data_4840 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4840 _Entry.Title ; 1H, 13C and 15N resonance assignment and secondary structure of Mycobacterium tuberculosis adenylate kinase ; _Entry.Type . _Entry.Version_type original _Entry.Submission_date 2000-09-26 _Entry.Accession_date 2000-09-26 _Entry.Last_release_date 2001-02-14 _Entry.Original_release_date 2001-02-14 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Simona Miron . . . 4840 2 Helene Munier-Lehmann . . . 4840 3 Constantin Craescu . T. . 4840 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4840 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 848 4840 '13C chemical shifts' 333 4840 '15N chemical shifts' 178 4840 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 . . 2001-02-14 2000-09-26 original author . 4840 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4840 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Letter to the Editor: 1H, 13C and 15N resonance assignment and secondary structure of Mycobacterium tuberculosis adenylate kinase ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 19 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 89 _Citation.Page_last 90 _Citation.Year 2001 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Simona Miron . . . 4840 1 2 Helene Munier-Lehmann . . . 4840 1 3 Constantin Craescu . T. . 4840 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'nuclear magnetic resonance' 4840 1 protein 4840 1 'resonance assignment' 4840 1 'Adenylate kinase' 4840 1 'NMP kinase' 4840 1 'Mycobacterium tuberculosis' 4840 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_AK _Assembly.Sf_category assembly _Assembly.Sf_framecode system_AK _Assembly.Entry_ID 4840 _Assembly.ID 1 _Assembly.Name 'Adenylate kinase' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4840 1 stop_ 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 AK 1 $AK . . . native . . . . . 4840 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . SWISS-PROT 053796 . . . . . . 4840 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'Adenylate kinase' system 4840 1 AK abbreviation 4840 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_AK _Entity.Sf_category entity _Entity.Sf_framecode AK _Entity.Entry_ID 4840 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Adenylate kinase from M. tuberculosis' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MRVLLLGPPGAGKGTQAVKL AEKLGIPQISTGELFRRNIE EGTKLGVEAKRYLDAGDLVP SDLTNELVDDRLNNPDAANG FILDGYPRSVEQAKALHEML ERRGTDIDAVLEFRVSEEVL LERLKGRGRADDTDDVILNR MKVYRDETAPLLEYYRDQLK TVDAVGTMDEVFARALRALG K ; _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 . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 181 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-29 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1P4S . "Solution Structure Of Mycobacterium Tuberculosis Adenylate Kinase" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 2 no PDB 2CDN . "Crystal Structure Of Mycobacterium Tuberculosis Adenylate Kinase Complexed With Two Molecules Of Adp And Mg" . . . . . 100.00 201 100.00 100.00 8.84e-124 . . . . 4840 1 3 no DBJ BAH25046 . "adenylate kinase [Mycobacterium bovis BCG str. Tokyo 172]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 4 no DBJ BAL64618 . "adenylate kinase [Mycobacterium tuberculosis str. Erdman = ATCC 35801]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 5 no DBJ BAQ04633 . "adenylate kinase [Mycobacterium tuberculosis str. Kurono]" . . . . . 90.61 164 99.39 100.00 9.65e-110 . . . . 4840 1 6 no DBJ GAA44509 . "adenylate kinase [Mycobacterium tuberculosis NCGM2209]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 7 no EMBL CAD93616 . "PROBABLE ADENYLATE KINASE ADK (ATP-AMP TRANSPHOSPHORYLASE) [Mycobacterium bovis AF2122/97]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 8 no EMBL CAL70769 . "Probable adenylate kinase adk [Mycobacterium bovis BCG str. Pasteur 1173P2]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 9 no EMBL CCC25815 . "putative adenylate kinase ADK (ATP-AMP transphosphorylase) [Mycobacterium africanum GM041182]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 10 no EMBL CCC43078 . "putative adenylate kinase ADK (ATP-AMP transphosphorylase) [Mycobacterium canettii CIPT 140010059]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 11 no EMBL CCC63341 . "probable adenylate kinase adk [Mycobacterium bovis BCG str. Moreau RDJ]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 12 no GB AAD09879 . "adenylate kinase [Mycobacterium bovis]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 13 no GB AAK44991 . "adenylate kinase [Mycobacterium tuberculosis CDC1551]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 14 no GB ABQ72469 . "adenylate kinase [Mycobacterium tuberculosis H37Ra]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 15 no GB ABR05090 . "adenylate kinase adk (ATP-AMP transphosphorylase) [Mycobacterium tuberculosis F11]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 16 no GB ACT23783 . "adenylate kinase adk [Mycobacterium tuberculosis KZN 1435]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 17 no REF NP_215247 . "adenylate kinase [Mycobacterium tuberculosis H37Rv]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 18 no REF NP_335177 . "adenylate kinase [Mycobacterium tuberculosis CDC1551]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 19 no REF NP_854412 . "adenylate kinase [Mycobacterium bovis AF2122/97]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 20 no REF WP_003403726 . "MULTISPECIES: adenylate kinase [Mycobacterium tuberculosis complex]" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 21 no REF WP_003911271 . "adenylate kinase [Mycobacterium tuberculosis]" . . . . . 98.34 178 99.44 100.00 7.92e-121 . . . . 4840 1 22 no SP A1KGL4 . "RecName: Full=Adenylate kinase; Short=AK; AltName: Full=ATP-AMP transphosphorylase; AltName: Full=ATP:AMP phosphotransferase; A" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 23 no SP A5U0B9 . "RecName: Full=Adenylate kinase; Short=AK; AltName: Full=ATP-AMP transphosphorylase; AltName: Full=ATP:AMP phosphotransferase; A" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 24 no SP C1AL67 . "RecName: Full=Adenylate kinase; Short=AK; AltName: Full=ATP-AMP transphosphorylase; AltName: Full=ATP:AMP phosphotransferase; A" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 25 no SP P69439 . "RecName: Full=Adenylate kinase; Short=AK; AltName: Full=ATP-AMP transphosphorylase; AltName: Full=ATP:AMP phosphotransferase; A" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 26 no SP P9WKF4 . "RecName: Full=Adenylate kinase; Short=AK; AltName: Full=ATP-AMP transphosphorylase; AltName: Full=ATP:AMP phosphotransferase; A" . . . . . 100.00 181 100.00 100.00 3.23e-123 . . . . 4840 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Adenylate kinase from M. tuberculosis' common 4840 1 AKmt abbreviation 4840 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 . MET . 4840 1 2 . ARG . 4840 1 3 . VAL . 4840 1 4 . LEU . 4840 1 5 . LEU . 4840 1 6 . LEU . 4840 1 7 . GLY . 4840 1 8 . PRO . 4840 1 9 . PRO . 4840 1 10 . GLY . 4840 1 11 . ALA . 4840 1 12 . GLY . 4840 1 13 . LYS . 4840 1 14 . GLY . 4840 1 15 . THR . 4840 1 16 . GLN . 4840 1 17 . ALA . 4840 1 18 . VAL . 4840 1 19 . LYS . 4840 1 20 . LEU . 4840 1 21 . ALA . 4840 1 22 . GLU . 4840 1 23 . LYS . 4840 1 24 . LEU . 4840 1 25 . GLY . 4840 1 26 . ILE . 4840 1 27 . PRO . 4840 1 28 . GLN . 4840 1 29 . ILE . 4840 1 30 . SER . 4840 1 31 . THR . 4840 1 32 . GLY . 4840 1 33 . GLU . 4840 1 34 . LEU . 4840 1 35 . PHE . 4840 1 36 . ARG . 4840 1 37 . ARG . 4840 1 38 . ASN . 4840 1 39 . ILE . 4840 1 40 . GLU . 4840 1 41 . GLU . 4840 1 42 . GLY . 4840 1 43 . THR . 4840 1 44 . LYS . 4840 1 45 . LEU . 4840 1 46 . GLY . 4840 1 47 . VAL . 4840 1 48 . GLU . 4840 1 49 . ALA . 4840 1 50 . LYS . 4840 1 51 . ARG . 4840 1 52 . TYR . 4840 1 53 . LEU . 4840 1 54 . ASP . 4840 1 55 . ALA . 4840 1 56 . GLY . 4840 1 57 . ASP . 4840 1 58 . LEU . 4840 1 59 . VAL . 4840 1 60 . PRO . 4840 1 61 . SER . 4840 1 62 . ASP . 4840 1 63 . LEU . 4840 1 64 . THR . 4840 1 65 . ASN . 4840 1 66 . GLU . 4840 1 67 . LEU . 4840 1 68 . VAL . 4840 1 69 . ASP . 4840 1 70 . ASP . 4840 1 71 . ARG . 4840 1 72 . LEU . 4840 1 73 . ASN . 4840 1 74 . ASN . 4840 1 75 . PRO . 4840 1 76 . ASP . 4840 1 77 . ALA . 4840 1 78 . ALA . 4840 1 79 . ASN . 4840 1 80 . GLY . 4840 1 81 . PHE . 4840 1 82 . ILE . 4840 1 83 . LEU . 4840 1 84 . ASP . 4840 1 85 . GLY . 4840 1 86 . TYR . 4840 1 87 . PRO . 4840 1 88 . ARG . 4840 1 89 . SER . 4840 1 90 . VAL . 4840 1 91 . GLU . 4840 1 92 . GLN . 4840 1 93 . ALA . 4840 1 94 . LYS . 4840 1 95 . ALA . 4840 1 96 . LEU . 4840 1 97 . HIS . 4840 1 98 . GLU . 4840 1 99 . MET . 4840 1 100 . LEU . 4840 1 101 . GLU . 4840 1 102 . ARG . 4840 1 103 . ARG . 4840 1 104 . GLY . 4840 1 105 . THR . 4840 1 106 . ASP . 4840 1 107 . ILE . 4840 1 108 . ASP . 4840 1 109 . ALA . 4840 1 110 . VAL . 4840 1 111 . LEU . 4840 1 112 . GLU . 4840 1 113 . PHE . 4840 1 114 . ARG . 4840 1 115 . VAL . 4840 1 116 . SER . 4840 1 117 . GLU . 4840 1 118 . GLU . 4840 1 119 . VAL . 4840 1 120 . LEU . 4840 1 121 . LEU . 4840 1 122 . GLU . 4840 1 123 . ARG . 4840 1 124 . LEU . 4840 1 125 . LYS . 4840 1 126 . GLY . 4840 1 127 . ARG . 4840 1 128 . GLY . 4840 1 129 . ARG . 4840 1 130 . ALA . 4840 1 131 . ASP . 4840 1 132 . ASP . 4840 1 133 . THR . 4840 1 134 . ASP . 4840 1 135 . ASP . 4840 1 136 . VAL . 4840 1 137 . ILE . 4840 1 138 . LEU . 4840 1 139 . ASN . 4840 1 140 . ARG . 4840 1 141 . MET . 4840 1 142 . LYS . 4840 1 143 . VAL . 4840 1 144 . TYR . 4840 1 145 . ARG . 4840 1 146 . ASP . 4840 1 147 . GLU . 4840 1 148 . THR . 4840 1 149 . ALA . 4840 1 150 . PRO . 4840 1 151 . LEU . 4840 1 152 . LEU . 4840 1 153 . GLU . 4840 1 154 . TYR . 4840 1 155 . TYR . 4840 1 156 . ARG . 4840 1 157 . ASP . 4840 1 158 . GLN . 4840 1 159 . LEU . 4840 1 160 . LYS . 4840 1 161 . THR . 4840 1 162 . VAL . 4840 1 163 . ASP . 4840 1 164 . ALA . 4840 1 165 . VAL . 4840 1 166 . GLY . 4840 1 167 . THR . 4840 1 168 . MET . 4840 1 169 . ASP . 4840 1 170 . GLU . 4840 1 171 . VAL . 4840 1 172 . PHE . 4840 1 173 . ALA . 4840 1 174 . ARG . 4840 1 175 . ALA . 4840 1 176 . LEU . 4840 1 177 . ARG . 4840 1 178 . ALA . 4840 1 179 . LEU . 4840 1 180 . GLY . 4840 1 181 . LYS . 4840 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 4840 1 . ARG 2 2 4840 1 . VAL 3 3 4840 1 . LEU 4 4 4840 1 . LEU 5 5 4840 1 . LEU 6 6 4840 1 . GLY 7 7 4840 1 . PRO 8 8 4840 1 . PRO 9 9 4840 1 . GLY 10 10 4840 1 . ALA 11 11 4840 1 . GLY 12 12 4840 1 . LYS 13 13 4840 1 . GLY 14 14 4840 1 . THR 15 15 4840 1 . GLN 16 16 4840 1 . ALA 17 17 4840 1 . VAL 18 18 4840 1 . LYS 19 19 4840 1 . LEU 20 20 4840 1 . ALA 21 21 4840 1 . GLU 22 22 4840 1 . LYS 23 23 4840 1 . LEU 24 24 4840 1 . GLY 25 25 4840 1 . ILE 26 26 4840 1 . PRO 27 27 4840 1 . GLN 28 28 4840 1 . ILE 29 29 4840 1 . SER 30 30 4840 1 . THR 31 31 4840 1 . GLY 32 32 4840 1 . GLU 33 33 4840 1 . LEU 34 34 4840 1 . PHE 35 35 4840 1 . ARG 36 36 4840 1 . ARG 37 37 4840 1 . ASN 38 38 4840 1 . ILE 39 39 4840 1 . GLU 40 40 4840 1 . GLU 41 41 4840 1 . GLY 42 42 4840 1 . THR 43 43 4840 1 . LYS 44 44 4840 1 . LEU 45 45 4840 1 . GLY 46 46 4840 1 . VAL 47 47 4840 1 . GLU 48 48 4840 1 . ALA 49 49 4840 1 . LYS 50 50 4840 1 . ARG 51 51 4840 1 . TYR 52 52 4840 1 . LEU 53 53 4840 1 . ASP 54 54 4840 1 . ALA 55 55 4840 1 . GLY 56 56 4840 1 . ASP 57 57 4840 1 . LEU 58 58 4840 1 . VAL 59 59 4840 1 . PRO 60 60 4840 1 . SER 61 61 4840 1 . ASP 62 62 4840 1 . LEU 63 63 4840 1 . THR 64 64 4840 1 . ASN 65 65 4840 1 . GLU 66 66 4840 1 . LEU 67 67 4840 1 . VAL 68 68 4840 1 . ASP 69 69 4840 1 . ASP 70 70 4840 1 . ARG 71 71 4840 1 . LEU 72 72 4840 1 . ASN 73 73 4840 1 . ASN 74 74 4840 1 . PRO 75 75 4840 1 . ASP 76 76 4840 1 . ALA 77 77 4840 1 . ALA 78 78 4840 1 . ASN 79 79 4840 1 . GLY 80 80 4840 1 . PHE 81 81 4840 1 . ILE 82 82 4840 1 . LEU 83 83 4840 1 . ASP 84 84 4840 1 . GLY 85 85 4840 1 . TYR 86 86 4840 1 . PRO 87 87 4840 1 . ARG 88 88 4840 1 . SER 89 89 4840 1 . VAL 90 90 4840 1 . GLU 91 91 4840 1 . GLN 92 92 4840 1 . ALA 93 93 4840 1 . LYS 94 94 4840 1 . ALA 95 95 4840 1 . LEU 96 96 4840 1 . HIS 97 97 4840 1 . GLU 98 98 4840 1 . MET 99 99 4840 1 . LEU 100 100 4840 1 . GLU 101 101 4840 1 . ARG 102 102 4840 1 . ARG 103 103 4840 1 . GLY 104 104 4840 1 . THR 105 105 4840 1 . ASP 106 106 4840 1 . ILE 107 107 4840 1 . ASP 108 108 4840 1 . ALA 109 109 4840 1 . VAL 110 110 4840 1 . LEU 111 111 4840 1 . GLU 112 112 4840 1 . PHE 113 113 4840 1 . ARG 114 114 4840 1 . VAL 115 115 4840 1 . SER 116 116 4840 1 . GLU 117 117 4840 1 . GLU 118 118 4840 1 . VAL 119 119 4840 1 . LEU 120 120 4840 1 . LEU 121 121 4840 1 . GLU 122 122 4840 1 . ARG 123 123 4840 1 . LEU 124 124 4840 1 . LYS 125 125 4840 1 . GLY 126 126 4840 1 . ARG 127 127 4840 1 . GLY 128 128 4840 1 . ARG 129 129 4840 1 . ALA 130 130 4840 1 . ASP 131 131 4840 1 . ASP 132 132 4840 1 . THR 133 133 4840 1 . ASP 134 134 4840 1 . ASP 135 135 4840 1 . VAL 136 136 4840 1 . ILE 137 137 4840 1 . LEU 138 138 4840 1 . ASN 139 139 4840 1 . ARG 140 140 4840 1 . MET 141 141 4840 1 . LYS 142 142 4840 1 . VAL 143 143 4840 1 . TYR 144 144 4840 1 . ARG 145 145 4840 1 . ASP 146 146 4840 1 . GLU 147 147 4840 1 . THR 148 148 4840 1 . ALA 149 149 4840 1 . PRO 150 150 4840 1 . LEU 151 151 4840 1 . LEU 152 152 4840 1 . GLU 153 153 4840 1 . TYR 154 154 4840 1 . TYR 155 155 4840 1 . ARG 156 156 4840 1 . ASP 157 157 4840 1 . GLN 158 158 4840 1 . LEU 159 159 4840 1 . LYS 160 160 4840 1 . THR 161 161 4840 1 . VAL 162 162 4840 1 . ASP 163 163 4840 1 . ALA 164 164 4840 1 . VAL 165 165 4840 1 . GLY 166 166 4840 1 . THR 167 167 4840 1 . MET 168 168 4840 1 . ASP 169 169 4840 1 . GLU 170 170 4840 1 . VAL 171 171 4840 1 . PHE 172 172 4840 1 . ALA 173 173 4840 1 . ARG 174 174 4840 1 . ALA 175 175 4840 1 . LEU 176 176 4840 1 . ARG 177 177 4840 1 . ALA 178 178 4840 1 . LEU 179 179 4840 1 . GLY 180 180 4840 1 . LYS 181 181 4840 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 4840 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $AK . 1773 . . 'Mycobacterium tuberculosis' . . . Bacteria . Mycobacterium tuberculosis . . . . . . . . . . . . . . . . . . . . . 4840 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 4840 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $AK . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli BLI5 . . . . . . . . . . . . pET22b . . pHL20 . . . . . . 4840 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Sample.Sf_category sample _Sample.Sf_framecode sample_one _Sample.Entry_ID 4840 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'Adenylate kinase from M. tuberculosis' . . . 1 $AK . . 1.0 . . mM . . . . 4840 1 2 H2O . . . . . . . 95 . . % . . . . 4840 1 3 D2O . . . . . . . 5 . . % . . . . 4840 1 stop_ save_ save_sample_two _Sample.Sf_category sample _Sample.Sf_framecode sample_two _Sample.Entry_ID 4840 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'Adenylate kinase from M. tuberculosis' [U-15N] . . 1 $AK . . 1.0 . . mM . . . . 4840 2 2 H2O . . . . . . . 95 . . % . . . . 4840 2 3 D2O . . . . . . . 5 . . % . . . . 4840 2 stop_ save_ save_sample_three _Sample.Sf_category sample _Sample.Sf_framecode sample_three _Sample.Entry_ID 4840 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'Adenylate kinase from M. tuberculosis' '[U-15N; U-13C]' . . 1 $AK . . 1.2 . . mM . . . . 4840 3 2 H2O . . . . . . . 95 . . % . . . . 4840 3 3 D2O . . . . . . . 5 . . % . . . . 4840 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_one _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_one _Sample_condition_list.Entry_ID 4840 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.1 . n/a 4840 1 temperature 308 . K 4840 1 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 4840 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Unity _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 4840 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 4840 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Varian Unity . 500 . . . 4840 1 2 NMR_spectrometer_2 Varian Inova . 750 . . . 4840 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 4840 _Experiment_list.ID 1 _Experiment_list.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_one _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_one _Chem_shift_reference.Entry_ID 4840 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct . . . . . . . . . . 4840 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.251449530 . . . . . . . . . 4840 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.101329118 . . . . . . . . . 4840 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_chemical_shift_assignment_AKmt _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_assignment_AKmt _Assigned_chem_shift_list.Entry_ID 4840 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_one _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_one _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 $sample_one . 4840 1 . . 2 $sample_two . 4840 1 . . 3 $sample_three . 4840 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 ARG H H 1 9.73 0.01 . 1 . . . . . . . . 4840 1 2 . 1 1 2 2 ARG HA H 1 4.30 0.01 . 1 . . . . . . . . 4840 1 3 . 1 1 2 2 ARG HB2 H 1 1.85 0.01 . 1 . . . . . . . . 4840 1 4 . 1 1 2 2 ARG HB3 H 1 1.85 0.01 . 1 . . . . . . . . 4840 1 5 . 1 1 2 2 ARG N N 15 124.3 0.1 . 1 . . . . . . . . 4840 1 6 . 1 1 2 2 ARG CA C 13 53.7 0.1 . 1 . . . . . . . . 4840 1 7 . 1 1 2 2 ARG CB C 13 27.7 0.1 . 1 . . . . . . . . 4840 1 8 . 1 1 3 3 VAL H H 1 8.48 0.01 . 1 . . . . . . . . 4840 1 9 . 1 1 3 3 VAL HA H 1 5.26 0.01 . 1 . . . . . . . . 4840 1 10 . 1 1 3 3 VAL HB H 1 2.08 0.01 . 1 . . . . . . . . 4840 1 11 . 1 1 3 3 VAL HG11 H 1 0.85 0.01 . 2 . . . . . . . . 4840 1 12 . 1 1 3 3 VAL HG12 H 1 0.85 0.01 . 2 . . . . . . . . 4840 1 13 . 1 1 3 3 VAL HG13 H 1 0.85 0.01 . 2 . . . . . . . . 4840 1 14 . 1 1 3 3 VAL HG21 H 1 0.92 0.01 . 2 . . . . . . . . 4840 1 15 . 1 1 3 3 VAL HG22 H 1 0.92 0.01 . 2 . . . . . . . . 4840 1 16 . 1 1 3 3 VAL HG23 H 1 0.92 0.01 . 2 . . . . . . . . 4840 1 17 . 1 1 3 3 VAL N N 15 125.2 0.1 . 1 . . . . . . . . 4840 1 18 . 1 1 3 3 VAL CA C 13 58.3 0.1 . 1 . . . . . . . . 4840 1 19 . 1 1 3 3 VAL CB C 13 34.0 0.1 . 1 . . . . . . . . 4840 1 20 . 1 1 4 4 LEU H H 1 8.21 0.01 . 1 . . . . . . . . 4840 1 21 . 1 1 4 4 LEU HA H 1 5.39 0.01 . 1 . . . . . . . . 4840 1 22 . 1 1 4 4 LEU HB2 H 1 1.68 0.01 . 1 . . . . . . . . 4840 1 23 . 1 1 4 4 LEU HB3 H 1 1.68 0.01 . 1 . . . . . . . . 4840 1 24 . 1 1 4 4 LEU HG H 1 1.65 0.01 . 1 . . . . . . . . 4840 1 25 . 1 1 4 4 LEU HD11 H 1 0.85 0.01 . 2 . . . . . . . . 4840 1 26 . 1 1 4 4 LEU HD12 H 1 0.85 0.01 . 2 . . . . . . . . 4840 1 27 . 1 1 4 4 LEU HD13 H 1 0.85 0.01 . 2 . . . . . . . . 4840 1 28 . 1 1 4 4 LEU HD21 H 1 1.05 0.01 . 2 . . . . . . . . 4840 1 29 . 1 1 4 4 LEU HD22 H 1 1.05 0.01 . 2 . . . . . . . . 4840 1 30 . 1 1 4 4 LEU HD23 H 1 1.05 0.01 . 2 . . . . . . . . 4840 1 31 . 1 1 4 4 LEU N N 15 125.4 0.1 . 1 . . . . . . . . 4840 1 32 . 1 1 4 4 LEU CA C 13 50.9 0.1 . 1 . . . . . . . . 4840 1 33 . 1 1 4 4 LEU CB C 13 42.8 0.1 . 1 . . . . . . . . 4840 1 34 . 1 1 5 5 LEU H H 1 8.35 0.01 . 1 . . . . . . . . 4840 1 35 . 1 1 5 5 LEU HA H 1 5.33 0.01 . 1 . . . . . . . . 4840 1 36 . 1 1 5 5 LEU HB2 H 1 2.00 0.01 . 1 . . . . . . . . 4840 1 37 . 1 1 5 5 LEU HB3 H 1 2.00 0.01 . 1 . . . . . . . . 4840 1 38 . 1 1 5 5 LEU HG H 1 1.31 0.01 . 1 . . . . . . . . 4840 1 39 . 1 1 5 5 LEU HD11 H 1 0.93 0.01 . 2 . . . . . . . . 4840 1 40 . 1 1 5 5 LEU HD12 H 1 0.93 0.01 . 2 . . . . . . . . 4840 1 41 . 1 1 5 5 LEU HD13 H 1 0.93 0.01 . 2 . . . . . . . . 4840 1 42 . 1 1 5 5 LEU HD21 H 1 0.87 0.01 . 2 . . . . . . . . 4840 1 43 . 1 1 5 5 LEU HD22 H 1 0.87 0.01 . 2 . . . . . . . . 4840 1 44 . 1 1 5 5 LEU HD23 H 1 0.87 0.01 . 2 . . . . . . . . 4840 1 45 . 1 1 5 5 LEU N N 15 121.2 0.1 . 1 . . . . . . . . 4840 1 46 . 1 1 5 5 LEU CA C 13 51.2 0.1 . 1 . . . . . . . . 4840 1 47 . 1 1 5 5 LEU CB C 13 41.2 0.1 . 1 . . . . . . . . 4840 1 48 . 1 1 6 6 LEU H H 1 9.33 0.01 . 1 . . . . . . . . 4840 1 49 . 1 1 6 6 LEU HA H 1 5.07 0.01 . 1 . . . . . . . . 4840 1 50 . 1 1 6 6 LEU HB2 H 1 1.68 0.01 . 2 . . . . . . . . 4840 1 51 . 1 1 6 6 LEU HB3 H 1 1.59 0.01 . 2 . . . . . . . . 4840 1 52 . 1 1 6 6 LEU HG H 1 1.49 0.01 . 1 . . . . . . . . 4840 1 53 . 1 1 6 6 LEU HD11 H 1 1.02 0.01 . 2 . . . . . . . . 4840 1 54 . 1 1 6 6 LEU HD12 H 1 1.02 0.01 . 2 . . . . . . . . 4840 1 55 . 1 1 6 6 LEU HD13 H 1 1.02 0.01 . 2 . . . . . . . . 4840 1 56 . 1 1 6 6 LEU HD21 H 1 0.75 0.01 . 2 . . . . . . . . 4840 1 57 . 1 1 6 6 LEU HD22 H 1 0.75 0.01 . 2 . . . . . . . . 4840 1 58 . 1 1 6 6 LEU HD23 H 1 0.75 0.01 . 2 . . . . . . . . 4840 1 59 . 1 1 6 6 LEU N N 15 123.5 0.1 . 1 . . . . . . . . 4840 1 60 . 1 1 6 6 LEU CA C 13 51.2 0.1 . 1 . . . . . . . . 4840 1 61 . 1 1 6 6 LEU CB C 13 43.9 0.1 . 1 . . . . . . . . 4840 1 62 . 1 1 7 7 GLY H H 1 8.55 0.01 . 1 . . . . . . . . 4840 1 63 . 1 1 7 7 GLY N N 15 109.9 0.1 . 1 . . . . . . . . 4840 1 64 . 1 1 7 7 GLY CA C 13 43.5 0.1 . 1 . . . . . . . . 4840 1 65 . 1 1 10 10 GLY CA C 13 43.3 0.1 . 1 . . . . . . . . 4840 1 66 . 1 1 11 11 ALA H H 1 8.03 0.01 . 1 . . . . . . . . 4840 1 67 . 1 1 11 11 ALA N N 15 122.5 0.1 . 1 . . . . . . . . 4840 1 68 . 1 1 11 11 ALA CA C 13 51.0 0.1 . 1 . . . . . . . . 4840 1 69 . 1 1 11 11 ALA CB C 13 17.0 0.1 . 1 . . . . . . . . 4840 1 70 . 1 1 12 12 GLY H H 1 8.42 0.01 . 1 . . . . . . . . 4840 1 71 . 1 1 12 12 GLY N N 15 108.2 0.1 . 1 . . . . . . . . 4840 1 72 . 1 1 12 12 GLY CA C 13 43.3 0.1 . 1 . . . . . . . . 4840 1 73 . 1 1 15 15 THR CA C 13 64 0.1 . 1 . . . . . . . . 4840 1 74 . 1 1 15 15 THR CB C 13 66.8 0.1 . 1 . . . . . . . . 4840 1 75 . 1 1 16 16 GLN H H 1 7.79 0.01 . 1 . . . . . . . . 4840 1 76 . 1 1 16 16 GLN HE21 H 1 6.55 0.01 . 2 . . . . . . . . 4840 1 77 . 1 1 16 16 GLN HE22 H 1 7.22 0.01 . 2 . . . . . . . . 4840 1 78 . 1 1 16 16 GLN N N 15 119.4 0.1 . 1 . . . . . . . . 4840 1 79 . 1 1 16 16 GLN NE2 N 15 108.3 0.1 . 2 . . . . . . . . 4840 1 80 . 1 1 16 16 GLN CA C 13 55.4 0.1 . 1 . . . . . . . . 4840 1 81 . 1 1 16 16 GLN CB C 13 24.8 0.1 . 1 . . . . . . . . 4840 1 82 . 1 1 17 17 ALA H H 1 8.93 0.01 . 1 . . . . . . . . 4840 1 83 . 1 1 17 17 ALA HA H 1 3.90 0.01 . 1 . . . . . . . . 4840 1 84 . 1 1 17 17 ALA HB1 H 1 1.51 0.01 . 1 . . . . . . . . 4840 1 85 . 1 1 17 17 ALA HB2 H 1 1.51 0.01 . 1 . . . . . . . . 4840 1 86 . 1 1 17 17 ALA HB3 H 1 1.51 0.01 . 1 . . . . . . . . 4840 1 87 . 1 1 17 17 ALA N N 15 122.1 0.1 . 1 . . . . . . . . 4840 1 88 . 1 1 17 17 ALA CA C 13 54.0 0.1 . 1 . . . . . . . . 4840 1 89 . 1 1 17 17 ALA CB C 13 16.0 0.1 . 1 . . . . . . . . 4840 1 90 . 1 1 18 18 VAL H H 1 7.04 0.01 . 1 . . . . . . . . 4840 1 91 . 1 1 18 18 VAL HA H 1 3.65 0.01 . 1 . . . . . . . . 4840 1 92 . 1 1 18 18 VAL HB H 1 2.18 0.01 . 1 . . . . . . . . 4840 1 93 . 1 1 18 18 VAL HG11 H 1 1.15 0.01 . 2 . . . . . . . . 4840 1 94 . 1 1 18 18 VAL HG12 H 1 1.15 0.01 . 2 . . . . . . . . 4840 1 95 . 1 1 18 18 VAL HG13 H 1 1.15 0.01 . 2 . . . . . . . . 4840 1 96 . 1 1 18 18 VAL HG21 H 1 1.01 0.01 . 2 . . . . . . . . 4840 1 97 . 1 1 18 18 VAL HG22 H 1 1.01 0.01 . 2 . . . . . . . . 4840 1 98 . 1 1 18 18 VAL HG23 H 1 1.01 0.01 . 2 . . . . . . . . 4840 1 99 . 1 1 18 18 VAL N N 15 114.8 0.1 . 1 . . . . . . . . 4840 1 100 . 1 1 18 18 VAL CA C 13 63.9 0.1 . 1 . . . . . . . . 4840 1 101 . 1 1 18 18 VAL CB C 13 30.0 0.1 . 1 . . . . . . . . 4840 1 102 . 1 1 19 19 LYS H H 1 7.38 0.01 . 1 . . . . . . . . 4840 1 103 . 1 1 19 19 LYS HA H 1 4.00 0.01 . 1 . . . . . . . . 4840 1 104 . 1 1 19 19 LYS HB2 H 1 1.56 0.01 . 2 . . . . . . . . 4840 1 105 . 1 1 19 19 LYS HB3 H 1 1.48 0.01 . 2 . . . . . . . . 4840 1 106 . 1 1 19 19 LYS HG2 H 1 1.19 0.01 . 2 . . . . . . . . 4840 1 107 . 1 1 19 19 LYS N N 15 120.2 0.1 . 1 . . . . . . . . 4840 1 108 . 1 1 19 19 LYS CA C 13 57.2 0.1 . 1 . . . . . . . . 4840 1 109 . 1 1 19 19 LYS CB C 13 29.8 0.1 . 1 . . . . . . . . 4840 1 110 . 1 1 20 20 LEU H H 1 9.33 0.01 . 1 . . . . . . . . 4840 1 111 . 1 1 20 20 LEU HA H 1 4.20 0.01 . 1 . . . . . . . . 4840 1 112 . 1 1 20 20 LEU HB2 H 1 2.15 0.01 . 1 . . . . . . . . 4840 1 113 . 1 1 20 20 LEU HB3 H 1 2.15 0.01 . 1 . . . . . . . . 4840 1 114 . 1 1 20 20 LEU N N 15 121.5 0.1 . 1 . . . . . . . . 4840 1 115 . 1 1 20 20 LEU CA C 13 56.2 0.1 . 1 . . . . . . . . 4840 1 116 . 1 1 20 20 LEU CB C 13 40.7 0.1 . 1 . . . . . . . . 4840 1 117 . 1 1 21 21 ALA H H 1 8.29 0.01 . 1 . . . . . . . . 4840 1 118 . 1 1 21 21 ALA HA H 1 4.06 0.01 . 1 . . . . . . . . 4840 1 119 . 1 1 21 21 ALA HB1 H 1 1.74 0.01 . 1 . . . . . . . . 4840 1 120 . 1 1 21 21 ALA HB2 H 1 1.74 0.01 . 1 . . . . . . . . 4840 1 121 . 1 1 21 21 ALA HB3 H 1 1.74 0.01 . 1 . . . . . . . . 4840 1 122 . 1 1 21 21 ALA N N 15 123.7 0.1 . 1 . . . . . . . . 4840 1 123 . 1 1 21 21 ALA CA C 13 53.7 0.1 . 1 . . . . . . . . 4840 1 124 . 1 1 21 21 ALA CB C 13 16.3 0.1 . 1 . . . . . . . . 4840 1 125 . 1 1 22 22 GLU H H 1 7.78 0.01 . 1 . . . . . . . . 4840 1 126 . 1 1 22 22 GLU HA H 1 4.11 0.01 . 1 . . . . . . . . 4840 1 127 . 1 1 22 22 GLU HB2 H 1 2.25 0.01 . 2 . . . . . . . . 4840 1 128 . 1 1 22 22 GLU HB3 H 1 2.15 0.01 . 2 . . . . . . . . 4840 1 129 . 1 1 22 22 GLU N N 15 116.9 0.1 . 1 . . . . . . . . 4840 1 130 . 1 1 22 22 GLU CA C 13 56.8 0.1 . 1 . . . . . . . . 4840 1 131 . 1 1 22 22 GLU CB C 13 27.4 0.1 . 1 . . . . . . . . 4840 1 132 . 1 1 23 23 LYS H H 1 7.85 0.01 . 1 . . . . . . . . 4840 1 133 . 1 1 23 23 LYS HA H 1 4.33 0.01 . 1 . . . . . . . . 4840 1 134 . 1 1 23 23 LYS N N 15 119.2 0.1 . 1 . . . . . . . . 4840 1 135 . 1 1 23 23 LYS CA C 13 55.4 0.1 . 1 . . . . . . . . 4840 1 136 . 1 1 23 23 LYS CB C 13 30.5 0.1 . 1 . . . . . . . . 4840 1 137 . 1 1 24 24 LEU H H 1 8.65 0.01 . 1 . . . . . . . . 4840 1 138 . 1 1 24 24 LEU HA H 1 4.38 0.01 . 1 . . . . . . . . 4840 1 139 . 1 1 24 24 LEU HB2 H 1 1.89 0.01 . 1 . . . . . . . . 4840 1 140 . 1 1 24 24 LEU HB3 H 1 1.89 0.01 . 1 . . . . . . . . 4840 1 141 . 1 1 24 24 LEU HG H 1 1.63 0.01 . 1 . . . . . . . . 4840 1 142 . 1 1 24 24 LEU HD11 H 1 0.87 0.01 . 1 . . . . . . . . 4840 1 143 . 1 1 24 24 LEU HD12 H 1 0.87 0.01 . 1 . . . . . . . . 4840 1 144 . 1 1 24 24 LEU HD13 H 1 0.87 0.01 . 1 . . . . . . . . 4840 1 145 . 1 1 24 24 LEU HD21 H 1 0.87 0.01 . 1 . . . . . . . . 4840 1 146 . 1 1 24 24 LEU HD22 H 1 0.87 0.01 . 1 . . . . . . . . 4840 1 147 . 1 1 24 24 LEU HD23 H 1 0.87 0.01 . 1 . . . . . . . . 4840 1 148 . 1 1 24 24 LEU N N 15 116.7 0.1 . 1 . . . . . . . . 4840 1 149 . 1 1 24 24 LEU CA C 13 53.3 0.1 . 1 . . . . . . . . 4840 1 150 . 1 1 24 24 LEU CB C 13 40.1 0.1 . 1 . . . . . . . . 4840 1 151 . 1 1 25 25 GLY H H 1 8.6 0.01 . 1 . . . . . . . . 4840 1 152 . 1 1 25 25 GLY HA2 H 1 4.00 0.01 . 2 . . . . . . . . 4840 1 153 . 1 1 25 25 GLY HA3 H 1 4.02 0.01 . 2 . . . . . . . . 4840 1 154 . 1 1 25 25 GLY N N 15 110.4 0.1 . 1 . . . . . . . . 4840 1 155 . 1 1 25 25 GLY CA C 13 44.9 0.1 . 1 . . . . . . . . 4840 1 156 . 1 1 26 26 ILE H H 1 7.66 0.01 . 1 . . . . . . . . 4840 1 157 . 1 1 26 26 ILE HA H 1 4.86 0.01 . 1 . . . . . . . . 4840 1 158 . 1 1 26 26 ILE N N 15 113.7 0.1 . 1 . . . . . . . . 4840 1 159 . 1 1 26 26 ILE CA C 13 55.6 0.1 . 1 . . . . . . . . 4840 1 160 . 1 1 26 26 ILE CB C 13 37.2 0.1 . 1 . . . . . . . . 4840 1 161 . 1 1 27 27 PRO CA C 13 60.6 0.1 . 1 . . . . . . . . 4840 1 162 . 1 1 27 27 PRO CB C 13 30.2 0.1 . 1 . . . . . . . . 4840 1 163 . 1 1 28 28 GLN H H 1 8.38 0.01 . 1 . . . . . . . . 4840 1 164 . 1 1 28 28 GLN HA H 1 5.11 0.01 . 1 . . . . . . . . 4840 1 165 . 1 1 28 28 GLN HB2 H 1 2.10 0.01 . 2 . . . . . . . . 4840 1 166 . 1 1 28 28 GLN HB3 H 1 2.06 0.01 . 2 . . . . . . . . 4840 1 167 . 1 1 28 28 GLN HG2 H 1 2.39 0.01 . 2 . . . . . . . . 4840 1 168 . 1 1 28 28 GLN HE21 H 1 6.76 0.01 . 2 . . . . . . . . 4840 1 169 . 1 1 28 28 GLN HE22 H 1 7.33 0.01 . 2 . . . . . . . . 4840 1 170 . 1 1 28 28 GLN N N 15 119.3 0.1 . 1 . . . . . . . . 4840 1 171 . 1 1 28 28 GLN NE2 N 15 111.2 0.1 . 1 . . . . . . . . 4840 1 172 . 1 1 28 28 GLN CA C 13 52.0 0.1 . 1 . . . . . . . . 4840 1 173 . 1 1 28 28 GLN CB C 13 26.5 0.1 . 1 . . . . . . . . 4840 1 174 . 1 1 29 29 ILE H H 1 9.45 0.01 . 1 . . . . . . . . 4840 1 175 . 1 1 29 29 ILE HA H 1 4.25 0.01 . 1 . . . . . . . . 4840 1 176 . 1 1 29 29 ILE HB H 1 1.83 0.01 . 1 . . . . . . . . 4840 1 177 . 1 1 29 29 ILE N N 15 128.2 0.1 . 1 . . . . . . . . 4840 1 178 . 1 1 29 29 ILE CA C 13 58.9 0.1 . 1 . . . . . . . . 4840 1 179 . 1 1 29 29 ILE CB C 13 37.8 0.1 . 1 . . . . . . . . 4840 1 180 . 1 1 30 30 SER H H 1 8.27 0.01 . 1 . . . . . . . . 4840 1 181 . 1 1 30 30 SER HA H 1 5.67 0.01 . 1 . . . . . . . . 4840 1 182 . 1 1 30 30 SER HB2 H 1 4.01 0.01 . 2 . . . . . . . . 4840 1 183 . 1 1 30 30 SER HB3 H 1 4.08 0.01 . 2 . . . . . . . . 4840 1 184 . 1 1 30 30 SER N N 15 122.4 0.1 . 1 . . . . . . . . 4840 1 185 . 1 1 30 30 SER CA C 13 53.0 0.1 . 1 . . . . . . . . 4840 1 186 . 1 1 30 30 SER CB C 13 62.7 0.1 . 1 . . . . . . . . 4840 1 187 . 1 1 31 31 THR H H 1 8.47 0.01 . 1 . . . . . . . . 4840 1 188 . 1 1 31 31 THR N N 15 118.8 0.1 . 1 . . . . . . . . 4840 1 189 . 1 1 31 31 THR CA C 13 64.5 0.1 . 1 . . . . . . . . 4840 1 190 . 1 1 32 32 GLY H H 1 8.74 0.01 . 1 . . . . . . . . 4840 1 191 . 1 1 32 32 GLY HA2 H 1 3.95 0.01 . 2 . . . . . . . . 4840 1 192 . 1 1 32 32 GLY HA3 H 1 4.08 0.01 . 2 . . . . . . . . 4840 1 193 . 1 1 32 32 GLY N N 15 109.6 0.1 . 1 . . . . . . . . 4840 1 194 . 1 1 32 32 GLY CA C 13 45.4 0.1 . 1 . . . . . . . . 4840 1 195 . 1 1 33 33 GLU H H 1 7.41 0.01 . 1 . . . . . . . . 4840 1 196 . 1 1 33 33 GLU HA H 1 4.36 0.01 . 1 . . . . . . . . 4840 1 197 . 1 1 33 33 GLU HB2 H 1 2.14 0.01 . 2 . . . . . . . . 4840 1 198 . 1 1 33 33 GLU HB3 H 1 2.18 0.01 . 2 . . . . . . . . 4840 1 199 . 1 1 33 33 GLU HG2 H 1 2.42 0.01 . 1 . . . . . . . . 4840 1 200 . 1 1 33 33 GLU HG3 H 1 2.42 0.01 . 1 . . . . . . . . 4840 1 201 . 1 1 33 33 GLU N N 15 122.7 0.1 . 1 . . . . . . . . 4840 1 202 . 1 1 33 33 GLU CA C 13 56.2 0.1 . 1 . . . . . . . . 4840 1 203 . 1 1 33 33 GLU CB C 13 27.4 0.1 . 1 . . . . . . . . 4840 1 204 . 1 1 34 34 LEU H H 1 8.07 0.01 . 1 . . . . . . . . 4840 1 205 . 1 1 34 34 LEU HA H 1 4.17 0.01 . 1 . . . . . . . . 4840 1 206 . 1 1 34 34 LEU HB2 H 1 1.75 0.01 . 1 . . . . . . . . 4840 1 207 . 1 1 34 34 LEU HB3 H 1 1.75 0.01 . 1 . . . . . . . . 4840 1 208 . 1 1 34 34 LEU HG H 1 1.47 0.01 . 1 . . . . . . . . 4840 1 209 . 1 1 34 34 LEU HD11 H 1 0.71 0.01 . 1 . . . . . . . . 4840 1 210 . 1 1 34 34 LEU HD12 H 1 0.71 0.01 . 1 . . . . . . . . 4840 1 211 . 1 1 34 34 LEU HD13 H 1 0.71 0.01 . 1 . . . . . . . . 4840 1 212 . 1 1 34 34 LEU HD21 H 1 0.71 0.01 . 1 . . . . . . . . 4840 1 213 . 1 1 34 34 LEU HD22 H 1 0.71 0.01 . 1 . . . . . . . . 4840 1 214 . 1 1 34 34 LEU HD23 H 1 0.71 0.01 . 1 . . . . . . . . 4840 1 215 . 1 1 34 34 LEU N N 15 120.6 0.1 . 1 . . . . . . . . 4840 1 216 . 1 1 34 34 LEU CA C 13 55.7 0.1 . 1 . . . . . . . . 4840 1 217 . 1 1 34 34 LEU CB C 13 39.7 0.1 . 1 . . . . . . . . 4840 1 218 . 1 1 35 35 PHE H H 1 8.55 0.01 . 1 . . . . . . . . 4840 1 219 . 1 1 35 35 PHE HA H 1 4.23 0.01 . 1 . . . . . . . . 4840 1 220 . 1 1 35 35 PHE HB2 H 1 3.33 0.01 . 2 . . . . . . . . 4840 1 221 . 1 1 35 35 PHE HB3 H 1 3.12 0.01 . 2 . . . . . . . . 4840 1 222 . 1 1 35 35 PHE HD1 H 1 7.24 0.01 . 1 . . . . . . . . 4840 1 223 . 1 1 35 35 PHE HD2 H 1 7.24 0.01 . 1 . . . . . . . . 4840 1 224 . 1 1 35 35 PHE N N 15 120.0 0.1 . 1 . . . . . . . . 4840 1 225 . 1 1 35 35 PHE CA C 13 59.5 0.1 . 1 . . . . . . . . 4840 1 226 . 1 1 35 35 PHE CB C 13 36.0 0.1 . 1 . . . . . . . . 4840 1 227 . 1 1 36 36 ARG H H 1 7.94 0.01 . 1 . . . . . . . . 4840 1 228 . 1 1 36 36 ARG HA H 1 4.03 0.01 . 1 . . . . . . . . 4840 1 229 . 1 1 36 36 ARG HB2 H 1 2.00 0.01 . 2 . . . . . . . . 4840 1 230 . 1 1 36 36 ARG HB3 H 1 2.11 0.01 . 2 . . . . . . . . 4840 1 231 . 1 1 36 36 ARG N N 15 119.2 0.1 . 1 . . . . . . . . 4840 1 232 . 1 1 36 36 ARG CA C 13 58.1 0.1 . 1 . . . . . . . . 4840 1 233 . 1 1 36 36 ARG CB C 13 27.8 0.1 . 1 . . . . . . . . 4840 1 234 . 1 1 37 37 ARG H H 1 8.80 0.01 . 1 . . . . . . . . 4840 1 235 . 1 1 37 37 ARG HA H 1 4.18 0.01 . 1 . . . . . . . . 4840 1 236 . 1 1 37 37 ARG HB2 H 1 1.94 0.01 . 2 . . . . . . . . 4840 1 237 . 1 1 37 37 ARG HB3 H 1 2.05 0.01 . 2 . . . . . . . . 4840 1 238 . 1 1 37 37 ARG HG2 H 1 1.76 0.01 . 1 . . . . . . . . 4840 1 239 . 1 1 37 37 ARG HG3 H 1 1.76 0.01 . 1 . . . . . . . . 4840 1 240 . 1 1 37 37 ARG N N 15 118.4 0.1 . 1 . . . . . . . . 4840 1 241 . 1 1 37 37 ARG CA C 13 57.2 0.1 . 1 . . . . . . . . 4840 1 242 . 1 1 37 37 ARG CB C 13 27.6 0.1 . 1 . . . . . . . . 4840 1 243 . 1 1 38 38 ASN H H 1 7.60 0.01 . 1 . . . . . . . . 4840 1 244 . 1 1 38 38 ASN HA H 1 4.42 0.01 . 1 . . . . . . . . 4840 1 245 . 1 1 38 38 ASN HB2 H 1 2.86 0.01 . 1 . . . . . . . . 4840 1 246 . 1 1 38 38 ASN HB3 H 1 2.86 0.01 . 1 . . . . . . . . 4840 1 247 . 1 1 38 38 ASN HD21 H 1 7.69 0.01 . 2 . . . . . . . . 4840 1 248 . 1 1 38 38 ASN HD22 H 1 8.00 0.01 . 2 . . . . . . . . 4840 1 249 . 1 1 38 38 ASN N N 15 116.5 0.1 . 1 . . . . . . . . 4840 1 250 . 1 1 38 38 ASN ND2 N 15 116.1 0.1 . 1 . . . . . . . . 4840 1 251 . 1 1 38 38 ASN CA C 13 55.6 0.1 . 1 . . . . . . . . 4840 1 252 . 1 1 38 38 ASN CB C 13 36.5 0.1 . 1 . . . . . . . . 4840 1 253 . 1 1 39 39 ILE H H 1 8.43 0.01 . 1 . . . . . . . . 4840 1 254 . 1 1 39 39 ILE HA H 1 3.58 0.01 . 1 . . . . . . . . 4840 1 255 . 1 1 39 39 ILE HB H 1 2.04 0.01 . 1 . . . . . . . . 4840 1 256 . 1 1 39 39 ILE HG12 H 1 0.97 0.01 . 2 . . . . . . . . 4840 1 257 . 1 1 39 39 ILE HG13 H 1 0.88 0.01 . 2 . . . . . . . . 4840 1 258 . 1 1 39 39 ILE HD11 H 1 1.28 0.01 . 1 . . . . . . . . 4840 1 259 . 1 1 39 39 ILE HD12 H 1 1.28 0.01 . 1 . . . . . . . . 4840 1 260 . 1 1 39 39 ILE HD13 H 1 1.28 0.01 . 1 . . . . . . . . 4840 1 261 . 1 1 39 39 ILE N N 15 120.5 0.1 . 1 . . . . . . . . 4840 1 262 . 1 1 39 39 ILE CA C 13 64.1 0.1 . 1 . . . . . . . . 4840 1 263 . 1 1 39 39 ILE CB C 13 35.9 0.1 . 1 . . . . . . . . 4840 1 264 . 1 1 40 40 GLU H H 1 8.70 0.01 . 1 . . . . . . . . 4840 1 265 . 1 1 40 40 GLU HA H 1 4.10 0.01 . 1 . . . . . . . . 4840 1 266 . 1 1 40 40 GLU HB2 H 1 2.01 0.01 . 2 . . . . . . . . 4840 1 267 . 1 1 40 40 GLU N N 15 121.8 0.1 . 1 . . . . . . . . 4840 1 268 . 1 1 40 40 GLU CA C 13 57.5 0.1 . 1 . . . . . . . . 4840 1 269 . 1 1 40 40 GLU CB C 13 27.5 0.1 . 1 . . . . . . . . 4840 1 270 . 1 1 41 41 GLU H H 1 8.15 0.01 . 1 . . . . . . . . 4840 1 271 . 1 1 41 41 GLU HA H 1 4.31 0.01 . 1 . . . . . . . . 4840 1 272 . 1 1 41 41 GLU HB2 H 1 2.10 0.01 . 2 . . . . . . . . 4840 1 273 . 1 1 41 41 GLU HB3 H 1 2.12 0.01 . 2 . . . . . . . . 4840 1 274 . 1 1 41 41 GLU N N 15 116.2 0.1 . 1 . . . . . . . . 4840 1 275 . 1 1 41 41 GLU CA C 13 54.9 0.1 . 1 . . . . . . . . 4840 1 276 . 1 1 41 41 GLU CB C 13 28.0 0.1 . 1 . . . . . . . . 4840 1 277 . 1 1 42 42 GLY H H 1 7.88 0.01 . 1 . . . . . . . . 4840 1 278 . 1 1 42 42 GLY HA2 H 1 3.98 0.01 . 2 . . . . . . . . 4840 1 279 . 1 1 42 42 GLY HA3 H 1 3.89 0.01 . 2 . . . . . . . . 4840 1 280 . 1 1 42 42 GLY N N 15 109.9 0.1 . 1 . . . . . . . . 4840 1 281 . 1 1 42 42 GLY CA C 13 44.5 0.1 . 1 . . . . . . . . 4840 1 282 . 1 1 43 43 THR H H 1 7.86 0.01 . 1 . . . . . . . . 4840 1 283 . 1 1 43 43 THR HA H 1 4.40 0.01 . 1 . . . . . . . . 4840 1 284 . 1 1 43 43 THR HB H 1 4.91 0.01 . 1 . . . . . . . . 4840 1 285 . 1 1 43 43 THR HG21 H 1 1.47 0.01 . 1 . . . . . . . . 4840 1 286 . 1 1 43 43 THR HG22 H 1 1.47 0.01 . 1 . . . . . . . . 4840 1 287 . 1 1 43 43 THR HG23 H 1 1.47 0.01 . 1 . . . . . . . . 4840 1 288 . 1 1 43 43 THR N N 15 110.2 0.1 . 1 . . . . . . . . 4840 1 289 . 1 1 43 43 THR CA C 13 58.8 0.1 . 1 . . . . . . . . 4840 1 290 . 1 1 43 43 THR CB C 13 68.4 0.1 . 1 . . . . . . . . 4840 1 291 . 1 1 44 44 LYS H H 1 8.81 0.01 . 1 . . . . . . . . 4840 1 292 . 1 1 44 44 LYS HA H 1 4.09 0.01 . 1 . . . . . . . . 4840 1 293 . 1 1 44 44 LYS N N 15 122.4 0.1 . 1 . . . . . . . . 4840 1 294 . 1 1 44 44 LYS CA C 13 58.2 0.1 . 1 . . . . . . . . 4840 1 295 . 1 1 44 44 LYS CB C 13 30.0 0.1 . 1 . . . . . . . . 4840 1 296 . 1 1 45 45 LEU H H 1 8.30 0.01 . 1 . . . . . . . . 4840 1 297 . 1 1 45 45 LEU HA H 1 4.20 0.01 . 1 . . . . . . . . 4840 1 298 . 1 1 45 45 LEU HB2 H 1 1.67 0.01 . 1 . . . . . . . . 4840 1 299 . 1 1 45 45 LEU HB3 H 1 1.67 0.01 . 1 . . . . . . . . 4840 1 300 . 1 1 45 45 LEU HG H 1 1.28 0.01 . 1 . . . . . . . . 4840 1 301 . 1 1 45 45 LEU HD11 H 1 0.90 0.01 . 2 . . . . . . . . 4840 1 302 . 1 1 45 45 LEU HD12 H 1 0.90 0.01 . 2 . . . . . . . . 4840 1 303 . 1 1 45 45 LEU HD13 H 1 0.90 0.01 . 2 . . . . . . . . 4840 1 304 . 1 1 45 45 LEU N N 15 117.3 0.1 . 1 . . . . . . . . 4840 1 305 . 1 1 45 45 LEU CA C 13 55.2 0.1 . 1 . . . . . . . . 4840 1 306 . 1 1 45 45 LEU CB C 13 39.9 0.1 . 1 . . . . . . . . 4840 1 307 . 1 1 46 46 GLY H H 1 8.24 0.01 . 1 . . . . . . . . 4840 1 308 . 1 1 46 46 GLY HA2 H 1 3.65 0.01 . 2 . . . . . . . . 4840 1 309 . 1 1 46 46 GLY HA3 H 1 3.52 0.01 . 2 . . . . . . . . 4840 1 310 . 1 1 46 46 GLY N N 15 109.0 0.1 . 1 . . . . . . . . 4840 1 311 . 1 1 46 46 GLY CA C 13 44.5 0.1 . 1 . . . . . . . . 4840 1 312 . 1 1 47 47 VAL H H 1 8.74 0.01 . 1 . . . . . . . . 4840 1 313 . 1 1 47 47 VAL HA H 1 3.69 0.01 . 1 . . . . . . . . 4840 1 314 . 1 1 47 47 VAL HB H 1 2.23 0.01 . 1 . . . . . . . . 4840 1 315 . 1 1 47 47 VAL HG11 H 1 1.02 0.01 . 2 . . . . . . . . 4840 1 316 . 1 1 47 47 VAL HG12 H 1 1.02 0.01 . 2 . . . . . . . . 4840 1 317 . 1 1 47 47 VAL HG13 H 1 1.02 0.01 . 2 . . . . . . . . 4840 1 318 . 1 1 47 47 VAL HG21 H 1 1.09 0.01 . 2 . . . . . . . . 4840 1 319 . 1 1 47 47 VAL HG22 H 1 1.09 0.01 . 2 . . . . . . . . 4840 1 320 . 1 1 47 47 VAL HG23 H 1 1.09 0.01 . 2 . . . . . . . . 4840 1 321 . 1 1 47 47 VAL N N 15 122.0 0.1 . 1 . . . . . . . . 4840 1 322 . 1 1 47 47 VAL CA C 13 64.4 0.1 . 1 . . . . . . . . 4840 1 323 . 1 1 47 47 VAL CB C 13 29.6 0.1 . 1 . . . . . . . . 4840 1 324 . 1 1 48 48 GLU H H 1 7.49 0.01 . 1 . . . . . . . . 4840 1 325 . 1 1 48 48 GLU HA H 1 4.22 0.01 . 1 . . . . . . . . 4840 1 326 . 1 1 48 48 GLU HB2 H 1 2.52 0.01 . 2 . . . . . . . . 4840 1 327 . 1 1 48 48 GLU HB3 H 1 2.27 0.01 . 2 . . . . . . . . 4840 1 328 . 1 1 48 48 GLU N N 15 120.2 0.1 . 1 . . . . . . . . 4840 1 329 . 1 1 48 48 GLU CA C 13 56.9 0.1 . 1 . . . . . . . . 4840 1 330 . 1 1 48 48 GLU CB C 13 27.4 0.1 . 1 . . . . . . . . 4840 1 331 . 1 1 49 49 ALA H H 1 8.54 0.01 . 1 . . . . . . . . 4840 1 332 . 1 1 49 49 ALA HA H 1 4.19 0.01 . 1 . . . . . . . . 4840 1 333 . 1 1 49 49 ALA HB1 H 1 1.54 0.01 . 1 . . . . . . . . 4840 1 334 . 1 1 49 49 ALA HB2 H 1 1.54 0.01 . 1 . . . . . . . . 4840 1 335 . 1 1 49 49 ALA HB3 H 1 1.54 0.01 . 1 . . . . . . . . 4840 1 336 . 1 1 49 49 ALA N N 15 120.5 0.1 . 1 . . . . . . . . 4840 1 337 . 1 1 49 49 ALA CA C 13 53.4 0.1 . 1 . . . . . . . . 4840 1 338 . 1 1 49 49 ALA CB C 13 16.5 0.1 . 1 . . . . . . . . 4840 1 339 . 1 1 50 50 LYS H H 1 8.48 0.01 . 1 . . . . . . . . 4840 1 340 . 1 1 50 50 LYS HA H 1 3.89 0.01 . 1 . . . . . . . . 4840 1 341 . 1 1 50 50 LYS HB2 H 1 2.03 0.01 . 2 . . . . . . . . 4840 1 342 . 1 1 50 50 LYS HB3 H 1 2.00 0.01 . 2 . . . . . . . . 4840 1 343 . 1 1 50 50 LYS N N 15 118.2 0.1 . 1 . . . . . . . . 4840 1 344 . 1 1 50 50 LYS CA C 13 57.2 0.1 . 1 . . . . . . . . 4840 1 345 . 1 1 50 50 LYS CB C 13 30.6 0.1 . 1 . . . . . . . . 4840 1 346 . 1 1 51 51 ARG H H 1 7.42 0.01 . 1 . . . . . . . . 4840 1 347 . 1 1 51 51 ARG HA H 1 4.10 0.01 . 1 . . . . . . . . 4840 1 348 . 1 1 51 51 ARG HB2 H 1 1.83 0.01 . 1 . . . . . . . . 4840 1 349 . 1 1 51 51 ARG HB3 H 1 1.83 0.01 . 1 . . . . . . . . 4840 1 350 . 1 1 51 51 ARG HG2 H 1 1.70 0.01 . 2 . . . . . . . . 4840 1 351 . 1 1 51 51 ARG N N 15 117.8 0.1 . 1 . . . . . . . . 4840 1 352 . 1 1 51 51 ARG CA C 13 57.4 0.1 . 1 . . . . . . . . 4840 1 353 . 1 1 51 51 ARG CB C 13 27.8 0.1 . 1 . . . . . . . . 4840 1 354 . 1 1 52 52 TYR H H 1 7.30 0.01 . 1 . . . . . . . . 4840 1 355 . 1 1 52 52 TYR HA H 1 4.25 0.01 . 1 . . . . . . . . 4840 1 356 . 1 1 52 52 TYR HB2 H 1 2.97 0.01 . 1 . . . . . . . . 4840 1 357 . 1 1 52 52 TYR HB3 H 1 2.97 0.01 . 1 . . . . . . . . 4840 1 358 . 1 1 52 52 TYR HD1 H 1 7.36 0.01 . 1 . . . . . . . . 4840 1 359 . 1 1 52 52 TYR HD2 H 1 7.36 0.01 . 1 . . . . . . . . 4840 1 360 . 1 1 52 52 TYR HE1 H 1 6.89 0.01 . 1 . . . . . . . . 4840 1 361 . 1 1 52 52 TYR HE2 H 1 6.89 0.01 . 1 . . . . . . . . 4840 1 362 . 1 1 52 52 TYR N N 15 117.8 0.1 . 1 . . . . . . . . 4840 1 363 . 1 1 52 52 TYR CA C 13 59.7 0.1 . 1 . . . . . . . . 4840 1 364 . 1 1 52 52 TYR CB C 13 36.0 0.1 . 1 . . . . . . . . 4840 1 365 . 1 1 53 53 LEU H H 1 8.06 0.01 . 1 . . . . . . . . 4840 1 366 . 1 1 53 53 LEU HA H 1 4.24 0.01 . 1 . . . . . . . . 4840 1 367 . 1 1 53 53 LEU HB2 H 1 1.82 0.01 . 1 . . . . . . . . 4840 1 368 . 1 1 53 53 LEU HB3 H 1 1.82 0.01 . 1 . . . . . . . . 4840 1 369 . 1 1 53 53 LEU HG H 1 1.66 0.01 . 1 . . . . . . . . 4840 1 370 . 1 1 53 53 LEU HD11 H 1 0.90 0.01 . 2 . . . . . . . . 4840 1 371 . 1 1 53 53 LEU HD12 H 1 0.90 0.01 . 2 . . . . . . . . 4840 1 372 . 1 1 53 53 LEU HD13 H 1 0.90 0.01 . 2 . . . . . . . . 4840 1 373 . 1 1 53 53 LEU N N 15 120.4 0.1 . 1 . . . . . . . . 4840 1 374 . 1 1 53 53 LEU CA C 13 56.3 0.1 . 1 . . . . . . . . 4840 1 375 . 1 1 53 53 LEU CB C 13 39.3 0.1 . 1 . . . . . . . . 4840 1 376 . 1 1 54 54 ASP H H 1 9.18 0.01 . 1 . . . . . . . . 4840 1 377 . 1 1 54 54 ASP HA H 1 4.47 0.01 . 1 . . . . . . . . 4840 1 378 . 1 1 54 54 ASP HB2 H 1 2.81 0.01 . 2 . . . . . . . . 4840 1 379 . 1 1 54 54 ASP HB3 H 1 2.70 0.01 . 2 . . . . . . . . 4840 1 380 . 1 1 54 54 ASP N N 15 121.2 0.1 . 1 . . . . . . . . 4840 1 381 . 1 1 54 54 ASP CA C 13 54.8 0.1 . 1 . . . . . . . . 4840 1 382 . 1 1 54 54 ASP CB C 13 37.8 0.1 . 1 . . . . . . . . 4840 1 383 . 1 1 55 55 ALA H H 1 7.21 0.01 . 1 . . . . . . . . 4840 1 384 . 1 1 55 55 ALA HA H 1 4.49 0.01 . 1 . . . . . . . . 4840 1 385 . 1 1 55 55 ALA HB1 H 1 1.59 0.01 . 1 . . . . . . . . 4840 1 386 . 1 1 55 55 ALA HB2 H 1 1.59 0.01 . 1 . . . . . . . . 4840 1 387 . 1 1 55 55 ALA HB3 H 1 1.59 0.01 . 1 . . . . . . . . 4840 1 388 . 1 1 55 55 ALA N N 15 120.3 0.1 . 1 . . . . . . . . 4840 1 389 . 1 1 55 55 ALA CA C 13 49.9 0.1 . 1 . . . . . . . . 4840 1 390 . 1 1 55 55 ALA CB C 13 17.4 0.1 . 1 . . . . . . . . 4840 1 391 . 1 1 56 56 GLY H H 1 7.96 0.01 . 1 . . . . . . . . 4840 1 392 . 1 1 56 56 GLY HA2 H 1 4.23 0.01 . 2 . . . . . . . . 4840 1 393 . 1 1 56 56 GLY HA3 H 1 3.89 0.01 . 2 . . . . . . . . 4840 1 394 . 1 1 56 56 GLY N N 15 107.7 0.1 . 1 . . . . . . . . 4840 1 395 . 1 1 56 56 GLY CA C 13 43.4 0.1 . 1 . . . . . . . . 4840 1 396 . 1 1 57 57 ASP H H 1 8.07 0.01 . 1 . . . . . . . . 4840 1 397 . 1 1 57 57 ASP HA H 1 5.00 0.01 . 1 . . . . . . . . 4840 1 398 . 1 1 57 57 ASP HB2 H 1 2.99 0.01 . 2 . . . . . . . . 4840 1 399 . 1 1 57 57 ASP HB3 H 1 2.72 0.01 . 2 . . . . . . . . 4840 1 400 . 1 1 57 57 ASP N N 15 121.2 0.1 . 1 . . . . . . . . 4840 1 401 . 1 1 57 57 ASP CA C 13 50.7 0.1 . 1 . . . . . . . . 4840 1 402 . 1 1 57 57 ASP CB C 13 41.7 0.1 . 1 . . . . . . . . 4840 1 403 . 1 1 58 58 LEU H H 1 8.20 0.01 . 1 . . . . . . . . 4840 1 404 . 1 1 58 58 LEU HA H 1 4.32 0.01 . 1 . . . . . . . . 4840 1 405 . 1 1 58 58 LEU HB2 H 1 1.57 0.01 . 2 . . . . . . . . 4840 1 406 . 1 1 58 58 LEU HB3 H 1 1.47 0.01 . 2 . . . . . . . . 4840 1 407 . 1 1 58 58 LEU HG H 1 1.76 0.01 . 1 . . . . . . . . 4840 1 408 . 1 1 58 58 LEU HD21 H 1 0.98 0.01 . 2 . . . . . . . . 4840 1 409 . 1 1 58 58 LEU HD22 H 1 0.98 0.01 . 2 . . . . . . . . 4840 1 410 . 1 1 58 58 LEU HD23 H 1 0.98 0.01 . 2 . . . . . . . . 4840 1 411 . 1 1 58 58 LEU N N 15 120.4 0.1 . 1 . . . . . . . . 4840 1 412 . 1 1 58 58 LEU CA C 13 52.0 0.1 . 1 . . . . . . . . 4840 1 413 . 1 1 58 58 LEU CB C 13 40.2 0.1 . 1 . . . . . . . . 4840 1 414 . 1 1 59 59 VAL H H 1 8.15 0.01 . 1 . . . . . . . . 4840 1 415 . 1 1 59 59 VAL HA H 1 3.61 0.01 . 1 . . . . . . . . 4840 1 416 . 1 1 59 59 VAL HB H 1 1.83 0.01 . 1 . . . . . . . . 4840 1 417 . 1 1 59 59 VAL HG11 H 1 0.95 0.01 . 2 . . . . . . . . 4840 1 418 . 1 1 59 59 VAL HG12 H 1 0.95 0.01 . 2 . . . . . . . . 4840 1 419 . 1 1 59 59 VAL HG13 H 1 0.95 0.01 . 2 . . . . . . . . 4840 1 420 . 1 1 59 59 VAL HG21 H 1 0.79 0.01 . 2 . . . . . . . . 4840 1 421 . 1 1 59 59 VAL HG22 H 1 0.79 0.01 . 2 . . . . . . . . 4840 1 422 . 1 1 59 59 VAL HG23 H 1 0.79 0.01 . 2 . . . . . . . . 4840 1 423 . 1 1 59 59 VAL N N 15 123.7 0.1 . 1 . . . . . . . . 4840 1 424 . 1 1 59 59 VAL CA C 13 58.3 0.1 . 1 . . . . . . . . 4840 1 425 . 1 1 59 59 VAL CB C 13 29.8 0.1 . 1 . . . . . . . . 4840 1 426 . 1 1 61 61 SER CA C 13 59.8 0.1 . 1 . . . . . . . . 4840 1 427 . 1 1 61 61 SER CB C 13 60.8 0.1 . 1 . . . . . . . . 4840 1 428 . 1 1 62 62 ASP H H 1 8.74 0.01 . 1 . . . . . . . . 4840 1 429 . 1 1 62 62 ASP HA H 1 4.50 0.01 . 1 . . . . . . . . 4840 1 430 . 1 1 62 62 ASP HB2 H 1 2.81 0.01 . 2 . . . . . . . . 4840 1 431 . 1 1 62 62 ASP HB3 H 1 2.66 0.01 . 2 . . . . . . . . 4840 1 432 . 1 1 62 62 ASP N N 15 118.4 0.1 . 1 . . . . . . . . 4840 1 433 . 1 1 62 62 ASP CA C 13 54.8 0.1 . 1 . . . . . . . . 4840 1 434 . 1 1 62 62 ASP CB C 13 37.4 0.1 . 1 . . . . . . . . 4840 1 435 . 1 1 63 63 LEU H H 1 7.24 0.01 . 1 . . . . . . . . 4840 1 436 . 1 1 63 63 LEU HA H 1 4.28 0.01 . 1 . . . . . . . . 4840 1 437 . 1 1 63 63 LEU HB2 H 1 1.70 0.01 . 2 . . . . . . . . 4840 1 438 . 1 1 63 63 LEU N N 15 122.0 0.1 . 1 . . . . . . . . 4840 1 439 . 1 1 63 63 LEU CA C 13 55.6 0.1 . 1 . . . . . . . . 4840 1 440 . 1 1 63 63 LEU CB C 13 39.6 0.1 . 1 . . . . . . . . 4840 1 441 . 1 1 64 64 THR H H 1 7.81 0.01 . 1 . . . . . . . . 4840 1 442 . 1 1 64 64 THR HA H 1 3.75 0.01 . 1 . . . . . . . . 4840 1 443 . 1 1 64 64 THR HB H 1 4.40 0.01 . 1 . . . . . . . . 4840 1 444 . 1 1 64 64 THR HG21 H 1 1.37 0.01 . 1 . . . . . . . . 4840 1 445 . 1 1 64 64 THR HG22 H 1 1.37 0.01 . 1 . . . . . . . . 4840 1 446 . 1 1 64 64 THR HG23 H 1 1.37 0.01 . 1 . . . . . . . . 4840 1 447 . 1 1 64 64 THR N N 15 116.3 0.1 . 1 . . . . . . . . 4840 1 448 . 1 1 64 64 THR CA C 13 56.8 0.1 . 1 . . . . . . . . 4840 1 449 . 1 1 64 64 THR CB C 13 65.5 0.1 . 1 . . . . . . . . 4840 1 450 . 1 1 65 65 ASN H H 1 8.33 0.01 . 1 . . . . . . . . 4840 1 451 . 1 1 65 65 ASN HA H 1 4.23 0.01 . 1 . . . . . . . . 4840 1 452 . 1 1 65 65 ASN HB2 H 1 2.83 0.01 . 2 . . . . . . . . 4840 1 453 . 1 1 65 65 ASN HB3 H 1 3.20 0.01 . 2 . . . . . . . . 4840 1 454 . 1 1 65 65 ASN HD21 H 1 6.74 0.01 . 2 . . . . . . . . 4840 1 455 . 1 1 65 65 ASN HD22 H 1 7.83 0.01 . 2 . . . . . . . . 4840 1 456 . 1 1 65 65 ASN N N 15 119.0 0.1 . 1 . . . . . . . . 4840 1 457 . 1 1 65 65 ASN ND2 N 15 113.7 0.1 . 1 . . . . . . . . 4840 1 458 . 1 1 65 65 ASN CA C 13 54.2 0.1 . 1 . . . . . . . . 4840 1 459 . 1 1 65 65 ASN CB C 13 35.2 0.1 . 1 . . . . . . . . 4840 1 460 . 1 1 66 66 GLU H H 1 7.64 0.01 . 1 . . . . . . . . 4840 1 461 . 1 1 66 66 GLU HA H 1 4.08 0.01 . 1 . . . . . . . . 4840 1 462 . 1 1 66 66 GLU N N 15 119.6 0.1 . 1 . . . . . . . . 4840 1 463 . 1 1 66 66 GLU CA C 13 57.4 0.1 . 1 . . . . . . . . 4840 1 464 . 1 1 66 66 GLU CB C 13 27.4 0.1 . 1 . . . . . . . . 4840 1 465 . 1 1 67 67 LEU H H 1 8.13 0.01 . 1 . . . . . . . . 4840 1 466 . 1 1 67 67 LEU HA H 1 3.91 0.01 . 1 . . . . . . . . 4840 1 467 . 1 1 67 67 LEU HB2 H 1 1.89 0.01 . 2 . . . . . . . . 4840 1 468 . 1 1 67 67 LEU N N 15 121.4 0.1 . 1 . . . . . . . . 4840 1 469 . 1 1 67 67 LEU CA C 13 56.5 0.1 . 1 . . . . . . . . 4840 1 470 . 1 1 67 67 LEU CB C 13 40.3 0.1 . 1 . . . . . . . . 4840 1 471 . 1 1 68 68 VAL H H 1 7.85 0.01 . 1 . . . . . . . . 4840 1 472 . 1 1 68 68 VAL HA H 1 3.07 0.01 . 1 . . . . . . . . 4840 1 473 . 1 1 68 68 VAL HB H 1 1.62 0.01 . 1 . . . . . . . . 4840 1 474 . 1 1 68 68 VAL HG11 H 1 0.49 0.01 . 2 . . . . . . . . 4840 1 475 . 1 1 68 68 VAL HG12 H 1 0.49 0.01 . 2 . . . . . . . . 4840 1 476 . 1 1 68 68 VAL HG13 H 1 0.49 0.01 . 2 . . . . . . . . 4840 1 477 . 1 1 68 68 VAL HG21 H 1 -0.05 0.01 . 2 . . . . . . . . 4840 1 478 . 1 1 68 68 VAL HG22 H 1 -0.05 0.01 . 2 . . . . . . . . 4840 1 479 . 1 1 68 68 VAL HG23 H 1 -0.05 0.01 . 2 . . . . . . . . 4840 1 480 . 1 1 68 68 VAL N N 15 122.1 0.1 . 1 . . . . . . . . 4840 1 481 . 1 1 68 68 VAL CA C 13 65.3 0.1 . 1 . . . . . . . . 4840 1 482 . 1 1 68 68 VAL CB C 13 29.1 0.1 . 1 . . . . . . . . 4840 1 483 . 1 1 69 69 ASP H H 1 8.22 0.01 . 1 . . . . . . . . 4840 1 484 . 1 1 69 69 ASP HA H 1 4.29 0.01 . 1 . . . . . . . . 4840 1 485 . 1 1 69 69 ASP HB2 H 1 2.95 0.01 . 2 . . . . . . . . 4840 1 486 . 1 1 69 69 ASP HB3 H 1 2.72 0.01 . 2 . . . . . . . . 4840 1 487 . 1 1 69 69 ASP N N 15 120.7 0.1 . 1 . . . . . . . . 4840 1 488 . 1 1 69 69 ASP CA C 13 55.5 0.1 . 1 . . . . . . . . 4840 1 489 . 1 1 69 69 ASP CB C 13 39.4 0.1 . 1 . . . . . . . . 4840 1 490 . 1 1 70 70 ASP H H 1 7.80 0.01 . 1 . . . . . . . . 4840 1 491 . 1 1 70 70 ASP HA H 1 4.33 0.01 . 1 . . . . . . . . 4840 1 492 . 1 1 70 70 ASP HB2 H 1 2.59 0.01 . 2 . . . . . . . . 4840 1 493 . 1 1 70 70 ASP HB3 H 1 2.79 0.01 . 2 . . . . . . . . 4840 1 494 . 1 1 70 70 ASP N N 15 114.9 0.1 . 1 . . . . . . . . 4840 1 495 . 1 1 70 70 ASP CA C 13 54.9 0.1 . 1 . . . . . . . . 4840 1 496 . 1 1 70 70 ASP CB C 13 40.3 0.1 . 1 . . . . . . . . 4840 1 497 . 1 1 71 71 ARG H H 1 7.64 0.01 . 1 . . . . . . . . 4840 1 498 . 1 1 71 71 ARG HA H 1 4.27 0.01 . 1 . . . . . . . . 4840 1 499 . 1 1 71 71 ARG HB2 H 1 2.14 0.01 . 2 . . . . . . . . 4840 1 500 . 1 1 71 71 ARG HB3 H 1 1.89 0.01 . 2 . . . . . . . . 4840 1 501 . 1 1 71 71 ARG N N 15 121.5 0.1 . 1 . . . . . . . . 4840 1 502 . 1 1 71 71 ARG CA C 13 54.9 0.1 . 1 . . . . . . . . 4840 1 503 . 1 1 71 71 ARG CB C 13 26.5 0.1 . 1 . . . . . . . . 4840 1 504 . 1 1 72 72 LEU H H 1 8.09 0.01 . 1 . . . . . . . . 4840 1 505 . 1 1 72 72 LEU HA H 1 3.94 0.01 . 1 . . . . . . . . 4840 1 506 . 1 1 72 72 LEU HB2 H 1 1.67 0.01 . 1 . . . . . . . . 4840 1 507 . 1 1 72 72 LEU HB3 H 1 1.67 0.01 . 1 . . . . . . . . 4840 1 508 . 1 1 72 72 LEU HG H 1 1.65 0.01 . 1 . . . . . . . . 4840 1 509 . 1 1 72 72 LEU HD11 H 1 0.50 0.01 . 2 . . . . . . . . 4840 1 510 . 1 1 72 72 LEU HD12 H 1 0.50 0.01 . 2 . . . . . . . . 4840 1 511 . 1 1 72 72 LEU HD13 H 1 0.50 0.01 . 2 . . . . . . . . 4840 1 512 . 1 1 72 72 LEU HD21 H 1 0.17 0.01 . 2 . . . . . . . . 4840 1 513 . 1 1 72 72 LEU HD22 H 1 0.17 0.01 . 2 . . . . . . . . 4840 1 514 . 1 1 72 72 LEU HD23 H 1 0.17 0.01 . 2 . . . . . . . . 4840 1 515 . 1 1 72 72 LEU N N 15 118.9 0.1 . 1 . . . . . . . . 4840 1 516 . 1 1 72 72 LEU CA C 13 53.6 0.1 . 1 . . . . . . . . 4840 1 517 . 1 1 72 72 LEU CB C 13 38.1 0.1 . 1 . . . . . . . . 4840 1 518 . 1 1 73 73 ASN H H 1 7.48 0.01 . 1 . . . . . . . . 4840 1 519 . 1 1 73 73 ASN HA H 1 4.87 0.01 . 1 . . . . . . . . 4840 1 520 . 1 1 73 73 ASN HB2 H 1 3.04 0.01 . 1 . . . . . . . . 4840 1 521 . 1 1 73 73 ASN HB3 H 1 3.04 0.01 . 1 . . . . . . . . 4840 1 522 . 1 1 73 73 ASN HD21 H 1 7.02 0.01 . 2 . . . . . . . . 4840 1 523 . 1 1 73 73 ASN HD22 H 1 7.68 0.01 . 2 . . . . . . . . 4840 1 524 . 1 1 73 73 ASN N N 15 116.6 0.1 . 1 . . . . . . . . 4840 1 525 . 1 1 73 73 ASN ND2 N 15 113.6 0.1 . 1 . . . . . . . . 4840 1 526 . 1 1 73 73 ASN CA C 13 50.6 0.1 . 1 . . . . . . . . 4840 1 527 . 1 1 73 73 ASN CB C 13 36.5 0.1 . 1 . . . . . . . . 4840 1 528 . 1 1 74 74 ASN H H 1 7.50 0.01 . 1 . . . . . . . . 4840 1 529 . 1 1 74 74 ASN HA H 1 4.88 0.01 . 1 . . . . . . . . 4840 1 530 . 1 1 74 74 ASN HB2 H 1 3.07 0.01 . 2 . . . . . . . . 4840 1 531 . 1 1 74 74 ASN HB3 H 1 2.92 0.01 . 2 . . . . . . . . 4840 1 532 . 1 1 74 74 ASN HD21 H 1 7.05 0.01 . 2 . . . . . . . . 4840 1 533 . 1 1 74 74 ASN HD22 H 1 7.63 0.01 . 2 . . . . . . . . 4840 1 534 . 1 1 74 74 ASN N N 15 123.0 0.1 . 1 . . . . . . . . 4840 1 535 . 1 1 74 74 ASN ND2 N 15 114.2 0.1 . 1 . . . . . . . . 4840 1 536 . 1 1 74 74 ASN CA C 13 49.9 0.1 . 1 . . . . . . . . 4840 1 537 . 1 1 74 74 ASN CB C 13 37.2 0.1 . 1 . . . . . . . . 4840 1 538 . 1 1 75 75 PRO CA C 13 62.8 0.1 . 1 . . . . . . . . 4840 1 539 . 1 1 75 75 PRO CB C 13 29.9 0.1 . 1 . . . . . . . . 4840 1 540 . 1 1 76 76 ASP H H 1 8.99 0.01 . 1 . . . . . . . . 4840 1 541 . 1 1 76 76 ASP HA H 1 4.37 0.01 . 1 . . . . . . . . 4840 1 542 . 1 1 76 76 ASP HB2 H 1 2.93 0.01 . 2 . . . . . . . . 4840 1 543 . 1 1 76 76 ASP HB3 H 1 2.81 0.01 . 2 . . . . . . . . 4840 1 544 . 1 1 76 76 ASP N N 15 119.5 0.1 . 1 . . . . . . . . 4840 1 545 . 1 1 76 76 ASP CA C 13 53.7 0.1 . 1 . . . . . . . . 4840 1 546 . 1 1 76 76 ASP CB C 13 36.3 0.1 . 1 . . . . . . . . 4840 1 547 . 1 1 77 77 ALA H H 1 7.94 0.01 . 1 . . . . . . . . 4840 1 548 . 1 1 77 77 ALA HA H 1 5.02 0.01 . 1 . . . . . . . . 4840 1 549 . 1 1 77 77 ALA HB1 H 1 1.54 0.01 . 1 . . . . . . . . 4840 1 550 . 1 1 77 77 ALA HB2 H 1 1.54 0.01 . 1 . . . . . . . . 4840 1 551 . 1 1 77 77 ALA HB3 H 1 1.54 0.01 . 1 . . . . . . . . 4840 1 552 . 1 1 77 77 ALA N N 15 124.7 0.1 . 1 . . . . . . . . 4840 1 553 . 1 1 77 77 ALA CA C 13 49.4 0.1 . 1 . . . . . . . . 4840 1 554 . 1 1 77 77 ALA CB C 13 16.0 0.1 . 1 . . . . . . . . 4840 1 555 . 1 1 78 78 ALA H H 1 7.70 0.01 . 1 . . . . . . . . 4840 1 556 . 1 1 78 78 ALA HA H 1 4.19 0.01 . 1 . . . . . . . . 4840 1 557 . 1 1 78 78 ALA HB1 H 1 1.61 0.01 . 1 . . . . . . . . 4840 1 558 . 1 1 78 78 ALA HB2 H 1 1.61 0.01 . 1 . . . . . . . . 4840 1 559 . 1 1 78 78 ALA HB3 H 1 1.61 0.01 . 1 . . . . . . . . 4840 1 560 . 1 1 78 78 ALA N N 15 123.5 0.1 . 1 . . . . . . . . 4840 1 561 . 1 1 78 78 ALA CA C 13 53.3 0.1 . 1 . . . . . . . . 4840 1 562 . 1 1 78 78 ALA CB C 13 16.6 0.1 . 1 . . . . . . . . 4840 1 563 . 1 1 79 79 ASN H H 1 8.43 0.01 . 1 . . . . . . . . 4840 1 564 . 1 1 79 79 ASN HA H 1 5.09 0.01 . 1 . . . . . . . . 4840 1 565 . 1 1 79 79 ASN HB2 H 1 3.08 0.01 . 2 . . . . . . . . 4840 1 566 . 1 1 79 79 ASN HB3 H 1 2.78 0.01 . 2 . . . . . . . . 4840 1 567 . 1 1 79 79 ASN HD21 H 1 6.97 0.01 . 2 . . . . . . . . 4840 1 568 . 1 1 79 79 ASN HD22 H 1 7.71 0.01 . 2 . . . . . . . . 4840 1 569 . 1 1 79 79 ASN N N 15 113.4 0.1 . 1 . . . . . . . . 4840 1 570 . 1 1 79 79 ASN ND2 N 15 114.5 0.1 . 1 . . . . . . . . 4840 1 571 . 1 1 79 79 ASN CA C 13 50.3 0.1 . 1 . . . . . . . . 4840 1 572 . 1 1 79 79 ASN CB C 13 37.1 0.1 . 1 . . . . . . . . 4840 1 573 . 1 1 80 80 GLY H H 1 7.42 0.01 . 1 . . . . . . . . 4840 1 574 . 1 1 80 80 GLY HA2 H 1 4.83 0.01 . 2 . . . . . . . . 4840 1 575 . 1 1 80 80 GLY HA3 H 1 3.14 0.01 . 2 . . . . . . . . 4840 1 576 . 1 1 80 80 GLY N N 15 107.7 0.1 . 1 . . . . . . . . 4840 1 577 . 1 1 80 80 GLY CA C 13 42.4 0.1 . 1 . . . . . . . . 4840 1 578 . 1 1 81 81 PHE H H 1 8.23 0.01 . 1 . . . . . . . . 4840 1 579 . 1 1 81 81 PHE HA H 1 5.08 0.01 . 1 . . . . . . . . 4840 1 580 . 1 1 81 81 PHE HB2 H 1 2.90 0.01 . 2 . . . . . . . . 4840 1 581 . 1 1 81 81 PHE HB3 H 1 3.70 0.01 . 2 . . . . . . . . 4840 1 582 . 1 1 81 81 PHE HD1 H 1 7.14 0.01 . 1 . . . . . . . . 4840 1 583 . 1 1 81 81 PHE HD2 H 1 7.14 0.01 . 1 . . . . . . . . 4840 1 584 . 1 1 81 81 PHE HE1 H 1 7.25 0.01 . 1 . . . . . . . . 4840 1 585 . 1 1 81 81 PHE HE2 H 1 7.25 0.01 . 1 . . . . . . . . 4840 1 586 . 1 1 81 81 PHE HZ H 1 6.91 0.01 . 1 . . . . . . . . 4840 1 587 . 1 1 81 81 PHE N N 15 111.2 0.1 . 1 . . . . . . . . 4840 1 588 . 1 1 81 81 PHE CA C 13 55.0 0.1 . 1 . . . . . . . . 4840 1 589 . 1 1 81 81 PHE CB C 13 37.8 0.1 . 1 . . . . . . . . 4840 1 590 . 1 1 82 82 ILE H H 1 8.70 0.01 . 1 . . . . . . . . 4840 1 591 . 1 1 82 82 ILE HA H 1 5.15 0.01 . 1 . . . . . . . . 4840 1 592 . 1 1 82 82 ILE HB H 1 1.85 0.01 . 2 . . . . . . . . 4840 1 593 . 1 1 82 82 ILE N N 15 119.5 0.1 . 1 . . . . . . . . 4840 1 594 . 1 1 82 82 ILE CA C 13 57.5 0.1 . 1 . . . . . . . . 4840 1 595 . 1 1 82 82 ILE CB C 13 38.2 0.1 . 1 . . . . . . . . 4840 1 596 . 1 1 83 83 LEU H H 1 9.28 0.01 . 1 . . . . . . . . 4840 1 597 . 1 1 83 83 LEU HA H 1 5.50 0.01 . 1 . . . . . . . . 4840 1 598 . 1 1 83 83 LEU HB2 H 1 1.91 0.01 . 1 . . . . . . . . 4840 1 599 . 1 1 83 83 LEU HB3 H 1 1.91 0.01 . 1 . . . . . . . . 4840 1 600 . 1 1 83 83 LEU HG H 1 1.87 0.01 . 1 . . . . . . . . 4840 1 601 . 1 1 83 83 LEU HD11 H 1 0.91 0.01 . 2 . . . . . . . . 4840 1 602 . 1 1 83 83 LEU HD12 H 1 0.91 0.01 . 2 . . . . . . . . 4840 1 603 . 1 1 83 83 LEU HD13 H 1 0.91 0.01 . 2 . . . . . . . . 4840 1 604 . 1 1 83 83 LEU HD21 H 1 0.89 0.01 . 2 . . . . . . . . 4840 1 605 . 1 1 83 83 LEU HD22 H 1 0.89 0.01 . 2 . . . . . . . . 4840 1 606 . 1 1 83 83 LEU HD23 H 1 0.89 0.01 . 2 . . . . . . . . 4840 1 607 . 1 1 83 83 LEU N N 15 130.6 0.1 . 1 . . . . . . . . 4840 1 608 . 1 1 83 83 LEU CA C 13 52.3 0.1 . 1 . . . . . . . . 4840 1 609 . 1 1 83 83 LEU CB C 13 43.6 0.1 . 1 . . . . . . . . 4840 1 610 . 1 1 84 84 ASP H H 1 8.64 0.01 . 1 . . . . . . . . 4840 1 611 . 1 1 84 84 ASP HA H 1 5.26 0.01 . 1 . . . . . . . . 4840 1 612 . 1 1 84 84 ASP HB2 H 1 2.71 0.01 . 2 . . . . . . . . 4840 1 613 . 1 1 84 84 ASP HB3 H 1 2.50 0.01 . 2 . . . . . . . . 4840 1 614 . 1 1 84 84 ASP N N 15 122.7 0.1 . 1 . . . . . . . . 4840 1 615 . 1 1 84 84 ASP CA C 13 51.0 0.1 . 1 . . . . . . . . 4840 1 616 . 1 1 84 84 ASP CB C 13 42.4 0.1 . 1 . . . . . . . . 4840 1 617 . 1 1 85 85 GLY H H 1 8.93 0.01 . 1 . . . . . . . . 4840 1 618 . 1 1 85 85 GLY HA2 H 1 3.80 0.01 . 2 . . . . . . . . 4840 1 619 . 1 1 85 85 GLY HA3 H 1 4.71 0.01 . 2 . . . . . . . . 4840 1 620 . 1 1 85 85 GLY N N 15 113.8 0.1 . 1 . . . . . . . . 4840 1 621 . 1 1 85 85 GLY CA C 13 43.2 0.1 . 1 . . . . . . . . 4840 1 622 . 1 1 86 86 TYR H H 1 7.50 0.01 . 1 . . . . . . . . 4840 1 623 . 1 1 86 86 TYR HA H 1 4.36 0.01 . 1 . . . . . . . . 4840 1 624 . 1 1 86 86 TYR HB2 H 1 3.14 0.01 . 2 . . . . . . . . 4840 1 625 . 1 1 86 86 TYR HB3 H 1 2.47 0.01 . 2 . . . . . . . . 4840 1 626 . 1 1 86 86 TYR HD1 H 1 7.02 0.01 . 1 . . . . . . . . 4840 1 627 . 1 1 86 86 TYR HD2 H 1 7.02 0.01 . 1 . . . . . . . . 4840 1 628 . 1 1 86 86 TYR HE1 H 1 6.81 0.01 . 1 . . . . . . . . 4840 1 629 . 1 1 86 86 TYR HE2 H 1 6.81 0.01 . 1 . . . . . . . . 4840 1 630 . 1 1 86 86 TYR N N 15 121.7 0.1 . 1 . . . . . . . . 4840 1 631 . 1 1 86 86 TYR CA C 13 53.0 0.1 . 1 . . . . . . . . 4840 1 632 . 1 1 86 86 TYR CB C 13 40.2 0.1 . 1 . . . . . . . . 4840 1 633 . 1 1 87 87 PRO CA C 13 60.1 0.1 . 1 . . . . . . . . 4840 1 634 . 1 1 87 87 PRO CB C 13 33.5 0.1 . 1 . . . . . . . . 4840 1 635 . 1 1 88 88 ARG H H 1 8.83 0.01 . 1 . . . . . . . . 4840 1 636 . 1 1 88 88 ARG HA H 1 4.60 0.01 . 1 . . . . . . . . 4840 1 637 . 1 1 88 88 ARG HB2 H 1 1.82 0.01 . 2 . . . . . . . . 4840 1 638 . 1 1 88 88 ARG N N 15 116.3 0.1 . 1 . . . . . . . . 4840 1 639 . 1 1 88 88 ARG CA C 13 52.9 0.1 . 1 . . . . . . . . 4840 1 640 . 1 1 88 88 ARG CB C 13 28.7 0.1 . 1 . . . . . . . . 4840 1 641 . 1 1 89 89 SER H H 1 7.45 0.01 . 1 . . . . . . . . 4840 1 642 . 1 1 89 89 SER HA H 1 4.90 0.01 . 1 . . . . . . . . 4840 1 643 . 1 1 89 89 SER HB2 H 1 4.39 0.01 . 2 . . . . . . . . 4840 1 644 . 1 1 89 89 SER HB3 H 1 3.95 0.01 . 2 . . . . . . . . 4840 1 645 . 1 1 89 89 SER N N 15 112.2 0.1 . 1 . . . . . . . . 4840 1 646 . 1 1 89 89 SER CA C 13 53.2 0.1 . 1 . . . . . . . . 4840 1 647 . 1 1 89 89 SER CB C 13 64.7 0.1 . 1 . . . . . . . . 4840 1 648 . 1 1 90 90 VAL H H 1 9.53 0.01 . 1 . . . . . . . . 4840 1 649 . 1 1 90 90 VAL HA H 1 4.39 0.01 . 1 . . . . . . . . 4840 1 650 . 1 1 90 90 VAL HB H 1 1.99 0.01 . 1 . . . . . . . . 4840 1 651 . 1 1 90 90 VAL HG11 H 1 0.97 0.01 . 2 . . . . . . . . 4840 1 652 . 1 1 90 90 VAL HG12 H 1 0.97 0.01 . 2 . . . . . . . . 4840 1 653 . 1 1 90 90 VAL HG13 H 1 0.97 0.01 . 2 . . . . . . . . 4840 1 654 . 1 1 90 90 VAL HG21 H 1 0.88 0.01 . 2 . . . . . . . . 4840 1 655 . 1 1 90 90 VAL HG22 H 1 0.88 0.01 . 2 . . . . . . . . 4840 1 656 . 1 1 90 90 VAL HG23 H 1 0.88 0.01 . 2 . . . . . . . . 4840 1 657 . 1 1 90 90 VAL N N 15 124.4 0.1 . 1 . . . . . . . . 4840 1 658 . 1 1 90 90 VAL CA C 13 64.1 0.1 . 1 . . . . . . . . 4840 1 659 . 1 1 90 90 VAL CB C 13 28.8 0.1 . 1 . . . . . . . . 4840 1 660 . 1 1 91 91 GLU H H 1 8.61 0.01 . 1 . . . . . . . . 4840 1 661 . 1 1 91 91 GLU HA H 1 3.99 0.01 . 1 . . . . . . . . 4840 1 662 . 1 1 91 91 GLU HB2 H 1 2.12 0.01 . 2 . . . . . . . . 4840 1 663 . 1 1 91 91 GLU HB3 H 1 2.00 0.01 . 2 . . . . . . . . 4840 1 664 . 1 1 91 91 GLU N N 15 121.2 0.1 . 1 . . . . . . . . 4840 1 665 . 1 1 91 91 GLU CA C 13 58.6 0.1 . 1 . . . . . . . . 4840 1 666 . 1 1 91 91 GLU CB C 13 26.4 0.1 . 1 . . . . . . . . 4840 1 667 . 1 1 92 92 GLN H H 1 7.67 0.01 . 1 . . . . . . . . 4840 1 668 . 1 1 92 92 GLN HA H 1 4.20 0.01 . 1 . . . . . . . . 4840 1 669 . 1 1 92 92 GLN HB2 H 1 2.90 0.01 . 2 . . . . . . . . 4840 1 670 . 1 1 92 92 GLN HB3 H 1 2.54 0.01 . 2 . . . . . . . . 4840 1 671 . 1 1 92 92 GLN HE21 H 1 7.02 0.01 . 2 . . . . . . . . 4840 1 672 . 1 1 92 92 GLN HE22 H 1 7.35 0.01 . 2 . . . . . . . . 4840 1 673 . 1 1 92 92 GLN N N 15 120.2 0.1 . 1 . . . . . . . . 4840 1 674 . 1 1 92 92 GLN NE2 N 15 109.6 0.1 . 1 . . . . . . . . 4840 1 675 . 1 1 92 92 GLN CA C 13 56.5 0.1 . 1 . . . . . . . . 4840 1 676 . 1 1 92 92 GLN CB C 13 26.1 0.1 . 1 . . . . . . . . 4840 1 677 . 1 1 93 93 ALA H H 1 8.06 0.01 . 1 . . . . . . . . 4840 1 678 . 1 1 93 93 ALA HA H 1 3.88 0.01 . 1 . . . . . . . . 4840 1 679 . 1 1 93 93 ALA HB1 H 1 0.91 0.01 . 1 . . . . . . . . 4840 1 680 . 1 1 93 93 ALA HB2 H 1 0.91 0.01 . 1 . . . . . . . . 4840 1 681 . 1 1 93 93 ALA HB3 H 1 0.91 0.01 . 1 . . . . . . . . 4840 1 682 . 1 1 93 93 ALA N N 15 125.9 0.1 . 1 . . . . . . . . 4840 1 683 . 1 1 93 93 ALA CA C 13 53.2 0.1 . 1 . . . . . . . . 4840 1 684 . 1 1 93 93 ALA CB C 13 15.7 0.1 . 1 . . . . . . . . 4840 1 685 . 1 1 94 94 LYS H H 1 8.33 0.01 . 1 . . . . . . . . 4840 1 686 . 1 1 94 94 LYS HA H 1 4.17 0.01 . 1 . . . . . . . . 4840 1 687 . 1 1 94 94 LYS HB2 H 1 1.86 0.01 . 2 . . . . . . . . 4840 1 688 . 1 1 94 94 LYS HB3 H 1 1.98 0.01 . 2 . . . . . . . . 4840 1 689 . 1 1 94 94 LYS N N 15 120.6 0.1 . 1 . . . . . . . . 4840 1 690 . 1 1 94 94 LYS CA C 13 57.9 0.1 . 1 . . . . . . . . 4840 1 691 . 1 1 94 94 LYS CB C 13 30.2 0.1 . 1 . . . . . . . . 4840 1 692 . 1 1 95 95 ALA H H 1 7.71 0.01 . 1 . . . . . . . . 4840 1 693 . 1 1 95 95 ALA HA H 1 4.30 0.01 . 1 . . . . . . . . 4840 1 694 . 1 1 95 95 ALA HB1 H 1 1.59 0.01 . 1 . . . . . . . . 4840 1 695 . 1 1 95 95 ALA HB2 H 1 1.59 0.01 . 1 . . . . . . . . 4840 1 696 . 1 1 95 95 ALA HB3 H 1 1.59 0.01 . 1 . . . . . . . . 4840 1 697 . 1 1 95 95 ALA N N 15 124.6 0.1 . 1 . . . . . . . . 4840 1 698 . 1 1 95 95 ALA CA C 13 53.3 0.1 . 1 . . . . . . . . 4840 1 699 . 1 1 95 95 ALA CB C 13 16.8 0.1 . 1 . . . . . . . . 4840 1 700 . 1 1 96 96 LEU H H 1 9.01 0.01 . 1 . . . . . . . . 4840 1 701 . 1 1 96 96 LEU HA H 1 4.56 0.01 . 1 . . . . . . . . 4840 1 702 . 1 1 96 96 LEU N N 15 122.8 0.1 . 1 . . . . . . . . 4840 1 703 . 1 1 96 96 LEU CA C 13 55.4 0.1 . 1 . . . . . . . . 4840 1 704 . 1 1 96 96 LEU CB C 13 38.3 0.1 . 1 . . . . . . . . 4840 1 705 . 1 1 97 97 HIS H H 1 8.48 0.01 . 1 . . . . . . . . 4840 1 706 . 1 1 97 97 HIS N N 15 118.9 0.1 . 1 . . . . . . . . 4840 1 707 . 1 1 97 97 HIS CA C 13 57.8 0.1 . 1 . . . . . . . . 4840 1 708 . 1 1 97 97 HIS CB C 13 26.4 0.1 . 1 . . . . . . . . 4840 1 709 . 1 1 98 98 GLU H H 1 8.12 0.01 . 1 . . . . . . . . 4840 1 710 . 1 1 98 98 GLU HA H 1 4.30 0.01 . 1 . . . . . . . . 4840 1 711 . 1 1 98 98 GLU HB2 H 1 2.28 0.01 . 2 . . . . . . . . 4840 1 712 . 1 1 98 98 GLU N N 15 119.6 0.1 . 1 . . . . . . . . 4840 1 713 . 1 1 98 98 GLU CA C 13 57.6 0.1 . 1 . . . . . . . . 4840 1 714 . 1 1 98 98 GLU CB C 13 27.2 0.1 . 1 . . . . . . . . 4840 1 715 . 1 1 99 99 MET H H 1 8.36 0.01 . 1 . . . . . . . . 4840 1 716 . 1 1 99 99 MET HA H 1 4.10 0.01 . 1 . . . . . . . . 4840 1 717 . 1 1 99 99 MET HB2 H 1 2.09 0.01 . 2 . . . . . . . . 4840 1 718 . 1 1 99 99 MET HB3 H 1 1.92 0.01 . 2 . . . . . . . . 4840 1 719 . 1 1 99 99 MET N N 15 119.6 0.1 . 1 . . . . . . . . 4840 1 720 . 1 1 99 99 MET CA C 13 57.0 0.1 . 1 . . . . . . . . 4840 1 721 . 1 1 99 99 MET CB C 13 30.6 0.1 . 1 . . . . . . . . 4840 1 722 . 1 1 100 100 LEU H H 1 8.18 0.01 . 1 . . . . . . . . 4840 1 723 . 1 1 100 100 LEU HA H 1 4.17 0.01 . 2 . . . . . . . . 4840 1 724 . 1 1 100 100 LEU N N 15 120.3 0.1 . 1 . . . . . . . . 4840 1 725 . 1 1 100 100 LEU CA C 13 54.9 0.1 . 1 . . . . . . . . 4840 1 726 . 1 1 100 100 LEU CB C 13 37.7 0.1 . 1 . . . . . . . . 4840 1 727 . 1 1 101 101 GLU H H 1 8.94 0.01 . 1 . . . . . . . . 4840 1 728 . 1 1 101 101 GLU HA H 1 4.19 0.01 . 1 . . . . . . . . 4840 1 729 . 1 1 101 101 GLU HB2 H 1 2.11 0.01 . 1 . . . . . . . . 4840 1 730 . 1 1 101 101 GLU HB3 H 1 2.11 0.01 . 1 . . . . . . . . 4840 1 731 . 1 1 101 101 GLU HG2 H 1 2.27 0.01 . 2 . . . . . . . . 4840 1 732 . 1 1 101 101 GLU N N 15 126.0 0.1 . 1 . . . . . . . . 4840 1 733 . 1 1 101 101 GLU CA C 13 58.0 0.1 . 1 . . . . . . . . 4840 1 734 . 1 1 101 101 GLU CB C 13 27.0 0.1 . 1 . . . . . . . . 4840 1 735 . 1 1 102 102 ARG H H 1 7.90 0.01 . 1 . . . . . . . . 4840 1 736 . 1 1 102 102 ARG HA H 1 4.20 0.01 . 1 . . . . . . . . 4840 1 737 . 1 1 102 102 ARG HB2 H 1 1.96 0.01 . 1 . . . . . . . . 4840 1 738 . 1 1 102 102 ARG HB3 H 1 1.96 0.01 . 1 . . . . . . . . 4840 1 739 . 1 1 102 102 ARG N N 15 119.8 0.1 . 1 . . . . . . . . 4840 1 740 . 1 1 102 102 ARG CA C 13 57.0 0.1 . 1 . . . . . . . . 4840 1 741 . 1 1 102 102 ARG CB C 13 28.3 0.1 . 1 . . . . . . . . 4840 1 742 . 1 1 103 103 ARG H H 1 7.25 0.01 . 1 . . . . . . . . 4840 1 743 . 1 1 103 103 ARG HA H 1 4.50 0.01 . 1 . . . . . . . . 4840 1 744 . 1 1 103 103 ARG HB2 H 1 1.76 0.01 . 1 . . . . . . . . 4840 1 745 . 1 1 103 103 ARG HB3 H 1 1.76 0.01 . 1 . . . . . . . . 4840 1 746 . 1 1 103 103 ARG N N 15 117.5 0.1 . 1 . . . . . . . . 4840 1 747 . 1 1 103 103 ARG CA C 13 53.3 0.1 . 1 . . . . . . . . 4840 1 748 . 1 1 103 103 ARG CB C 13 28.9 0.1 . 1 . . . . . . . . 4840 1 749 . 1 1 104 104 GLY H H 1 8.11 0.01 . 1 . . . . . . . . 4840 1 750 . 1 1 104 104 GLY HA2 H 1 4.14 0.01 . 2 . . . . . . . . 4840 1 751 . 1 1 104 104 GLY HA3 H 1 4.04 0.01 . 2 . . . . . . . . 4840 1 752 . 1 1 104 104 GLY N N 15 109.8 0.1 . 1 . . . . . . . . 4840 1 753 . 1 1 104 104 GLY CA C 13 44.0 0.1 . 1 . . . . . . . . 4840 1 754 . 1 1 105 105 THR H H 1 8.06 0.01 . 1 . . . . . . . . 4840 1 755 . 1 1 105 105 THR HA H 1 4.85 0.01 . 1 . . . . . . . . 4840 1 756 . 1 1 105 105 THR HB H 1 4.00 0.01 . 1 . . . . . . . . 4840 1 757 . 1 1 105 105 THR HG21 H 1 1.08 0.01 . 1 . . . . . . . . 4840 1 758 . 1 1 105 105 THR HG22 H 1 1.08 0.01 . 1 . . . . . . . . 4840 1 759 . 1 1 105 105 THR HG23 H 1 1.08 0.01 . 1 . . . . . . . . 4840 1 760 . 1 1 105 105 THR N N 15 114.9 0.1 . 1 . . . . . . . . 4840 1 761 . 1 1 105 105 THR CA C 13 57.5 0.1 . 1 . . . . . . . . 4840 1 762 . 1 1 105 105 THR CB C 13 68.4 0.1 . 1 . . . . . . . . 4840 1 763 . 1 1 106 106 ASP H H 1 8.62 0.01 . 1 . . . . . . . . 4840 1 764 . 1 1 106 106 ASP HA H 1 4.82 0.01 . 1 . . . . . . . . 4840 1 765 . 1 1 106 106 ASP HB2 H 1 2.81 0.01 . 2 . . . . . . . . 4840 1 766 . 1 1 106 106 ASP HB3 H 1 2.67 0.01 . 2 . . . . . . . . 4840 1 767 . 1 1 106 106 ASP N N 15 117.7 0.1 . 1 . . . . . . . . 4840 1 768 . 1 1 106 106 ASP CA C 13 50.7 0.1 . 1 . . . . . . . . 4840 1 769 . 1 1 106 106 ASP CB C 13 40.7 0.1 . 1 . . . . . . . . 4840 1 770 . 1 1 107 107 ILE H H 1 9.27 0.01 . 1 . . . . . . . . 4840 1 771 . 1 1 107 107 ILE HA H 1 3.87 0.01 . 1 . . . . . . . . 4840 1 772 . 1 1 107 107 ILE N N 15 120.5 0.1 . 1 . . . . . . . . 4840 1 773 . 1 1 107 107 ILE CA C 13 57.3 0.1 . 1 . . . . . . . . 4840 1 774 . 1 1 107 107 ILE CB C 13 35.7 0.1 . 1 . . . . . . . . 4840 1 775 . 1 1 108 108 ASP H H 1 9.18 0.01 . 1 . . . . . . . . 4840 1 776 . 1 1 108 108 ASP HA H 1 4.86 0.01 . 1 . . . . . . . . 4840 1 777 . 1 1 108 108 ASP HB2 H 1 2.61 0.01 . 2 . . . . . . . . 4840 1 778 . 1 1 108 108 ASP HB3 H 1 2.75 0.01 . 2 . . . . . . . . 4840 1 779 . 1 1 108 108 ASP N N 15 125.0 0.1 . 1 . . . . . . . . 4840 1 780 . 1 1 108 108 ASP CA C 13 54.2 0.1 . 1 . . . . . . . . 4840 1 781 . 1 1 108 108 ASP CB C 13 41.8 0.1 . 1 . . . . . . . . 4840 1 782 . 1 1 109 109 ALA H H 1 7.58 0.01 . 1 . . . . . . . . 4840 1 783 . 1 1 109 109 ALA HA H 1 4.84 0.01 . 1 . . . . . . . . 4840 1 784 . 1 1 109 109 ALA HB1 H 1 1.29 0.01 . 1 . . . . . . . . 4840 1 785 . 1 1 109 109 ALA HB2 H 1 1.29 0.01 . 1 . . . . . . . . 4840 1 786 . 1 1 109 109 ALA HB3 H 1 1.29 0.01 . 1 . . . . . . . . 4840 1 787 . 1 1 109 109 ALA N N 15 118.7 0.1 . 1 . . . . . . . . 4840 1 788 . 1 1 109 109 ALA CA C 13 49.5 0.1 . 1 . . . . . . . . 4840 1 789 . 1 1 109 109 ALA CB C 13 20.5 0.1 . 1 . . . . . . . . 4840 1 790 . 1 1 110 110 VAL H H 1 7.98 0.01 . 1 . . . . . . . . 4840 1 791 . 1 1 110 110 VAL HA H 1 4.65 0.01 . 1 . . . . . . . . 4840 1 792 . 1 1 110 110 VAL HB H 1 1.68 0.01 . 1 . . . . . . . . 4840 1 793 . 1 1 110 110 VAL HG11 H 1 0.45 0.01 . 2 . . . . . . . . 4840 1 794 . 1 1 110 110 VAL HG12 H 1 0.45 0.01 . 2 . . . . . . . . 4840 1 795 . 1 1 110 110 VAL HG13 H 1 0.45 0.01 . 2 . . . . . . . . 4840 1 796 . 1 1 110 110 VAL HG21 H 1 0.60 0.01 . 2 . . . . . . . . 4840 1 797 . 1 1 110 110 VAL HG22 H 1 0.60 0.01 . 2 . . . . . . . . 4840 1 798 . 1 1 110 110 VAL HG23 H 1 0.60 0.01 . 2 . . . . . . . . 4840 1 799 . 1 1 110 110 VAL N N 15 122.8 0.1 . 1 . . . . . . . . 4840 1 800 . 1 1 110 110 VAL CA C 13 58.7 0.1 . 1 . . . . . . . . 4840 1 801 . 1 1 110 110 VAL CB C 13 31.5 0.1 . 1 . . . . . . . . 4840 1 802 . 1 1 111 111 LEU H H 1 8.97 0.01 . 1 . . . . . . . . 4840 1 803 . 1 1 111 111 LEU HA H 1 5.14 0.01 . 1 . . . . . . . . 4840 1 804 . 1 1 111 111 LEU HB2 H 1 1.86 0.01 . 1 . . . . . . . . 4840 1 805 . 1 1 111 111 LEU HB3 H 1 1.86 0.01 . 1 . . . . . . . . 4840 1 806 . 1 1 111 111 LEU HG H 1 1.04 0.01 . 1 . . . . . . . . 4840 1 807 . 1 1 111 111 LEU HD21 H 1 0.93 0.01 . 2 . . . . . . . . 4840 1 808 . 1 1 111 111 LEU HD22 H 1 0.93 0.01 . 2 . . . . . . . . 4840 1 809 . 1 1 111 111 LEU HD23 H 1 0.93 0.01 . 2 . . . . . . . . 4840 1 810 . 1 1 111 111 LEU N N 15 127.2 0.1 . 1 . . . . . . . . 4840 1 811 . 1 1 111 111 LEU CA C 13 50.8 0.1 . 1 . . . . . . . . 4840 1 812 . 1 1 111 111 LEU CB C 13 40.7 0.1 . 1 . . . . . . . . 4840 1 813 . 1 1 112 112 GLU H H 1 8.61 0.01 . 1 . . . . . . . . 4840 1 814 . 1 1 112 112 GLU HA H 1 4.94 0.01 . 1 . . . . . . . . 4840 1 815 . 1 1 112 112 GLU HB2 H 1 2.27 0.01 . 2 . . . . . . . . 4840 1 816 . 1 1 112 112 GLU N N 15 125.2 0.1 . 1 . . . . . . . . 4840 1 817 . 1 1 112 112 GLU CA C 13 52.0 0.1 . 1 . . . . . . . . 4840 1 818 . 1 1 112 112 GLU CB C 13 28.8 0.1 . 1 . . . . . . . . 4840 1 819 . 1 1 113 113 PHE H H 1 9.23 0.01 . 1 . . . . . . . . 4840 1 820 . 1 1 113 113 PHE HA H 1 4.85 0.01 . 1 . . . . . . . . 4840 1 821 . 1 1 113 113 PHE HB2 H 1 3.15 0.01 . 2 . . . . . . . . 4840 1 822 . 1 1 113 113 PHE HB3 H 1 2.75 0.01 . 2 . . . . . . . . 4840 1 823 . 1 1 113 113 PHE HD1 H 1 7.28 0.01 . 1 . . . . . . . . 4840 1 824 . 1 1 113 113 PHE HD2 H 1 7.28 0.01 . 1 . . . . . . . . 4840 1 825 . 1 1 113 113 PHE HE1 H 1 7.16 0.01 . 1 . . . . . . . . 4840 1 826 . 1 1 113 113 PHE HE2 H 1 7.16 0.01 . 1 . . . . . . . . 4840 1 827 . 1 1 113 113 PHE N N 15 130.0 0.1 . 1 . . . . . . . . 4840 1 828 . 1 1 113 113 PHE CA C 13 55.4 0.1 . 1 . . . . . . . . 4840 1 829 . 1 1 113 113 PHE CB C 13 36.1 0.1 . 1 . . . . . . . . 4840 1 830 . 1 1 114 114 ARG H H 1 8.87 0.01 . 1 . . . . . . . . 4840 1 831 . 1 1 114 114 ARG HA H 1 4.70 0.01 . 1 . . . . . . . . 4840 1 832 . 1 1 114 114 ARG N N 15 126.0 0.1 . 1 . . . . . . . . 4840 1 833 . 1 1 114 114 ARG CA C 13 53.3 0.1 . 1 . . . . . . . . 4840 1 834 . 1 1 114 114 ARG CB C 13 29.8 0.1 . 1 . . . . . . . . 4840 1 835 . 1 1 115 115 VAL H H 1 8.54 0.01 . 1 . . . . . . . . 4840 1 836 . 1 1 115 115 VAL HA H 1 4.37 0.01 . 1 . . . . . . . . 4840 1 837 . 1 1 115 115 VAL HB H 1 1.98 0.01 . 1 . . . . . . . . 4840 1 838 . 1 1 115 115 VAL HG11 H 1 0.99 0.01 . 1 . . . . . . . . 4840 1 839 . 1 1 115 115 VAL HG12 H 1 0.99 0.01 . 1 . . . . . . . . 4840 1 840 . 1 1 115 115 VAL HG13 H 1 0.99 0.01 . 1 . . . . . . . . 4840 1 841 . 1 1 115 115 VAL HG21 H 1 0.99 0.01 . 1 . . . . . . . . 4840 1 842 . 1 1 115 115 VAL HG22 H 1 0.99 0.01 . 1 . . . . . . . . 4840 1 843 . 1 1 115 115 VAL HG23 H 1 0.99 0.01 . 1 . . . . . . . . 4840 1 844 . 1 1 115 115 VAL N N 15 124.9 0.1 . 1 . . . . . . . . 4840 1 845 . 1 1 115 115 VAL CA C 13 58.3 0.1 . 1 . . . . . . . . 4840 1 846 . 1 1 115 115 VAL CB C 13 32.5 0.1 . 1 . . . . . . . . 4840 1 847 . 1 1 116 116 SER H H 1 7.46 0.01 . 1 . . . . . . . . 4840 1 848 . 1 1 116 116 SER HA H 1 4.47 0.01 . 1 . . . . . . . . 4840 1 849 . 1 1 116 116 SER HB2 H 1 4.08 0.01 . 2 . . . . . . . . 4840 1 850 . 1 1 116 116 SER HB3 H 1 3.96 0.01 . 2 . . . . . . . . 4840 1 851 . 1 1 116 116 SER N N 15 120.7 0.1 . 1 . . . . . . . . 4840 1 852 . 1 1 116 116 SER CA C 13 55.8 0.1 . 1 . . . . . . . . 4840 1 853 . 1 1 116 116 SER CB C 13 62.4 0.1 . 1 . . . . . . . . 4840 1 854 . 1 1 117 117 GLU H H 1 9.24 0.01 . 1 . . . . . . . . 4840 1 855 . 1 1 117 117 GLU HA H 1 4.34 0.01 . 1 . . . . . . . . 4840 1 856 . 1 1 117 117 GLU HB2 H 1 2.18 0.01 . 2 . . . . . . . . 4840 1 857 . 1 1 117 117 GLU HB3 H 1 2.08 0.01 . 2 . . . . . . . . 4840 1 858 . 1 1 117 117 GLU HG2 H 1 2.44 0.01 . 1 . . . . . . . . 4840 1 859 . 1 1 117 117 GLU HG3 H 1 2.44 0.01 . 1 . . . . . . . . 4840 1 860 . 1 1 117 117 GLU N N 15 124.2 0.1 . 1 . . . . . . . . 4840 1 861 . 1 1 117 117 GLU CA C 13 58.7 0.1 . 1 . . . . . . . . 4840 1 862 . 1 1 117 117 GLU CB C 13 27.5 0.1 . 1 . . . . . . . . 4840 1 863 . 1 1 118 118 GLU H H 1 8.99 0.01 . 1 . . . . . . . . 4840 1 864 . 1 1 118 118 GLU HA H 1 4.10 0.01 . 1 . . . . . . . . 4840 1 865 . 1 1 118 118 GLU HB2 H 1 2.10 0.01 . 2 . . . . . . . . 4840 1 866 . 1 1 118 118 GLU HB3 H 1 2.15 0.01 . 2 . . . . . . . . 4840 1 867 . 1 1 118 118 GLU HG2 H 1 2.44 0.01 . 1 . . . . . . . . 4840 1 868 . 1 1 118 118 GLU HG3 H 1 2.44 0.01 . 1 . . . . . . . . 4840 1 869 . 1 1 118 118 GLU N N 15 117.4 0.1 . 1 . . . . . . . . 4840 1 870 . 1 1 118 118 GLU CA C 13 58.0 0.1 . 1 . . . . . . . . 4840 1 871 . 1 1 118 118 GLU CB C 13 26.7 0.1 . 1 . . . . . . . . 4840 1 872 . 1 1 119 119 VAL H H 1 7.31 0.01 . 1 . . . . . . . . 4840 1 873 . 1 1 119 119 VAL HA H 1 3.88 0.01 . 1 . . . . . . . . 4840 1 874 . 1 1 119 119 VAL HB H 1 2.15 0.01 . 1 . . . . . . . . 4840 1 875 . 1 1 119 119 VAL HG11 H 1 1.10 0.01 . 2 . . . . . . . . 4840 1 876 . 1 1 119 119 VAL HG12 H 1 1.10 0.01 . 2 . . . . . . . . 4840 1 877 . 1 1 119 119 VAL HG13 H 1 1.10 0.01 . 2 . . . . . . . . 4840 1 878 . 1 1 119 119 VAL HG21 H 1 0.99 0.01 . 2 . . . . . . . . 4840 1 879 . 1 1 119 119 VAL HG22 H 1 0.99 0.01 . 2 . . . . . . . . 4840 1 880 . 1 1 119 119 VAL HG23 H 1 0.99 0.01 . 2 . . . . . . . . 4840 1 881 . 1 1 119 119 VAL N N 15 121.4 0.1 . 1 . . . . . . . . 4840 1 882 . 1 1 119 119 VAL CA C 13 63.4 0.1 . 1 . . . . . . . . 4840 1 883 . 1 1 119 119 VAL CB C 13 29.5 0.1 . 1 . . . . . . . . 4840 1 884 . 1 1 120 120 LEU H H 1 8.19 0.01 . 1 . . . . . . . . 4840 1 885 . 1 1 120 120 LEU HA H 1 3.95 0.01 . 1 . . . . . . . . 4840 1 886 . 1 1 120 120 LEU HB2 H 1 1.75 0.01 . 2 . . . . . . . . 4840 1 887 . 1 1 120 120 LEU N N 15 122.1 0.1 . 1 . . . . . . . . 4840 1 888 . 1 1 120 120 LEU CA C 13 56.1 0.1 . 1 . . . . . . . . 4840 1 889 . 1 1 120 120 LEU CB C 13 39.5 0.1 . 1 . . . . . . . . 4840 1 890 . 1 1 121 121 LEU H H 1 8.38 0.01 . 1 . . . . . . . . 4840 1 891 . 1 1 121 121 LEU HA H 1 4.03 0.01 . 1 . . . . . . . . 4840 1 892 . 1 1 121 121 LEU HB2 H 1 1.76 0.01 . 1 . . . . . . . . 4840 1 893 . 1 1 121 121 LEU HB3 H 1 1.76 0.01 . 1 . . . . . . . . 4840 1 894 . 1 1 121 121 LEU HG H 1 1.73 0.01 . 1 . . . . . . . . 4840 1 895 . 1 1 121 121 LEU HD11 H 1 1.00 0.01 . 2 . . . . . . . . 4840 1 896 . 1 1 121 121 LEU HD12 H 1 1.00 0.01 . 2 . . . . . . . . 4840 1 897 . 1 1 121 121 LEU HD13 H 1 1.00 0.01 . 2 . . . . . . . . 4840 1 898 . 1 1 121 121 LEU HD21 H 1 0.91 0.01 . 2 . . . . . . . . 4840 1 899 . 1 1 121 121 LEU HD22 H 1 0.91 0.01 . 2 . . . . . . . . 4840 1 900 . 1 1 121 121 LEU HD23 H 1 0.91 0.01 . 2 . . . . . . . . 4840 1 901 . 1 1 121 121 LEU N N 15 118.5 0.1 . 1 . . . . . . . . 4840 1 902 . 1 1 121 121 LEU CA C 13 56.5 0.1 . 1 . . . . . . . . 4840 1 903 . 1 1 121 121 LEU CB C 13 39.8 0.1 . 1 . . . . . . . . 4840 1 904 . 1 1 122 122 GLU H H 1 7.38 0.01 . 1 . . . . . . . . 4840 1 905 . 1 1 122 122 GLU HA H 1 4.08 0.01 . 1 . . . . . . . . 4840 1 906 . 1 1 122 122 GLU HB2 H 1 2.27 0.01 . 2 . . . . . . . . 4840 1 907 . 1 1 122 122 GLU HG2 H 1 2.37 0.01 . 2 . . . . . . . . 4840 1 908 . 1 1 122 122 GLU HG3 H 1 2.47 0.01 . 2 . . . . . . . . 4840 1 909 . 1 1 122 122 GLU N N 15 118.1 0.1 . 1 . . . . . . . . 4840 1 910 . 1 1 122 122 GLU CA C 13 57.2 0.1 . 1 . . . . . . . . 4840 1 911 . 1 1 122 122 GLU CB C 13 27.5 0.1 . 1 . . . . . . . . 4840 1 912 . 1 1 123 123 ARG H H 1 8.30 0.01 . 1 . . . . . . . . 4840 1 913 . 1 1 123 123 ARG HA H 1 4.19 0.01 . 1 . . . . . . . . 4840 1 914 . 1 1 123 123 ARG N N 15 119.4 0.1 . 1 . . . . . . . . 4840 1 915 . 1 1 123 123 ARG CA C 13 56.7 0.1 . 1 . . . . . . . . 4840 1 916 . 1 1 123 123 ARG CB C 13 28.6 0.1 . 1 . . . . . . . . 4840 1 917 . 1 1 124 124 LEU H H 1 8.42 0.01 . 1 . . . . . . . . 4840 1 918 . 1 1 124 124 LEU HA H 1 4.23 0.01 . 1 . . . . . . . . 4840 1 919 . 1 1 124 124 LEU N N 15 119.5 0.1 . 1 . . . . . . . . 4840 1 920 . 1 1 124 124 LEU CA C 13 54.8 0.1 . 1 . . . . . . . . 4840 1 921 . 1 1 124 124 LEU CB C 13 40.0 0.1 . 1 . . . . . . . . 4840 1 922 . 1 1 125 125 LYS H H 1 8.20 0.01 . 1 . . . . . . . . 4840 1 923 . 1 1 125 125 LYS HA H 1 4.21 0.01 . 1 . . . . . . . . 4840 1 924 . 1 1 125 125 LYS HB2 H 1 1.96 0.01 . 2 . . . . . . . . 4840 1 925 . 1 1 125 125 LYS N N 15 120.7 0.01 . 1 . . . . . . . . 4840 1 926 . 1 1 125 125 LYS CA C 13 56.6 0.1 . 1 . . . . . . . . 4840 1 927 . 1 1 125 125 LYS CB C 13 29.9 0.1 . 1 . . . . . . . . 4840 1 928 . 1 1 126 126 GLY H H 1 8.14 0.01 . 1 . . . . . . . . 4840 1 929 . 1 1 126 126 GLY HA2 H 1 4.04 0.01 . 2 . . . . . . . . 4840 1 930 . 1 1 126 126 GLY HA3 H 1 4.10 0.01 . 2 . . . . . . . . 4840 1 931 . 1 1 126 126 GLY N N 15 108.0 0.1 . 1 . . . . . . . . 4840 1 932 . 1 1 126 126 GLY CA C 13 43.6 0.1 . 1 . . . . . . . . 4840 1 933 . 1 1 127 127 ARG H H 1 7.74 0.01 . 1 . . . . . . . . 4840 1 934 . 1 1 127 127 ARG N N 15 120.0 0.1 . 1 . . . . . . . . 4840 1 935 . 1 1 127 127 ARG CA C 13 54.2 0.1 . 1 . . . . . . . . 4840 1 936 . 1 1 127 127 ARG CB C 13 28.6 0.1 . 1 . . . . . . . . 4840 1 937 . 1 1 128 128 GLY H H 1 8.03 0.01 . 1 . . . . . . . . 4840 1 938 . 1 1 128 128 GLY N N 15 109.0 0.1 . 1 . . . . . . . . 4840 1 939 . 1 1 128 128 GLY CA C 13 43.4 0.1 . 1 . . . . . . . . 4840 1 940 . 1 1 129 129 ARG H H 1 8.46 0.01 . 1 . . . . . . . . 4840 1 941 . 1 1 129 129 ARG N N 15 121.6 0.1 . 1 . . . . . . . . 4840 1 942 . 1 1 129 129 ARG CA C 13 53.8 0.1 . 1 . . . . . . . . 4840 1 943 . 1 1 129 129 ARG CB C 13 28.6 0.1 . 1 . . . . . . . . 4840 1 944 . 1 1 130 130 ALA H H 1 8.59 0.01 . 1 . . . . . . . . 4840 1 945 . 1 1 130 130 ALA HA H 1 4.33 0.01 . 1 . . . . . . . . 4840 1 946 . 1 1 130 130 ALA HB1 H 1 1.50 0.01 . 1 . . . . . . . . 4840 1 947 . 1 1 130 130 ALA HB2 H 1 1.50 0.01 . 1 . . . . . . . . 4840 1 948 . 1 1 130 130 ALA HB3 H 1 1.50 0.01 . 1 . . . . . . . . 4840 1 949 . 1 1 130 130 ALA N N 15 125.8 0.1 . 1 . . . . . . . . 4840 1 950 . 1 1 130 130 ALA CA C 13 51.6 0.1 . 1 . . . . . . . . 4840 1 951 . 1 1 130 130 ALA CB C 13 16.6 0.1 . 1 . . . . . . . . 4840 1 952 . 1 1 131 131 ASP H H 1 8.31 0.01 . 1 . . . . . . . . 4840 1 953 . 1 1 131 131 ASP HA H 1 4.70 0.01 . 1 . . . . . . . . 4840 1 954 . 1 1 131 131 ASP HB2 H 1 2.79 0.01 . 2 . . . . . . . . 4840 1 955 . 1 1 131 131 ASP N N 15 116.4 0.1 . 1 . . . . . . . . 4840 1 956 . 1 1 131 131 ASP CA C 13 51.7 0.1 . 1 . . . . . . . . 4840 1 957 . 1 1 131 131 ASP CB C 13 38.3 0.1 . 1 . . . . . . . . 4840 1 958 . 1 1 132 132 ASP H H 1 7.79 0.01 . 1 . . . . . . . . 4840 1 959 . 1 1 132 132 ASP HA H 1 4.85 0.01 . 1 . . . . . . . . 4840 1 960 . 1 1 132 132 ASP HB2 H 1 2.75 0.01 . 1 . . . . . . . . 4840 1 961 . 1 1 132 132 ASP HB3 H 1 2.75 0.01 . 1 . . . . . . . . 4840 1 962 . 1 1 132 132 ASP N N 15 121.5 0.1 . 1 . . . . . . . . 4840 1 963 . 1 1 132 132 ASP CA C 13 52.3 0.1 . 1 . . . . . . . . 4840 1 964 . 1 1 132 132 ASP CB C 13 39.0 0.1 . 1 . . . . . . . . 4840 1 965 . 1 1 133 133 THR H H 1 7.74 0.01 . 1 . . . . . . . . 4840 1 966 . 1 1 133 133 THR HA H 1 4.52 0.01 . 1 . . . . . . . . 4840 1 967 . 1 1 133 133 THR N N 15 112.0 0.1 . 1 . . . . . . . . 4840 1 968 . 1 1 133 133 THR CA C 13 58.9 0.1 . 1 . . . . . . . . 4840 1 969 . 1 1 133 133 THR CB C 13 68.4 0.1 . 1 . . . . . . . . 4840 1 970 . 1 1 134 134 ASP H H 1 8.78 0.01 . 1 . . . . . . . . 4840 1 971 . 1 1 134 134 ASP HA H 1 4.32 0.01 . 1 . . . . . . . . 4840 1 972 . 1 1 134 134 ASP HB2 H 1 2.75 0.01 . 1 . . . . . . . . 4840 1 973 . 1 1 134 134 ASP HB3 H 1 2.75 0.01 . 1 . . . . . . . . 4840 1 974 . 1 1 134 134 ASP N N 15 121.8 0.1 . 1 . . . . . . . . 4840 1 975 . 1 1 134 134 ASP CA C 13 55.5 0.1 . 1 . . . . . . . . 4840 1 976 . 1 1 134 134 ASP CB C 13 37.9 0.1 . 1 . . . . . . . . 4840 1 977 . 1 1 135 135 ASP H H 1 8.46 0.01 . 1 . . . . . . . . 4840 1 978 . 1 1 135 135 ASP HA H 1 4.41 0.01 . 1 . . . . . . . . 4840 1 979 . 1 1 135 135 ASP HB2 H 1 2.67 0.01 . 2 . . . . . . . . 4840 1 980 . 1 1 135 135 ASP HB3 H 1 2.77 0.01 . 2 . . . . . . . . 4840 1 981 . 1 1 135 135 ASP N N 15 116.9 0.1 . 1 . . . . . . . . 4840 1 982 . 1 1 135 135 ASP CA C 13 55.0 0.1 . 1 . . . . . . . . 4840 1 983 . 1 1 135 135 ASP CB C 13 38.2 0.1 . 1 . . . . . . . . 4840 1 984 . 1 1 136 136 VAL H H 1 7.55 0.01 . 1 . . . . . . . . 4840 1 985 . 1 1 136 136 VAL HA H 1 3.84 0.01 . 1 . . . . . . . . 4840 1 986 . 1 1 136 136 VAL HB H 1 2.33 0.01 . 1 . . . . . . . . 4840 1 987 . 1 1 136 136 VAL HG11 H 1 1.19 0.01 . 2 . . . . . . . . 4840 1 988 . 1 1 136 136 VAL HG12 H 1 1.19 0.01 . 2 . . . . . . . . 4840 1 989 . 1 1 136 136 VAL HG13 H 1 1.19 0.01 . 2 . . . . . . . . 4840 1 990 . 1 1 136 136 VAL HG21 H 1 1.08 0.01 . 2 . . . . . . . . 4840 1 991 . 1 1 136 136 VAL HG22 H 1 1.08 0.01 . 2 . . . . . . . . 4840 1 992 . 1 1 136 136 VAL HG23 H 1 1.08 0.01 . 2 . . . . . . . . 4840 1 993 . 1 1 136 136 VAL N N 15 121.7 0.1 . 1 . . . . . . . . 4840 1 994 . 1 1 136 136 VAL CA C 13 64.0 0.1 . 1 . . . . . . . . 4840 1 995 . 1 1 136 136 VAL CB C 13 29.9 0.1 . 1 . . . . . . . . 4840 1 996 . 1 1 137 137 ILE H H 1 8.00 0.01 . 1 . . . . . . . . 4840 1 997 . 1 1 137 137 ILE HA H 1 3.71 0.01 . 1 . . . . . . . . 4840 1 998 . 1 1 137 137 ILE N N 15 122.2 0.1 . 1 . . . . . . . . 4840 1 999 . 1 1 137 137 ILE CA C 13 62.9 0.1 . 1 . . . . . . . . 4840 1 1000 . 1 1 137 137 ILE CB C 13 35.3 0.1 . 1 . . . . . . . . 4840 1 1001 . 1 1 138 138 LEU H H 1 8.65 0.01 . 1 . . . . . . . . 4840 1 1002 . 1 1 138 138 LEU HA H 1 4.20 0.01 . 1 . . . . . . . . 4840 1 1003 . 1 1 138 138 LEU HB2 H 1 2.00 0.01 . 2 . . . . . . . . 4840 1 1004 . 1 1 138 138 LEU HG H 1 1.63 0.01 . 1 . . . . . . . . 4840 1 1005 . 1 1 138 138 LEU HD21 H 1 1.00 0.01 . 2 . . . . . . . . 4840 1 1006 . 1 1 138 138 LEU HD22 H 1 1.00 0.01 . 2 . . . . . . . . 4840 1 1007 . 1 1 138 138 LEU HD23 H 1 1.00 0.01 . 2 . . . . . . . . 4840 1 1008 . 1 1 138 138 LEU N N 15 120.5 0.1 . 1 . . . . . . . . 4840 1 1009 . 1 1 138 138 LEU CA C 13 56.2 0.1 . 1 . . . . . . . . 4840 1 1010 . 1 1 138 138 LEU CB C 13 39.1 0.1 . 1 . . . . . . . . 4840 1 1011 . 1 1 139 139 ASN H H 1 8.17 0.01 . 1 . . . . . . . . 4840 1 1012 . 1 1 139 139 ASN HA H 1 4.65 0.01 . 1 . . . . . . . . 4840 1 1013 . 1 1 139 139 ASN HB2 H 1 3.04 0.01 . 2 . . . . . . . . 4840 1 1014 . 1 1 139 139 ASN HB3 H 1 2.96 0.01 . 2 . . . . . . . . 4840 1 1015 . 1 1 139 139 ASN HD21 H 1 7.00 0.01 . 2 . . . . . . . . 4840 1 1016 . 1 1 139 139 ASN HD22 H 1 7.78 0.01 . 2 . . . . . . . . 4840 1 1017 . 1 1 139 139 ASN N N 15 119.5 0.1 . 1 . . . . . . . . 4840 1 1018 . 1 1 139 139 ASN ND2 N 15 115.3 0.1 . 1 . . . . . . . . 4840 1 1019 . 1 1 139 139 ASN CA C 13 54.7 0.1 . 1 . . . . . . . . 4840 1 1020 . 1 1 139 139 ASN CB C 13 36.3 0.1 . 1 . . . . . . . . 4840 1 1021 . 1 1 140 140 ARG H H 1 8.17 0.01 . 1 . . . . . . . . 4840 1 1022 . 1 1 140 140 ARG HA H 1 4.19 0.01 . 1 . . . . . . . . 4840 1 1023 . 1 1 140 140 ARG N N 15 120.7 0.1 . 1 . . . . . . . . 4840 1 1024 . 1 1 140 140 ARG CA C 13 57.4 0.1 . 1 . . . . . . . . 4840 1 1025 . 1 1 140 140 ARG CB C 13 27.7 0.1 . 1 . . . . . . . . 4840 1 1026 . 1 1 141 141 MET H H 1 8.24 0.01 . 1 . . . . . . . . 4840 1 1027 . 1 1 141 141 MET HA H 1 4.38 0.01 . 1 . . . . . . . . 4840 1 1028 . 1 1 141 141 MET HB2 H 1 2.39 0.01 . 2 . . . . . . . . 4840 1 1029 . 1 1 141 141 MET N N 15 120.4 0.1 . 1 . . . . . . . . 4840 1 1030 . 1 1 141 141 MET CA C 13 56.9 0.1 . 1 . . . . . . . . 4840 1 1031 . 1 1 141 141 MET CB C 13 30.5 0.1 . 1 . . . . . . . . 4840 1 1032 . 1 1 142 142 LYS H H 1 7.95 0.01 . 1 . . . . . . . . 4840 1 1033 . 1 1 142 142 LYS HA H 1 4.13 0.01 . 1 . . . . . . . . 4840 1 1034 . 1 1 142 142 LYS HB2 H 1 2.20 0.01 . 1 . . . . . . . . 4840 1 1035 . 1 1 142 142 LYS HB3 H 1 2.20 0.01 . 1 . . . . . . . . 4840 1 1036 . 1 1 142 142 LYS N N 15 122.7 0.1 . 1 . . . . . . . . 4840 1 1037 . 1 1 142 142 LYS CA C 13 58.0 0.1 . 1 . . . . . . . . 4840 1 1038 . 1 1 142 142 LYS CB C 13 29.8 0.1 . 1 . . . . . . . . 4840 1 1039 . 1 1 143 143 VAL H H 1 8.07 0.01 . 1 . . . . . . . . 4840 1 1040 . 1 1 143 143 VAL HA H 1 3.90 0.01 . 1 . . . . . . . . 4840 1 1041 . 1 1 143 143 VAL HB H 1 2.24 0.01 . 1 . . . . . . . . 4840 1 1042 . 1 1 143 143 VAL HG11 H 1 1.21 0.01 . 2 . . . . . . . . 4840 1 1043 . 1 1 143 143 VAL HG12 H 1 1.21 0.01 . 2 . . . . . . . . 4840 1 1044 . 1 1 143 143 VAL HG13 H 1 1.21 0.01 . 2 . . . . . . . . 4840 1 1045 . 1 1 143 143 VAL HG21 H 1 1.10 0.01 . 2 . . . . . . . . 4840 1 1046 . 1 1 143 143 VAL HG22 H 1 1.10 0.01 . 2 . . . . . . . . 4840 1 1047 . 1 1 143 143 VAL HG23 H 1 1.10 0.01 . 2 . . . . . . . . 4840 1 1048 . 1 1 143 143 VAL N N 15 119.7 0.1 . 1 . . . . . . . . 4840 1 1049 . 1 1 143 143 VAL CA C 13 64.4 0.1 . 1 . . . . . . . . 4840 1 1050 . 1 1 143 143 VAL CB C 13 29.5 0.1 . 1 . . . . . . . . 4840 1 1051 . 1 1 144 144 TYR H H 1 7.87 0.01 . 1 . . . . . . . . 4840 1 1052 . 1 1 144 144 TYR HA H 1 4.42 0.01 . 1 . . . . . . . . 4840 1 1053 . 1 1 144 144 TYR HB2 H 1 3.34 0.01 . 1 . . . . . . . . 4840 1 1054 . 1 1 144 144 TYR HB3 H 1 3.34 0.01 . 1 . . . . . . . . 4840 1 1055 . 1 1 144 144 TYR HD1 H 1 7.23 0.01 . 1 . . . . . . . . 4840 1 1056 . 1 1 144 144 TYR HD2 H 1 7.23 0.01 . 1 . . . . . . . . 4840 1 1057 . 1 1 144 144 TYR HE1 H 1 6.86 0.01 . 1 . . . . . . . . 4840 1 1058 . 1 1 144 144 TYR HE2 H 1 6.86 0.01 . 1 . . . . . . . . 4840 1 1059 . 1 1 144 144 TYR N N 15 119.7 0.1 . 1 . . . . . . . . 4840 1 1060 . 1 1 144 144 TYR CA C 13 59.4 0.1 . 1 . . . . . . . . 4840 1 1061 . 1 1 144 144 TYR CB C 13 35.7 0.1 . 1 . . . . . . . . 4840 1 1062 . 1 1 145 145 ARG H H 1 8.40 0.01 . 1 . . . . . . . . 4840 1 1063 . 1 1 145 145 ARG HA H 1 3.78 0.01 . 1 . . . . . . . . 4840 1 1064 . 1 1 145 145 ARG HB2 H 1 2.25 0.01 . 2 . . . . . . . . 4840 1 1065 . 1 1 145 145 ARG HB3 H 1 2.11 0.01 . 2 . . . . . . . . 4840 1 1066 . 1 1 145 145 ARG HG2 H 1 1.81 0.01 . 2 . . . . . . . . 4840 1 1067 . 1 1 145 145 ARG N N 15 122.7 0.1 . 1 . . . . . . . . 4840 1 1068 . 1 1 145 145 ARG CA C 13 57.9 0.1 . 1 . . . . . . . . 4840 1 1069 . 1 1 145 145 ARG CB C 13 27.8 0.1 . 1 . . . . . . . . 4840 1 1070 . 1 1 146 146 ASP H H 1 8.49 0.01 . 1 . . . . . . . . 4840 1 1071 . 1 1 146 146 ASP HA H 1 4.53 0.01 . 1 . . . . . . . . 4840 1 1072 . 1 1 146 146 ASP HB2 H 1 2.94 0.01 . 2 . . . . . . . . 4840 1 1073 . 1 1 146 146 ASP HB3 H 1 2.77 0.01 . 2 . . . . . . . . 4840 1 1074 . 1 1 146 146 ASP N N 15 120.7 0.1 . 1 . . . . . . . . 4840 1 1075 . 1 1 146 146 ASP CA C 13 55.0 0.1 . 1 . . . . . . . . 4840 1 1076 . 1 1 146 146 ASP CB C 13 38.2 0.1 . 1 . . . . . . . . 4840 1 1077 . 1 1 147 147 GLU H H 1 8.50 0.01 . 1 . . . . . . . . 4840 1 1078 . 1 1 147 147 GLU HA H 1 4.23 0.01 . 1 . . . . . . . . 4840 1 1079 . 1 1 147 147 GLU HB2 H 1 2.14 0.01 . 2 . . . . . . . . 4840 1 1080 . 1 1 147 147 GLU HB3 H 1 2.24 0.01 . 2 . . . . . . . . 4840 1 1081 . 1 1 147 147 GLU HG2 H 1 2.59 0.01 . 2 . . . . . . . . 4840 1 1082 . 1 1 147 147 GLU N N 15 118.6 0.1 . 1 . . . . . . . . 4840 1 1083 . 1 1 147 147 GLU CA C 13 56.4 0.1 . 1 . . . . . . . . 4840 1 1084 . 1 1 147 147 GLU CB C 13 28.2 0.1 . 1 . . . . . . . . 4840 1 1085 . 1 1 148 148 THR H H 1 7.87 0.01 . 1 . . . . . . . . 4840 1 1086 . 1 1 148 148 THR HA H 1 3.77 0.01 . 1 . . . . . . . . 4840 1 1087 . 1 1 148 148 THR HB H 1 4.08 0.01 . 1 . . . . . . . . 4840 1 1088 . 1 1 148 148 THR N N 15 113.1 0.1 . 1 . . . . . . . . 4840 1 1089 . 1 1 148 148 THR CA C 13 62.5 0.1 . 1 . . . . . . . . 4840 1 1090 . 1 1 148 148 THR CB C 13 67.1 0.1 . 1 . . . . . . . . 4840 1 1091 . 1 1 149 149 ALA H H 1 7.86 0.01 . 1 . . . . . . . . 4840 1 1092 . 1 1 149 149 ALA HA H 1 4.25 0.01 . 1 . . . . . . . . 4840 1 1093 . 1 1 149 149 ALA HB1 H 1 1.65 0.01 . 1 . . . . . . . . 4840 1 1094 . 1 1 149 149 ALA HB2 H 1 1.65 0.01 . 1 . . . . . . . . 4840 1 1095 . 1 1 149 149 ALA HB3 H 1 1.65 0.01 . 1 . . . . . . . . 4840 1 1096 . 1 1 149 149 ALA N N 15 127.0 0.1 . 1 . . . . . . . . 4840 1 1097 . 1 1 149 149 ALA CA C 13 55.2 0.1 . 1 . . . . . . . . 4840 1 1098 . 1 1 150 150 PRO CA C 13 63.4 0.1 . 1 . . . . . . . . 4840 1 1099 . 1 1 150 150 PRO CB C 13 29.4 0.1 . 1 . . . . . . . . 4840 1 1100 . 1 1 151 151 LEU H H 1 7.45 0.01 . 1 . . . . . . . . 4840 1 1101 . 1 1 151 151 LEU HA H 1 4.10 0.01 . 1 . . . . . . . . 4840 1 1102 . 1 1 151 151 LEU N N 15 118.9 0.1 . 1 . . . . . . . . 4840 1 1103 . 1 1 151 151 LEU CA C 13 55.3 0.1 . 1 . . . . . . . . 4840 1 1104 . 1 1 151 151 LEU CB C 13 39.9 0.1 . 1 . . . . . . . . 4840 1 1105 . 1 1 152 152 LEU H H 1 7.94 0.01 . 1 . . . . . . . . 4840 1 1106 . 1 1 152 152 LEU HA H 1 3.99 0.01 . 1 . . . . . . . . 4840 1 1107 . 1 1 152 152 LEU N N 15 119.0 0.1 . 1 . . . . . . . . 4840 1 1108 . 1 1 152 152 LEU CA C 13 55.8 0.1 . 1 . . . . . . . . 4840 1 1109 . 1 1 152 152 LEU CB C 13 37.6 0.1 . 1 . . . . . . . . 4840 1 1110 . 1 1 153 153 GLU H H 1 7.13 0.01 . 1 . . . . . . . . 4840 1 1111 . 1 1 153 153 GLU HA H 1 4.18 0.01 . 1 . . . . . . . . 4840 1 1112 . 1 1 153 153 GLU HB2 H 1 2.11 0.01 . 2 . . . . . . . . 4840 1 1113 . 1 1 153 153 GLU N N 15 115.7 0.1 . 1 . . . . . . . . 4840 1 1114 . 1 1 153 153 GLU CA C 13 56.6 0.1 . 1 . . . . . . . . 4840 1 1115 . 1 1 153 153 GLU CB C 13 27.7 0.1 . 1 . . . . . . . . 4840 1 1116 . 1 1 154 154 TYR H H 1 7.89 0.01 . 1 . . . . . . . . 4840 1 1117 . 1 1 154 154 TYR HA H 1 3.92 0.01 . 1 . . . . . . . . 4840 1 1118 . 1 1 154 154 TYR HB2 H 1 3.02 0.01 . 2 . . . . . . . . 4840 1 1119 . 1 1 154 154 TYR HB3 H 1 2.74 0.01 . 2 . . . . . . . . 4840 1 1120 . 1 1 154 154 TYR HD1 H 1 6.02 0.01 . 1 . . . . . . . . 4840 1 1121 . 1 1 154 154 TYR HD2 H 1 6.02 0.01 . 1 . . . . . . . . 4840 1 1122 . 1 1 154 154 TYR HE1 H 1 6.45 0.01 . 1 . . . . . . . . 4840 1 1123 . 1 1 154 154 TYR HE2 H 1 6.45 0.01 . 1 . . . . . . . . 4840 1 1124 . 1 1 154 154 TYR N N 15 122.8 0.1 . 1 . . . . . . . . 4840 1 1125 . 1 1 154 154 TYR CA C 13 60.2 0.1 . 1 . . . . . . . . 4840 1 1126 . 1 1 154 154 TYR CB C 13 36.5 0.1 . 1 . . . . . . . . 4840 1 1127 . 1 1 155 155 TYR H H 1 8.05 0.01 . 1 . . . . . . . . 4840 1 1128 . 1 1 155 155 TYR HA H 1 4.91 0.01 . 1 . . . . . . . . 4840 1 1129 . 1 1 155 155 TYR HB2 H 1 2.63 0.01 . 2 . . . . . . . . 4840 1 1130 . 1 1 155 155 TYR HB3 H 1 2.61 0.01 . 2 . . . . . . . . 4840 1 1131 . 1 1 155 155 TYR HD1 H 1 7.25 0.01 . 1 . . . . . . . . 4840 1 1132 . 1 1 155 155 TYR HD2 H 1 7.25 0.01 . 1 . . . . . . . . 4840 1 1133 . 1 1 155 155 TYR HE1 H 1 6.73 0.01 . 1 . . . . . . . . 4840 1 1134 . 1 1 155 155 TYR HE2 H 1 6.73 0.01 . 1 . . . . . . . . 4840 1 1135 . 1 1 155 155 TYR N N 15 115.4 0.1 . 1 . . . . . . . . 4840 1 1136 . 1 1 155 155 TYR CA C 13 56.0 0.1 . 1 . . . . . . . . 4840 1 1137 . 1 1 155 155 TYR CB C 13 35.5 0.1 . 1 . . . . . . . . 4840 1 1138 . 1 1 156 156 ARG H H 1 7.02 0.01 . 1 . . . . . . . . 4840 1 1139 . 1 1 156 156 ARG HA H 1 4.02 0.01 . 1 . . . . . . . . 4840 1 1140 . 1 1 156 156 ARG HB2 H 1 2.20 0.01 . 2 . . . . . . . . 4840 1 1141 . 1 1 156 156 ARG HB3 H 1 1.94 0.01 . 2 . . . . . . . . 4840 1 1142 . 1 1 156 156 ARG HG2 H 1 1.74 0.01 . 1 . . . . . . . . 4840 1 1143 . 1 1 156 156 ARG HG3 H 1 1.74 0.01 . 1 . . . . . . . . 4840 1 1144 . 1 1 156 156 ARG HD2 H 1 3.32 0.01 . 1 . . . . . . . . 4840 1 1145 . 1 1 156 156 ARG HD3 H 1 3.32 0.01 . 1 . . . . . . . . 4840 1 1146 . 1 1 156 156 ARG N N 15 120.5 0.1 . 1 . . . . . . . . 4840 1 1147 . 1 1 156 156 ARG CA C 13 58.4 0.1 . 1 . . . . . . . . 4840 1 1148 . 1 1 156 156 ARG CB C 13 30.0 0.1 . 1 . . . . . . . . 4840 1 1149 . 1 1 157 157 ASP H H 1 8.73 0.01 . 1 . . . . . . . . 4840 1 1150 . 1 1 157 157 ASP HA H 1 4.63 0.01 . 1 . . . . . . . . 4840 1 1151 . 1 1 157 157 ASP HB2 H 1 2.59 0.01 . 2 . . . . . . . . 4840 1 1152 . 1 1 157 157 ASP HB3 H 1 2.79 0.01 . 2 . . . . . . . . 4840 1 1153 . 1 1 157 157 ASP N N 15 117.5 0.1 . 1 . . . . . . . . 4840 1 1154 . 1 1 157 157 ASP CA C 13 54.6 0.1 . 1 . . . . . . . . 4840 1 1155 . 1 1 157 157 ASP CB C 13 37.8 0.1 . 1 . . . . . . . . 4840 1 1156 . 1 1 158 158 GLN H H 1 8.06 0.01 . 1 . . . . . . . . 4840 1 1157 . 1 1 158 158 GLN HA H 1 4.60 0.01 . 1 . . . . . . . . 4840 1 1158 . 1 1 158 158 GLN HB2 H 1 2.10 0.01 . 2 . . . . . . . . 4840 1 1159 . 1 1 158 158 GLN HB3 H 1 2.25 0.01 . 2 . . . . . . . . 4840 1 1160 . 1 1 158 158 GLN HG2 H 1 2.43 0.01 . 2 . . . . . . . . 4840 1 1161 . 1 1 158 158 GLN HE21 H 1 6.64 0.01 . 2 . . . . . . . . 4840 1 1162 . 1 1 158 158 GLN HE22 H 1 7.45 0.01 . 2 . . . . . . . . 4840 1 1163 . 1 1 158 158 GLN N N 15 117.9 0.1 . 1 . . . . . . . . 4840 1 1164 . 1 1 158 158 GLN NE2 N 15 110.3 0.1 . 1 . . . . . . . . 4840 1 1165 . 1 1 158 158 GLN CA C 13 54.5 0.1 . 1 . . . . . . . . 4840 1 1166 . 1 1 158 158 GLN CB C 13 27.8 0.1 . 1 . . . . . . . . 4840 1 1167 . 1 1 159 159 LEU H H 1 7.35 0.01 . 1 . . . . . . . . 4840 1 1168 . 1 1 159 159 LEU HA H 1 4.80 0.01 . 1 . . . . . . . . 4840 1 1169 . 1 1 159 159 LEU HB2 H 1 1.89 0.01 . 1 . . . . . . . . 4840 1 1170 . 1 1 159 159 LEU HB3 H 1 1.89 0.01 . 1 . . . . . . . . 4840 1 1171 . 1 1 159 159 LEU HG H 1 1.63 0.01 . 1 . . . . . . . . 4840 1 1172 . 1 1 159 159 LEU HD11 H 1 0.96 0.01 . 1 . . . . . . . . 4840 1 1173 . 1 1 159 159 LEU HD12 H 1 0.96 0.01 . 1 . . . . . . . . 4840 1 1174 . 1 1 159 159 LEU HD13 H 1 0.96 0.01 . 1 . . . . . . . . 4840 1 1175 . 1 1 159 159 LEU HD21 H 1 0.96 0.01 . 1 . . . . . . . . 4840 1 1176 . 1 1 159 159 LEU HD22 H 1 0.96 0.01 . 1 . . . . . . . . 4840 1 1177 . 1 1 159 159 LEU HD23 H 1 0.96 0.01 . 1 . . . . . . . . 4840 1 1178 . 1 1 159 159 LEU N N 15 124.3 0.1 . 1 . . . . . . . . 4840 1 1179 . 1 1 159 159 LEU CA C 13 54.1 0.1 . 1 . . . . . . . . 4840 1 1180 . 1 1 159 159 LEU CB C 13 41.6 0.1 . 1 . . . . . . . . 4840 1 1181 . 1 1 160 160 LYS H H 1 9.39 0.01 . 1 . . . . . . . . 4840 1 1182 . 1 1 160 160 LYS HA H 1 4.80 0.01 . 1 . . . . . . . . 4840 1 1183 . 1 1 160 160 LYS N N 15 127.3 0.1 . 1 . . . . . . . . 4840 1 1184 . 1 1 160 160 LYS CA C 13 51.9 0.1 . 1 . . . . . . . . 4840 1 1185 . 1 1 160 160 LYS CB C 13 32.7 0.1 . 1 . . . . . . . . 4840 1 1186 . 1 1 161 161 THR H H 1 8.55 0.01 . 1 . . . . . . . . 4840 1 1187 . 1 1 161 161 THR HA H 1 4.82 0.01 . 1 . . . . . . . . 4840 1 1188 . 1 1 161 161 THR HB H 1 3.95 0.01 . 1 . . . . . . . . 4840 1 1189 . 1 1 161 161 THR HG21 H 1 1.21 0.01 . 1 . . . . . . . . 4840 1 1190 . 1 1 161 161 THR HG22 H 1 1.21 0.01 . 1 . . . . . . . . 4840 1 1191 . 1 1 161 161 THR HG23 H 1 1.21 0.01 . 1 . . . . . . . . 4840 1 1192 . 1 1 161 161 THR N N 15 118.9 0.1 . 1 . . . . . . . . 4840 1 1193 . 1 1 161 161 THR CA C 13 60.5 0.1 . 1 . . . . . . . . 4840 1 1194 . 1 1 161 161 THR CB C 13 67.7 0.1 . 1 . . . . . . . . 4840 1 1195 . 1 1 162 162 VAL H H 1 9.12 0.01 . 1 . . . . . . . . 4840 1 1196 . 1 1 162 162 VAL HA H 1 4.06 0.01 . 1 . . . . . . . . 4840 1 1197 . 1 1 162 162 VAL HB H 1 1.50 0.01 . 1 . . . . . . . . 4840 1 1198 . 1 1 162 162 VAL HG11 H 1 0.56 0.01 . 2 . . . . . . . . 4840 1 1199 . 1 1 162 162 VAL HG12 H 1 0.56 0.01 . 2 . . . . . . . . 4840 1 1200 . 1 1 162 162 VAL HG13 H 1 0.56 0.01 . 2 . . . . . . . . 4840 1 1201 . 1 1 162 162 VAL N N 15 127.2 0.1 . 1 . . . . . . . . 4840 1 1202 . 1 1 162 162 VAL CA C 13 58.4 0.1 . 1 . . . . . . . . 4840 1 1203 . 1 1 162 162 VAL CB C 13 32.4 0.1 . 1 . . . . . . . . 4840 1 1204 . 1 1 163 163 ASP H H 1 8.56 0.01 . 1 . . . . . . . . 4840 1 1205 . 1 1 163 163 ASP HA H 1 4.64 0.01 . 1 . . . . . . . . 4840 1 1206 . 1 1 163 163 ASP HB2 H 1 2.70 0.01 . 2 . . . . . . . . 4840 1 1207 . 1 1 163 163 ASP HB3 H 1 2.79 0.01 . 2 . . . . . . . . 4840 1 1208 . 1 1 163 163 ASP N N 15 127.5 0.1 . 1 . . . . . . . . 4840 1 1209 . 1 1 163 163 ASP CA C 13 52.1 0.1 . 1 . . . . . . . . 4840 1 1210 . 1 1 163 163 ASP CB C 13 37.8 0.1 . 1 . . . . . . . . 4840 1 1211 . 1 1 164 164 ALA H H 1 8.73 0.01 . 1 . . . . . . . . 4840 1 1212 . 1 1 164 164 ALA HA H 1 4.71 0.01 . 1 . . . . . . . . 4840 1 1213 . 1 1 164 164 ALA HB1 H 1 1.50 0.01 . 1 . . . . . . . . 4840 1 1214 . 1 1 164 164 ALA HB2 H 1 1.50 0.01 . 1 . . . . . . . . 4840 1 1215 . 1 1 164 164 ALA HB3 H 1 1.50 0.01 . 1 . . . . . . . . 4840 1 1216 . 1 1 164 164 ALA N N 15 131.6 0.1 . 1 . . . . . . . . 4840 1 1217 . 1 1 164 164 ALA CA C 13 48.5 0.1 . 1 . . . . . . . . 4840 1 1218 . 1 1 164 164 ALA CB C 13 16.4 0.1 . 1 . . . . . . . . 4840 1 1219 . 1 1 165 165 VAL H H 1 8.11 0.01 . 1 . . . . . . . . 4840 1 1220 . 1 1 165 165 VAL HA H 1 4.06 0.01 . 1 . . . . . . . . 4840 1 1221 . 1 1 165 165 VAL HB H 1 2.46 0.01 . 1 . . . . . . . . 4840 1 1222 . 1 1 165 165 VAL HG11 H 1 1.19 0.01 . 2 . . . . . . . . 4840 1 1223 . 1 1 165 165 VAL HG12 H 1 1.19 0.01 . 2 . . . . . . . . 4840 1 1224 . 1 1 165 165 VAL HG13 H 1 1.19 0.01 . 2 . . . . . . . . 4840 1 1225 . 1 1 165 165 VAL N N 15 121.8 0.1 . 1 . . . . . . . . 4840 1 1226 . 1 1 165 165 VAL CA C 13 61.2 0.1 . 1 . . . . . . . . 4840 1 1227 . 1 1 165 165 VAL CB C 13 29.0 0.1 . 1 . . . . . . . . 4840 1 1228 . 1 1 166 166 GLY H H 1 7.86 0.01 . 1 . . . . . . . . 4840 1 1229 . 1 1 166 166 GLY HA2 H 1 4.09 0.01 . 2 . . . . . . . . 4840 1 1230 . 1 1 166 166 GLY HA3 H 1 4.40 0.01 . 2 . . . . . . . . 4840 1 1231 . 1 1 166 166 GLY N N 15 115.7 0.1 . 1 . . . . . . . . 4840 1 1232 . 1 1 166 166 GLY CA C 13 42.0 0.1 . 1 . . . . . . . . 4840 1 1233 . 1 1 167 167 THR H H 1 9.03 0.01 . 1 . . . . . . . . 4840 1 1234 . 1 1 167 167 THR HA H 1 4.53 0.01 . 1 . . . . . . . . 4840 1 1235 . 1 1 167 167 THR N N 15 112.4 0.1 . 1 . . . . . . . . 4840 1 1236 . 1 1 167 167 THR CA C 13 59.3 0.1 . 1 . . . . . . . . 4840 1 1237 . 1 1 167 167 THR CB C 13 68.5 0.1 . 1 . . . . . . . . 4840 1 1238 . 1 1 168 168 MET H H 1 9.05 0.01 . 1 . . . . . . . . 4840 1 1239 . 1 1 168 168 MET N N 15 120.2 0.1 . 1 . . . . . . . . 4840 1 1240 . 1 1 168 168 MET CA C 13 57.0 0.1 . 1 . . . . . . . . 4840 1 1241 . 1 1 168 168 MET CB C 13 30.7 0.1 . 1 . . . . . . . . 4840 1 1242 . 1 1 169 169 ASP H H 1 8.26 0.01 . 1 . . . . . . . . 4840 1 1243 . 1 1 169 169 ASP HA H 1 4.71 0.01 . 1 . . . . . . . . 4840 1 1244 . 1 1 169 169 ASP HB2 H 1 2.61 0.01 . 2 . . . . . . . . 4840 1 1245 . 1 1 169 169 ASP HB3 H 1 2.79 0.01 . 2 . . . . . . . . 4840 1 1246 . 1 1 169 169 ASP N N 15 118.2 0.1 . 1 . . . . . . . . 4840 1 1247 . 1 1 169 169 ASP CA C 13 55.4 0.1 . 1 . . . . . . . . 4840 1 1248 . 1 1 169 169 ASP CB C 13 38.6 0.1 . 1 . . . . . . . . 4840 1 1249 . 1 1 170 170 GLU H H 1 7.89 0.01 . 1 . . . . . . . . 4840 1 1250 . 1 1 170 170 GLU HA H 1 4.17 0.01 . 1 . . . . . . . . 4840 1 1251 . 1 1 170 170 GLU N N 15 124.0 0.1 . 1 . . . . . . . . 4840 1 1252 . 1 1 170 170 GLU CA C 13 57.2 0.1 . 1 . . . . . . . . 4840 1 1253 . 1 1 170 170 GLU CB C 13 27.7 0.1 . 1 . . . . . . . . 4840 1 1254 . 1 1 171 171 VAL H H 1 8.47 0.01 . 1 . . . . . . . . 4840 1 1255 . 1 1 171 171 VAL HA H 1 3.45 0.01 . 1 . . . . . . . . 4840 1 1256 . 1 1 171 171 VAL HB H 1 2.07 0.01 . 1 . . . . . . . . 4840 1 1257 . 1 1 171 171 VAL HG11 H 1 0.95 0.01 . 1 . . . . . . . . 4840 1 1258 . 1 1 171 171 VAL HG12 H 1 0.95 0.01 . 1 . . . . . . . . 4840 1 1259 . 1 1 171 171 VAL HG13 H 1 0.95 0.01 . 1 . . . . . . . . 4840 1 1260 . 1 1 171 171 VAL HG21 H 1 0.95 0.01 . 1 . . . . . . . . 4840 1 1261 . 1 1 171 171 VAL HG22 H 1 0.95 0.01 . 1 . . . . . . . . 4840 1 1262 . 1 1 171 171 VAL HG23 H 1 0.95 0.01 . 1 . . . . . . . . 4840 1 1263 . 1 1 171 171 VAL N N 15 120.7 0.1 . 1 . . . . . . . . 4840 1 1264 . 1 1 171 171 VAL CA C 13 65.2 0.1 . 1 . . . . . . . . 4840 1 1265 . 1 1 171 171 VAL CB C 13 29.6 0.1 . 1 . . . . . . . . 4840 1 1266 . 1 1 172 172 PHE H H 1 8.15 0.01 . 1 . . . . . . . . 4840 1 1267 . 1 1 172 172 PHE HA H 1 4.65 0.01 . 1 . . . . . . . . 4840 1 1268 . 1 1 172 172 PHE HB2 H 1 3.18 0.01 . 1 . . . . . . . . 4840 1 1269 . 1 1 172 172 PHE HB3 H 1 3.18 0.01 . 1 . . . . . . . . 4840 1 1270 . 1 1 172 172 PHE HD1 H 1 7.51 0.01 . 1 . . . . . . . . 4840 1 1271 . 1 1 172 172 PHE HD2 H 1 7.51 0.01 . 1 . . . . . . . . 4840 1 1272 . 1 1 172 172 PHE HE1 H 1 7.21 0.01 . 1 . . . . . . . . 4840 1 1273 . 1 1 172 172 PHE HE2 H 1 7.21 0.01 . 1 . . . . . . . . 4840 1 1274 . 1 1 172 172 PHE HZ H 1 7.08 0.01 . 1 . . . . . . . . 4840 1 1275 . 1 1 172 172 PHE N N 15 121.9 0.1 . 1 . . . . . . . . 4840 1 1276 . 1 1 172 172 PHE CA C 13 58.5 0.1 . 1 . . . . . . . . 4840 1 1277 . 1 1 172 172 PHE CB C 13 37.3 0.1 . 1 . . . . . . . . 4840 1 1278 . 1 1 173 173 ALA H H 1 7.71 0.01 . 1 . . . . . . . . 4840 1 1279 . 1 1 173 173 ALA HA H 1 3.90 0.01 . 1 . . . . . . . . 4840 1 1280 . 1 1 173 173 ALA HB1 H 1 1.60 0.01 . 1 . . . . . . . . 4840 1 1281 . 1 1 173 173 ALA HB2 H 1 1.60 0.01 . 1 . . . . . . . . 4840 1 1282 . 1 1 173 173 ALA HB3 H 1 1.60 0.01 . 1 . . . . . . . . 4840 1 1283 . 1 1 173 173 ALA N N 15 119.9 0.1 . 1 . . . . . . . . 4840 1 1284 . 1 1 173 173 ALA CA C 13 53.0 0.1 . 1 . . . . . . . . 4840 1 1285 . 1 1 173 173 ALA CB C 13 15.5 0.1 . 1 . . . . . . . . 4840 1 1286 . 1 1 174 174 ARG H H 1 7.84 0.01 . 1 . . . . . . . . 4840 1 1287 . 1 1 174 174 ARG HA H 1 4.01 0.01 . 1 . . . . . . . . 4840 1 1288 . 1 1 174 174 ARG HB2 H 1 2.10 0.01 . 2 . . . . . . . . 4840 1 1289 . 1 1 174 174 ARG HB3 H 1 2.00 0.01 . 2 . . . . . . . . 4840 1 1290 . 1 1 174 174 ARG HG2 H 1 1.82 0.01 . 1 . . . . . . . . 4840 1 1291 . 1 1 174 174 ARG HG3 H 1 1.82 0.01 . 1 . . . . . . . . 4840 1 1292 . 1 1 174 174 ARG HD2 H 1 3.21 0.01 . 1 . . . . . . . . 4840 1 1293 . 1 1 174 174 ARG HD3 H 1 3.21 0.01 . 1 . . . . . . . . 4840 1 1294 . 1 1 174 174 ARG N N 15 118.1 0.1 . 1 . . . . . . . . 4840 1 1295 . 1 1 174 174 ARG CA C 13 57.4 0.1 . 1 . . . . . . . . 4840 1 1296 . 1 1 174 174 ARG CB C 13 28.8 0.1 . 1 . . . . . . . . 4840 1 1297 . 1 1 175 175 ALA H H 1 8.77 0.01 . 1 . . . . . . . . 4840 1 1298 . 1 1 175 175 ALA HA H 1 3.91 0.01 . 1 . . . . . . . . 4840 1 1299 . 1 1 175 175 ALA HB1 H 1 1.55 0.01 . 1 . . . . . . . . 4840 1 1300 . 1 1 175 175 ALA HB2 H 1 1.55 0.01 . 1 . . . . . . . . 4840 1 1301 . 1 1 175 175 ALA HB3 H 1 1.55 0.01 . 1 . . . . . . . . 4840 1 1302 . 1 1 175 175 ALA N N 15 126.0 0.1 . 1 . . . . . . . . 4840 1 1303 . 1 1 175 175 ALA CA C 13 52.9 0.1 . 1 . . . . . . . . 4840 1 1304 . 1 1 175 175 ALA CB C 13 15.5 0.1 . 1 . . . . . . . . 4840 1 1305 . 1 1 176 176 LEU H H 1 8.24 0.01 . 1 . . . . . . . . 4840 1 1306 . 1 1 176 176 LEU HA H 1 3.73 0.01 . 1 . . . . . . . . 4840 1 1307 . 1 1 176 176 LEU HB2 H 1 1.53 0.01 . 1 . . . . . . . . 4840 1 1308 . 1 1 176 176 LEU HB3 H 1 1.53 0.01 . 1 . . . . . . . . 4840 1 1309 . 1 1 176 176 LEU HG H 1 1.28 0.01 . 1 . . . . . . . . 4840 1 1310 . 1 1 176 176 LEU HD11 H 1 0.59 0.01 . 2 . . . . . . . . 4840 1 1311 . 1 1 176 176 LEU HD12 H 1 0.59 0.01 . 2 . . . . . . . . 4840 1 1312 . 1 1 176 176 LEU HD13 H 1 0.59 0.01 . 2 . . . . . . . . 4840 1 1313 . 1 1 176 176 LEU HD21 H 1 0.49 0.01 . 2 . . . . . . . . 4840 1 1314 . 1 1 176 176 LEU HD22 H 1 0.49 0.01 . 2 . . . . . . . . 4840 1 1315 . 1 1 176 176 LEU HD23 H 1 0.49 0.01 . 2 . . . . . . . . 4840 1 1316 . 1 1 176 176 LEU N N 15 117.2 0.1 . 1 . . . . . . . . 4840 1 1317 . 1 1 176 176 LEU CA C 13 55.9 0.1 . 1 . . . . . . . . 4840 1 1318 . 1 1 176 176 LEU CB C 13 38.8 0.1 . 1 . . . . . . . . 4840 1 1319 . 1 1 177 177 ARG H H 1 7.84 0.01 . 1 . . . . . . . . 4840 1 1320 . 1 1 177 177 ARG HA H 1 4.24 0.01 . 1 . . . . . . . . 4840 1 1321 . 1 1 177 177 ARG HB2 H 1 1.97 0.01 . 2 . . . . . . . . 4840 1 1322 . 1 1 177 177 ARG HG2 H 1 1.82 0.01 . 2 . . . . . . . . 4840 1 1323 . 1 1 177 177 ARG N N 15 118.6 0.1 . 1 . . . . . . . . 4840 1 1324 . 1 1 177 177 ARG CA C 13 57.0 0.1 . 1 . . . . . . . . 4840 1 1325 . 1 1 177 177 ARG CB C 13 27.7 0.1 . 1 . . . . . . . . 4840 1 1326 . 1 1 178 178 ALA H H 1 7.95 0.01 . 1 . . . . . . . . 4840 1 1327 . 1 1 178 178 ALA HA H 1 4.17 0.01 . 1 . . . . . . . . 4840 1 1328 . 1 1 178 178 ALA HB1 H 1 1.43 0.01 . 1 . . . . . . . . 4840 1 1329 . 1 1 178 178 ALA HB2 H 1 1.43 0.01 . 1 . . . . . . . . 4840 1 1330 . 1 1 178 178 ALA HB3 H 1 1.43 0.01 . 1 . . . . . . . . 4840 1 1331 . 1 1 178 178 ALA N N 15 123.8 0.1 . 1 . . . . . . . . 4840 1 1332 . 1 1 178 178 ALA CA C 13 52.5 0.1 . 1 . . . . . . . . 4840 1 1333 . 1 1 178 178 ALA CB C 13 16.0 0.1 . 1 . . . . . . . . 4840 1 1334 . 1 1 179 179 LEU H H 1 7.40 0.01 . 1 . . . . . . . . 4840 1 1335 . 1 1 179 179 LEU HA H 1 4.23 0.01 . 1 . . . . . . . . 4840 1 1336 . 1 1 179 179 LEU HB2 H 1 2.02 0.01 . 2 . . . . . . . . 4840 1 1337 . 1 1 179 179 LEU HB3 H 1 1.90 0.01 . 2 . . . . . . . . 4840 1 1338 . 1 1 179 179 LEU HG H 1 1.62 0.01 . 1 . . . . . . . . 4840 1 1339 . 1 1 179 179 LEU HD11 H 1 0.87 0.01 . 2 . . . . . . . . 4840 1 1340 . 1 1 179 179 LEU HD12 H 1 0.87 0.01 . 2 . . . . . . . . 4840 1 1341 . 1 1 179 179 LEU HD13 H 1 0.87 0.01 . 2 . . . . . . . . 4840 1 1342 . 1 1 179 179 LEU HD21 H 1 0.76 0.01 . 2 . . . . . . . . 4840 1 1343 . 1 1 179 179 LEU HD22 H 1 0.76 0.01 . 2 . . . . . . . . 4840 1 1344 . 1 1 179 179 LEU HD23 H 1 0.76 0.01 . 2 . . . . . . . . 4840 1 1345 . 1 1 179 179 LEU N N 15 115.4 0.1 . 1 . . . . . . . . 4840 1 1346 . 1 1 179 179 LEU CA C 13 52.4 0.1 . 1 . . . . . . . . 4840 1 1347 . 1 1 179 179 LEU CB C 13 40.3 0.1 . 1 . . . . . . . . 4840 1 1348 . 1 1 180 180 GLY H H 1 7.95 0.01 . 1 . . . . . . . . 4840 1 1349 . 1 1 180 180 GLY HA2 H 1 3.92 0.01 . 2 . . . . . . . . 4840 1 1350 . 1 1 180 180 GLY HA3 H 1 4.11 0.01 . 2 . . . . . . . . 4840 1 1351 . 1 1 180 180 GLY N N 15 108.4 0.1 . 1 . . . . . . . . 4840 1 1352 . 1 1 180 180 GLY CA C 13 43.6 0.1 . 1 . . . . . . . . 4840 1 1353 . 1 1 181 181 LYS H H 1 7.81 0.01 . 1 . . . . . . . . 4840 1 1354 . 1 1 181 181 LYS HA H 1 4.36 0.01 . 1 . . . . . . . . 4840 1 1355 . 1 1 181 181 LYS HB2 H 1 1.96 0.01 . 2 . . . . . . . . 4840 1 1356 . 1 1 181 181 LYS HB3 H 1 1.57 0.01 . 2 . . . . . . . . 4840 1 1357 . 1 1 181 181 LYS N N 15 126.4 0.1 . 1 . . . . . . . . 4840 1 1358 . 1 1 181 181 LYS CA C 13 52.7 0.1 . 1 . . . . . . . . 4840 1 1359 . 1 1 181 181 LYS CB C 13 31.6 0.1 . 1 . . . . . . . . 4840 1 stop_ save_