data_36483 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36483 _Entry.Title ; NMR strucutre of chimeric protein for model of PHD-Stella complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-04-04 _Entry.Accession_date 2023-03-08 _Entry.Last_release_date 2023-03-08 _Entry.Original_release_date 2023-03-08 _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 N. Kobayashi N. . . . 36483 2 T. Konuma T. . . . 36483 3 K. Arita K. . . . 36483 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'DNA methylation' . 36483 TRANSCRIPTION . 36483 'chimeric model' . 36483 complex . 36483 zinc-finger . 36483 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36483 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 510 36483 '15N chemical shifts' 123 36483 '1H chemical shifts' 728 36483 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2025-10-26 . original BMRB . 36483 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 7XGA 'BMRB Entry Tracking System' 36483 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36483 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 36420895 _Citation.DOI 10.1093/nar/gkac1082 _Citation.Full_citation . _Citation.Title ; Structural basis for the unique multifaceted interaction of DPPA3 with the UHRF1 PHD finger. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nucleic Acids Res.' _Citation.Journal_name_full 'Nucleic acids research' _Citation.Journal_volume 50 _Citation.Journal_issue 21 _Citation.Journal_ASTM NARHAD _Citation.Journal_ISSN 0305-1048 _Citation.Journal_CSD 0389 _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 12527 _Citation.Page_last 12542 _Citation.Year 2022 _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 Keiichi Hata K. . . . 36483 1 2 Naohiro Kobayashi N. . . . 36483 1 3 Keita Sugimura K. . . . 36483 1 4 Weihua Qin W. . . . 36483 1 5 Deis Haxholli D. . . . 36483 1 6 Yoshie Chiba Y. . . . 36483 1 7 Sae Yoshimi S. . . . 36483 1 8 Gosuke Hayashi G. . . . 36483 1 9 Hiroki Onoda H. . . . 36483 1 10 Takahisa Ikegami T. . . . 36483 1 11 Christopher Mulholland C. B. . . 36483 1 12 Atsuya Nishiyama A. . . . 36483 1 13 Makoto Nakanishi M. . . . 36483 1 14 Heinrich Leonhardt H. . . . 36483 1 15 Tsuyoshi Konuma T. . . . 36483 1 16 Kyohei Arita K. . . . 36483 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36483 _Assembly.ID 1 _Assembly.Name 'E3 ubiquitin-protein ligase UHRF1,Developmental pluripotency-associated protein 3 (E.C.2.3.2.27)' _Assembly.BMRB_code . _Assembly.Number_of_components 4 _Assembly.Organic_ligands . _Assembly.Metal_ions 3 _Assembly.Non_standard_bonds yes _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all other bound' _Assembly.Molecular_mass 14778.112 _Assembly.Enzyme_commission_number 2.3.2.27 _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 . . . . ; RING-type E3 ubiquitin transferase UHRF1,Ubiquitin-like PHD and RING finger domain-containing protein 1,mUhrf1,Ubiquitin-like-containing PHD and RING finger domains protein 1 ; . 36483 1 2 entity_ZN 2 $entity_ZN B,C,D A . . . . . . . 36483 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 'metal coordination' sing . 1 entity_1 1 CYS 9 9 SG . 2 entity_ZN 2 ZN 1 1 ZN . . A 9 CYS SG . . A 201 ZN ZN 36483 1 2 'metal coordination' sing . 1 entity_1 1 CYS 12 12 SG . 2 entity_ZN 2 ZN 1 1 ZN . . A 12 CYS SG . . A 201 ZN ZN 36483 1 3 'metal coordination' sing . 1 entity_1 1 CYS 20 20 SG . 2 entity_ZN 2 ZN 1 1 ZN . . A 20 CYS SG . . A 201 ZN ZN 36483 1 4 'metal coordination' sing . 1 entity_1 1 CYS 23 23 SG . 2 entity_ZN 2 ZN 1 1 ZN . . A 23 CYS SG . . A 201 ZN ZN 36483 1 5 'metal coordination' sing . 1 entity_1 1 CYS 25 25 SG . 2 entity_ZN 2 ZN 3 3 ZN . . A 25 CYS SG . . A 203 ZN ZN 36483 1 6 'metal coordination' sing . 1 entity_1 1 CYS 28 28 SG . 2 entity_ZN 2 ZN 3 3 ZN . . A 28 CYS SG . . A 203 ZN ZN 36483 1 7 'metal coordination' sing . 1 entity_1 1 CYS 40 40 SG . 2 entity_ZN 2 ZN 2 2 ZN . . A 40 CYS SG . . A 202 ZN ZN 36483 1 8 'metal coordination' sing . 1 entity_1 1 CYS 43 43 SG . 2 entity_ZN 2 ZN 2 2 ZN . . A 43 CYS SG . . A 202 ZN ZN 36483 1 9 'metal coordination' sing . 1 entity_1 1 HIS 48 48 ND1 . 2 entity_ZN 2 ZN 3 3 ZN . . A 48 HIS ND1 . . A 203 ZN ZN 36483 1 10 'metal coordination' sing . 1 entity_1 1 CYS 51 51 SG . 2 entity_ZN 2 ZN 3 3 ZN . . A 51 CYS SG . . A 203 ZN ZN 36483 1 11 'metal coordination' sing . 1 entity_1 1 CYS 67 67 SG . 2 entity_ZN 2 ZN 2 2 ZN . . A 67 CYS SG . . A 202 ZN ZN 36483 1 12 'metal coordination' sing . 1 entity_1 1 CYS 70 70 SG . 2 entity_ZN 2 ZN 2 2 ZN . . A 70 CYS SG . . A 202 ZN ZN 36483 1 stop_ loop_ _Entity_deleted_atom.ID _Entity_deleted_atom.Entity_atom_list_ID _Entity_deleted_atom.Entity_assembly_ID _Entity_deleted_atom.Entity_ID _Entity_deleted_atom.Comp_ID _Entity_deleted_atom.Comp_index_ID _Entity_deleted_atom.Seq_ID _Entity_deleted_atom.Atom_ID _Entity_deleted_atom.Auth_entity_assembly_ID _Entity_deleted_atom.Auth_seq_ID _Entity_deleted_atom.Auth_comp_ID _Entity_deleted_atom.Auth_atom_ID _Entity_deleted_atom.Entry_ID _Entity_deleted_atom.Assembly_ID 1 . 1 . CYS 9 9 HG A 9 CYS HG 36483 1 2 . 1 . CYS 12 12 HG A 12 CYS HG 36483 1 3 . 1 . CYS 20 20 HG A 20 CYS HG 36483 1 4 . 1 . CYS 23 23 HG A 23 CYS HG 36483 1 5 . 1 . CYS 25 25 HG A 25 CYS HG 36483 1 6 . 1 . CYS 28 28 HG A 28 CYS HG 36483 1 7 . 1 . CYS 40 40 HG A 40 CYS HG 36483 1 8 . 1 . CYS 43 43 HG A 43 CYS HG 36483 1 9 . 1 . HIS 48 48 HD1 A 48 HIS HD1 36483 1 10 . 1 . CYS 51 51 HG A 51 CYS HG 36483 1 11 . 1 . CYS 67 67 HG A 67 CYS HG 36483 1 12 . 1 . CYS 70 70 HG A 70 CYS HG 36483 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 . 36483 1 . 1 1 10 ARG 10 . A 10 ARG . middle . . 36483 1 . 1 1 100 LYS 100 . A 100 LYS . middle . . 36483 1 . 1 1 101 MET 101 . A 101 MET . middle . . 36483 1 . 1 1 102 ARG 102 . A 102 ARG . middle . . 36483 1 . 1 1 103 ARG 103 . A 103 ARG . middle . . 36483 1 . 1 1 104 LEU 104 . A 104 LEU . middle . . 36483 1 . 1 1 105 VAL 105 . A 105 VAL . middle . . 36483 1 . 1 1 106 ARG 106 . A 106 ARG . middle . . 36483 1 . 1 1 107 ILE 107 . A 107 ILE . middle . . 36483 1 . 1 1 108 GLU 108 . A 108 GLU . middle . . 36483 1 . 1 1 109 GLN 109 . A 109 GLN . middle . . 36483 1 . 1 1 11 PHE 11 . A 11 PHE . middle . . 36483 1 . 1 1 110 ARG 110 . A 110 ARG . middle . . 36483 1 . 1 1 111 GLN 111 . A 111 GLN . middle . . 36483 1 . 1 1 112 LYS 112 . A 112 LYS . middle . . 36483 1 . 1 1 113 ARG 113 . A 113 ARG . middle . . 36483 1 . 1 1 114 LEU 114 . A 114 LEU . middle . . 36483 1 . 1 1 115 GLU 115 . A 115 GLU . middle . . 36483 1 . 1 1 116 GLY 116 . A 116 GLY . middle no . 36483 1 . 1 1 117 ASN 117 . A 117 ASN . middle . . 36483 1 . 1 1 118 GLU 118 . A 118 GLU . middle . . 36483 1 . 1 1 119 PHE 119 . A 119 PHE . middle . . 36483 1 . 1 1 12 CYS 12 . A 12 CYS . middle . . 36483 1 . 1 1 120 GLU 120 . A 120 GLU . middle . . 36483 1 . 1 1 121 ARG 121 . A 121 ARG . middle . . 36483 1 . 1 1 122 ASP 122 . A 122 ASP . middle . . 36483 1 . 1 1 123 SER 123 . A 123 SER . middle . . 36483 1 . 1 1 124 GLU 124 . A 124 GLU . middle . . 36483 1 . 1 1 125 PRO 125 . A 125 PRO . middle no . 36483 1 . 1 1 126 PHE 126 . A 126 PHE . end . . 36483 1 . 1 1 13 LYS 13 . A 13 LYS . middle . . 36483 1 . 1 1 14 ASP 14 . A 14 ASP . middle . . 36483 1 . 1 1 15 ASP 15 . A 15 ASP . middle . . 36483 1 . 1 1 16 GLU 16 . A 16 GLU . middle . . 36483 1 . 1 1 17 ASN 17 . A 17 ASN . middle . . 36483 1 . 1 1 18 LYS 18 . A 18 LYS . middle . . 36483 1 . 1 1 19 PRO 19 . A 19 PRO . middle no . 36483 1 . 1 1 2 PRO 2 . A 2 PRO . middle no . 36483 1 . 1 1 20 CYS 20 . A 20 CYS . middle . . 36483 1 . 1 1 21 ARG 21 . A 21 ARG . middle . . 36483 1 . 1 1 22 LYS 22 . A 22 LYS . middle . . 36483 1 . 1 1 23 CYS 23 . A 23 CYS . middle . . 36483 1 . 1 1 24 ALA 24 . A 24 ALA . middle . . 36483 1 . 1 1 25 CYS 25 . A 25 CYS . middle . . 36483 1 . 1 1 26 HIS 26 . A 26 HIS . middle . . 36483 1 . 1 1 27 VAL 27 . A 27 VAL . middle . . 36483 1 . 1 1 28 CYS 28 . A 28 CYS . middle . . 36483 1 . 1 1 29 GLY 29 . A 29 GLY . middle no . 36483 1 . 1 1 3 LEU 3 . A 3 LEU . middle . . 36483 1 . 1 1 30 GLY 30 . A 30 GLY . middle no . 36483 1 . 1 1 31 ARG 31 . A 31 ARG . middle . . 36483 1 . 1 1 32 GLU 32 . A 32 GLU . middle . . 36483 1 . 1 1 33 ALA 33 . A 33 ALA . middle . . 36483 1 . 1 1 34 PRO 34 . A 34 PRO . middle no . 36483 1 . 1 1 35 GLU 35 . A 35 GLU . middle . . 36483 1 . 1 1 36 LYS 36 . A 36 LYS . middle . . 36483 1 . 1 1 37 GLN 37 . A 37 GLN . middle . . 36483 1 . 1 1 38 LEU 38 . A 38 LEU . middle . . 36483 1 . 1 1 39 LEU 39 . A 39 LEU . middle . . 36483 1 . 1 1 4 GLY 4 . A 4 GLY . middle no . 36483 1 . 1 1 40 CYS 40 . A 40 CYS . middle . . 36483 1 . 1 1 41 ASP 41 . A 41 ASP . middle . . 36483 1 . 1 1 42 GLU 42 . A 42 GLU . middle . . 36483 1 . 1 1 43 CYS 43 . A 43 CYS . middle . . 36483 1 . 1 1 44 ASP 44 . A 44 ASP . middle . . 36483 1 . 1 1 45 MET 45 . A 45 MET . middle . . 36483 1 . 1 1 46 ALA 46 . A 46 ALA . middle . . 36483 1 . 1 1 47 PHE 47 . A 47 PHE . middle . . 36483 1 . 1 1 48 HIS 48 . A 48 HIS . middle . . 36483 1 . 1 1 49 LEU 49 . A 49 LEU . middle . . 36483 1 . 1 1 5 SER 5 . A 5 SER . middle . . 36483 1 . 1 1 50 TYR 50 . A 50 TYR . middle . . 36483 1 . 1 1 51 CYS 51 . A 51 CYS . middle . . 36483 1 . 1 1 52 LEU 52 . A 52 LEU . middle . . 36483 1 . 1 1 53 LYS 53 . A 53 LYS . middle . . 36483 1 . 1 1 54 PRO 54 . A 54 PRO . middle no . 36483 1 . 1 1 55 PRO 55 . A 55 PRO . middle no . 36483 1 . 1 1 56 LEU 56 . A 56 LEU . middle . . 36483 1 . 1 1 57 THR 57 . A 57 THR . middle . . 36483 1 . 1 1 58 SER 58 . A 58 SER . middle . . 36483 1 . 1 1 59 VAL 59 . A 59 VAL . middle . . 36483 1 . 1 1 6 GLY 6 . A 6 GLY . middle no . 36483 1 . 1 1 60 PRO 60 . A 60 PRO . middle no . 36483 1 . 1 1 61 PRO 61 . A 61 PRO . middle no . 36483 1 . 1 1 62 GLU 62 . A 62 GLU . middle . . 36483 1 . 1 1 63 PRO 63 . A 63 PRO . middle no . 36483 1 . 1 1 64 GLU 64 . A 64 GLU . middle . . 36483 1 . 1 1 65 TRP 65 . A 65 TRP . middle . . 36483 1 . 1 1 66 TYR 66 . A 66 TYR . middle . . 36483 1 . 1 1 67 CYS 67 . A 67 CYS . middle . . 36483 1 . 1 1 68 PRO 68 . A 68 PRO . middle no . 36483 1 . 1 1 69 SER 69 . A 69 SER . middle . . 36483 1 . 1 1 7 PRO 7 . A 7 PRO . middle no . 36483 1 . 1 1 70 CYS 70 . A 70 CYS . middle . . 36483 1 . 1 1 71 ARG 71 . A 71 ARG . middle . . 36483 1 . 1 1 72 THR 72 . A 72 THR . middle . . 36483 1 . 1 1 73 ASP 73 . A 73 ASP . middle . . 36483 1 . 1 1 74 SER 74 . A 74 SER . middle . . 36483 1 . 1 1 75 ARG 75 . A 75 ARG . middle . . 36483 1 . 1 1 76 ARG 76 . A 76 ARG . middle . . 36483 1 . 1 1 77 GLU 77 . A 77 GLU . middle . . 36483 1 . 1 1 78 VAL 78 . A 78 VAL . middle . . 36483 1 . 1 1 79 GLN 79 . A 79 GLN . middle . . 36483 1 . 1 1 8 SER 8 . A 8 SER . middle . . 36483 1 . 1 1 80 SER 80 . A 80 SER . middle . . 36483 1 . 1 1 81 ALA 81 . A 81 ALA . middle . . 36483 1 . 1 1 82 PHE 82 . A 82 PHE . middle . . 36483 1 . 1 1 83 PRO 83 . A 83 PRO . middle no . 36483 1 . 1 1 84 LYS 84 . A 84 LYS . middle . . 36483 1 . 1 1 85 ARG 85 . A 85 ARG . middle . . 36483 1 . 1 1 86 ARG 86 . A 86 ARG . middle . . 36483 1 . 1 1 87 VAL 87 . A 87 VAL . middle . . 36483 1 . 1 1 88 ARG 88 . A 88 ARG . middle . . 36483 1 . 1 1 89 THR 89 . A 89 THR . middle . . 36483 1 . 1 1 9 CYS 9 . A 9 CYS . middle . . 36483 1 . 1 1 90 LEU 90 . A 90 LEU . middle . . 36483 1 . 1 1 91 LEU 91 . A 91 LEU . middle . . 36483 1 . 1 1 92 SER 92 . A 92 SER . middle . . 36483 1 . 1 1 93 VAL 93 . A 93 VAL . middle . . 36483 1 . 1 1 94 LEU 94 . A 94 LEU . middle . . 36483 1 . 1 1 95 LYS 95 . A 95 LYS . middle . . 36483 1 . 1 1 96 ASP 96 . A 96 ASP . middle . . 36483 1 . 1 1 97 PRO 97 . A 97 PRO . middle no . 36483 1 . 1 1 98 ILE 98 . A 98 ILE . middle . . 36483 1 . 1 1 99 ALA 99 . A 99 ALA . middle . . 36483 1 . 2 2 1 ZN 1 . A 201 ZN . . . . 36483 1 . 2 2 2 ZN 2 . A 202 ZN . . . . 36483 1 . 2 2 3 ZN 3 . A 203 ZN . . . . 36483 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36483 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Chimera of E3 ubiquitin-protein ligase UHRF1 and Developmental pluripotency-associated protein 3' _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 ; GPLGSGPSCRFCKDDENKPC RKCACHVCGGREAPEKQLLC DECDMAFHLYCLKPPLTSVP PEPEWYCPSCRTDSRREVQS AFPKRRVRTLLSVLKDPIAK MRRLVRIEQRQKRLEGNEFE RDSEPF ; _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 126 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all other bound' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 2.3.2.27 _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14581.885 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID ; RING-type E3 ubiquitin transferase UHRF1,Ubiquitin-like PHD and RING finger domain-containing protein 1,mUhrf1,Ubiquitin-like-containing PHD and RING finger domains protein 1 ; common 36483 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 GLY . 36483 1 2 2 PRO . 36483 1 3 3 LEU . 36483 1 4 4 GLY . 36483 1 5 5 SER . 36483 1 6 6 GLY . 36483 1 7 7 PRO . 36483 1 8 8 SER . 36483 1 9 9 CYS . 36483 1 10 10 ARG . 36483 1 11 11 PHE . 36483 1 12 12 CYS . 36483 1 13 13 LYS . 36483 1 14 14 ASP . 36483 1 15 15 ASP . 36483 1 16 16 GLU . 36483 1 17 17 ASN . 36483 1 18 18 LYS . 36483 1 19 19 PRO . 36483 1 20 20 CYS . 36483 1 21 21 ARG . 36483 1 22 22 LYS . 36483 1 23 23 CYS . 36483 1 24 24 ALA . 36483 1 25 25 CYS . 36483 1 26 26 HIS . 36483 1 27 27 VAL . 36483 1 28 28 CYS . 36483 1 29 29 GLY . 36483 1 30 30 GLY . 36483 1 31 31 ARG . 36483 1 32 32 GLU . 36483 1 33 33 ALA . 36483 1 34 34 PRO . 36483 1 35 35 GLU . 36483 1 36 36 LYS . 36483 1 37 37 GLN . 36483 1 38 38 LEU . 36483 1 39 39 LEU . 36483 1 40 40 CYS . 36483 1 41 41 ASP . 36483 1 42 42 GLU . 36483 1 43 43 CYS . 36483 1 44 44 ASP . 36483 1 45 45 MET . 36483 1 46 46 ALA . 36483 1 47 47 PHE . 36483 1 48 48 HIS . 36483 1 49 49 LEU . 36483 1 50 50 TYR . 36483 1 51 51 CYS . 36483 1 52 52 LEU . 36483 1 53 53 LYS . 36483 1 54 54 PRO . 36483 1 55 55 PRO . 36483 1 56 56 LEU . 36483 1 57 57 THR . 36483 1 58 58 SER . 36483 1 59 59 VAL . 36483 1 60 60 PRO . 36483 1 61 61 PRO . 36483 1 62 62 GLU . 36483 1 63 63 PRO . 36483 1 64 64 GLU . 36483 1 65 65 TRP . 36483 1 66 66 TYR . 36483 1 67 67 CYS . 36483 1 68 68 PRO . 36483 1 69 69 SER . 36483 1 70 70 CYS . 36483 1 71 71 ARG . 36483 1 72 72 THR . 36483 1 73 73 ASP . 36483 1 74 74 SER . 36483 1 75 75 ARG . 36483 1 76 76 ARG . 36483 1 77 77 GLU . 36483 1 78 78 VAL . 36483 1 79 79 GLN . 36483 1 80 80 SER . 36483 1 81 81 ALA . 36483 1 82 82 PHE . 36483 1 83 83 PRO . 36483 1 84 84 LYS . 36483 1 85 85 ARG . 36483 1 86 86 ARG . 36483 1 87 87 VAL . 36483 1 88 88 ARG . 36483 1 89 89 THR . 36483 1 90 90 LEU . 36483 1 91 91 LEU . 36483 1 92 92 SER . 36483 1 93 93 VAL . 36483 1 94 94 LEU . 36483 1 95 95 LYS . 36483 1 96 96 ASP . 36483 1 97 97 PRO . 36483 1 98 98 ILE . 36483 1 99 99 ALA . 36483 1 100 100 LYS . 36483 1 101 101 MET . 36483 1 102 102 ARG . 36483 1 103 103 ARG . 36483 1 104 104 LEU . 36483 1 105 105 VAL . 36483 1 106 106 ARG . 36483 1 107 107 ILE . 36483 1 108 108 GLU . 36483 1 109 109 GLN . 36483 1 110 110 ARG . 36483 1 111 111 GLN . 36483 1 112 112 LYS . 36483 1 113 113 ARG . 36483 1 114 114 LEU . 36483 1 115 115 GLU . 36483 1 116 116 GLY . 36483 1 117 117 ASN . 36483 1 118 118 GLU . 36483 1 119 119 PHE . 36483 1 120 120 GLU . 36483 1 121 121 ARG . 36483 1 122 122 ASP . 36483 1 123 123 SER . 36483 1 124 124 GLU . 36483 1 125 125 PRO . 36483 1 126 126 PHE . 36483 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 36483 1 . PRO 2 2 36483 1 . LEU 3 3 36483 1 . GLY 4 4 36483 1 . SER 5 5 36483 1 . GLY 6 6 36483 1 . PRO 7 7 36483 1 . SER 8 8 36483 1 . CYS 9 9 36483 1 . ARG 10 10 36483 1 . PHE 11 11 36483 1 . CYS 12 12 36483 1 . LYS 13 13 36483 1 . ASP 14 14 36483 1 . ASP 15 15 36483 1 . GLU 16 16 36483 1 . ASN 17 17 36483 1 . LYS 18 18 36483 1 . PRO 19 19 36483 1 . CYS 20 20 36483 1 . ARG 21 21 36483 1 . LYS 22 22 36483 1 . CYS 23 23 36483 1 . ALA 24 24 36483 1 . CYS 25 25 36483 1 . HIS 26 26 36483 1 . VAL 27 27 36483 1 . CYS 28 28 36483 1 . GLY 29 29 36483 1 . GLY 30 30 36483 1 . ARG 31 31 36483 1 . GLU 32 32 36483 1 . ALA 33 33 36483 1 . PRO 34 34 36483 1 . GLU 35 35 36483 1 . LYS 36 36 36483 1 . GLN 37 37 36483 1 . LEU 38 38 36483 1 . LEU 39 39 36483 1 . CYS 40 40 36483 1 . ASP 41 41 36483 1 . GLU 42 42 36483 1 . CYS 43 43 36483 1 . ASP 44 44 36483 1 . MET 45 45 36483 1 . ALA 46 46 36483 1 . PHE 47 47 36483 1 . HIS 48 48 36483 1 . LEU 49 49 36483 1 . TYR 50 50 36483 1 . CYS 51 51 36483 1 . LEU 52 52 36483 1 . LYS 53 53 36483 1 . PRO 54 54 36483 1 . PRO 55 55 36483 1 . LEU 56 56 36483 1 . THR 57 57 36483 1 . SER 58 58 36483 1 . VAL 59 59 36483 1 . PRO 60 60 36483 1 . PRO 61 61 36483 1 . GLU 62 62 36483 1 . PRO 63 63 36483 1 . GLU 64 64 36483 1 . TRP 65 65 36483 1 . TYR 66 66 36483 1 . CYS 67 67 36483 1 . PRO 68 68 36483 1 . SER 69 69 36483 1 . CYS 70 70 36483 1 . ARG 71 71 36483 1 . THR 72 72 36483 1 . ASP 73 73 36483 1 . SER 74 74 36483 1 . ARG 75 75 36483 1 . ARG 76 76 36483 1 . GLU 77 77 36483 1 . VAL 78 78 36483 1 . GLN 79 79 36483 1 . SER 80 80 36483 1 . ALA 81 81 36483 1 . PHE 82 82 36483 1 . PRO 83 83 36483 1 . LYS 84 84 36483 1 . ARG 85 85 36483 1 . ARG 86 86 36483 1 . VAL 87 87 36483 1 . ARG 88 88 36483 1 . THR 89 89 36483 1 . LEU 90 90 36483 1 . LEU 91 91 36483 1 . SER 92 92 36483 1 . VAL 93 93 36483 1 . LEU 94 94 36483 1 . LYS 95 95 36483 1 . ASP 96 96 36483 1 . PRO 97 97 36483 1 . ILE 98 98 36483 1 . ALA 99 99 36483 1 . LYS 100 100 36483 1 . MET 101 101 36483 1 . ARG 102 102 36483 1 . ARG 103 103 36483 1 . LEU 104 104 36483 1 . VAL 105 105 36483 1 . ARG 106 106 36483 1 . ILE 107 107 36483 1 . GLU 108 108 36483 1 . GLN 109 109 36483 1 . ARG 110 110 36483 1 . GLN 111 111 36483 1 . LYS 112 112 36483 1 . ARG 113 113 36483 1 . LEU 114 114 36483 1 . GLU 115 115 36483 1 . GLY 116 116 36483 1 . ASN 117 117 36483 1 . GLU 118 118 36483 1 . PHE 119 119 36483 1 . GLU 120 120 36483 1 . ARG 121 121 36483 1 . ASP 122 122 36483 1 . SER 123 123 36483 1 . GLU 124 124 36483 1 . PRO 125 125 36483 1 . PHE 126 126 36483 1 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 36483 _Entity.ID 2 _Entity.BMRB_code ZN _Entity.Name 'ZINC ION' _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _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 . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method syn _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _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 1 201 ZN $chem_comp_ZN 36483 2 2 202 ZN $chem_comp_ZN 36483 2 3 203 ZN $chem_comp_ZN 36483 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 36483 _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' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . Uhrf1 . 36483 1 2 1 $entity_1 . 10090 organism . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . Dppa3 . 36483 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 36483 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' 'E. coli' . 562 Escherichia coli . . . . . . . . . . 36483 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 36483 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2020-07-10 _Chem_comp.Modified_date 2020-07-10 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag no _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 36483 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 36483 ZN [Zn++] SMILES CACTVS 3.341 36483 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 36483 ZN [Zn+2] SMILES ACDLabs 10.04 36483 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 36483 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 36483 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 36483 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 36483 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 N N . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 36483 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_PHD_Stella _Sample.Sf_category sample _Sample.Sf_framecode PHD_Stella _Sample.Entry_ID 36483 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.66 mM [U-100% 13C; U-100% 15N] PHD_Stella, 10 mM sodium phosphate, 50 mM sodium chloride, 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 'Chimera of E3 ubiquitin-protein ligase UHRF1 and Developmental pluripotency-associated protein 3' '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . protein . . . mM . . . . 36483 1 2 'sodium chloride' 'natural abundance' . . . . . salt 50 . . mM . . . . 36483 1 3 'sodium phosphate' 'natural abundance' . . . . . buffer 10 . . mM . . . . 36483 1 4 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 36483 1 5 D2O [U-2H] . . . . . solvent 10 . . % . . . . 36483 1 stop_ save_ save_PHD_Stella_D2O _Sample.Sf_category sample _Sample.Sf_framecode PHD_Stella_D2O _Sample.Entry_ID 36483 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.66 mM [U-100% 13C; U-100% 15N] PHD_Stella, 10 mM sodium phosphate, 50 mM sodium chloride, 100% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Chimera of E3 ubiquitin-protein ligase UHRF1 and Developmental pluripotency-associated protein 3' '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . protein . . . mM . . . . 36483 2 2 'sodium chloride' 'natural abundance' . . . . . salt 50 . . mM . . . . 36483 2 3 'sodium phosphate' 'natural abundance' . . . . . buffer 10 . . mM . . . . 36483 2 4 D2O [U-2H] . . . . . solvent 100 . . % . . . . 36483 2 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 36483 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details PHD_Stella 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' 50 . mM 36483 1 pH 7.0 . pH 36483 1 pressure 1 . atm 36483 1 temperature 293 . K 36483 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 36483 _Sample_condition_list.ID 2 _Sample_condition_list.Name . _Sample_condition_list.Details PHD_Stella_D2O loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 50 . mM 36483 2 pH 7.0 . pD 36483 2 pressure 1 . atm 36483 2 temperature 293 . K 36483 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36483 _Software.ID 1 _Software.Type . _Software.Name TopSpin _Software.Version 3.5 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 36483 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 36483 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36483 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version 2017 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 36483 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 36483 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 36483 _Software.ID 3 _Software.Type . _Software.Name CYANA _Software.Version 3.98 _Software.DOI . _Software.Details 'FLYA macro was used for fully automated chemical shift assignments' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 36483 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 36483 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 36483 _Software.ID 4 _Software.Type . _Software.Name MAGRO _Software.Version 2.01.41 _Software.DOI . _Software.Details 'Upgraded version of KUJIRA (Kobayashi, N. et al.)' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 36483 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 36483 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 36483 _Software.ID 5 _Software.Type . _Software.Name NMRViewJ _Software.Version 9 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B. J.' . . 36483 5 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 36483 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 36483 _Software.ID 6 _Software.Type . _Software.Name CYANA _Software.Version 3.98 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 36483 6 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 36483 6 stop_ save_ save_software_7 _Software.Sf_category software _Software.Sf_framecode software_7 _Software.Entry_ID 36483 _Software.ID 7 _Software.Type . _Software.Name Amber _Software.Version 12 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 36483 7 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 36483 7 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 36483 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 36483 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _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 36483 _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 III' . 500 . . . 36483 1 2 NMR_spectrometer_2 Bruker 'AVANCE III' . 800 . . . 36483 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 36483 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 2 '2D 1H-13C HSQC aliphatic' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 3 '2D 1H-13C HSQC aliphatic' . . . . . . . . . . . . . 2 $PHD_Stella_D2O isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 4 '3D HNCO' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 5 '3D HN(CO)CA' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 6 '3D HNCACB' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 7 '3D CBCA(CO)NH' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 8 '2D 1H-13C HSQC aromatic' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 9 '2D 1H-13C HSQC aromatic' . . . . . . . . . . . . . 2 $PHD_Stella_D2O isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 10 '3D HCCH-TOCSY' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 11 '3D H(CCO)NH' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 12 '3D C(CO)NH' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 13 '3D 1H-15N NOESY' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 14 '3D 1H-13C NOESY aliphatic' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36483 1 15 '3D 1H-13C NOESY aliphatic' . . . . . . . . . . . . . 2 $PHD_Stella_D2O isotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36483 1 16 '3D 1H-13C NOESY aromatic' . . . . . . . . . . . . . 1 $PHD_Stella isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36483 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 36483 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details ; Chemical shift reference of 1H resonance was based on the proton signal of water (4.821ppm at 293K) and then zero ppm offsets for 15N and 13C resonace 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 water protons . . . . ppm 0.000 internal indirect 0.251449530 . . . . . 36483 1 H 1 water protons . . . . ppm 4.821 internal direct 1.0 . . . . . 36483 1 N 15 water protons . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 36483 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 36483 _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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $PHD_Stella isotropic 36483 1 2 '2D 1H-13C HSQC aliphatic' 1 $PHD_Stella isotropic 36483 1 3 '2D 1H-13C HSQC aliphatic' 2 $PHD_Stella_D2O isotropic 36483 1 4 '3D HNCO' 1 $PHD_Stella isotropic 36483 1 5 '3D HN(CO)CA' 1 $PHD_Stella isotropic 36483 1 6 '3D HNCACB' 1 $PHD_Stella isotropic 36483 1 7 '3D CBCA(CO)NH' 1 $PHD_Stella isotropic 36483 1 8 '2D 1H-13C HSQC aromatic' 1 $PHD_Stella isotropic 36483 1 9 '2D 1H-13C HSQC aromatic' 2 $PHD_Stella_D2O isotropic 36483 1 10 '3D HCCH-TOCSY' 1 $PHD_Stella isotropic 36483 1 11 '3D H(CCO)NH' 1 $PHD_Stella isotropic 36483 1 12 '3D C(CO)NH' 1 $PHD_Stella isotropic 36483 1 13 '3D 1H-15N NOESY' 1 $PHD_Stella isotropic 36483 1 14 '3D 1H-13C NOESY aliphatic' 1 $PHD_Stella isotropic 36483 1 15 '3D 1H-13C NOESY aliphatic' 2 $PHD_Stella_D2O isotropic 36483 1 16 '3D 1H-13C NOESY aromatic' 1 $PHD_Stella isotropic 36483 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 2 2 PRO HA H 1 4.473 0.030 . 1 . . . . A 2 PRO HA . 36483 1 2 . 1 . 1 2 2 PRO HB2 H 1 2.320 0.030 . 2 . . . . A 2 PRO HB2 . 36483 1 3 . 1 . 1 2 2 PRO HB3 H 1 1.945 0.030 . 2 . . . . A 2 PRO HB3 . 36483 1 4 . 1 . 1 2 2 PRO HG2 H 1 2.015 0.030 . 1 . . . . A 2 PRO HG2 . 36483 1 5 . 1 . 1 2 2 PRO HG3 H 1 2.015 0.030 . 1 . . . . A 2 PRO HG3 . 36483 1 6 . 1 . 1 2 2 PRO HD2 H 1 3.584 0.030 . 1 . . . . A 2 PRO HD2 . 36483 1 7 . 1 . 1 2 2 PRO HD3 H 1 3.584 0.030 . 1 . . . . A 2 PRO HD3 . 36483 1 8 . 1 . 1 2 2 PRO C C 13 177.085 0.300 . 1 . . . . A 2 PRO C . 36483 1 9 . 1 . 1 2 2 PRO CA C 13 63.147 0.300 . 1 . . . . A 2 PRO CA . 36483 1 10 . 1 . 1 2 2 PRO CB C 13 32.368 0.300 . 1 . . . . A 2 PRO CB . 36483 1 11 . 1 . 1 2 2 PRO CG C 13 27.181 0.300 . 1 . . . . A 2 PRO CG . 36483 1 12 . 1 . 1 2 2 PRO CD C 13 49.672 0.300 . 1 . . . . A 2 PRO CD . 36483 1 13 . 1 . 1 3 3 LEU H H 1 8.567 0.030 . 1 . . . . A 3 LEU H . 36483 1 14 . 1 . 1 3 3 LEU HA H 1 4.352 0.030 . 1 . . . . A 3 LEU HA . 36483 1 15 . 1 . 1 3 3 LEU HB2 H 1 1.679 0.030 . 2 . . . . A 3 LEU HB2 . 36483 1 16 . 1 . 1 3 3 LEU HB3 H 1 1.619 0.030 . 2 . . . . A 3 LEU HB3 . 36483 1 17 . 1 . 1 3 3 LEU HG H 1 1.659 0.030 . 1 . . . . A 3 LEU HG . 36483 1 18 . 1 . 1 3 3 LEU HD11 H 1 0.897 0.030 . 2 . . . . A 3 LEU HD11 . 36483 1 19 . 1 . 1 3 3 LEU HD12 H 1 0.897 0.030 . 2 . . . . A 3 LEU HD12 . 36483 1 20 . 1 . 1 3 3 LEU HD13 H 1 0.897 0.030 . 2 . . . . A 3 LEU HD13 . 36483 1 21 . 1 . 1 3 3 LEU HD21 H 1 0.940 0.030 . 2 . . . . A 3 LEU HD21 . 36483 1 22 . 1 . 1 3 3 LEU HD22 H 1 0.940 0.030 . 2 . . . . A 3 LEU HD22 . 36483 1 23 . 1 . 1 3 3 LEU HD23 H 1 0.940 0.030 . 2 . . . . A 3 LEU HD23 . 36483 1 24 . 1 . 1 3 3 LEU C C 13 177.997 0.300 . 1 . . . . A 3 LEU C . 36483 1 25 . 1 . 1 3 3 LEU CA C 13 55.512 0.300 . 1 . . . . A 3 LEU CA . 36483 1 26 . 1 . 1 3 3 LEU CB C 13 42.216 0.300 . 1 . . . . A 3 LEU CB . 36483 1 27 . 1 . 1 3 3 LEU CG C 13 27.010 0.300 . 1 . . . . A 3 LEU CG . 36483 1 28 . 1 . 1 3 3 LEU CD1 C 13 23.439 0.300 . 2 . . . . A 3 LEU CD1 . 36483 1 29 . 1 . 1 3 3 LEU CD2 C 13 24.848 0.300 . 2 . . . . A 3 LEU CD2 . 36483 1 30 . 1 . 1 3 3 LEU N N 15 122.338 0.300 . 1 . . . . A 3 LEU N . 36483 1 31 . 1 . 1 4 4 GLY H H 1 8.431 0.030 . 1 . . . . A 4 GLY H . 36483 1 32 . 1 . 1 4 4 GLY HA2 H 1 3.991 0.030 . 1 . . . . A 4 GLY HA2 . 36483 1 33 . 1 . 1 4 4 GLY HA3 H 1 3.991 0.030 . 1 . . . . A 4 GLY HA3 . 36483 1 34 . 1 . 1 4 4 GLY C C 13 174.175 0.300 . 1 . . . . A 4 GLY C . 36483 1 35 . 1 . 1 4 4 GLY CA C 13 45.335 0.300 . 1 . . . . A 4 GLY CA . 36483 1 36 . 1 . 1 4 4 GLY N N 15 110.085 0.300 . 1 . . . . A 4 GLY N . 36483 1 37 . 1 . 1 5 5 SER H H 1 8.246 0.030 . 1 . . . . A 5 SER H . 36483 1 38 . 1 . 1 5 5 SER HA H 1 4.507 0.030 . 1 . . . . A 5 SER HA . 36483 1 39 . 1 . 1 5 5 SER HB2 H 1 3.861 0.030 . 1 . . . . A 5 SER HB2 . 36483 1 40 . 1 . 1 5 5 SER HB3 H 1 3.861 0.030 . 1 . . . . A 5 SER HB3 . 36483 1 41 . 1 . 1 5 5 SER C C 13 174.486 0.300 . 1 . . . . A 5 SER C . 36483 1 42 . 1 . 1 5 5 SER CA C 13 58.290 0.300 . 1 . . . . A 5 SER CA . 36483 1 43 . 1 . 1 5 5 SER CB C 13 64.048 0.300 . 1 . . . . A 5 SER CB . 36483 1 44 . 1 . 1 5 5 SER N N 15 115.538 0.300 . 1 . . . . A 5 SER N . 36483 1 45 . 1 . 1 6 6 GLY H H 1 8.315 0.030 . 1 . . . . A 6 GLY H . 36483 1 46 . 1 . 1 6 6 GLY HA2 H 1 4.091 0.030 . 1 . . . . A 6 GLY HA2 . 36483 1 47 . 1 . 1 6 6 GLY HA3 H 1 4.091 0.030 . 1 . . . . A 6 GLY HA3 . 36483 1 48 . 1 . 1 6 6 GLY C C 13 171.282 0.300 . 1 . . . . A 6 GLY C . 36483 1 49 . 1 . 1 6 6 GLY CA C 13 44.564 0.300 . 1 . . . . A 6 GLY CA . 36483 1 50 . 1 . 1 6 6 GLY N N 15 110.766 0.300 . 1 . . . . A 6 GLY N . 36483 1 51 . 1 . 1 7 7 PRO HB2 H 1 2.646 0.030 . 2 . . . . A 7 PRO HB2 . 36483 1 52 . 1 . 1 7 7 PRO HB3 H 1 2.470 0.030 . 2 . . . . A 7 PRO HB3 . 36483 1 53 . 1 . 1 7 7 PRO HG2 H 1 2.269 0.030 . 2 . . . . A 7 PRO HG2 . 36483 1 54 . 1 . 1 7 7 PRO HG3 H 1 2.143 0.030 . 2 . . . . A 7 PRO HG3 . 36483 1 55 . 1 . 1 7 7 PRO HD2 H 1 3.709 0.030 . 2 . . . . A 7 PRO HD2 . 36483 1 56 . 1 . 1 7 7 PRO HD3 H 1 3.496 0.030 . 2 . . . . A 7 PRO HD3 . 36483 1 57 . 1 . 1 7 7 PRO CB C 13 34.176 0.300 . 1 . . . . A 7 PRO CB . 36483 1 58 . 1 . 1 7 7 PRO CG C 13 28.309 0.300 . 1 . . . . A 7 PRO CG . 36483 1 59 . 1 . 1 8 8 SER H H 1 8.998 0.030 . 1 . . . . A 8 SER H . 36483 1 60 . 1 . 1 8 8 SER HA H 1 4.633 0.030 . 1 . . . . A 8 SER HA . 36483 1 61 . 1 . 1 8 8 SER HB2 H 1 3.623 0.030 . 1 . . . . A 8 SER HB2 . 36483 1 62 . 1 . 1 8 8 SER HB3 H 1 3.623 0.030 . 1 . . . . A 8 SER HB3 . 36483 1 63 . 1 . 1 8 8 SER C C 13 173.701 0.300 . 1 . . . . A 8 SER C . 36483 1 64 . 1 . 1 8 8 SER CA C 13 57.993 0.300 . 1 . . . . A 8 SER CA . 36483 1 65 . 1 . 1 8 8 SER CB C 13 65.069 0.300 . 1 . . . . A 8 SER CB . 36483 1 66 . 1 . 1 8 8 SER N N 15 121.174 0.300 . 1 . . . . A 8 SER N . 36483 1 67 . 1 . 1 9 9 CYS H H 1 8.982 0.030 . 1 . . . . A 9 CYS H . 36483 1 68 . 1 . 1 9 9 CYS HA H 1 4.446 0.030 . 1 . . . . A 9 CYS HA . 36483 1 69 . 1 . 1 9 9 CYS HB2 H 1 3.352 0.030 . 1 . . . . A 9 CYS HB2 . 36483 1 70 . 1 . 1 9 9 CYS HB3 H 1 3.352 0.030 . 1 . . . . A 9 CYS HB3 . 36483 1 71 . 1 . 1 9 9 CYS C C 13 177.595 0.300 . 1 . . . . A 9 CYS C . 36483 1 72 . 1 . 1 9 9 CYS CA C 13 59.220 0.300 . 1 . . . . A 9 CYS CA . 36483 1 73 . 1 . 1 9 9 CYS CB C 13 31.834 0.300 . 1 . . . . A 9 CYS CB . 36483 1 74 . 1 . 1 9 9 CYS N N 15 126.602 0.300 . 1 . . . . A 9 CYS N . 36483 1 75 . 1 . 1 10 10 ARG H H 1 9.275 0.030 . 1 . . . . A 10 ARG H . 36483 1 76 . 1 . 1 10 10 ARG HA H 1 3.996 0.030 . 1 . . . . A 10 ARG HA . 36483 1 77 . 1 . 1 10 10 ARG HB2 H 1 1.572 0.030 . 1 . . . . A 10 ARG HB2 . 36483 1 78 . 1 . 1 10 10 ARG HB3 H 1 1.572 0.030 . 1 . . . . A 10 ARG HB3 . 36483 1 79 . 1 . 1 10 10 ARG HG2 H 1 1.333 0.030 . 1 . . . . A 10 ARG HG2 . 36483 1 80 . 1 . 1 10 10 ARG HG3 H 1 1.333 0.030 . 1 . . . . A 10 ARG HG3 . 36483 1 81 . 1 . 1 10 10 ARG HD2 H 1 2.925 0.030 . 1 . . . . A 10 ARG HD2 . 36483 1 82 . 1 . 1 10 10 ARG HD3 H 1 2.925 0.030 . 1 . . . . A 10 ARG HD3 . 36483 1 83 . 1 . 1 10 10 ARG C C 13 176.341 0.300 . 1 . . . . A 10 ARG C . 36483 1 84 . 1 . 1 10 10 ARG CA C 13 57.726 0.300 . 1 . . . . A 10 ARG CA . 36483 1 85 . 1 . 1 10 10 ARG CB C 13 29.753 0.300 . 1 . . . . A 10 ARG CB . 36483 1 86 . 1 . 1 10 10 ARG CG C 13 26.282 0.300 . 1 . . . . A 10 ARG CG . 36483 1 87 . 1 . 1 10 10 ARG CD C 13 43.391 0.300 . 1 . . . . A 10 ARG CD . 36483 1 88 . 1 . 1 10 10 ARG N N 15 129.046 0.300 . 1 . . . . A 10 ARG N . 36483 1 89 . 1 . 1 11 11 PHE H H 1 8.967 0.030 . 1 . . . . A 11 PHE H . 36483 1 90 . 1 . 1 11 11 PHE HA H 1 4.348 0.030 . 1 . . . . A 11 PHE HA . 36483 1 91 . 1 . 1 11 11 PHE HB2 H 1 3.196 0.030 . 2 . . . . A 11 PHE HB2 . 36483 1 92 . 1 . 1 11 11 PHE HB3 H 1 3.017 0.030 . 2 . . . . A 11 PHE HB3 . 36483 1 93 . 1 . 1 11 11 PHE HD1 H 1 7.240 0.030 . 1 . . . . A 11 PHE HD1 . 36483 1 94 . 1 . 1 11 11 PHE HD2 H 1 7.240 0.030 . 1 . . . . A 11 PHE HD2 . 36483 1 95 . 1 . 1 11 11 PHE C C 13 176.392 0.300 . 1 . . . . A 11 PHE C . 36483 1 96 . 1 . 1 11 11 PHE CA C 13 60.865 0.300 . 1 . . . . A 11 PHE CA . 36483 1 97 . 1 . 1 11 11 PHE CB C 13 39.515 0.300 . 1 . . . . A 11 PHE CB . 36483 1 98 . 1 . 1 11 11 PHE CD1 C 13 131.472 0.300 . 1 . . . . A 11 PHE CD1 . 36483 1 99 . 1 . 1 11 11 PHE CD2 C 13 131.472 0.300 . 1 . . . . A 11 PHE CD2 . 36483 1 100 . 1 . 1 11 11 PHE CE1 C 13 131.773 0.300 . 1 . . . . A 11 PHE CE1 . 36483 1 101 . 1 . 1 11 11 PHE CE2 C 13 131.773 0.300 . 1 . . . . A 11 PHE CE2 . 36483 1 102 . 1 . 1 11 11 PHE N N 15 121.153 0.300 . 1 . . . . A 11 PHE N . 36483 1 103 . 1 . 1 12 12 CYS H H 1 8.232 0.030 . 1 . . . . A 12 CYS H . 36483 1 104 . 1 . 1 12 12 CYS HA H 1 4.505 0.030 . 1 . . . . A 12 CYS HA . 36483 1 105 . 1 . 1 12 12 CYS CA C 13 57.655 0.300 . 1 . . . . A 12 CYS CA . 36483 1 106 . 1 . 1 12 12 CYS N N 15 121.928 0.300 . 1 . . . . A 12 CYS N . 36483 1 107 . 1 . 1 13 13 LYS H H 1 7.517 0.030 . 1 . . . . A 13 LYS H . 36483 1 108 . 1 . 1 13 13 LYS HA H 1 3.979 0.030 . 1 . . . . A 13 LYS HA . 36483 1 109 . 1 . 1 13 13 LYS HB2 H 1 2.023 0.030 . 2 . . . . A 13 LYS HB2 . 36483 1 110 . 1 . 1 13 13 LYS HB3 H 1 1.933 0.030 . 2 . . . . A 13 LYS HB3 . 36483 1 111 . 1 . 1 13 13 LYS HG2 H 1 0.882 0.030 . 1 . . . . A 13 LYS HG2 . 36483 1 112 . 1 . 1 13 13 LYS HG3 H 1 0.882 0.030 . 1 . . . . A 13 LYS HG3 . 36483 1 113 . 1 . 1 13 13 LYS HD2 H 1 1.307 0.030 . 2 . . . . A 13 LYS HD2 . 36483 1 114 . 1 . 1 13 13 LYS HD3 H 1 1.246 0.030 . 2 . . . . A 13 LYS HD3 . 36483 1 115 . 1 . 1 13 13 LYS HE2 H 1 2.960 0.030 . 1 . . . . A 13 LYS HE2 . 36483 1 116 . 1 . 1 13 13 LYS HE3 H 1 2.960 0.030 . 1 . . . . A 13 LYS HE3 . 36483 1 117 . 1 . 1 13 13 LYS C C 13 174.969 0.300 . 1 . . . . A 13 LYS C . 36483 1 118 . 1 . 1 13 13 LYS CA C 13 57.628 0.300 . 1 . . . . A 13 LYS CA . 36483 1 119 . 1 . 1 13 13 LYS CB C 13 29.008 0.300 . 1 . . . . A 13 LYS CB . 36483 1 120 . 1 . 1 13 13 LYS CE C 13 42.300 0.300 . 1 . . . . A 13 LYS CE . 36483 1 121 . 1 . 1 13 13 LYS N N 15 134.051 0.300 . 1 . . . . A 13 LYS N . 36483 1 122 . 1 . 1 14 14 ASP H H 1 9.086 0.030 . 1 . . . . A 14 ASP H . 36483 1 123 . 1 . 1 14 14 ASP HA H 1 4.214 0.030 . 1 . . . . A 14 ASP HA . 36483 1 124 . 1 . 1 14 14 ASP HB2 H 1 2.994 0.030 . 1 . . . . A 14 ASP HB2 . 36483 1 125 . 1 . 1 14 14 ASP HB3 H 1 2.994 0.030 . 1 . . . . A 14 ASP HB3 . 36483 1 126 . 1 . 1 14 14 ASP C C 13 175.091 0.300 . 1 . . . . A 14 ASP C . 36483 1 127 . 1 . 1 14 14 ASP CA C 13 54.532 0.300 . 1 . . . . A 14 ASP CA . 36483 1 128 . 1 . 1 14 14 ASP CB C 13 38.424 0.300 . 1 . . . . A 14 ASP CB . 36483 1 129 . 1 . 1 14 14 ASP N N 15 118.465 0.300 . 1 . . . . A 14 ASP N . 36483 1 130 . 1 . 1 15 15 ASP H H 1 7.228 0.030 . 1 . . . . A 15 ASP H . 36483 1 131 . 1 . 1 15 15 ASP HA H 1 4.513 0.030 . 1 . . . . A 15 ASP HA . 36483 1 132 . 1 . 1 15 15 ASP HB2 H 1 2.986 0.030 . 2 . . . . A 15 ASP HB2 . 36483 1 133 . 1 . 1 15 15 ASP HB3 H 1 2.581 0.030 . 2 . . . . A 15 ASP HB3 . 36483 1 134 . 1 . 1 15 15 ASP C C 13 176.638 0.300 . 1 . . . . A 15 ASP C . 36483 1 135 . 1 . 1 15 15 ASP CA C 13 53.815 0.300 . 1 . . . . A 15 ASP CA . 36483 1 136 . 1 . 1 15 15 ASP CB C 13 40.571 0.300 . 1 . . . . A 15 ASP CB . 36483 1 137 . 1 . 1 15 15 ASP N N 15 118.747 0.300 . 1 . . . . A 15 ASP N . 36483 1 138 . 1 . 1 16 16 GLU H H 1 8.605 0.030 . 1 . . . . A 16 GLU H . 36483 1 139 . 1 . 1 16 16 GLU HA H 1 3.875 0.030 . 1 . . . . A 16 GLU HA . 36483 1 140 . 1 . 1 16 16 GLU HB2 H 1 2.092 0.030 . 2 . . . . A 16 GLU HB2 . 36483 1 141 . 1 . 1 16 16 GLU HB3 H 1 1.968 0.030 . 2 . . . . A 16 GLU HB3 . 36483 1 142 . 1 . 1 16 16 GLU HG2 H 1 2.324 0.030 . 2 . . . . A 16 GLU HG2 . 36483 1 143 . 1 . 1 16 16 GLU HG3 H 1 2.104 0.030 . 2 . . . . A 16 GLU HG3 . 36483 1 144 . 1 . 1 16 16 GLU C C 13 176.829 0.300 . 1 . . . . A 16 GLU C . 36483 1 145 . 1 . 1 16 16 GLU CA C 13 58.035 0.300 . 1 . . . . A 16 GLU CA . 36483 1 146 . 1 . 1 16 16 GLU CB C 13 29.289 0.300 . 1 . . . . A 16 GLU CB . 36483 1 147 . 1 . 1 16 16 GLU N N 15 125.766 0.300 . 1 . . . . A 16 GLU N . 36483 1 148 . 1 . 1 17 17 ASN H H 1 8.592 0.030 . 1 . . . . A 17 ASN H . 36483 1 149 . 1 . 1 17 17 ASN HA H 1 4.665 0.030 . 1 . . . . A 17 ASN HA . 36483 1 150 . 1 . 1 17 17 ASN HB2 H 1 2.873 0.030 . 1 . . . . A 17 ASN HB2 . 36483 1 151 . 1 . 1 17 17 ASN HB3 H 1 2.873 0.030 . 1 . . . . A 17 ASN HB3 . 36483 1 152 . 1 . 1 17 17 ASN HD21 H 1 7.037 0.030 . 2 . . . . A 17 ASN HD21 . 36483 1 153 . 1 . 1 17 17 ASN HD22 H 1 7.984 0.030 . 2 . . . . A 17 ASN HD22 . 36483 1 154 . 1 . 1 17 17 ASN C C 13 174.639 0.300 . 1 . . . . A 17 ASN C . 36483 1 155 . 1 . 1 17 17 ASN CA C 13 53.848 0.300 . 1 . . . . A 17 ASN CA . 36483 1 156 . 1 . 1 17 17 ASN CB C 13 39.101 0.300 . 1 . . . . A 17 ASN CB . 36483 1 157 . 1 . 1 17 17 ASN N N 15 115.928 0.300 . 1 . . . . A 17 ASN N . 36483 1 158 . 1 . 1 17 17 ASN ND2 N 15 115.547 0.300 . 1 . . . . A 17 ASN ND2 . 36483 1 159 . 1 . 1 18 18 LYS H H 1 7.986 0.030 . 1 . . . . A 18 LYS H . 36483 1 160 . 1 . 1 18 18 LYS HA H 1 4.615 0.030 . 1 . . . . A 18 LYS HA . 36483 1 161 . 1 . 1 18 18 LYS HB2 H 1 1.929 0.030 . 1 . . . . A 18 LYS HB2 . 36483 1 162 . 1 . 1 18 18 LYS HB3 H 1 1.929 0.030 . 1 . . . . A 18 LYS HB3 . 36483 1 163 . 1 . 1 18 18 LYS HE2 H 1 3.037 0.030 . 1 . . . . A 18 LYS HE2 . 36483 1 164 . 1 . 1 18 18 LYS HE3 H 1 3.037 0.030 . 1 . . . . A 18 LYS HE3 . 36483 1 165 . 1 . 1 18 18 LYS C C 13 173.371 0.300 . 1 . . . . A 18 LYS C . 36483 1 166 . 1 . 1 18 18 LYS CA C 13 53.020 0.300 . 1 . . . . A 18 LYS CA . 36483 1 167 . 1 . 1 18 18 LYS CB C 13 34.390 0.300 . 1 . . . . A 18 LYS CB . 36483 1 168 . 1 . 1 18 18 LYS CG C 13 24.865 0.300 . 1 . . . . A 18 LYS CG . 36483 1 169 . 1 . 1 18 18 LYS CD C 13 29.122 0.300 . 1 . . . . A 18 LYS CD . 36483 1 170 . 1 . 1 18 18 LYS CE C 13 42.250 0.300 . 1 . . . . A 18 LYS CE . 36483 1 171 . 1 . 1 18 18 LYS N N 15 121.689 0.300 . 1 . . . . A 18 LYS N . 36483 1 172 . 1 . 1 19 19 PRO HA H 1 4.552 0.030 . 1 . . . . A 19 PRO HA . 36483 1 173 . 1 . 1 19 19 PRO HB2 H 1 2.203 0.030 . 2 . . . . A 19 PRO HB2 . 36483 1 174 . 1 . 1 19 19 PRO HB3 H 1 1.785 0.030 . 2 . . . . A 19 PRO HB3 . 36483 1 175 . 1 . 1 19 19 PRO HG2 H 1 2.015 0.030 . 1 . . . . A 19 PRO HG2 . 36483 1 176 . 1 . 1 19 19 PRO HG3 H 1 2.015 0.030 . 1 . . . . A 19 PRO HG3 . 36483 1 177 . 1 . 1 19 19 PRO HD2 H 1 3.715 0.030 . 1 . . . . A 19 PRO HD2 . 36483 1 178 . 1 . 1 19 19 PRO HD3 H 1 3.715 0.030 . 1 . . . . A 19 PRO HD3 . 36483 1 179 . 1 . 1 19 19 PRO C C 13 176.551 0.300 . 1 . . . . A 19 PRO C . 36483 1 180 . 1 . 1 19 19 PRO CA C 13 62.541 0.300 . 1 . . . . A 19 PRO CA . 36483 1 181 . 1 . 1 19 19 PRO CB C 13 32.605 0.300 . 1 . . . . A 19 PRO CB . 36483 1 182 . 1 . 1 19 19 PRO CG C 13 27.173 0.300 . 1 . . . . A 19 PRO CG . 36483 1 183 . 1 . 1 19 19 PRO CD C 13 50.508 0.300 . 1 . . . . A 19 PRO CD . 36483 1 184 . 1 . 1 20 20 CYS H H 1 9.340 0.030 . 1 . . . . A 20 CYS H . 36483 1 185 . 1 . 1 20 20 CYS HA H 1 4.429 0.030 . 1 . . . . A 20 CYS HA . 36483 1 186 . 1 . 1 20 20 CYS HB2 H 1 3.023 0.030 . 2 . . . . A 20 CYS HB2 . 36483 1 187 . 1 . 1 20 20 CYS HB3 H 1 2.444 0.030 . 2 . . . . A 20 CYS HB3 . 36483 1 188 . 1 . 1 20 20 CYS C C 13 174.991 0.300 . 1 . . . . A 20 CYS C . 36483 1 189 . 1 . 1 20 20 CYS CA C 13 60.523 0.300 . 1 . . . . A 20 CYS CA . 36483 1 190 . 1 . 1 20 20 CYS CB C 13 32.747 0.300 . 1 . . . . A 20 CYS CB . 36483 1 191 . 1 . 1 20 20 CYS N N 15 122.541 0.300 . 1 . . . . A 20 CYS N . 36483 1 192 . 1 . 1 21 21 ARG H H 1 8.848 0.030 . 1 . . . . A 21 ARG H . 36483 1 193 . 1 . 1 21 21 ARG HA H 1 4.538 0.030 . 1 . . . . A 21 ARG HA . 36483 1 194 . 1 . 1 21 21 ARG HB2 H 1 2.026 0.030 . 1 . . . . A 21 ARG HB2 . 36483 1 195 . 1 . 1 21 21 ARG HB3 H 1 2.026 0.030 . 1 . . . . A 21 ARG HB3 . 36483 1 196 . 1 . 1 21 21 ARG HG2 H 1 1.929 0.030 . 1 . . . . A 21 ARG HG2 . 36483 1 197 . 1 . 1 21 21 ARG HG3 H 1 1.929 0.030 . 1 . . . . A 21 ARG HG3 . 36483 1 198 . 1 . 1 21 21 ARG HD2 H 1 3.260 0.030 . 1 . . . . A 21 ARG HD2 . 36483 1 199 . 1 . 1 21 21 ARG HD3 H 1 3.260 0.030 . 1 . . . . A 21 ARG HD3 . 36483 1 200 . 1 . 1 21 21 ARG C C 13 175.674 0.300 . 1 . . . . A 21 ARG C . 36483 1 201 . 1 . 1 21 21 ARG CA C 13 56.454 0.300 . 1 . . . . A 21 ARG CA . 36483 1 202 . 1 . 1 21 21 ARG CB C 13 30.170 0.300 . 1 . . . . A 21 ARG CB . 36483 1 203 . 1 . 1 21 21 ARG CG C 13 26.043 0.300 . 1 . . . . A 21 ARG CG . 36483 1 204 . 1 . 1 21 21 ARG N N 15 127.696 0.300 . 1 . . . . A 21 ARG N . 36483 1 205 . 1 . 1 22 22 LYS H H 1 8.932 0.030 . 1 . . . . A 22 LYS H . 36483 1 206 . 1 . 1 22 22 LYS HA H 1 4.071 0.030 . 1 . . . . A 22 LYS HA . 36483 1 207 . 1 . 1 22 22 LYS HB2 H 1 2.062 0.030 . 1 . . . . A 22 LYS HB2 . 36483 1 208 . 1 . 1 22 22 LYS HB3 H 1 2.062 0.030 . 1 . . . . A 22 LYS HB3 . 36483 1 209 . 1 . 1 22 22 LYS HG2 H 1 0.931 0.030 . 1 . . . . A 22 LYS HG2 . 36483 1 210 . 1 . 1 22 22 LYS HG3 H 1 0.931 0.030 . 1 . . . . A 22 LYS HG3 . 36483 1 211 . 1 . 1 22 22 LYS HE2 H 1 2.351 0.030 . 1 . . . . A 22 LYS HE2 . 36483 1 212 . 1 . 1 22 22 LYS HE3 H 1 2.351 0.030 . 1 . . . . A 22 LYS HE3 . 36483 1 213 . 1 . 1 22 22 LYS C C 13 176.351 0.300 . 1 . . . . A 22 LYS C . 36483 1 214 . 1 . 1 22 22 LYS CA C 13 56.940 0.300 . 1 . . . . A 22 LYS CA . 36483 1 215 . 1 . 1 22 22 LYS CB C 13 32.693 0.300 . 1 . . . . A 22 LYS CB . 36483 1 216 . 1 . 1 22 22 LYS CG C 13 24.324 0.300 . 1 . . . . A 22 LYS CG . 36483 1 217 . 1 . 1 22 22 LYS CD C 13 28.236 0.300 . 1 . . . . A 22 LYS CD . 36483 1 218 . 1 . 1 22 22 LYS CE C 13 42.043 0.300 . 1 . . . . A 22 LYS CE . 36483 1 219 . 1 . 1 22 22 LYS N N 15 120.567 0.300 . 1 . . . . A 22 LYS N . 36483 1 220 . 1 . 1 23 23 CYS H H 1 8.288 0.030 . 1 . . . . A 23 CYS H . 36483 1 221 . 1 . 1 23 23 CYS HA H 1 4.064 0.030 . 1 . . . . A 23 CYS HA . 36483 1 222 . 1 . 1 23 23 CYS HB2 H 1 2.052 0.030 . 1 . . . . A 23 CYS HB2 . 36483 1 223 . 1 . 1 23 23 CYS HB3 H 1 2.052 0.030 . 1 . . . . A 23 CYS HB3 . 36483 1 224 . 1 . 1 23 23 CYS CA C 13 62.539 0.300 . 1 . . . . A 23 CYS CA . 36483 1 225 . 1 . 1 23 23 CYS CB C 13 32.678 0.300 . 1 . . . . A 23 CYS CB . 36483 1 226 . 1 . 1 23 23 CYS N N 15 122.008 0.300 . 1 . . . . A 23 CYS N . 36483 1 227 . 1 . 1 24 24 ALA H H 1 8.591 0.030 . 1 . . . . A 24 ALA H . 36483 1 228 . 1 . 1 24 24 ALA HA H 1 4.521 0.030 . 1 . . . . A 24 ALA HA . 36483 1 229 . 1 . 1 24 24 ALA HB1 H 1 1.333 0.030 . 1 . . . . A 24 ALA HB1 . 36483 1 230 . 1 . 1 24 24 ALA HB2 H 1 1.333 0.030 . 1 . . . . A 24 ALA HB2 . 36483 1 231 . 1 . 1 24 24 ALA HB3 H 1 1.333 0.030 . 1 . . . . A 24 ALA HB3 . 36483 1 232 . 1 . 1 24 24 ALA C C 13 174.999 0.300 . 1 . . . . A 24 ALA C . 36483 1 233 . 1 . 1 24 24 ALA CA C 13 50.675 0.300 . 1 . . . . A 24 ALA CA . 36483 1 234 . 1 . 1 24 24 ALA CB C 13 18.365 0.300 . 1 . . . . A 24 ALA CB . 36483 1 235 . 1 . 1 24 24 ALA N N 15 124.856 0.300 . 1 . . . . A 24 ALA N . 36483 1 236 . 1 . 1 25 25 CYS H H 1 6.813 0.030 . 1 . . . . A 25 CYS H . 36483 1 237 . 1 . 1 25 25 CYS HA H 1 3.529 0.030 . 1 . . . . A 25 CYS HA . 36483 1 238 . 1 . 1 25 25 CYS HB2 H 1 2.930 0.030 . 2 . . . . A 25 CYS HB2 . 36483 1 239 . 1 . 1 25 25 CYS HB3 H 1 1.812 0.030 . 2 . . . . A 25 CYS HB3 . 36483 1 240 . 1 . 1 25 25 CYS C C 13 178.009 0.300 . 1 . . . . A 25 CYS C . 36483 1 241 . 1 . 1 25 25 CYS CA C 13 60.696 0.300 . 1 . . . . A 25 CYS CA . 36483 1 242 . 1 . 1 25 25 CYS CB C 13 29.743 0.300 . 1 . . . . A 25 CYS CB . 36483 1 243 . 1 . 1 25 25 CYS N N 15 121.139 0.300 . 1 . . . . A 25 CYS N . 36483 1 244 . 1 . 1 26 26 HIS H H 1 9.656 0.030 . 1 . . . . A 26 HIS H . 36483 1 245 . 1 . 1 26 26 HIS HA H 1 4.678 0.030 . 1 . . . . A 26 HIS HA . 36483 1 246 . 1 . 1 26 26 HIS HB2 H 1 2.805 0.030 . 2 . . . . A 26 HIS HB2 . 36483 1 247 . 1 . 1 26 26 HIS HB3 H 1 2.270 0.030 . 2 . . . . A 26 HIS HB3 . 36483 1 248 . 1 . 1 26 26 HIS HD2 H 1 7.237 0.030 . 1 . . . . A 26 HIS HD2 . 36483 1 249 . 1 . 1 26 26 HIS HE1 H 1 8.384 0.030 . 1 . . . . A 26 HIS HE1 . 36483 1 250 . 1 . 1 26 26 HIS C C 13 175.374 0.300 . 1 . . . . A 26 HIS C . 36483 1 251 . 1 . 1 26 26 HIS CA C 13 56.651 0.300 . 1 . . . . A 26 HIS CA . 36483 1 252 . 1 . 1 26 26 HIS CB C 13 29.611 0.300 . 1 . . . . A 26 HIS CB . 36483 1 253 . 1 . 1 26 26 HIS CD2 C 13 121.341 0.300 . 1 . . . . A 26 HIS CD2 . 36483 1 254 . 1 . 1 26 26 HIS CE1 C 13 137.628 0.300 . 1 . . . . A 26 HIS CE1 . 36483 1 255 . 1 . 1 26 26 HIS N N 15 128.177 0.300 . 1 . . . . A 26 HIS N . 36483 1 256 . 1 . 1 27 27 VAL H H 1 8.945 0.030 . 1 . . . . A 27 VAL H . 36483 1 257 . 1 . 1 27 27 VAL HA H 1 3.947 0.030 . 1 . . . . A 27 VAL HA . 36483 1 258 . 1 . 1 27 27 VAL HB H 1 2.229 0.030 . 1 . . . . A 27 VAL HB . 36483 1 259 . 1 . 1 27 27 VAL HG11 H 1 1.132 0.030 . 2 . . . . A 27 VAL HG11 . 36483 1 260 . 1 . 1 27 27 VAL HG12 H 1 1.132 0.030 . 2 . . . . A 27 VAL HG12 . 36483 1 261 . 1 . 1 27 27 VAL HG13 H 1 1.132 0.030 . 2 . . . . A 27 VAL HG13 . 36483 1 262 . 1 . 1 27 27 VAL HG21 H 1 1.289 0.030 . 2 . . . . A 27 VAL HG21 . 36483 1 263 . 1 . 1 27 27 VAL HG22 H 1 1.289 0.030 . 2 . . . . A 27 VAL HG22 . 36483 1 264 . 1 . 1 27 27 VAL HG23 H 1 1.289 0.030 . 2 . . . . A 27 VAL HG23 . 36483 1 265 . 1 . 1 27 27 VAL C C 13 177.230 0.300 . 1 . . . . A 27 VAL C . 36483 1 266 . 1 . 1 27 27 VAL CA C 13 64.765 0.300 . 1 . . . . A 27 VAL CA . 36483 1 267 . 1 . 1 27 27 VAL CB C 13 32.930 0.300 . 1 . . . . A 27 VAL CB . 36483 1 268 . 1 . 1 27 27 VAL CG1 C 13 20.743 0.300 . 2 . . . . A 27 VAL CG1 . 36483 1 269 . 1 . 1 27 27 VAL CG2 C 13 21.629 0.300 . 2 . . . . A 27 VAL CG2 . 36483 1 270 . 1 . 1 27 27 VAL N N 15 120.027 0.300 . 1 . . . . A 27 VAL N . 36483 1 271 . 1 . 1 28 28 CYS H H 1 8.237 0.030 . 1 . . . . A 28 CYS H . 36483 1 272 . 1 . 1 28 28 CYS HA H 1 5.011 0.030 . 1 . . . . A 28 CYS HA . 36483 1 273 . 1 . 1 28 28 CYS HB2 H 1 3.401 0.030 . 2 . . . . A 28 CYS HB2 . 36483 1 274 . 1 . 1 28 28 CYS HB3 H 1 3.009 0.030 . 2 . . . . A 28 CYS HB3 . 36483 1 275 . 1 . 1 28 28 CYS C C 13 176.851 0.300 . 1 . . . . A 28 CYS C . 36483 1 276 . 1 . 1 28 28 CYS CA C 13 58.833 0.300 . 1 . . . . A 28 CYS CA . 36483 1 277 . 1 . 1 28 28 CYS CB C 13 32.453 0.300 . 1 . . . . A 28 CYS CB . 36483 1 278 . 1 . 1 28 28 CYS N N 15 117.701 0.300 . 1 . . . . A 28 CYS N . 36483 1 279 . 1 . 1 29 29 GLY H H 1 8.860 0.030 . 1 . . . . A 29 GLY H . 36483 1 280 . 1 . 1 29 29 GLY HA2 H 1 3.743 0.030 . 1 . . . . A 29 GLY HA2 . 36483 1 281 . 1 . 1 29 29 GLY HA3 H 1 3.743 0.030 . 1 . . . . A 29 GLY HA3 . 36483 1 282 . 1 . 1 29 29 GLY C C 13 172.182 0.300 . 1 . . . . A 29 GLY C . 36483 1 283 . 1 . 1 29 29 GLY CA C 13 45.389 0.300 . 1 . . . . A 29 GLY CA . 36483 1 284 . 1 . 1 29 29 GLY N N 15 118.261 0.300 . 1 . . . . A 29 GLY N . 36483 1 285 . 1 . 1 30 30 GLY H H 1 9.626 0.030 . 1 . . . . A 30 GLY H . 36483 1 286 . 1 . 1 30 30 GLY HA2 H 1 4.097 0.030 . 2 . . . . A 30 GLY HA2 . 36483 1 287 . 1 . 1 30 30 GLY HA3 H 1 4.015 0.030 . 2 . . . . A 30 GLY HA3 . 36483 1 288 . 1 . 1 30 30 GLY C C 13 173.728 0.300 . 1 . . . . A 30 GLY C . 36483 1 289 . 1 . 1 30 30 GLY CA C 13 45.381 0.300 . 1 . . . . A 30 GLY CA . 36483 1 290 . 1 . 1 30 30 GLY N N 15 111.832 0.300 . 1 . . . . A 30 GLY N . 36483 1 291 . 1 . 1 31 31 ARG H H 1 8.657 0.030 . 1 . . . . A 31 ARG H . 36483 1 292 . 1 . 1 31 31 ARG HA H 1 4.014 0.030 . 1 . . . . A 31 ARG HA . 36483 1 293 . 1 . 1 31 31 ARG HB2 H 1 2.005 0.030 . 2 . . . . A 31 ARG HB2 . 36483 1 294 . 1 . 1 31 31 ARG HB3 H 1 1.556 0.030 . 2 . . . . A 31 ARG HB3 . 36483 1 295 . 1 . 1 31 31 ARG HG2 H 1 1.682 0.030 . 1 . . . . A 31 ARG HG2 . 36483 1 296 . 1 . 1 31 31 ARG HG3 H 1 1.682 0.030 . 1 . . . . A 31 ARG HG3 . 36483 1 297 . 1 . 1 31 31 ARG HD2 H 1 3.200 0.030 . 2 . . . . A 31 ARG HD2 . 36483 1 298 . 1 . 1 31 31 ARG HD3 H 1 3.153 0.030 . 2 . . . . A 31 ARG HD3 . 36483 1 299 . 1 . 1 31 31 ARG HE H 1 6.879 0.030 . 1 . . . . A 31 ARG HE . 36483 1 300 . 1 . 1 31 31 ARG C C 13 177.125 0.300 . 1 . . . . A 31 ARG C . 36483 1 301 . 1 . 1 31 31 ARG CA C 13 55.042 0.300 . 1 . . . . A 31 ARG CA . 36483 1 302 . 1 . 1 31 31 ARG CB C 13 31.069 0.300 . 1 . . . . A 31 ARG CB . 36483 1 303 . 1 . 1 31 31 ARG CG C 13 24.781 0.300 . 1 . . . . A 31 ARG CG . 36483 1 304 . 1 . 1 31 31 ARG CD C 13 43.404 0.300 . 1 . . . . A 31 ARG CD . 36483 1 305 . 1 . 1 31 31 ARG N N 15 118.763 0.300 . 1 . . . . A 31 ARG N . 36483 1 306 . 1 . 1 31 31 ARG NE N 15 85.121 0.300 . 1 . . . . A 31 ARG NE . 36483 1 307 . 1 . 1 32 32 GLU H H 1 9.327 0.030 . 1 . . . . A 32 GLU H . 36483 1 308 . 1 . 1 32 32 GLU HA H 1 4.280 0.030 . 1 . . . . A 32 GLU HA . 36483 1 309 . 1 . 1 32 32 GLU HB2 H 1 2.110 0.030 . 2 . . . . A 32 GLU HB2 . 36483 1 310 . 1 . 1 32 32 GLU HB3 H 1 2.057 0.030 . 2 . . . . A 32 GLU HB3 . 36483 1 311 . 1 . 1 32 32 GLU HG2 H 1 2.415 0.030 . 1 . . . . A 32 GLU HG2 . 36483 1 312 . 1 . 1 32 32 GLU HG3 H 1 2.415 0.030 . 1 . . . . A 32 GLU HG3 . 36483 1 313 . 1 . 1 32 32 GLU C C 13 175.768 0.300 . 1 . . . . A 32 GLU C . 36483 1 314 . 1 . 1 32 32 GLU CA C 13 56.208 0.300 . 1 . . . . A 32 GLU CA . 36483 1 315 . 1 . 1 32 32 GLU CB C 13 28.477 0.300 . 1 . . . . A 32 GLU CB . 36483 1 316 . 1 . 1 32 32 GLU CG C 13 36.324 0.300 . 1 . . . . A 32 GLU CG . 36483 1 317 . 1 . 1 32 32 GLU N N 15 121.435 0.300 . 1 . . . . A 32 GLU N . 36483 1 318 . 1 . 1 33 33 ALA H H 1 9.369 0.030 . 1 . . . . A 33 ALA H . 36483 1 319 . 1 . 1 33 33 ALA HA H 1 4.601 0.030 . 1 . . . . A 33 ALA HA . 36483 1 320 . 1 . 1 33 33 ALA HB1 H 1 1.532 0.030 . 1 . . . . A 33 ALA HB1 . 36483 1 321 . 1 . 1 33 33 ALA HB2 H 1 1.532 0.030 . 1 . . . . A 33 ALA HB2 . 36483 1 322 . 1 . 1 33 33 ALA HB3 H 1 1.532 0.030 . 1 . . . . A 33 ALA HB3 . 36483 1 323 . 1 . 1 33 33 ALA C C 13 175.663 0.300 . 1 . . . . A 33 ALA C . 36483 1 324 . 1 . 1 33 33 ALA CA C 13 52.127 0.300 . 1 . . . . A 33 ALA CA . 36483 1 325 . 1 . 1 33 33 ALA CB C 13 18.236 0.300 . 1 . . . . A 33 ALA CB . 36483 1 326 . 1 . 1 33 33 ALA N N 15 122.946 0.300 . 1 . . . . A 33 ALA N . 36483 1 327 . 1 . 1 34 34 PRO HA H 1 4.225 0.030 . 1 . . . . A 34 PRO HA . 36483 1 328 . 1 . 1 34 34 PRO HB2 H 1 2.300 0.030 . 1 . . . . A 34 PRO HB2 . 36483 1 329 . 1 . 1 34 34 PRO HB3 H 1 2.300 0.030 . 1 . . . . A 34 PRO HB3 . 36483 1 330 . 1 . 1 34 34 PRO HG2 H 1 2.131 0.030 . 2 . . . . A 34 PRO HG2 . 36483 1 331 . 1 . 1 34 34 PRO HG3 H 1 2.019 0.030 . 2 . . . . A 34 PRO HG3 . 36483 1 332 . 1 . 1 34 34 PRO C C 13 178.363 0.300 . 1 . . . . A 34 PRO C . 36483 1 333 . 1 . 1 34 34 PRO CA C 13 65.335 0.300 . 1 . . . . A 34 PRO CA . 36483 1 334 . 1 . 1 34 34 PRO CB C 13 29.802 0.300 . 1 . . . . A 34 PRO CB . 36483 1 335 . 1 . 1 34 34 PRO CG C 13 27.548 0.300 . 1 . . . . A 34 PRO CG . 36483 1 336 . 1 . 1 34 34 PRO CD C 13 50.768 0.300 . 1 . . . . A 34 PRO CD . 36483 1 337 . 1 . 1 35 35 GLU H H 1 10.702 0.030 . 1 . . . . A 35 GLU H . 36483 1 338 . 1 . 1 35 35 GLU HA H 1 4.356 0.030 . 1 . . . . A 35 GLU HA . 36483 1 339 . 1 . 1 35 35 GLU HB2 H 1 2.123 0.030 . 1 . . . . A 35 GLU HB2 . 36483 1 340 . 1 . 1 35 35 GLU HB3 H 1 2.123 0.030 . 1 . . . . A 35 GLU HB3 . 36483 1 341 . 1 . 1 35 35 GLU HG2 H 1 2.386 0.030 . 1 . . . . A 35 GLU HG2 . 36483 1 342 . 1 . 1 35 35 GLU HG3 H 1 2.386 0.030 . 1 . . . . A 35 GLU HG3 . 36483 1 343 . 1 . 1 35 35 GLU C C 13 175.549 0.300 . 1 . . . . A 35 GLU C . 36483 1 344 . 1 . 1 35 35 GLU CA C 13 57.799 0.300 . 1 . . . . A 35 GLU CA . 36483 1 345 . 1 . 1 35 35 GLU CB C 13 27.389 0.300 . 1 . . . . A 35 GLU CB . 36483 1 346 . 1 . 1 35 35 GLU CG C 13 37.273 0.300 . 1 . . . . A 35 GLU CG . 36483 1 347 . 1 . 1 35 35 GLU N N 15 124.055 0.300 . 1 . . . . A 35 GLU N . 36483 1 348 . 1 . 1 36 36 LYS H H 1 8.425 0.030 . 1 . . . . A 36 LYS H . 36483 1 349 . 1 . 1 36 36 LYS HA H 1 4.355 0.030 . 1 . . . . A 36 LYS HA . 36483 1 350 . 1 . 1 36 36 LYS HB2 H 1 2.031 0.030 . 1 . . . . A 36 LYS HB2 . 36483 1 351 . 1 . 1 36 36 LYS HB3 H 1 2.031 0.030 . 1 . . . . A 36 LYS HB3 . 36483 1 352 . 1 . 1 36 36 LYS HG2 H 1 1.336 0.030 . 1 . . . . A 36 LYS HG2 . 36483 1 353 . 1 . 1 36 36 LYS HG3 H 1 1.336 0.030 . 1 . . . . A 36 LYS HG3 . 36483 1 354 . 1 . 1 36 36 LYS HE2 H 1 2.938 0.030 . 1 . . . . A 36 LYS HE2 . 36483 1 355 . 1 . 1 36 36 LYS HE3 H 1 2.938 0.030 . 1 . . . . A 36 LYS HE3 . 36483 1 356 . 1 . 1 36 36 LYS C C 13 173.964 0.300 . 1 . . . . A 36 LYS C . 36483 1 357 . 1 . 1 36 36 LYS CA C 13 54.565 0.300 . 1 . . . . A 36 LYS CA . 36483 1 358 . 1 . 1 36 36 LYS CB C 13 33.241 0.300 . 1 . . . . A 36 LYS CB . 36483 1 359 . 1 . 1 36 36 LYS CE C 13 42.086 0.300 . 1 . . . . A 36 LYS CE . 36483 1 360 . 1 . 1 36 36 LYS N N 15 119.704 0.300 . 1 . . . . A 36 LYS N . 36483 1 361 . 1 . 1 37 37 GLN H H 1 7.107 0.030 . 1 . . . . A 37 GLN H . 36483 1 362 . 1 . 1 37 37 GLN HA H 1 4.834 0.030 . 1 . . . . A 37 GLN HA . 36483 1 363 . 1 . 1 37 37 GLN HB2 H 1 2.327 0.030 . 1 . . . . A 37 GLN HB2 . 36483 1 364 . 1 . 1 37 37 GLN HB3 H 1 2.327 0.030 . 1 . . . . A 37 GLN HB3 . 36483 1 365 . 1 . 1 37 37 GLN HG2 H 1 2.340 0.030 . 2 . . . . A 37 GLN HG2 . 36483 1 366 . 1 . 1 37 37 GLN HG3 H 1 1.115 0.030 . 2 . . . . A 37 GLN HG3 . 36483 1 367 . 1 . 1 37 37 GLN HE21 H 1 5.562 0.030 . 1 . . . . A 37 GLN HE21 . 36483 1 368 . 1 . 1 37 37 GLN HE22 H 1 5.562 0.030 . 1 . . . . A 37 GLN HE22 . 36483 1 369 . 1 . 1 37 37 GLN C C 13 175.055 0.300 . 1 . . . . A 37 GLN C . 36483 1 370 . 1 . 1 37 37 GLN CA C 13 55.178 0.300 . 1 . . . . A 37 GLN CA . 36483 1 371 . 1 . 1 37 37 GLN CB C 13 29.475 0.300 . 1 . . . . A 37 GLN CB . 36483 1 372 . 1 . 1 37 37 GLN CG C 13 35.962 0.300 . 1 . . . . A 37 GLN CG . 36483 1 373 . 1 . 1 37 37 GLN N N 15 118.745 0.300 . 1 . . . . A 37 GLN N . 36483 1 374 . 1 . 1 37 37 GLN NE2 N 15 104.987 0.300 . 1 . . . . A 37 GLN NE2 . 36483 1 375 . 1 . 1 38 38 LEU H H 1 8.208 0.030 . 1 . . . . A 38 LEU H . 36483 1 376 . 1 . 1 38 38 LEU HA H 1 4.261 0.030 . 1 . . . . A 38 LEU HA . 36483 1 377 . 1 . 1 38 38 LEU HB2 H 1 0.668 0.030 . 2 . . . . A 38 LEU HB2 . 36483 1 378 . 1 . 1 38 38 LEU HB3 H 1 0.383 0.030 . 2 . . . . A 38 LEU HB3 . 36483 1 379 . 1 . 1 38 38 LEU HG H 1 1.035 0.030 . 1 . . . . A 38 LEU HG . 36483 1 380 . 1 . 1 38 38 LEU HD11 H 1 0.263 0.030 . 2 . . . . A 38 LEU HD11 . 36483 1 381 . 1 . 1 38 38 LEU HD12 H 1 0.263 0.030 . 2 . . . . A 38 LEU HD12 . 36483 1 382 . 1 . 1 38 38 LEU HD13 H 1 0.263 0.030 . 2 . . . . A 38 LEU HD13 . 36483 1 383 . 1 . 1 38 38 LEU HD21 H 1 -0.539 0.030 . 2 . . . . A 38 LEU HD21 . 36483 1 384 . 1 . 1 38 38 LEU HD22 H 1 -0.539 0.030 . 2 . . . . A 38 LEU HD22 . 36483 1 385 . 1 . 1 38 38 LEU HD23 H 1 -0.539 0.030 . 2 . . . . A 38 LEU HD23 . 36483 1 386 . 1 . 1 38 38 LEU C C 13 176.138 0.300 . 1 . . . . A 38 LEU C . 36483 1 387 . 1 . 1 38 38 LEU CA C 13 53.491 0.300 . 1 . . . . A 38 LEU CA . 36483 1 388 . 1 . 1 38 38 LEU CB C 13 43.038 0.300 . 1 . . . . A 38 LEU CB . 36483 1 389 . 1 . 1 38 38 LEU CG C 13 25.804 0.300 . 1 . . . . A 38 LEU CG . 36483 1 390 . 1 . 1 38 38 LEU CD1 C 13 23.246 0.300 . 2 . . . . A 38 LEU CD1 . 36483 1 391 . 1 . 1 38 38 LEU CD2 C 13 24.150 0.300 . 2 . . . . A 38 LEU CD2 . 36483 1 392 . 1 . 1 38 38 LEU N N 15 123.126 0.300 . 1 . . . . A 38 LEU N . 36483 1 393 . 1 . 1 39 39 LEU H H 1 7.728 0.030 . 1 . . . . A 39 LEU H . 36483 1 394 . 1 . 1 39 39 LEU HA H 1 5.237 0.030 . 1 . . . . A 39 LEU HA . 36483 1 395 . 1 . 1 39 39 LEU HB2 H 1 1.526 0.030 . 2 . . . . A 39 LEU HB2 . 36483 1 396 . 1 . 1 39 39 LEU HB3 H 1 1.070 0.030 . 2 . . . . A 39 LEU HB3 . 36483 1 397 . 1 . 1 39 39 LEU HG H 1 1.159 0.030 . 1 . . . . A 39 LEU HG . 36483 1 398 . 1 . 1 39 39 LEU HD11 H 1 0.570 0.030 . 2 . . . . A 39 LEU HD11 . 36483 1 399 . 1 . 1 39 39 LEU HD12 H 1 0.570 0.030 . 2 . . . . A 39 LEU HD12 . 36483 1 400 . 1 . 1 39 39 LEU HD13 H 1 0.570 0.030 . 2 . . . . A 39 LEU HD13 . 36483 1 401 . 1 . 1 39 39 LEU HD21 H 1 0.623 0.030 . 2 . . . . A 39 LEU HD21 . 36483 1 402 . 1 . 1 39 39 LEU HD22 H 1 0.623 0.030 . 2 . . . . A 39 LEU HD22 . 36483 1 403 . 1 . 1 39 39 LEU HD23 H 1 0.623 0.030 . 2 . . . . A 39 LEU HD23 . 36483 1 404 . 1 . 1 39 39 LEU C C 13 176.247 0.300 . 1 . . . . A 39 LEU C . 36483 1 405 . 1 . 1 39 39 LEU CA C 13 52.341 0.300 . 1 . . . . A 39 LEU CA . 36483 1 406 . 1 . 1 39 39 LEU CB C 13 43.002 0.300 . 1 . . . . A 39 LEU CB . 36483 1 407 . 1 . 1 39 39 LEU CG C 13 26.619 0.300 . 1 . . . . A 39 LEU CG . 36483 1 408 . 1 . 1 39 39 LEU CD1 C 13 24.323 0.300 . 2 . . . . A 39 LEU CD1 . 36483 1 409 . 1 . 1 39 39 LEU CD2 C 13 27.533 0.300 . 2 . . . . A 39 LEU CD2 . 36483 1 410 . 1 . 1 39 39 LEU N N 15 117.431 0.300 . 1 . . . . A 39 LEU N . 36483 1 411 . 1 . 1 40 40 CYS H H 1 8.833 0.030 . 1 . . . . A 40 CYS H . 36483 1 412 . 1 . 1 40 40 CYS HA H 1 4.581 0.030 . 1 . . . . A 40 CYS HA . 36483 1 413 . 1 . 1 40 40 CYS HB2 H 1 3.633 0.030 . 2 . . . . A 40 CYS HB2 . 36483 1 414 . 1 . 1 40 40 CYS HB3 H 1 2.920 0.030 . 2 . . . . A 40 CYS HB3 . 36483 1 415 . 1 . 1 40 40 CYS C C 13 177.842 0.300 . 1 . . . . A 40 CYS C . 36483 1 416 . 1 . 1 40 40 CYS CA C 13 60.054 0.300 . 1 . . . . A 40 CYS CA . 36483 1 417 . 1 . 1 40 40 CYS CB C 13 31.920 0.300 . 1 . . . . A 40 CYS CB . 36483 1 418 . 1 . 1 40 40 CYS N N 15 124.451 0.300 . 1 . . . . A 40 CYS N . 36483 1 419 . 1 . 1 41 41 ASP H H 1 9.176 0.030 . 1 . . . . A 41 ASP H . 36483 1 420 . 1 . 1 41 41 ASP HA H 1 4.633 0.030 . 1 . . . . A 41 ASP HA . 36483 1 421 . 1 . 1 41 41 ASP HB2 H 1 2.715 0.030 . 2 . . . . A 41 ASP HB2 . 36483 1 422 . 1 . 1 41 41 ASP HB3 H 1 1.864 0.030 . 2 . . . . A 41 ASP HB3 . 36483 1 423 . 1 . 1 41 41 ASP C C 13 175.361 0.300 . 1 . . . . A 41 ASP C . 36483 1 424 . 1 . 1 41 41 ASP CA C 13 57.871 0.300 . 1 . . . . A 41 ASP CA . 36483 1 425 . 1 . 1 41 41 ASP CB C 13 40.877 0.300 . 1 . . . . A 41 ASP CB . 36483 1 426 . 1 . 1 41 41 ASP N N 15 129.522 0.300 . 1 . . . . A 41 ASP N . 36483 1 427 . 1 . 1 42 42 GLU H H 1 9.537 0.030 . 1 . . . . A 42 GLU H . 36483 1 428 . 1 . 1 42 42 GLU HA H 1 4.939 0.030 . 1 . . . . A 42 GLU HA . 36483 1 429 . 1 . 1 42 42 GLU HB2 H 1 2.209 0.030 . 1 . . . . A 42 GLU HB2 . 36483 1 430 . 1 . 1 42 42 GLU HB3 H 1 2.209 0.030 . 1 . . . . A 42 GLU HB3 . 36483 1 431 . 1 . 1 42 42 GLU C C 13 176.211 0.300 . 1 . . . . A 42 GLU C . 36483 1 432 . 1 . 1 42 42 GLU CA C 13 58.129 0.300 . 1 . . . . A 42 GLU CA . 36483 1 433 . 1 . 1 42 42 GLU CB C 13 30.280 0.300 . 1 . . . . A 42 GLU CB . 36483 1 434 . 1 . 1 42 42 GLU CG C 13 36.102 0.300 . 1 . . . . A 42 GLU CG . 36483 1 435 . 1 . 1 42 42 GLU N N 15 124.426 0.300 . 1 . . . . A 42 GLU N . 36483 1 436 . 1 . 1 43 43 CYS H H 1 8.475 0.030 . 1 . . . . A 43 CYS H . 36483 1 437 . 1 . 1 43 43 CYS HA H 1 4.643 0.030 . 1 . . . . A 43 CYS HA . 36483 1 438 . 1 . 1 43 43 CYS HB2 H 1 2.667 0.030 . 1 . . . . A 43 CYS HB2 . 36483 1 439 . 1 . 1 43 43 CYS HB3 H 1 2.667 0.030 . 1 . . . . A 43 CYS HB3 . 36483 1 440 . 1 . 1 43 43 CYS C C 13 175.488 0.300 . 1 . . . . A 43 CYS C . 36483 1 441 . 1 . 1 43 43 CYS CA C 13 59.875 0.300 . 1 . . . . A 43 CYS CA . 36483 1 442 . 1 . 1 43 43 CYS CB C 13 32.381 0.300 . 1 . . . . A 43 CYS CB . 36483 1 443 . 1 . 1 43 43 CYS N N 15 118.331 0.300 . 1 . . . . A 43 CYS N . 36483 1 444 . 1 . 1 44 44 ASP H H 1 8.025 0.030 . 1 . . . . A 44 ASP H . 36483 1 445 . 1 . 1 44 44 ASP HA H 1 4.850 0.030 . 1 . . . . A 44 ASP HA . 36483 1 446 . 1 . 1 44 44 ASP HB2 H 1 2.902 0.030 . 2 . . . . A 44 ASP HB2 . 36483 1 447 . 1 . 1 44 44 ASP HB3 H 1 2.737 0.030 . 2 . . . . A 44 ASP HB3 . 36483 1 448 . 1 . 1 44 44 ASP C C 13 175.855 0.300 . 1 . . . . A 44 ASP C . 36483 1 449 . 1 . 1 44 44 ASP CA C 13 56.677 0.300 . 1 . . . . A 44 ASP CA . 36483 1 450 . 1 . 1 44 44 ASP CB C 13 42.110 0.300 . 1 . . . . A 44 ASP CB . 36483 1 451 . 1 . 1 44 44 ASP N N 15 118.083 0.300 . 1 . . . . A 44 ASP N . 36483 1 452 . 1 . 1 45 45 MET H H 1 8.603 0.030 . 1 . . . . A 45 MET H . 36483 1 453 . 1 . 1 45 45 MET HA H 1 4.319 0.030 . 1 . . . . A 45 MET HA . 36483 1 454 . 1 . 1 45 45 MET HB2 H 1 2.019 0.030 . 2 . . . . A 45 MET HB2 . 36483 1 455 . 1 . 1 45 45 MET HB3 H 1 1.277 0.030 . 2 . . . . A 45 MET HB3 . 36483 1 456 . 1 . 1 45 45 MET HG2 H 1 2.552 0.030 . 2 . . . . A 45 MET HG2 . 36483 1 457 . 1 . 1 45 45 MET HG3 H 1 2.525 0.030 . 2 . . . . A 45 MET HG3 . 36483 1 458 . 1 . 1 45 45 MET HE1 H 1 2.140 0.030 . 1 . . . . A 45 MET HE1 . 36483 1 459 . 1 . 1 45 45 MET HE2 H 1 2.140 0.030 . 1 . . . . A 45 MET HE2 . 36483 1 460 . 1 . 1 45 45 MET HE3 H 1 2.140 0.030 . 1 . . . . A 45 MET HE3 . 36483 1 461 . 1 . 1 45 45 MET C C 13 173.780 0.300 . 1 . . . . A 45 MET C . 36483 1 462 . 1 . 1 45 45 MET CA C 13 55.791 0.300 . 1 . . . . A 45 MET CA . 36483 1 463 . 1 . 1 45 45 MET CB C 13 34.688 0.300 . 1 . . . . A 45 MET CB . 36483 1 464 . 1 . 1 45 45 MET CG C 13 33.822 0.300 . 1 . . . . A 45 MET CG . 36483 1 465 . 1 . 1 45 45 MET CE C 13 20.779 0.300 . 1 . . . . A 45 MET CE . 36483 1 466 . 1 . 1 45 45 MET N N 15 120.222 0.300 . 1 . . . . A 45 MET N . 36483 1 467 . 1 . 1 46 46 ALA H H 1 8.411 0.030 . 1 . . . . A 46 ALA H . 36483 1 468 . 1 . 1 46 46 ALA HA H 1 5.483 0.030 . 1 . . . . A 46 ALA HA . 36483 1 469 . 1 . 1 46 46 ALA HB1 H 1 0.988 0.030 . 1 . . . . A 46 ALA HB1 . 36483 1 470 . 1 . 1 46 46 ALA HB2 H 1 0.988 0.030 . 1 . . . . A 46 ALA HB2 . 36483 1 471 . 1 . 1 46 46 ALA HB3 H 1 0.988 0.030 . 1 . . . . A 46 ALA HB3 . 36483 1 472 . 1 . 1 46 46 ALA C C 13 177.310 0.300 . 1 . . . . A 46 ALA C . 36483 1 473 . 1 . 1 46 46 ALA CA C 13 49.752 0.300 . 1 . . . . A 46 ALA CA . 36483 1 474 . 1 . 1 46 46 ALA CB C 13 20.954 0.300 . 1 . . . . A 46 ALA CB . 36483 1 475 . 1 . 1 46 46 ALA N N 15 124.147 0.300 . 1 . . . . A 46 ALA N . 36483 1 476 . 1 . 1 47 47 PHE H H 1 8.879 0.030 . 1 . . . . A 47 PHE H . 36483 1 477 . 1 . 1 47 47 PHE HA H 1 5.215 0.030 . 1 . . . . A 47 PHE HA . 36483 1 478 . 1 . 1 47 47 PHE HB2 H 1 2.794 0.030 . 1 . . . . A 47 PHE HB2 . 36483 1 479 . 1 . 1 47 47 PHE HB3 H 1 2.794 0.030 . 1 . . . . A 47 PHE HB3 . 36483 1 480 . 1 . 1 47 47 PHE HD1 H 1 7.490 0.030 . 1 . . . . A 47 PHE HD1 . 36483 1 481 . 1 . 1 47 47 PHE HD2 H 1 7.490 0.030 . 1 . . . . A 47 PHE HD2 . 36483 1 482 . 1 . 1 47 47 PHE HE1 H 1 7.326 0.030 . 1 . . . . A 47 PHE HE1 . 36483 1 483 . 1 . 1 47 47 PHE HE2 H 1 7.326 0.030 . 1 . . . . A 47 PHE HE2 . 36483 1 484 . 1 . 1 47 47 PHE HZ H 1 7.390 0.030 . 1 . . . . A 47 PHE HZ . 36483 1 485 . 1 . 1 47 47 PHE C C 13 176.682 0.300 . 1 . . . . A 47 PHE C . 36483 1 486 . 1 . 1 47 47 PHE CA C 13 56.696 0.300 . 1 . . . . A 47 PHE CA . 36483 1 487 . 1 . 1 47 47 PHE CB C 13 43.592 0.300 . 1 . . . . A 47 PHE CB . 36483 1 488 . 1 . 1 47 47 PHE CD1 C 13 132.707 0.300 . 1 . . . . A 47 PHE CD1 . 36483 1 489 . 1 . 1 47 47 PHE CD2 C 13 132.707 0.300 . 1 . . . . A 47 PHE CD2 . 36483 1 490 . 1 . 1 47 47 PHE CE1 C 13 131.397 0.300 . 1 . . . . A 47 PHE CE1 . 36483 1 491 . 1 . 1 47 47 PHE CE2 C 13 131.397 0.300 . 1 . . . . A 47 PHE CE2 . 36483 1 492 . 1 . 1 47 47 PHE CZ C 13 131.573 0.300 . 1 . . . . A 47 PHE CZ . 36483 1 493 . 1 . 1 47 47 PHE N N 15 115.906 0.300 . 1 . . . . A 47 PHE N . 36483 1 494 . 1 . 1 48 48 HIS H H 1 9.196 0.030 . 1 . . . . A 48 HIS H . 36483 1 495 . 1 . 1 48 48 HIS HA H 1 4.655 0.030 . 1 . . . . A 48 HIS HA . 36483 1 496 . 1 . 1 48 48 HIS HB2 H 1 3.276 0.030 . 2 . . . . A 48 HIS HB2 . 36483 1 497 . 1 . 1 48 48 HIS HB3 H 1 1.377 0.030 . 2 . . . . A 48 HIS HB3 . 36483 1 498 . 1 . 1 48 48 HIS HD2 H 1 6.578 0.030 . 1 . . . . A 48 HIS HD2 . 36483 1 499 . 1 . 1 48 48 HIS HE1 H 1 7.246 0.030 . 1 . . . . A 48 HIS HE1 . 36483 1 500 . 1 . 1 48 48 HIS HE2 H 1 11.602 0.030 . 1 . . . . A 48 HIS HE2 . 36483 1 501 . 1 . 1 48 48 HIS C C 13 179.231 0.300 . 1 . . . . A 48 HIS C . 36483 1 502 . 1 . 1 48 48 HIS CA C 13 58.857 0.300 . 1 . . . . A 48 HIS CA . 36483 1 503 . 1 . 1 48 48 HIS CB C 13 30.947 0.300 . 1 . . . . A 48 HIS CB . 36483 1 504 . 1 . 1 48 48 HIS CD2 C 13 119.886 0.300 . 1 . . . . A 48 HIS CD2 . 36483 1 505 . 1 . 1 48 48 HIS CE1 C 13 137.627 0.300 . 1 . . . . A 48 HIS CE1 . 36483 1 506 . 1 . 1 48 48 HIS N N 15 123.173 0.300 . 1 . . . . A 48 HIS N . 36483 1 507 . 1 . 1 48 48 HIS NE2 N 15 168.752 0.300 . 1 . . . . A 48 HIS NE2 . 36483 1 508 . 1 . 1 49 49 LEU H H 1 8.720 0.030 . 1 . . . . A 49 LEU H . 36483 1 509 . 1 . 1 49 49 LEU HA H 1 3.830 0.030 . 1 . . . . A 49 LEU HA . 36483 1 510 . 1 . 1 49 49 LEU HB2 H 1 3.095 0.030 . 1 . . . . A 49 LEU HB2 . 36483 1 511 . 1 . 1 49 49 LEU HB3 H 1 3.095 0.030 . 1 . . . . A 49 LEU HB3 . 36483 1 512 . 1 . 1 49 49 LEU HG H 1 0.710 0.030 . 1 . . . . A 49 LEU HG . 36483 1 513 . 1 . 1 49 49 LEU HD11 H 1 0.604 0.030 . 2 . . . . A 49 LEU HD11 . 36483 1 514 . 1 . 1 49 49 LEU HD12 H 1 0.604 0.030 . 2 . . . . A 49 LEU HD12 . 36483 1 515 . 1 . 1 49 49 LEU HD13 H 1 0.604 0.030 . 2 . . . . A 49 LEU HD13 . 36483 1 516 . 1 . 1 49 49 LEU HD21 H 1 0.697 0.030 . 2 . . . . A 49 LEU HD21 . 36483 1 517 . 1 . 1 49 49 LEU HD22 H 1 0.697 0.030 . 2 . . . . A 49 LEU HD22 . 36483 1 518 . 1 . 1 49 49 LEU HD23 H 1 0.697 0.030 . 2 . . . . A 49 LEU HD23 . 36483 1 519 . 1 . 1 49 49 LEU C C 13 177.191 0.300 . 1 . . . . A 49 LEU C . 36483 1 520 . 1 . 1 49 49 LEU CA C 13 58.051 0.300 . 1 . . . . A 49 LEU CA . 36483 1 521 . 1 . 1 49 49 LEU CB C 13 42.045 0.300 . 1 . . . . A 49 LEU CB . 36483 1 522 . 1 . 1 49 49 LEU CG C 13 25.818 0.300 . 1 . . . . A 49 LEU CG . 36483 1 523 . 1 . 1 49 49 LEU CD1 C 13 22.824 0.300 . 2 . . . . A 49 LEU CD1 . 36483 1 524 . 1 . 1 49 49 LEU CD2 C 13 25.400 0.300 . 2 . . . . A 49 LEU CD2 . 36483 1 525 . 1 . 1 49 49 LEU N N 15 119.483 0.300 . 1 . . . . A 49 LEU N . 36483 1 526 . 1 . 1 50 50 TYR H H 1 6.191 0.030 . 1 . . . . A 50 TYR H . 36483 1 527 . 1 . 1 50 50 TYR HA H 1 4.705 0.030 . 1 . . . . A 50 TYR HA . 36483 1 528 . 1 . 1 50 50 TYR HB2 H 1 3.501 0.030 . 2 . . . . A 50 TYR HB2 . 36483 1 529 . 1 . 1 50 50 TYR HB3 H 1 3.082 0.030 . 2 . . . . A 50 TYR HB3 . 36483 1 530 . 1 . 1 50 50 TYR HD1 H 1 7.189 0.030 . 1 . . . . A 50 TYR HD1 . 36483 1 531 . 1 . 1 50 50 TYR HD2 H 1 7.189 0.030 . 1 . . . . A 50 TYR HD2 . 36483 1 532 . 1 . 1 50 50 TYR HE1 H 1 6.386 0.030 . 1 . . . . A 50 TYR HE1 . 36483 1 533 . 1 . 1 50 50 TYR HE2 H 1 6.386 0.030 . 1 . . . . A 50 TYR HE2 . 36483 1 534 . 1 . 1 50 50 TYR C C 13 176.961 0.300 . 1 . . . . A 50 TYR C . 36483 1 535 . 1 . 1 50 50 TYR CA C 13 54.918 0.300 . 1 . . . . A 50 TYR CA . 36483 1 536 . 1 . 1 50 50 TYR CB C 13 36.262 0.300 . 1 . . . . A 50 TYR CB . 36483 1 537 . 1 . 1 50 50 TYR CD1 C 13 134.570 0.300 . 1 . . . . A 50 TYR CD1 . 36483 1 538 . 1 . 1 50 50 TYR CD2 C 13 134.570 0.300 . 1 . . . . A 50 TYR CD2 . 36483 1 539 . 1 . 1 50 50 TYR CE1 C 13 118.222 0.300 . 1 . . . . A 50 TYR CE1 . 36483 1 540 . 1 . 1 50 50 TYR CE2 C 13 118.222 0.300 . 1 . . . . A 50 TYR CE2 . 36483 1 541 . 1 . 1 50 50 TYR N N 15 105.781 0.300 . 1 . . . . A 50 TYR N . 36483 1 542 . 1 . 1 51 51 CYS H H 1 7.733 0.030 . 1 . . . . A 51 CYS H . 36483 1 543 . 1 . 1 51 51 CYS HA H 1 4.552 0.030 . 1 . . . . A 51 CYS HA . 36483 1 544 . 1 . 1 51 51 CYS HB2 H 1 3.306 0.030 . 2 . . . . A 51 CYS HB2 . 36483 1 545 . 1 . 1 51 51 CYS HB3 H 1 2.769 0.030 . 2 . . . . A 51 CYS HB3 . 36483 1 546 . 1 . 1 51 51 CYS C C 13 175.130 0.300 . 1 . . . . A 51 CYS C . 36483 1 547 . 1 . 1 51 51 CYS CA C 13 62.032 0.300 . 1 . . . . A 51 CYS CA . 36483 1 548 . 1 . 1 51 51 CYS CB C 13 30.302 0.300 . 1 . . . . A 51 CYS CB . 36483 1 549 . 1 . 1 51 51 CYS N N 15 122.299 0.300 . 1 . . . . A 51 CYS N . 36483 1 550 . 1 . 1 52 52 LEU H H 1 6.599 0.030 . 1 . . . . A 52 LEU H . 36483 1 551 . 1 . 1 52 52 LEU HA H 1 4.312 0.030 . 1 . . . . A 52 LEU HA . 36483 1 552 . 1 . 1 52 52 LEU HB2 H 1 1.919 0.030 . 2 . . . . A 52 LEU HB2 . 36483 1 553 . 1 . 1 52 52 LEU HB3 H 1 1.563 0.030 . 2 . . . . A 52 LEU HB3 . 36483 1 554 . 1 . 1 52 52 LEU HD11 H 1 0.925 0.030 . 2 . . . . A 52 LEU HD11 . 36483 1 555 . 1 . 1 52 52 LEU HD12 H 1 0.925 0.030 . 2 . . . . A 52 LEU HD12 . 36483 1 556 . 1 . 1 52 52 LEU HD13 H 1 0.925 0.030 . 2 . . . . A 52 LEU HD13 . 36483 1 557 . 1 . 1 52 52 LEU HD21 H 1 0.983 0.030 . 2 . . . . A 52 LEU HD21 . 36483 1 558 . 1 . 1 52 52 LEU HD22 H 1 0.983 0.030 . 2 . . . . A 52 LEU HD22 . 36483 1 559 . 1 . 1 52 52 LEU HD23 H 1 0.983 0.030 . 2 . . . . A 52 LEU HD23 . 36483 1 560 . 1 . 1 52 52 LEU C C 13 174.985 0.300 . 1 . . . . A 52 LEU C . 36483 1 561 . 1 . 1 52 52 LEU CA C 13 54.958 0.300 . 1 . . . . A 52 LEU CA . 36483 1 562 . 1 . 1 52 52 LEU CB C 13 44.275 0.300 . 1 . . . . A 52 LEU CB . 36483 1 563 . 1 . 1 52 52 LEU CD1 C 13 26.617 0.300 . 2 . . . . A 52 LEU CD1 . 36483 1 564 . 1 . 1 52 52 LEU CD2 C 13 26.617 0.300 . 2 . . . . A 52 LEU CD2 . 36483 1 565 . 1 . 1 52 52 LEU N N 15 121.286 0.300 . 1 . . . . A 52 LEU N . 36483 1 566 . 1 . 1 53 53 LYS H H 1 8.303 0.030 . 1 . . . . A 53 LYS H . 36483 1 567 . 1 . 1 53 53 LYS HA H 1 4.877 0.030 . 1 . . . . A 53 LYS HA . 36483 1 568 . 1 . 1 53 53 LYS HB2 H 1 1.735 0.030 . 1 . . . . A 53 LYS HB2 . 36483 1 569 . 1 . 1 53 53 LYS HB3 H 1 1.735 0.030 . 1 . . . . A 53 LYS HB3 . 36483 1 570 . 1 . 1 53 53 LYS C C 13 174.427 0.300 . 1 . . . . A 53 LYS C . 36483 1 571 . 1 . 1 53 53 LYS CA C 13 52.817 0.300 . 1 . . . . A 53 LYS CA . 36483 1 572 . 1 . 1 53 53 LYS CB C 13 34.493 0.300 . 1 . . . . A 53 LYS CB . 36483 1 573 . 1 . 1 53 53 LYS CG C 13 24.804 0.300 . 1 . . . . A 53 LYS CG . 36483 1 574 . 1 . 1 53 53 LYS CD C 13 29.405 0.300 . 1 . . . . A 53 LYS CD . 36483 1 575 . 1 . 1 53 53 LYS CE C 13 41.955 0.300 . 1 . . . . A 53 LYS CE . 36483 1 576 . 1 . 1 53 53 LYS N N 15 118.959 0.300 . 1 . . . . A 53 LYS N . 36483 1 577 . 1 . 1 54 54 PRO HA H 1 5.140 0.030 . 1 . . . . A 54 PRO HA . 36483 1 578 . 1 . 1 54 54 PRO HB2 H 1 2.470 0.030 . 2 . . . . A 54 PRO HB2 . 36483 1 579 . 1 . 1 54 54 PRO HB3 H 1 2.095 0.030 . 2 . . . . A 54 PRO HB3 . 36483 1 580 . 1 . 1 54 54 PRO HG2 H 1 1.947 0.030 . 1 . . . . A 54 PRO HG2 . 36483 1 581 . 1 . 1 54 54 PRO HG3 H 1 1.947 0.030 . 1 . . . . A 54 PRO HG3 . 36483 1 582 . 1 . 1 54 54 PRO HD2 H 1 3.724 0.030 . 2 . . . . A 54 PRO HD2 . 36483 1 583 . 1 . 1 54 54 PRO HD3 H 1 3.514 0.030 . 2 . . . . A 54 PRO HD3 . 36483 1 584 . 1 . 1 54 54 PRO CA C 13 62.043 0.300 . 1 . . . . A 54 PRO CA . 36483 1 585 . 1 . 1 54 54 PRO CB C 13 32.237 0.300 . 1 . . . . A 54 PRO CB . 36483 1 586 . 1 . 1 54 54 PRO CG C 13 24.854 0.300 . 1 . . . . A 54 PRO CG . 36483 1 587 . 1 . 1 54 54 PRO CD C 13 50.118 0.300 . 1 . . . . A 54 PRO CD . 36483 1 588 . 1 . 1 55 55 PRO HA H 1 4.472 0.030 . 1 . . . . A 55 PRO HA . 36483 1 589 . 1 . 1 55 55 PRO HB2 H 1 2.321 0.030 . 2 . . . . A 55 PRO HB2 . 36483 1 590 . 1 . 1 55 55 PRO HB3 H 1 1.910 0.030 . 2 . . . . A 55 PRO HB3 . 36483 1 591 . 1 . 1 55 55 PRO HG2 H 1 2.043 0.030 . 1 . . . . A 55 PRO HG2 . 36483 1 592 . 1 . 1 55 55 PRO HG3 H 1 2.043 0.030 . 1 . . . . A 55 PRO HG3 . 36483 1 593 . 1 . 1 55 55 PRO C C 13 177.472 0.300 . 1 . . . . A 55 PRO C . 36483 1 594 . 1 . 1 55 55 PRO CA C 13 63.089 0.300 . 1 . . . . A 55 PRO CA . 36483 1 595 . 1 . 1 55 55 PRO CB C 13 32.358 0.300 . 1 . . . . A 55 PRO CB . 36483 1 596 . 1 . 1 55 55 PRO CD C 13 49.765 0.300 . 1 . . . . A 55 PRO CD . 36483 1 597 . 1 . 1 56 56 LEU H H 1 7.676 0.030 . 1 . . . . A 56 LEU H . 36483 1 598 . 1 . 1 56 56 LEU HA H 1 4.797 0.030 . 1 . . . . A 56 LEU HA . 36483 1 599 . 1 . 1 56 56 LEU HB2 H 1 1.663 0.030 . 1 . . . . A 56 LEU HB2 . 36483 1 600 . 1 . 1 56 56 LEU HB3 H 1 1.663 0.030 . 1 . . . . A 56 LEU HB3 . 36483 1 601 . 1 . 1 56 56 LEU HD11 H 1 0.954 0.030 . 2 . . . . A 56 LEU HD11 . 36483 1 602 . 1 . 1 56 56 LEU HD12 H 1 0.954 0.030 . 2 . . . . A 56 LEU HD12 . 36483 1 603 . 1 . 1 56 56 LEU HD13 H 1 0.954 0.030 . 2 . . . . A 56 LEU HD13 . 36483 1 604 . 1 . 1 56 56 LEU HD21 H 1 0.889 0.030 . 2 . . . . A 56 LEU HD21 . 36483 1 605 . 1 . 1 56 56 LEU HD22 H 1 0.889 0.030 . 2 . . . . A 56 LEU HD22 . 36483 1 606 . 1 . 1 56 56 LEU HD23 H 1 0.889 0.030 . 2 . . . . A 56 LEU HD23 . 36483 1 607 . 1 . 1 56 56 LEU C C 13 177.449 0.300 . 1 . . . . A 56 LEU C . 36483 1 608 . 1 . 1 56 56 LEU CA C 13 53.348 0.300 . 1 . . . . A 56 LEU CA . 36483 1 609 . 1 . 1 56 56 LEU CB C 13 44.748 0.300 . 1 . . . . A 56 LEU CB . 36483 1 610 . 1 . 1 56 56 LEU CG C 13 25.411 0.300 . 1 . . . . A 56 LEU CG . 36483 1 611 . 1 . 1 56 56 LEU CD1 C 13 22.810 0.300 . 2 . . . . A 56 LEU CD1 . 36483 1 612 . 1 . 1 56 56 LEU CD2 C 13 23.467 0.300 . 2 . . . . A 56 LEU CD2 . 36483 1 613 . 1 . 1 56 56 LEU N N 15 120.825 0.300 . 1 . . . . A 56 LEU N . 36483 1 614 . 1 . 1 57 57 THR H H 1 8.868 0.030 . 1 . . . . A 57 THR H . 36483 1 615 . 1 . 1 57 57 THR HA H 1 4.381 0.030 . 1 . . . . A 57 THR HA . 36483 1 616 . 1 . 1 57 57 THR HB H 1 4.386 0.030 . 1 . . . . A 57 THR HB . 36483 1 617 . 1 . 1 57 57 THR HG21 H 1 1.200 0.030 . 1 . . . . A 57 THR HG21 . 36483 1 618 . 1 . 1 57 57 THR HG22 H 1 1.200 0.030 . 1 . . . . A 57 THR HG22 . 36483 1 619 . 1 . 1 57 57 THR HG23 H 1 1.200 0.030 . 1 . . . . A 57 THR HG23 . 36483 1 620 . 1 . 1 57 57 THR C C 13 174.681 0.300 . 1 . . . . A 57 THR C . 36483 1 621 . 1 . 1 57 57 THR CA C 13 62.259 0.300 . 1 . . . . A 57 THR CA . 36483 1 622 . 1 . 1 57 57 THR CB C 13 69.575 0.300 . 1 . . . . A 57 THR CB . 36483 1 623 . 1 . 1 57 57 THR CG2 C 13 21.846 0.300 . 1 . . . . A 57 THR CG2 . 36483 1 624 . 1 . 1 57 57 THR N N 15 109.760 0.300 . 1 . . . . A 57 THR N . 36483 1 625 . 1 . 1 58 58 SER H H 1 7.513 0.030 . 1 . . . . A 58 SER H . 36483 1 626 . 1 . 1 58 58 SER HA H 1 4.545 0.030 . 1 . . . . A 58 SER HA . 36483 1 627 . 1 . 1 58 58 SER HB2 H 1 3.827 0.030 . 2 . . . . A 58 SER HB2 . 36483 1 628 . 1 . 1 58 58 SER HB3 H 1 3.733 0.030 . 2 . . . . A 58 SER HB3 . 36483 1 629 . 1 . 1 58 58 SER C C 13 173.039 0.300 . 1 . . . . A 58 SER C . 36483 1 630 . 1 . 1 58 58 SER CA C 13 56.890 0.300 . 1 . . . . A 58 SER CA . 36483 1 631 . 1 . 1 58 58 SER CB C 13 65.235 0.300 . 1 . . . . A 58 SER CB . 36483 1 632 . 1 . 1 58 58 SER N N 15 114.288 0.300 . 1 . . . . A 58 SER N . 36483 1 633 . 1 . 1 59 59 VAL H H 1 8.641 0.030 . 1 . . . . A 59 VAL H . 36483 1 634 . 1 . 1 59 59 VAL HA H 1 3.792 0.030 . 1 . . . . A 59 VAL HA . 36483 1 635 . 1 . 1 59 59 VAL HB H 1 1.933 0.030 . 1 . . . . A 59 VAL HB . 36483 1 636 . 1 . 1 59 59 VAL HG11 H 1 0.848 0.030 . 2 . . . . A 59 VAL HG11 . 36483 1 637 . 1 . 1 59 59 VAL HG12 H 1 0.848 0.030 . 2 . . . . A 59 VAL HG12 . 36483 1 638 . 1 . 1 59 59 VAL HG13 H 1 0.848 0.030 . 2 . . . . A 59 VAL HG13 . 36483 1 639 . 1 . 1 59 59 VAL HG21 H 1 0.935 0.030 . 2 . . . . A 59 VAL HG21 . 36483 1 640 . 1 . 1 59 59 VAL HG22 H 1 0.935 0.030 . 2 . . . . A 59 VAL HG22 . 36483 1 641 . 1 . 1 59 59 VAL HG23 H 1 0.935 0.030 . 2 . . . . A 59 VAL HG23 . 36483 1 642 . 1 . 1 59 59 VAL C C 13 174.284 0.300 . 1 . . . . A 59 VAL C . 36483 1 643 . 1 . 1 59 59 VAL CA C 13 61.884 0.300 . 1 . . . . A 59 VAL CA . 36483 1 644 . 1 . 1 59 59 VAL CB C 13 32.217 0.300 . 1 . . . . A 59 VAL CB . 36483 1 645 . 1 . 1 59 59 VAL CG1 C 13 20.272 0.300 . 2 . . . . A 59 VAL CG1 . 36483 1 646 . 1 . 1 59 59 VAL CG2 C 13 21.461 0.300 . 2 . . . . A 59 VAL CG2 . 36483 1 647 . 1 . 1 59 59 VAL N N 15 123.901 0.300 . 1 . . . . A 59 VAL N . 36483 1 648 . 1 . 1 60 60 PRO HA H 1 4.703 0.030 . 1 . . . . A 60 PRO HA . 36483 1 649 . 1 . 1 60 60 PRO HB2 H 1 2.158 0.030 . 1 . . . . A 60 PRO HB2 . 36483 1 650 . 1 . 1 60 60 PRO HB3 H 1 2.158 0.030 . 1 . . . . A 60 PRO HB3 . 36483 1 651 . 1 . 1 60 60 PRO HD2 H 1 3.724 0.030 . 2 . . . . A 60 PRO HD2 . 36483 1 652 . 1 . 1 60 60 PRO HD3 H 1 3.261 0.030 . 2 . . . . A 60 PRO HD3 . 36483 1 653 . 1 . 1 60 60 PRO CA C 13 61.823 0.300 . 1 . . . . A 60 PRO CA . 36483 1 654 . 1 . 1 60 60 PRO CB C 13 31.930 0.300 . 1 . . . . A 60 PRO CB . 36483 1 655 . 1 . 1 60 60 PRO CG C 13 27.269 0.300 . 1 . . . . A 60 PRO CG . 36483 1 656 . 1 . 1 60 60 PRO CD C 13 51.620 0.300 . 1 . . . . A 60 PRO CD . 36483 1 657 . 1 . 1 61 61 PRO HA H 1 4.634 0.030 . 1 . . . . A 61 PRO HA . 36483 1 658 . 1 . 1 61 61 PRO HB2 H 1 2.071 0.030 . 1 . . . . A 61 PRO HB2 . 36483 1 659 . 1 . 1 61 61 PRO HB3 H 1 2.071 0.030 . 1 . . . . A 61 PRO HB3 . 36483 1 660 . 1 . 1 61 61 PRO HG2 H 1 0.840 0.030 . 1 . . . . A 61 PRO HG2 . 36483 1 661 . 1 . 1 61 61 PRO HG3 H 1 0.840 0.030 . 1 . . . . A 61 PRO HG3 . 36483 1 662 . 1 . 1 61 61 PRO C C 13 176.787 0.300 . 1 . . . . A 61 PRO C . 36483 1 663 . 1 . 1 61 61 PRO CA C 13 62.948 0.300 . 1 . . . . A 61 PRO CA . 36483 1 664 . 1 . 1 61 61 PRO CB C 13 31.088 0.300 . 1 . . . . A 61 PRO CB . 36483 1 665 . 1 . 1 61 61 PRO CG C 13 27.083 0.300 . 1 . . . . A 61 PRO CG . 36483 1 666 . 1 . 1 61 61 PRO CD C 13 50.397 0.300 . 1 . . . . A 61 PRO CD . 36483 1 667 . 1 . 1 62 62 GLU H H 1 7.719 0.030 . 1 . . . . A 62 GLU H . 36483 1 668 . 1 . 1 62 62 GLU HG3 H 1 2.051 0.030 . 2 . . . . A 62 GLU HG3 . 36483 1 669 . 1 . 1 62 62 GLU C C 13 174.654 0.300 . 1 . . . . A 62 GLU C . 36483 1 670 . 1 . 1 62 62 GLU CA C 13 56.488 0.300 . 1 . . . . A 62 GLU CA . 36483 1 671 . 1 . 1 62 62 GLU CB C 13 30.208 0.300 . 1 . . . . A 62 GLU CB . 36483 1 672 . 1 . 1 62 62 GLU CG C 13 35.575 0.300 . 1 . . . . A 62 GLU CG . 36483 1 673 . 1 . 1 62 62 GLU N N 15 121.348 0.300 . 1 . . . . A 62 GLU N . 36483 1 674 . 1 . 1 63 63 PRO HA H 1 4.470 0.030 . 1 . . . . A 63 PRO HA . 36483 1 675 . 1 . 1 63 63 PRO HB2 H 1 2.251 0.030 . 2 . . . . A 63 PRO HB2 . 36483 1 676 . 1 . 1 63 63 PRO HB3 H 1 1.942 0.030 . 2 . . . . A 63 PRO HB3 . 36483 1 677 . 1 . 1 63 63 PRO HD2 H 1 3.845 0.030 . 1 . . . . A 63 PRO HD2 . 36483 1 678 . 1 . 1 63 63 PRO HD3 H 1 3.845 0.030 . 1 . . . . A 63 PRO HD3 . 36483 1 679 . 1 . 1 63 63 PRO C C 13 174.637 0.300 . 1 . . . . A 63 PRO C . 36483 1 680 . 1 . 1 63 63 PRO CA C 13 64.242 0.300 . 1 . . . . A 63 PRO CA . 36483 1 681 . 1 . 1 63 63 PRO CB C 13 32.436 0.300 . 1 . . . . A 63 PRO CB . 36483 1 682 . 1 . 1 63 63 PRO CG C 13 27.199 0.300 . 1 . . . . A 63 PRO CG . 36483 1 683 . 1 . 1 63 63 PRO CD C 13 50.567 0.300 . 1 . . . . A 63 PRO CD . 36483 1 684 . 1 . 1 64 64 GLU H H 1 6.937 0.030 . 1 . . . . A 64 GLU H . 36483 1 685 . 1 . 1 64 64 GLU HA H 1 4.613 0.030 . 1 . . . . A 64 GLU HA . 36483 1 686 . 1 . 1 64 64 GLU HB2 H 1 1.955 0.030 . 2 . . . . A 64 GLU HB2 . 36483 1 687 . 1 . 1 64 64 GLU HB3 H 1 1.782 0.030 . 2 . . . . A 64 GLU HB3 . 36483 1 688 . 1 . 1 64 64 GLU C C 13 174.629 0.300 . 1 . . . . A 64 GLU C . 36483 1 689 . 1 . 1 64 64 GLU CA C 13 53.698 0.300 . 1 . . . . A 64 GLU CA . 36483 1 690 . 1 . 1 64 64 GLU CB C 13 33.863 0.300 . 1 . . . . A 64 GLU CB . 36483 1 691 . 1 . 1 64 64 GLU N N 15 110.280 0.300 . 1 . . . . A 64 GLU N . 36483 1 692 . 1 . 1 65 65 TRP H H 1 8.952 0.030 . 1 . . . . A 65 TRP H . 36483 1 693 . 1 . 1 65 65 TRP HA H 1 4.290 0.030 . 1 . . . . A 65 TRP HA . 36483 1 694 . 1 . 1 65 65 TRP HB2 H 1 3.040 0.030 . 2 . . . . A 65 TRP HB2 . 36483 1 695 . 1 . 1 65 65 TRP HB3 H 1 2.932 0.030 . 2 . . . . A 65 TRP HB3 . 36483 1 696 . 1 . 1 65 65 TRP HD1 H 1 7.331 0.030 . 1 . . . . A 65 TRP HD1 . 36483 1 697 . 1 . 1 65 65 TRP HE1 H 1 9.709 0.030 . 1 . . . . A 65 TRP HE1 . 36483 1 698 . 1 . 1 65 65 TRP HZ2 H 1 7.080 0.030 . 1 . . . . A 65 TRP HZ2 . 36483 1 699 . 1 . 1 65 65 TRP HZ3 H 1 6.708 0.030 . 1 . . . . A 65 TRP HZ3 . 36483 1 700 . 1 . 1 65 65 TRP HH2 H 1 6.245 0.030 . 1 . . . . A 65 TRP HH2 . 36483 1 701 . 1 . 1 65 65 TRP C C 13 171.430 0.300 . 1 . . . . A 65 TRP C . 36483 1 702 . 1 . 1 65 65 TRP CA C 13 59.972 0.300 . 1 . . . . A 65 TRP CA . 36483 1 703 . 1 . 1 65 65 TRP CB C 13 31.947 0.300 . 1 . . . . A 65 TRP CB . 36483 1 704 . 1 . 1 65 65 TRP CD1 C 13 126.250 0.300 . 1 . . . . A 65 TRP CD1 . 36483 1 705 . 1 . 1 65 65 TRP CZ2 C 13 113.817 0.300 . 1 . . . . A 65 TRP CZ2 . 36483 1 706 . 1 . 1 65 65 TRP CZ3 C 13 120.245 0.300 . 1 . . . . A 65 TRP CZ3 . 36483 1 707 . 1 . 1 65 65 TRP CH2 C 13 122.387 0.300 . 1 . . . . A 65 TRP CH2 . 36483 1 708 . 1 . 1 65 65 TRP N N 15 122.740 0.300 . 1 . . . . A 65 TRP N . 36483 1 709 . 1 . 1 65 65 TRP NE1 N 15 127.712 0.300 . 1 . . . . A 65 TRP NE1 . 36483 1 710 . 1 . 1 66 66 TYR H H 1 7.026 0.030 . 1 . . . . A 66 TYR H . 36483 1 711 . 1 . 1 66 66 TYR HA H 1 5.168 0.030 . 1 . . . . A 66 TYR HA . 36483 1 712 . 1 . 1 66 66 TYR HB2 H 1 2.426 0.030 . 2 . . . . A 66 TYR HB2 . 36483 1 713 . 1 . 1 66 66 TYR HB3 H 1 2.084 0.030 . 2 . . . . A 66 TYR HB3 . 36483 1 714 . 1 . 1 66 66 TYR HD1 H 1 6.873 0.030 . 1 . . . . A 66 TYR HD1 . 36483 1 715 . 1 . 1 66 66 TYR HD2 H 1 6.873 0.030 . 1 . . . . A 66 TYR HD2 . 36483 1 716 . 1 . 1 66 66 TYR HE1 H 1 6.571 0.030 . 1 . . . . A 66 TYR HE1 . 36483 1 717 . 1 . 1 66 66 TYR HE2 H 1 6.571 0.030 . 1 . . . . A 66 TYR HE2 . 36483 1 718 . 1 . 1 66 66 TYR C C 13 173.910 0.300 . 1 . . . . A 66 TYR C . 36483 1 719 . 1 . 1 66 66 TYR CA C 13 54.979 0.300 . 1 . . . . A 66 TYR CA . 36483 1 720 . 1 . 1 66 66 TYR CB C 13 41.276 0.300 . 1 . . . . A 66 TYR CB . 36483 1 721 . 1 . 1 66 66 TYR CD1 C 13 132.979 0.300 . 1 . . . . A 66 TYR CD1 . 36483 1 722 . 1 . 1 66 66 TYR CD2 C 13 132.979 0.300 . 1 . . . . A 66 TYR CD2 . 36483 1 723 . 1 . 1 66 66 TYR CE1 C 13 118.210 0.300 . 1 . . . . A 66 TYR CE1 . 36483 1 724 . 1 . 1 66 66 TYR CE2 C 13 118.210 0.300 . 1 . . . . A 66 TYR CE2 . 36483 1 725 . 1 . 1 66 66 TYR N N 15 122.953 0.300 . 1 . . . . A 66 TYR N . 36483 1 726 . 1 . 1 67 67 CYS H H 1 9.322 0.030 . 1 . . . . A 67 CYS H . 36483 1 727 . 1 . 1 67 67 CYS HA H 1 3.452 0.030 . 1 . . . . A 67 CYS HA . 36483 1 728 . 1 . 1 67 67 CYS HB2 H 1 2.545 0.030 . 2 . . . . A 67 CYS HB2 . 36483 1 729 . 1 . 1 67 67 CYS HB3 H 1 2.203 0.030 . 2 . . . . A 67 CYS HB3 . 36483 1 730 . 1 . 1 67 67 CYS C C 13 172.664 0.300 . 1 . . . . A 67 CYS C . 36483 1 731 . 1 . 1 67 67 CYS CA C 13 57.350 0.300 . 1 . . . . A 67 CYS CA . 36483 1 732 . 1 . 1 67 67 CYS CB C 13 30.392 0.300 . 1 . . . . A 67 CYS CB . 36483 1 733 . 1 . 1 67 67 CYS N N 15 127.243 0.300 . 1 . . . . A 67 CYS N . 36483 1 734 . 1 . 1 68 68 PRO HA H 1 3.899 0.030 . 1 . . . . A 68 PRO HA . 36483 1 735 . 1 . 1 68 68 PRO HB2 H 1 2.391 0.030 . 2 . . . . A 68 PRO HB2 . 36483 1 736 . 1 . 1 68 68 PRO HB3 H 1 1.911 0.030 . 2 . . . . A 68 PRO HB3 . 36483 1 737 . 1 . 1 68 68 PRO HG2 H 1 2.162 0.030 . 1 . . . . A 68 PRO HG2 . 36483 1 738 . 1 . 1 68 68 PRO HG3 H 1 2.162 0.030 . 1 . . . . A 68 PRO HG3 . 36483 1 739 . 1 . 1 68 68 PRO HD2 H 1 3.097 0.030 . 1 . . . . A 68 PRO HD2 . 36483 1 740 . 1 . 1 68 68 PRO HD3 H 1 3.097 0.030 . 1 . . . . A 68 PRO HD3 . 36483 1 741 . 1 . 1 68 68 PRO C C 13 178.164 0.300 . 1 . . . . A 68 PRO C . 36483 1 742 . 1 . 1 68 68 PRO CA C 13 65.723 0.300 . 1 . . . . A 68 PRO CA . 36483 1 743 . 1 . 1 68 68 PRO CB C 13 32.061 0.300 . 1 . . . . A 68 PRO CB . 36483 1 744 . 1 . 1 68 68 PRO CG C 13 28.291 0.300 . 1 . . . . A 68 PRO CG . 36483 1 745 . 1 . 1 68 68 PRO CD C 13 49.843 0.300 . 1 . . . . A 68 PRO CD . 36483 1 746 . 1 . 1 69 69 SER H H 1 8.036 0.030 . 1 . . . . A 69 SER H . 36483 1 747 . 1 . 1 69 69 SER HA H 1 4.415 0.030 . 1 . . . . A 69 SER HA . 36483 1 748 . 1 . 1 69 69 SER HB2 H 1 3.977 0.030 . 1 . . . . A 69 SER HB2 . 36483 1 749 . 1 . 1 69 69 SER HB3 H 1 3.977 0.030 . 1 . . . . A 69 SER HB3 . 36483 1 750 . 1 . 1 69 69 SER C C 13 175.889 0.300 . 1 . . . . A 69 SER C . 36483 1 751 . 1 . 1 69 69 SER CA C 13 60.865 0.300 . 1 . . . . A 69 SER CA . 36483 1 752 . 1 . 1 69 69 SER CB C 13 63.325 0.300 . 1 . . . . A 69 SER CB . 36483 1 753 . 1 . 1 69 69 SER N N 15 112.410 0.300 . 1 . . . . A 69 SER N . 36483 1 754 . 1 . 1 70 70 CYS H H 1 8.194 0.030 . 1 . . . . A 70 CYS H . 36483 1 755 . 1 . 1 70 70 CYS HA H 1 4.067 0.030 . 1 . . . . A 70 CYS HA . 36483 1 756 . 1 . 1 70 70 CYS HB2 H 1 2.862 0.030 . 2 . . . . A 70 CYS HB2 . 36483 1 757 . 1 . 1 70 70 CYS HB3 H 1 2.761 0.030 . 2 . . . . A 70 CYS HB3 . 36483 1 758 . 1 . 1 70 70 CYS C C 13 177.446 0.300 . 1 . . . . A 70 CYS C . 36483 1 759 . 1 . 1 70 70 CYS CA C 13 62.570 0.300 . 1 . . . . A 70 CYS CA . 36483 1 760 . 1 . 1 70 70 CYS CB C 13 31.029 0.300 . 1 . . . . A 70 CYS CB . 36483 1 761 . 1 . 1 70 70 CYS N N 15 124.346 0.300 . 1 . . . . A 70 CYS N . 36483 1 762 . 1 . 1 71 71 ARG H H 1 8.192 0.030 . 1 . . . . A 71 ARG H . 36483 1 763 . 1 . 1 71 71 ARG HA H 1 3.787 0.030 . 1 . . . . A 71 ARG HA . 36483 1 764 . 1 . 1 71 71 ARG HB2 H 1 1.717 0.030 . 2 . . . . A 71 ARG HB2 . 36483 1 765 . 1 . 1 71 71 ARG HB3 H 1 1.556 0.030 . 2 . . . . A 71 ARG HB3 . 36483 1 766 . 1 . 1 71 71 ARG C C 13 176.045 0.300 . 1 . . . . A 71 ARG C . 36483 1 767 . 1 . 1 71 71 ARG CA C 13 57.707 0.300 . 1 . . . . A 71 ARG CA . 36483 1 768 . 1 . 1 71 71 ARG CB C 13 29.690 0.300 . 1 . . . . A 71 ARG CB . 36483 1 769 . 1 . 1 71 71 ARG N N 15 118.090 0.300 . 1 . . . . A 71 ARG N . 36483 1 770 . 1 . 1 72 72 THR H H 1 7.531 0.030 . 1 . . . . A 72 THR H . 36483 1 771 . 1 . 1 72 72 THR HA H 1 4.296 0.030 . 1 . . . . A 72 THR HA . 36483 1 772 . 1 . 1 72 72 THR HB H 1 4.301 0.030 . 1 . . . . A 72 THR HB . 36483 1 773 . 1 . 1 72 72 THR HG21 H 1 1.128 0.030 . 1 . . . . A 72 THR HG21 . 36483 1 774 . 1 . 1 72 72 THR HG22 H 1 1.128 0.030 . 1 . . . . A 72 THR HG22 . 36483 1 775 . 1 . 1 72 72 THR HG23 H 1 1.128 0.030 . 1 . . . . A 72 THR HG23 . 36483 1 776 . 1 . 1 72 72 THR C C 13 174.303 0.300 . 1 . . . . A 72 THR C . 36483 1 777 . 1 . 1 72 72 THR CA C 13 61.685 0.300 . 1 . . . . A 72 THR CA . 36483 1 778 . 1 . 1 72 72 THR CB C 13 69.541 0.300 . 1 . . . . A 72 THR CB . 36483 1 779 . 1 . 1 72 72 THR CG2 C 13 21.696 0.300 . 1 . . . . A 72 THR CG2 . 36483 1 780 . 1 . 1 72 72 THR N N 15 111.892 0.300 . 1 . . . . A 72 THR N . 36483 1 781 . 1 . 1 73 73 ASP H H 1 7.825 0.030 . 1 . . . . A 73 ASP H . 36483 1 782 . 1 . 1 73 73 ASP HA H 1 4.579 0.030 . 1 . . . . A 73 ASP HA . 36483 1 783 . 1 . 1 73 73 ASP HB2 H 1 2.724 0.030 . 1 . . . . A 73 ASP HB2 . 36483 1 784 . 1 . 1 73 73 ASP HB3 H 1 2.724 0.030 . 1 . . . . A 73 ASP HB3 . 36483 1 785 . 1 . 1 73 73 ASP C C 13 176.560 0.300 . 1 . . . . A 73 ASP C . 36483 1 786 . 1 . 1 73 73 ASP CA C 13 54.599 0.300 . 1 . . . . A 73 ASP CA . 36483 1 787 . 1 . 1 73 73 ASP CB C 13 41.198 0.300 . 1 . . . . A 73 ASP CB . 36483 1 788 . 1 . 1 73 73 ASP N N 15 122.032 0.300 . 1 . . . . A 73 ASP N . 36483 1 789 . 1 . 1 74 74 SER H H 1 8.177 0.030 . 1 . . . . A 74 SER H . 36483 1 790 . 1 . 1 74 74 SER HA H 1 4.277 0.030 . 1 . . . . A 74 SER HA . 36483 1 791 . 1 . 1 74 74 SER HB2 H 1 3.748 0.030 . 1 . . . . A 74 SER HB2 . 36483 1 792 . 1 . 1 74 74 SER HB3 H 1 3.748 0.030 . 1 . . . . A 74 SER HB3 . 36483 1 793 . 1 . 1 74 74 SER C C 13 174.576 0.300 . 1 . . . . A 74 SER C . 36483 1 794 . 1 . 1 74 74 SER CA C 13 58.938 0.300 . 1 . . . . A 74 SER CA . 36483 1 795 . 1 . 1 74 74 SER CB C 13 63.632 0.300 . 1 . . . . A 74 SER CB . 36483 1 796 . 1 . 1 74 74 SER N N 15 116.880 0.300 . 1 . . . . A 74 SER N . 36483 1 797 . 1 . 1 75 75 ARG H H 1 8.229 0.030 . 1 . . . . A 75 ARG H . 36483 1 798 . 1 . 1 75 75 ARG HA H 1 4.270 0.030 . 1 . . . . A 75 ARG HA . 36483 1 799 . 1 . 1 75 75 ARG HB2 H 1 1.756 0.030 . 2 . . . . A 75 ARG HB2 . 36483 1 800 . 1 . 1 75 75 ARG HB3 H 1 1.669 0.030 . 2 . . . . A 75 ARG HB3 . 36483 1 801 . 1 . 1 75 75 ARG C C 13 176.249 0.300 . 1 . . . . A 75 ARG C . 36483 1 802 . 1 . 1 75 75 ARG CA C 13 56.227 0.300 . 1 . . . . A 75 ARG CA . 36483 1 803 . 1 . 1 75 75 ARG CB C 13 30.487 0.300 . 1 . . . . A 75 ARG CB . 36483 1 804 . 1 . 1 75 75 ARG CG C 13 27.029 0.300 . 1 . . . . A 75 ARG CG . 36483 1 805 . 1 . 1 75 75 ARG N N 15 122.641 0.300 . 1 . . . . A 75 ARG N . 36483 1 806 . 1 . 1 76 76 ARG H H 1 8.071 0.030 . 1 . . . . A 76 ARG H . 36483 1 807 . 1 . 1 76 76 ARG HA H 1 4.242 0.030 . 1 . . . . A 76 ARG HA . 36483 1 808 . 1 . 1 76 76 ARG C C 13 176.214 0.300 . 1 . . . . A 76 ARG C . 36483 1 809 . 1 . 1 76 76 ARG CA C 13 56.224 0.300 . 1 . . . . A 76 ARG CA . 36483 1 810 . 1 . 1 76 76 ARG CB C 13 30.692 0.300 . 1 . . . . A 76 ARG CB . 36483 1 811 . 1 . 1 76 76 ARG CG C 13 27.039 0.300 . 1 . . . . A 76 ARG CG . 36483 1 812 . 1 . 1 76 76 ARG N N 15 122.151 0.300 . 1 . . . . A 76 ARG N . 36483 1 813 . 1 . 1 77 77 GLU H H 1 8.616 0.030 . 1 . . . . A 77 GLU H . 36483 1 814 . 1 . 1 77 77 GLU HA H 1 4.328 0.030 . 1 . . . . A 77 GLU HA . 36483 1 815 . 1 . 1 77 77 GLU HB2 H 1 2.021 0.030 . 2 . . . . A 77 GLU HB2 . 36483 1 816 . 1 . 1 77 77 GLU HB3 H 1 1.931 0.030 . 2 . . . . A 77 GLU HB3 . 36483 1 817 . 1 . 1 77 77 GLU C C 13 176.374 0.300 . 1 . . . . A 77 GLU C . 36483 1 818 . 1 . 1 77 77 GLU CA C 13 56.217 0.300 . 1 . . . . A 77 GLU CA . 36483 1 819 . 1 . 1 77 77 GLU CB C 13 30.345 0.300 . 1 . . . . A 77 GLU CB . 36483 1 820 . 1 . 1 77 77 GLU N N 15 123.167 0.300 . 1 . . . . A 77 GLU N . 36483 1 821 . 1 . 1 78 78 VAL H H 1 8.440 0.030 . 1 . . . . A 78 VAL H . 36483 1 822 . 1 . 1 78 78 VAL HA H 1 4.093 0.030 . 1 . . . . A 78 VAL HA . 36483 1 823 . 1 . 1 78 78 VAL HB H 1 2.062 0.030 . 1 . . . . A 78 VAL HB . 36483 1 824 . 1 . 1 78 78 VAL HG21 H 1 0.958 0.030 . 2 . . . . A 78 VAL HG21 . 36483 1 825 . 1 . 1 78 78 VAL HG22 H 1 0.958 0.030 . 2 . . . . A 78 VAL HG22 . 36483 1 826 . 1 . 1 78 78 VAL HG23 H 1 0.958 0.030 . 2 . . . . A 78 VAL HG23 . 36483 1 827 . 1 . 1 78 78 VAL C C 13 176.223 0.300 . 1 . . . . A 78 VAL C . 36483 1 828 . 1 . 1 78 78 VAL CA C 13 62.417 0.300 . 1 . . . . A 78 VAL CA . 36483 1 829 . 1 . 1 78 78 VAL CB C 13 32.701 0.300 . 1 . . . . A 78 VAL CB . 36483 1 830 . 1 . 1 78 78 VAL CG1 C 13 20.871 0.300 . 2 . . . . A 78 VAL CG1 . 36483 1 831 . 1 . 1 78 78 VAL CG2 C 13 21.135 0.300 . 2 . . . . A 78 VAL CG2 . 36483 1 832 . 1 . 1 78 78 VAL N N 15 122.959 0.300 . 1 . . . . A 78 VAL N . 36483 1 833 . 1 . 1 79 79 GLN H H 1 8.690 0.030 . 1 . . . . A 79 GLN H . 36483 1 834 . 1 . 1 79 79 GLN HA H 1 4.388 0.030 . 1 . . . . A 79 GLN HA . 36483 1 835 . 1 . 1 79 79 GLN HB2 H 1 2.125 0.030 . 2 . . . . A 79 GLN HB2 . 36483 1 836 . 1 . 1 79 79 GLN HB3 H 1 1.989 0.030 . 2 . . . . A 79 GLN HB3 . 36483 1 837 . 1 . 1 79 79 GLN C C 13 175.960 0.300 . 1 . . . . A 79 GLN C . 36483 1 838 . 1 . 1 79 79 GLN CA C 13 55.644 0.300 . 1 . . . . A 79 GLN CA . 36483 1 839 . 1 . 1 79 79 GLN CB C 13 29.685 0.300 . 1 . . . . A 79 GLN CB . 36483 1 840 . 1 . 1 79 79 GLN N N 15 125.167 0.300 . 1 . . . . A 79 GLN N . 36483 1 841 . 1 . 1 80 80 SER H H 1 8.423 0.030 . 1 . . . . A 80 SER H . 36483 1 842 . 1 . 1 80 80 SER HA H 1 4.373 0.030 . 1 . . . . A 80 SER HA . 36483 1 843 . 1 . 1 80 80 SER HB2 H 1 3.865 0.030 . 2 . . . . A 80 SER HB2 . 36483 1 844 . 1 . 1 80 80 SER HB3 H 1 3.754 0.030 . 2 . . . . A 80 SER HB3 . 36483 1 845 . 1 . 1 80 80 SER C C 13 174.275 0.300 . 1 . . . . A 80 SER C . 36483 1 846 . 1 . 1 80 80 SER CA C 13 58.354 0.300 . 1 . . . . A 80 SER CA . 36483 1 847 . 1 . 1 80 80 SER CB C 13 63.911 0.300 . 1 . . . . A 80 SER CB . 36483 1 848 . 1 . 1 80 80 SER N N 15 117.413 0.300 . 1 . . . . A 80 SER N . 36483 1 849 . 1 . 1 81 81 ALA H H 1 8.371 0.030 . 1 . . . . A 81 ALA H . 36483 1 850 . 1 . 1 81 81 ALA HA H 1 4.223 0.030 . 1 . . . . A 81 ALA HA . 36483 1 851 . 1 . 1 81 81 ALA HB1 H 1 1.211 0.030 . 1 . . . . A 81 ALA HB1 . 36483 1 852 . 1 . 1 81 81 ALA HB2 H 1 1.211 0.030 . 1 . . . . A 81 ALA HB2 . 36483 1 853 . 1 . 1 81 81 ALA HB3 H 1 1.211 0.030 . 1 . . . . A 81 ALA HB3 . 36483 1 854 . 1 . 1 81 81 ALA C C 13 176.845 0.300 . 1 . . . . A 81 ALA C . 36483 1 855 . 1 . 1 81 81 ALA CA C 13 52.782 0.300 . 1 . . . . A 81 ALA CA . 36483 1 856 . 1 . 1 81 81 ALA CB C 13 19.261 0.300 . 1 . . . . A 81 ALA CB . 36483 1 857 . 1 . 1 81 81 ALA N N 15 126.021 0.300 . 1 . . . . A 81 ALA N . 36483 1 858 . 1 . 1 82 82 PHE H H 1 8.101 0.030 . 1 . . . . A 82 PHE H . 36483 1 859 . 1 . 1 82 82 PHE HA H 1 4.921 0.030 . 1 . . . . A 82 PHE HA . 36483 1 860 . 1 . 1 82 82 PHE HB2 H 1 3.179 0.030 . 2 . . . . A 82 PHE HB2 . 36483 1 861 . 1 . 1 82 82 PHE HB3 H 1 2.943 0.030 . 2 . . . . A 82 PHE HB3 . 36483 1 862 . 1 . 1 82 82 PHE HD1 H 1 7.265 0.030 . 1 . . . . A 82 PHE HD1 . 36483 1 863 . 1 . 1 82 82 PHE HD2 H 1 7.265 0.030 . 1 . . . . A 82 PHE HD2 . 36483 1 864 . 1 . 1 82 82 PHE C C 13 176.843 0.300 . 1 . . . . A 82 PHE C . 36483 1 865 . 1 . 1 82 82 PHE CA C 13 55.419 0.300 . 1 . . . . A 82 PHE CA . 36483 1 866 . 1 . 1 82 82 PHE CB C 13 39.275 0.300 . 1 . . . . A 82 PHE CB . 36483 1 867 . 1 . 1 82 82 PHE CD1 C 13 131.953 0.300 . 1 . . . . A 82 PHE CD1 . 36483 1 868 . 1 . 1 82 82 PHE CD2 C 13 131.953 0.300 . 1 . . . . A 82 PHE CD2 . 36483 1 869 . 1 . 1 82 82 PHE N N 15 118.821 0.300 . 1 . . . . A 82 PHE N . 36483 1 870 . 1 . 1 83 83 PRO HA H 1 4.380 0.030 . 1 . . . . A 83 PRO HA . 36483 1 871 . 1 . 1 83 83 PRO HB2 H 1 2.317 0.030 . 2 . . . . A 83 PRO HB2 . 36483 1 872 . 1 . 1 83 83 PRO HB3 H 1 1.926 0.030 . 2 . . . . A 83 PRO HB3 . 36483 1 873 . 1 . 1 83 83 PRO C C 13 177.001 0.300 . 1 . . . . A 83 PRO C . 36483 1 874 . 1 . 1 83 83 PRO CA C 13 63.966 0.300 . 1 . . . . A 83 PRO CA . 36483 1 875 . 1 . 1 83 83 PRO CB C 13 32.294 0.300 . 1 . . . . A 83 PRO CB . 36483 1 876 . 1 . 1 83 83 PRO CG C 13 27.176 0.300 . 1 . . . . A 83 PRO CG . 36483 1 877 . 1 . 1 84 84 LYS H H 1 8.367 0.030 . 1 . . . . A 84 LYS H . 36483 1 878 . 1 . 1 84 84 LYS HA H 1 4.327 0.030 . 1 . . . . A 84 LYS HA . 36483 1 879 . 1 . 1 84 84 LYS HB2 H 1 1.926 0.030 . 2 . . . . A 84 LYS HB2 . 36483 1 880 . 1 . 1 84 84 LYS HB3 H 1 1.804 0.030 . 2 . . . . A 84 LYS HB3 . 36483 1 881 . 1 . 1 84 84 LYS C C 13 176.110 0.300 . 1 . . . . A 84 LYS C . 36483 1 882 . 1 . 1 84 84 LYS CA C 13 56.166 0.300 . 1 . . . . A 84 LYS CA . 36483 1 883 . 1 . 1 84 84 LYS CB C 13 32.417 0.300 . 1 . . . . A 84 LYS CB . 36483 1 884 . 1 . 1 84 84 LYS CG C 13 24.851 0.300 . 1 . . . . A 84 LYS CG . 36483 1 885 . 1 . 1 84 84 LYS N N 15 118.962 0.300 . 1 . . . . A 84 LYS N . 36483 1 886 . 1 . 1 85 85 ARG H H 1 7.984 0.030 . 1 . . . . A 85 ARG H . 36483 1 887 . 1 . 1 85 85 ARG HA H 1 4.278 0.030 . 1 . . . . A 85 ARG HA . 36483 1 888 . 1 . 1 85 85 ARG HB2 H 1 1.920 0.030 . 2 . . . . A 85 ARG HB2 . 36483 1 889 . 1 . 1 85 85 ARG HB3 H 1 1.761 0.030 . 2 . . . . A 85 ARG HB3 . 36483 1 890 . 1 . 1 85 85 ARG C C 13 174.566 0.300 . 1 . . . . A 85 ARG C . 36483 1 891 . 1 . 1 85 85 ARG CA C 13 56.575 0.300 . 1 . . . . A 85 ARG CA . 36483 1 892 . 1 . 1 85 85 ARG CB C 13 31.417 0.300 . 1 . . . . A 85 ARG CB . 36483 1 893 . 1 . 1 85 85 ARG N N 15 121.744 0.300 . 1 . . . . A 85 ARG N . 36483 1 894 . 1 . 1 86 86 ARG H H 1 7.842 0.030 . 1 . . . . A 86 ARG H . 36483 1 895 . 1 . 1 86 86 ARG HA H 1 4.283 0.030 . 1 . . . . A 86 ARG HA . 36483 1 896 . 1 . 1 86 86 ARG HB2 H 1 1.704 0.030 . 1 . . . . A 86 ARG HB2 . 36483 1 897 . 1 . 1 86 86 ARG HB3 H 1 1.704 0.030 . 1 . . . . A 86 ARG HB3 . 36483 1 898 . 1 . 1 86 86 ARG HD2 H 1 3.220 0.030 . 1 . . . . A 86 ARG HD2 . 36483 1 899 . 1 . 1 86 86 ARG HD3 H 1 3.220 0.030 . 1 . . . . A 86 ARG HD3 . 36483 1 900 . 1 . 1 86 86 ARG C C 13 175.287 0.300 . 1 . . . . A 86 ARG C . 36483 1 901 . 1 . 1 86 86 ARG CA C 13 54.306 0.300 . 1 . . . . A 86 ARG CA . 36483 1 902 . 1 . 1 86 86 ARG CB C 13 32.886 0.300 . 1 . . . . A 86 ARG CB . 36483 1 903 . 1 . 1 86 86 ARG N N 15 120.422 0.300 . 1 . . . . A 86 ARG N . 36483 1 904 . 1 . 1 87 87 VAL H H 1 8.138 0.030 . 1 . . . . A 87 VAL H . 36483 1 905 . 1 . 1 87 87 VAL HA H 1 3.744 0.030 . 1 . . . . A 87 VAL HA . 36483 1 906 . 1 . 1 87 87 VAL HB H 1 1.881 0.030 . 1 . . . . A 87 VAL HB . 36483 1 907 . 1 . 1 87 87 VAL HG11 H 1 0.923 0.030 . 2 . . . . A 87 VAL HG11 . 36483 1 908 . 1 . 1 87 87 VAL HG12 H 1 0.923 0.030 . 2 . . . . A 87 VAL HG12 . 36483 1 909 . 1 . 1 87 87 VAL HG13 H 1 0.923 0.030 . 2 . . . . A 87 VAL HG13 . 36483 1 910 . 1 . 1 87 87 VAL HG21 H 1 0.870 0.030 . 2 . . . . A 87 VAL HG21 . 36483 1 911 . 1 . 1 87 87 VAL HG22 H 1 0.870 0.030 . 2 . . . . A 87 VAL HG22 . 36483 1 912 . 1 . 1 87 87 VAL HG23 H 1 0.870 0.030 . 2 . . . . A 87 VAL HG23 . 36483 1 913 . 1 . 1 87 87 VAL C C 13 175.436 0.300 . 1 . . . . A 87 VAL C . 36483 1 914 . 1 . 1 87 87 VAL CA C 13 63.679 0.300 . 1 . . . . A 87 VAL CA . 36483 1 915 . 1 . 1 87 87 VAL CB C 13 32.021 0.300 . 1 . . . . A 87 VAL CB . 36483 1 916 . 1 . 1 87 87 VAL CG1 C 13 22.507 0.300 . 2 . . . . A 87 VAL CG1 . 36483 1 917 . 1 . 1 87 87 VAL CG2 C 13 23.444 0.300 . 2 . . . . A 87 VAL CG2 . 36483 1 918 . 1 . 1 87 87 VAL N N 15 121.529 0.300 . 1 . . . . A 87 VAL N . 36483 1 919 . 1 . 1 88 88 ARG H H 1 9.378 0.030 . 1 . . . . A 88 ARG H . 36483 1 920 . 1 . 1 88 88 ARG HA H 1 4.353 0.030 . 1 . . . . A 88 ARG HA . 36483 1 921 . 1 . 1 88 88 ARG HB2 H 1 1.509 0.030 . 1 . . . . A 88 ARG HB2 . 36483 1 922 . 1 . 1 88 88 ARG HB3 H 1 1.509 0.030 . 1 . . . . A 88 ARG HB3 . 36483 1 923 . 1 . 1 88 88 ARG HD2 H 1 2.982 0.030 . 1 . . . . A 88 ARG HD2 . 36483 1 924 . 1 . 1 88 88 ARG HD3 H 1 2.982 0.030 . 1 . . . . A 88 ARG HD3 . 36483 1 925 . 1 . 1 88 88 ARG HE H 1 7.428 0.030 . 1 . . . . A 88 ARG HE . 36483 1 926 . 1 . 1 88 88 ARG C C 13 176.038 0.300 . 1 . . . . A 88 ARG C . 36483 1 927 . 1 . 1 88 88 ARG CA C 13 55.648 0.300 . 1 . . . . A 88 ARG CA . 36483 1 928 . 1 . 1 88 88 ARG CB C 13 32.037 0.300 . 1 . . . . A 88 ARG CB . 36483 1 929 . 1 . 1 88 88 ARG CG C 13 26.861 0.300 . 1 . . . . A 88 ARG CG . 36483 1 930 . 1 . 1 88 88 ARG CD C 13 41.808 0.300 . 1 . . . . A 88 ARG CD . 36483 1 931 . 1 . 1 88 88 ARG N N 15 126.356 0.300 . 1 . . . . A 88 ARG N . 36483 1 932 . 1 . 1 88 88 ARG NE N 15 85.055 0.300 . 1 . . . . A 88 ARG NE . 36483 1 933 . 1 . 1 89 89 THR H H 1 7.455 0.030 . 1 . . . . A 89 THR H . 36483 1 934 . 1 . 1 89 89 THR HA H 1 5.498 0.030 . 1 . . . . A 89 THR HA . 36483 1 935 . 1 . 1 89 89 THR HB H 1 4.610 0.030 . 1 . . . . A 89 THR HB . 36483 1 936 . 1 . 1 89 89 THR HG21 H 1 1.093 0.030 . 1 . . . . A 89 THR HG21 . 36483 1 937 . 1 . 1 89 89 THR HG22 H 1 1.093 0.030 . 1 . . . . A 89 THR HG22 . 36483 1 938 . 1 . 1 89 89 THR HG23 H 1 1.093 0.030 . 1 . . . . A 89 THR HG23 . 36483 1 939 . 1 . 1 89 89 THR C C 13 177.566 0.300 . 1 . . . . A 89 THR C . 36483 1 940 . 1 . 1 89 89 THR CA C 13 58.460 0.300 . 1 . . . . A 89 THR CA . 36483 1 941 . 1 . 1 89 89 THR CB C 13 72.450 0.300 . 1 . . . . A 89 THR CB . 36483 1 942 . 1 . 1 89 89 THR CG2 C 13 21.010 0.300 . 1 . . . . A 89 THR CG2 . 36483 1 943 . 1 . 1 89 89 THR N N 15 107.655 0.300 . 1 . . . . A 89 THR N . 36483 1 944 . 1 . 1 90 90 LEU H H 1 8.992 0.030 . 1 . . . . A 90 LEU H . 36483 1 945 . 1 . 1 90 90 LEU HA H 1 4.052 0.030 . 1 . . . . A 90 LEU HA . 36483 1 946 . 1 . 1 90 90 LEU HB2 H 1 2.116 0.030 . 2 . . . . A 90 LEU HB2 . 36483 1 947 . 1 . 1 90 90 LEU HB3 H 1 1.102 0.030 . 2 . . . . A 90 LEU HB3 . 36483 1 948 . 1 . 1 90 90 LEU HG H 1 1.511 0.030 . 1 . . . . A 90 LEU HG . 36483 1 949 . 1 . 1 90 90 LEU HD11 H 1 0.857 0.030 . 2 . . . . A 90 LEU HD11 . 36483 1 950 . 1 . 1 90 90 LEU HD12 H 1 0.857 0.030 . 2 . . . . A 90 LEU HD12 . 36483 1 951 . 1 . 1 90 90 LEU HD13 H 1 0.857 0.030 . 2 . . . . A 90 LEU HD13 . 36483 1 952 . 1 . 1 90 90 LEU HD21 H 1 0.778 0.030 . 2 . . . . A 90 LEU HD21 . 36483 1 953 . 1 . 1 90 90 LEU HD22 H 1 0.778 0.030 . 2 . . . . A 90 LEU HD22 . 36483 1 954 . 1 . 1 90 90 LEU HD23 H 1 0.778 0.030 . 2 . . . . A 90 LEU HD23 . 36483 1 955 . 1 . 1 90 90 LEU C C 13 178.331 0.300 . 1 . . . . A 90 LEU C . 36483 1 956 . 1 . 1 90 90 LEU CA C 13 57.912 0.300 . 1 . . . . A 90 LEU CA . 36483 1 957 . 1 . 1 90 90 LEU CB C 13 42.318 0.300 . 1 . . . . A 90 LEU CB . 36483 1 958 . 1 . 1 90 90 LEU CG C 13 26.932 0.300 . 1 . . . . A 90 LEU CG . 36483 1 959 . 1 . 1 90 90 LEU CD1 C 13 22.465 0.300 . 2 . . . . A 90 LEU CD1 . 36483 1 960 . 1 . 1 90 90 LEU CD2 C 13 24.822 0.300 . 2 . . . . A 90 LEU CD2 . 36483 1 961 . 1 . 1 90 90 LEU N N 15 123.396 0.300 . 1 . . . . A 90 LEU N . 36483 1 962 . 1 . 1 91 91 LEU H H 1 7.118 0.030 . 1 . . . . A 91 LEU H . 36483 1 963 . 1 . 1 91 91 LEU HA H 1 3.879 0.030 . 1 . . . . A 91 LEU HA . 36483 1 964 . 1 . 1 91 91 LEU HB2 H 1 1.750 0.030 . 2 . . . . A 91 LEU HB2 . 36483 1 965 . 1 . 1 91 91 LEU HB3 H 1 1.045 0.030 . 2 . . . . A 91 LEU HB3 . 36483 1 966 . 1 . 1 91 91 LEU HG H 1 1.577 0.030 . 1 . . . . A 91 LEU HG . 36483 1 967 . 1 . 1 91 91 LEU HD11 H 1 0.700 0.030 . 2 . . . . A 91 LEU HD11 . 36483 1 968 . 1 . 1 91 91 LEU HD12 H 1 0.700 0.030 . 2 . . . . A 91 LEU HD12 . 36483 1 969 . 1 . 1 91 91 LEU HD13 H 1 0.700 0.030 . 2 . . . . A 91 LEU HD13 . 36483 1 970 . 1 . 1 91 91 LEU HD21 H 1 0.983 0.030 . 2 . . . . A 91 LEU HD21 . 36483 1 971 . 1 . 1 91 91 LEU HD22 H 1 0.983 0.030 . 2 . . . . A 91 LEU HD22 . 36483 1 972 . 1 . 1 91 91 LEU HD23 H 1 0.983 0.030 . 2 . . . . A 91 LEU HD23 . 36483 1 973 . 1 . 1 91 91 LEU C C 13 176.634 0.300 . 1 . . . . A 91 LEU C . 36483 1 974 . 1 . 1 91 91 LEU CA C 13 57.875 0.300 . 1 . . . . A 91 LEU CA . 36483 1 975 . 1 . 1 91 91 LEU CB C 13 41.230 0.300 . 1 . . . . A 91 LEU CB . 36483 1 976 . 1 . 1 91 91 LEU CG C 13 25.096 0.300 . 1 . . . . A 91 LEU CG . 36483 1 977 . 1 . 1 91 91 LEU CD1 C 13 25.402 0.300 . 2 . . . . A 91 LEU CD1 . 36483 1 978 . 1 . 1 91 91 LEU CD2 C 13 26.561 0.300 . 2 . . . . A 91 LEU CD2 . 36483 1 979 . 1 . 1 91 91 LEU N N 15 117.150 0.300 . 1 . . . . A 91 LEU N . 36483 1 980 . 1 . 1 92 92 SER H H 1 7.620 0.030 . 1 . . . . A 92 SER H . 36483 1 981 . 1 . 1 92 92 SER HA H 1 4.016 0.030 . 1 . . . . A 92 SER HA . 36483 1 982 . 1 . 1 92 92 SER HB2 H 1 3.975 0.030 . 2 . . . . A 92 SER HB2 . 36483 1 983 . 1 . 1 92 92 SER HB3 H 1 3.946 0.030 . 2 . . . . A 92 SER HB3 . 36483 1 984 . 1 . 1 92 92 SER HG H 1 4.849 0.030 . 1 . . . . A 92 SER HG . 36483 1 985 . 1 . 1 92 92 SER C C 13 176.136 0.300 . 1 . . . . A 92 SER C . 36483 1 986 . 1 . 1 92 92 SER CA C 13 61.660 0.300 . 1 . . . . A 92 SER CA . 36483 1 987 . 1 . 1 92 92 SER CB C 13 63.154 0.300 . 1 . . . . A 92 SER CB . 36483 1 988 . 1 . 1 92 92 SER N N 15 111.992 0.300 . 1 . . . . A 92 SER N . 36483 1 989 . 1 . 1 93 93 VAL H H 1 7.216 0.030 . 1 . . . . A 93 VAL H . 36483 1 990 . 1 . 1 93 93 VAL HA H 1 4.065 0.030 . 1 . . . . A 93 VAL HA . 36483 1 991 . 1 . 1 93 93 VAL HB H 1 2.058 0.030 . 1 . . . . A 93 VAL HB . 36483 1 992 . 1 . 1 93 93 VAL HG11 H 1 0.812 0.030 . 2 . . . . A 93 VAL HG11 . 36483 1 993 . 1 . 1 93 93 VAL HG12 H 1 0.812 0.030 . 2 . . . . A 93 VAL HG12 . 36483 1 994 . 1 . 1 93 93 VAL HG13 H 1 0.812 0.030 . 2 . . . . A 93 VAL HG13 . 36483 1 995 . 1 . 1 93 93 VAL HG21 H 1 0.996 0.030 . 2 . . . . A 93 VAL HG21 . 36483 1 996 . 1 . 1 93 93 VAL HG22 H 1 0.996 0.030 . 2 . . . . A 93 VAL HG22 . 36483 1 997 . 1 . 1 93 93 VAL HG23 H 1 0.996 0.030 . 2 . . . . A 93 VAL HG23 . 36483 1 998 . 1 . 1 93 93 VAL C C 13 176.334 0.300 . 1 . . . . A 93 VAL C . 36483 1 999 . 1 . 1 93 93 VAL CA C 13 64.742 0.300 . 1 . . . . A 93 VAL CA . 36483 1 1000 . 1 . 1 93 93 VAL CB C 13 32.246 0.300 . 1 . . . . A 93 VAL CB . 36483 1 1001 . 1 . 1 93 93 VAL CG1 C 13 21.651 0.300 . 2 . . . . A 93 VAL CG1 . 36483 1 1002 . 1 . 1 93 93 VAL CG2 C 13 23.457 0.300 . 2 . . . . A 93 VAL CG2 . 36483 1 1003 . 1 . 1 93 93 VAL N N 15 120.657 0.300 . 1 . . . . A 93 VAL N . 36483 1 1004 . 1 . 1 94 94 LEU H H 1 8.253 0.030 . 1 . . . . A 94 LEU H . 36483 1 1005 . 1 . 1 94 94 LEU HA H 1 3.901 0.030 . 1 . . . . A 94 LEU HA . 36483 1 1006 . 1 . 1 94 94 LEU HB2 H 1 1.866 0.030 . 2 . . . . A 94 LEU HB2 . 36483 1 1007 . 1 . 1 94 94 LEU HB3 H 1 1.498 0.030 . 2 . . . . A 94 LEU HB3 . 36483 1 1008 . 1 . 1 94 94 LEU HG H 1 0.852 0.030 . 1 . . . . A 94 LEU HG . 36483 1 1009 . 1 . 1 94 94 LEU HD11 H 1 0.873 0.030 . 2 . . . . A 94 LEU HD11 . 36483 1 1010 . 1 . 1 94 94 LEU HD12 H 1 0.873 0.030 . 2 . . . . A 94 LEU HD12 . 36483 1 1011 . 1 . 1 94 94 LEU HD13 H 1 0.873 0.030 . 2 . . . . A 94 LEU HD13 . 36483 1 1012 . 1 . 1 94 94 LEU HD21 H 1 0.969 0.030 . 2 . . . . A 94 LEU HD21 . 36483 1 1013 . 1 . 1 94 94 LEU HD22 H 1 0.969 0.030 . 2 . . . . A 94 LEU HD22 . 36483 1 1014 . 1 . 1 94 94 LEU HD23 H 1 0.969 0.030 . 2 . . . . A 94 LEU HD23 . 36483 1 1015 . 1 . 1 94 94 LEU C C 13 179.585 0.300 . 1 . . . . A 94 LEU C . 36483 1 1016 . 1 . 1 94 94 LEU CA C 13 57.661 0.300 . 1 . . . . A 94 LEU CA . 36483 1 1017 . 1 . 1 94 94 LEU CB C 13 41.594 0.300 . 1 . . . . A 94 LEU CB . 36483 1 1018 . 1 . 1 94 94 LEU CG C 13 27.923 0.300 . 1 . . . . A 94 LEU CG . 36483 1 1019 . 1 . 1 94 94 LEU CD1 C 13 25.777 0.300 . 2 . . . . A 94 LEU CD1 . 36483 1 1020 . 1 . 1 94 94 LEU CD2 C 13 22.996 0.300 . 2 . . . . A 94 LEU CD2 . 36483 1 1021 . 1 . 1 94 94 LEU N N 15 117.871 0.300 . 1 . . . . A 94 LEU N . 36483 1 1022 . 1 . 1 95 95 LYS H H 1 7.500 0.030 . 1 . . . . A 95 LYS H . 36483 1 1023 . 1 . 1 95 95 LYS HA H 1 4.217 0.030 . 1 . . . . A 95 LYS HA . 36483 1 1024 . 1 . 1 95 95 LYS HB2 H 1 1.970 0.030 . 2 . . . . A 95 LYS HB2 . 36483 1 1025 . 1 . 1 95 95 LYS HB3 H 1 1.764 0.030 . 2 . . . . A 95 LYS HB3 . 36483 1 1026 . 1 . 1 95 95 LYS C C 13 175.178 0.300 . 1 . . . . A 95 LYS C . 36483 1 1027 . 1 . 1 95 95 LYS CA C 13 56.622 0.300 . 1 . . . . A 95 LYS CA . 36483 1 1028 . 1 . 1 95 95 LYS CB C 13 32.820 0.300 . 1 . . . . A 95 LYS CB . 36483 1 1029 . 1 . 1 95 95 LYS CE C 13 43.309 0.300 . 1 . . . . A 95 LYS CE . 36483 1 1030 . 1 . 1 95 95 LYS N N 15 113.846 0.300 . 1 . . . . A 95 LYS N . 36483 1 1031 . 1 . 1 96 96 ASP H H 1 7.471 0.030 . 1 . . . . A 96 ASP H . 36483 1 1032 . 1 . 1 96 96 ASP HA H 1 5.247 0.030 . 1 . . . . A 96 ASP HA . 36483 1 1033 . 1 . 1 96 96 ASP HB2 H 1 3.122 0.030 . 2 . . . . A 96 ASP HB2 . 36483 1 1034 . 1 . 1 96 96 ASP HB3 H 1 2.589 0.030 . 2 . . . . A 96 ASP HB3 . 36483 1 1035 . 1 . 1 96 96 ASP C C 13 172.849 0.300 . 1 . . . . A 96 ASP C . 36483 1 1036 . 1 . 1 96 96 ASP CA C 13 49.965 0.300 . 1 . . . . A 96 ASP CA . 36483 1 1037 . 1 . 1 96 96 ASP CB C 13 43.188 0.300 . 1 . . . . A 96 ASP CB . 36483 1 1038 . 1 . 1 96 96 ASP N N 15 120.666 0.300 . 1 . . . . A 96 ASP N . 36483 1 1039 . 1 . 1 97 97 PRO HA H 1 4.229 0.030 . 1 . . . . A 97 PRO HA . 36483 1 1040 . 1 . 1 97 97 PRO HB2 H 1 2.449 0.030 . 2 . . . . A 97 PRO HB2 . 36483 1 1041 . 1 . 1 97 97 PRO HB3 H 1 2.012 0.030 . 2 . . . . A 97 PRO HB3 . 36483 1 1042 . 1 . 1 97 97 PRO HG2 H 1 2.013 0.030 . 2 . . . . A 97 PRO HG2 . 36483 1 1043 . 1 . 1 97 97 PRO HG3 H 1 1.611 0.030 . 2 . . . . A 97 PRO HG3 . 36483 1 1044 . 1 . 1 97 97 PRO HD2 H 1 4.072 0.030 . 1 . . . . A 97 PRO HD2 . 36483 1 1045 . 1 . 1 97 97 PRO HD3 H 1 4.072 0.030 . 1 . . . . A 97 PRO HD3 . 36483 1 1046 . 1 . 1 97 97 PRO C C 13 179.411 0.300 . 1 . . . . A 97 PRO C . 36483 1 1047 . 1 . 1 97 97 PRO CA C 13 65.306 0.300 . 1 . . . . A 97 PRO CA . 36483 1 1048 . 1 . 1 97 97 PRO CB C 13 32.693 0.300 . 1 . . . . A 97 PRO CB . 36483 1 1049 . 1 . 1 97 97 PRO CG C 13 30.165 0.300 . 1 . . . . A 97 PRO CG . 36483 1 1050 . 1 . 1 98 98 ILE H H 1 7.770 0.030 . 1 . . . . A 98 ILE H . 36483 1 1051 . 1 . 1 98 98 ILE HA H 1 3.864 0.030 . 1 . . . . A 98 ILE HA . 36483 1 1052 . 1 . 1 98 98 ILE HB H 1 2.145 0.030 . 1 . . . . A 98 ILE HB . 36483 1 1053 . 1 . 1 98 98 ILE HG12 H 1 1.607 0.030 . 2 . . . . A 98 ILE HG12 . 36483 1 1054 . 1 . 1 98 98 ILE HG13 H 1 1.339 0.030 . 2 . . . . A 98 ILE HG13 . 36483 1 1055 . 1 . 1 98 98 ILE HG21 H 1 0.913 0.030 . 1 . . . . A 98 ILE HG21 . 36483 1 1056 . 1 . 1 98 98 ILE HG22 H 1 0.913 0.030 . 1 . . . . A 98 ILE HG22 . 36483 1 1057 . 1 . 1 98 98 ILE HG23 H 1 0.913 0.030 . 1 . . . . A 98 ILE HG23 . 36483 1 1058 . 1 . 1 98 98 ILE HD11 H 1 0.887 0.030 . 1 . . . . A 98 ILE HD11 . 36483 1 1059 . 1 . 1 98 98 ILE HD12 H 1 0.887 0.030 . 1 . . . . A 98 ILE HD12 . 36483 1 1060 . 1 . 1 98 98 ILE HD13 H 1 0.887 0.030 . 1 . . . . A 98 ILE HD13 . 36483 1 1061 . 1 . 1 98 98 ILE C C 13 178.282 0.300 . 1 . . . . A 98 ILE C . 36483 1 1062 . 1 . 1 98 98 ILE CA C 13 63.667 0.300 . 1 . . . . A 98 ILE CA . 36483 1 1063 . 1 . 1 98 98 ILE CB C 13 36.613 0.300 . 1 . . . . A 98 ILE CB . 36483 1 1064 . 1 . 1 98 98 ILE CG1 C 13 28.586 0.300 . 1 . . . . A 98 ILE CG1 . 36483 1 1065 . 1 . 1 98 98 ILE CG2 C 13 17.109 0.300 . 1 . . . . A 98 ILE CG2 . 36483 1 1066 . 1 . 1 98 98 ILE CD1 C 13 11.340 0.300 . 1 . . . . A 98 ILE CD1 . 36483 1 1067 . 1 . 1 98 98 ILE N N 15 117.923 0.300 . 1 . . . . A 98 ILE N . 36483 1 1068 . 1 . 1 99 99 ALA H H 1 7.449 0.030 . 1 . . . . A 99 ALA H . 36483 1 1069 . 1 . 1 99 99 ALA HA H 1 4.073 0.030 . 1 . . . . A 99 ALA HA . 36483 1 1070 . 1 . 1 99 99 ALA HB1 H 1 1.627 0.030 . 1 . . . . A 99 ALA HB1 . 36483 1 1071 . 1 . 1 99 99 ALA HB2 H 1 1.627 0.030 . 1 . . . . A 99 ALA HB2 . 36483 1 1072 . 1 . 1 99 99 ALA HB3 H 1 1.627 0.030 . 1 . . . . A 99 ALA HB3 . 36483 1 1073 . 1 . 1 99 99 ALA C C 13 181.087 0.300 . 1 . . . . A 99 ALA C . 36483 1 1074 . 1 . 1 99 99 ALA CA C 13 54.764 0.300 . 1 . . . . A 99 ALA CA . 36483 1 1075 . 1 . 1 99 99 ALA CB C 13 18.489 0.300 . 1 . . . . A 99 ALA CB . 36483 1 1076 . 1 . 1 99 99 ALA N N 15 124.794 0.300 . 1 . . . . A 99 ALA N . 36483 1 1077 . 1 . 1 100 100 LYS H H 1 8.993 0.030 . 1 . . . . A 100 LYS H . 36483 1 1078 . 1 . 1 100 100 LYS HA H 1 3.704 0.030 . 1 . . . . A 100 LYS HA . 36483 1 1079 . 1 . 1 100 100 LYS HB2 H 1 2.262 0.030 . 2 . . . . A 100 LYS HB2 . 36483 1 1080 . 1 . 1 100 100 LYS HB3 H 1 1.817 0.030 . 2 . . . . A 100 LYS HB3 . 36483 1 1081 . 1 . 1 100 100 LYS C C 13 178.506 0.300 . 1 . . . . A 100 LYS C . 36483 1 1082 . 1 . 1 100 100 LYS CA C 13 60.454 0.300 . 1 . . . . A 100 LYS CA . 36483 1 1083 . 1 . 1 100 100 LYS CB C 13 32.558 0.300 . 1 . . . . A 100 LYS CB . 36483 1 1084 . 1 . 1 100 100 LYS CG C 13 25.272 0.300 . 1 . . . . A 100 LYS CG . 36483 1 1085 . 1 . 1 100 100 LYS CD C 13 30.100 0.300 . 1 . . . . A 100 LYS CD . 36483 1 1086 . 1 . 1 100 100 LYS CE C 13 41.944 0.300 . 1 . . . . A 100 LYS CE . 36483 1 1087 . 1 . 1 100 100 LYS N N 15 121.171 0.300 . 1 . . . . A 100 LYS N . 36483 1 1088 . 1 . 1 101 101 MET H H 1 7.645 0.030 . 1 . . . . A 101 MET H . 36483 1 1089 . 1 . 1 101 101 MET HA H 1 4.161 0.030 . 1 . . . . A 101 MET HA . 36483 1 1090 . 1 . 1 101 101 MET HB2 H 1 2.317 0.030 . 2 . . . . A 101 MET HB2 . 36483 1 1091 . 1 . 1 101 101 MET HB3 H 1 1.899 0.030 . 2 . . . . A 101 MET HB3 . 36483 1 1092 . 1 . 1 101 101 MET HG2 H 1 2.731 0.030 . 2 . . . . A 101 MET HG2 . 36483 1 1093 . 1 . 1 101 101 MET HG3 H 1 2.621 0.030 . 2 . . . . A 101 MET HG3 . 36483 1 1094 . 1 . 1 101 101 MET C C 13 177.788 0.300 . 1 . . . . A 101 MET C . 36483 1 1095 . 1 . 1 101 101 MET CA C 13 58.749 0.300 . 1 . . . . A 101 MET CA . 36483 1 1096 . 1 . 1 101 101 MET CB C 13 32.241 0.300 . 1 . . . . A 101 MET CB . 36483 1 1097 . 1 . 1 101 101 MET CG C 13 31.829 0.300 . 1 . . . . A 101 MET CG . 36483 1 1098 . 1 . 1 101 101 MET N N 15 117.879 0.300 . 1 . . . . A 101 MET N . 36483 1 1099 . 1 . 1 102 102 ARG H H 1 8.367 0.030 . 1 . . . . A 102 ARG H . 36483 1 1100 . 1 . 1 102 102 ARG HA H 1 3.933 0.030 . 1 . . . . A 102 ARG HA . 36483 1 1101 . 1 . 1 102 102 ARG HB2 H 1 1.887 0.030 . 1 . . . . A 102 ARG HB2 . 36483 1 1102 . 1 . 1 102 102 ARG HB3 H 1 1.887 0.030 . 1 . . . . A 102 ARG HB3 . 36483 1 1103 . 1 . 1 102 102 ARG HG2 H 1 1.656 0.030 . 1 . . . . A 102 ARG HG2 . 36483 1 1104 . 1 . 1 102 102 ARG HG3 H 1 1.656 0.030 . 1 . . . . A 102 ARG HG3 . 36483 1 1105 . 1 . 1 102 102 ARG HD2 H 1 3.169 0.030 . 1 . . . . A 102 ARG HD2 . 36483 1 1106 . 1 . 1 102 102 ARG HD3 H 1 3.169 0.030 . 1 . . . . A 102 ARG HD3 . 36483 1 1107 . 1 . 1 102 102 ARG HE H 1 6.874 0.030 . 1 . . . . A 102 ARG HE . 36483 1 1108 . 1 . 1 102 102 ARG C C 13 179.017 0.300 . 1 . . . . A 102 ARG C . 36483 1 1109 . 1 . 1 102 102 ARG CA C 13 59.660 0.300 . 1 . . . . A 102 ARG CA . 36483 1 1110 . 1 . 1 102 102 ARG CB C 13 30.072 0.300 . 1 . . . . A 102 ARG CB . 36483 1 1111 . 1 . 1 102 102 ARG N N 15 118.903 0.300 . 1 . . . . A 102 ARG N . 36483 1 1112 . 1 . 1 102 102 ARG NE N 15 84.554 0.300 . 1 . . . . A 102 ARG NE . 36483 1 1113 . 1 . 1 103 103 ARG H H 1 7.923 0.030 . 1 . . . . A 103 ARG H . 36483 1 1114 . 1 . 1 103 103 ARG HA H 1 4.173 0.030 . 1 . . . . A 103 ARG HA . 36483 1 1115 . 1 . 1 103 103 ARG HB2 H 1 1.709 0.030 . 1 . . . . A 103 ARG HB2 . 36483 1 1116 . 1 . 1 103 103 ARG HB3 H 1 1.709 0.030 . 1 . . . . A 103 ARG HB3 . 36483 1 1117 . 1 . 1 103 103 ARG HG2 H 1 1.464 0.030 . 1 . . . . A 103 ARG HG2 . 36483 1 1118 . 1 . 1 103 103 ARG HG3 H 1 1.464 0.030 . 1 . . . . A 103 ARG HG3 . 36483 1 1119 . 1 . 1 103 103 ARG HD2 H 1 3.008 0.030 . 1 . . . . A 103 ARG HD2 . 36483 1 1120 . 1 . 1 103 103 ARG HD3 H 1 3.008 0.030 . 1 . . . . A 103 ARG HD3 . 36483 1 1121 . 1 . 1 103 103 ARG HE H 1 6.350 0.030 . 1 . . . . A 103 ARG HE . 36483 1 1122 . 1 . 1 103 103 ARG C C 13 177.167 0.300 . 1 . . . . A 103 ARG C . 36483 1 1123 . 1 . 1 103 103 ARG CA C 13 58.373 0.300 . 1 . . . . A 103 ARG CA . 36483 1 1124 . 1 . 1 103 103 ARG CB C 13 29.272 0.300 . 1 . . . . A 103 ARG CB . 36483 1 1125 . 1 . 1 103 103 ARG CG C 13 24.921 0.300 . 1 . . . . A 103 ARG CG . 36483 1 1126 . 1 . 1 103 103 ARG CD C 13 41.897 0.300 . 1 . . . . A 103 ARG CD . 36483 1 1127 . 1 . 1 103 103 ARG N N 15 119.503 0.300 . 1 . . . . A 103 ARG N . 36483 1 1128 . 1 . 1 103 103 ARG NE N 15 84.363 0.300 . 1 . . . . A 103 ARG NE . 36483 1 1129 . 1 . 1 104 104 LEU H H 1 7.722 0.030 . 1 . . . . A 104 LEU H . 36483 1 1130 . 1 . 1 104 104 LEU HA H 1 4.095 0.030 . 1 . . . . A 104 LEU HA . 36483 1 1131 . 1 . 1 104 104 LEU HB2 H 1 1.986 0.030 . 2 . . . . A 104 LEU HB2 . 36483 1 1132 . 1 . 1 104 104 LEU HB3 H 1 1.570 0.030 . 2 . . . . A 104 LEU HB3 . 36483 1 1133 . 1 . 1 104 104 LEU HG H 1 1.891 0.030 . 1 . . . . A 104 LEU HG . 36483 1 1134 . 1 . 1 104 104 LEU C C 13 180.249 0.300 . 1 . . . . A 104 LEU C . 36483 1 1135 . 1 . 1 104 104 LEU CA C 13 58.356 0.300 . 1 . . . . A 104 LEU CA . 36483 1 1136 . 1 . 1 104 104 LEU CB C 13 41.222 0.300 . 1 . . . . A 104 LEU CB . 36483 1 1137 . 1 . 1 104 104 LEU CD1 C 13 25.769 0.300 . 2 . . . . A 104 LEU CD1 . 36483 1 1138 . 1 . 1 104 104 LEU CD2 C 13 25.769 0.300 . 2 . . . . A 104 LEU CD2 . 36483 1 1139 . 1 . 1 104 104 LEU N N 15 118.682 0.300 . 1 . . . . A 104 LEU N . 36483 1 1140 . 1 . 1 105 105 VAL H H 1 8.277 0.030 . 1 . . . . A 105 VAL H . 36483 1 1141 . 1 . 1 105 105 VAL HA H 1 3.763 0.030 . 1 . . . . A 105 VAL HA . 36483 1 1142 . 1 . 1 105 105 VAL HB H 1 2.159 0.030 . 1 . . . . A 105 VAL HB . 36483 1 1143 . 1 . 1 105 105 VAL HG11 H 1 0.975 0.030 . 2 . . . . A 105 VAL HG11 . 36483 1 1144 . 1 . 1 105 105 VAL HG12 H 1 0.975 0.030 . 2 . . . . A 105 VAL HG12 . 36483 1 1145 . 1 . 1 105 105 VAL HG13 H 1 0.975 0.030 . 2 . . . . A 105 VAL HG13 . 36483 1 1146 . 1 . 1 105 105 VAL HG21 H 1 1.104 0.030 . 2 . . . . A 105 VAL HG21 . 36483 1 1147 . 1 . 1 105 105 VAL HG22 H 1 1.104 0.030 . 2 . . . . A 105 VAL HG22 . 36483 1 1148 . 1 . 1 105 105 VAL HG23 H 1 1.104 0.030 . 2 . . . . A 105 VAL HG23 . 36483 1 1149 . 1 . 1 105 105 VAL C C 13 178.306 0.300 . 1 . . . . A 105 VAL C . 36483 1 1150 . 1 . 1 105 105 VAL CA C 13 66.663 0.300 . 1 . . . . A 105 VAL CA . 36483 1 1151 . 1 . 1 105 105 VAL CB C 13 31.917 0.300 . 1 . . . . A 105 VAL CB . 36483 1 1152 . 1 . 1 105 105 VAL CG1 C 13 21.103 0.300 . 2 . . . . A 105 VAL CG1 . 36483 1 1153 . 1 . 1 105 105 VAL CG2 C 13 23.169 0.300 . 2 . . . . A 105 VAL CG2 . 36483 1 1154 . 1 . 1 105 105 VAL N N 15 120.228 0.300 . 1 . . . . A 105 VAL N . 36483 1 1155 . 1 . 1 106 106 ARG H H 1 7.941 0.030 . 1 . . . . A 106 ARG H . 36483 1 1156 . 1 . 1 106 106 ARG HA H 1 4.100 0.030 . 1 . . . . A 106 ARG HA . 36483 1 1157 . 1 . 1 106 106 ARG HB2 H 1 2.029 0.030 . 1 . . . . A 106 ARG HB2 . 36483 1 1158 . 1 . 1 106 106 ARG HB3 H 1 2.029 0.030 . 1 . . . . A 106 ARG HB3 . 36483 1 1159 . 1 . 1 106 106 ARG C C 13 179.801 0.300 . 1 . . . . A 106 ARG C . 36483 1 1160 . 1 . 1 106 106 ARG CA C 13 60.348 0.300 . 1 . . . . A 106 ARG CA . 36483 1 1161 . 1 . 1 106 106 ARG CB C 13 30.152 0.300 . 1 . . . . A 106 ARG CB . 36483 1 1162 . 1 . 1 106 106 ARG CG C 13 27.834 0.300 . 1 . . . . A 106 ARG CG . 36483 1 1163 . 1 . 1 106 106 ARG CD C 13 43.677 0.300 . 1 . . . . A 106 ARG CD . 36483 1 1164 . 1 . 1 106 106 ARG N N 15 120.924 0.300 . 1 . . . . A 106 ARG N . 36483 1 1165 . 1 . 1 107 107 ILE H H 1 8.573 0.030 . 1 . . . . A 107 ILE H . 36483 1 1166 . 1 . 1 107 107 ILE HA H 1 3.781 0.030 . 1 . . . . A 107 ILE HA . 36483 1 1167 . 1 . 1 107 107 ILE HB H 1 1.947 0.030 . 1 . . . . A 107 ILE HB . 36483 1 1168 . 1 . 1 107 107 ILE HG12 H 1 1.102 0.030 . 2 . . . . A 107 ILE HG12 . 36483 1 1169 . 1 . 1 107 107 ILE HG13 H 1 1.986 0.030 . 2 . . . . A 107 ILE HG13 . 36483 1 1170 . 1 . 1 107 107 ILE HG21 H 1 0.998 0.030 . 1 . . . . A 107 ILE HG21 . 36483 1 1171 . 1 . 1 107 107 ILE HG22 H 1 0.998 0.030 . 1 . . . . A 107 ILE HG22 . 36483 1 1172 . 1 . 1 107 107 ILE HG23 H 1 0.998 0.030 . 1 . . . . A 107 ILE HG23 . 36483 1 1173 . 1 . 1 107 107 ILE HD11 H 1 0.847 0.030 . 1 . . . . A 107 ILE HD11 . 36483 1 1174 . 1 . 1 107 107 ILE HD12 H 1 0.847 0.030 . 1 . . . . A 107 ILE HD12 . 36483 1 1175 . 1 . 1 107 107 ILE HD13 H 1 0.847 0.030 . 1 . . . . A 107 ILE HD13 . 36483 1 1176 . 1 . 1 107 107 ILE C C 13 179.046 0.300 . 1 . . . . A 107 ILE C . 36483 1 1177 . 1 . 1 107 107 ILE CA C 13 66.064 0.300 . 1 . . . . A 107 ILE CA . 36483 1 1178 . 1 . 1 107 107 ILE CB C 13 38.837 0.300 . 1 . . . . A 107 ILE CB . 36483 1 1179 . 1 . 1 107 107 ILE CG1 C 13 29.104 0.300 . 1 . . . . A 107 ILE CG1 . 36483 1 1180 . 1 . 1 107 107 ILE CG2 C 13 17.067 0.300 . 1 . . . . A 107 ILE CG2 . 36483 1 1181 . 1 . 1 107 107 ILE CD1 C 13 14.159 0.300 . 1 . . . . A 107 ILE CD1 . 36483 1 1182 . 1 . 1 107 107 ILE N N 15 119.938 0.300 . 1 . . . . A 107 ILE N . 36483 1 1183 . 1 . 1 108 108 GLU H H 1 8.146 0.030 . 1 . . . . A 108 GLU H . 36483 1 1184 . 1 . 1 108 108 GLU HA H 1 4.192 0.030 . 1 . . . . A 108 GLU HA . 36483 1 1185 . 1 . 1 108 108 GLU HB2 H 1 2.333 0.030 . 2 . . . . A 108 GLU HB2 . 36483 1 1186 . 1 . 1 108 108 GLU HB3 H 1 2.225 0.030 . 2 . . . . A 108 GLU HB3 . 36483 1 1187 . 1 . 1 108 108 GLU C C 13 179.036 0.300 . 1 . . . . A 108 GLU C . 36483 1 1188 . 1 . 1 108 108 GLU CA C 13 59.823 0.300 . 1 . . . . A 108 GLU CA . 36483 1 1189 . 1 . 1 108 108 GLU CB C 13 29.425 0.300 . 1 . . . . A 108 GLU CB . 36483 1 1190 . 1 . 1 108 108 GLU CG C 13 36.632 0.300 . 1 . . . . A 108 GLU CG . 36483 1 1191 . 1 . 1 108 108 GLU N N 15 121.351 0.300 . 1 . . . . A 108 GLU N . 36483 1 1192 . 1 . 1 109 109 GLN H H 1 8.492 0.030 . 1 . . . . A 109 GLN H . 36483 1 1193 . 1 . 1 109 109 GLN HA H 1 4.063 0.030 . 1 . . . . A 109 GLN HA . 36483 1 1194 . 1 . 1 109 109 GLN HB2 H 1 2.139 0.030 . 1 . . . . A 109 GLN HB2 . 36483 1 1195 . 1 . 1 109 109 GLN HB3 H 1 2.139 0.030 . 1 . . . . A 109 GLN HB3 . 36483 1 1196 . 1 . 1 109 109 GLN HG2 H 1 2.648 0.030 . 2 . . . . A 109 GLN HG2 . 36483 1 1197 . 1 . 1 109 109 GLN HG3 H 1 2.483 0.030 . 2 . . . . A 109 GLN HG3 . 36483 1 1198 . 1 . 1 109 109 GLN HE21 H 1 6.870 0.030 . 2 . . . . A 109 GLN HE21 . 36483 1 1199 . 1 . 1 109 109 GLN HE22 H 1 7.531 0.030 . 2 . . . . A 109 GLN HE22 . 36483 1 1200 . 1 . 1 109 109 GLN C C 13 178.807 0.300 . 1 . . . . A 109 GLN C . 36483 1 1201 . 1 . 1 109 109 GLN CA C 13 58.675 0.300 . 1 . . . . A 109 GLN CA . 36483 1 1202 . 1 . 1 109 109 GLN CB C 13 28.364 0.300 . 1 . . . . A 109 GLN CB . 36483 1 1203 . 1 . 1 109 109 GLN CG C 13 34.225 0.300 . 1 . . . . A 109 GLN CG . 36483 1 1204 . 1 . 1 109 109 GLN N N 15 118.369 0.300 . 1 . . . . A 109 GLN N . 36483 1 1205 . 1 . 1 109 109 GLN NE2 N 15 112.045 0.300 . 1 . . . . A 109 GLN NE2 . 36483 1 1206 . 1 . 1 110 110 ARG H H 1 8.136 0.030 . 1 . . . . A 110 ARG H . 36483 1 1207 . 1 . 1 110 110 ARG HA H 1 4.075 0.030 . 1 . . . . A 110 ARG HA . 36483 1 1208 . 1 . 1 110 110 ARG HB2 H 1 2.022 0.030 . 2 . . . . A 110 ARG HB2 . 36483 1 1209 . 1 . 1 110 110 ARG HB3 H 1 1.941 0.030 . 2 . . . . A 110 ARG HB3 . 36483 1 1210 . 1 . 1 110 110 ARG C C 13 178.146 0.300 . 1 . . . . A 110 ARG C . 36483 1 1211 . 1 . 1 110 110 ARG CA C 13 58.929 0.300 . 1 . . . . A 110 ARG CA . 36483 1 1212 . 1 . 1 110 110 ARG CB C 13 30.108 0.300 . 1 . . . . A 110 ARG CB . 36483 1 1213 . 1 . 1 110 110 ARG N N 15 119.577 0.300 . 1 . . . . A 110 ARG N . 36483 1 1214 . 1 . 1 111 111 GLN H H 1 8.054 0.030 . 1 . . . . A 111 GLN H . 36483 1 1215 . 1 . 1 111 111 GLN HA H 1 4.112 0.030 . 1 . . . . A 111 GLN HA . 36483 1 1216 . 1 . 1 111 111 GLN HB2 H 1 2.261 0.030 . 1 . . . . A 111 GLN HB2 . 36483 1 1217 . 1 . 1 111 111 GLN HB3 H 1 2.261 0.030 . 1 . . . . A 111 GLN HB3 . 36483 1 1218 . 1 . 1 111 111 GLN HG2 H 1 2.564 0.030 . 2 . . . . A 111 GLN HG2 . 36483 1 1219 . 1 . 1 111 111 GLN HG3 H 1 2.453 0.030 . 2 . . . . A 111 GLN HG3 . 36483 1 1220 . 1 . 1 111 111 GLN HE21 H 1 6.981 0.030 . 2 . . . . A 111 GLN HE21 . 36483 1 1221 . 1 . 1 111 111 GLN HE22 H 1 7.729 0.030 . 2 . . . . A 111 GLN HE22 . 36483 1 1222 . 1 . 1 111 111 GLN C C 13 177.740 0.300 . 1 . . . . A 111 GLN C . 36483 1 1223 . 1 . 1 111 111 GLN CA C 13 57.798 0.300 . 1 . . . . A 111 GLN CA . 36483 1 1224 . 1 . 1 111 111 GLN CB C 13 28.284 0.300 . 1 . . . . A 111 GLN CB . 36483 1 1225 . 1 . 1 111 111 GLN CG C 13 33.859 0.300 . 1 . . . . A 111 GLN CG . 36483 1 1226 . 1 . 1 111 111 GLN N N 15 118.799 0.300 . 1 . . . . A 111 GLN N . 36483 1 1227 . 1 . 1 111 111 GLN NE2 N 15 112.918 0.300 . 1 . . . . A 111 GLN NE2 . 36483 1 1228 . 1 . 1 112 112 LYS H H 1 8.080 0.030 . 1 . . . . A 112 LYS H . 36483 1 1229 . 1 . 1 112 112 LYS HA H 1 4.174 0.030 . 1 . . . . A 112 LYS HA . 36483 1 1230 . 1 . 1 112 112 LYS HB2 H 1 1.893 0.030 . 1 . . . . A 112 LYS HB2 . 36483 1 1231 . 1 . 1 112 112 LYS HB3 H 1 1.893 0.030 . 1 . . . . A 112 LYS HB3 . 36483 1 1232 . 1 . 1 112 112 LYS C C 13 178.271 0.300 . 1 . . . . A 112 LYS C . 36483 1 1233 . 1 . 1 112 112 LYS CA C 13 58.255 0.300 . 1 . . . . A 112 LYS CA . 36483 1 1234 . 1 . 1 112 112 LYS CB C 13 32.329 0.300 . 1 . . . . A 112 LYS CB . 36483 1 1235 . 1 . 1 112 112 LYS CG C 13 25.045 0.300 . 1 . . . . A 112 LYS CG . 36483 1 1236 . 1 . 1 112 112 LYS N N 15 119.446 0.300 . 1 . . . . A 112 LYS N . 36483 1 1237 . 1 . 1 113 113 ARG H H 1 7.914 0.030 . 1 . . . . A 113 ARG H . 36483 1 1238 . 1 . 1 113 113 ARG HA H 1 4.228 0.030 . 1 . . . . A 113 ARG HA . 36483 1 1239 . 1 . 1 113 113 ARG HB2 H 1 1.899 0.030 . 1 . . . . A 113 ARG HB2 . 36483 1 1240 . 1 . 1 113 113 ARG HB3 H 1 1.899 0.030 . 1 . . . . A 113 ARG HB3 . 36483 1 1241 . 1 . 1 113 113 ARG HG2 H 1 1.732 0.030 . 1 . . . . A 113 ARG HG2 . 36483 1 1242 . 1 . 1 113 113 ARG HG3 H 1 1.732 0.030 . 1 . . . . A 113 ARG HG3 . 36483 1 1243 . 1 . 1 113 113 ARG C C 13 177.670 0.300 . 1 . . . . A 113 ARG C . 36483 1 1244 . 1 . 1 113 113 ARG CA C 13 57.831 0.300 . 1 . . . . A 113 ARG CA . 36483 1 1245 . 1 . 1 113 113 ARG CB C 13 30.288 0.300 . 1 . . . . A 113 ARG CB . 36483 1 1246 . 1 . 1 113 113 ARG CG C 13 27.178 0.300 . 1 . . . . A 113 ARG CG . 36483 1 1247 . 1 . 1 113 113 ARG CD C 13 43.399 0.300 . 1 . . . . A 113 ARG CD . 36483 1 1248 . 1 . 1 113 113 ARG N N 15 119.584 0.300 . 1 . . . . A 113 ARG N . 36483 1 1249 . 1 . 1 114 114 LEU H H 1 8.037 0.030 . 1 . . . . A 114 LEU H . 36483 1 1250 . 1 . 1 114 114 LEU HA H 1 4.289 0.030 . 1 . . . . A 114 LEU HA . 36483 1 1251 . 1 . 1 114 114 LEU HB2 H 1 1.785 0.030 . 2 . . . . A 114 LEU HB2 . 36483 1 1252 . 1 . 1 114 114 LEU HB3 H 1 1.626 0.030 . 2 . . . . A 114 LEU HB3 . 36483 1 1253 . 1 . 1 114 114 LEU C C 13 178.147 0.300 . 1 . . . . A 114 LEU C . 36483 1 1254 . 1 . 1 114 114 LEU CA C 13 56.180 0.300 . 1 . . . . A 114 LEU CA . 36483 1 1255 . 1 . 1 114 114 LEU CB C 13 42.201 0.300 . 1 . . . . A 114 LEU CB . 36483 1 1256 . 1 . 1 114 114 LEU N N 15 120.917 0.300 . 1 . . . . A 114 LEU N . 36483 1 1257 . 1 . 1 115 115 GLU H H 1 8.147 0.030 . 1 . . . . A 115 GLU H . 36483 1 1258 . 1 . 1 115 115 GLU HA H 1 4.283 0.030 . 1 . . . . A 115 GLU HA . 36483 1 1259 . 1 . 1 115 115 GLU HB2 H 1 2.078 0.030 . 1 . . . . A 115 GLU HB2 . 36483 1 1260 . 1 . 1 115 115 GLU HB3 H 1 2.078 0.030 . 1 . . . . A 115 GLU HB3 . 36483 1 1261 . 1 . 1 115 115 GLU HG2 H 1 2.454 0.030 . 2 . . . . A 115 GLU HG2 . 36483 1 1262 . 1 . 1 115 115 GLU HG3 H 1 2.308 0.030 . 2 . . . . A 115 GLU HG3 . 36483 1 1263 . 1 . 1 115 115 GLU C C 13 177.245 0.300 . 1 . . . . A 115 GLU C . 36483 1 1264 . 1 . 1 115 115 GLU CA C 13 57.066 0.300 . 1 . . . . A 115 GLU CA . 36483 1 1265 . 1 . 1 115 115 GLU CB C 13 30.279 0.300 . 1 . . . . A 115 GLU CB . 36483 1 1266 . 1 . 1 115 115 GLU CG C 13 36.300 0.300 . 1 . . . . A 115 GLU CG . 36483 1 1267 . 1 . 1 115 115 GLU N N 15 119.547 0.300 . 1 . . . . A 115 GLU N . 36483 1 1268 . 1 . 1 116 116 GLY H H 1 8.228 0.030 . 1 . . . . A 116 GLY H . 36483 1 1269 . 1 . 1 116 116 GLY HA2 H 1 4.034 0.030 . 2 . . . . A 116 GLY HA2 . 36483 1 1270 . 1 . 1 116 116 GLY HA3 H 1 3.977 0.030 . 2 . . . . A 116 GLY HA3 . 36483 1 1271 . 1 . 1 116 116 GLY C C 13 174.166 0.300 . 1 . . . . A 116 GLY C . 36483 1 1272 . 1 . 1 116 116 GLY CA C 13 45.621 0.300 . 1 . . . . A 116 GLY CA . 36483 1 1273 . 1 . 1 116 116 GLY N N 15 108.843 0.300 . 1 . . . . A 116 GLY N . 36483 1 1274 . 1 . 1 117 117 ASN H H 1 8.303 0.030 . 1 . . . . A 117 ASN H . 36483 1 1275 . 1 . 1 117 117 ASN HA H 1 4.737 0.030 . 1 . . . . A 117 ASN HA . 36483 1 1276 . 1 . 1 117 117 ASN HB2 H 1 2.800 0.030 . 2 . . . . A 117 ASN HB2 . 36483 1 1277 . 1 . 1 117 117 ASN HB3 H 1 2.765 0.030 . 2 . . . . A 117 ASN HB3 . 36483 1 1278 . 1 . 1 117 117 ASN C C 13 175.475 0.300 . 1 . . . . A 117 ASN C . 36483 1 1279 . 1 . 1 117 117 ASN CA C 13 53.324 0.300 . 1 . . . . A 117 ASN CA . 36483 1 1280 . 1 . 1 117 117 ASN CB C 13 39.193 0.300 . 1 . . . . A 117 ASN CB . 36483 1 1281 . 1 . 1 117 117 ASN N N 15 118.629 0.300 . 1 . . . . A 117 ASN N . 36483 1 1282 . 1 . 1 117 117 ASN ND2 N 15 112.958 0.300 . 1 . . . . A 117 ASN ND2 . 36483 1 1283 . 1 . 1 118 118 GLU H H 1 8.577 0.030 . 1 . . . . A 118 GLU H . 36483 1 1284 . 1 . 1 118 118 GLU HA H 1 4.143 0.030 . 1 . . . . A 118 GLU HA . 36483 1 1285 . 1 . 1 118 118 GLU HB2 H 1 1.879 0.030 . 1 . . . . A 118 GLU HB2 . 36483 1 1286 . 1 . 1 118 118 GLU HB3 H 1 1.879 0.030 . 1 . . . . A 118 GLU HB3 . 36483 1 1287 . 1 . 1 118 118 GLU C C 13 176.315 0.300 . 1 . . . . A 118 GLU C . 36483 1 1288 . 1 . 1 118 118 GLU CA C 13 57.481 0.300 . 1 . . . . A 118 GLU CA . 36483 1 1289 . 1 . 1 118 118 GLU CB C 13 29.987 0.300 . 1 . . . . A 118 GLU CB . 36483 1 1290 . 1 . 1 118 118 GLU CG C 13 36.156 0.300 . 1 . . . . A 118 GLU CG . 36483 1 1291 . 1 . 1 118 118 GLU N N 15 120.931 0.300 . 1 . . . . A 118 GLU N . 36483 1 1292 . 1 . 1 119 119 PHE H H 1 8.123 0.030 . 1 . . . . A 119 PHE H . 36483 1 1293 . 1 . 1 119 119 PHE HA H 1 4.629 0.030 . 1 . . . . A 119 PHE HA . 36483 1 1294 . 1 . 1 119 119 PHE HB2 H 1 3.199 0.030 . 2 . . . . A 119 PHE HB2 . 36483 1 1295 . 1 . 1 119 119 PHE HB3 H 1 3.022 0.030 . 2 . . . . A 119 PHE HB3 . 36483 1 1296 . 1 . 1 119 119 PHE HD1 H 1 7.238 0.030 . 1 . . . . A 119 PHE HD1 . 36483 1 1297 . 1 . 1 119 119 PHE HD2 H 1 7.238 0.030 . 1 . . . . A 119 PHE HD2 . 36483 1 1298 . 1 . 1 119 119 PHE C C 13 175.826 0.300 . 1 . . . . A 119 PHE C . 36483 1 1299 . 1 . 1 119 119 PHE CA C 13 57.740 0.300 . 1 . . . . A 119 PHE CA . 36483 1 1300 . 1 . 1 119 119 PHE CB C 13 39.552 0.300 . 1 . . . . A 119 PHE CB . 36483 1 1301 . 1 . 1 119 119 PHE CD1 C 13 132.241 0.300 . 1 . . . . A 119 PHE CD1 . 36483 1 1302 . 1 . 1 119 119 PHE CD2 C 13 132.241 0.300 . 1 . . . . A 119 PHE CD2 . 36483 1 1303 . 1 . 1 119 119 PHE N N 15 119.444 0.300 . 1 . . . . A 119 PHE N . 36483 1 1304 . 1 . 1 120 120 GLU H H 1 8.225 0.030 . 1 . . . . A 120 GLU H . 36483 1 1305 . 1 . 1 120 120 GLU HA H 1 4.266 0.030 . 1 . . . . A 120 GLU HA . 36483 1 1306 . 1 . 1 120 120 GLU HB2 H 1 2.027 0.030 . 2 . . . . A 120 GLU HB2 . 36483 1 1307 . 1 . 1 120 120 GLU HB3 H 1 1.925 0.030 . 2 . . . . A 120 GLU HB3 . 36483 1 1308 . 1 . 1 120 120 GLU C C 13 176.577 0.300 . 1 . . . . A 120 GLU C . 36483 1 1309 . 1 . 1 120 120 GLU CA C 13 56.592 0.300 . 1 . . . . A 120 GLU CA . 36483 1 1310 . 1 . 1 120 120 GLU CB C 13 30.291 0.300 . 1 . . . . A 120 GLU CB . 36483 1 1311 . 1 . 1 120 120 GLU N N 15 121.899 0.300 . 1 . . . . A 120 GLU N . 36483 1 1312 . 1 . 1 121 121 ARG H H 1 8.282 0.030 . 1 . . . . A 121 ARG H . 36483 1 1313 . 1 . 1 121 121 ARG HA H 1 4.323 0.030 . 1 . . . . A 121 ARG HA . 36483 1 1314 . 1 . 1 121 121 ARG HB2 H 1 1.873 0.030 . 2 . . . . A 121 ARG HB2 . 36483 1 1315 . 1 . 1 121 121 ARG HB3 H 1 1.775 0.030 . 2 . . . . A 121 ARG HB3 . 36483 1 1316 . 1 . 1 121 121 ARG C C 13 176.197 0.300 . 1 . . . . A 121 ARG C . 36483 1 1317 . 1 . 1 121 121 ARG CA C 13 56.348 0.300 . 1 . . . . A 121 ARG CA . 36483 1 1318 . 1 . 1 121 121 ARG CB C 13 31.117 0.300 . 1 . . . . A 121 ARG CB . 36483 1 1319 . 1 . 1 121 121 ARG CD C 13 43.467 0.300 . 1 . . . . A 121 ARG CD . 36483 1 1320 . 1 . 1 121 121 ARG N N 15 121.958 0.300 . 1 . . . . A 121 ARG N . 36483 1 1321 . 1 . 1 122 122 ASP H H 1 8.460 0.030 . 1 . . . . A 122 ASP H . 36483 1 1322 . 1 . 1 122 122 ASP HA H 1 4.624 0.030 . 1 . . . . A 122 ASP HA . 36483 1 1323 . 1 . 1 122 122 ASP HB2 H 1 2.732 0.030 . 2 . . . . A 122 ASP HB2 . 36483 1 1324 . 1 . 1 122 122 ASP HB3 H 1 2.664 0.030 . 2 . . . . A 122 ASP HB3 . 36483 1 1325 . 1 . 1 122 122 ASP C C 13 176.241 0.300 . 1 . . . . A 122 ASP C . 36483 1 1326 . 1 . 1 122 122 ASP CA C 13 54.639 0.300 . 1 . . . . A 122 ASP CA . 36483 1 1327 . 1 . 1 122 122 ASP CB C 13 41.187 0.300 . 1 . . . . A 122 ASP CB . 36483 1 1328 . 1 . 1 122 122 ASP N N 15 121.323 0.300 . 1 . . . . A 122 ASP N . 36483 1 1329 . 1 . 1 123 123 SER H H 1 8.178 0.030 . 1 . . . . A 123 SER H . 36483 1 1330 . 1 . 1 123 123 SER HA H 1 4.441 0.030 . 1 . . . . A 123 SER HA . 36483 1 1331 . 1 . 1 123 123 SER HB2 H 1 3.853 0.030 . 1 . . . . A 123 SER HB2 . 36483 1 1332 . 1 . 1 123 123 SER HB3 H 1 3.853 0.030 . 1 . . . . A 123 SER HB3 . 36483 1 1333 . 1 . 1 123 123 SER C C 13 174.195 0.300 . 1 . . . . A 123 SER C . 36483 1 1334 . 1 . 1 123 123 SER CA C 13 58.277 0.300 . 1 . . . . A 123 SER CA . 36483 1 1335 . 1 . 1 123 123 SER CB C 13 64.101 0.300 . 1 . . . . A 123 SER CB . 36483 1 1336 . 1 . 1 123 123 SER N N 15 115.467 0.300 . 1 . . . . A 123 SER N . 36483 1 1337 . 1 . 1 124 124 GLU H H 1 8.361 0.030 . 1 . . . . A 124 GLU H . 36483 1 1338 . 1 . 1 124 124 GLU HA H 1 4.562 0.030 . 1 . . . . A 124 GLU HA . 36483 1 1339 . 1 . 1 124 124 GLU HB2 H 1 2.004 0.030 . 2 . . . . A 124 GLU HB2 . 36483 1 1340 . 1 . 1 124 124 GLU HB3 H 1 1.882 0.030 . 2 . . . . A 124 GLU HB3 . 36483 1 1341 . 1 . 1 124 124 GLU C C 13 174.763 0.300 . 1 . . . . A 124 GLU C . 36483 1 1342 . 1 . 1 124 124 GLU CA C 13 54.472 0.300 . 1 . . . . A 124 GLU CA . 36483 1 1343 . 1 . 1 124 124 GLU CB C 13 29.986 0.300 . 1 . . . . A 124 GLU CB . 36483 1 1344 . 1 . 1 124 124 GLU CG C 13 36.132 0.300 . 1 . . . . A 124 GLU CG . 36483 1 1345 . 1 . 1 124 124 GLU N N 15 123.655 0.300 . 1 . . . . A 124 GLU N . 36483 1 1346 . 1 . 1 125 125 PRO HA H 1 4.378 0.030 . 1 . . . . A 125 PRO HA . 36483 1 1347 . 1 . 1 125 125 PRO HB2 H 1 2.166 0.030 . 2 . . . . A 125 PRO HB2 . 36483 1 1348 . 1 . 1 125 125 PRO HB3 H 1 1.897 0.030 . 2 . . . . A 125 PRO HB3 . 36483 1 1349 . 1 . 1 125 125 PRO C C 13 175.753 0.300 . 1 . . . . A 125 PRO C . 36483 1 1350 . 1 . 1 125 125 PRO CA C 13 63.464 0.300 . 1 . . . . A 125 PRO CA . 36483 1 1351 . 1 . 1 125 125 PRO CB C 13 31.881 0.300 . 1 . . . . A 125 PRO CB . 36483 1 1352 . 1 . 1 125 125 PRO CG C 13 26.845 0.300 . 1 . . . . A 125 PRO CG . 36483 1 1353 . 1 . 1 125 125 PRO CD C 13 50.499 0.300 . 1 . . . . A 125 PRO CD . 36483 1 1354 . 1 . 1 126 126 PHE H H 1 7.620 0.030 . 1 . . . . A 126 PHE H . 36483 1 1355 . 1 . 1 126 126 PHE HA H 1 4.414 0.030 . 1 . . . . A 126 PHE HA . 36483 1 1356 . 1 . 1 126 126 PHE HB2 H 1 3.109 0.030 . 2 . . . . A 126 PHE HB2 . 36483 1 1357 . 1 . 1 126 126 PHE HB3 H 1 3.024 0.030 . 2 . . . . A 126 PHE HB3 . 36483 1 1358 . 1 . 1 126 126 PHE C C 13 180.274 0.300 . 1 . . . . A 126 PHE C . 36483 1 1359 . 1 . 1 126 126 PHE CA C 13 58.990 0.300 . 1 . . . . A 126 PHE CA . 36483 1 1360 . 1 . 1 126 126 PHE CB C 13 40.198 0.300 . 1 . . . . A 126 PHE CB . 36483 1 1361 . 1 . 1 126 126 PHE N N 15 124.410 0.300 . 1 . . . . A 126 PHE N . 36483 1 stop_ save_