 . 1 . . . . B 121 GLN CG . 36787 1 1351 . 2 . 2 38 38 GLN N N 15 123.636 0.300 . 1 . . . . B 121 GLN N . 36787 1 1352 . 2 . 2 38 38 GLN NE2 N 15 110.272 0.300 . 1 . . . . B 121 GLN NE2 . 36787 1 1353 . 2 . 2 39 39 ASP H H 1 8.088 0.030 . 1 . . . . B 122 ASP H . 36787 1 1354 . 2 . 2 39 39 ASP HA H 1 4.315 0.030 . 1 . . . . B 122 ASP HA . 36787 1 1355 . 2 . 2 39 39 ASP HB2 H 1 2.737 0.030 . 2 . . . . B 122 ASP HB2 . 36787 1 1356 . 2 . 2 39 39 ASP HB3 H 1 2.828 0.030 . 2 . . . . B 122 ASP HB3 . 36787 1 1357 . 2 . 2 39 39 ASP C C 13 177.308 0.300 . 1 . . . . B 122 ASP C . 36787 1 1358 . 2 . 2 39 39 ASP CA C 13 57.210 0.300 . 1 . . . . B 122 ASP CA . 36787 1 1359 . 2 . 2 39 39 ASP CB C 13 41.075 0.300 . 1 . . . . B 122 ASP CB . 36787 1 1360 . 2 . 2 39 39 ASP N N 15 120.077 0.300 . 1 . . . . B 122 ASP N . 36787 1 1361 . 2 . 2 40 40 LYS H H 1 7.501 0.030 . 1 . . . . B 123 LYS H . 36787 1 1362 . 2 . 2 40 40 LYS HA H 1 4.282 0.030 . 1 . . . . B 123 LYS HA . 36787 1 1363 . 2 . 2 40 40 LYS HB2 H 1 1.999 0.030 . 2 . . . . B 123 LYS HB2 . 36787 1 1364 . 2 . 2 40 40 LYS HB3 H 1 1.831 0.030 . 2 . . . . B 123 LYS HB3 . 36787 1 1365 . 2 . 2 40 40 LYS HD2 H 1 1.677 0.030 . 2 . . . . B 123 LYS HD2 . 36787 1 1366 . 2 . 2 40 40 LYS HD3 H 1 1.706 0.030 . 2 . . . . B 123 LYS HD3 . 36787 1 1367 . 2 . 2 40 40 LYS HE2 H 1 3.110 0.030 . 2 . . . . B 123 LYS HE2 . 36787 1 1368 . 2 . 2 40 40 LYS HE3 H 1 3.152 0.030 . 2 . . . . B 123 LYS HE3 . 36787 1 1369 . 2 . 2 40 40 LYS HG2 H 1 1.585 0.030 . 1 . . . . B 123 LYS HG2 . 36787 1 1370 . 2 . 2 40 40 LYS HG3 H 1 1.585 0.030 . 1 . . . . B 123 LYS HG3 . 36787 1 1371 . 2 . 2 40 40 LYS C C 13 177.795 0.300 . 1 . . . . B 123 LYS C . 36787 1 1372 . 2 . 2 40 40 LYS CA C 13 58.355 0.300 . 1 . . . . B 123 LYS CA . 36787 1 1373 . 2 . 2 40 40 LYS CB C 13 34.025 0.300 . 1 . . . . B 123 LYS CB . 36787 1 1374 . 2 . 2 40 40 LYS CD C 13 29.003 0.300 . 1 . . . . B 123 LYS CD . 36787 1 1375 . 2 . 2 40 40 LYS CE C 13 42.203 0.300 . 1 . . . . B 123 LYS CE . 36787 1 1376 . 2 . 2 40 40 LYS CG C 13 25.328 0.300 . 1 . . . . B 123 LYS CG . 36787 1 1377 . 2 . 2 40 40 LYS N N 15 115.722 0.300 . 1 . . . . B 123 LYS N . 36787 1 1378 . 2 . 2 41 41 GLU H H 1 8.710 0.030 . 1 . . . . B 124 GLU H . 36787 1 1379 . 2 . 2 41 41 GLU HA H 1 4.561 0.030 . 1 . . . . B 124 GLU HA . 36787 1 1380 . 2 . 2 41 41 GLU HB2 H 1 2.255 0.030 . 2 . . . . B 124 GLU HB2 . 36787 1 1381 . 2 . 2 41 41 GLU HB3 H 1 1.661 0.030 . 2 . . . . B 124 GLU HB3 . 36787 1 1382 . 2 . 2 41 41 GLU HG2 H 1 2.051 0.030 . 2 . . . . B 124 GLU HG2 . 36787 1 1383 . 2 . 2 41 41 GLU HG3 H 1 2.156 0.030 . 2 . . . . B 124 GLU HG3 . 36787 1 1384 . 2 . 2 41 41 GLU C C 13 177.858 0.300 . 1 . . . . B 124 GLU C . 36787 1 1385 . 2 . 2 41 41 GLU CA C 13 55.374 0.300 . 1 . . . . B 124 GLU CA . 36787 1 1386 . 2 . 2 41 41 GLU CB C 13 33.297 0.300 . 1 . . . . B 124 GLU CB . 36787 1 1387 . 2 . 2 41 41 GLU CG C 13 36.340 0.300 . 1 . . . . B 124 GLU CG . 36787 1 1388 . 2 . 2 41 41 GLU N N 15 114.227 0.300 . 1 . . . . B 124 GLU N . 36787 1 1389 . 2 . 2 42 42 GLY H H 1 8.500 0.030 . 1 . . . . B 125 GLY H . 36787 1 1390 . 2 . 2 42 42 GLY HA2 H 1 3.905 0.030 . 2 . . . . B 125 GLY HA2 . 36787 1 1391 . 2 . 2 42 42 GLY HA3 H 1 4.122 0.030 . 2 . . . . B 125 GLY HA3 . 36787 1 1392 . 2 . 2 42 42 GLY C C 13 173.876 0.300 . 1 . . . . B 125 GLY C . 36787 1 1393 . 2 . 2 42 42 GLY CA C 13 45.889 0.300 . 1 . . . . B 125 GLY CA . 36787 1 1394 . 2 . 2 42 42 GLY N N 15 109.073 0.300 . 1 . . . . B 125 GLY N . 36787 1 1395 . 2 . 2 43 43 ILE H H 1 6.147 0.030 . 1 . . . . B 126 ILE H . 36787 1 1396 . 2 . 2 43 43 ILE HA H 1 4.384 0.030 . 1 . . . . B 126 ILE HA . 36787 1 1397 . 2 . 2 43 43 ILE HB H 1 1.393 0.030 . 1 . . . . B 126 ILE HB . 36787 1 1398 . 2 . 2 43 43 ILE HD11 H 1 0.761 0.030 . 1 . . . . B 126 ILE HD11 . 36787 1 1399 . 2 . 2 43 43 ILE HD12 H 1 0.761 0.030 . 1 . . . . B 126 ILE HD12 . 36787 1 1400 . 2 . 2 43 43 ILE HD13 H 1 0.761 0.030 . 1 . . . . B 126 ILE HD13 . 36787 1 1401 . 2 . 2 43 43 ILE HG12 H 1 1.069 0.030 . 2 . . . . B 126 ILE HG12 . 36787 1 1402 . 2 . 2 43 43 ILE HG13 H 1 1.367 0.030 . 2 . . . . B 126 ILE HG13 . 36787 1 1403 . 2 . 2 43 43 ILE HG21 H 1 0.916 0.030 . 1 . . . . B 126 ILE HG21 . 36787 1 1404 . 2 . 2 43 43 ILE HG22 H 1 0.916 0.030 . 1 . . . . B 126 ILE HG22 . 36787 1 1405 . 2 . 2 43 43 ILE HG23 H 1 0.916 0.030 . 1 . . . . B 126 ILE HG23 . 36787 1 1406 . 2 . 2 43 43 ILE C C 13 173.279 0.300 . 1 . . . . B 126 ILE C . 36787 1 1407 . 2 . 2 43 43 ILE CA C 13 57.946 0.300 . 1 . . . . B 126 ILE CA . 36787 1 1408 . 2 . 2 43 43 ILE CB C 13 40.529 0.300 . 1 . . . . B 126 ILE CB . 36787 1 1409 . 2 . 2 43 43 ILE CD1 C 13 13.596 0.300 . 1 . . . . B 126 ILE CD1 . 36787 1 1410 . 2 . 2 43 43 ILE CG1 C 13 26.981 0.300 . 1 . . . . B 126 ILE CG1 . 36787 1 1411 . 2 . 2 43 43 ILE CG2 C 13 17.844 0.300 . 1 . . . . B 126 ILE CG2 . 36787 1 1412 . 2 . 2 43 43 ILE N N 15 120.632 0.300 . 1 . . . . B 126 ILE N . 36787 1 1413 . 2 . 2 44 44 PRO HA H 1 4.613 0.030 . 1 . . . . B 127 PRO HA . 36787 1 1414 . 2 . 2 44 44 PRO HB2 H 1 1.952 0.030 . 2 . . . . B 127 PRO HB2 . 36787 1 1415 . 2 . 2 44 44 PRO HB3 H 1 2.403 0.030 . 2 . . . . B 127 PRO HB3 . 36787 1 1416 . 2 . 2 44 44 PRO HD2 H 1 3.542 0.030 . 2 . . . . B 127 PRO HD2 . 36787 1 1417 . 2 . 2 44 44 PRO HD3 H 1 4.192 0.030 . 2 . . . . B 127 PRO HD3 . 36787 1 1418 . 2 . 2 44 44 PRO HG2 H 1 2.028 0.030 . 2 . . . . B 127 PRO HG2 . 36787 1 1419 . 2 . 2 44 44 PRO HG3 H 1 2.096 0.030 . 2 . . . . B 127 PRO HG3 . 36787 1 1420 . 2 . 2 44 44 PRO CA C 13 61.542 0.300 . 1 . . . . B 127 PRO CA . 36787 1 1421 . 2 . 2 44 44 PRO CB C 13 31.862 0.300 . 1 . . . . B 127 PRO CB . 36787 1 1422 . 2 . 2 44 44 PRO CD C 13 51.033 0.300 . 1 . . . . B 127 PRO CD . 36787 1 1423 . 2 . 2 44 44 PRO CG C 13 28.256 0.300 . 1 . . . . B 127 PRO CG . 36787 1 1424 . 2 . 2 45 45 PRO HA H 1 4.113 0.030 . 1 . . . . B 128 PRO HA . 36787 1 1425 . 2 . 2 45 45 PRO HB2 H 1 2.228 0.030 . 2 . . . . B 128 PRO HB2 . 36787 1 1426 . 2 . 2 45 45 PRO HB3 H 1 2.013 0.030 . 2 . . . . B 128 PRO HB3 . 36787 1 1427 . 2 . 2 45 45 PRO HD2 H 1 3.736 0.030 . 1 . . . . B 128 PRO HD2 . 36787 1 1428 . 2 . 2 45 45 PRO HD3 H 1 3.736 0.030 . 1 . . . . B 128 PRO HD3 . 36787 1 1429 . 2 . 2 45 45 PRO HG2 H 1 1.620 0.030 . 2 . . . . B 128 PRO HG2 . 36787 1 1430 . 2 . 2 45 45 PRO HG3 H 1 2.170 0.030 . 2 . . . . B 128 PRO HG3 . 36787 1 1431 . 2 . 2 45 45 PRO C C 13 178.279 0.300 . 1 . . . . B 128 PRO C . 36787 1 1432 . 2 . 2 45 45 PRO CA C 13 66.090 0.300 . 1 . . . . B 128 PRO CA . 36787 1 1433 . 2 . 2 45 45 PRO CB C 13 32.831 0.300 . 1 . . . . B 128 PRO CB . 36787 1 1434 . 2 . 2 45 45 PRO CD C 13 51.171 0.300 . 1 . . . . B 128 PRO CD . 36787 1 1435 . 2 . 2 45 45 PRO CG C 13 27.731 0.300 . 1 . . . . B 128 PRO CG . 36787 1 1436 . 2 . 2 46 46 ASP H H 1 8.537 0.030 . 1 . . . . B 129 ASP H . 36787 1 1437 . 2 . 2 46 46 ASP HA H 1 4.383 0.030 . 1 . . . . B 129 ASP HA . 36787 1 1438 . 2 . 2 46 46 ASP HB2 H 1 2.657 0.030 . 2 . . . . B 129 ASP HB2 . 36787 1 1439 . 2 . 2 46 46 ASP HB3 H 1 2.760 0.030 . 2 . . . . B 129 ASP HB3 . 36787 1 1440 . 2 . 2 46 46 ASP C C 13 176.977 0.300 . 1 . . . . B 129 ASP C . 36787 1 1441 . 2 . 2 46 46 ASP CA C 13 55.787 0.300 . 1 . . . . B 129 ASP CA . 36787 1 1442 . 2 . 2 46 46 ASP CB C 13 39.772 0.300 . 1 . . . . B 129 ASP CB . 36787 1 1443 . 2 . 2 46 46 ASP N N 15 113.752 0.300 . 1 . . . . B 129 ASP N . 36787 1 1444 . 2 . 2 47 47 GLN H H 1 7.805 0.030 . 1 . . . . B 130 GLN H . 36787 1 1445 . 2 . 2 47 47 GLN HA H 1 4.429 0.030 . 1 . . . . B 130 GLN HA . 36787 1 1446 . 2 . 2 47 47 GLN HB2 H 1 1.825 0.030 . 2 . . . . B 130 GLN HB2 . 36787 1 1447 . 2 . 2 47 47 GLN HB3 H 1 2.446 0.030 . 2 . . . . B 130 GLN HB3 . 36787 1 1448 . 2 . 2 47 47 GLN HE21 H 1 6.734 0.030 . 2 . . . . B 130 GLN HE21 . 36787 1 1449 . 2 . 2 47 47 GLN HE22 H 1 7.667 0.030 . 2 . . . . B 130 GLN HE22 . 36787 1 1450 . 2 . 2 47 47 GLN HG2 H 1 2.402 0.030 . 1 . . . . B 130 GLN HG2 . 36787 1 1451 . 2 . 2 47 47 GLN HG3 H 1 2.402 0.030 . 1 . . . . B 130 GLN HG3 . 36787 1 1452 . 2 . 2 47 47 GLN C C 13 175.227 0.300 . 1 . . . . B 130 GLN C . 36787 1 1453 . 2 . 2 47 47 GLN CA C 13 55.496 0.300 . 1 . . . . B 130 GLN CA . 36787 1 1454 . 2 . 2 47 47 GLN CB C 13 30.093 0.300 . 1 . . . . B 130 GLN CB . 36787 1 1455 . 2 . 2 47 47 GLN CG C 13 34.465 0.300 . 1 . . . . B 130 GLN CG . 36787 1 1456 . 2 . 2 47 47 GLN N N 15 116.966 0.300 . 1 . . . . B 130 GLN N . 36787 1 1457 . 2 . 2 47 47 GLN NE2 N 15 110.977 0.300 . 1 . . . . B 130 GLN NE2 . 36787 1 1458 . 2 . 2 48 48 GLN H H 1 7.500 0.030 . 1 . . . . B 131 GLN H . 36787 1 1459 . 2 . 2 48 48 GLN HA H 1 4.163 0.030 . 1 . . . . B 131 GLN HA . 36787 1 1460 . 2 . 2 48 48 GLN HB2 H 1 1.864 0.030 . 2 . . . . B 131 GLN HB2 . 36787 1 1461 . 2 . 2 48 48 GLN HB3 H 1 1.948 0.030 . 2 . . . . B 131 GLN HB3 . 36787 1 1462 . 2 . 2 48 48 GLN HE21 H 1 6.494 0.030 . 2 . . . . B 131 GLN HE21 . 36787 1 1463 . 2 . 2 48 48 GLN HE22 H 1 6.078 0.030 . 2 . . . . B 131 GLN HE22 . 36787 1 1464 . 2 . 2 48 48 GLN HG2 H 1 1.635 0.030 . 2 . . . . B 131 GLN HG2 . 36787 1 1465 . 2 . 2 48 48 GLN HG3 H 1 2.510 0.030 . 2 . . . . B 131 GLN HG3 . 36787 1 1466 . 2 . 2 48 48 GLN C C 13 176.001 0.300 . 1 . . . . B 131 GLN C . 36787 1 1467 . 2 . 2 48 48 GLN CA C 13 56.733 0.300 . 1 . . . . B 131 GLN CA . 36787 1 1468 . 2 . 2 48 48 GLN CB C 13 31.450 0.300 . 1 . . . . B 131 GLN CB . 36787 1 1469 . 2 . 2 48 48 GLN CG C 13 33.474 0.300 . 1 . . . . B 131 GLN CG . 36787 1 1470 . 2 . 2 48 48 GLN N N 15 117.944 0.300 . 1 . . . . B 131 GLN N . 36787 1 1471 . 2 . 2 48 48 GLN NE2 N 15 104.387 0.300 . 1 . . . . B 131 GLN NE2 . 36787 1 1472 . 2 . 2 49 49 ARG H H 1 8.390 0.030 . 1 . . . . B 132 ARG H . 36787 1 1473 . 2 . 2 49 49 ARG HA H 1 4.501 0.030 . 1 . . . . B 132 ARG HA . 36787 1 1474 . 2 . 2 49 49 ARG HB2 H 1 1.564 0.030 . 2 . . . . B 132 ARG HB2 . 36787 1 1475 . 2 . 2 49 49 ARG HB3 H 1 1.802 0.030 . 2 . . . . B 132 ARG HB3 . 36787 1 1476 . 2 . 2 49 49 ARG HD2 H 1 2.943 0.030 . 2 . . . . B 132 ARG HD2 . 36787 1 1477 . 2 . 2 49 49 ARG HD3 H 1 3.084 0.030 . 2 . . . . B 132 ARG HD3 . 36787 1 1478 . 2 . 2 49 49 ARG HG2 H 1 1.466 0.030 . 1 . . . . B 132 ARG HG2 . 36787 1 1479 . 2 . 2 49 49 ARG HG3 H 1 1.466 0.030 . 1 . . . . B 132 ARG HG3 . 36787 1 1480 . 2 . 2 49 49 ARG C C 13 174.120 0.300 . 1 . . . . B 132 ARG C . 36787 1 1481 . 2 . 2 49 49 ARG CA C 13 55.105 0.300 . 1 . . . . B 132 ARG CA . 36787 1 1482 . 2 . 2 49 49 ARG CB C 13 31.581 0.300 . 1 . . . . B 132 ARG CB . 36787 1 1483 . 2 . 2 49 49 ARG CD C 13 43.843 0.300 . 1 . . . . B 132 ARG CD . 36787 1 1484 . 2 . 2 49 49 ARG CG C 13 26.899 0.300 . 1 . . . . B 132 ARG CG . 36787 1 1485 . 2 . 2 49 49 ARG N N 15 122.433 0.300 . 1 . . . . B 132 ARG N . 36787 1 1486 . 2 . 2 50 50 LEU H H 1 8.762 0.030 . 1 . . . . B 133 LEU H . 36787 1 1487 . 2 . 2 50 50 LEU HA H 1 5.375 0.030 . 1 . . . . B 133 LEU HA . 36787 1 1488 . 2 . 2 50 50 LEU HB2 H 1 1.148 0.030 . 2 . . . . B 133 LEU HB2 . 36787 1 1489 . 2 . 2 50 50 LEU HB3 H 1 1.528 0.030 . 2 . . . . B 133 LEU HB3 . 36787 1 1490 . 2 . 2 50 50 LEU HD11 H 1 0.750 0.030 . 2 . . . . B 133 LEU HD11 . 36787 1 1491 . 2 . 2 50 50 LEU HD12 H 1 0.750 0.030 . 2 . . . . B 133 LEU HD12 . 36787 1 1492 . 2 . 2 50 50 LEU HD13 H 1 0.750 0.030 . 2 . . . . B 133 LEU HD13 . 36787 1 1493 . 2 . 2 50 50 LEU HD21 H 1 0.788 0.030 . 2 . . . . B 133 LEU HD21 . 36787 1 1494 . 2 . 2 50 50 LEU HD22 H 1 0.788 0.030 . 2 . . . . B 133 LEU HD22 . 36787 1 1495 . 2 . 2 50 50 LEU HD23 H 1 0.788 0.030 . 2 . . . . B 133 LEU HD23 . 36787 1 1496 . 2 . 2 50 50 LEU HG H 1 1.455 0.030 . 1 . . . . B 133 LEU HG . 36787 1 1497 . 2 . 2 50 50 LEU C C 13 175.263 0.300 . 1 . . . . B 133 LEU C . 36787 1 1498 . 2 . 2 50 50 LEU CA C 13 53.062 0.300 . 1 . . . . B 133 LEU CA . 36787 1 1499 . 2 . 2 50 50 LEU CB C 13 45.690 0.300 . 1 . . . . B 133 LEU CB . 36787 1 1500 . 2 . 2 50 50 LEU CD1 C 13 26.546 0.300 . 2 . . . . B 133 LEU CD1 . 36787 1 1501 . 2 . 2 50 50 LEU CD2 C 13 24.231 0.300 . 2 . . . . B 133 LEU CD2 . 36787 1 1502 . 2 . 2 50 50 LEU CG C 13 26.981 0.300 . 1 . . . . B 133 LEU CG . 36787 1 1503 . 2 . 2 50 50 LEU N N 15 123.986 0.300 . 1 . . . . B 133 LEU N . 36787 1 1504 . 2 . 2 51 51 ILE H H 1 9.177 0.030 . 1 . . . . B 134 ILE H . 36787 1 1505 . 2 . 2 51 51 ILE HA H 1 4.966 0.030 . 1 . . . . B 134 ILE HA . 36787 1 1506 . 2 . 2 51 51 ILE HB H 1 1.729 0.030 . 1 . . . . B 134 ILE HB . 36787 1 1507 . 2 . 2 51 51 ILE HD11 H 1 0.625 0.030 . 1 . . . . B 134 ILE HD11 . 36787 1 1508 . 2 . 2 51 51 ILE HD12 H 1 0.625 0.030 . 1 . . . . B 134 ILE HD12 . 36787 1 1509 . 2 . 2 51 51 ILE HD13 H 1 0.625 0.030 . 1 . . . . B 134 ILE HD13 . 36787 1 1510 . 2 . 2 51 51 ILE HG12 H 1 1.010 0.030 . 2 . . . . B 134 ILE HG12 . 36787 1 1511 . 2 . 2 51 51 ILE HG13 H 1 1.277 0.030 . 2 . . . . B 134 ILE HG13 . 36787 1 1512 . 2 . 2 51 51 ILE HG21 H 1 0.676 0.030 . 1 . . . . B 134 ILE HG21 . 36787 1 1513 . 2 . 2 51 51 ILE HG22 H 1 0.676 0.030 . 1 . . . . B 134 ILE HG22 . 36787 1 1514 . 2 . 2 51 51 ILE HG23 H 1 0.676 0.030 . 1 . . . . B 134 ILE HG23 . 36787 1 1515 . 2 . 2 51 51 ILE C C 13 175.421 0.300 . 1 . . . . B 134 ILE C . 36787 1 1516 . 2 . 2 51 51 ILE CA C 13 58.949 0.300 . 1 . . . . B 134 ILE CA . 36787 1 1517 . 2 . 2 51 51 ILE CB C 13 41.256 0.300 . 1 . . . . B 134 ILE CB . 36787 1 1518 . 2 . 2 51 51 ILE CD1 C 13 13.296 0.300 . 1 . . . . B 134 ILE CD1 . 36787 1 1519 . 2 . 2 51 51 ILE CG1 C 13 28.232 0.300 . 1 . . . . B 134 ILE CG1 . 36787 1 1520 . 2 . 2 51 51 ILE CG2 C 13 17.809 0.300 . 1 . . . . B 134 ILE CG2 . 36787 1 1521 . 2 . 2 51 51 ILE N N 15 122.843 0.300 . 1 . . . . B 134 ILE N . 36787 1 1522 . 2 . 2 52 52 PHE H H 1 8.802 0.030 . 1 . . . . B 135 PHE H . 36787 1 1523 . 2 . 2 52 52 PHE HA H 1 5.167 0.030 . 1 . . . . B 135 PHE HA . 36787 1 1524 . 2 . 2 52 52 PHE HB2 H 1 2.790 0.030 . 2 . . . . B 135 PHE HB2 . 36787 1 1525 . 2 . 2 52 52 PHE HB3 H 1 3.039 0.030 . 2 . . . . B 135 PHE HB3 . 36787 1 1526 . 2 . 2 52 52 PHE HD1 H 1 7.374 0.030 . 1 . . . . B 135 PHE HD1 . 36787 1 1527 . 2 . 2 52 52 PHE HD2 H 1 7.374 0.030 . 1 . . . . B 135 PHE HD2 . 36787 1 1528 . 2 . 2 52 52 PHE HE1 H 1 7.534 0.030 . 1 . . . . B 135 PHE HE1 . 36787 1 1529 . 2 . 2 52 52 PHE HE2 H 1 7.534 0.030 . 1 . . . . B 135 PHE HE2 . 36787 1 1530 . 2 . 2 52 52 PHE C C 13 174.523 0.300 . 1 . . . . B 135 PHE C . 36787 1 1531 . 2 . 2 52 52 PHE CA C 13 56.817 0.300 . 1 . . . . B 135 PHE CA . 36787 1 1532 . 2 . 2 52 52 PHE CB C 13 43.859 0.300 . 1 . . . . B 135 PHE CB . 36787 1 1533 . 2 . 2 52 52 PHE CD1 C 13 132.156 0.300 . 1 . . . . B 135 PHE CD1 . 36787 1 1534 . 2 . 2 52 52 PHE CD2 C 13 132.156 0.300 . 1 . . . . B 135 PHE CD2 . 36787 1 1535 . 2 . 2 52 52 PHE CE1 C 13 132.199 0.300 . 1 . . . . B 135 PHE CE1 . 36787 1 1536 . 2 . 2 52 52 PHE CE2 C 13 132.199 0.300 . 1 . . . . B 135 PHE CE2 . 36787 1 1537 . 2 . 2 52 52 PHE N N 15 124.935 0.300 . 1 . . . . B 135 PHE N . 36787 1 1538 . 2 . 2 53 53 ALA H H 1 8.920 0.030 . 1 . . . . B 136 ALA H . 36787 1 1539 . 2 . 2 53 53 ALA HA H 1 3.625 0.030 . 1 . . . . B 136 ALA HA . 36787 1 1540 . 2 . 2 53 53 ALA HB1 H 1 0.876 0.030 . 1 . . . . B 136 ALA HB1 . 36787 1 1541 . 2 . 2 53 53 ALA HB2 H 1 0.876 0.030 . 1 . . . . B 136 ALA HB2 . 36787 1 1542 . 2 . 2 53 53 ALA HB3 H 1 0.876 0.030 . 1 . . . . B 136 ALA HB3 . 36787 1 1543 . 2 . 2 53 53 ALA C C 13 177.030 0.300 . 1 . . . . B 136 ALA C . 36787 1 1544 . 2 . 2 53 53 ALA CA C 13 52.639 0.300 . 1 . . . . B 136 ALA CA . 36787 1 1545 . 2 . 2 53 53 ALA CB C 13 16.569 0.300 . 1 . . . . B 136 ALA CB . 36787 1 1546 . 2 . 2 53 53 ALA N N 15 132.896 0.300 . 1 . . . . B 136 ALA N . 36787 1 1547 . 2 . 2 54 54 GLY H H 1 8.315 0.030 . 1 . . . . B 137 GLY H . 36787 1 1548 . 2 . 2 54 54 GLY HA2 H 1 4.122 0.030 . 2 . . . . B 137 GLY HA2 . 36787 1 1549 . 2 . 2 54 54 GLY HA3 H 1 3.393 0.030 . 2 . . . . B 137 GLY HA3 . 36787 1 1550 . 2 . 2 54 54 GLY C C 13 172.951 0.300 . 1 . . . . B 137 GLY C . 36787 1 1551 . 2 . 2 54 54 GLY CA C 13 45.774 0.300 . 1 . . . . B 137 GLY CA . 36787 1 1552 . 2 . 2 54 54 GLY N N 15 102.507 0.300 . 1 . . . . B 137 GLY N . 36787 1 1553 . 2 . 2 55 55 LYS H H 1 7.913 0.030 . 1 . . . . B 138 LYS H . 36787 1 1554 . 2 . 2 55 55 LYS HA H 1 4.605 0.030 . 1 . . . . B 138 LYS HA . 36787 1 1555 . 2 . 2 55 55 LYS HB2 H 1 1.866 0.030 . 1 . . . . B 138 LYS HB2 . 36787 1 1556 . 2 . 2 55 55 LYS HB3 H 1 1.866 0.030 . 1 . . . . B 138 LYS HB3 . 36787 1 1557 . 2 . 2 55 55 LYS HD2 H 1 1.830 0.030 . 2 . . . . B 138 LYS HD2 . 36787 1 1558 . 2 . 2 55 55 LYS HD3 H 1 1.859 0.030 . 2 . . . . B 138 LYS HD3 . 36787 1 1559 . 2 . 2 55 55 LYS HE2 H 1 3.159 0.030 . 1 . . . . B 138 LYS HE2 . 36787 1 1560 . 2 . 2 55 55 LYS HE3 H 1 3.159 0.030 . 1 . . . . B 138 LYS HE3 . 36787 1 1561 . 2 . 2 55 55 LYS HG2 H 1 1.504 0.030 . 1 . . . . B 138 LYS HG2 . 36787 1 1562 . 2 . 2 55 55 LYS HG3 H 1 1.504 0.030 . 1 . . . . B 138 LYS HG3 . 36787 1 1563 . 2 . 2 55 55 LYS C C 13 174.765 0.300 . 1 . . . . B 138 LYS C . 36787 1 1564 . 2 . 2 55 55 LYS CA C 13 54.403 0.300 . 1 . . . . B 138 LYS CA . 36787 1 1565 . 2 . 2 55 55 LYS CB C 13 34.606 0.300 . 1 . . . . B 138 LYS CB . 36787 1 1566 . 2 . 2 55 55 LYS CD C 13 29.153 0.300 . 1 . . . . B 138 LYS CD . 36787 1 1567 . 2 . 2 55 55 LYS CE C 13 42.274 0.300 . 1 . . . . B 138 LYS CE . 36787 1 1568 . 2 . 2 55 55 LYS CG C 13 24.443 0.300 . 1 . . . . B 138 LYS CG . 36787 1 1569 . 2 . 2 55 55 LYS N N 15 120.818 0.300 . 1 . . . . B 138 LYS N . 36787 1 1570 . 2 . 2 56 56 GLN H H 1 8.720 0.030 . 1 . . . . B 139 GLN H . 36787 1 1571 . 2 . 2 56 56 GLN HA H 1 4.504 0.030 . 1 . . . . B 139 GLN HA . 36787 1 1572 . 2 . 2 56 56 GLN HB2 H 1 1.935 0.030 . 2 . . . . B 139 GLN HB2 . 36787 1 1573 . 2 . 2 56 56 GLN HB3 H 1 2.013 0.030 . 2 . . . . B 139 GLN HB3 . 36787 1 1574 . 2 . 2 56 56 GLN HE21 H 1 7.708 0.030 . 2 . . . . B 139 GLN HE21 . 36787 1 1575 . 2 . 2 56 56 GLN HE22 H 1 6.905 0.030 . 2 . . . . B 139 GLN HE22 . 36787 1 1576 . 2 . 2 56 56 GLN HG2 H 1 2.160 0.030 . 2 . . . . B 139 GLN HG2 . 36787 1 1577 . 2 . 2 56 56 GLN HG3 H 1 2.239 0.030 . 2 . . . . B 139 GLN HG3 . 36787 1 1578 . 2 . 2 56 56 GLN C C 13 175.621 0.300 . 1 . . . . B 139 GLN C . 36787 1 1579 . 2 . 2 56 56 GLN CA C 13 55.793 0.300 . 1 . . . . B 139 GLN CA . 36787 1 1580 . 2 . 2 56 56 GLN CB C 13 29.295 0.300 . 1 . . . . B 139 GLN CB . 36787 1 1581 . 2 . 2 56 56 GLN CG C 13 35.122 0.300 . 1 . . . . B 139 GLN CG . 36787 1 1582 . 2 . 2 56 56 GLN N N 15 122.478 0.300 . 1 . . . . B 139 GLN N . 36787 1 1583 . 2 . 2 56 56 GLN NE2 N 15 112.498 0.300 . 1 . . . . B 139 GLN NE2 . 36787 1 1584 . 2 . 2 57 57 LEU H H 1 8.579 0.030 . 1 . . . . B 140 LEU H . 36787 1 1585 . 2 . 2 57 57 LEU HA H 1 4.098 0.030 . 1 . . . . B 140 LEU HA . 36787 1 1586 . 2 . 2 57 57 LEU HB2 H 1 1.025 0.030 . 2 . . . . B 140 LEU HB2 . 36787 1 1587 . 2 . 2 57 57 LEU HB3 H 1 1.462 0.030 . 2 . . . . B 140 LEU HB3 . 36787 1 1588 . 2 . 2 57 57 LEU HD11 H 1 0.504 0.030 . 2 . . . . B 140 LEU HD11 . 36787 1 1589 . 2 . 2 57 57 LEU HD12 H 1 0.504 0.030 . 2 . . . . B 140 LEU HD12 . 36787 1 1590 . 2 . 2 57 57 LEU HD13 H 1 0.504 0.030 . 2 . . . . B 140 LEU HD13 . 36787 1 1591 . 2 . 2 57 57 LEU HD21 H 1 -0.180 0.030 . 2 . . . . B 140 LEU HD21 . 36787 1 1592 . 2 . 2 57 57 LEU HD22 H 1 -0.180 0.030 . 2 . . . . B 140 LEU HD22 . 36787 1 1593 . 2 . 2 57 57 LEU HD23 H 1 -0.180 0.030 . 2 . . . . B 140 LEU HD23 . 36787 1 1594 . 2 . 2 57 57 LEU HG H 1 1.504 0.030 . 1 . . . . B 140 LEU HG . 36787 1 1595 . 2 . 2 57 57 LEU C C 13 176.617 0.300 . 1 . . . . B 140 LEU C . 36787 1 1596 . 2 . 2 57 57 LEU CA C 13 54.300 0.300 . 1 . . . . B 140 LEU CA . 36787 1 1597 . 2 . 2 57 57 LEU CB C 13 41.643 0.300 . 1 . . . . B 140 LEU CB . 36787 1 1598 . 2 . 2 57 57 LEU CD1 C 13 25.969 0.300 . 2 . . . . B 140 LEU CD1 . 36787 1 1599 . 2 . 2 57 57 LEU CD2 C 13 19.434 0.300 . 2 . . . . B 140 LEU CD2 . 36787 1 1600 . 2 . 2 57 57 LEU CG C 13 25.806 0.300 . 1 . . . . B 140 LEU CG . 36787 1 1601 . 2 . 2 57 57 LEU N N 15 125.574 0.300 . 1 . . . . B 140 LEU N . 36787 1 1602 . 2 . 2 58 58 GLU H H 1 8.459 0.030 . 1 . . . . B 141 GLU H . 36787 1 1603 . 2 . 2 58 58 GLU HA H 1 4.456 0.030 . 1 . . . . B 141 GLU HA . 36787 1 1604 . 2 . 2 58 58 GLU HB2 H 1 1.865 0.030 . 2 . . . . B 141 GLU HB2 . 36787 1 1605 . 2 . 2 58 58 GLU HB3 H 1 2.226 0.030 . 2 . . . . B 141 GLU HB3 . 36787 1 1606 . 2 . 2 58 58 GLU HG2 H 1 2.320 0.030 . 2 . . . . B 141 GLU HG2 . 36787 1 1607 . 2 . 2 58 58 GLU HG3 H 1 2.412 0.030 . 2 . . . . B 141 GLU HG3 . 36787 1 1608 . 2 . 2 58 58 GLU C C 13 175.747 0.300 . 1 . . . . B 141 GLU C . 36787 1 1609 . 2 . 2 58 58 GLU CA C 13 56.056 0.300 . 1 . . . . B 141 GLU CA . 36787 1 1610 . 2 . 2 58 58 GLU CB C 13 31.693 0.300 . 1 . . . . B 141 GLU CB . 36787 1 1611 . 2 . 2 58 58 GLU CG C 13 36.612 0.300 . 1 . . . . B 141 GLU CG . 36787 1 1612 . 2 . 2 58 58 GLU N N 15 123.287 0.300 . 1 . . . . B 141 GLU N . 36787 1 1613 . 2 . 2 59 59 ASP H H 1 8.180 0.030 . 1 . . . . B 142 ASP H . 36787 1 1614 . 2 . 2 59 59 ASP HA H 1 4.366 0.030 . 1 . . . . B 142 ASP HA . 36787 1 1615 . 2 . 2 59 59 ASP HB2 H 1 2.508 0.030 . 2 . . . . B 142 ASP HB2 . 36787 1 1616 . 2 . 2 59 59 ASP HB3 H 1 2.599 0.030 . 2 . . . . B 142 ASP HB3 . 36787 1 1617 . 2 . 2 59 59 ASP C C 13 177.352 0.300 . 1 . . . . B 142 ASP C . 36787 1 1618 . 2 . 2 59 59 ASP CA C 13 56.906 0.300 . 1 . . . . B 142 ASP CA . 36787 1 1619 . 2 . 2 59 59 ASP CB C 13 40.881 0.300 . 1 . . . . B 142 ASP CB . 36787 1 1620 . 2 . 2 59 59 ASP N N 15 120.620 0.300 . 1 . . . . B 142 ASP N . 36787 1 1621 . 2 . 2 60 60 GLY HA2 H 1 4.019 0.030 . 1 . . . . B 143 GLY HA2 . 36787 1 1622 . 2 . 2 60 60 GLY HA3 H 1 4.019 0.030 . 1 . . . . B 143 GLY HA3 . 36787 1 1623 . 2 . 2 60 60 GLY C C 13 174.716 0.300 . 1 . . . . B 143 GLY C . 36787 1 1624 . 2 . 2 60 60 GLY CA C 13 45.248 0.300 . 1 . . . . B 143 GLY CA . 36787 1 1625 . 2 . 2 61 61 ARG H H 1 7.450 0.030 . 1 . . . . B 144 ARG H . 36787 1 1626 . 2 . 2 61 61 ARG HA H 1 4.683 0.030 . 1 . . . . B 144 ARG HA . 36787 1 1627 . 2 . 2 61 61 ARG HB2 H 1 2.014 0.030 . 2 . . . . B 144 ARG HB2 . 36787 1 1628 . 2 . 2 61 61 ARG HB3 H 1 2.186 0.030 . 2 . . . . B 144 ARG HB3 . 36787 1 1629 . 2 . 2 61 61 ARG HD2 H 1 3.040 0.030 . 2 . . . . B 144 ARG HD2 . 36787 1 1630 . 2 . 2 61 61 ARG HD3 H 1 3.115 0.030 . 2 . . . . B 144 ARG HD3 . 36787 1 1631 . 2 . 2 61 61 ARG HG2 H 1 1.591 0.030 . 2 . . . . B 144 ARG HG2 . 36787 1 1632 . 2 . 2 61 61 ARG HG3 H 1 1.787 0.030 . 2 . . . . B 144 ARG HG3 . 36787 1 1633 . 2 . 2 61 61 ARG C C 13 175.200 0.300 . 1 . . . . B 144 ARG C . 36787 1 1634 . 2 . 2 61 61 ARG CA C 13 54.428 0.300 . 1 . . . . B 144 ARG CA . 36787 1 1635 . 2 . 2 61 61 ARG CB C 13 32.725 0.300 . 1 . . . . B 144 ARG CB . 36787 1 1636 . 2 . 2 61 61 ARG CD C 13 42.959 0.300 . 1 . . . . B 144 ARG CD . 36787 1 1637 . 2 . 2 61 61 ARG CG C 13 27.509 0.300 . 1 . . . . B 144 ARG CG . 36787 1 1638 . 2 . 2 61 61 ARG N N 15 119.473 0.300 . 1 . . . . B 144 ARG N . 36787 1 1639 . 2 . 2 62 62 THR H H 1 8.829 0.030 . 1 . . . . B 145 THR H . 36787 1 1640 . 2 . 2 62 62 THR HA H 1 5.226 0.030 . 1 . . . . B 145 THR HA . 36787 1 1641 . 2 . 2 62 62 THR HB H 1 4.519 0.030 . 1 . . . . B 145 THR HB . 36787 1 1642 . 2 . 2 62 62 THR HG21 H 1 1.114 0.030 . 1 . . . . B 145 THR HG21 . 36787 1 1643 . 2 . 2 62 62 THR HG22 H 1 1.114 0.030 . 1 . . . . B 145 THR HG22 . 36787 1 1644 . 2 . 2 62 62 THR HG23 H 1 1.114 0.030 . 1 . . . . B 145 THR HG23 . 36787 1 1645 . 2 . 2 62 62 THR C C 13 176.344 0.300 . 1 . . . . B 145 THR C . 36787 1 1646 . 2 . 2 62 62 THR CA C 13 59.718 0.300 . 1 . . . . B 145 THR CA . 36787 1 1647 . 2 . 2 62 62 THR CB C 13 72.483 0.300 . 1 . . . . B 145 THR CB . 36787 1 1648 . 2 . 2 62 62 THR CG2 C 13 22.291 0.300 . 1 . . . . B 145 THR CG2 . 36787 1 1649 . 2 . 2 62 62 THR N N 15 108.807 0.300 . 1 . . . . B 145 THR N . 36787 1 1650 . 2 . 2 63 63 LEU H H 1 8.186 0.030 . 1 . . . . B 146 LEU H . 36787 1 1651 . 2 . 2 63 63 LEU HA H 1 4.038 0.030 . 1 . . . . B 146 LEU HA . 36787 1 1652 . 2 . 2 63 63 LEU HB2 H 1 1.174 0.030 . 2 . . . . B 146 LEU HB2 . 36787 1 1653 . 2 . 2 63 63 LEU HB3 H 1 2.084 0.030 . 2 . . . . B 146 LEU HB3 . 36787 1 1654 . 2 . 2 63 63 LEU HD11 H 1 0.761 0.030 . 2 . . . . B 146 LEU HD11 . 36787 1 1655 . 2 . 2 63 63 LEU HD12 H 1 0.761 0.030 . 2 . . . . B 146 LEU HD12 . 36787 1 1656 . 2 . 2 63 63 LEU HD13 H 1 0.761 0.030 . 2 . . . . B 146 LEU HD13 . 36787 1 1657 . 2 . 2 63 63 LEU HD21 H 1 0.608 0.030 . 2 . . . . B 146 LEU HD21 . 36787 1 1658 . 2 . 2 63 63 LEU HD22 H 1 0.608 0.030 . 2 . . . . B 146 LEU HD22 . 36787 1 1659 . 2 . 2 63 63 LEU HD23 H 1 0.608 0.030 . 2 . . . . B 146 LEU HD23 . 36787 1 1660 . 2 . 2 63 63 LEU HG H 1 1.740 0.030 . 1 . . . . B 146 LEU HG . 36787 1 1661 . 2 . 2 63 63 LEU C C 13 180.600 0.300 . 1 . . . . B 146 LEU C . 36787 1 1662 . 2 . 2 63 63 LEU CA C 13 58.641 0.300 . 1 . . . . B 146 LEU CA . 36787 1 1663 . 2 . 2 63 63 LEU CB C 13 40.221 0.300 . 1 . . . . B 146 LEU CB . 36787 1 1664 . 2 . 2 63 63 LEU CD1 C 13 26.762 0.300 . 2 . . . . B 146 LEU CD1 . 36787 1 1665 . 2 . 2 63 63 LEU CD2 C 13 23.043 0.300 . 2 . . . . B 146 LEU CD2 . 36787 1 1666 . 2 . 2 63 63 LEU CG C 13 26.652 0.300 . 1 . . . . B 146 LEU CG . 36787 1 1667 . 2 . 2 63 63 LEU N N 15 117.701 0.300 . 1 . . . . B 146 LEU N . 36787 1 1668 . 2 . 2 64 64 SER H H 1 8.381 0.030 . 1 . . . . B 147 SER H . 36787 1 1669 . 2 . 2 64 64 SER HA H 1 4.241 0.030 . 1 . . . . B 147 SER HA . 36787 1 1670 . 2 . 2 64 64 SER HB2 H 1 3.740 0.030 . 2 . . . . B 147 SER HB2 . 36787 1 1671 . 2 . 2 64 64 SER HB3 H 1 3.833 0.030 . 2 . . . . B 147 SER HB3 . 36787 1 1672 . 2 . 2 64 64 SER C C 13 178.248 0.300 . 1 . . . . B 147 SER C . 36787 1 1673 . 2 . 2 64 64 SER CA C 13 61.187 0.300 . 1 . . . . B 147 SER CA . 36787 1 1674 . 2 . 2 64 64 SER CB C 13 62.599 0.300 . 1 . . . . B 147 SER CB . 36787 1 1675 . 2 . 2 64 64 SER N N 15 113.296 0.300 . 1 . . . . B 147 SER N . 36787 1 1676 . 2 . 2 65 65 ASP H H 1 7.974 0.030 . 1 . . . . B 148 ASP H . 36787 1 1677 . 2 . 2 65 65 ASP HA H 1 4.258 0.030 . 1 . . . . B 148 ASP HA . 36787 1 1678 . 2 . 2 65 65 ASP HB2 H 1 2.991 0.030 . 2 . . . . B 148 ASP HB2 . 36787 1 1679 . 2 . 2 65 65 ASP HB3 H 1 2.267 0.030 . 2 . . . . B 148 ASP HB3 . 36787 1 1680 . 2 . 2 65 65 ASP C C 13 177.484 0.300 . 1 . . . . B 148 ASP C . 36787 1 1681 . 2 . 2 65 65 ASP CA C 13 57.481 0.300 . 1 . . . . B 148 ASP CA . 36787 1 1682 . 2 . 2 65 65 ASP CB C 13 40.390 0.300 . 1 . . . . B 148 ASP CB . 36787 1 1683 . 2 . 2 65 65 ASP N N 15 124.726 0.300 . 1 . . . . B 148 ASP N . 36787 1 1684 . 2 . 2 66 66 TYR H H 1 7.244 0.030 . 1 . . . . B 149 TYR H . 36787 1 1685 . 2 . 2 66 66 TYR HA H 1 4.646 0.030 . 1 . . . . B 149 TYR HA . 36787 1 1686 . 2 . 2 66 66 TYR HB2 H 1 3.455 0.030 . 2 . . . . B 149 TYR HB2 . 36787 1 1687 . 2 . 2 66 66 TYR HB3 H 1 2.514 0.030 . 2 . . . . B 149 TYR HB3 . 36787 1 1688 . 2 . 2 66 66 TYR HD1 H 1 7.235 0.030 . 1 . . . . B 149 TYR HD1 . 36787 1 1689 . 2 . 2 66 66 TYR HD2 H 1 7.235 0.030 . 1 . . . . B 149 TYR HD2 . 36787 1 1690 . 2 . 2 66 66 TYR HE1 H 1 6.880 0.030 . 1 . . . . B 149 TYR HE1 . 36787 1 1691 . 2 . 2 66 66 TYR HE2 H 1 6.880 0.030 . 1 . . . . B 149 TYR HE2 . 36787 1 1692 . 2 . 2 66 66 TYR C C 13 174.597 0.300 . 1 . . . . B 149 TYR C . 36787 1 1693 . 2 . 2 66 66 TYR CA C 13 58.450 0.300 . 1 . . . . B 149 TYR CA . 36787 1 1694 . 2 . 2 66 66 TYR CB C 13 40.030 0.300 . 1 . . . . B 149 TYR CB . 36787 1 1695 . 2 . 2 66 66 TYR CD1 C 13 133.445 0.300 . 1 . . . . B 149 TYR CD1 . 36787 1 1696 . 2 . 2 66 66 TYR CD2 C 13 133.445 0.300 . 1 . . . . B 149 TYR CD2 . 36787 1 1697 . 2 . 2 66 66 TYR CE1 C 13 118.567 0.300 . 1 . . . . B 149 TYR CE1 . 36787 1 1698 . 2 . 2 66 66 TYR CE2 C 13 118.567 0.300 . 1 . . . . B 149 TYR CE2 . 36787 1 1699 . 2 . 2 66 66 TYR N N 15 115.778 0.300 . 1 . . . . B 149 TYR N . 36787 1 1700 . 2 . 2 67 67 ASN H H 1 8.163 0.030 . 1 . . . . B 150 ASN H . 36787 1 1701 . 2 . 2 67 67 ASN HA H 1 4.335 0.030 . 1 . . . . B 150 ASN HA . 36787 1 1702 . 2 . 2 67 67 ASN HB2 H 1 3.296 0.030 . 2 . . . . B 150 ASN HB2 . 36787 1 1703 . 2 . 2 67 67 ASN HB3 H 1 2.809 0.030 . 2 . . . . B 150 ASN HB3 . 36787 1 1704 . 2 . 2 67 67 ASN HD21 H 1 6.829 0.030 . 2 . . . . B 150 ASN HD21 . 36787 1 1705 . 2 . 2 67 67 ASN HD22 H 1 7.563 0.030 . 2 . . . . B 150 ASN HD22 . 36787 1 1706 . 2 . 2 67 67 ASN C C 13 174.191 0.300 . 1 . . . . B 150 ASN C . 36787 1 1707 . 2 . 2 67 67 ASN CA C 13 54.240 0.300 . 1 . . . . B 150 ASN CA . 36787 1 1708 . 2 . 2 67 67 ASN CB C 13 37.425 0.300 . 1 . . . . B 150 ASN CB . 36787 1 1709 . 2 . 2 67 67 ASN N N 15 115.963 0.300 . 1 . . . . B 150 ASN N . 36787 1 1710 . 2 . 2 67 67 ASN ND2 N 15 111.713 0.300 . 1 . . . . B 150 ASN ND2 . 36787 1 1711 . 2 . 2 68 68 ILE H H 1 7.332 0.030 . 1 . . . . B 151 ILE H . 36787 1 1712 . 2 . 2 68 68 ILE HA H 1 3.347 0.030 . 1 . . . . B 151 ILE HA . 36787 1 1713 . 2 . 2 68 68 ILE HB H 1 1.374 0.030 . 1 . . . . B 151 ILE HB . 36787 1 1714 . 2 . 2 68 68 ILE HD11 H 1 0.405 0.030 . 1 . . . . B 151 ILE HD11 . 36787 1 1715 . 2 . 2 68 68 ILE HD12 H 1 0.405 0.030 . 1 . . . . B 151 ILE HD12 . 36787 1 1716 . 2 . 2 68 68 ILE HD13 H 1 0.405 0.030 . 1 . . . . B 151 ILE HD13 . 36787 1 1717 . 2 . 2 68 68 ILE HG12 H 1 -0.447 0.030 . 2 . . . . B 151 ILE HG12 . 36787 1 1718 . 2 . 2 68 68 ILE HG13 H 1 1.077 0.030 . 2 . . . . B 151 ILE HG13 . 36787 1 1719 . 2 . 2 68 68 ILE HG21 H 1 0.471 0.030 . 1 . . . . B 151 ILE HG21 . 36787 1 1720 . 2 . 2 68 68 ILE HG22 H 1 0.471 0.030 . 1 . . . . B 151 ILE HG22 . 36787 1 1721 . 2 . 2 68 68 ILE HG23 H 1 0.471 0.030 . 1 . . . . B 151 ILE HG23 . 36787 1 1722 . 2 . 2 68 68 ILE C C 13 174.384 0.300 . 1 . . . . B 151 ILE C . 36787 1 1723 . 2 . 2 68 68 ILE CA C 13 62.532 0.300 . 1 . . . . B 151 ILE CA . 36787 1 1724 . 2 . 2 68 68 ILE CB C 13 36.756 0.300 . 1 . . . . B 151 ILE CB . 36787 1 1725 . 2 . 2 68 68 ILE CD1 C 13 14.428 0.300 . 1 . . . . B 151 ILE CD1 . 36787 1 1726 . 2 . 2 68 68 ILE CG1 C 13 28.297 0.300 . 1 . . . . B 151 ILE CG1 . 36787 1 1727 . 2 . 2 68 68 ILE CG2 C 13 17.453 0.300 . 1 . . . . B 151 ILE CG2 . 36787 1 1728 . 2 . 2 68 68 ILE N N 15 119.216 0.300 . 1 . . . . B 151 ILE N . 36787 1 1729 . 2 . 2 69 69 GLN H H 1 7.682 0.030 . 1 . . . . B 152 GLN H . 36787 1 1730 . 2 . 2 69 69 GLN HA H 1 4.485 0.030 . 1 . . . . B 152 GLN HA . 36787 1 1731 . 2 . 2 69 69 GLN HB2 H 1 2.230 0.030 . 2 . . . . B 152 GLN HB2 . 36787 1 1732 . 2 . 2 69 69 GLN HB3 H 1 1.871 0.030 . 2 . . . . B 152 GLN HB3 . 36787 1 1733 . 2 . 2 69 69 GLN HE21 H 1 7.283 0.030 . 2 . . . . B 152 GLN HE21 . 36787 1 1734 . 2 . 2 69 69 GLN HE22 H 1 6.827 0.030 . 2 . . . . B 152 GLN HE22 . 36787 1 1735 . 2 . 2 69 69 GLN HG2 H 1 2.295 0.030 . 2 . . . . B 152 GLN HG2 . 36787 1 1736 . 2 . 2 69 69 GLN HG3 H 1 2.356 0.030 . 2 . . . . B 152 GLN HG3 . 36787 1 1737 . 2 . 2 69 69 GLN C C 13 175.654 0.300 . 1 . . . . B 152 GLN C . 36787 1 1738 . 2 . 2 69 69 GLN CA C 13 53.579 0.300 . 1 . . . . B 152 GLN CA . 36787 1 1739 . 2 . 2 69 69 GLN CB C 13 31.690 0.300 . 1 . . . . B 152 GLN CB . 36787 1 1740 . 2 . 2 69 69 GLN CG C 13 33.387 0.300 . 1 . . . . B 152 GLN CG . 36787 1 1741 . 2 . 2 69 69 GLN N N 15 124.852 0.300 . 1 . . . . B 152 GLN N . 36787 1 1742 . 2 . 2 69 69 GLN NE2 N 15 112.521 0.300 . 1 . . . . B 152 GLN NE2 . 36787 1 1743 . 2 . 2 70 70 LYS H H 1 8.475 0.030 . 1 . . . . B 153 LYS H . 36787 1 1744 . 2 . 2 70 70 LYS HA H 1 3.944 0.030 . 1 . . . . B 153 LYS HA . 36787 1 1745 . 2 . 2 70 70 LYS HB2 H 1 1.892 0.030 . 2 . . . . B 153 LYS HB2 . 36787 1 1746 . 2 . 2 70 70 LYS HB3 H 1 2.033 0.030 . 2 . . . . B 153 LYS HB3 . 36787 1 1747 . 2 . 2 70 70 LYS HD2 H 1 1.743 0.030 . 1 . . . . B 153 LYS HD2 . 36787 1 1748 . 2 . 2 70 70 LYS HD3 H 1 1.743 0.030 . 1 . . . . B 153 LYS HD3 . 36787 1 1749 . 2 . 2 70 70 LYS HE2 H 1 3.022 0.030 . 1 . . . . B 153 LYS HE2 . 36787 1 1750 . 2 . 2 70 70 LYS HE3 H 1 3.022 0.030 . 1 . . . . B 153 LYS HE3 . 36787 1 1751 . 2 . 2 70 70 LYS HG2 H 1 1.500 0.030 . 1 . . . . B 153 LYS HG2 . 36787 1 1752 . 2 . 2 70 70 LYS HG3 H 1 1.500 0.030 . 1 . . . . B 153 LYS HG3 . 36787 1 1753 . 2 . 2 70 70 LYS C C 13 175.938 0.300 . 1 . . . . B 153 LYS C . 36787 1 1754 . 2 . 2 70 70 LYS CA C 13 58.125 0.300 . 1 . . . . B 153 LYS CA . 36787 1 1755 . 2 . 2 70 70 LYS CB C 13 32.591 0.300 . 1 . . . . B 153 LYS CB . 36787 1 1756 . 2 . 2 70 70 LYS CD C 13 29.800 0.300 . 1 . . . . B 153 LYS CD . 36787 1 1757 . 2 . 2 70 70 LYS CE C 13 42.209 0.300 . 1 . . . . B 153 LYS CE . 36787 1 1758 . 2 . 2 70 70 LYS CG C 13 24.450 0.300 . 1 . . . . B 153 LYS CG . 36787 1 1759 . 2 . 2 70 70 LYS N N 15 120.139 0.300 . 1 . . . . B 153 LYS N . 36787 1 1760 . 2 . 2 71 71 GLU H H 1 9.286 0.030 . 1 . . . . B 154 GLU H . 36787 1 1761 . 2 . 2 71 71 GLU HA H 1 3.330 0.030 . 1 . . . . B 154 GLU HA . 36787 1 1762 . 2 . 2 71 71 GLU HB2 H 1 2.394 0.030 . 2 . . . . B 154 GLU HB2 . 36787 1 1763 . 2 . 2 71 71 GLU HB3 H 1 2.527 0.030 . 2 . . . . B 154 GLU HB3 . 36787 1 1764 . 2 . 2 71 71 GLU HG2 H 1 2.204 0.030 . 2 . . . . B 154 GLU HG2 . 36787 1 1765 . 2 . 2 71 71 GLU HG3 H 1 2.232 0.030 . 2 . . . . B 154 GLU HG3 . 36787 1 1766 . 2 . 2 71 71 GLU C C 13 175.126 0.300 . 1 . . . . B 154 GLU C . 36787 1 1767 . 2 . 2 71 71 GLU CA C 13 58.502 0.300 . 1 . . . . B 154 GLU CA . 36787 1 1768 . 2 . 2 71 71 GLU CB C 13 26.083 0.300 . 1 . . . . B 154 GLU CB . 36787 1 1769 . 2 . 2 71 71 GLU CG C 13 37.393 0.300 . 1 . . . . B 154 GLU CG . 36787 1 1770 . 2 . 2 71 71 GLU N N 15 115.085 0.300 . 1 . . . . B 154 GLU N . 36787 1 1771 . 2 . 2 72 72 SER H H 1 7.723 0.030 . 1 . . . . B 155 SER H . 36787 1 1772 . 2 . 2 72 72 SER HA H 1 4.622 0.030 . 1 . . . . B 155 SER HA . 36787 1 1773 . 2 . 2 72 72 SER HB2 H 1 3.921 0.030 . 2 . . . . B 155 SER HB2 . 36787 1 1774 . 2 . 2 72 72 SER HB3 H 1 3.655 0.030 . 2 . . . . B 155 SER HB3 . 36787 1 1775 . 2 . 2 72 72 SER C C 13 171.900 0.300 . 1 . . . . B 155 SER C . 36787 1 1776 . 2 . 2 72 72 SER CA C 13 61.053 0.300 . 1 . . . . B 155 SER CA . 36787 1 1777 . 2 . 2 72 72 SER CB C 13 65.008 0.300 . 1 . . . . B 155 SER CB . 36787 1 1778 . 2 . 2 72 72 SER N N 15 115.198 0.300 . 1 . . . . B 155 SER N . 36787 1 1779 . 2 . 2 73 73 THR H H 1 8.720 0.030 . 1 . . . . B 156 THR H . 36787 1 1780 . 2 . 2 73 73 THR HA H 1 5.278 0.030 . 1 . . . . B 156 THR HA . 36787 1 1781 . 2 . 2 73 73 THR HB H 1 4.040 0.030 . 1 . . . . B 156 THR HB . 36787 1 1782 . 2 . 2 73 73 THR HG21 H 1 0.883 0.030 . 1 . . . . B 156 THR HG21 . 36787 1 1783 . 2 . 2 73 73 THR HG22 H 1 0.883 0.030 . 1 . . . . B 156 THR HG22 . 36787 1 1784 . 2 . 2 73 73 THR HG23 H 1 0.883 0.030 . 1 . . . . B 156 THR HG23 . 36787 1 1785 . 2 . 2 73 73 THR C C 13 173.545 0.300 . 1 . . . . B 156 THR C . 36787 1 1786 . 2 . 2 73 73 THR CA C 13 62.524 0.300 . 1 . . . . B 156 THR CA . 36787 1 1787 . 2 . 2 73 73 THR CB C 13 70.355 0.300 . 1 . . . . B 156 THR CB . 36787 1 1788 . 2 . 2 73 73 THR CG2 C 13 21.512 0.300 . 1 . . . . B 156 THR CG2 . 36787 1 1789 . 2 . 2 73 73 THR N N 15 117.589 0.300 . 1 . . . . B 156 THR N . 36787 1 1790 . 2 . 2 74 74 LEU H H 1 9.405 0.030 . 1 . . . . B 157 LEU H . 36787 1 1791 . 2 . 2 74 74 LEU HA H 1 5.088 0.030 . 1 . . . . B 157 LEU HA . 36787 1 1792 . 2 . 2 74 74 LEU HB2 H 1 1.611 0.030 . 1 . . . . B 157 LEU HB2 . 36787 1 1793 . 2 . 2 74 74 LEU HB3 H 1 1.611 0.030 . 1 . . . . B 157 LEU HB3 . 36787 1 1794 . 2 . 2 74 74 LEU HD11 H 1 0.641 0.030 . 2 . . . . B 157 LEU HD11 . 36787 1 1795 . 2 . 2 74 74 LEU HD12 H 1 0.641 0.030 . 2 . . . . B 157 LEU HD12 . 36787 1 1796 . 2 . 2 74 74 LEU HD13 H 1 0.641 0.030 . 2 . . . . B 157 LEU HD13 . 36787 1 1797 . 2 . 2 74 74 LEU HD21 H 1 0.684 0.030 . 2 . . . . B 157 LEU HD21 . 36787 1 1798 . 2 . 2 74 74 LEU HD22 H 1 0.684 0.030 . 2 . . . . B 157 LEU HD22 . 36787 1 1799 . 2 . 2 74 74 LEU HD23 H 1 0.684 0.030 . 2 . . . . B 157 LEU HD23 . 36787 1 1800 . 2 . 2 74 74 LEU HG H 1 1.762 0.030 . 1 . . . . B 157 LEU HG . 36787 1 1801 . 2 . 2 74 74 LEU C C 13 175.008 0.300 . 1 . . . . B 157 LEU C . 36787 1 1802 . 2 . 2 74 74 LEU CA C 13 53.896 0.300 . 1 . . . . B 157 LEU CA . 36787 1 1803 . 2 . 2 74 74 LEU CB C 13 44.600 0.300 . 1 . . . . B 157 LEU CB . 36787 1 1804 . 2 . 2 74 74 LEU CD1 C 13 25.491 0.300 . 2 . . . . B 157 LEU CD1 . 36787 1 1805 . 2 . 2 74 74 LEU CD2 C 13 24.877 0.300 . 2 . . . . B 157 LEU CD2 . 36787 1 1806 . 2 . 2 74 74 LEU CG C 13 29.695 0.300 . 1 . . . . B 157 LEU CG . 36787 1 1807 . 2 . 2 74 74 LEU N N 15 128.061 0.300 . 1 . . . . B 157 LEU N . 36787 1 1808 . 2 . 2 75 75 HIS H H 1 9.181 0.030 . 1 . . . . B 158 HIS H . 36787 1 1809 . 2 . 2 75 75 HIS HA H 1 5.183 0.030 . 1 . . . . B 158 HIS HA . 36787 1 1810 . 2 . 2 75 75 HIS HB2 H 1 2.963 0.030 . 2 . . . . B 158 HIS HB2 . 36787 1 1811 . 2 . 2 75 75 HIS HB3 H 1 2.796 0.030 . 2 . . . . B 158 HIS HB3 . 36787 1 1812 . 2 . 2 75 75 HIS HD2 H 1 6.918 0.030 . 1 . . . . B 158 HIS HD2 . 36787 1 1813 . 2 . 2 75 75 HIS C C 13 173.980 0.300 . 1 . . . . B 158 HIS C . 36787 1 1814 . 2 . 2 75 75 HIS CA C 13 56.528 0.300 . 1 . . . . B 158 HIS CA . 36787 1 1815 . 2 . 2 75 75 HIS CB C 13 33.234 0.300 . 1 . . . . B 158 HIS CB . 36787 1 1816 . 2 . 2 75 75 HIS CD2 C 13 119.017 0.300 . 1 . . . . B 158 HIS CD2 . 36787 1 1817 . 2 . 2 75 75 HIS N N 15 119.531 0.300 . 1 . . . . B 158 HIS N . 36787 1 1818 . 2 . 2 76 76 LEU H H 1 8.365 0.030 . 1 . . . . B 159 LEU H . 36787 1 1819 . 2 . 2 76 76 LEU HA H 1 5.187 0.030 . 1 . . . . B 159 LEU HA . 36787 1 1820 . 2 . 2 76 76 LEU HB2 H 1 1.060 0.030 . 2 . . . . B 159 LEU HB2 . 36787 1 1821 . 2 . 2 76 76 LEU HB3 H 1 1.545 0.030 . 2 . . . . B 159 LEU HB3 . 36787 1 1822 . 2 . 2 76 76 LEU HD11 H 1 0.706 0.030 . 2 . . . . B 159 LEU HD11 . 36787 1 1823 . 2 . 2 76 76 LEU HD12 H 1 0.706 0.030 . 2 . . . . B 159 LEU HD12 . 36787 1 1824 . 2 . 2 76 76 LEU HD13 H 1 0.706 0.030 . 2 . . . . B 159 LEU HD13 . 36787 1 1825 . 2 . 2 76 76 LEU HD21 H 1 0.823 0.030 . 2 . . . . B 159 LEU HD21 . 36787 1 1826 . 2 . 2 76 76 LEU HD22 H 1 0.823 0.030 . 2 . . . . B 159 LEU HD22 . 36787 1 1827 . 2 . 2 76 76 LEU HD23 H 1 0.823 0.030 . 2 . . . . B 159 LEU HD23 . 36787 1 1828 . 2 . 2 76 76 LEU HG H 1 1.295 0.030 . 1 . . . . B 159 LEU HG . 36787 1 1829 . 2 . 2 76 76 LEU C C 13 174.997 0.300 . 1 . . . . B 159 LEU C . 36787 1 1830 . 2 . 2 76 76 LEU CA C 13 53.589 0.300 . 1 . . . . B 159 LEU CA . 36787 1 1831 . 2 . 2 76 76 LEU CB C 13 44.425 0.300 . 1 . . . . B 159 LEU CB . 36787 1 1832 . 2 . 2 76 76 LEU CD1 C 13 26.087 0.300 . 2 . . . . B 159 LEU CD1 . 36787 1 1833 . 2 . 2 76 76 LEU CD2 C 13 23.856 0.300 . 2 . . . . B 159 LEU CD2 . 36787 1 1834 . 2 . 2 76 76 LEU CG C 13 27.639 0.300 . 1 . . . . B 159 LEU CG . 36787 1 1835 . 2 . 2 76 76 LEU N N 15 123.941 0.300 . 1 . . . . B 159 LEU N . 36787 1 1836 . 2 . 2 77 77 VAL H H 1 9.110 0.030 . 1 . . . . B 160 VAL H . 36787 1 1837 . 2 . 2 77 77 VAL HA H 1 4.285 0.030 . 1 . . . . B 160 VAL HA . 36787 1 1838 . 2 . 2 77 77 VAL HB H 1 1.900 0.030 . 1 . . . . B 160 VAL HB . 36787 1 1839 . 2 . 2 77 77 VAL HG11 H 1 0.921 0.030 . 2 . . . . B 160 VAL HG11 . 36787 1 1840 . 2 . 2 77 77 VAL HG12 H 1 0.921 0.030 . 2 . . . . B 160 VAL HG12 . 36787 1 1841 . 2 . 2 77 77 VAL HG13 H 1 0.921 0.030 . 2 . . . . B 160 VAL HG13 . 36787 1 1842 . 2 . 2 77 77 VAL HG21 H 1 0.831 0.030 . 2 . . . . B 160 VAL HG21 . 36787 1 1843 . 2 . 2 77 77 VAL HG22 H 1 0.831 0.030 . 2 . . . . B 160 VAL HG22 . 36787 1 1844 . 2 . 2 77 77 VAL HG23 H 1 0.831 0.030 . 2 . . . . B 160 VAL HG23 . 36787 1 1845 . 2 . 2 77 77 VAL C C 13 174.028 0.300 . 1 . . . . B 160 VAL C . 36787 1 1846 . 2 . 2 77 77 VAL CA C 13 60.776 0.300 . 1 . . . . B 160 VAL CA . 36787 1 1847 . 2 . 2 77 77 VAL CB C 13 34.834 0.300 . 1 . . . . B 160 VAL CB . 36787 1 1848 . 2 . 2 77 77 VAL CG1 C 13 21.419 0.300 . 2 . . . . B 160 VAL CG1 . 36787 1 1849 . 2 . 2 77 77 VAL CG2 C 13 21.338 0.300 . 2 . . . . B 160 VAL CG2 . 36787 1 1850 . 2 . 2 77 77 VAL N N 15 127.483 0.300 . 1 . . . . B 160 VAL N . 36787 1 1851 . 2 . 2 78 78 LEU HA H 1 5.024 0.030 . 1 . . . . B 161 LEU HA . 36787 1 1852 . 2 . 2 78 78 LEU HB2 H 1 1.677 0.030 . 2 . . . . B 161 LEU HB2 . 36787 1 1853 . 2 . 2 78 78 LEU HB3 H 1 1.479 0.030 . 2 . . . . B 161 LEU HB3 . 36787 1 1854 . 2 . 2 78 78 LEU HD11 H 1 0.950 0.030 . 2 . . . . B 161 LEU HD11 . 36787 1 1855 . 2 . 2 78 78 LEU HD12 H 1 0.950 0.030 . 2 . . . . B 161 LEU HD12 . 36787 1 1856 . 2 . 2 78 78 LEU HD13 H 1 0.950 0.030 . 2 . . . . B 161 LEU HD13 . 36787 1 1857 . 2 . 2 78 78 LEU HD21 H 1 0.830 0.030 . 2 . . . . B 161 LEU HD21 . 36787 1 1858 . 2 . 2 78 78 LEU HD22 H 1 0.830 0.030 . 2 . . . . B 161 LEU HD22 . 36787 1 1859 . 2 . 2 78 78 LEU HD23 H 1 0.830 0.030 . 2 . . . . B 161 LEU HD23 . 36787 1 1860 . 2 . 2 78 78 LEU HG H 1 1.677 0.030 . 1 . . . . B 161 LEU HG . 36787 1 1861 . 2 . 2 78 78 LEU C C 13 177.943 0.300 . 1 . . . . B 161 LEU C . 36787 1 1862 . 2 . 2 78 78 LEU CA C 13 54.056 0.300 . 1 . . . . B 161 LEU CA . 36787 1 1863 . 2 . 2 78 78 LEU CB C 13 42.437 0.300 . 1 . . . . B 161 LEU CB . 36787 1 1864 . 2 . 2 78 78 LEU CD1 C 13 25.125 0.300 . 2 . . . . B 161 LEU CD1 . 36787 1 1865 . 2 . 2 78 78 LEU CD2 C 13 23.856 0.300 . 2 . . . . B 161 LEU CD2 . 36787 1 1866 . 2 . 2 78 78 LEU CG C 13 27.557 0.300 . 1 . . . . B 161 LEU CG . 36787 1 1867 . 2 . 2 79 79 ARG H H 1 8.641 0.030 . 1 . . . . B 162 ARG H . 36787 1 1868 . 2 . 2 79 79 ARG HA H 1 4.276 0.030 . 1 . . . . B 162 ARG HA . 36787 1 1869 . 2 . 2 79 79 ARG HB2 H 1 1.762 0.030 . 2 . . . . B 162 ARG HB2 . 36787 1 1870 . 2 . 2 79 79 ARG HB3 H 1 1.517 0.030 . 2 . . . . B 162 ARG HB3 . 36787 1 1871 . 2 . 2 79 79 ARG HD2 H 1 3.149 0.030 . 1 . . . . B 162 ARG HD2 . 36787 1 1872 . 2 . 2 79 79 ARG HD3 H 1 3.149 0.030 . 1 . . . . B 162 ARG HD3 . 36787 1 1873 . 2 . 2 79 79 ARG HG2 H 1 1.534 0.030 . 2 . . . . B 162 ARG HG2 . 36787 1 1874 . 2 . 2 79 79 ARG HG3 H 1 1.467 0.030 . 2 . . . . B 162 ARG HG3 . 36787 1 1875 . 2 . 2 79 79 ARG C C 13 175.305 0.300 . 1 . . . . B 162 ARG C . 36787 1 1876 . 2 . 2 79 79 ARG CA C 13 55.756 0.300 . 1 . . . . B 162 ARG CA . 36787 1 1877 . 2 . 2 79 79 ARG CB C 13 31.294 0.300 . 1 . . . . B 162 ARG CB . 36787 1 1878 . 2 . 2 79 79 ARG CD C 13 43.384 0.300 . 1 . . . . B 162 ARG CD . 36787 1 1879 . 2 . 2 79 79 ARG CG C 13 27.500 0.300 . 1 . . . . B 162 ARG CG . 36787 1 1880 . 2 . 2 79 79 ARG N N 15 123.390 0.300 . 1 . . . . B 162 ARG N . 36787 1 1881 . 2 . 2 80 80 LEU H H 1 8.359 0.030 . 1 . . . . B 163 LEU H . 36787 1 1882 . 2 . 2 80 80 LEU HA H 1 4.362 0.030 . 1 . . . . B 163 LEU HA . 36787 1 1883 . 2 . 2 80 80 LEU HB2 H 1 1.532 0.030 . 2 . . . . B 163 LEU HB2 . 36787 1 1884 . 2 . 2 80 80 LEU HB3 H 1 1.622 0.030 . 2 . . . . B 163 LEU HB3 . 36787 1 1885 . 2 . 2 80 80 LEU HD11 H 1 0.833 0.030 . 2 . . . . B 163 LEU HD11 . 36787 1 1886 . 2 . 2 80 80 LEU HD12 H 1 0.833 0.030 . 2 . . . . B 163 LEU HD12 . 36787 1 1887 . 2 . 2 80 80 LEU HD13 H 1 0.833 0.030 . 2 . . . . B 163 LEU HD13 . 36787 1 1888 . 2 . 2 80 80 LEU HD21 H 1 0.833 0.030 . 2 . . . . B 163 LEU HD21 . 36787 1 1889 . 2 . 2 80 80 LEU HD22 H 1 0.833 0.030 . 2 . . . . B 163 LEU HD22 . 36787 1 1890 . 2 . 2 80 80 LEU HD23 H 1 0.833 0.030 . 2 . . . . B 163 LEU HD23 . 36787 1 1891 . 2 . 2 80 80 LEU HG H 1 1.605 0.030 . 1 . . . . B 163 LEU HG . 36787 1 1892 . 2 . 2 80 80 LEU C C 13 177.331 0.300 . 1 . . . . B 163 LEU C . 36787 1 1893 . 2 . 2 80 80 LEU CA C 13 54.859 0.300 . 1 . . . . B 163 LEU CA . 36787 1 1894 . 2 . 2 80 80 LEU CB C 13 42.393 0.300 . 1 . . . . B 163 LEU CB . 36787 1 1895 . 2 . 2 80 80 LEU CD1 C 13 25.090 0.300 . 2 . . . . B 163 LEU CD1 . 36787 1 1896 . 2 . 2 80 80 LEU CD2 C 13 23.482 0.300 . 2 . . . . B 163 LEU CD2 . 36787 1 1897 . 2 . 2 80 80 LEU CG C 13 26.981 0.300 . 1 . . . . B 163 LEU CG . 36787 1 1898 . 2 . 2 80 80 LEU N N 15 124.437 0.300 . 1 . . . . B 163 LEU N . 36787 1 1899 . 2 . 2 81 81 ARG H H 1 8.435 0.030 . 1 . . . . B 164 ARG H . 36787 1 1900 . 2 . 2 81 81 ARG HA H 1 4.302 0.030 . 1 . . . . B 164 ARG HA . 36787 1 1901 . 2 . 2 81 81 ARG HB2 H 1 1.851 0.030 . 1 . . . . B 164 ARG HB2 . 36787 1 1902 . 2 . 2 81 81 ARG HB3 H 1 1.851 0.030 . 1 . . . . B 164 ARG HB3 . 36787 1 1903 . 2 . 2 81 81 ARG HD2 H 1 3.162 0.030 . 1 . . . . B 164 ARG HD2 . 36787 1 1904 . 2 . 2 81 81 ARG HD3 H 1 3.162 0.030 . 1 . . . . B 164 ARG HD3 . 36787 1 1905 . 2 . 2 81 81 ARG HG2 H 1 1.623 0.030 . 1 . . . . B 164 ARG HG2 . 36787 1 1906 . 2 . 2 81 81 ARG HG3 H 1 1.623 0.030 . 1 . . . . B 164 ARG HG3 . 36787 1 1907 . 2 . 2 81 81 ARG C C 13 176.727 0.300 . 1 . . . . B 164 ARG C . 36787 1 1908 . 2 . 2 81 81 ARG CA C 13 56.339 0.300 . 1 . . . . B 164 ARG CA . 36787 1 1909 . 2 . 2 81 81 ARG CB C 13 30.803 0.300 . 1 . . . . B 164 ARG CB . 36787 1 1910 . 2 . 2 81 81 ARG CD C 13 43.346 0.300 . 1 . . . . B 164 ARG CD . 36787 1 1911 . 2 . 2 81 81 ARG CG C 13 26.981 0.300 . 1 . . . . B 164 ARG CG . 36787 1 1912 . 2 . 2 81 81 ARG N N 15 122.095 0.300 . 1 . . . . B 164 ARG N . 36787 1 1913 . 2 . 2 82 82 GLY H H 1 8.472 0.030 . 1 . . . . B 165 GLY H . 36787 1 1914 . 2 . 2 82 82 GLY HA2 H 1 3.914 0.030 . 1 . . . . B 165 GLY HA2 . 36787 1 1915 . 2 . 2 82 82 GLY HA3 H 1 3.914 0.030 . 1 . . . . B 165 GLY HA3 . 36787 1 1916 . 2 . 2 82 82 GLY C C 13 173.569 0.300 . 1 . . . . B 165 GLY C . 36787 1 1917 . 2 . 2 82 82 GLY CA C 13 45.197 0.300 . 1 . . . . B 165 GLY CA . 36787 1 1918 . 2 . 2 82 82 GLY N N 15 111.061 0.300 . 1 . . . . B 165 GLY N . 36787 1 1919 . 2 . 2 83 83 GLY H H 1 7.956 0.030 . 1 . . . . B 166 GLY H . 36787 1 1920 . 2 . 2 83 83 GLY HA2 H 1 3.779 0.030 . 2 . . . . B 166 GLY HA2 . 36787 1 1921 . 2 . 2 83 83 GLY HA3 H 1 3.730 0.030 . 2 . . . . B 166 GLY HA3 . 36787 1 1922 . 2 . 2 83 83 GLY C C 13 179.099 0.300 . 1 . . . . B 166 GLY C . 36787 1 1923 . 2 . 2 83 83 GLY CA C 13 46.057 0.300 . 1 . . . . B 166 GLY CA . 36787 1 1924 . 2 . 2 83 83 GLY N N 15 115.180 0.300 . 1 . . . . B 166 GLY N . 36787 1 stop_ save_