data_18663 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18663 _Entry.Title ; The third member of the eIF4E family represses gene expression via a novel mode of recognition of the methyl-7 guanosine cap moiety ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-08-15 _Entry.Accession_date 2012-08-15 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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 M. Osborne . J. . 18663 2 Laurent Volpon . . . 18663 3 J. Kornblatt . A. . 18663 4 B. Culjkovic-kraljcic . . . 18663 5 A. Baguet . . . 18663 6 K. Borden . L.B. . 18663 7 A. Borden . . . 18663 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 18663 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . VolponGroup . 18663 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID eIF4E3 . 18663 'm7G cap' . 18663 NMR . 18663 TRANSLATION . 18663 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18663 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 620 18663 '15N chemical shifts' 207 18663 '1H chemical shifts' 1327 18663 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 2 . . 2013-03-11 2012-08-15 update BMRB 'update entry citation' 18663 1 . . 2013-02-28 2012-08-15 original author 'original release' 18663 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18663 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23431134 _Citation.Full_citation . _Citation.Title 'eIF4E3 acts as a tumor suppressor by utilizing an atypical mode of methyl-7-guanosine cap recognition.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full 'Proceedings of the National Academy of Sciences of the United States of America' _Citation.Journal_volume 110 _Citation.Journal_issue 10 _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 3877 _Citation.Page_last 3882 _Citation.Year 2013 _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 Michael Osborne . J. . 18663 1 2 Laurent Volpon . . . 18663 1 3 Jack Kornblatt . A. . 18663 1 4 Biljana Culjkovic-Kraljacic . . . 18663 1 5 Aurelie Baguet . . . 18663 1 6 Katherine Borden . L.B. . 18663 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18663 _Assembly.ID 1 _Assembly.Name 'The third member of the eIF4E family represses gene expression via a novel mode of recognition of the methyl-7 guanosine cap mo' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 22831.0043 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'EUKARYOTIC TRANSLATION INITIATION FACTOR 4E TYPE' 1 $EUKARYOTIC_TRANSLATION_INITIATION_FACTOR_4E_TYPE A . yes native no no . . . 18663 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_EUKARYOTIC_TRANSLATION_INITIATION_FACTOR_4E_TYPE _Entity.Sf_category entity _Entity.Sf_framecode EUKARYOTIC_TRANSLATION_INITIATION_FACTOR_4E_TYPE _Entity.Entry_ID 18663 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name EUKARYOTIC_TRANSLATION_INITIATION_FACTOR_4E_TYPE _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MALPPAAAPPGANEPLDKAL SALPPEPGGVPLHSPWTFWL DRSLPGATAAECASNLKKIY TVQTVQIFWSVYNNIPPVTS LPLRCSYHLMRGERRPLWEE ESNAKGGVWKMKVPKDSTST VWKELLLATIGEQFTDCAAA DDEIIGVSVSVRDREDVVQV WNVNASLVGEATVLEKIHQL LPHIAFKAVFYKPHEEHHAF EGGRGKH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 207 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation WT _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 22831.0043 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP Q9DBB5.1 . Q9DBB5.1 . . . . . . . . . . . . . . 18663 1 2 yes UNP IF4E3_MOUSE . Q9DBB5 . . . . . . . . . . . . . . 18663 1 3 no BMRB 18667 . EUKARYOTIC_TRANSLATION_INITIATION_FACTOR_4E_TYPE . . . . . 100.00 207 100.00 100.00 2.13e-149 . . . . 18663 1 4 no PDB 4B6U . "Solution Structure Of Eif4e3 In Complex With M7gdp" . . . . . 99.03 207 100.00 100.00 2.00e-147 . . . . 18663 1 5 no PDB 4B6V . "The Third Member Of The Eif4e Family Represses Gene Expression Via A Novel Mode Of Recognition Of The Methyl-7 Guanosine Cap Mo" . . . . . 99.52 207 100.00 100.00 1.65e-148 . . . . 18663 1 6 no DBJ BAB23780 . "unnamed protein product [Mus musculus]" . . . . . 100.00 207 100.00 100.00 2.13e-149 . . . . 18663 1 7 no DBJ BAB24928 . "unnamed protein product [Mus musculus]" . . . . . 100.00 207 99.52 99.52 6.76e-148 . . . . 18663 1 8 no GB AAH27014 . "Eukaryotic translation initiation factor 4E member 3 [Mus musculus]" . . . . . 100.00 207 100.00 100.00 2.13e-149 . . . . 18663 1 9 no GB AAI68936 . "Eukaryotic translation initiation factor 4E member 3 [Rattus norvegicus]" . . . . . 100.00 207 97.10 98.55 1.95e-145 . . . . 18663 1 10 no GB AAT45741 . "eukaryotic translation initiation factor-3 [Mus musculus]" . . . . . 100.00 207 100.00 100.00 2.13e-149 . . . . 18663 1 11 no GB EDK99365 . "eukaryotic translation initiation factor 4E member 3 [Mus musculus]" . . . . . 100.00 207 100.00 100.00 2.13e-149 . . . . 18663 1 12 no GB EDL91436 . "similar to eukaryotic translation initiation factor 4E member 3 [Rattus norvegicus]" . . . . . 100.00 207 97.10 98.55 1.95e-145 . . . . 18663 1 13 no REF NP_001100082 . "eukaryotic translation initiation factor 4E type 3 [Rattus norvegicus]" . . . . . 100.00 207 97.10 98.55 1.95e-145 . . . . 18663 1 14 no REF NP_080105 . "eukaryotic translation initiation factor 4E type 3 [Mus musculus]" . . . . . 100.00 207 100.00 100.00 2.13e-149 . . . . 18663 1 15 no REF XP_005547668 . "PREDICTED: eukaryotic translation initiation factor 4E type 3 isoform X1 [Macaca fascicularis]" . . . . . 81.16 195 97.02 98.81 5.57e-115 . . . . 18663 1 16 no REF XP_005547669 . "PREDICTED: eukaryotic translation initiation factor 4E type 3 isoform X2 [Macaca fascicularis]" . . . . . 80.19 186 97.59 99.40 3.07e-116 . . . . 18663 1 17 no REF XP_005547670 . "PREDICTED: eukaryotic translation initiation factor 4E type 3 isoform X3 [Macaca fascicularis]" . . . . . 79.71 180 97.58 99.39 3.71e-115 . . . . 18663 1 18 no SP Q9DBB5 . "RecName: Full=Eukaryotic translation initiation factor 4E type 3; Short=eIF-4E type 3; Short=eIF-4E3; Short=eIF4E type 3; Short" . . . . . 100.00 207 100.00 100.00 2.13e-149 . . . . 18663 1 19 no TPG DAA17098 . "TPA: eukaryotic translation initiation factor 4E family member 3 [Bos taurus]" . . . . . 64.73 166 97.01 98.51 8.62e-89 . . . . 18663 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 . 18663 1 2 . ALA . 18663 1 3 . LEU . 18663 1 4 . PRO . 18663 1 5 . PRO . 18663 1 6 . ALA . 18663 1 7 . ALA . 18663 1 8 . ALA . 18663 1 9 . PRO . 18663 1 10 . PRO . 18663 1 11 . GLY . 18663 1 12 . ALA . 18663 1 13 . ASN . 18663 1 14 . GLU . 18663 1 15 . PRO . 18663 1 16 . LEU . 18663 1 17 . ASP . 18663 1 18 . LYS . 18663 1 19 . ALA . 18663 1 20 . LEU . 18663 1 21 . SER . 18663 1 22 . ALA . 18663 1 23 . LEU . 18663 1 24 . PRO . 18663 1 25 . PRO . 18663 1 26 . GLU . 18663 1 27 . PRO . 18663 1 28 . GLY . 18663 1 29 . GLY . 18663 1 30 . VAL . 18663 1 31 . PRO . 18663 1 32 . LEU . 18663 1 33 . HIS . 18663 1 34 . SER . 18663 1 35 . PRO . 18663 1 36 . TRP . 18663 1 37 . THR . 18663 1 38 . PHE . 18663 1 39 . TRP . 18663 1 40 . LEU . 18663 1 41 . ASP . 18663 1 42 . ARG . 18663 1 43 . SER . 18663 1 44 . LEU . 18663 1 45 . PRO . 18663 1 46 . GLY . 18663 1 47 . ALA . 18663 1 48 . THR . 18663 1 49 . ALA . 18663 1 50 . ALA . 18663 1 51 . GLU . 18663 1 52 . CYS . 18663 1 53 . ALA . 18663 1 54 . SER . 18663 1 55 . ASN . 18663 1 56 . LEU . 18663 1 57 . LYS . 18663 1 58 . LYS . 18663 1 59 . ILE . 18663 1 60 . TYR . 18663 1 61 . THR . 18663 1 62 . VAL . 18663 1 63 . GLN . 18663 1 64 . THR . 18663 1 65 . VAL . 18663 1 66 . GLN . 18663 1 67 . ILE . 18663 1 68 . PHE . 18663 1 69 . TRP . 18663 1 70 . SER . 18663 1 71 . VAL . 18663 1 72 . TYR . 18663 1 73 . ASN . 18663 1 74 . ASN . 18663 1 75 . ILE . 18663 1 76 . PRO . 18663 1 77 . PRO . 18663 1 78 . VAL . 18663 1 79 . THR . 18663 1 80 . SER . 18663 1 81 . LEU . 18663 1 82 . PRO . 18663 1 83 . LEU . 18663 1 84 . ARG . 18663 1 85 . CYS . 18663 1 86 . SER . 18663 1 87 . TYR . 18663 1 88 . HIS . 18663 1 89 . LEU . 18663 1 90 . MET . 18663 1 91 . ARG . 18663 1 92 . GLY . 18663 1 93 . GLU . 18663 1 94 . ARG . 18663 1 95 . ARG . 18663 1 96 . PRO . 18663 1 97 . LEU . 18663 1 98 . TRP . 18663 1 99 . GLU . 18663 1 100 . GLU . 18663 1 101 . GLU . 18663 1 102 . SER . 18663 1 103 . ASN . 18663 1 104 . ALA . 18663 1 105 . LYS . 18663 1 106 . GLY . 18663 1 107 . GLY . 18663 1 108 . VAL . 18663 1 109 . TRP . 18663 1 110 . LYS . 18663 1 111 . MET . 18663 1 112 . LYS . 18663 1 113 . VAL . 18663 1 114 . PRO . 18663 1 115 . LYS . 18663 1 116 . ASP . 18663 1 117 . SER . 18663 1 118 . THR . 18663 1 119 . SER . 18663 1 120 . THR . 18663 1 121 . VAL . 18663 1 122 . TRP . 18663 1 123 . LYS . 18663 1 124 . GLU . 18663 1 125 . LEU . 18663 1 126 . LEU . 18663 1 127 . LEU . 18663 1 128 . ALA . 18663 1 129 . THR . 18663 1 130 . ILE . 18663 1 131 . GLY . 18663 1 132 . GLU . 18663 1 133 . GLN . 18663 1 134 . PHE . 18663 1 135 . THR . 18663 1 136 . ASP . 18663 1 137 . CYS . 18663 1 138 . ALA . 18663 1 139 . ALA . 18663 1 140 . ALA . 18663 1 141 . ASP . 18663 1 142 . ASP . 18663 1 143 . GLU . 18663 1 144 . ILE . 18663 1 145 . ILE . 18663 1 146 . GLY . 18663 1 147 . VAL . 18663 1 148 . SER . 18663 1 149 . VAL . 18663 1 150 . SER . 18663 1 151 . VAL . 18663 1 152 . ARG . 18663 1 153 . ASP . 18663 1 154 . ARG . 18663 1 155 . GLU . 18663 1 156 . ASP . 18663 1 157 . VAL . 18663 1 158 . VAL . 18663 1 159 . GLN . 18663 1 160 . VAL . 18663 1 161 . TRP . 18663 1 162 . ASN . 18663 1 163 . VAL . 18663 1 164 . ASN . 18663 1 165 . ALA . 18663 1 166 . SER . 18663 1 167 . LEU . 18663 1 168 . VAL . 18663 1 169 . GLY . 18663 1 170 . GLU . 18663 1 171 . ALA . 18663 1 172 . THR . 18663 1 173 . VAL . 18663 1 174 . LEU . 18663 1 175 . GLU . 18663 1 176 . LYS . 18663 1 177 . ILE . 18663 1 178 . HIS . 18663 1 179 . GLN . 18663 1 180 . LEU . 18663 1 181 . LEU . 18663 1 182 . PRO . 18663 1 183 . HIS . 18663 1 184 . ILE . 18663 1 185 . ALA . 18663 1 186 . PHE . 18663 1 187 . LYS . 18663 1 188 . ALA . 18663 1 189 . VAL . 18663 1 190 . PHE . 18663 1 191 . TYR . 18663 1 192 . LYS . 18663 1 193 . PRO . 18663 1 194 . HIS . 18663 1 195 . GLU . 18663 1 196 . GLU . 18663 1 197 . HIS . 18663 1 198 . HIS . 18663 1 199 . ALA . 18663 1 200 . PHE . 18663 1 201 . GLU . 18663 1 202 . GLY . 18663 1 203 . GLY . 18663 1 204 . ARG . 18663 1 205 . GLY . 18663 1 206 . LYS . 18663 1 207 . HIS . 18663 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 18663 1 . ALA 2 2 18663 1 . LEU 3 3 18663 1 . PRO 4 4 18663 1 . PRO 5 5 18663 1 . ALA 6 6 18663 1 . ALA 7 7 18663 1 . ALA 8 8 18663 1 . PRO 9 9 18663 1 . PRO 10 10 18663 1 . GLY 11 11 18663 1 . ALA 12 12 18663 1 . ASN 13 13 18663 1 . GLU 14 14 18663 1 . PRO 15 15 18663 1 . LEU 16 16 18663 1 . ASP 17 17 18663 1 . LYS 18 18 18663 1 . ALA 19 19 18663 1 . LEU 20 20 18663 1 . SER 21 21 18663 1 . ALA 22 22 18663 1 . LEU 23 23 18663 1 . PRO 24 24 18663 1 . PRO 25 25 18663 1 . GLU 26 26 18663 1 . PRO 27 27 18663 1 . GLY 28 28 18663 1 . GLY 29 29 18663 1 . VAL 30 30 18663 1 . PRO 31 31 18663 1 . LEU 32 32 18663 1 . HIS 33 33 18663 1 . SER 34 34 18663 1 . PRO 35 35 18663 1 . TRP 36 36 18663 1 . THR 37 37 18663 1 . PHE 38 38 18663 1 . TRP 39 39 18663 1 . LEU 40 40 18663 1 . ASP 41 41 18663 1 . ARG 42 42 18663 1 . SER 43 43 18663 1 . LEU 44 44 18663 1 . PRO 45 45 18663 1 . GLY 46 46 18663 1 . ALA 47 47 18663 1 . THR 48 48 18663 1 . ALA 49 49 18663 1 . ALA 50 50 18663 1 . GLU 51 51 18663 1 . CYS 52 52 18663 1 . ALA 53 53 18663 1 . SER 54 54 18663 1 . ASN 55 55 18663 1 . LEU 56 56 18663 1 . LYS 57 57 18663 1 . LYS 58 58 18663 1 . ILE 59 59 18663 1 . TYR 60 60 18663 1 . THR 61 61 18663 1 . VAL 62 62 18663 1 . GLN 63 63 18663 1 . THR 64 64 18663 1 . VAL 65 65 18663 1 . GLN 66 66 18663 1 . ILE 67 67 18663 1 . PHE 68 68 18663 1 . TRP 69 69 18663 1 . SER 70 70 18663 1 . VAL 71 71 18663 1 . TYR 72 72 18663 1 . ASN 73 73 18663 1 . ASN 74 74 18663 1 . ILE 75 75 18663 1 . PRO 76 76 18663 1 . PRO 77 77 18663 1 . VAL 78 78 18663 1 . THR 79 79 18663 1 . SER 80 80 18663 1 . LEU 81 81 18663 1 . PRO 82 82 18663 1 . LEU 83 83 18663 1 . ARG 84 84 18663 1 . CYS 85 85 18663 1 . SER 86 86 18663 1 . TYR 87 87 18663 1 . HIS 88 88 18663 1 . LEU 89 89 18663 1 . MET 90 90 18663 1 . ARG 91 91 18663 1 . GLY 92 92 18663 1 . GLU 93 93 18663 1 . ARG 94 94 18663 1 . ARG 95 95 18663 1 . PRO 96 96 18663 1 . LEU 97 97 18663 1 . TRP 98 98 18663 1 . GLU 99 99 18663 1 . GLU 100 100 18663 1 . GLU 101 101 18663 1 . SER 102 102 18663 1 . ASN 103 103 18663 1 . ALA 104 104 18663 1 . LYS 105 105 18663 1 . GLY 106 106 18663 1 . GLY 107 107 18663 1 . VAL 108 108 18663 1 . TRP 109 109 18663 1 . LYS 110 110 18663 1 . MET 111 111 18663 1 . LYS 112 112 18663 1 . VAL 113 113 18663 1 . PRO 114 114 18663 1 . LYS 115 115 18663 1 . ASP 116 116 18663 1 . SER 117 117 18663 1 . THR 118 118 18663 1 . SER 119 119 18663 1 . THR 120 120 18663 1 . VAL 121 121 18663 1 . TRP 122 122 18663 1 . LYS 123 123 18663 1 . GLU 124 124 18663 1 . LEU 125 125 18663 1 . LEU 126 126 18663 1 . LEU 127 127 18663 1 . ALA 128 128 18663 1 . THR 129 129 18663 1 . ILE 130 130 18663 1 . GLY 131 131 18663 1 . GLU 132 132 18663 1 . GLN 133 133 18663 1 . PHE 134 134 18663 1 . THR 135 135 18663 1 . ASP 136 136 18663 1 . CYS 137 137 18663 1 . ALA 138 138 18663 1 . ALA 139 139 18663 1 . ALA 140 140 18663 1 . ASP 141 141 18663 1 . ASP 142 142 18663 1 . GLU 143 143 18663 1 . ILE 144 144 18663 1 . ILE 145 145 18663 1 . GLY 146 146 18663 1 . VAL 147 147 18663 1 . SER 148 148 18663 1 . VAL 149 149 18663 1 . SER 150 150 18663 1 . VAL 151 151 18663 1 . ARG 152 152 18663 1 . ASP 153 153 18663 1 . ARG 154 154 18663 1 . GLU 155 155 18663 1 . ASP 156 156 18663 1 . VAL 157 157 18663 1 . VAL 158 158 18663 1 . GLN 159 159 18663 1 . VAL 160 160 18663 1 . TRP 161 161 18663 1 . ASN 162 162 18663 1 . VAL 163 163 18663 1 . ASN 164 164 18663 1 . ALA 165 165 18663 1 . SER 166 166 18663 1 . LEU 167 167 18663 1 . VAL 168 168 18663 1 . GLY 169 169 18663 1 . GLU 170 170 18663 1 . ALA 171 171 18663 1 . THR 172 172 18663 1 . VAL 173 173 18663 1 . LEU 174 174 18663 1 . GLU 175 175 18663 1 . LYS 176 176 18663 1 . ILE 177 177 18663 1 . HIS 178 178 18663 1 . GLN 179 179 18663 1 . LEU 180 180 18663 1 . LEU 181 181 18663 1 . PRO 182 182 18663 1 . HIS 183 183 18663 1 . ILE 184 184 18663 1 . ALA 185 185 18663 1 . PHE 186 186 18663 1 . LYS 187 187 18663 1 . ALA 188 188 18663 1 . VAL 189 189 18663 1 . PHE 190 190 18663 1 . TYR 191 191 18663 1 . LYS 192 192 18663 1 . PRO 193 193 18663 1 . HIS 194 194 18663 1 . GLU 195 195 18663 1 . GLU 196 196 18663 1 . HIS 197 197 18663 1 . HIS 198 198 18663 1 . ALA 199 199 18663 1 . PHE 200 200 18663 1 . GLU 201 201 18663 1 . GLY 202 202 18663 1 . GLY 203 203 18663 1 . ARG 204 204 18663 1 . GLY 205 205 18663 1 . LYS 206 206 18663 1 . HIS 207 207 18663 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 18663 _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 $EUKARYOTIC_TRANSLATION_INITIATION_FACTOR_4E_TYPE . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 18663 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 18663 _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 $EUKARYOTIC_TRANSLATION_INITIATION_FACTOR_4E_TYPE . 'recombinant technology' 'Escherichia coli' 'Escherichia coli' . . Escherichia coli BL21(DE3) . . . . . . . . . . . . n/a . . pET-15b . . . . . . 18663 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18663 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'eIF4E3 0.2mM' _Sample.Aggregate_sample_number . _Sample.Solvent_system '50mM Phosphate, 100mM NaCl, 100uM TCEP, NaN3, 7% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'EUKARYOTIC TRANSLATION INITIATION FACTOR 4E TYPE' '[U-13C; U-15N]' . . 1 $EUKARYOTIC_TRANSLATION_INITIATION_FACTOR_4E_TYPE . . 0.2 . . mM . . . . 18663 1 2 Phosphate 'natural abundance' . . . . . . 50 . . mM . . . . 18663 1 3 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 18663 1 4 TCEP 'natural abundance' . . . . . . 100 . . uM . . . . 18663 1 5 D2O '[U-100% 2H]' . . . . . . 7 . . % . . . . 18663 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 18663 _Sample_condition_list.ID 1 _Sample_condition_list.Details 'pH [7.3], temp [293], pressure [1], ionStrength [100.0]' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100.000 . mM 18663 1 pH 7.300 . pH 18663 1 pressure 1.000 . atm 18663 1 temperature 293.000 . K 18663 1 stop_ save_ ############################ # Computer software used # ############################ save_AutoDep _Software.Sf_category software _Software.Sf_framecode AutoDep _Software.Entry_ID 18663 _Software.ID 1 _Software.Name AutoDep _Software.Version 4.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID PDBe . . 18663 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 18663 1 stop_ save_ save_Sparky _Software.Sf_category software _Software.Sf_framecode Sparky _Software.Entry_ID 18663 _Software.ID 2 _Software.Name SPARKY _Software.Version any _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 18663 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18663 2 stop_ save_ save_X-PLOR _Software.Sf_category software _Software.Sf_framecode X-PLOR _Software.Entry_ID 18663 _Software.ID 3 _Software.Name X-PLOR _Software.Version any _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID BRUNGER . . 18663 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18663 3 stop_ save_ save_Xplor _Method.Sf_category method _Method.Sf_framecode Xplor _Method.Entry_ID 18663 _Method.ID 1 _Method.Derivation_type . _Method.Details Xplor _Method.Computer_ID . _Method.Computer_label . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_Varian_UnityInova-800 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode Varian_UnityInova-800 _NMR_spectrometer.Entry_ID 18663 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model UnityInova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 18663 _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 Varian_UnityInova-800 Varian UnityInova . 800 . . . 18663 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 18663 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 NOESY no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 1 $Varian_UnityInova-800 . . . . . . . . . . . . . . . . 18663 1 stop_ save_ save_NMR_spectrometer_expt _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt _NMR_spec_expt.Entry_ID 18663 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $Varian_UnityInova-800 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID 1 _NMR_spec_expt.Method_label $Xplor _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 18663 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.251449519 . . . . . . . . . 18663 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 external indirect 1.0 . . . . . . . . . 18663 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 18663 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details 'Origin nmrStar file /ebi/msd/pdb_root/Processing/prepare/4b6v/ebi/CHEMICAL-SHIFTS_apo4E3_6.txt.csh' _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 NOESY 1 $sample_1 solution 18663 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET H H 1 8.372 0.002 . 1 . 3 . . 1 MET H . 18663 1 2 . 1 1 1 1 MET HA H 1 4.427 0.002 . 1 . 4 . . 1 MET HA . 18663 1 3 . 1 1 1 1 MET HB2 H 1 2.039 0.004 . 2 . 5 . . 1 MET HB2 . 18663 1 4 . 1 1 1 1 MET HB3 H 1 1.965 0.001 . 2 . 6 . . 1 MET HB3 . 18663 1 5 . 1 1 1 1 MET CA C 13 55.521 . . 1 . 1 . . 1 MET CA . 18663 1 6 . 1 1 1 1 MET CB C 13 32.538 . . 1 . 2 . . 1 MET CB . 18663 1 7 . 1 1 1 1 MET N N 15 122.031 0.021 . 1 . 7 . . 1 MET N . 18663 1 8 . 1 1 2 2 ALA H H 1 8.263 0.005 . 1 . 10 . . 2 ALA H . 18663 1 9 . 1 1 2 2 ALA HA H 1 4.305 0.004 . 1 . 11 . . 2 ALA HA . 18663 1 10 . 1 1 2 2 ALA HB1 H 1 1.344 0.002 . 1 . 13 . . 2 ALA HB1 . 18663 1 11 . 1 1 2 2 ALA HB2 H 1 1.344 0.002 . 1 . 13 . . 2 ALA HB2 . 18663 1 12 . 1 1 2 2 ALA HB3 H 1 1.344 0.002 . 1 . 13 . . 2 ALA HB3 . 18663 1 13 . 1 1 2 2 ALA CA C 13 51.936 0.001 . 1 . 8 . . 2 ALA CA . 18663 1 14 . 1 1 2 2 ALA CB C 13 18.885 . . 1 . 9 . . 2 ALA CB . 18663 1 15 . 1 1 2 2 ALA N N 15 125.602 0.007 . 1 . 12 . . 2 ALA N . 18663 1 16 . 1 1 3 3 LEU H H 1 8.218 0.004 . 1 . 18 . . 3 LEU H . 18663 1 17 . 1 1 3 3 LEU HA H 1 4.580 0.002 . 1 . 19 . . 3 LEU HA . 18663 1 18 . 1 1 3 3 LEU HB2 H 1 1.557 0.002 . 2 . 20 . . 3 LEU HB2 . 18663 1 19 . 1 1 3 3 LEU HB3 H 1 1.518 0.002 . 2 . 21 . . 3 LEU HB3 . 18663 1 20 . 1 1 3 3 LEU HG H 1 1.666 0.004 . 1 . 22 . . 3 LEU HG . 18663 1 21 . 1 1 3 3 LEU HD11 H 1 0.896 0.004 . 2 . 24 . . 3 LEU HD11 . 18663 1 22 . 1 1 3 3 LEU HD12 H 1 0.896 0.004 . 2 . 24 . . 3 LEU HD12 . 18663 1 23 . 1 1 3 3 LEU HD13 H 1 0.896 0.004 . 2 . 24 . . 3 LEU HD13 . 18663 1 24 . 1 1 3 3 LEU HD21 H 1 0.917 . . 2 . 25 . . 3 LEU HD21 . 18663 1 25 . 1 1 3 3 LEU HD22 H 1 0.917 . . 2 . 25 . . 3 LEU HD22 . 18663 1 26 . 1 1 3 3 LEU HD23 H 1 0.917 . . 2 . 25 . . 3 LEU HD23 . 18663 1 27 . 1 1 3 3 LEU CA C 13 52.588 . . 1 . 14 . . 3 LEU CA . 18663 1 28 . 1 1 3 3 LEU CB C 13 41.403 . . 1 . 15 . . 3 LEU CB . 18663 1 29 . 1 1 3 3 LEU CG C 13 27.455 . . 1 . 17 . . 3 LEU CG . 18663 1 30 . 1 1 3 3 LEU CD1 C 13 23.059 . . 1 . 16 . . 3 LEU CD1 . 18663 1 31 . 1 1 3 3 LEU N N 15 123.255 0.01 . 1 . 23 . . 3 LEU N . 18663 1 32 . 1 1 4 4 PRO HD2 H 1 3.853 0.002 . 2 . 27 . . 4 PRO HD2 . 18663 1 33 . 1 1 4 4 PRO HD3 H 1 3.598 0.002 . 2 . 28 . . 4 PRO HD3 . 18663 1 34 . 1 1 4 4 PRO CD C 13 50.126 0.011 . 1 . 26 . . 4 PRO CD . 18663 1 35 . 1 1 5 5 PRO HA H 1 4.376 0.003 . 1 . 33 . . 5 PRO HA . 18663 1 36 . 1 1 5 5 PRO HB2 H 1 2.288 0.004 . 2 . 34 . . 5 PRO HB2 . 18663 1 37 . 1 1 5 5 PRO HB3 H 1 1.898 0.004 . 2 . 35 . . 5 PRO HB3 . 18663 1 38 . 1 1 5 5 PRO HG3 H 1 2.019 0.002 . 1 . 38 . . 5 PRO HG3 . 18663 1 39 . 1 1 5 5 PRO HD2 H 1 3.801 0.003 . 2 . 36 . . 5 PRO HD2 . 18663 1 40 . 1 1 5 5 PRO HD3 H 1 3.641 0.001 . 2 . 37 . . 5 PRO HD3 . 18663 1 41 . 1 1 5 5 PRO CA C 13 62.900 . . 1 . 29 . . 5 PRO CA . 18663 1 42 . 1 1 5 5 PRO CB C 13 31.813 0.013 . 1 . 30 . . 5 PRO CB . 18663 1 43 . 1 1 5 5 PRO CG C 13 27.185 . . 1 . 32 . . 5 PRO CG . 18663 1 44 . 1 1 5 5 PRO CD C 13 50.096 . . 1 . 31 . . 5 PRO CD . 18663 1 45 . 1 1 6 6 ALA H H 1 8.344 0.005 . 1 . 41 . . 6 ALA H . 18663 1 46 . 1 1 6 6 ALA HA H 1 4.247 0.001 . 1 . 42 . . 6 ALA HA . 18663 1 47 . 1 1 6 6 ALA HB1 H 1 1.365 0.001 . 1 . 44 . . 6 ALA HB1 . 18663 1 48 . 1 1 6 6 ALA HB2 H 1 1.365 0.001 . 1 . 44 . . 6 ALA HB2 . 18663 1 49 . 1 1 6 6 ALA HB3 H 1 1.365 0.001 . 1 . 44 . . 6 ALA HB3 . 18663 1 50 . 1 1 6 6 ALA CA C 13 52.280 . . 1 . 39 . . 6 ALA CA . 18663 1 51 . 1 1 6 6 ALA CB C 13 18.836 . . 1 . 40 . . 6 ALA CB . 18663 1 52 . 1 1 6 6 ALA N N 15 124.133 0.05 . 1 . 43 . . 6 ALA N . 18663 1 53 . 1 1 7 7 ALA H H 1 8.246 0.007 . 1 . 47 . . 7 ALA H . 18663 1 54 . 1 1 7 7 ALA HA H 1 4.293 0.001 . 1 . 48 . . 7 ALA HA . 18663 1 55 . 1 1 7 7 ALA HB1 H 1 1.351 0.002 . 1 . 50 . . 7 ALA HB1 . 18663 1 56 . 1 1 7 7 ALA HB2 H 1 1.351 0.002 . 1 . 50 . . 7 ALA HB2 . 18663 1 57 . 1 1 7 7 ALA HB3 H 1 1.351 0.002 . 1 . 50 . . 7 ALA HB3 . 18663 1 58 . 1 1 7 7 ALA CA C 13 52.096 . . 1 . 45 . . 7 ALA CA . 18663 1 59 . 1 1 7 7 ALA CB C 13 19.032 . . 1 . 46 . . 7 ALA CB . 18663 1 60 . 1 1 7 7 ALA N N 15 123.494 0.027 . 1 . 49 . . 7 ALA N . 18663 1 61 . 1 1 8 8 ALA H H 1 8.239 0.006 . 1 . 53 . . 8 ALA H . 18663 1 62 . 1 1 8 8 ALA HA H 1 4.556 . . 1 . 54 . . 8 ALA HA . 18663 1 63 . 1 1 8 8 ALA HB1 H 1 1.320 0.002 . 1 . 56 . . 8 ALA HB1 . 18663 1 64 . 1 1 8 8 ALA HB2 H 1 1.320 0.002 . 1 . 56 . . 8 ALA HB2 . 18663 1 65 . 1 1 8 8 ALA HB3 H 1 1.320 0.002 . 1 . 56 . . 8 ALA HB3 . 18663 1 66 . 1 1 8 8 ALA CA C 13 50.083 . . 1 . 51 . . 8 ALA CA . 18663 1 67 . 1 1 8 8 ALA CB C 13 17.773 . . 1 . 52 . . 8 ALA CB . 18663 1 68 . 1 1 8 8 ALA N N 15 124.787 0.07 . 1 . 55 . . 8 ALA N . 18663 1 69 . 1 1 9 9 PRO HA H 1 4.683 0.001 . 1 . 61 . . 9 PRO HA . 18663 1 70 . 1 1 9 9 PRO HB2 H 1 2.337 0.001 . 2 . 62 . . 9 PRO HB2 . 18663 1 71 . 1 1 9 9 PRO HB3 H 1 1.894 0.001 . 2 . 63 . . 9 PRO HB3 . 18663 1 72 . 1 1 9 9 PRO HG2 H 1 2.042 . . 2 . 66 . . 9 PRO HG2 . 18663 1 73 . 1 1 9 9 PRO HG3 H 1 2.027 0.001 . 2 . 67 . . 9 PRO HG3 . 18663 1 74 . 1 1 9 9 PRO HD2 H 1 3.799 0.002 . 2 . 64 . . 9 PRO HD2 . 18663 1 75 . 1 1 9 9 PRO HD3 H 1 3.590 0.001 . 2 . 65 . . 9 PRO HD3 . 18663 1 76 . 1 1 9 9 PRO CA C 13 61.166 . . 1 . 57 . . 9 PRO CA . 18663 1 77 . 1 1 9 9 PRO CB C 13 30.585 0.013 . 1 . 58 . . 9 PRO CB . 18663 1 78 . 1 1 9 9 PRO CG C 13 27.146 0.001 . 1 . 60 . . 9 PRO CG . 18663 1 79 . 1 1 9 9 PRO CD C 13 50.150 0.019 . 1 . 59 . . 9 PRO CD . 18663 1 80 . 1 1 10 10 PRO HA H 1 4.405 0.003 . 1 . 72 . . 10 PRO HA . 18663 1 81 . 1 1 10 10 PRO HB2 H 1 2.290 0.003 . 2 . 73 . . 10 PRO HB2 . 18663 1 82 . 1 1 10 10 PRO HB3 H 1 1.933 0.003 . 2 . 74 . . 10 PRO HB3 . 18663 1 83 . 1 1 10 10 PRO HG3 H 1 2.030 0.003 . 1 . 77 . . 10 PRO HG3 . 18663 1 84 . 1 1 10 10 PRO HD2 H 1 3.804 0.001 . 2 . 75 . . 10 PRO HD2 . 18663 1 85 . 1 1 10 10 PRO HD3 H 1 3.633 0.003 . 2 . 76 . . 10 PRO HD3 . 18663 1 86 . 1 1 10 10 PRO CA C 13 63.104 . . 1 . 68 . . 10 PRO CA . 18663 1 87 . 1 1 10 10 PRO CB C 13 31.500 0.008 . 1 . 69 . . 10 PRO CB . 18663 1 88 . 1 1 10 10 PRO CG C 13 27.362 . . 1 . 71 . . 10 PRO CG . 18663 1 89 . 1 1 10 10 PRO CD C 13 50.180 0.008 . 1 . 70 . . 10 PRO CD . 18663 1 90 . 1 1 11 11 GLY H H 1 8.544 0.004 . 1 . 79 . . 11 GLY H . 18663 1 91 . 1 1 11 11 GLY HA3 H 1 3.945 0.004 . 1 . 80 . . 11 GLY HA3 . 18663 1 92 . 1 1 11 11 GLY CA C 13 45.168 . . 1 . 78 . . 11 GLY CA . 18663 1 93 . 1 1 11 11 GLY N N 15 109.662 0.029 . 1 . 81 . . 11 GLY N . 18663 1 94 . 1 1 12 12 ALA H H 1 8.152 0.004 . 1 . 84 . . 12 ALA H . 18663 1 95 . 1 1 12 12 ALA HA H 1 4.301 0.005 . 1 . 85 . . 12 ALA HA . 18663 1 96 . 1 1 12 12 ALA HB1 H 1 1.381 0.004 . 1 . 87 . . 12 ALA HB1 . 18663 1 97 . 1 1 12 12 ALA HB2 H 1 1.381 0.004 . 1 . 87 . . 12 ALA HB2 . 18663 1 98 . 1 1 12 12 ALA HB3 H 1 1.381 0.004 . 1 . 87 . . 12 ALA HB3 . 18663 1 99 . 1 1 12 12 ALA CA C 13 52.573 . . 1 . 82 . . 12 ALA CA . 18663 1 100 . 1 1 12 12 ALA CB C 13 18.864 . . 1 . 83 . . 12 ALA CB . 18663 1 101 . 1 1 12 12 ALA N N 15 123.547 0.059 . 1 . 86 . . 12 ALA N . 18663 1 102 . 1 1 13 13 ASN H H 1 8.516 0.007 . 1 . 90 . . 13 ASN H . 18663 1 103 . 1 1 13 13 ASN HA H 1 4.697 0.001 . 1 . 91 . . 13 ASN HA . 18663 1 104 . 1 1 13 13 ASN HB2 H 1 2.831 0.004 . 2 . 92 . . 13 ASN HB2 . 18663 1 105 . 1 1 13 13 ASN HB3 H 1 2.689 0.003 . 2 . 93 . . 13 ASN HB3 . 18663 1 106 . 1 1 13 13 ASN HD21 H 1 6.915 0.003 . 1 . 94 . . 13 ASN HD21 . 18663 1 107 . 1 1 13 13 ASN HD22 H 1 7.634 0.002 . 1 . 95 . . 13 ASN HD22 . 18663 1 108 . 1 1 13 13 ASN CA C 13 52.763 . . 1 . 88 . . 13 ASN CA . 18663 1 109 . 1 1 13 13 ASN CB C 13 38.806 0.008 . 1 . 89 . . 13 ASN CB . 18663 1 110 . 1 1 13 13 ASN N N 15 117.435 0.072 . 1 . 96 . . 13 ASN N . 18663 1 111 . 1 1 13 13 ASN ND2 N 15 113.016 . . 1 . 97 . . 13 ASN ND2 . 18663 1 112 . 1 1 14 14 GLU H H 1 8.298 0.004 . 1 . 101 . . 14 GLU H . 18663 1 113 . 1 1 14 14 GLU HA H 1 4.556 0.001 . 1 . 102 . . 14 GLU HA . 18663 1 114 . 1 1 14 14 GLU HB2 H 1 2.058 0.003 . 2 . 103 . . 14 GLU HB2 . 18663 1 115 . 1 1 14 14 GLU HB3 H 1 1.925 0.002 . 2 . 104 . . 14 GLU HB3 . 18663 1 116 . 1 1 14 14 GLU HG3 H 1 2.285 0.007 . 1 . 105 . . 14 GLU HG3 . 18663 1 117 . 1 1 14 14 GLU CA C 13 55.051 . . 1 . 98 . . 14 GLU CA . 18663 1 118 . 1 1 14 14 GLU CB C 13 29.109 0.016 . 1 . 99 . . 14 GLU CB . 18663 1 119 . 1 1 14 14 GLU CG C 13 35.621 . . 1 . 100 . . 14 GLU CG . 18663 1 120 . 1 1 14 14 GLU N N 15 122.307 0.009 . 1 . 106 . . 14 GLU N . 18663 1 121 . 1 1 15 15 PRO HA H 1 4.421 0.01 . 1 . 111 . . 15 PRO HA . 18663 1 122 . 1 1 15 15 PRO HB2 H 1 2.296 0.005 . 2 . 112 . . 15 PRO HB2 . 18663 1 123 . 1 1 15 15 PRO HB3 H 1 1.923 0.004 . 2 . 113 . . 15 PRO HB3 . 18663 1 124 . 1 1 15 15 PRO HG3 H 1 2.027 0.002 . 1 . 116 . . 15 PRO HG3 . 18663 1 125 . 1 1 15 15 PRO HD2 H 1 3.806 0.004 . 2 . 114 . . 15 PRO HD2 . 18663 1 126 . 1 1 15 15 PRO HD3 H 1 3.631 0.004 . 2 . 115 . . 15 PRO HD3 . 18663 1 127 . 1 1 15 15 PRO CA C 13 63.046 0.007 . 1 . 107 . . 15 PRO CA . 18663 1 128 . 1 1 15 15 PRO CB C 13 31.555 0.032 . 1 . 108 . . 15 PRO CB . 18663 1 129 . 1 1 15 15 PRO CG C 13 27.361 0.032 . 1 . 110 . . 15 PRO CG . 18663 1 130 . 1 1 15 15 PRO CD C 13 50.124 0.016 . 1 . 109 . . 15 PRO CD . 18663 1 131 . 1 1 16 16 LEU H H 1 8.385 0.005 . 1 . 121 . . 16 LEU H . 18663 1 132 . 1 1 16 16 LEU HA H 1 4.178 0.003 . 1 . 122 . . 16 LEU HA . 18663 1 133 . 1 1 16 16 LEU HB2 H 1 1.607 0.002 . 1 . 1863 . . 16 LEU HB2 . 18663 1 134 . 1 1 16 16 LEU HB3 H 1 1.607 0.002 . 1 . 125 . . 16 LEU HB3 . 18663 1 135 . 1 1 16 16 LEU HG H 1 1.618 0.004 . 1 . 123 . . 16 LEU HG . 18663 1 136 . 1 1 16 16 LEU HD11 H 1 0.842 0.003 . 2 . 126 . . 16 LEU HD11 . 18663 1 137 . 1 1 16 16 LEU HD12 H 1 0.842 0.003 . 2 . 126 . . 16 LEU HD12 . 18663 1 138 . 1 1 16 16 LEU HD13 H 1 0.842 0.003 . 2 . 126 . . 16 LEU HD13 . 18663 1 139 . 1 1 16 16 LEU HD21 H 1 0.868 . . 2 . 127 . . 16 LEU HD21 . 18663 1 140 . 1 1 16 16 LEU HD22 H 1 0.868 . . 2 . 127 . . 16 LEU HD22 . 18663 1 141 . 1 1 16 16 LEU HD23 H 1 0.868 . . 2 . 127 . . 16 LEU HD23 . 18663 1 142 . 1 1 16 16 LEU CA C 13 56.210 . . 1 . 117 . . 16 LEU CA . 18663 1 143 . 1 1 16 16 LEU CB C 13 41.785 0.032 . 1 . 118 . . 16 LEU CB . 18663 1 144 . 1 1 16 16 LEU CG C 13 26.860 0.006 . 1 . 120 . . 16 LEU CG . 18663 1 145 . 1 1 16 16 LEU CD1 C 13 24.089 . . 1 . 119 . . 16 LEU CD1 . 18663 1 146 . 1 1 16 16 LEU N N 15 121.615 0.048 . 1 . 124 . . 16 LEU N . 18663 1 147 . 1 1 17 17 ASP H H 1 8.189 0.005 . 1 . 130 . . 17 ASP H . 18663 1 148 . 1 1 17 17 ASP HA H 1 4.409 0.009 . 1 . 131 . . 17 ASP HA . 18663 1 149 . 1 1 17 17 ASP HB2 H 1 2.689 0.005 . 2 . 132 . . 17 ASP HB2 . 18663 1 150 . 1 1 17 17 ASP HB3 H 1 2.683 0.011 . 2 . 133 . . 17 ASP HB3 . 18663 1 151 . 1 1 17 17 ASP CA C 13 55.257 . . 1 . 128 . . 17 ASP CA . 18663 1 152 . 1 1 17 17 ASP CB C 13 40.577 . . 1 . 129 . . 17 ASP CB . 18663 1 153 . 1 1 17 17 ASP N N 15 118.882 0.081 . 1 . 134 . . 17 ASP N . 18663 1 154 . 1 1 18 18 LYS H H 1 8.042 0.007 . 1 . 140 . . 18 LYS H . 18663 1 155 . 1 1 18 18 LYS HA H 1 4.137 0.003 . 1 . 141 . . 18 LYS HA . 18663 1 156 . 1 1 18 18 LYS HB2 H 1 1.840 0.005 . 2 . 142 . . 18 LYS HB2 . 18663 1 157 . 1 1 18 18 LYS HB3 H 1 1.798 0.002 . 2 . 143 . . 18 LYS HB3 . 18663 1 158 . 1 1 18 18 LYS HG2 H 1 1.475 0.003 . 2 . 147 . . 18 LYS HG2 . 18663 1 159 . 1 1 18 18 LYS HG3 H 1 1.413 0.003 . 2 . 148 . . 18 LYS HG3 . 18663 1 160 . 1 1 18 18 LYS HD3 H 1 1.655 0.007 . 1 . 144 . . 18 LYS HD3 . 18663 1 161 . 1 1 18 18 LYS HE2 H 1 2.981 0.003 . 2 . 145 . . 18 LYS HE2 . 18663 1 162 . 1 1 18 18 LYS HE3 H 1 2.960 0.009 . 2 . 146 . . 18 LYS HE3 . 18663 1 163 . 1 1 18 18 LYS CA C 13 57.450 . . 1 . 135 . . 18 LYS CA . 18663 1 164 . 1 1 18 18 LYS CB C 13 32.254 . . 1 . 136 . . 18 LYS CB . 18663 1 165 . 1 1 18 18 LYS CG C 13 24.534 . . 1 . 139 . . 18 LYS CG . 18663 1 166 . 1 1 18 18 LYS CD C 13 28.797 0.007 . 1 . 137 . . 18 LYS CD . 18663 1 167 . 1 1 18 18 LYS CE C 13 41.800 0.016 . 1 . 138 . . 18 LYS CE . 18663 1 168 . 1 1 18 18 LYS N N 15 121.355 0.023 . 1 . 149 . . 18 LYS N . 18663 1 169 . 1 1 19 19 ALA H H 1 8.161 0.004 . 1 . 152 . . 19 ALA H . 18663 1 170 . 1 1 19 19 ALA HA H 1 4.163 0.005 . 1 . 153 . . 19 ALA HA . 18663 1 171 . 1 1 19 19 ALA HB1 H 1 1.403 0.001 . 1 . 155 . . 19 ALA HB1 . 18663 1 172 . 1 1 19 19 ALA HB2 H 1 1.403 0.001 . 1 . 155 . . 19 ALA HB2 . 18663 1 173 . 1 1 19 19 ALA HB3 H 1 1.403 0.001 . 1 . 155 . . 19 ALA HB3 . 18663 1 174 . 1 1 19 19 ALA CA C 13 53.669 . . 1 . 150 . . 19 ALA CA . 18663 1 175 . 1 1 19 19 ALA CB C 13 18.148 0.064 . 1 . 151 . . 19 ALA CB . 18663 1 176 . 1 1 19 19 ALA N N 15 123.388 0.091 . 1 . 154 . . 19 ALA N . 18663 1 177 . 1 1 20 20 LEU H H 1 8.095 0.006 . 1 . 161 . . 20 LEU H . 18663 1 178 . 1 1 20 20 LEU HA H 1 4.180 0.003 . 1 . 162 . . 20 LEU HA . 18663 1 179 . 1 1 20 20 LEU HB2 H 1 1.727 0.003 . 2 . 163 . . 20 LEU HB2 . 18663 1 180 . 1 1 20 20 LEU HB3 H 1 1.499 0.003 . 2 . 164 . . 20 LEU HB3 . 18663 1 181 . 1 1 20 20 LEU HG H 1 1.656 0.005 . 1 . 165 . . 20 LEU HG . 18663 1 182 . 1 1 20 20 LEU HD11 H 1 0.685 0.002 . 2 . 167 . . 20 LEU HD11 . 18663 1 183 . 1 1 20 20 LEU HD12 H 1 0.685 0.002 . 2 . 167 . . 20 LEU HD12 . 18663 1 184 . 1 1 20 20 LEU HD13 H 1 0.685 0.002 . 2 . 167 . . 20 LEU HD13 . 18663 1 185 . 1 1 20 20 LEU HD21 H 1 0.738 0.003 . 2 . 168 . . 20 LEU HD21 . 18663 1 186 . 1 1 20 20 LEU HD22 H 1 0.738 0.003 . 2 . 168 . . 20 LEU HD22 . 18663 1 187 . 1 1 20 20 LEU HD23 H 1 0.738 0.003 . 2 . 168 . . 20 LEU HD23 . 18663 1 188 . 1 1 20 20 LEU CA C 13 55.829 . . 1 . 156 . . 20 LEU CA . 18663 1 189 . 1 1 20 20 LEU CB C 13 41.324 0.016 . 1 . 157 . . 20 LEU CB . 18663 1 190 . 1 1 20 20 LEU CG C 13 27.203 . . 1 . 160 . . 20 LEU CG . 18663 1 191 . 1 1 20 20 LEU CD1 C 13 22.914 . . 2 . 158 . . 20 LEU CD1 . 18663 1 192 . 1 1 20 20 LEU CD2 C 13 25.466 . . 2 . 159 . . 20 LEU CD2 . 18663 1 193 . 1 1 20 20 LEU N N 15 118.227 0.092 . 1 . 166 . . 20 LEU N . 18663 1 194 . 1 1 21 21 SER H H 1 7.980 0.008 . 1 . 171 . . 21 SER H . 18663 1 195 . 1 1 21 21 SER HA H 1 4.344 0.005 . 1 . 172 . . 21 SER HA . 18663 1 196 . 1 1 21 21 SER HB2 H 1 3.939 0.004 . 2 . 173 . . 21 SER HB2 . 18663 1 197 . 1 1 21 21 SER HB3 H 1 3.915 0.003 . 2 . 174 . . 21 SER HB3 . 18663 1 198 . 1 1 21 21 SER CA C 13 59.197 . . 1 . 169 . . 21 SER CA . 18663 1 199 . 1 1 21 21 SER CB C 13 63.263 . . 1 . 170 . . 21 SER CB . 18663 1 200 . 1 1 21 21 SER N N 15 115.098 0.081 . 1 . 175 . . 21 SER N . 18663 1 201 . 1 1 22 22 ALA H H 1 7.780 0.009 . 1 . 178 . . 22 ALA H . 18663 1 202 . 1 1 22 22 ALA HA H 1 4.386 0.005 . 1 . 179 . . 22 ALA HA . 18663 1 203 . 1 1 22 22 ALA HB1 H 1 1.379 0.008 . 1 . 181 . . 22 ALA HB1 . 18663 1 204 . 1 1 22 22 ALA HB2 H 1 1.379 0.008 . 1 . 181 . . 22 ALA HB2 . 18663 1 205 . 1 1 22 22 ALA HB3 H 1 1.379 0.008 . 1 . 181 . . 22 ALA HB3 . 18663 1 206 . 1 1 22 22 ALA CA C 13 51.858 . . 1 . 176 . . 22 ALA CA . 18663 1 207 . 1 1 22 22 ALA CB C 13 18.848 0.127 . 1 . 177 . . 22 ALA CB . 18663 1 208 . 1 1 22 22 ALA N N 15 124.129 0.097 . 1 . 180 . . 22 ALA N . 18663 1 209 . 1 1 23 23 LEU H H 1 7.683 0.003 . 1 . 187 . . 23 LEU H . 18663 1 210 . 1 1 23 23 LEU HA H 1 4.496 0.002 . 1 . 188 . . 23 LEU HA . 18663 1 211 . 1 1 23 23 LEU HB2 H 1 1.619 0.003 . 2 . 189 . . 23 LEU HB2 . 18663 1 212 . 1 1 23 23 LEU HB3 H 1 1.478 0.005 . 2 . 190 . . 23 LEU HB3 . 18663 1 213 . 1 1 23 23 LEU HG H 1 1.711 0.003 . 1 . 191 . . 23 LEU HG . 18663 1 214 . 1 1 23 23 LEU HD11 H 1 0.830 0.004 . 2 . 193 . . 23 LEU HD11 . 18663 1 215 . 1 1 23 23 LEU HD12 H 1 0.830 0.004 . 2 . 193 . . 23 LEU HD12 . 18663 1 216 . 1 1 23 23 LEU HD13 H 1 0.830 0.004 . 2 . 193 . . 23 LEU HD13 . 18663 1 217 . 1 1 23 23 LEU HD21 H 1 0.826 0.001 . 2 . 194 . . 23 LEU HD21 . 18663 1 218 . 1 1 23 23 LEU HD22 H 1 0.826 0.001 . 2 . 194 . . 23 LEU HD22 . 18663 1 219 . 1 1 23 23 LEU HD23 H 1 0.826 0.001 . 2 . 194 . . 23 LEU HD23 . 18663 1 220 . 1 1 23 23 LEU CA C 13 52.844 0.036 . 1 . 182 . . 23 LEU CA . 18663 1 221 . 1 1 23 23 LEU CB C 13 41.085 0.032 . 1 . 183 . . 23 LEU CB . 18663 1 222 . 1 1 23 23 LEU CG C 13 26.758 . . 1 . 186 . . 23 LEU CG . 18663 1 223 . 1 1 23 23 LEU CD1 C 13 22.787 . . 2 . 184 . . 23 LEU CD1 . 18663 1 224 . 1 1 23 23 LEU CD2 C 13 23.279 . . 2 . 185 . . 23 LEU CD2 . 18663 1 225 . 1 1 23 23 LEU N N 15 122.139 0.017 . 1 . 192 . . 23 LEU N . 18663 1 226 . 1 1 24 24 PRO HD2 H 1 3.875 0.006 . 2 . 195 . . 24 PRO HD2 . 18663 1 227 . 1 1 24 24 PRO HD3 H 1 3.583 0.001 . 2 . 196 . . 24 PRO HD3 . 18663 1 228 . 1 1 25 25 PRO HA H 1 4.423 0.003 . 1 . 199 . . 25 PRO HA . 18663 1 229 . 1 1 25 25 PRO HB2 H 1 2.276 0.004 . 2 . 200 . . 25 PRO HB2 . 18663 1 230 . 1 1 25 25 PRO HB3 H 1 1.904 0.002 . 2 . 201 . . 25 PRO HB3 . 18663 1 231 . 1 1 25 25 PRO CA C 13 62.776 0.01 . 1 . 197 . . 25 PRO CA . 18663 1 232 . 1 1 25 25 PRO CB C 13 31.666 . . 1 . 198 . . 25 PRO CB . 18663 1 233 . 1 1 26 26 GLU H H 1 8.395 0.006 . 1 . 205 . . 26 GLU H . 18663 1 234 . 1 1 26 26 GLU HA H 1 4.601 0.004 . 1 . 206 . . 26 GLU HA . 18663 1 235 . 1 1 26 26 GLU HB2 H 1 2.032 0.004 . 2 . 207 . . 26 GLU HB2 . 18663 1 236 . 1 1 26 26 GLU HB3 H 1 1.883 0.003 . 2 . 208 . . 26 GLU HB3 . 18663 1 237 . 1 1 26 26 GLU HG3 H 1 2.261 0.002 . 1 . 209 . . 26 GLU HG3 . 18663 1 238 . 1 1 26 26 GLU CA C 13 54.209 . . 1 . 202 . . 26 GLU CA . 18663 1 239 . 1 1 26 26 GLU CB C 13 29.236 . . 1 . 203 . . 26 GLU CB . 18663 1 240 . 1 1 26 26 GLU CG C 13 36.543 . . 1 . 204 . . 26 GLU CG . 18663 1 241 . 1 1 26 26 GLU N N 15 122.116 0.013 . 1 . 210 . . 26 GLU N . 18663 1 242 . 1 1 27 27 PRO HD2 H 1 3.774 0.008 . 2 . 212 . . 27 PRO HD2 . 18663 1 243 . 1 1 27 27 PRO HD3 H 1 3.728 0.004 . 2 . 213 . . 27 PRO HD3 . 18663 1 244 . 1 1 27 27 PRO CD C 13 50.378 . . 1 . 211 . . 27 PRO CD . 18663 1 245 . 1 1 28 28 GLY H H 1 8.569 0.006 . 1 . 215 . . 28 GLY H . 18663 1 246 . 1 1 28 28 GLY HA2 H 1 3.986 0.004 . 1 . 1864 . . 28 GLY HA2 . 18663 1 247 . 1 1 28 28 GLY HA3 H 1 3.986 0.004 . 1 . 217 . . 28 GLY HA3 . 18663 1 248 . 1 1 28 28 GLY CA C 13 45.028 0.012 . 1 . 214 . . 28 GLY CA . 18663 1 249 . 1 1 28 28 GLY N N 15 109.207 0.074 . 1 . 216 . . 28 GLY N . 18663 1 250 . 1 1 29 29 GLY H H 1 8.255 0.004 . 1 . 219 . . 29 GLY H . 18663 1 251 . 1 1 29 29 GLY HA2 H 1 4.067 0.003 . 2 . 220 . . 29 GLY HA2 . 18663 1 252 . 1 1 29 29 GLY HA3 H 1 4.047 0.002 . 2 . 221 . . 29 GLY HA3 . 18663 1 253 . 1 1 29 29 GLY CA C 13 44.659 0.016 . 1 . 218 . . 29 GLY CA . 18663 1 254 . 1 1 29 29 GLY N N 15 108.931 0.041 . 1 . 222 . . 29 GLY N . 18663 1 255 . 1 1 30 30 VAL H H 1 8.838 0.003 . 1 . 227 . . 30 VAL H . 18663 1 256 . 1 1 30 30 VAL HA H 1 4.396 0.002 . 1 . 228 . . 30 VAL HA . 18663 1 257 . 1 1 30 30 VAL HB H 1 2.109 0.003 . 1 . 229 . . 30 VAL HB . 18663 1 258 . 1 1 30 30 VAL HG11 H 1 1.024 0.002 . 2 . 231 . . 30 VAL HG11 . 18663 1 259 . 1 1 30 30 VAL HG12 H 1 1.024 0.002 . 2 . 231 . . 30 VAL HG12 . 18663 1 260 . 1 1 30 30 VAL HG13 H 1 1.024 0.002 . 2 . 231 . . 30 VAL HG13 . 18663 1 261 . 1 1 30 30 VAL HG21 H 1 1.098 0.004 . 2 . 232 . . 30 VAL HG21 . 18663 1 262 . 1 1 30 30 VAL HG22 H 1 1.098 0.004 . 2 . 232 . . 30 VAL HG22 . 18663 1 263 . 1 1 30 30 VAL HG23 H 1 1.098 0.004 . 2 . 232 . . 30 VAL HG23 . 18663 1 264 . 1 1 30 30 VAL CA C 13 60.372 . . 1 . 223 . . 30 VAL CA . 18663 1 265 . 1 1 30 30 VAL CB C 13 32.349 . . 1 . 224 . . 30 VAL CB . 18663 1 266 . 1 1 30 30 VAL CG1 C 13 20.722 . . 2 . 225 . . 30 VAL CG1 . 18663 1 267 . 1 1 30 30 VAL CG2 C 13 20.754 . . 2 . 226 . . 30 VAL CG2 . 18663 1 268 . 1 1 30 30 VAL N N 15 123.730 0.069 . 1 . 230 . . 30 VAL N . 18663 1 269 . 1 1 31 31 PRO HA H 1 4.655 0.002 . 1 . 235 . . 31 PRO HA . 18663 1 270 . 1 1 31 31 PRO HB2 H 1 2.397 0.001 . 2 . 236 . . 31 PRO HB2 . 18663 1 271 . 1 1 31 31 PRO HB3 H 1 1.994 . . 2 . 237 . . 31 PRO HB3 . 18663 1 272 . 1 1 31 31 PRO HD2 H 1 4.122 . . 2 . 238 . . 31 PRO HD2 . 18663 1 273 . 1 1 31 31 PRO HD3 H 1 3.795 . . 2 . 239 . . 31 PRO HD3 . 18663 1 274 . 1 1 31 31 PRO CA C 13 62.929 . . 1 . 233 . . 31 PRO CA . 18663 1 275 . 1 1 31 31 PRO CB C 13 32.206 . . 1 . 234 . . 31 PRO CB . 18663 1 276 . 1 1 32 32 LEU H H 1 7.759 0.006 . 1 . 244 . . 32 LEU H . 18663 1 277 . 1 1 32 32 LEU HA H 1 4.592 0.004 . 1 . 245 . . 32 LEU HA . 18663 1 278 . 1 1 32 32 LEU HG H 1 1.292 0.001 . 1 . 246 . . 32 LEU HG . 18663 1 279 . 1 1 32 32 LEU HD11 H 1 0.710 0.004 . 2 . 248 . . 32 LEU HD11 . 18663 1 280 . 1 1 32 32 LEU HD12 H 1 0.710 0.004 . 2 . 248 . . 32 LEU HD12 . 18663 1 281 . 1 1 32 32 LEU HD13 H 1 0.710 0.004 . 2 . 248 . . 32 LEU HD13 . 18663 1 282 . 1 1 32 32 LEU HD21 H 1 0.905 0.004 . 2 . 249 . . 32 LEU HD21 . 18663 1 283 . 1 1 32 32 LEU HD22 H 1 0.905 0.004 . 2 . 249 . . 32 LEU HD22 . 18663 1 284 . 1 1 32 32 LEU HD23 H 1 0.905 0.004 . 2 . 249 . . 32 LEU HD23 . 18663 1 285 . 1 1 32 32 LEU CA C 13 53.462 . . 1 . 240 . . 32 LEU CA . 18663 1 286 . 1 1 32 32 LEU CG C 13 27.544 . . 1 . 243 . . 32 LEU CG . 18663 1 287 . 1 1 32 32 LEU CD1 C 13 23.295 . . 2 . 241 . . 32 LEU CD1 . 18663 1 288 . 1 1 32 32 LEU CD2 C 13 26.155 . . 2 . 242 . . 32 LEU CD2 . 18663 1 289 . 1 1 32 32 LEU N N 15 121.156 0.039 . 1 . 247 . . 32 LEU N . 18663 1 290 . 1 1 33 33 HIS H H 1 9.152 0.005 . 1 . 252 . . 33 HIS H . 18663 1 291 . 1 1 33 33 HIS HA H 1 4.220 0.006 . 1 . 253 . . 33 HIS HA . 18663 1 292 . 1 1 33 33 HIS HB2 H 1 3.560 0.009 . 2 . 254 . . 33 HIS HB2 . 18663 1 293 . 1 1 33 33 HIS HB3 H 1 3.334 0.001 . 2 . 255 . . 33 HIS HB3 . 18663 1 294 . 1 1 33 33 HIS CA C 13 59.736 . . 1 . 250 . . 33 HIS CA . 18663 1 295 . 1 1 33 33 HIS CB C 13 29.506 0.016 . 1 . 251 . . 33 HIS CB . 18663 1 296 . 1 1 33 33 HIS N N 15 123.333 0.08 . 1 . 256 . . 33 HIS N . 18663 1 297 . 1 1 34 34 SER H H 1 8.254 0.004 . 1 . 259 . . 34 SER H . 18663 1 298 . 1 1 34 34 SER HA H 1 4.798 0.001 . 1 . 260 . . 34 SER HA . 18663 1 299 . 1 1 34 34 SER HB2 H 1 3.454 0.011 . 2 . 261 . . 34 SER HB2 . 18663 1 300 . 1 1 34 34 SER HB3 H 1 3.420 0.012 . 2 . 262 . . 34 SER HB3 . 18663 1 301 . 1 1 34 34 SER CA C 13 54.503 . . 1 . 257 . . 34 SER CA . 18663 1 302 . 1 1 34 34 SER CB C 13 65.836 . . 1 . 258 . . 34 SER CB . 18663 1 303 . 1 1 34 34 SER N N 15 112.278 0.071 . 1 . 263 . . 34 SER N . 18663 1 304 . 1 1 35 35 PRO HA H 1 5.173 0.002 . 1 . 265 . . 35 PRO HA . 18663 1 305 . 1 1 35 35 PRO CA C 13 61.931 . . 1 . 264 . . 35 PRO CA . 18663 1 306 . 1 1 36 36 TRP H H 1 8.462 0.004 . 1 . 268 . . 36 TRP H . 18663 1 307 . 1 1 36 36 TRP HA H 1 5.162 0.005 . 1 . 269 . . 36 TRP HA . 18663 1 308 . 1 1 36 36 TRP HB2 H 1 2.936 0.004 . 2 . 270 . . 36 TRP HB2 . 18663 1 309 . 1 1 36 36 TRP HB3 H 1 2.533 0.005 . 2 . 271 . . 36 TRP HB3 . 18663 1 310 . 1 1 36 36 TRP HE1 H 1 11.252 0.01 . 1 . 272 . . 36 TRP HE1 . 18663 1 311 . 1 1 36 36 TRP CA C 13 56.528 . . 1 . 266 . . 36 TRP CA . 18663 1 312 . 1 1 36 36 TRP CB C 13 32.759 0.012 . 1 . 267 . . 36 TRP CB . 18663 1 313 . 1 1 36 36 TRP N N 15 119.591 0.082 . 1 . 273 . . 36 TRP N . 18663 1 314 . 1 1 36 36 TRP NE1 N 15 132.897 . . 1 . 274 . . 36 TRP NE1 . 18663 1 315 . 1 1 37 37 THR H H 1 9.949 0.004 . 1 . 278 . . 37 THR H . 18663 1 316 . 1 1 37 37 THR HA H 1 5.373 0.001 . 1 . 279 . . 37 THR HA . 18663 1 317 . 1 1 37 37 THR HB H 1 4.115 0.001 . 1 . 280 . . 37 THR HB . 18663 1 318 . 1 1 37 37 THR HG21 H 1 0.400 0.001 . 1 . 282 . . 37 THR HG21 . 18663 1 319 . 1 1 37 37 THR HG22 H 1 0.400 0.001 . 1 . 282 . . 37 THR HG22 . 18663 1 320 . 1 1 37 37 THR HG23 H 1 0.400 0.001 . 1 . 282 . . 37 THR HG23 . 18663 1 321 . 1 1 37 37 THR CA C 13 61.992 . . 1 . 275 . . 37 THR CA . 18663 1 322 . 1 1 37 37 THR CB C 13 71.268 . . 1 . 276 . . 37 THR CB . 18663 1 323 . 1 1 37 37 THR CG2 C 13 21.110 0.025 . 1 . 277 . . 37 THR CG2 . 18663 1 324 . 1 1 37 37 THR N N 15 118.568 0.017 . 1 . 281 . . 37 THR N . 18663 1 325 . 1 1 38 38 PHE H H 1 8.870 0.009 . 1 . 285 . . 38 PHE H . 18663 1 326 . 1 1 38 38 PHE HA H 1 5.700 0.001 . 1 . 286 . . 38 PHE HA . 18663 1 327 . 1 1 38 38 PHE HB2 H 1 2.970 0.004 . 2 . 287 . . 38 PHE HB2 . 18663 1 328 . 1 1 38 38 PHE HB3 H 1 2.942 0.003 . 2 . 288 . . 38 PHE HB3 . 18663 1 329 . 1 1 38 38 PHE CA C 13 57.894 . . 1 . 283 . . 38 PHE CA . 18663 1 330 . 1 1 38 38 PHE CB C 13 43.331 0.041 . 1 . 284 . . 38 PHE CB . 18663 1 331 . 1 1 38 38 PHE N N 15 125.225 0.038 . 1 . 289 . . 38 PHE N . 18663 1 332 . 1 1 39 39 TRP H H 1 10.148 0.008 . 1 . 297 . . 39 TRP H . 18663 1 333 . 1 1 39 39 TRP HA H 1 5.458 0.005 . 1 . 298 . . 39 TRP HA . 18663 1 334 . 1 1 39 39 TRP HB2 H 1 3.394 0.003 . 2 . 299 . . 39 TRP HB2 . 18663 1 335 . 1 1 39 39 TRP HB3 H 1 3.388 0.01 . 2 . 300 . . 39 TRP HB3 . 18663 1 336 . 1 1 39 39 TRP HD1 H 1 7.132 0.001 . 1 . 301 . . 39 TRP HD1 . 18663 1 337 . 1 1 39 39 TRP HE1 H 1 9.692 . . 1 . 302 . . 39 TRP HE1 . 18663 1 338 . 1 1 39 39 TRP HE3 H 1 7.270 0.002 . 1 . 303 . . 39 TRP HE3 . 18663 1 339 . 1 1 39 39 TRP HZ2 H 1 7.274 0.001 . 1 . 305 . . 39 TRP HZ2 . 18663 1 340 . 1 1 39 39 TRP HZ3 H 1 7.034 0.001 . 1 . 306 . . 39 TRP HZ3 . 18663 1 341 . 1 1 39 39 TRP HH2 H 1 7.202 0.002 . 1 . 304 . . 39 TRP HH2 . 18663 1 342 . 1 1 39 39 TRP CA C 13 56.496 . . 1 . 290 . . 39 TRP CA . 18663 1 343 . 1 1 39 39 TRP CB C 13 33.522 0.006 . 1 . 291 . . 39 TRP CB . 18663 1 344 . 1 1 39 39 TRP CD1 C 13 126.512 . . 1 . 292 . . 39 TRP CD1 . 18663 1 345 . 1 1 39 39 TRP CE3 C 13 119.333 . . 1 . 293 . . 39 TRP CE3 . 18663 1 346 . 1 1 39 39 TRP CZ2 C 13 114.377 . . 1 . 295 . . 39 TRP CZ2 . 18663 1 347 . 1 1 39 39 TRP CZ3 C 13 122.700 . . 1 . 296 . . 39 TRP CZ3 . 18663 1 348 . 1 1 39 39 TRP CH2 C 13 124.765 . . 1 . 294 . . 39 TRP CH2 . 18663 1 349 . 1 1 39 39 TRP N N 15 121.730 0.051 . 1 . 307 . . 39 TRP N . 18663 1 350 . 1 1 39 39 TRP NE1 N 15 128.860 . . 1 . 308 . . 39 TRP NE1 . 18663 1 351 . 1 1 40 40 LEU H H 1 9.611 0.005 . 1 . 314 . . 40 LEU H . 18663 1 352 . 1 1 40 40 LEU HA H 1 5.561 0.002 . 1 . 315 . . 40 LEU HA . 18663 1 353 . 1 1 40 40 LEU HB2 H 1 2.028 0.003 . 2 . 316 . . 40 LEU HB2 . 18663 1 354 . 1 1 40 40 LEU HB3 H 1 1.780 0.007 . 2 . 317 . . 40 LEU HB3 . 18663 1 355 . 1 1 40 40 LEU HG H 1 1.649 0.004 . 1 . 318 . . 40 LEU HG . 18663 1 356 . 1 1 40 40 LEU HD11 H 1 0.921 0.004 . 2 . 320 . . 40 LEU HD11 . 18663 1 357 . 1 1 40 40 LEU HD12 H 1 0.921 0.004 . 2 . 320 . . 40 LEU HD12 . 18663 1 358 . 1 1 40 40 LEU HD13 H 1 0.921 0.004 . 2 . 320 . . 40 LEU HD13 . 18663 1 359 . 1 1 40 40 LEU HD21 H 1 0.987 0.012 . 2 . 321 . . 40 LEU HD21 . 18663 1 360 . 1 1 40 40 LEU HD22 H 1 0.987 0.012 . 2 . 321 . . 40 LEU HD22 . 18663 1 361 . 1 1 40 40 LEU HD23 H 1 0.987 0.012 . 2 . 321 . . 40 LEU HD23 . 18663 1 362 . 1 1 40 40 LEU CA C 13 54.304 . . 1 . 309 . . 40 LEU CA . 18663 1 363 . 1 1 40 40 LEU CB C 13 45.644 0.016 . 1 . 310 . . 40 LEU CB . 18663 1 364 . 1 1 40 40 LEU CG C 13 27.876 0.006 . 1 . 313 . . 40 LEU CG . 18663 1 365 . 1 1 40 40 LEU CD1 C 13 23.276 0.012 . 2 . 311 . . 40 LEU CD1 . 18663 1 366 . 1 1 40 40 LEU CD2 C 13 26.282 . . 2 . 312 . . 40 LEU CD2 . 18663 1 367 . 1 1 40 40 LEU N N 15 123.014 0.018 . 1 . 319 . . 40 LEU N . 18663 1 368 . 1 1 41 41 ASP H H 1 9.177 0.007 . 1 . 324 . . 41 ASP H . 18663 1 369 . 1 1 41 41 ASP HA H 1 5.411 0.005 . 1 . 325 . . 41 ASP HA . 18663 1 370 . 1 1 41 41 ASP HB2 H 1 3.027 0.003 . 2 . 326 . . 41 ASP HB2 . 18663 1 371 . 1 1 41 41 ASP HB3 H 1 2.598 0.002 . 2 . 327 . . 41 ASP HB3 . 18663 1 372 . 1 1 41 41 ASP CA C 13 52.271 . . 1 . 322 . . 41 ASP CA . 18663 1 373 . 1 1 41 41 ASP CB C 13 44.453 . . 1 . 323 . . 41 ASP CB . 18663 1 374 . 1 1 41 41 ASP N N 15 126.788 0.05 . 1 . 328 . . 41 ASP N . 18663 1 375 . 1 1 42 42 ARG H H 1 8.442 0.003 . 1 . 333 . . 42 ARG H . 18663 1 376 . 1 1 42 42 ARG HA H 1 4.947 0.002 . 1 . 334 . . 42 ARG HA . 18663 1 377 . 1 1 42 42 ARG HB2 H 1 2.008 0.005 . 2 . 335 . . 42 ARG HB2 . 18663 1 378 . 1 1 42 42 ARG HB3 H 1 1.775 0.004 . 2 . 336 . . 42 ARG HB3 . 18663 1 379 . 1 1 42 42 ARG HG3 H 1 1.675 0.002 . 1 . 339 . . 42 ARG HG3 . 18663 1 380 . 1 1 42 42 ARG HD2 H 1 3.237 0.004 . 2 . 337 . . 42 ARG HD2 . 18663 1 381 . 1 1 42 42 ARG HD3 H 1 3.203 0.001 . 2 . 338 . . 42 ARG HD3 . 18663 1 382 . 1 1 42 42 ARG CA C 13 55.289 . . 1 . 329 . . 42 ARG CA . 18663 1 383 . 1 1 42 42 ARG CB C 13 31.206 . . 1 . 330 . . 42 ARG CB . 18663 1 384 . 1 1 42 42 ARG CG C 13 27.425 . . 1 . 332 . . 42 ARG CG . 18663 1 385 . 1 1 42 42 ARG CD C 13 43.729 0.024 . 1 . 331 . . 42 ARG CD . 18663 1 386 . 1 1 42 42 ARG N N 15 123.915 0.038 . 1 . 340 . . 42 ARG N . 18663 1 387 . 1 1 43 43 SER H H 1 8.240 0.007 . 1 . 343 . . 43 SER H . 18663 1 388 . 1 1 43 43 SER HA H 1 4.441 0.005 . 1 . 344 . . 43 SER HA . 18663 1 389 . 1 1 43 43 SER HB2 H 1 3.886 0.005 . 2 . 345 . . 43 SER HB2 . 18663 1 390 . 1 1 43 43 SER HB3 H 1 3.845 0.006 . 2 . 346 . . 43 SER HB3 . 18663 1 391 . 1 1 43 43 SER CA C 13 58.561 . . 1 . 341 . . 43 SER CA . 18663 1 392 . 1 1 43 43 SER CB C 13 63.635 0.009 . 1 . 342 . . 43 SER CB . 18663 1 393 . 1 1 43 43 SER N N 15 118.998 0.029 . 1 . 347 . . 43 SER N . 18663 1 394 . 1 1 44 44 LEU H H 1 8.442 0.005 . 1 . 352 . . 44 LEU H . 18663 1 395 . 1 1 44 44 LEU HA H 1 4.654 0.002 . 1 . 353 . . 44 LEU HA . 18663 1 396 . 1 1 44 44 LEU HB2 H 1 1.567 0.002 . 2 . 354 . . 44 LEU HB2 . 18663 1 397 . 1 1 44 44 LEU HB3 H 1 1.516 0.002 . 2 . 355 . . 44 LEU HB3 . 18663 1 398 . 1 1 44 44 LEU HG H 1 1.658 0.002 . 1 . 356 . . 44 LEU HG . 18663 1 399 . 1 1 44 44 LEU HD11 H 1 0.893 0.005 . 1 . 358 . . 44 LEU HD11 . 18663 1 400 . 1 1 44 44 LEU HD12 H 1 0.893 0.005 . 1 . 358 . . 44 LEU HD12 . 18663 1 401 . 1 1 44 44 LEU HD13 H 1 0.893 0.005 . 1 . 358 . . 44 LEU HD13 . 18663 1 402 . 1 1 44 44 LEU CA C 13 52.491 . . 1 . 348 . . 44 LEU CA . 18663 1 403 . 1 1 44 44 LEU CB C 13 41.467 . . 1 . 349 . . 44 LEU CB . 18663 1 404 . 1 1 44 44 LEU CG C 13 27.425 . . 1 . 351 . . 44 LEU CG . 18663 1 405 . 1 1 44 44 LEU CD1 C 13 23.645 . . 1 . 350 . . 44 LEU CD1 . 18663 1 406 . 1 1 44 44 LEU N N 15 125.229 0.064 . 1 . 357 . . 44 LEU N . 18663 1 407 . 1 1 45 45 PRO HA H 1 4.351 0.003 . 1 . 362 . . 45 PRO HA . 18663 1 408 . 1 1 45 45 PRO HB2 H 1 2.084 . . 2 . 363 . . 45 PRO HB2 . 18663 1 409 . 1 1 45 45 PRO HB3 H 1 1.897 . . 2 . 364 . . 45 PRO HB3 . 18663 1 410 . 1 1 45 45 PRO HD2 H 1 3.806 0.004 . 2 . 365 . . 45 PRO HD2 . 18663 1 411 . 1 1 45 45 PRO HD3 H 1 3.640 0.007 . 2 . 366 . . 45 PRO HD3 . 18663 1 412 . 1 1 45 45 PRO CA C 13 63.421 . . 1 . 359 . . 45 PRO CA . 18663 1 413 . 1 1 45 45 PRO CB C 13 31.261 . . 1 . 360 . . 45 PRO CB . 18663 1 414 . 1 1 45 45 PRO CD C 13 50.177 0.013 . 1 . 361 . . 45 PRO CD . 18663 1 415 . 1 1 46 46 GLY H H 1 8.708 0.004 . 1 . 368 . . 46 GLY H . 18663 1 416 . 1 1 46 46 GLY HA2 H 1 3.997 0.004 . 2 . 369 . . 46 GLY HA2 . 18663 1 417 . 1 1 46 46 GLY HA3 H 1 3.819 0.001 . 2 . 370 . . 46 GLY HA3 . 18663 1 418 . 1 1 46 46 GLY CA C 13 44.962 0.022 . 1 . 367 . . 46 GLY CA . 18663 1 419 . 1 1 46 46 GLY N N 15 111.472 0.054 . 1 . 371 . . 46 GLY N . 18663 1 420 . 1 1 47 47 ALA H H 1 7.746 0.005 . 1 . 374 . . 47 ALA H . 18663 1 421 . 1 1 47 47 ALA HA H 1 4.383 0.004 . 1 . 375 . . 47 ALA HA . 18663 1 422 . 1 1 47 47 ALA HB1 H 1 1.507 0.002 . 1 . 377 . . 47 ALA HB1 . 18663 1 423 . 1 1 47 47 ALA HB2 H 1 1.507 0.002 . 1 . 377 . . 47 ALA HB2 . 18663 1 424 . 1 1 47 47 ALA HB3 H 1 1.507 0.002 . 1 . 377 . . 47 ALA HB3 . 18663 1 425 . 1 1 47 47 ALA CA C 13 52.620 . . 1 . 372 . . 47 ALA CA . 18663 1 426 . 1 1 47 47 ALA CB C 13 19.864 . . 1 . 373 . . 47 ALA CB . 18663 1 427 . 1 1 47 47 ALA N N 15 123.370 0.043 . 1 . 376 . . 47 ALA N . 18663 1 428 . 1 1 48 48 THR H H 1 8.406 0.007 . 1 . 381 . . 48 THR H . 18663 1 429 . 1 1 48 48 THR HA H 1 4.414 0.002 . 1 . 382 . . 48 THR HA . 18663 1 430 . 1 1 48 48 THR HB H 1 4.566 0.002 . 1 . 383 . . 48 THR HB . 18663 1 431 . 1 1 48 48 THR HG21 H 1 1.319 0.002 . 1 . 385 . . 48 THR HG21 . 18663 1 432 . 1 1 48 48 THR HG22 H 1 1.319 0.002 . 1 . 385 . . 48 THR HG22 . 18663 1 433 . 1 1 48 48 THR HG23 H 1 1.319 0.002 . 1 . 385 . . 48 THR HG23 . 18663 1 434 . 1 1 48 48 THR CA C 13 60.753 . . 1 . 378 . . 48 THR CA . 18663 1 435 . 1 1 48 48 THR CB C 13 70.855 . . 1 . 379 . . 48 THR CB . 18663 1 436 . 1 1 48 48 THR CG2 C 13 21.459 0.006 . 1 . 380 . . 48 THR CG2 . 18663 1 437 . 1 1 48 48 THR N N 15 112.231 0.063 . 1 . 384 . . 48 THR N . 18663 1 438 . 1 1 49 49 ALA H H 1 8.822 0.006 . 1 . 388 . . 49 ALA H . 18663 1 439 . 1 1 49 49 ALA HA H 1 4.073 0.002 . 1 . 389 . . 49 ALA HA . 18663 1 440 . 1 1 49 49 ALA HB1 H 1 1.361 0.004 . 1 . 391 . . 49 ALA HB1 . 18663 1 441 . 1 1 49 49 ALA HB2 H 1 1.361 0.004 . 1 . 391 . . 49 ALA HB2 . 18663 1 442 . 1 1 49 49 ALA HB3 H 1 1.361 0.004 . 1 . 391 . . 49 ALA HB3 . 18663 1 443 . 1 1 49 49 ALA CA C 13 54.739 0.01 . 1 . 386 . . 49 ALA CA . 18663 1 444 . 1 1 49 49 ALA CB C 13 17.901 0.006 . 1 . 387 . . 49 ALA CB . 18663 1 445 . 1 1 49 49 ALA N N 15 124.737 0.042 . 1 . 390 . . 49 ALA N . 18663 1 446 . 1 1 50 50 ALA H H 1 8.320 0.005 . 1 . 394 . . 50 ALA H . 18663 1 447 . 1 1 50 50 ALA HA H 1 4.130 0.004 . 1 . 395 . . 50 ALA HA . 18663 1 448 . 1 1 50 50 ALA HB1 H 1 1.381 0.002 . 1 . 397 . . 50 ALA HB1 . 18663 1 449 . 1 1 50 50 ALA HB2 H 1 1.381 0.002 . 1 . 397 . . 50 ALA HB2 . 18663 1 450 . 1 1 50 50 ALA HB3 H 1 1.381 0.002 . 1 . 397 . . 50 ALA HB3 . 18663 1 451 . 1 1 50 50 ALA CA C 13 53.986 . . 1 . 392 . . 50 ALA CA . 18663 1 452 . 1 1 50 50 ALA CB C 13 18.108 0.022 . 1 . 393 . . 50 ALA CB . 18663 1 453 . 1 1 50 50 ALA N N 15 120.340 0.075 . 1 . 396 . . 50 ALA N . 18663 1 454 . 1 1 51 51 GLU H H 1 7.800 0.003 . 1 . 401 . . 51 GLU H . 18663 1 455 . 1 1 51 51 GLU HA H 1 4.144 0.001 . 1 . 402 . . 51 GLU HA . 18663 1 456 . 1 1 51 51 GLU HB2 H 1 2.202 0.004 . 2 . 403 . . 51 GLU HB2 . 18663 1 457 . 1 1 51 51 GLU HB3 H 1 2.052 0.003 . 2 . 404 . . 51 GLU HB3 . 18663 1 458 . 1 1 51 51 GLU HG2 H 1 2.271 0.003 . 1 . 1865 . . 51 GLU HG2 . 18663 1 459 . 1 1 51 51 GLU HG3 H 1 2.271 0.003 . 1 . 406 . . 51 GLU HG3 . 18663 1 460 . 1 1 51 51 GLU CA C 13 57.767 . . 1 . 398 . . 51 GLU CA . 18663 1 461 . 1 1 51 51 GLU CB C 13 29.823 0.047 . 1 . 399 . . 51 GLU CB . 18663 1 462 . 1 1 51 51 GLU CG C 13 36.320 . . 1 . 400 . . 51 GLU CG . 18663 1 463 . 1 1 51 51 GLU N N 15 119.158 0.054 . 1 . 405 . . 51 GLU N . 18663 1 464 . 1 1 52 52 CYS H H 1 8.409 0.005 . 1 . 409 . . 52 CYS H . 18663 1 465 . 1 1 52 52 CYS HA H 1 4.324 0.005 . 1 . 410 . . 52 CYS HA . 18663 1 466 . 1 1 52 52 CYS HB2 H 1 2.982 0.005 . 2 . 411 . . 52 CYS HB2 . 18663 1 467 . 1 1 52 52 CYS HB3 H 1 2.847 0.006 . 2 . 412 . . 52 CYS HB3 . 18663 1 468 . 1 1 52 52 CYS CA C 13 61.166 . . 1 . 407 . . 52 CYS CA . 18663 1 469 . 1 1 52 52 CYS CB C 13 27.012 . . 1 . 408 . . 52 CYS CB . 18663 1 470 . 1 1 52 52 CYS N N 15 119.247 0.041 . 1 . 413 . . 52 CYS N . 18663 1 471 . 1 1 53 53 ALA H H 1 8.191 0.003 . 1 . 416 . . 53 ALA H . 18663 1 472 . 1 1 53 53 ALA HA H 1 4.147 0.004 . 1 . 417 . . 53 ALA HA . 18663 1 473 . 1 1 53 53 ALA HB1 H 1 1.395 0.006 . 1 . 419 . . 53 ALA HB1 . 18663 1 474 . 1 1 53 53 ALA HB2 H 1 1.395 0.006 . 1 . 419 . . 53 ALA HB2 . 18663 1 475 . 1 1 53 53 ALA HB3 H 1 1.395 0.006 . 1 . 419 . . 53 ALA HB3 . 18663 1 476 . 1 1 53 53 ALA CA C 13 53.796 . . 1 . 414 . . 53 ALA CA . 18663 1 477 . 1 1 53 53 ALA CB C 13 18.117 . . 1 . 415 . . 53 ALA CB . 18663 1 478 . 1 1 53 53 ALA N N 15 122.766 0.021 . 1 . 418 . . 53 ALA N . 18663 1 479 . 1 1 54 54 SER H H 1 7.957 0.007 . 1 . 422 . . 54 SER H . 18663 1 480 . 1 1 54 54 SER HA H 1 4.441 0.001 . 1 . 423 . . 54 SER HA . 18663 1 481 . 1 1 54 54 SER HB2 H 1 3.934 0.004 . 2 . 424 . . 54 SER HB2 . 18663 1 482 . 1 1 54 54 SER HB3 H 1 3.906 0.003 . 2 . 425 . . 54 SER HB3 . 18663 1 483 . 1 1 54 54 SER CA C 13 59.863 . . 1 . 420 . . 54 SER CA . 18663 1 484 . 1 1 54 54 SER CB C 13 63.263 . . 1 . 421 . . 54 SER CB . 18663 1 485 . 1 1 54 54 SER N N 15 113.059 0.057 . 1 . 426 . . 54 SER N . 18663 1 486 . 1 1 55 55 ASN H H 1 8.079 0.003 . 1 . 429 . . 55 ASN H . 18663 1 487 . 1 1 55 55 ASN HA H 1 4.873 0.002 . 1 . 430 . . 55 ASN HA . 18663 1 488 . 1 1 55 55 ASN HB2 H 1 2.958 0.005 . 2 . 431 . . 55 ASN HB2 . 18663 1 489 . 1 1 55 55 ASN HB3 H 1 2.804 0.002 . 2 . 432 . . 55 ASN HB3 . 18663 1 490 . 1 1 55 55 ASN HD21 H 1 7.009 0.002 . 1 . 433 . . 55 ASN HD21 . 18663 1 491 . 1 1 55 55 ASN HD22 H 1 7.662 0.003 . 1 . 434 . . 55 ASN HD22 . 18663 1 492 . 1 1 55 55 ASN CA C 13 53.446 . . 1 . 427 . . 55 ASN CA . 18663 1 493 . 1 1 55 55 ASN CB C 13 39.815 0.032 . 1 . 428 . . 55 ASN CB . 18663 1 494 . 1 1 55 55 ASN N N 15 119.767 0.027 . 1 . 435 . . 55 ASN N . 18663 1 495 . 1 1 55 55 ASN ND2 N 15 113.373 0.02 . 1 . 436 . . 55 ASN ND2 . 18663 1 496 . 1 1 56 56 LEU H H 1 7.569 0.004 . 1 . 441 . . 56 LEU H . 18663 1 497 . 1 1 56 56 LEU HA H 1 5.026 0.004 . 1 . 442 . . 56 LEU HA . 18663 1 498 . 1 1 56 56 LEU HB2 H 1 1.793 0.003 . 2 . 443 . . 56 LEU HB2 . 18663 1 499 . 1 1 56 56 LEU HB3 H 1 1.750 0.002 . 2 . 444 . . 56 LEU HB3 . 18663 1 500 . 1 1 56 56 LEU HG H 1 1.807 0.004 . 1 . 445 . . 56 LEU HG . 18663 1 501 . 1 1 56 56 LEU HD11 H 1 0.604 0.001 . 2 . 447 . . 56 LEU HD11 . 18663 1 502 . 1 1 56 56 LEU HD12 H 1 0.604 0.001 . 2 . 447 . . 56 LEU HD12 . 18663 1 503 . 1 1 56 56 LEU HD13 H 1 0.604 0.001 . 2 . 447 . . 56 LEU HD13 . 18663 1 504 . 1 1 56 56 LEU HD21 H 1 0.617 . . 2 . 448 . . 56 LEU HD21 . 18663 1 505 . 1 1 56 56 LEU HD22 H 1 0.617 . . 2 . 448 . . 56 LEU HD22 . 18663 1 506 . 1 1 56 56 LEU HD23 H 1 0.617 . . 2 . 448 . . 56 LEU HD23 . 18663 1 507 . 1 1 56 56 LEU CA C 13 55.066 . . 1 . 437 . . 56 LEU CA . 18663 1 508 . 1 1 56 56 LEU CB C 13 43.564 . . 1 . 438 . . 56 LEU CB . 18663 1 509 . 1 1 56 56 LEU CG C 13 26.536 . . 1 . 440 . . 56 LEU CG . 18663 1 510 . 1 1 56 56 LEU CD1 C 13 24.058 . . 1 . 439 . . 56 LEU CD1 . 18663 1 511 . 1 1 56 56 LEU N N 15 122.397 0.082 . 1 . 446 . . 56 LEU N . 18663 1 512 . 1 1 57 57 LYS H H 1 9.360 0.006 . 1 . 454 . . 57 LYS H . 18663 1 513 . 1 1 57 57 LYS HA H 1 4.881 0.006 . 1 . 455 . . 57 LYS HA . 18663 1 514 . 1 1 57 57 LYS HB2 H 1 1.954 0.005 . 2 . 456 . . 57 LYS HB2 . 18663 1 515 . 1 1 57 57 LYS HB3 H 1 1.894 0.002 . 2 . 457 . . 57 LYS HB3 . 18663 1 516 . 1 1 57 57 LYS HG2 H 1 1.487 0.004 . 2 . 459 . . 57 LYS HG2 . 18663 1 517 . 1 1 57 57 LYS HG3 H 1 1.386 0.002 . 2 . 460 . . 57 LYS HG3 . 18663 1 518 . 1 1 57 57 LYS HD3 H 1 1.745 0.001 . 1 . 458 . . 57 LYS HD3 . 18663 1 519 . 1 1 57 57 LYS HE2 H 1 3.030 0.002 . 1 . 1866 . . 57 LYS HE2 . 18663 1 520 . 1 1 57 57 LYS HE3 H 1 3.030 0.002 . 1 . 462 . . 57 LYS HE3 . 18663 1 521 . 1 1 57 57 LYS CA C 13 54.749 . . 1 . 449 . . 57 LYS CA . 18663 1 522 . 1 1 57 57 LYS CB C 13 35.431 . . 1 . 450 . . 57 LYS CB . 18663 1 523 . 1 1 57 57 LYS CG C 13 24.450 0.013 . 1 . 453 . . 57 LYS CG . 18663 1 524 . 1 1 57 57 LYS CD C 13 28.537 . . 1 . 451 . . 57 LYS CD . 18663 1 525 . 1 1 57 57 LYS CE C 13 42.011 0.003 . 1 . 452 . . 57 LYS CE . 18663 1 526 . 1 1 57 57 LYS N N 15 125.110 0.034 . 1 . 461 . . 57 LYS N . 18663 1 527 . 1 1 58 58 LYS H H 1 8.980 0.004 . 1 . 468 . . 58 LYS H . 18663 1 528 . 1 1 58 58 LYS HA H 1 3.353 0.006 . 1 . 469 . . 58 LYS HA . 18663 1 529 . 1 1 58 58 LYS HB2 H 1 1.354 0.003 . 2 . 470 . . 58 LYS HB2 . 18663 1 530 . 1 1 58 58 LYS HB3 H 1 0.939 0.002 . 2 . 471 . . 58 LYS HB3 . 18663 1 531 . 1 1 58 58 LYS HG2 H 1 0.331 0.002 . 2 . 474 . . 58 LYS HG2 . 18663 1 532 . 1 1 58 58 LYS HG3 H 1 -0.045 0.004 . 2 . 475 . . 58 LYS HG3 . 18663 1 533 . 1 1 58 58 LYS HD2 H 1 1.246 0.004 . 1 . 1867 . . 58 LYS HD2 . 18663 1 534 . 1 1 58 58 LYS HD3 H 1 1.246 0.004 . 1 . 477 . . 58 LYS HD3 . 18663 1 535 . 1 1 58 58 LYS HE2 H 1 2.603 0.004 . 2 . 472 . . 58 LYS HE2 . 18663 1 536 . 1 1 58 58 LYS HE3 H 1 2.554 0.001 . 2 . 473 . . 58 LYS HE3 . 18663 1 537 . 1 1 58 58 LYS CA C 13 56.973 . . 1 . 463 . . 58 LYS CA . 18663 1 538 . 1 1 58 58 LYS CB C 13 31.809 0.032 . 1 . 464 . . 58 LYS CB . 18663 1 539 . 1 1 58 58 LYS CG C 13 24.344 . . 1 . 467 . . 58 LYS CG . 18663 1 540 . 1 1 58 58 LYS CD C 13 29.045 . . 1 . 465 . . 58 LYS CD . 18663 1 541 . 1 1 58 58 LYS CE C 13 41.554 0.014 . 1 . 466 . . 58 LYS CE . 18663 1 542 . 1 1 58 58 LYS N N 15 129.317 0.046 . 1 . 476 . . 58 LYS N . 18663 1 543 . 1 1 59 59 ILE H H 1 8.897 0.006 . 1 . 483 . . 59 ILE H . 18663 1 544 . 1 1 59 59 ILE HA H 1 4.066 0.003 . 1 . 484 . . 59 ILE HA . 18663 1 545 . 1 1 59 59 ILE HB H 1 1.701 0.006 . 1 . 485 . . 59 ILE HB . 18663 1 546 . 1 1 59 59 ILE HG12 H 1 1.703 0.003 . 2 . 486 . . 59 ILE HG12 . 18663 1 547 . 1 1 59 59 ILE HG13 H 1 1.113 0.002 . 2 . 487 . . 59 ILE HG13 . 18663 1 548 . 1 1 59 59 ILE HG21 H 1 0.790 0.003 . 1 . 490 . . 59 ILE HG21 . 18663 1 549 . 1 1 59 59 ILE HG22 H 1 0.790 0.003 . 1 . 490 . . 59 ILE HG22 . 18663 1 550 . 1 1 59 59 ILE HG23 H 1 0.790 0.003 . 1 . 490 . . 59 ILE HG23 . 18663 1 551 . 1 1 59 59 ILE HD11 H 1 0.953 0.003 . 1 . 489 . . 59 ILE HD11 . 18663 1 552 . 1 1 59 59 ILE HD12 H 1 0.953 0.003 . 1 . 489 . . 59 ILE HD12 . 18663 1 553 . 1 1 59 59 ILE HD13 H 1 0.953 0.003 . 1 . 489 . . 59 ILE HD13 . 18663 1 554 . 1 1 59 59 ILE CA C 13 62.977 . . 1 . 478 . . 59 ILE CA . 18663 1 555 . 1 1 59 59 ILE CB C 13 37.448 0.016 . 1 . 479 . . 59 ILE CB . 18663 1 556 . 1 1 59 59 ILE CG1 C 13 27.406 . . 1 . 481 . . 59 ILE CG1 . 18663 1 557 . 1 1 59 59 ILE CG2 C 13 16.751 . . 1 . 482 . . 59 ILE CG2 . 18663 1 558 . 1 1 59 59 ILE CD1 C 13 13.254 . . 1 . 480 . . 59 ILE CD1 . 18663 1 559 . 1 1 59 59 ILE N N 15 128.019 0.005 . 1 . 488 . . 59 ILE N . 18663 1 560 . 1 1 60 60 TYR H H 1 7.163 0.003 . 1 . 495 . . 60 TYR H . 18663 1 561 . 1 1 60 60 TYR HA H 1 4.242 0.004 . 1 . 496 . . 60 TYR HA . 18663 1 562 . 1 1 60 60 TYR HB2 H 1 3.034 0.003 . 2 . 497 . . 60 TYR HB2 . 18663 1 563 . 1 1 60 60 TYR HB3 H 1 2.585 0.003 . 2 . 498 . . 60 TYR HB3 . 18663 1 564 . 1 1 60 60 TYR HD1 H 1 7.075 0.003 . 3 . 500 . . 60 TYR HD1 . 18663 1 565 . 1 1 60 60 TYR HD2 H 1 7.075 0.003 . 3 . 500 . . 60 TYR HD2 . 18663 1 566 . 1 1 60 60 TYR HE1 H 1 6.827 0.002 . 3 . 501 . . 60 TYR HE1 . 18663 1 567 . 1 1 60 60 TYR HE2 H 1 6.827 0.002 . 3 . 501 . . 60 TYR HE2 . 18663 1 568 . 1 1 60 60 TYR CA C 13 59.591 0.012 . 1 . 491 . . 60 TYR CA . 18663 1 569 . 1 1 60 60 TYR CB C 13 44.199 . . 1 . 492 . . 60 TYR CB . 18663 1 570 . 1 1 60 60 TYR CD1 C 13 133.628 . . 3 . 493 . . 60 TYR CD1 . 18663 1 571 . 1 1 60 60 TYR CE1 C 13 117.553 . . 3 . 494 . . 60 TYR CE1 . 18663 1 572 . 1 1 60 60 TYR N N 15 115.026 0.025 . 1 . 499 . . 60 TYR N . 18663 1 573 . 1 1 61 61 THR H H 1 8.318 0.006 . 1 . 505 . . 61 THR H . 18663 1 574 . 1 1 61 61 THR HA H 1 5.212 0.003 . 1 . 506 . . 61 THR HA . 18663 1 575 . 1 1 61 61 THR HB H 1 3.607 0.001 . 1 . 507 . . 61 THR HB . 18663 1 576 . 1 1 61 61 THR HG21 H 1 1.061 0.001 . 1 . 509 . . 61 THR HG21 . 18663 1 577 . 1 1 61 61 THR HG22 H 1 1.061 0.001 . 1 . 509 . . 61 THR HG22 . 18663 1 578 . 1 1 61 61 THR HG23 H 1 1.061 0.001 . 1 . 509 . . 61 THR HG23 . 18663 1 579 . 1 1 61 61 THR CA C 13 62.469 . . 1 . 502 . . 61 THR CA . 18663 1 580 . 1 1 61 61 THR CB C 13 69.363 . . 1 . 503 . . 61 THR CB . 18663 1 581 . 1 1 61 61 THR CG2 C 13 21.866 . . 1 . 504 . . 61 THR CG2 . 18663 1 582 . 1 1 61 61 THR N N 15 124.319 0.026 . 1 . 508 . . 61 THR N . 18663 1 583 . 1 1 62 62 VAL H H 1 9.990 0.007 . 1 . 513 . . 62 VAL H . 18663 1 584 . 1 1 62 62 VAL HA H 1 4.786 0.004 . 1 . 514 . . 62 VAL HA . 18663 1 585 . 1 1 62 62 VAL HB H 1 2.374 0.001 . 1 . 515 . . 62 VAL HB . 18663 1 586 . 1 1 62 62 VAL HG11 H 1 1.311 0.001 . 2 . 517 . . 62 VAL HG11 . 18663 1 587 . 1 1 62 62 VAL HG12 H 1 1.311 0.001 . 2 . 517 . . 62 VAL HG12 . 18663 1 588 . 1 1 62 62 VAL HG13 H 1 1.311 0.001 . 2 . 517 . . 62 VAL HG13 . 18663 1 589 . 1 1 62 62 VAL HG21 H 1 1.336 . . 2 . 518 . . 62 VAL HG21 . 18663 1 590 . 1 1 62 62 VAL HG22 H 1 1.336 . . 2 . 518 . . 62 VAL HG22 . 18663 1 591 . 1 1 62 62 VAL HG23 H 1 1.336 . . 2 . 518 . . 62 VAL HG23 . 18663 1 592 . 1 1 62 62 VAL CA C 13 59.524 . . 1 . 510 . . 62 VAL CA . 18663 1 593 . 1 1 62 62 VAL CB C 13 33.815 . . 1 . 511 . . 62 VAL CB . 18663 1 594 . 1 1 62 62 VAL CG1 C 13 23.549 . . 1 . 512 . . 62 VAL CG1 . 18663 1 595 . 1 1 62 62 VAL N N 15 120.353 0.035 . 1 . 516 . . 62 VAL N . 18663 1 596 . 1 1 63 63 GLN H H 1 8.659 0.007 . 1 . 522 . . 63 GLN H . 18663 1 597 . 1 1 63 63 GLN HA H 1 4.791 0.003 . 1 . 523 . . 63 GLN HA . 18663 1 598 . 1 1 63 63 GLN HB2 H 1 2.296 0.001 . 2 . 524 . . 63 GLN HB2 . 18663 1 599 . 1 1 63 63 GLN HB3 H 1 2.101 0.004 . 2 . 525 . . 63 GLN HB3 . 18663 1 600 . 1 1 63 63 GLN HG2 H 1 2.523 0.001 . 2 . 528 . . 63 GLN HG2 . 18663 1 601 . 1 1 63 63 GLN HG3 H 1 2.356 0.002 . 2 . 529 . . 63 GLN HG3 . 18663 1 602 . 1 1 63 63 GLN HE21 H 1 6.840 0.001 . 1 . 526 . . 63 GLN HE21 . 18663 1 603 . 1 1 63 63 GLN HE22 H 1 7.467 0.002 . 1 . 527 . . 63 GLN HE22 . 18663 1 604 . 1 1 63 63 GLN CA C 13 55.939 . . 1 . 519 . . 63 GLN CA . 18663 1 605 . 1 1 63 63 GLN CB C 13 31.186 0.002 . 1 . 520 . . 63 GLN CB . 18663 1 606 . 1 1 63 63 GLN CG C 13 34.257 . . 1 . 521 . . 63 GLN CG . 18663 1 607 . 1 1 63 63 GLN N N 15 117.654 0.02 . 1 . 530 . . 63 GLN N . 18663 1 608 . 1 1 63 63 GLN NE2 N 15 110.792 . . 1 . 531 . . 63 GLN NE2 . 18663 1 609 . 1 1 64 64 THR H H 1 7.488 0.004 . 1 . 535 . . 64 THR H . 18663 1 610 . 1 1 64 64 THR HA H 1 5.234 0.001 . 1 . 536 . . 64 THR HA . 18663 1 611 . 1 1 64 64 THR HB H 1 4.539 0.003 . 1 . 537 . . 64 THR HB . 18663 1 612 . 1 1 64 64 THR HG21 H 1 1.178 0.004 . 1 . 539 . . 64 THR HG21 . 18663 1 613 . 1 1 64 64 THR HG22 H 1 1.178 0.004 . 1 . 539 . . 64 THR HG22 . 18663 1 614 . 1 1 64 64 THR HG23 H 1 1.178 0.004 . 1 . 539 . . 64 THR HG23 . 18663 1 615 . 1 1 64 64 THR CA C 13 58.783 . . 1 . 532 . . 64 THR CA . 18663 1 616 . 1 1 64 64 THR CB C 13 72.952 . . 1 . 533 . . 64 THR CB . 18663 1 617 . 1 1 64 64 THR CG2 C 13 21.357 . . 1 . 534 . . 64 THR CG2 . 18663 1 618 . 1 1 64 64 THR N N 15 109.123 0.069 . 1 . 538 . . 64 THR N . 18663 1 619 . 1 1 65 65 VAL H H 1 9.186 0.004 . 1 . 544 . . 65 VAL H . 18663 1 620 . 1 1 65 65 VAL HA H 1 3.514 0.005 . 1 . 545 . . 65 VAL HA . 18663 1 621 . 1 1 65 65 VAL HB H 1 2.137 0.007 . 1 . 546 . . 65 VAL HB . 18663 1 622 . 1 1 65 65 VAL HG11 H 1 1.017 0.002 . 2 . 548 . . 65 VAL HG11 . 18663 1 623 . 1 1 65 65 VAL HG12 H 1 1.017 0.002 . 2 . 548 . . 65 VAL HG12 . 18663 1 624 . 1 1 65 65 VAL HG13 H 1 1.017 0.002 . 2 . 548 . . 65 VAL HG13 . 18663 1 625 . 1 1 65 65 VAL HG21 H 1 1.176 0.004 . 2 . 549 . . 65 VAL HG21 . 18663 1 626 . 1 1 65 65 VAL HG22 H 1 1.176 0.004 . 2 . 549 . . 65 VAL HG22 . 18663 1 627 . 1 1 65 65 VAL HG23 H 1 1.176 0.004 . 2 . 549 . . 65 VAL HG23 . 18663 1 628 . 1 1 65 65 VAL CA C 13 66.694 . . 1 . 540 . . 65 VAL CA . 18663 1 629 . 1 1 65 65 VAL CB C 13 32.572 . . 1 . 541 . . 65 VAL CB . 18663 1 630 . 1 1 65 65 VAL CG1 C 13 23.359 . . 2 . 542 . . 65 VAL CG1 . 18663 1 631 . 1 1 65 65 VAL CG2 C 13 21.532 0.016 . 2 . 543 . . 65 VAL CG2 . 18663 1 632 . 1 1 65 65 VAL N N 15 123.108 0.016 . 1 . 547 . . 65 VAL N . 18663 1 633 . 1 1 66 66 GLN H H 1 8.615 0.003 . 1 . 553 . . 66 GLN H . 18663 1 634 . 1 1 66 66 GLN HA H 1 4.309 0.004 . 1 . 554 . . 66 GLN HA . 18663 1 635 . 1 1 66 66 GLN HB2 H 1 2.267 0.002 . 2 . 555 . . 66 GLN HB2 . 18663 1 636 . 1 1 66 66 GLN HB3 H 1 2.088 0.003 . 2 . 556 . . 66 GLN HB3 . 18663 1 637 . 1 1 66 66 GLN HG2 H 1 2.674 0.003 . 2 . 559 . . 66 GLN HG2 . 18663 1 638 . 1 1 66 66 GLN HG3 H 1 2.556 0.006 . 2 . 560 . . 66 GLN HG3 . 18663 1 639 . 1 1 66 66 GLN HE21 H 1 6.722 0.004 . 1 . 557 . . 66 GLN HE21 . 18663 1 640 . 1 1 66 66 GLN HE22 H 1 7.757 0.002 . 1 . 558 . . 66 GLN HE22 . 18663 1 641 . 1 1 66 66 GLN CA C 13 60.086 . . 1 . 550 . . 66 GLN CA . 18663 1 642 . 1 1 66 66 GLN CB C 13 27.401 0.047 . 1 . 551 . . 66 GLN CB . 18663 1 643 . 1 1 66 66 GLN CG C 13 34.875 0.016 . 1 . 552 . . 66 GLN CG . 18663 1 644 . 1 1 66 66 GLN N N 15 117.884 0.01 . 1 . 561 . . 66 GLN N . 18663 1 645 . 1 1 66 66 GLN NE2 N 15 112.519 0.016 . 1 . 562 . . 66 GLN NE2 . 18663 1 646 . 1 1 67 67 ILE H H 1 7.952 0.005 . 1 . 568 . . 67 ILE H . 18663 1 647 . 1 1 67 67 ILE HA H 1 4.036 0.005 . 1 . 569 . . 67 ILE HA . 18663 1 648 . 1 1 67 67 ILE HB H 1 2.035 0.004 . 1 . 570 . . 67 ILE HB . 18663 1 649 . 1 1 67 67 ILE HG12 H 1 1.689 0.003 . 2 . 571 . . 67 ILE HG12 . 18663 1 650 . 1 1 67 67 ILE HG13 H 1 1.365 0.005 . 2 . 572 . . 67 ILE HG13 . 18663 1 651 . 1 1 67 67 ILE HG21 H 1 1.310 0.002 . 1 . 575 . . 67 ILE HG21 . 18663 1 652 . 1 1 67 67 ILE HG22 H 1 1.310 0.002 . 1 . 575 . . 67 ILE HG22 . 18663 1 653 . 1 1 67 67 ILE HG23 H 1 1.310 0.002 . 1 . 575 . . 67 ILE HG23 . 18663 1 654 . 1 1 67 67 ILE HD11 H 1 1.021 0.002 . 1 . 574 . . 67 ILE HD11 . 18663 1 655 . 1 1 67 67 ILE HD12 H 1 1.021 0.002 . 1 . 574 . . 67 ILE HD12 . 18663 1 656 . 1 1 67 67 ILE HD13 H 1 1.021 0.002 . 1 . 574 . . 67 ILE HD13 . 18663 1 657 . 1 1 67 67 ILE CA C 13 63.771 . . 1 . 563 . . 67 ILE CA . 18663 1 658 . 1 1 67 67 ILE CB C 13 36.924 . . 1 . 564 . . 67 ILE CB . 18663 1 659 . 1 1 67 67 ILE CG1 C 13 29.585 . . 1 . 566 . . 67 ILE CG1 . 18663 1 660 . 1 1 67 67 ILE CG2 C 13 18.276 . . 1 . 567 . . 67 ILE CG2 . 18663 1 661 . 1 1 67 67 ILE CD1 C 13 12.300 . . 1 . 565 . . 67 ILE CD1 . 18663 1 662 . 1 1 67 67 ILE N N 15 120.491 0.003 . 1 . 573 . . 67 ILE N . 18663 1 663 . 1 1 68 68 PHE H H 1 8.307 0.002 . 1 . 580 . . 68 PHE H . 18663 1 664 . 1 1 68 68 PHE HA H 1 4.031 0.004 . 1 . 581 . . 68 PHE HA . 18663 1 665 . 1 1 68 68 PHE HB2 H 1 3.480 0.001 . 2 . 582 . . 68 PHE HB2 . 18663 1 666 . 1 1 68 68 PHE HB3 H 1 2.843 0.004 . 2 . 583 . . 68 PHE HB3 . 18663 1 667 . 1 1 68 68 PHE HD1 H 1 6.179 0.003 . 3 . 585 . . 68 PHE HD1 . 18663 1 668 . 1 1 68 68 PHE HD2 H 1 6.179 0.003 . 3 . 585 . . 68 PHE HD2 . 18663 1 669 . 1 1 68 68 PHE HE1 H 1 6.874 . . 3 . 586 . . 68 PHE HE1 . 18663 1 670 . 1 1 68 68 PHE HE2 H 1 6.874 . . 3 . 586 . . 68 PHE HE2 . 18663 1 671 . 1 1 68 68 PHE CA C 13 62.956 . . 1 . 576 . . 68 PHE CA . 18663 1 672 . 1 1 68 68 PHE CB C 13 37.155 . . 1 . 577 . . 68 PHE CB . 18663 1 673 . 1 1 68 68 PHE CD1 C 13 127.910 . . 3 . 578 . . 68 PHE CD1 . 18663 1 674 . 1 1 68 68 PHE CE1 C 13 129.371 . . 3 . 579 . . 68 PHE CE1 . 18663 1 675 . 1 1 68 68 PHE N N 15 121.744 . . 1 . 584 . . 68 PHE N . 18663 1 676 . 1 1 69 69 TRP H H 1 8.162 0.004 . 1 . 591 . . 69 TRP H . 18663 1 677 . 1 1 69 69 TRP HA H 1 4.241 0.001 . 1 . 592 . . 69 TRP HA . 18663 1 678 . 1 1 69 69 TRP HB2 H 1 3.330 0.002 . 2 . 593 . . 69 TRP HB2 . 18663 1 679 . 1 1 69 69 TRP HB3 H 1 3.187 0.002 . 2 . 594 . . 69 TRP HB3 . 18663 1 680 . 1 1 69 69 TRP HD1 H 1 7.844 0.004 . 1 . 595 . . 69 TRP HD1 . 18663 1 681 . 1 1 69 69 TRP HE1 H 1 10.552 0.005 . 1 . 596 . . 69 TRP HE1 . 18663 1 682 . 1 1 69 69 TRP HZ2 H 1 7.164 0.001 . 1 . 597 . . 69 TRP HZ2 . 18663 1 683 . 1 1 69 69 TRP CA C 13 60.138 . . 1 . 587 . . 69 TRP CA . 18663 1 684 . 1 1 69 69 TRP CB C 13 28.977 . . 1 . 588 . . 69 TRP CB . 18663 1 685 . 1 1 69 69 TRP CD1 C 13 128.291 . . 1 . 589 . . 69 TRP CD1 . 18663 1 686 . 1 1 69 69 TRP CZ2 C 13 113.868 . . 1 . 590 . . 69 TRP CZ2 . 18663 1 687 . 1 1 69 69 TRP N N 15 118.535 . . 1 . 598 . . 69 TRP N . 18663 1 688 . 1 1 69 69 TRP NE1 N 15 128.393 0.01 . 1 . 599 . . 69 TRP NE1 . 18663 1 689 . 1 1 70 70 SER H H 1 8.067 0.001 . 1 . 602 . . 70 SER H . 18663 1 690 . 1 1 70 70 SER HA H 1 4.197 0.004 . 1 . 603 . . 70 SER HA . 18663 1 691 . 1 1 70 70 SER HB2 H 1 4.037 0.004 . 2 . 604 . . 70 SER HB2 . 18663 1 692 . 1 1 70 70 SER HB3 H 1 4.025 0.005 . 2 . 605 . . 70 SER HB3 . 18663 1 693 . 1 1 70 70 SER CA C 13 61.772 . . 1 . 600 . . 70 SER CA . 18663 1 694 . 1 1 70 70 SER CB C 13 63.191 0.004 . 1 . 601 . . 70 SER CB . 18663 1 695 . 1 1 70 70 SER N N 15 114.846 . . 1 . 606 . . 70 SER N . 18663 1 696 . 1 1 71 71 VAL H H 1 8.052 0.005 . 1 . 611 . . 71 VAL H . 18663 1 697 . 1 1 71 71 VAL HA H 1 3.281 0.005 . 1 . 612 . . 71 VAL HA . 18663 1 698 . 1 1 71 71 VAL HB H 1 1.707 0.004 . 1 . 613 . . 71 VAL HB . 18663 1 699 . 1 1 71 71 VAL HG11 H 1 0.148 0.005 . 2 . 615 . . 71 VAL HG11 . 18663 1 700 . 1 1 71 71 VAL HG12 H 1 0.148 0.005 . 2 . 615 . . 71 VAL HG12 . 18663 1 701 . 1 1 71 71 VAL HG13 H 1 0.148 0.005 . 2 . 615 . . 71 VAL HG13 . 18663 1 702 . 1 1 71 71 VAL HG21 H 1 0.508 0.002 . 2 . 616 . . 71 VAL HG21 . 18663 1 703 . 1 1 71 71 VAL HG22 H 1 0.508 0.002 . 2 . 616 . . 71 VAL HG22 . 18663 1 704 . 1 1 71 71 VAL HG23 H 1 0.508 0.002 . 2 . 616 . . 71 VAL HG23 . 18663 1 705 . 1 1 71 71 VAL CA C 13 66.249 . . 1 . 607 . . 71 VAL CA . 18663 1 706 . 1 1 71 71 VAL CB C 13 30.824 . . 1 . 608 . . 71 VAL CB . 18663 1 707 . 1 1 71 71 VAL CG1 C 13 21.167 . . 2 . 609 . . 71 VAL CG1 . 18663 1 708 . 1 1 71 71 VAL CG2 C 13 23.009 . . 2 . 610 . . 71 VAL CG2 . 18663 1 709 . 1 1 71 71 VAL N N 15 120.788 0.021 . 1 . 614 . . 71 VAL N . 18663 1 710 . 1 1 72 72 TYR H H 1 8.456 0.004 . 1 . 621 . . 72 TYR H . 18663 1 711 . 1 1 72 72 TYR HA H 1 3.234 0.001 . 1 . 622 . . 72 TYR HA . 18663 1 712 . 1 1 72 72 TYR HB2 H 1 2.519 0.004 . 2 . 623 . . 72 TYR HB2 . 18663 1 713 . 1 1 72 72 TYR HB3 H 1 2.028 0.004 . 2 . 624 . . 72 TYR HB3 . 18663 1 714 . 1 1 72 72 TYR HD1 H 1 6.865 0.003 . 3 . 626 . . 72 TYR HD1 . 18663 1 715 . 1 1 72 72 TYR HD2 H 1 6.865 0.003 . 3 . 626 . . 72 TYR HD2 . 18663 1 716 . 1 1 72 72 TYR HE1 H 1 6.806 0.004 . 3 . 627 . . 72 TYR HE1 . 18663 1 717 . 1 1 72 72 TYR HE2 H 1 6.806 0.004 . 3 . 627 . . 72 TYR HE2 . 18663 1 718 . 1 1 72 72 TYR CA C 13 61.882 . . 1 . 617 . . 72 TYR CA . 18663 1 719 . 1 1 72 72 TYR CB C 13 38.407 . . 1 . 618 . . 72 TYR CB . 18663 1 720 . 1 1 72 72 TYR CD1 C 13 132.739 . . 3 . 619 . . 72 TYR CD1 . 18663 1 721 . 1 1 72 72 TYR CE1 C 13 117.363 . . 3 . 620 . . 72 TYR CE1 . 18663 1 722 . 1 1 72 72 TYR N N 15 119.345 0.096 . 1 . 625 . . 72 TYR N . 18663 1 723 . 1 1 73 73 ASN H H 1 8.551 0.005 . 1 . 630 . . 73 ASN H . 18663 1 724 . 1 1 73 73 ASN HA H 1 4.456 0.003 . 1 . 631 . . 73 ASN HA . 18663 1 725 . 1 1 73 73 ASN HB2 H 1 2.891 0.001 . 2 . 632 . . 73 ASN HB2 . 18663 1 726 . 1 1 73 73 ASN HB3 H 1 2.824 0.003 . 2 . 633 . . 73 ASN HB3 . 18663 1 727 . 1 1 73 73 ASN HD21 H 1 6.880 0.004 . 1 . 634 . . 73 ASN HD21 . 18663 1 728 . 1 1 73 73 ASN HD22 H 1 7.467 0.002 . 1 . 635 . . 73 ASN HD22 . 18663 1 729 . 1 1 73 73 ASN CA C 13 54.765 0.016 . 1 . 628 . . 73 ASN CA . 18663 1 730 . 1 1 73 73 ASN CB C 13 38.592 0.016 . 1 . 629 . . 73 ASN CB . 18663 1 731 . 1 1 73 73 ASN N N 15 112.214 0.037 . 1 . 636 . . 73 ASN N . 18663 1 732 . 1 1 73 73 ASN ND2 N 15 111.547 . . 1 . 637 . . 73 ASN ND2 . 18663 1 733 . 1 1 74 74 ASN H H 1 7.624 0.003 . 1 . 640 . . 74 ASN H . 18663 1 734 . 1 1 74 74 ASN HA H 1 4.756 0.001 . 1 . 641 . . 74 ASN HA . 18663 1 735 . 1 1 74 74 ASN HB2 H 1 2.635 0.004 . 2 . 642 . . 74 ASN HB2 . 18663 1 736 . 1 1 74 74 ASN HB3 H 1 2.595 0.004 . 2 . 643 . . 74 ASN HB3 . 18663 1 737 . 1 1 74 74 ASN HD21 H 1 6.947 0.002 . 1 . 644 . . 74 ASN HD21 . 18663 1 738 . 1 1 74 74 ASN HD22 H 1 8.204 0.004 . 1 . 645 . . 74 ASN HD22 . 18663 1 739 . 1 1 74 74 ASN CA C 13 53.955 . . 1 . 638 . . 74 ASN CA . 18663 1 740 . 1 1 74 74 ASN CB C 13 40.625 0.016 . 1 . 639 . . 74 ASN CB . 18663 1 741 . 1 1 74 74 ASN N N 15 117.587 0.072 . 1 . 646 . . 74 ASN N . 18663 1 742 . 1 1 74 74 ASN ND2 N 15 115.200 . . 1 . 647 . . 74 ASN ND2 . 18663 1 743 . 1 1 75 75 ILE H H 1 7.200 0.004 . 1 . 653 . . 75 ILE H . 18663 1 744 . 1 1 75 75 ILE HA H 1 4.515 0.005 . 1 . 654 . . 75 ILE HA . 18663 1 745 . 1 1 75 75 ILE HB H 1 1.810 0.002 . 1 . 655 . . 75 ILE HB . 18663 1 746 . 1 1 75 75 ILE HG12 H 1 1.017 0.005 . 2 . 656 . . 75 ILE HG12 . 18663 1 747 . 1 1 75 75 ILE HG13 H 1 0.950 0.007 . 2 . 657 . . 75 ILE HG13 . 18663 1 748 . 1 1 75 75 ILE HG21 H 1 0.645 0.003 . 1 . 660 . . 75 ILE HG21 . 18663 1 749 . 1 1 75 75 ILE HG22 H 1 0.645 0.003 . 1 . 660 . . 75 ILE HG22 . 18663 1 750 . 1 1 75 75 ILE HG23 H 1 0.645 0.003 . 1 . 660 . . 75 ILE HG23 . 18663 1 751 . 1 1 75 75 ILE HD11 H 1 -0.105 0.002 . 1 . 659 . . 75 ILE HD11 . 18663 1 752 . 1 1 75 75 ILE HD12 H 1 -0.105 0.002 . 1 . 659 . . 75 ILE HD12 . 18663 1 753 . 1 1 75 75 ILE HD13 H 1 -0.105 0.002 . 1 . 659 . . 75 ILE HD13 . 18663 1 754 . 1 1 75 75 ILE CA C 13 59.705 . . 1 . 648 . . 75 ILE CA . 18663 1 755 . 1 1 75 75 ILE CB C 13 37.051 . . 1 . 649 . . 75 ILE CB . 18663 1 756 . 1 1 75 75 ILE CG1 C 13 24.344 . . 1 . 651 . . 75 ILE CG1 . 18663 1 757 . 1 1 75 75 ILE CG2 C 13 16.783 . . 1 . 652 . . 75 ILE CG2 . 18663 1 758 . 1 1 75 75 ILE CD1 C 13 12.356 . . 1 . 650 . . 75 ILE CD1 . 18663 1 759 . 1 1 75 75 ILE N N 15 117.330 0.113 . 1 . 658 . . 75 ILE N . 18663 1 760 . 1 1 76 76 PRO HD2 H 1 3.831 . . 2 . 661 . . 76 PRO HD2 . 18663 1 761 . 1 1 76 76 PRO HD3 H 1 3.722 . . 2 . 662 . . 76 PRO HD3 . 18663 1 762 . 1 1 77 77 PRO HA H 1 4.643 0.003 . 1 . 665 . . 77 PRO HA . 18663 1 763 . 1 1 77 77 PRO HB2 H 1 2.495 0.004 . 2 . 666 . . 77 PRO HB2 . 18663 1 764 . 1 1 77 77 PRO HB3 H 1 2.353 0.002 . 2 . 667 . . 77 PRO HB3 . 18663 1 765 . 1 1 77 77 PRO CA C 13 62.341 . . 1 . 663 . . 77 PRO CA . 18663 1 766 . 1 1 77 77 PRO CB C 13 32.651 0.016 . 1 . 664 . . 77 PRO CB . 18663 1 767 . 1 1 78 78 VAL H H 1 9.257 0.004 . 1 . 672 . . 78 VAL H . 18663 1 768 . 1 1 78 78 VAL HA H 1 3.720 0.006 . 1 . 673 . . 78 VAL HA . 18663 1 769 . 1 1 78 78 VAL HB H 1 2.061 0.003 . 1 . 674 . . 78 VAL HB . 18663 1 770 . 1 1 78 78 VAL HG11 H 1 0.822 0.003 . 2 . 676 . . 78 VAL HG11 . 18663 1 771 . 1 1 78 78 VAL HG12 H 1 0.822 0.003 . 2 . 676 . . 78 VAL HG12 . 18663 1 772 . 1 1 78 78 VAL HG13 H 1 0.822 0.003 . 2 . 676 . . 78 VAL HG13 . 18663 1 773 . 1 1 78 78 VAL HG21 H 1 0.924 0.004 . 2 . 677 . . 78 VAL HG21 . 18663 1 774 . 1 1 78 78 VAL HG22 H 1 0.924 0.004 . 2 . 677 . . 78 VAL HG22 . 18663 1 775 . 1 1 78 78 VAL HG23 H 1 0.924 0.004 . 2 . 677 . . 78 VAL HG23 . 18663 1 776 . 1 1 78 78 VAL CA C 13 65.105 . . 1 . 668 . . 78 VAL CA . 18663 1 777 . 1 1 78 78 VAL CB C 13 31.110 . . 1 . 669 . . 78 VAL CB . 18663 1 778 . 1 1 78 78 VAL CG1 C 13 22.151 . . 2 . 670 . . 78 VAL CG1 . 18663 1 779 . 1 1 78 78 VAL CG2 C 13 21.262 . . 2 . 671 . . 78 VAL CG2 . 18663 1 780 . 1 1 78 78 VAL N N 15 121.316 0.026 . 1 . 675 . . 78 VAL N . 18663 1 781 . 1 1 79 79 THR H H 1 7.073 0.004 . 1 . 681 . . 79 THR H . 18663 1 782 . 1 1 79 79 THR HA H 1 4.102 0.004 . 1 . 682 . . 79 THR HA . 18663 1 783 . 1 1 79 79 THR HB H 1 4.465 0.002 . 1 . 683 . . 79 THR HB . 18663 1 784 . 1 1 79 79 THR HG21 H 1 1.395 0.002 . 1 . 685 . . 79 THR HG21 . 18663 1 785 . 1 1 79 79 THR HG22 H 1 1.395 0.002 . 1 . 685 . . 79 THR HG22 . 18663 1 786 . 1 1 79 79 THR HG23 H 1 1.395 0.002 . 1 . 685 . . 79 THR HG23 . 18663 1 787 . 1 1 79 79 THR CA C 13 62.882 . . 1 . 678 . . 79 THR CA . 18663 1 788 . 1 1 79 79 THR CB C 13 68.219 . . 1 . 679 . . 79 THR CB . 18663 1 789 . 1 1 79 79 THR CG2 C 13 22.596 . . 1 . 680 . . 79 THR CG2 . 18663 1 790 . 1 1 79 79 THR N N 15 106.521 0.046 . 1 . 684 . . 79 THR N . 18663 1 791 . 1 1 80 80 SER H H 1 8.120 0.004 . 1 . 688 . . 80 SER H . 18663 1 792 . 1 1 80 80 SER HA H 1 4.613 0.001 . 1 . 689 . . 80 SER HA . 18663 1 793 . 1 1 80 80 SER HB2 H 1 3.962 0.008 . 2 . 690 . . 80 SER HB2 . 18663 1 794 . 1 1 80 80 SER HB3 H 1 3.873 0.001 . 2 . 691 . . 80 SER HB3 . 18663 1 795 . 1 1 80 80 SER CA C 13 58.148 . . 1 . 686 . . 80 SER CA . 18663 1 796 . 1 1 80 80 SER CB C 13 64.930 0.016 . 1 . 687 . . 80 SER CB . 18663 1 797 . 1 1 80 80 SER N N 15 116.699 0.053 . 1 . 692 . . 80 SER N . 18663 1 798 . 1 1 81 81 LEU H H 1 7.218 0.003 . 1 . 698 . . 81 LEU H . 18663 1 799 . 1 1 81 81 LEU HA H 1 4.323 0.003 . 1 . 699 . . 81 LEU HA . 18663 1 800 . 1 1 81 81 LEU HB2 H 1 1.669 0.002 . 2 . 700 . . 81 LEU HB2 . 18663 1 801 . 1 1 81 81 LEU HB3 H 1 1.239 0.007 . 2 . 701 . . 81 LEU HB3 . 18663 1 802 . 1 1 81 81 LEU HG H 1 1.413 0.001 . 1 . 702 . . 81 LEU HG . 18663 1 803 . 1 1 81 81 LEU HD11 H 1 0.194 0.003 . 2 . 704 . . 81 LEU HD11 . 18663 1 804 . 1 1 81 81 LEU HD12 H 1 0.194 0.003 . 2 . 704 . . 81 LEU HD12 . 18663 1 805 . 1 1 81 81 LEU HD13 H 1 0.194 0.003 . 2 . 704 . . 81 LEU HD13 . 18663 1 806 . 1 1 81 81 LEU HD21 H 1 0.327 0.003 . 2 . 705 . . 81 LEU HD21 . 18663 1 807 . 1 1 81 81 LEU HD22 H 1 0.327 0.003 . 2 . 705 . . 81 LEU HD22 . 18663 1 808 . 1 1 81 81 LEU HD23 H 1 0.327 0.003 . 2 . 705 . . 81 LEU HD23 . 18663 1 809 . 1 1 81 81 LEU CA C 13 52.970 . . 1 . 693 . . 81 LEU CA . 18663 1 810 . 1 1 81 81 LEU CB C 13 41.673 0.016 . 1 . 694 . . 81 LEU CB . 18663 1 811 . 1 1 81 81 LEU CG C 13 26.059 . . 1 . 697 . . 81 LEU CG . 18663 1 812 . 1 1 81 81 LEU CD1 C 13 23.804 . . 2 . 695 . . 81 LEU CD1 . 18663 1 813 . 1 1 81 81 LEU CD2 C 13 22.025 . . 2 . 696 . . 81 LEU CD2 . 18663 1 814 . 1 1 81 81 LEU N N 15 125.223 0.028 . 1 . 703 . . 81 LEU N . 18663 1 815 . 1 1 82 82 PRO HA H 1 4.383 0.001 . 1 . 710 . . 82 PRO HA . 18663 1 816 . 1 1 82 82 PRO HB2 H 1 2.336 0.005 . 2 . 711 . . 82 PRO HB2 . 18663 1 817 . 1 1 82 82 PRO HB3 H 1 1.977 0.005 . 2 . 712 . . 82 PRO HB3 . 18663 1 818 . 1 1 82 82 PRO HG2 H 1 1.970 0.002 . 1 . 1868 . . 82 PRO HG2 . 18663 1 819 . 1 1 82 82 PRO HG3 H 1 1.970 0.002 . 1 . 715 . . 82 PRO HG3 . 18663 1 820 . 1 1 82 82 PRO HD2 H 1 3.975 0.002 . 2 . 713 . . 82 PRO HD2 . 18663 1 821 . 1 1 82 82 PRO HD3 H 1 3.502 0.001 . 2 . 714 . . 82 PRO HD3 . 18663 1 822 . 1 1 82 82 PRO CA C 13 61.759 . . 1 . 706 . . 82 PRO CA . 18663 1 823 . 1 1 82 82 PRO CB C 13 31.904 0.001 . 1 . 707 . . 82 PRO CB . 18663 1 824 . 1 1 82 82 PRO CG C 13 27.408 . . 1 . 709 . . 82 PRO CG . 18663 1 825 . 1 1 82 82 PRO CD C 13 50.511 0.002 . 1 . 708 . . 82 PRO CD . 18663 1 826 . 1 1 83 83 LEU H H 1 7.814 0.003 . 1 . 720 . . 83 LEU H . 18663 1 827 . 1 1 83 83 LEU HA H 1 3.681 0.008 . 1 . 721 . . 83 LEU HA . 18663 1 828 . 1 1 83 83 LEU HB2 H 1 1.601 0.004 . 2 . 722 . . 83 LEU HB2 . 18663 1 829 . 1 1 83 83 LEU HB3 H 1 1.438 0.004 . 2 . 723 . . 83 LEU HB3 . 18663 1 830 . 1 1 83 83 LEU HG H 1 1.641 0.003 . 1 . 724 . . 83 LEU HG . 18663 1 831 . 1 1 83 83 LEU HD11 H 1 0.840 0.003 . 2 . 726 . . 83 LEU HD11 . 18663 1 832 . 1 1 83 83 LEU HD12 H 1 0.840 0.003 . 2 . 726 . . 83 LEU HD12 . 18663 1 833 . 1 1 83 83 LEU HD13 H 1 0.840 0.003 . 2 . 726 . . 83 LEU HD13 . 18663 1 834 . 1 1 83 83 LEU HD21 H 1 0.865 . . 2 . 727 . . 83 LEU HD21 . 18663 1 835 . 1 1 83 83 LEU HD22 H 1 0.865 . . 2 . 727 . . 83 LEU HD22 . 18663 1 836 . 1 1 83 83 LEU HD23 H 1 0.865 . . 2 . 727 . . 83 LEU HD23 . 18663 1 837 . 1 1 83 83 LEU CA C 13 56.464 . . 1 . 716 . . 83 LEU CA . 18663 1 838 . 1 1 83 83 LEU CB C 13 42.134 . . 1 . 717 . . 83 LEU CB . 18663 1 839 . 1 1 83 83 LEU CG C 13 27.552 . . 1 . 719 . . 83 LEU CG . 18663 1 840 . 1 1 83 83 LEU CD1 C 13 21.548 . . 1 . 718 . . 83 LEU CD1 . 18663 1 841 . 1 1 83 83 LEU N N 15 117.797 0.008 . 1 . 725 . . 83 LEU N . 18663 1 842 . 1 1 84 84 ARG H H 1 8.559 0.002 . 1 . 732 . . 84 ARG H . 18663 1 843 . 1 1 84 84 ARG HA H 1 3.767 0.001 . 1 . 733 . . 84 ARG HA . 18663 1 844 . 1 1 84 84 ARG HB2 H 1 2.307 0.003 . 2 . 734 . . 84 ARG HB2 . 18663 1 845 . 1 1 84 84 ARG HB3 H 1 2.132 0.005 . 2 . 735 . . 84 ARG HB3 . 18663 1 846 . 1 1 84 84 ARG HG2 H 1 1.641 0.004 . 2 . 738 . . 84 ARG HG2 . 18663 1 847 . 1 1 84 84 ARG HG3 H 1 1.544 0.003 . 2 . 739 . . 84 ARG HG3 . 18663 1 848 . 1 1 84 84 ARG HD2 H 1 3.227 0.006 . 2 . 736 . . 84 ARG HD2 . 18663 1 849 . 1 1 84 84 ARG HD3 H 1 3.161 0.002 . 2 . 737 . . 84 ARG HD3 . 18663 1 850 . 1 1 84 84 ARG CA C 13 58.432 . . 1 . 728 . . 84 ARG CA . 18663 1 851 . 1 1 84 84 ARG CB C 13 26.615 0.016 . 1 . 729 . . 84 ARG CB . 18663 1 852 . 1 1 84 84 ARG CG C 13 26.433 0.01 . 1 . 731 . . 84 ARG CG . 18663 1 853 . 1 1 84 84 ARG CD C 13 42.770 0.001 . 1 . 730 . . 84 ARG CD . 18663 1 854 . 1 1 84 84 ARG N N 15 113.688 0.006 . 1 . 740 . . 84 ARG N . 18663 1 855 . 1 1 85 85 CYS H H 1 7.826 0.008 . 1 . 743 . . 85 CYS H . 18663 1 856 . 1 1 85 85 CYS HA H 1 5.015 0.002 . 1 . 744 . . 85 CYS HA . 18663 1 857 . 1 1 85 85 CYS HB2 H 1 2.997 . . 2 . 745 . . 85 CYS HB2 . 18663 1 858 . 1 1 85 85 CYS HB3 H 1 2.717 0.001 . 2 . 746 . . 85 CYS HB3 . 18663 1 859 . 1 1 85 85 CYS CA C 13 59.927 . . 1 . 741 . . 85 CYS CA . 18663 1 860 . 1 1 85 85 CYS CB C 13 29.522 . . 1 . 742 . . 85 CYS CB . 18663 1 861 . 1 1 85 85 CYS N N 15 118.325 0.075 . 1 . 747 . . 85 CYS N . 18663 1 862 . 1 1 86 86 SER H H 1 8.610 0.006 . 1 . 750 . . 86 SER H . 18663 1 863 . 1 1 86 86 SER HA H 1 5.656 0.003 . 1 . 751 . . 86 SER HA . 18663 1 864 . 1 1 86 86 SER HB2 H 1 3.380 . . 2 . 752 . . 86 SER HB2 . 18663 1 865 . 1 1 86 86 SER HB3 H 1 3.366 0.003 . 2 . 753 . . 86 SER HB3 . 18663 1 866 . 1 1 86 86 SER CA C 13 57.131 . . 1 . 748 . . 86 SER CA . 18663 1 867 . 1 1 86 86 SER CB C 13 66.725 0.001 . 1 . 749 . . 86 SER CB . 18663 1 868 . 1 1 86 86 SER N N 15 114.203 0.021 . 1 . 754 . . 86 SER N . 18663 1 869 . 1 1 87 87 TYR H H 1 8.114 0.005 . 1 . 759 . . 87 TYR H . 18663 1 870 . 1 1 87 87 TYR HA H 1 6.013 0.003 . 1 . 760 . . 87 TYR HA . 18663 1 871 . 1 1 87 87 TYR HB2 H 1 3.341 0.005 . 2 . 761 . . 87 TYR HB2 . 18663 1 872 . 1 1 87 87 TYR HB3 H 1 2.542 0.006 . 2 . 762 . . 87 TYR HB3 . 18663 1 873 . 1 1 87 87 TYR HD1 H 1 7.089 0.002 . 3 . 764 . . 87 TYR HD1 . 18663 1 874 . 1 1 87 87 TYR HD2 H 1 7.089 0.002 . 3 . 764 . . 87 TYR HD2 . 18663 1 875 . 1 1 87 87 TYR HE1 H 1 6.639 0.002 . 3 . 765 . . 87 TYR HE1 . 18663 1 876 . 1 1 87 87 TYR HE2 H 1 6.639 0.002 . 3 . 765 . . 87 TYR HE2 . 18663 1 877 . 1 1 87 87 TYR CA C 13 54.654 . . 1 . 755 . . 87 TYR CA . 18663 1 878 . 1 1 87 87 TYR CB C 13 43.135 0.016 . 1 . 756 . . 87 TYR CB . 18663 1 879 . 1 1 87 87 TYR CD1 C 13 130.801 . . 3 . 757 . . 87 TYR CD1 . 18663 1 880 . 1 1 87 87 TYR CE1 C 13 117.903 . . 3 . 758 . . 87 TYR CE1 . 18663 1 881 . 1 1 87 87 TYR N N 15 118.314 0.029 . 1 . 763 . . 87 TYR N . 18663 1 882 . 1 1 88 88 HIS H H 1 9.034 0.007 . 1 . 768 . . 88 HIS H . 18663 1 883 . 1 1 88 88 HIS HA H 1 5.896 0.006 . 1 . 769 . . 88 HIS HA . 18663 1 884 . 1 1 88 88 HIS HB2 H 1 3.059 0.006 . 1 . 1869 . . 88 HIS HB2 . 18663 1 885 . 1 1 88 88 HIS HB3 H 1 3.059 0.006 . 1 . 771 . . 88 HIS HB3 . 18663 1 886 . 1 1 88 88 HIS CA C 13 54.399 . . 1 . 766 . . 88 HIS CA . 18663 1 887 . 1 1 88 88 HIS CB C 13 35.336 . . 1 . 767 . . 88 HIS CB . 18663 1 888 . 1 1 88 88 HIS N N 15 114.640 0.015 . 1 . 770 . . 88 HIS N . 18663 1 889 . 1 1 89 89 LEU H H 1 10.112 0.007 . 1 . 777 . . 89 LEU H . 18663 1 890 . 1 1 89 89 LEU HA H 1 5.406 0.005 . 1 . 778 . . 89 LEU HA . 18663 1 891 . 1 1 89 89 LEU HB2 H 1 0.822 . . 2 . 779 . . 89 LEU HB2 . 18663 1 892 . 1 1 89 89 LEU HB3 H 1 0.823 0.003 . 2 . 780 . . 89 LEU HB3 . 18663 1 893 . 1 1 89 89 LEU HG H 1 1.291 0.007 . 1 . 781 . . 89 LEU HG . 18663 1 894 . 1 1 89 89 LEU HD11 H 1 -0.189 0.003 . 2 . 783 . . 89 LEU HD11 . 18663 1 895 . 1 1 89 89 LEU HD12 H 1 -0.189 0.003 . 2 . 783 . . 89 LEU HD12 . 18663 1 896 . 1 1 89 89 LEU HD13 H 1 -0.189 0.003 . 2 . 783 . . 89 LEU HD13 . 18663 1 897 . 1 1 89 89 LEU HD21 H 1 0.118 0.002 . 2 . 784 . . 89 LEU HD21 . 18663 1 898 . 1 1 89 89 LEU HD22 H 1 0.118 0.002 . 2 . 784 . . 89 LEU HD22 . 18663 1 899 . 1 1 89 89 LEU HD23 H 1 0.118 0.002 . 2 . 784 . . 89 LEU HD23 . 18663 1 900 . 1 1 89 89 LEU CA C 13 54.463 . . 1 . 772 . . 89 LEU CA . 18663 1 901 . 1 1 89 89 LEU CB C 13 42.706 . . 1 . 773 . . 89 LEU CB . 18663 1 902 . 1 1 89 89 LEU CG C 13 27.266 . . 1 . 776 . . 89 LEU CG . 18663 1 903 . 1 1 89 89 LEU CD1 C 13 22.438 . . 2 . 774 . . 89 LEU CD1 . 18663 1 904 . 1 1 89 89 LEU CD2 C 13 25.960 . . 2 . 775 . . 89 LEU CD2 . 18663 1 905 . 1 1 89 89 LEU N N 15 127.061 0.024 . 1 . 782 . . 89 LEU N . 18663 1 906 . 1 1 90 90 MET H H 1 8.908 0.006 . 1 . 787 . . 90 MET H . 18663 1 907 . 1 1 90 90 MET HA H 1 5.729 0.003 . 1 . 788 . . 90 MET HA . 18663 1 908 . 1 1 90 90 MET HB2 H 1 1.740 . . 1 . 1870 . . 90 MET HB2 . 18663 1 909 . 1 1 90 90 MET HB3 H 1 1.740 . . 1 . 790 . . 90 MET HB3 . 18663 1 910 . 1 1 90 90 MET HE1 H 1 0.599 0.003 . 1 . 791 . . 90 MET HE1 . 18663 1 911 . 1 1 90 90 MET HE2 H 1 0.599 0.003 . 1 . 791 . . 90 MET HE2 . 18663 1 912 . 1 1 90 90 MET HE3 H 1 0.599 0.003 . 1 . 791 . . 90 MET HE3 . 18663 1 913 . 1 1 90 90 MET CA C 13 50.870 . . 1 . 785 . . 90 MET CA . 18663 1 914 . 1 1 90 90 MET CE C 13 14.112 0.001 . 1 . 786 . . 90 MET CE . 18663 1 915 . 1 1 90 90 MET N N 15 121.219 0.058 . 1 . 789 . . 90 MET N . 18663 1 916 . 1 1 91 91 ARG H H 1 8.571 0.007 . 1 . 793 . . 91 ARG H . 18663 1 917 . 1 1 91 91 ARG HA H 1 2.686 0.005 . 1 . 794 . . 91 ARG HA . 18663 1 918 . 1 1 91 91 ARG CA C 13 57.386 . . 1 . 792 . . 91 ARG CA . 18663 1 919 . 1 1 91 91 ARG N N 15 124.353 0.06 . 1 . 795 . . 91 ARG N . 18663 1 920 . 1 1 92 92 GLY H H 1 8.465 0.003 . 1 . 797 . . 92 GLY H . 18663 1 921 . 1 1 92 92 GLY HA2 H 1 3.690 0.003 . 2 . 798 . . 92 GLY HA2 . 18663 1 922 . 1 1 92 92 GLY HA3 H 1 3.190 0.003 . 2 . 799 . . 92 GLY HA3 . 18663 1 923 . 1 1 92 92 GLY CA C 13 46.566 0.016 . 1 . 796 . . 92 GLY CA . 18663 1 924 . 1 1 92 92 GLY N N 15 116.946 0.03 . 1 . 800 . . 92 GLY N . 18663 1 925 . 1 1 93 93 GLU H H 1 8.821 0.005 . 1 . 804 . . 93 GLU H . 18663 1 926 . 1 1 93 93 GLU HA H 1 4.470 0.001 . 1 . 805 . . 93 GLU HA . 18663 1 927 . 1 1 93 93 GLU HB2 H 1 1.704 0.003 . 2 . 806 . . 93 GLU HB2 . 18663 1 928 . 1 1 93 93 GLU HB3 H 1 1.688 0.003 . 2 . 807 . . 93 GLU HB3 . 18663 1 929 . 1 1 93 93 GLU HG2 H 1 2.074 0.004 . 1 . 1871 . . 93 GLU HG2 . 18663 1 930 . 1 1 93 93 GLU HG3 H 1 2.074 0.004 . 1 . 809 . . 93 GLU HG3 . 18663 1 931 . 1 1 93 93 GLU CA C 13 55.030 . . 1 . 801 . . 93 GLU CA . 18663 1 932 . 1 1 93 93 GLU CB C 13 29.465 0.005 . 1 . 802 . . 93 GLU CB . 18663 1 933 . 1 1 93 93 GLU CG C 13 36.300 . . 1 . 803 . . 93 GLU CG . 18663 1 934 . 1 1 93 93 GLU N N 15 125.098 0.026 . 1 . 808 . . 93 GLU N . 18663 1 935 . 1 1 94 94 ARG H H 1 7.456 0.004 . 1 . 812 . . 94 ARG H . 18663 1 936 . 1 1 94 94 ARG HA H 1 4.043 0.004 . 1 . 813 . . 94 ARG HA . 18663 1 937 . 1 1 94 94 ARG HB2 H 1 1.662 0.002 . 2 . 814 . . 94 ARG HB2 . 18663 1 938 . 1 1 94 94 ARG HB3 H 1 1.621 0.002 . 2 . 815 . . 94 ARG HB3 . 18663 1 939 . 1 1 94 94 ARG CA C 13 56.338 . . 1 . 810 . . 94 ARG CA . 18663 1 940 . 1 1 94 94 ARG CB C 13 30.333 0.02 . 1 . 811 . . 94 ARG CB . 18663 1 941 . 1 1 94 94 ARG N N 15 119.934 0.058 . 1 . 816 . . 94 ARG N . 18663 1 942 . 1 1 95 95 ARG H H 1 8.558 0.006 . 1 . 821 . . 95 ARG H . 18663 1 943 . 1 1 95 95 ARG HA H 1 3.660 0.002 . 1 . 822 . . 95 ARG HA . 18663 1 944 . 1 1 95 95 ARG HB2 H 1 1.357 0.002 . 1 . 1872 . . 95 ARG HB2 . 18663 1 945 . 1 1 95 95 ARG HB3 H 1 1.357 0.002 . 1 . 828 . . 95 ARG HB3 . 18663 1 946 . 1 1 95 95 ARG HG2 H 1 3.136 . . 2 . 825 . . 95 ARG HG2 . 18663 1 947 . 1 1 95 95 ARG HG3 H 1 0.568 0.001 . 2 . 826 . . 95 ARG HG3 . 18663 1 948 . 1 1 95 95 ARG HD2 H 1 3.138 0.002 . 2 . 823 . . 95 ARG HD2 . 18663 1 949 . 1 1 95 95 ARG HD3 H 1 2.880 0.002 . 2 . 824 . . 95 ARG HD3 . 18663 1 950 . 1 1 95 95 ARG CA C 13 52.716 . . 1 . 817 . . 95 ARG CA . 18663 1 951 . 1 1 95 95 ARG CB C 13 30.598 . . 1 . 818 . . 95 ARG CB . 18663 1 952 . 1 1 95 95 ARG CG C 13 24.877 . . 1 . 820 . . 95 ARG CG . 18663 1 953 . 1 1 95 95 ARG CD C 13 43.416 . . 1 . 819 . . 95 ARG CD . 18663 1 954 . 1 1 95 95 ARG N N 15 119.731 0.055 . 1 . 827 . . 95 ARG N . 18663 1 955 . 1 1 96 96 PRO HA H 1 3.504 0.004 . 1 . 830 . . 96 PRO HA . 18663 1 956 . 1 1 96 96 PRO CA C 13 60.944 . . 1 . 829 . . 96 PRO CA . 18663 1 957 . 1 1 97 97 LEU H H 1 7.426 0.004 . 1 . 835 . . 97 LEU H . 18663 1 958 . 1 1 97 97 LEU HA H 1 4.610 0.005 . 1 . 836 . . 97 LEU HA . 18663 1 959 . 1 1 97 97 LEU HB2 H 1 1.308 0.001 . 2 . 837 . . 97 LEU HB2 . 18663 1 960 . 1 1 97 97 LEU HB3 H 1 1.077 0.002 . 2 . 838 . . 97 LEU HB3 . 18663 1 961 . 1 1 97 97 LEU HD11 H 1 0.577 0.009 . 2 . 840 . . 97 LEU HD11 . 18663 1 962 . 1 1 97 97 LEU HD12 H 1 0.577 0.009 . 2 . 840 . . 97 LEU HD12 . 18663 1 963 . 1 1 97 97 LEU HD13 H 1 0.577 0.009 . 2 . 840 . . 97 LEU HD13 . 18663 1 964 . 1 1 97 97 LEU HD21 H 1 0.658 0.002 . 2 . 841 . . 97 LEU HD21 . 18663 1 965 . 1 1 97 97 LEU HD22 H 1 0.658 0.002 . 2 . 841 . . 97 LEU HD22 . 18663 1 966 . 1 1 97 97 LEU HD23 H 1 0.658 0.002 . 2 . 841 . . 97 LEU HD23 . 18663 1 967 . 1 1 97 97 LEU CA C 13 52.557 . . 1 . 831 . . 97 LEU CA . 18663 1 968 . 1 1 97 97 LEU CB C 13 44.263 0.031 . 1 . 832 . . 97 LEU CB . 18663 1 969 . 1 1 97 97 LEU CD1 C 13 25.034 . . 2 . 833 . . 97 LEU CD1 . 18663 1 970 . 1 1 97 97 LEU CD2 C 13 23.327 . . 2 . 834 . . 97 LEU CD2 . 18663 1 971 . 1 1 97 97 LEU N N 15 121.788 0.064 . 1 . 839 . . 97 LEU N . 18663 1 972 . 1 1 98 98 TRP H H 1 8.496 0.004 . 1 . 849 . . 98 TRP H . 18663 1 973 . 1 1 98 98 TRP HA H 1 3.779 0.004 . 1 . 850 . . 98 TRP HA . 18663 1 974 . 1 1 98 98 TRP HB2 H 1 2.326 0.001 . 2 . 851 . . 98 TRP HB2 . 18663 1 975 . 1 1 98 98 TRP HB3 H 1 2.308 0.008 . 2 . 852 . . 98 TRP HB3 . 18663 1 976 . 1 1 98 98 TRP HD1 H 1 7.108 0.001 . 1 . 853 . . 98 TRP HD1 . 18663 1 977 . 1 1 98 98 TRP HE1 H 1 9.873 0.004 . 1 . 854 . . 98 TRP HE1 . 18663 1 978 . 1 1 98 98 TRP HE3 H 1 7.158 0.003 . 1 . 855 . . 98 TRP HE3 . 18663 1 979 . 1 1 98 98 TRP HZ2 H 1 7.227 0.001 . 1 . 857 . . 98 TRP HZ2 . 18663 1 980 . 1 1 98 98 TRP HZ3 H 1 6.980 0.001 . 1 . 858 . . 98 TRP HZ3 . 18663 1 981 . 1 1 98 98 TRP HH2 H 1 7.030 0.001 . 1 . 856 . . 98 TRP HH2 . 18663 1 982 . 1 1 98 98 TRP CA C 13 59.609 0.001 . 1 . 842 . . 98 TRP CA . 18663 1 983 . 1 1 98 98 TRP CB C 13 26.059 . . 1 . 843 . . 98 TRP CB . 18663 1 984 . 1 1 98 98 TRP CD1 C 13 127.021 . . 1 . 844 . . 98 TRP CD1 . 18663 1 985 . 1 1 98 98 TRP CE3 C 13 120.476 . . 1 . 845 . . 98 TRP CE3 . 18663 1 986 . 1 1 98 98 TRP CZ2 C 13 114.218 . . 1 . 847 . . 98 TRP CZ2 . 18663 1 987 . 1 1 98 98 TRP CZ3 C 13 121.652 . . 1 . 848 . . 98 TRP CZ3 . 18663 1 988 . 1 1 98 98 TRP CH2 C 13 124.384 . . 1 . 846 . . 98 TRP CH2 . 18663 1 989 . 1 1 98 98 TRP N N 15 126.388 0.021 . 1 . 859 . . 98 TRP N . 18663 1 990 . 1 1 98 98 TRP NE1 N 15 129.496 . . 1 . 860 . . 98 TRP NE1 . 18663 1 991 . 1 1 99 99 GLU H H 1 7.344 0.007 . 1 . 864 . . 99 GLU H . 18663 1 992 . 1 1 99 99 GLU HA H 1 3.397 0.002 . 1 . 865 . . 99 GLU HA . 18663 1 993 . 1 1 99 99 GLU HB2 H 1 1.161 0.006 . 2 . 866 . . 99 GLU HB2 . 18663 1 994 . 1 1 99 99 GLU HB3 H 1 1.078 0.004 . 2 . 867 . . 99 GLU HB3 . 18663 1 995 . 1 1 99 99 GLU HG2 H 1 1.438 0.004 . 2 . 868 . . 99 GLU HG2 . 18663 1 996 . 1 1 99 99 GLU HG3 H 1 1.090 0.01 . 2 . 869 . . 99 GLU HG3 . 18663 1 997 . 1 1 99 99 GLU CA C 13 56.909 . . 1 . 861 . . 99 GLU CA . 18663 1 998 . 1 1 99 99 GLU CB C 13 28.791 . . 1 . 862 . . 99 GLU CB . 18663 1 999 . 1 1 99 99 GLU CG C 13 35.637 0.016 . 1 . 863 . . 99 GLU CG . 18663 1 1000 . 1 1 99 99 GLU N N 15 114.841 0.015 . 1 . 870 . . 99 GLU N . 18663 1 1001 . 1 1 100 100 GLU H H 1 6.815 0.003 . 1 . 874 . . 100 GLU H . 18663 1 1002 . 1 1 100 100 GLU HA H 1 4.013 0.004 . 1 . 875 . . 100 GLU HA . 18663 1 1003 . 1 1 100 100 GLU HB2 H 1 2.070 0.004 . 2 . 876 . . 100 GLU HB2 . 18663 1 1004 . 1 1 100 100 GLU HB3 H 1 1.777 0.002 . 2 . 877 . . 100 GLU HB3 . 18663 1 1005 . 1 1 100 100 GLU HG2 H 1 2.245 0.002 . 1 . 1873 . . 100 GLU HG2 . 18663 1 1006 . 1 1 100 100 GLU HG3 H 1 2.245 0.002 . 1 . 879 . . 100 GLU HG3 . 18663 1 1007 . 1 1 100 100 GLU CA C 13 56.560 . . 1 . 871 . . 100 GLU CA . 18663 1 1008 . 1 1 100 100 GLU CB C 13 29.697 0.016 . 1 . 872 . . 100 GLU CB . 18663 1 1009 . 1 1 100 100 GLU CG C 13 36.860 . . 1 . 873 . . 100 GLU CG . 18663 1 1010 . 1 1 100 100 GLU N N 15 120.290 0.043 . 1 . 878 . . 100 GLU N . 18663 1 1011 . 1 1 101 101 GLU H H 1 9.020 0.004 . 1 . 883 . . 101 GLU H . 18663 1 1012 . 1 1 101 101 GLU HA H 1 3.939 0.003 . 1 . 884 . . 101 GLU HA . 18663 1 1013 . 1 1 101 101 GLU HB2 H 1 2.096 0.002 . 2 . 885 . . 101 GLU HB2 . 18663 1 1014 . 1 1 101 101 GLU HB3 H 1 2.033 0.001 . 2 . 886 . . 101 GLU HB3 . 18663 1 1015 . 1 1 101 101 GLU HG2 H 1 2.333 0.005 . 2 . 887 . . 101 GLU HG2 . 18663 1 1016 . 1 1 101 101 GLU HG3 H 1 2.269 0.001 . 2 . 888 . . 101 GLU HG3 . 18663 1 1017 . 1 1 101 101 GLU CA C 13 59.895 . . 1 . 880 . . 101 GLU CA . 18663 1 1018 . 1 1 101 101 GLU CB C 13 28.950 . . 1 . 881 . . 101 GLU CB . 18663 1 1019 . 1 1 101 101 GLU CG C 13 35.907 . . 1 . 882 . . 101 GLU CG . 18663 1 1020 . 1 1 101 101 GLU N N 15 126.792 0.027 . 1 . 889 . . 101 GLU N . 18663 1 1021 . 1 1 102 102 SER H H 1 8.421 0.006 . 1 . 892 . . 102 SER H . 18663 1 1022 . 1 1 102 102 SER HA H 1 4.302 0.004 . 1 . 893 . . 102 SER HA . 18663 1 1023 . 1 1 102 102 SER HB2 H 1 3.992 0.003 . 2 . 894 . . 102 SER HB2 . 18663 1 1024 . 1 1 102 102 SER HB3 H 1 3.885 0.006 . 2 . 895 . . 102 SER HB3 . 18663 1 1025 . 1 1 102 102 SER CA C 13 59.959 . . 1 . 890 . . 102 SER CA . 18663 1 1026 . 1 1 102 102 SER CB C 13 62.612 0.065 . 1 . 891 . . 102 SER CB . 18663 1 1027 . 1 1 102 102 SER N N 15 110.898 0.056 . 1 . 896 . . 102 SER N . 18663 1 1028 . 1 1 103 103 ASN H H 1 8.069 0.005 . 1 . 899 . . 103 ASN H . 18663 1 1029 . 1 1 103 103 ASN HA H 1 5.051 0.002 . 1 . 900 . . 103 ASN HA . 18663 1 1030 . 1 1 103 103 ASN HB2 H 1 2.972 0.01 . 2 . 901 . . 103 ASN HB2 . 18663 1 1031 . 1 1 103 103 ASN HB3 H 1 2.945 0.005 . 2 . 902 . . 103 ASN HB3 . 18663 1 1032 . 1 1 103 103 ASN HD21 H 1 6.218 0.001 . 1 . 903 . . 103 ASN HD21 . 18663 1 1033 . 1 1 103 103 ASN HD22 H 1 7.323 0.002 . 1 . 904 . . 103 ASN HD22 . 18663 1 1034 . 1 1 103 103 ASN CA C 13 53.605 . . 1 . 897 . . 103 ASN CA . 18663 1 1035 . 1 1 103 103 ASN CB C 13 38.767 0.001 . 1 . 898 . . 103 ASN CB . 18663 1 1036 . 1 1 103 103 ASN N N 15 119.891 0.029 . 1 . 905 . . 103 ASN N . 18663 1 1037 . 1 1 103 103 ASN ND2 N 15 109.621 0.02 . 1 . 906 . . 103 ASN ND2 . 18663 1 1038 . 1 1 104 104 ALA H H 1 7.723 0.004 . 1 . 909 . . 104 ALA H . 18663 1 1039 . 1 1 104 104 ALA HA H 1 4.558 0.003 . 1 . 910 . . 104 ALA HA . 18663 1 1040 . 1 1 104 104 ALA HB1 H 1 1.558 0.002 . 1 . 912 . . 104 ALA HB1 . 18663 1 1041 . 1 1 104 104 ALA HB2 H 1 1.558 0.002 . 1 . 912 . . 104 ALA HB2 . 18663 1 1042 . 1 1 104 104 ALA HB3 H 1 1.558 0.002 . 1 . 912 . . 104 ALA HB3 . 18663 1 1043 . 1 1 104 104 ALA CA C 13 56.274 . . 1 . 907 . . 104 ALA CA . 18663 1 1044 . 1 1 104 104 ALA CB C 13 19.451 . . 1 . 908 . . 104 ALA CB . 18663 1 1045 . 1 1 104 104 ALA N N 15 123.194 0.027 . 1 . 911 . . 104 ALA N . 18663 1 1046 . 1 1 105 105 LYS H H 1 8.278 0.003 . 1 . 918 . . 105 LYS H . 18663 1 1047 . 1 1 105 105 LYS HA H 1 4.661 0.007 . 1 . 919 . . 105 LYS HA . 18663 1 1048 . 1 1 105 105 LYS HB2 H 1 2.249 0.001 . 2 . 920 . . 105 LYS HB2 . 18663 1 1049 . 1 1 105 105 LYS HB3 H 1 1.992 0.005 . 2 . 921 . . 105 LYS HB3 . 18663 1 1050 . 1 1 105 105 LYS HG2 H 1 1.667 0.002 . 2 . 924 . . 105 LYS HG2 . 18663 1 1051 . 1 1 105 105 LYS HG3 H 1 1.575 0.003 . 2 . 925 . . 105 LYS HG3 . 18663 1 1052 . 1 1 105 105 LYS HD2 H 1 1.777 0.002 . 2 . 922 . . 105 LYS HD2 . 18663 1 1053 . 1 1 105 105 LYS HD3 H 1 1.715 0.003 . 2 . 923 . . 105 LYS HD3 . 18663 1 1054 . 1 1 105 105 LYS HE2 H 1 3.054 0.002 . 1 . 1874 . . 105 LYS HE2 . 18663 1 1055 . 1 1 105 105 LYS HE3 H 1 3.054 0.002 . 1 . 927 . . 105 LYS HE3 . 18663 1 1056 . 1 1 105 105 LYS CA C 13 55.499 0.013 . 1 . 913 . . 105 LYS CA . 18663 1 1057 . 1 1 105 105 LYS CB C 13 31.065 . . 1 . 914 . . 105 LYS CB . 18663 1 1058 . 1 1 105 105 LYS CG C 13 25.134 0.012 . 1 . 917 . . 105 LYS CG . 18663 1 1059 . 1 1 105 105 LYS CD C 13 28.498 0.012 . 1 . 915 . . 105 LYS CD . 18663 1 1060 . 1 1 105 105 LYS CE C 13 41.992 . . 1 . 916 . . 105 LYS CE . 18663 1 1061 . 1 1 105 105 LYS N N 15 115.105 0.053 . 1 . 926 . . 105 LYS N . 18663 1 1062 . 1 1 106 106 GLY H H 1 8.038 0.004 . 1 . 928 . . 106 GLY H . 18663 1 1063 . 1 1 106 106 GLY HA2 H 1 3.985 . . 2 . 929 . . 106 GLY HA2 . 18663 1 1064 . 1 1 106 106 GLY HA3 H 1 3.845 . . 2 . 930 . . 106 GLY HA3 . 18663 1 1065 . 1 1 106 106 GLY N N 15 108.579 0.05 . 1 . 931 . . 106 GLY N . 18663 1 1066 . 1 1 107 107 GLY H H 1 7.530 0.002 . 1 . 932 . . 107 GLY H . 18663 1 1067 . 1 1 107 107 GLY HA2 H 1 4.157 . . 2 . 933 . . 107 GLY HA2 . 18663 1 1068 . 1 1 107 107 GLY HA3 H 1 3.370 . . 2 . 934 . . 107 GLY HA3 . 18663 1 1069 . 1 1 107 107 GLY N N 15 115.093 0.062 . 1 . 935 . . 107 GLY N . 18663 1 1070 . 1 1 108 108 VAL H H 1 6.534 0.005 . 1 . 940 . . 108 VAL H . 18663 1 1071 . 1 1 108 108 VAL HA H 1 5.234 0.002 . 1 . 941 . . 108 VAL HA . 18663 1 1072 . 1 1 108 108 VAL HB H 1 1.240 0.004 . 1 . 942 . . 108 VAL HB . 18663 1 1073 . 1 1 108 108 VAL HG11 H 1 -0.313 0.003 . 2 . 944 . . 108 VAL HG11 . 18663 1 1074 . 1 1 108 108 VAL HG12 H 1 -0.313 0.003 . 2 . 944 . . 108 VAL HG12 . 18663 1 1075 . 1 1 108 108 VAL HG13 H 1 -0.313 0.003 . 2 . 944 . . 108 VAL HG13 . 18663 1 1076 . 1 1 108 108 VAL HG21 H 1 0.300 0.002 . 2 . 945 . . 108 VAL HG21 . 18663 1 1077 . 1 1 108 108 VAL HG22 H 1 0.300 0.002 . 2 . 945 . . 108 VAL HG22 . 18663 1 1078 . 1 1 108 108 VAL HG23 H 1 0.300 0.002 . 2 . 945 . . 108 VAL HG23 . 18663 1 1079 . 1 1 108 108 VAL CA C 13 56.337 . . 1 . 936 . . 108 VAL CA . 18663 1 1080 . 1 1 108 108 VAL CB C 13 34.478 . . 1 . 937 . . 108 VAL CB . 18663 1 1081 . 1 1 108 108 VAL CG1 C 13 20.754 . . 2 . 938 . . 108 VAL CG1 . 18663 1 1082 . 1 1 108 108 VAL CG2 C 13 17.863 . . 2 . 939 . . 108 VAL CG2 . 18663 1 1083 . 1 1 108 108 VAL N N 15 107.373 0.134 . 1 . 943 . . 108 VAL N . 18663 1 1084 . 1 1 109 109 TRP H H 1 9.150 0.005 . 1 . 950 . . 109 TRP H . 18663 1 1085 . 1 1 109 109 TRP HA H 1 4.756 . . 1 . 951 . . 109 TRP HA . 18663 1 1086 . 1 1 109 109 TRP HB2 H 1 2.964 0.002 . 2 . 952 . . 109 TRP HB2 . 18663 1 1087 . 1 1 109 109 TRP HB3 H 1 2.620 0.002 . 2 . 953 . . 109 TRP HB3 . 18663 1 1088 . 1 1 109 109 TRP HD1 H 1 6.823 0.002 . 1 . 954 . . 109 TRP HD1 . 18663 1 1089 . 1 1 109 109 TRP HE1 H 1 10.362 0.005 . 1 . 955 . . 109 TRP HE1 . 18663 1 1090 . 1 1 109 109 TRP HZ2 H 1 6.962 0.002 . 1 . 957 . . 109 TRP HZ2 . 18663 1 1091 . 1 1 109 109 TRP HH2 H 1 6.767 . . 1 . 956 . . 109 TRP HH2 . 18663 1 1092 . 1 1 109 109 TRP CB C 13 28.953 . . 1 . 946 . . 109 TRP CB . 18663 1 1093 . 1 1 109 109 TRP CD1 C 13 125.019 . . 1 . 947 . . 109 TRP CD1 . 18663 1 1094 . 1 1 109 109 TRP CZ2 C 13 113.709 . . 1 . 949 . . 109 TRP CZ2 . 18663 1 1095 . 1 1 109 109 TRP CH2 C 13 123.176 . . 1 . 948 . . 109 TRP CH2 . 18663 1 1096 . 1 1 109 109 TRP N N 15 121.556 0.04 . 1 . 958 . . 109 TRP N . 18663 1 1097 . 1 1 109 109 TRP NE1 N 15 128.803 0.013 . 1 . 959 . . 109 TRP NE1 . 18663 1 1098 . 1 1 110 110 LYS H H 1 8.959 0.004 . 1 . 965 . . 110 LYS H . 18663 1 1099 . 1 1 110 110 LYS HA H 1 4.895 0.005 . 1 . 966 . . 110 LYS HA . 18663 1 1100 . 1 1 110 110 LYS HB2 H 1 1.113 0.001 . 2 . 967 . . 110 LYS HB2 . 18663 1 1101 . 1 1 110 110 LYS HB3 H 1 0.909 0.001 . 2 . 968 . . 110 LYS HB3 . 18663 1 1102 . 1 1 110 110 LYS HG2 H 1 1.006 0.002 . 1 . 1877 . . 110 LYS HG2 . 18663 1 1103 . 1 1 110 110 LYS HG3 H 1 1.006 0.002 . 1 . 972 . . 110 LYS HG3 . 18663 1 1104 . 1 1 110 110 LYS HD2 H 1 1.391 0.003 . 1 . 1875 . . 110 LYS HD2 . 18663 1 1105 . 1 1 110 110 LYS HD3 H 1 1.391 0.003 . 1 . 970 . . 110 LYS HD3 . 18663 1 1106 . 1 1 110 110 LYS HE2 H 1 2.654 0.001 . 1 . 1876 . . 110 LYS HE2 . 18663 1 1107 . 1 1 110 110 LYS HE3 H 1 2.654 0.001 . 1 . 971 . . 110 LYS HE3 . 18663 1 1108 . 1 1 110 110 LYS CA C 13 54.939 . . 1 . 960 . . 110 LYS CA . 18663 1 1109 . 1 1 110 110 LYS CB C 13 34.686 0.013 . 1 . 961 . . 110 LYS CB . 18663 1 1110 . 1 1 110 110 LYS CG C 13 25.319 . . 1 . 964 . . 110 LYS CG . 18663 1 1111 . 1 1 110 110 LYS CD C 13 29.560 . . 1 . 962 . . 110 LYS CD . 18663 1 1112 . 1 1 110 110 LYS CE C 13 41.581 . . 1 . 963 . . 110 LYS CE . 18663 1 1113 . 1 1 110 110 LYS N N 15 123.084 0.021 . 1 . 969 . . 110 LYS N . 18663 1 1114 . 1 1 111 111 MET H H 1 8.780 0.002 . 1 . 977 . . 111 MET H . 18663 1 1115 . 1 1 111 111 MET HA H 1 4.944 0.002 . 1 . 978 . . 111 MET HA . 18663 1 1116 . 1 1 111 111 MET HB2 H 1 1.956 0.006 . 2 . 979 . . 111 MET HB2 . 18663 1 1117 . 1 1 111 111 MET HB3 H 1 1.933 0.001 . 2 . 980 . . 111 MET HB3 . 18663 1 1118 . 1 1 111 111 MET HG2 H 1 2.228 0.006 . 1 . 1878 . . 111 MET HG2 . 18663 1 1119 . 1 1 111 111 MET HG3 H 1 2.228 0.006 . 1 . 983 . . 111 MET HG3 . 18663 1 1120 . 1 1 111 111 MET HE1 H 1 1.527 0.004 . 1 . 982 . . 111 MET HE1 . 18663 1 1121 . 1 1 111 111 MET HE2 H 1 1.527 0.004 . 1 . 982 . . 111 MET HE2 . 18663 1 1122 . 1 1 111 111 MET HE3 H 1 1.527 0.004 . 1 . 982 . . 111 MET HE3 . 18663 1 1123 . 1 1 111 111 MET CA C 13 54.209 . . 1 . 973 . . 111 MET CA . 18663 1 1124 . 1 1 111 111 MET CB C 13 37.337 0.001 . 1 . 974 . . 111 MET CB . 18663 1 1125 . 1 1 111 111 MET CG C 13 31.187 . . 1 . 976 . . 111 MET CG . 18663 1 1126 . 1 1 111 111 MET CE C 13 16.994 . . 1 . 975 . . 111 MET CE . 18663 1 1127 . 1 1 111 111 MET N N 15 117.979 0.047 . 1 . 981 . . 111 MET N . 18663 1 1128 . 1 1 112 112 LYS H H 1 8.747 0.007 . 1 . 989 . . 112 LYS H . 18663 1 1129 . 1 1 112 112 LYS HA H 1 5.279 0.004 . 1 . 990 . . 112 LYS HA . 18663 1 1130 . 1 1 112 112 LYS HB2 H 1 1.641 0.002 . 2 . 991 . . 112 LYS HB2 . 18663 1 1131 . 1 1 112 112 LYS HB3 H 1 1.578 0.001 . 2 . 992 . . 112 LYS HB3 . 18663 1 1132 . 1 1 112 112 LYS HG2 H 1 1.512 0.007 . 2 . 993 . . 112 LYS HG2 . 18663 1 1133 . 1 1 112 112 LYS HG3 H 1 1.462 0.003 . 2 . 994 . . 112 LYS HG3 . 18663 1 1134 . 1 1 112 112 LYS HD2 H 1 1.676 0.003 . 1 . 1879 . . 112 LYS HD2 . 18663 1 1135 . 1 1 112 112 LYS HD3 H 1 1.676 0.003 . 1 . 996 . . 112 LYS HD3 . 18663 1 1136 . 1 1 112 112 LYS HE2 H 1 2.944 0.003 . 1 . 1880 . . 112 LYS HE2 . 18663 1 1137 . 1 1 112 112 LYS HE3 H 1 2.944 0.003 . 1 . 997 . . 112 LYS HE3 . 18663 1 1138 . 1 1 112 112 LYS CA C 13 55.225 0.001 . 1 . 984 . . 112 LYS CA . 18663 1 1139 . 1 1 112 112 LYS CB C 13 33.907 0.004 . 1 . 985 . . 112 LYS CB . 18663 1 1140 . 1 1 112 112 LYS CG C 13 24.765 0.013 . 1 . 988 . . 112 LYS CG . 18663 1 1141 . 1 1 112 112 LYS CD C 13 28.535 . . 1 . 986 . . 112 LYS CD . 18663 1 1142 . 1 1 112 112 LYS CE C 13 39.807 . . 1 . 987 . . 112 LYS CE . 18663 1 1143 . 1 1 112 112 LYS N N 15 121.660 0.044 . 1 . 995 . . 112 LYS N . 18663 1 1144 . 1 1 113 113 VAL H H 1 9.302 0.003 . 1 . 1002 . . 113 VAL H . 18663 1 1145 . 1 1 113 113 VAL HA H 1 4.791 0.002 . 1 . 1003 . . 113 VAL HA . 18663 1 1146 . 1 1 113 113 VAL HB H 1 1.974 0.001 . 1 . 1004 . . 113 VAL HB . 18663 1 1147 . 1 1 113 113 VAL HG11 H 1 0.948 0.01 . 2 . 1006 . . 113 VAL HG11 . 18663 1 1148 . 1 1 113 113 VAL HG12 H 1 0.948 0.01 . 2 . 1006 . . 113 VAL HG12 . 18663 1 1149 . 1 1 113 113 VAL HG13 H 1 0.948 0.01 . 2 . 1006 . . 113 VAL HG13 . 18663 1 1150 . 1 1 113 113 VAL HG21 H 1 0.949 0.004 . 2 . 1007 . . 113 VAL HG21 . 18663 1 1151 . 1 1 113 113 VAL HG22 H 1 0.949 0.004 . 2 . 1007 . . 113 VAL HG22 . 18663 1 1152 . 1 1 113 113 VAL HG23 H 1 0.949 0.004 . 2 . 1007 . . 113 VAL HG23 . 18663 1 1153 . 1 1 113 113 VAL CA C 13 57.903 . . 1 . 998 . . 113 VAL CA . 18663 1 1154 . 1 1 113 113 VAL CB C 13 34.700 . . 1 . 999 . . 113 VAL CB . 18663 1 1155 . 1 1 113 113 VAL CG1 C 13 21.262 . . 2 . 1000 . . 113 VAL CG1 . 18663 1 1156 . 1 1 113 113 VAL CG2 C 13 22.851 . . 2 . 1001 . . 113 VAL CG2 . 18663 1 1157 . 1 1 113 113 VAL N N 15 121.910 0.047 . 1 . 1005 . . 113 VAL N . 18663 1 1158 . 1 1 114 114 PRO HA H 1 4.658 0.002 . 1 . 1011 . . 114 PRO HA . 18663 1 1159 . 1 1 114 114 PRO HB2 H 1 2.447 . . 1 . 1881 . . 114 PRO HB2 . 18663 1 1160 . 1 1 114 114 PRO HB3 H 1 2.447 . . 1 . 1012 . . 114 PRO HB3 . 18663 1 1161 . 1 1 114 114 PRO HG2 H 1 2.139 . . 1 . 1882 . . 114 PRO HG2 . 18663 1 1162 . 1 1 114 114 PRO HG3 H 1 2.139 . . 1 . 1013 . . 114 PRO HG3 . 18663 1 1163 . 1 1 114 114 PRO CA C 13 62.527 . . 1 . 1008 . . 114 PRO CA . 18663 1 1164 . 1 1 114 114 PRO CB C 13 32.136 . . 1 . 1009 . . 114 PRO CB . 18663 1 1165 . 1 1 114 114 PRO CG C 13 26.841 . . 1 . 1010 . . 114 PRO CG . 18663 1 1166 . 1 1 115 115 LYS H H 1 8.613 0.004 . 1 . 1016 . . 115 LYS H . 18663 1 1167 . 1 1 115 115 LYS HA H 1 4.182 0.001 . 1 . 1017 . . 115 LYS HA . 18663 1 1168 . 1 1 115 115 LYS HB2 H 1 1.999 . . 2 . 1018 . . 115 LYS HB2 . 18663 1 1169 . 1 1 115 115 LYS HB3 H 1 1.769 0.003 . 2 . 1019 . . 115 LYS HB3 . 18663 1 1170 . 1 1 115 115 LYS CA C 13 58.115 0.001 . 1 . 1014 . . 115 LYS CA . 18663 1 1171 . 1 1 115 115 LYS CB C 13 31.463 . . 1 . 1015 . . 115 LYS CB . 18663 1 1172 . 1 1 115 115 LYS N N 15 121.095 0.038 . 1 . 1020 . . 115 LYS N . 18663 1 1173 . 1 1 116 116 ASP H H 1 8.514 0.007 . 1 . 1023 . . 116 ASP H . 18663 1 1174 . 1 1 116 116 ASP HA H 1 4.501 0.001 . 1 . 1024 . . 116 ASP HA . 18663 1 1175 . 1 1 116 116 ASP HB2 H 1 2.810 0.011 . 2 . 1025 . . 116 ASP HB2 . 18663 1 1176 . 1 1 116 116 ASP HB3 H 1 2.725 0.005 . 2 . 1026 . . 116 ASP HB3 . 18663 1 1177 . 1 1 116 116 ASP CA C 13 55.321 . . 1 . 1021 . . 116 ASP CA . 18663 1 1178 . 1 1 116 116 ASP CB C 13 39.831 0.016 . 1 . 1022 . . 116 ASP CB . 18663 1 1179 . 1 1 116 116 ASP N N 15 114.575 0.048 . 1 . 1027 . . 116 ASP N . 18663 1 1180 . 1 1 117 117 SER H H 1 8.510 0.01 . 1 . 1030 . . 117 SER H . 18663 1 1181 . 1 1 117 117 SER HA H 1 4.842 0.006 . 1 . 1031 . . 117 SER HA . 18663 1 1182 . 1 1 117 117 SER HB2 H 1 3.878 0.003 . 2 . 1032 . . 117 SER HB2 . 18663 1 1183 . 1 1 117 117 SER HB3 H 1 3.705 0.001 . 2 . 1033 . . 117 SER HB3 . 18663 1 1184 . 1 1 117 117 SER CA C 13 59.426 . . 1 . 1028 . . 117 SER CA . 18663 1 1185 . 1 1 117 117 SER CB C 13 65.013 0.012 . 1 . 1029 . . 117 SER CB . 18663 1 1186 . 1 1 117 117 SER N N 15 114.985 0.022 . 1 . 1034 . . 117 SER N . 18663 1 1187 . 1 1 118 118 THR H H 1 7.837 0.003 . 1 . 1038 . . 118 THR H . 18663 1 1188 . 1 1 118 118 THR HA H 1 3.906 0.015 . 1 . 1039 . . 118 THR HA . 18663 1 1189 . 1 1 118 118 THR HB H 1 3.414 0.003 . 1 . 1040 . . 118 THR HB . 18663 1 1190 . 1 1 118 118 THR HG21 H 1 1.008 0.002 . 1 . 1042 . . 118 THR HG21 . 18663 1 1191 . 1 1 118 118 THR HG22 H 1 1.008 0.002 . 1 . 1042 . . 118 THR HG22 . 18663 1 1192 . 1 1 118 118 THR HG23 H 1 1.008 0.002 . 1 . 1042 . . 118 THR HG23 . 18663 1 1193 . 1 1 118 118 THR CA C 13 65.049 0.049 . 1 . 1035 . . 118 THR CA . 18663 1 1194 . 1 1 118 118 THR CB C 13 68.045 . . 1 . 1036 . . 118 THR CB . 18663 1 1195 . 1 1 118 118 THR CG2 C 13 23.867 . . 1 . 1037 . . 118 THR CG2 . 18663 1 1196 . 1 1 118 118 THR N N 15 120.314 0.042 . 1 . 1041 . . 118 THR N . 18663 1 1197 . 1 1 119 119 SER H H 1 9.258 0.005 . 1 . 1045 . . 119 SER H . 18663 1 1198 . 1 1 119 119 SER HA H 1 4.225 0.005 . 1 . 1046 . . 119 SER HA . 18663 1 1199 . 1 1 119 119 SER HB2 H 1 4.126 0.001 . 2 . 1047 . . 119 SER HB2 . 18663 1 1200 . 1 1 119 119 SER HB3 H 1 4.079 0.005 . 2 . 1048 . . 119 SER HB3 . 18663 1 1201 . 1 1 119 119 SER CA C 13 62.437 . . 1 . 1043 . . 119 SER CA . 18663 1 1202 . 1 1 119 119 SER CB C 13 62.196 0.029 . 1 . 1044 . . 119 SER CB . 18663 1 1203 . 1 1 119 119 SER N N 15 114.885 0.03 . 1 . 1049 . . 119 SER N . 18663 1 1204 . 1 1 120 120 THR H H 1 7.972 0.005 . 1 . 1053 . . 120 THR H . 18663 1 1205 . 1 1 120 120 THR HA H 1 4.165 0.002 . 1 . 1054 . . 120 THR HA . 18663 1 1206 . 1 1 120 120 THR HB H 1 4.321 0.004 . 1 . 1055 . . 120 THR HB . 18663 1 1207 . 1 1 120 120 THR HG21 H 1 1.354 0.002 . 1 . 1057 . . 120 THR HG21 . 18663 1 1208 . 1 1 120 120 THR HG22 H 1 1.354 0.002 . 1 . 1057 . . 120 THR HG22 . 18663 1 1209 . 1 1 120 120 THR HG23 H 1 1.354 0.002 . 1 . 1057 . . 120 THR HG23 . 18663 1 1210 . 1 1 120 120 THR CA C 13 66.471 . . 1 . 1050 . . 120 THR CA . 18663 1 1211 . 1 1 120 120 THR CB C 13 68.854 . . 1 . 1051 . . 120 THR CB . 18663 1 1212 . 1 1 120 120 THR CG2 C 13 21.230 . . 1 . 1052 . . 120 THR CG2 . 18663 1 1213 . 1 1 120 120 THR N N 15 119.317 0.009 . 1 . 1056 . . 120 THR N . 18663 1 1214 . 1 1 121 121 VAL H H 1 8.154 0.004 . 1 . 1062 . . 121 VAL H . 18663 1 1215 . 1 1 121 121 VAL HA H 1 3.666 0.003 . 1 . 1063 . . 121 VAL HA . 18663 1 1216 . 1 1 121 121 VAL HB H 1 2.229 0.001 . 1 . 1064 . . 121 VAL HB . 18663 1 1217 . 1 1 121 121 VAL HG11 H 1 1.121 0.004 . 2 . 1066 . . 121 VAL HG11 . 18663 1 1218 . 1 1 121 121 VAL HG12 H 1 1.121 0.004 . 2 . 1066 . . 121 VAL HG12 . 18663 1 1219 . 1 1 121 121 VAL HG13 H 1 1.121 0.004 . 2 . 1066 . . 121 VAL HG13 . 18663 1 1220 . 1 1 121 121 VAL HG21 H 1 1.169 0.009 . 2 . 1067 . . 121 VAL HG21 . 18663 1 1221 . 1 1 121 121 VAL HG22 H 1 1.169 0.009 . 2 . 1067 . . 121 VAL HG22 . 18663 1 1222 . 1 1 121 121 VAL HG23 H 1 1.169 0.009 . 2 . 1067 . . 121 VAL HG23 . 18663 1 1223 . 1 1 121 121 VAL CA C 13 66.535 . . 1 . 1058 . . 121 VAL CA . 18663 1 1224 . 1 1 121 121 VAL CB C 13 31.364 . . 1 . 1059 . . 121 VAL CB . 18663 1 1225 . 1 1 121 121 VAL CG1 C 13 24.089 . . 2 . 1060 . . 121 VAL CG1 . 18663 1 1226 . 1 1 121 121 VAL CG2 C 13 27.769 . . 2 . 1061 . . 121 VAL CG2 . 18663 1 1227 . 1 1 121 121 VAL N N 15 120.884 0.007 . 1 . 1065 . . 121 VAL N . 18663 1 1228 . 1 1 122 122 TRP H H 1 9.103 0.004 . 1 . 1075 . . 122 TRP H . 18663 1 1229 . 1 1 122 122 TRP HA H 1 4.231 0.001 . 1 . 1076 . . 122 TRP HA . 18663 1 1230 . 1 1 122 122 TRP HB2 H 1 3.297 0.002 . 2 . 1077 . . 122 TRP HB2 . 18663 1 1231 . 1 1 122 122 TRP HB3 H 1 3.274 0.002 . 2 . 1078 . . 122 TRP HB3 . 18663 1 1232 . 1 1 122 122 TRP HD1 H 1 7.363 0.001 . 1 . 1079 . . 122 TRP HD1 . 18663 1 1233 . 1 1 122 122 TRP HE1 H 1 10.348 0.004 . 1 . 1080 . . 122 TRP HE1 . 18663 1 1234 . 1 1 122 122 TRP HE3 H 1 7.571 0.002 . 1 . 1081 . . 122 TRP HE3 . 18663 1 1235 . 1 1 122 122 TRP HZ2 H 1 7.464 0.004 . 1 . 1083 . . 122 TRP HZ2 . 18663 1 1236 . 1 1 122 122 TRP HZ3 H 1 6.675 . . 1 . 1084 . . 122 TRP HZ3 . 18663 1 1237 . 1 1 122 122 TRP HH2 H 1 6.955 0.002 . 1 . 1082 . . 122 TRP HH2 . 18663 1 1238 . 1 1 122 122 TRP CA C 13 59.843 . . 1 . 1068 . . 122 TRP CA . 18663 1 1239 . 1 1 122 122 TRP CB C 13 31.261 . . 1 . 1069 . . 122 TRP CB . 18663 1 1240 . 1 1 122 122 TRP CD1 C 13 128.431 . . 1 . 1070 . . 122 TRP CD1 . 18663 1 1241 . 1 1 122 122 TRP CE3 C 13 120.667 . . 1 . 1071 . . 122 TRP CE3 . 18663 1 1242 . 1 1 122 122 TRP CZ2 C 13 115.012 . . 1 . 1073 . . 122 TRP CZ2 . 18663 1 1243 . 1 1 122 122 TRP CZ3 C 13 121.366 . . 1 . 1074 . . 122 TRP CZ3 . 18663 1 1244 . 1 1 122 122 TRP CH2 C 13 123.272 . . 1 . 1072 . . 122 TRP CH2 . 18663 1 1245 . 1 1 122 122 TRP N N 15 119.092 0.014 . 1 . 1085 . . 122 TRP N . 18663 1 1246 . 1 1 122 122 TRP NE1 N 15 127.510 . . 1 . 1086 . . 122 TRP NE1 . 18663 1 1247 . 1 1 123 123 LYS H H 1 7.750 0.003 . 1 . 1092 . . 123 LYS H . 18663 1 1248 . 1 1 123 123 LYS HA H 1 3.565 0.003 . 1 . 1093 . . 123 LYS HA . 18663 1 1249 . 1 1 123 123 LYS HB2 H 1 2.275 0.004 . 2 . 1094 . . 123 LYS HB2 . 18663 1 1250 . 1 1 123 123 LYS HB3 H 1 2.005 0.001 . 2 . 1095 . . 123 LYS HB3 . 18663 1 1251 . 1 1 123 123 LYS HG2 H 1 1.339 0.005 . 1 . 1883 . . 123 LYS HG2 . 18663 1 1252 . 1 1 123 123 LYS HG3 H 1 1.339 0.005 . 1 . 1101 . . 123 LYS HG3 . 18663 1 1253 . 1 1 123 123 LYS HD2 H 1 1.943 0.001 . 2 . 1096 . . 123 LYS HD2 . 18663 1 1254 . 1 1 123 123 LYS HD3 H 1 1.899 0.001 . 2 . 1097 . . 123 LYS HD3 . 18663 1 1255 . 1 1 123 123 LYS HE2 H 1 3.095 0.003 . 2 . 1098 . . 123 LYS HE2 . 18663 1 1256 . 1 1 123 123 LYS HE3 H 1 3.079 0.002 . 2 . 1099 . . 123 LYS HE3 . 18663 1 1257 . 1 1 123 123 LYS CA C 13 60.721 . . 1 . 1087 . . 123 LYS CA . 18663 1 1258 . 1 1 123 123 LYS CB C 13 32.284 0.008 . 1 . 1088 . . 123 LYS CB . 18663 1 1259 . 1 1 123 123 LYS CG C 13 24.031 . . 1 . 1091 . . 123 LYS CG . 18663 1 1260 . 1 1 123 123 LYS CD C 13 29.604 0.013 . 1 . 1089 . . 123 LYS CD . 18663 1 1261 . 1 1 123 123 LYS CE C 13 42.041 . . 1 . 1090 . . 123 LYS CE . 18663 1 1262 . 1 1 123 123 LYS N N 15 116.257 0.025 . 1 . 1100 . . 123 LYS N . 18663 1 1263 . 1 1 124 124 GLU H H 1 8.118 0.003 . 1 . 1104 . . 124 GLU H . 18663 1 1264 . 1 1 124 124 GLU HA H 1 4.060 0.002 . 1 . 1105 . . 124 GLU HA . 18663 1 1265 . 1 1 124 124 GLU HB2 H 1 2.123 0.005 . 2 . 1106 . . 124 GLU HB2 . 18663 1 1266 . 1 1 124 124 GLU HB3 H 1 2.054 0.002 . 2 . 1107 . . 124 GLU HB3 . 18663 1 1267 . 1 1 124 124 GLU HG2 H 1 2.287 . . 1 . 1884 . . 124 GLU HG2 . 18663 1 1268 . 1 1 124 124 GLU HG3 H 1 2.287 . . 1 . 1109 . . 124 GLU HG3 . 18663 1 1269 . 1 1 124 124 GLU CA C 13 58.402 . . 1 . 1102 . . 124 GLU CA . 18663 1 1270 . 1 1 124 124 GLU CB C 13 29.363 . . 1 . 1103 . . 124 GLU CB . 18663 1 1271 . 1 1 124 124 GLU N N 15 113.906 0.065 . 1 . 1108 . . 124 GLU N . 18663 1 1272 . 1 1 125 125 LEU H H 1 8.840 0.003 . 1 . 1115 . . 125 LEU H . 18663 1 1273 . 1 1 125 125 LEU HA H 1 4.148 0.005 . 1 . 1116 . . 125 LEU HA . 18663 1 1274 . 1 1 125 125 LEU HB2 H 1 2.087 0.004 . 2 . 1117 . . 125 LEU HB2 . 18663 1 1275 . 1 1 125 125 LEU HB3 H 1 2.076 0.002 . 2 . 1118 . . 125 LEU HB3 . 18663 1 1276 . 1 1 125 125 LEU HG H 1 2.082 0.003 . 1 . 1119 . . 125 LEU HG . 18663 1 1277 . 1 1 125 125 LEU HD11 H 1 0.883 0.004 . 2 . 1121 . . 125 LEU HD11 . 18663 1 1278 . 1 1 125 125 LEU HD12 H 1 0.883 0.004 . 2 . 1121 . . 125 LEU HD12 . 18663 1 1279 . 1 1 125 125 LEU HD13 H 1 0.883 0.004 . 2 . 1121 . . 125 LEU HD13 . 18663 1 1280 . 1 1 125 125 LEU HD21 H 1 0.880 0.001 . 2 . 1122 . . 125 LEU HD21 . 18663 1 1281 . 1 1 125 125 LEU HD22 H 1 0.880 0.001 . 2 . 1122 . . 125 LEU HD22 . 18663 1 1282 . 1 1 125 125 LEU HD23 H 1 0.880 0.001 . 2 . 1122 . . 125 LEU HD23 . 18663 1 1283 . 1 1 125 125 LEU CA C 13 57.576 0.001 . 1 . 1110 . . 125 LEU CA . 18663 1 1284 . 1 1 125 125 LEU CB C 13 40.800 . . 1 . 1111 . . 125 LEU CB . 18663 1 1285 . 1 1 125 125 LEU CG C 13 26.790 . . 1 . 1114 . . 125 LEU CG . 18663 1 1286 . 1 1 125 125 LEU CD1 C 13 23.295 . . 2 . 1112 . . 125 LEU CD1 . 18663 1 1287 . 1 1 125 125 LEU CD2 C 13 25.653 0.025 . 2 . 1113 . . 125 LEU CD2 . 18663 1 1288 . 1 1 125 125 LEU N N 15 118.687 0.024 . 1 . 1120 . . 125 LEU N . 18663 1 1289 . 1 1 126 126 LEU H H 1 8.567 0.005 . 1 . 1128 . . 126 LEU H . 18663 1 1290 . 1 1 126 126 LEU HA H 1 3.346 0.003 . 1 . 1129 . . 126 LEU HA . 18663 1 1291 . 1 1 126 126 LEU HB2 H 1 1.745 0.003 . 2 . 1130 . . 126 LEU HB2 . 18663 1 1292 . 1 1 126 126 LEU HB3 H 1 1.715 0.008 . 2 . 1131 . . 126 LEU HB3 . 18663 1 1293 . 1 1 126 126 LEU HG H 1 0.679 0.006 . 1 . 1132 . . 126 LEU HG . 18663 1 1294 . 1 1 126 126 LEU HD11 H 1 -0.014 0.004 . 2 . 1134 . . 126 LEU HD11 . 18663 1 1295 . 1 1 126 126 LEU HD12 H 1 -0.014 0.004 . 2 . 1134 . . 126 LEU HD12 . 18663 1 1296 . 1 1 126 126 LEU HD13 H 1 -0.014 0.004 . 2 . 1134 . . 126 LEU HD13 . 18663 1 1297 . 1 1 126 126 LEU HD21 H 1 0.010 0.004 . 2 . 1135 . . 126 LEU HD21 . 18663 1 1298 . 1 1 126 126 LEU HD22 H 1 0.010 0.004 . 2 . 1135 . . 126 LEU HD22 . 18663 1 1299 . 1 1 126 126 LEU HD23 H 1 0.010 0.004 . 2 . 1135 . . 126 LEU HD23 . 18663 1 1300 . 1 1 126 126 LEU CA C 13 58.307 . . 1 . 1123 . . 126 LEU CA . 18663 1 1301 . 1 1 126 126 LEU CB C 13 42.118 0.016 . 1 . 1124 . . 126 LEU CB . 18663 1 1302 . 1 1 126 126 LEU CG C 13 25.424 . . 1 . 1127 . . 126 LEU CG . 18663 1 1303 . 1 1 126 126 LEU CD1 C 13 24.248 . . 2 . 1125 . . 126 LEU CD1 . 18663 1 1304 . 1 1 126 126 LEU CD2 C 13 24.693 . . 2 . 1126 . . 126 LEU CD2 . 18663 1 1305 . 1 1 126 126 LEU N N 15 124.052 0.046 . 1 . 1133 . . 126 LEU N . 18663 1 1306 . 1 1 127 127 LEU H H 1 7.419 0.003 . 1 . 1141 . . 127 LEU H . 18663 1 1307 . 1 1 127 127 LEU HA H 1 3.346 0.004 . 1 . 1142 . . 127 LEU HA . 18663 1 1308 . 1 1 127 127 LEU HB2 H 1 1.668 0.003 . 2 . 1143 . . 127 LEU HB2 . 18663 1 1309 . 1 1 127 127 LEU HB3 H 1 1.286 0.002 . 2 . 1144 . . 127 LEU HB3 . 18663 1 1310 . 1 1 127 127 LEU HG H 1 1.555 0.003 . 1 . 1145 . . 127 LEU HG . 18663 1 1311 . 1 1 127 127 LEU HD11 H 1 0.539 0.002 . 2 . 1147 . . 127 LEU HD11 . 18663 1 1312 . 1 1 127 127 LEU HD12 H 1 0.539 0.002 . 2 . 1147 . . 127 LEU HD12 . 18663 1 1313 . 1 1 127 127 LEU HD13 H 1 0.539 0.002 . 2 . 1147 . . 127 LEU HD13 . 18663 1 1314 . 1 1 127 127 LEU HD21 H 1 0.883 0.001 . 2 . 1148 . . 127 LEU HD21 . 18663 1 1315 . 1 1 127 127 LEU HD22 H 1 0.883 0.001 . 2 . 1148 . . 127 LEU HD22 . 18663 1 1316 . 1 1 127 127 LEU HD23 H 1 0.883 0.001 . 2 . 1148 . . 127 LEU HD23 . 18663 1 1317 . 1 1 127 127 LEU CA C 13 57.005 0.001 . 1 . 1136 . . 127 LEU CA . 18663 1 1318 . 1 1 127 127 LEU CB C 13 41.165 0.016 . 1 . 1137 . . 127 LEU CB . 18663 1 1319 . 1 1 127 127 LEU CG C 13 26.440 . . 1 . 1140 . . 127 LEU CG . 18663 1 1320 . 1 1 127 127 LEU CD1 C 13 22.564 . . 2 . 1138 . . 127 LEU CD1 . 18663 1 1321 . 1 1 127 127 LEU CD2 C 13 25.170 . . 2 . 1139 . . 127 LEU CD2 . 18663 1 1322 . 1 1 127 127 LEU N N 15 116.699 0.056 . 1 . 1146 . . 127 LEU N . 18663 1 1323 . 1 1 128 128 ALA H H 1 7.854 0.004 . 1 . 1151 . . 128 ALA H . 18663 1 1324 . 1 1 128 128 ALA HA H 1 3.717 0.001 . 1 . 1152 . . 128 ALA HA . 18663 1 1325 . 1 1 128 128 ALA HB1 H 1 0.925 0.003 . 1 . 1154 . . 128 ALA HB1 . 18663 1 1326 . 1 1 128 128 ALA HB2 H 1 0.925 0.003 . 1 . 1154 . . 128 ALA HB2 . 18663 1 1327 . 1 1 128 128 ALA HB3 H 1 0.925 0.003 . 1 . 1154 . . 128 ALA HB3 . 18663 1 1328 . 1 1 128 128 ALA CA C 13 53.986 . . 1 . 1149 . . 128 ALA CA . 18663 1 1329 . 1 1 128 128 ALA CB C 13 18.562 . . 1 . 1150 . . 128 ALA CB . 18663 1 1330 . 1 1 128 128 ALA N N 15 121.480 0.022 . 1 . 1153 . . 128 ALA N . 18663 1 1331 . 1 1 129 129 THR H H 1 7.753 0.003 . 1 . 1158 . . 129 THR H . 18663 1 1332 . 1 1 129 129 THR HA H 1 3.761 0.008 . 1 . 1159 . . 129 THR HA . 18663 1 1333 . 1 1 129 129 THR HB H 1 3.594 0.006 . 1 . 1160 . . 129 THR HB . 18663 1 1334 . 1 1 129 129 THR HG21 H 1 0.368 0.003 . 1 . 1162 . . 129 THR HG21 . 18663 1 1335 . 1 1 129 129 THR HG22 H 1 0.368 0.003 . 1 . 1162 . . 129 THR HG22 . 18663 1 1336 . 1 1 129 129 THR HG23 H 1 0.368 0.003 . 1 . 1162 . . 129 THR HG23 . 18663 1 1337 . 1 1 129 129 THR CA C 13 67.170 . . 1 . 1155 . . 129 THR CA . 18663 1 1338 . 1 1 129 129 THR CB C 13 67.138 . . 1 . 1156 . . 129 THR CB . 18663 1 1339 . 1 1 129 129 THR CG2 C 13 21.707 . . 1 . 1157 . . 129 THR CG2 . 18663 1 1340 . 1 1 129 129 THR N N 15 116.263 0.024 . 1 . 1161 . . 129 THR N . 18663 1 1341 . 1 1 130 130 ILE H H 1 7.641 0.002 . 1 . 1168 . . 130 ILE H . 18663 1 1342 . 1 1 130 130 ILE HA H 1 3.541 0.008 . 1 . 1169 . . 130 ILE HA . 18663 1 1343 . 1 1 130 130 ILE HB H 1 1.444 0.005 . 1 . 1170 . . 130 ILE HB . 18663 1 1344 . 1 1 130 130 ILE HG12 H 1 0.712 0.007 . 1 . 1885 . . 130 ILE HG12 . 18663 1 1345 . 1 1 130 130 ILE HG13 H 1 0.712 0.007 . 1 . 1173 . . 130 ILE HG13 . 18663 1 1346 . 1 1 130 130 ILE HG21 H 1 -0.541 0.006 . 1 . 1174 . . 130 ILE HG21 . 18663 1 1347 . 1 1 130 130 ILE HG22 H 1 -0.541 0.006 . 1 . 1174 . . 130 ILE HG22 . 18663 1 1348 . 1 1 130 130 ILE HG23 H 1 -0.541 0.006 . 1 . 1174 . . 130 ILE HG23 . 18663 1 1349 . 1 1 130 130 ILE HD11 H 1 -0.564 0.004 . 1 . 1172 . . 130 ILE HD11 . 18663 1 1350 . 1 1 130 130 ILE HD12 H 1 -0.564 0.004 . 1 . 1172 . . 130 ILE HD12 . 18663 1 1351 . 1 1 130 130 ILE HD13 H 1 -0.564 0.004 . 1 . 1172 . . 130 ILE HD13 . 18663 1 1352 . 1 1 130 130 ILE CA C 13 63.676 . . 1 . 1163 . . 130 ILE CA . 18663 1 1353 . 1 1 130 130 ILE CB C 13 36.352 . . 1 . 1164 . . 130 ILE CB . 18663 1 1354 . 1 1 130 130 ILE CG1 C 13 23.613 . . 1 . 1166 . . 130 ILE CG1 . 18663 1 1355 . 1 1 130 130 ILE CG2 C 13 15.595 0.001 . 1 . 1167 . . 130 ILE CG2 . 18663 1 1356 . 1 1 130 130 ILE CD1 C 13 11.463 0.018 . 1 . 1165 . . 130 ILE CD1 . 18663 1 1357 . 1 1 130 130 ILE N N 15 114.212 0.06 . 1 . 1171 . . 130 ILE N . 18663 1 1358 . 1 1 131 131 GLY H H 1 7.298 0.001 . 1 . 1176 . . 131 GLY H . 18663 1 1359 . 1 1 131 131 GLY HA2 H 1 4.106 0.003 . 2 . 1177 . . 131 GLY HA2 . 18663 1 1360 . 1 1 131 131 GLY HA3 H 1 3.607 0.003 . 2 . 1178 . . 131 GLY HA3 . 18663 1 1361 . 1 1 131 131 GLY CA C 13 44.564 0.016 . 1 . 1175 . . 131 GLY CA . 18663 1 1362 . 1 1 131 131 GLY N N 15 108.622 0.039 . 1 . 1179 . . 131 GLY N . 18663 1 1363 . 1 1 132 132 GLU H H 1 7.943 0.003 . 1 . 1183 . . 132 GLU H . 18663 1 1364 . 1 1 132 132 GLU HA H 1 4.418 0.002 . 1 . 1184 . . 132 GLU HA . 18663 1 1365 . 1 1 132 132 GLU HB2 H 1 3.160 0.001 . 2 . 1185 . . 132 GLU HB2 . 18663 1 1366 . 1 1 132 132 GLU HB3 H 1 2.997 0.001 . 2 . 1186 . . 132 GLU HB3 . 18663 1 1367 . 1 1 132 132 GLU HG2 H 1 3.148 0.003 . 2 . 1187 . . 132 GLU HG2 . 18663 1 1368 . 1 1 132 132 GLU HG3 H 1 2.995 0.003 . 2 . 1188 . . 132 GLU HG3 . 18663 1 1369 . 1 1 132 132 GLU CA C 13 56.541 . . 1 . 1180 . . 132 GLU CA . 18663 1 1370 . 1 1 132 132 GLU CB C 13 22.440 0.013 . 1 . 1181 . . 132 GLU CB . 18663 1 1371 . 1 1 132 132 GLU CG C 13 31.014 0.002 . 1 . 1182 . . 132 GLU CG . 18663 1 1372 . 1 1 132 132 GLU N N 15 113.149 0.096 . 1 . 1189 . . 132 GLU N . 18663 1 1373 . 1 1 133 133 GLN H H 1 8.480 0.005 . 1 . 1193 . . 133 GLN H . 18663 1 1374 . 1 1 133 133 GLN HA H 1 4.016 0.004 . 1 . 1194 . . 133 GLN HA . 18663 1 1375 . 1 1 133 133 GLN HB2 H 1 1.798 0.004 . 2 . 1195 . . 133 GLN HB2 . 18663 1 1376 . 1 1 133 133 GLN HB3 H 1 1.347 0.003 . 2 . 1196 . . 133 GLN HB3 . 18663 1 1377 . 1 1 133 133 GLN HG2 H 1 2.216 0.003 . 2 . 1199 . . 133 GLN HG2 . 18663 1 1378 . 1 1 133 133 GLN HG3 H 1 2.137 0.001 . 2 . 1200 . . 133 GLN HG3 . 18663 1 1379 . 1 1 133 133 GLN HE21 H 1 6.762 0.001 . 1 . 1197 . . 133 GLN HE21 . 18663 1 1380 . 1 1 133 133 GLN HE22 H 1 7.246 . . 1 . 1198 . . 133 GLN HE22 . 18663 1 1381 . 1 1 133 133 GLN CA C 13 57.576 . . 1 . 1190 . . 133 GLN CA . 18663 1 1382 . 1 1 133 133 GLN CB C 13 27.267 0.031 . 1 . 1191 . . 133 GLN CB . 18663 1 1383 . 1 1 133 133 GLN CG C 13 34.224 . . 1 . 1192 . . 133 GLN CG . 18663 1 1384 . 1 1 133 133 GLN N N 15 115.596 0.055 . 1 . 1201 . . 133 GLN N . 18663 1 1385 . 1 1 133 133 GLN NE2 N 15 112.222 . . 1 . 1202 . . 133 GLN NE2 . 18663 1 1386 . 1 1 134 134 PHE H H 1 7.900 0.007 . 1 . 1208 . . 134 PHE H . 18663 1 1387 . 1 1 134 134 PHE HA H 1 4.814 0.001 . 1 . 1209 . . 134 PHE HA . 18663 1 1388 . 1 1 134 134 PHE HB2 H 1 3.186 0.003 . 2 . 1210 . . 134 PHE HB2 . 18663 1 1389 . 1 1 134 134 PHE HB3 H 1 2.985 0.004 . 2 . 1211 . . 134 PHE HB3 . 18663 1 1390 . 1 1 134 134 PHE HD1 H 1 7.113 0.002 . 3 . 1214 . . 134 PHE HD1 . 18663 1 1391 . 1 1 134 134 PHE HD2 H 1 7.113 0.002 . 3 . 1214 . . 134 PHE HD2 . 18663 1 1392 . 1 1 134 134 PHE HE1 H 1 7.077 0.004 . 3 . 1215 . . 134 PHE HE1 . 18663 1 1393 . 1 1 134 134 PHE HE2 H 1 7.077 0.004 . 3 . 1215 . . 134 PHE HE2 . 18663 1 1394 . 1 1 134 134 PHE HZ H 1 6.730 0.003 . 1 . 1212 . . 134 PHE HZ . 18663 1 1395 . 1 1 134 134 PHE CA C 13 58.051 . . 1 . 1203 . . 134 PHE CA . 18663 1 1396 . 1 1 134 134 PHE CB C 13 38.418 0.013 . 1 . 1204 . . 134 PHE CB . 18663 1 1397 . 1 1 134 134 PHE CD1 C 13 130.578 . . 3 . 1205 . . 134 PHE CD1 . 18663 1 1398 . 1 1 134 134 PHE CE1 C 13 130.420 . . 3 . 1206 . . 134 PHE CE1 . 18663 1 1399 . 1 1 134 134 PHE CZ C 13 127.942 . . 1 . 1207 . . 134 PHE CZ . 18663 1 1400 . 1 1 134 134 PHE N N 15 113.186 0.056 . 1 . 1213 . . 134 PHE N . 18663 1 1401 . 1 1 135 135 THR H H 1 7.382 0.001 . 1 . 1219 . . 135 THR H . 18663 1 1402 . 1 1 135 135 THR HA H 1 3.913 0.002 . 1 . 1220 . . 135 THR HA . 18663 1 1403 . 1 1 135 135 THR HB H 1 4.316 0.002 . 1 . 1221 . . 135 THR HB . 18663 1 1404 . 1 1 135 135 THR HG21 H 1 1.343 0.004 . 1 . 1223 . . 135 THR HG21 . 18663 1 1405 . 1 1 135 135 THR HG22 H 1 1.343 0.004 . 1 . 1223 . . 135 THR HG22 . 18663 1 1406 . 1 1 135 135 THR HG23 H 1 1.343 0.004 . 1 . 1223 . . 135 THR HG23 . 18663 1 1407 . 1 1 135 135 THR CA C 13 66.440 . . 1 . 1216 . . 135 THR CA . 18663 1 1408 . 1 1 135 135 THR CB C 13 68.663 . . 1 . 1217 . . 135 THR CB . 18663 1 1409 . 1 1 135 135 THR CG2 C 13 21.592 0.012 . 1 . 1218 . . 135 THR CG2 . 18663 1 1410 . 1 1 135 135 THR N N 15 118.726 0.036 . 1 . 1222 . . 135 THR N . 18663 1 1411 . 1 1 136 136 ASP H H 1 8.165 0.005 . 1 . 1226 . . 136 ASP H . 18663 1 1412 . 1 1 136 136 ASP HA H 1 4.806 0.002 . 1 . 1227 . . 136 ASP HA . 18663 1 1413 . 1 1 136 136 ASP HB2 H 1 2.819 0.003 . 2 . 1228 . . 136 ASP HB2 . 18663 1 1414 . 1 1 136 136 ASP HB3 H 1 2.692 0.001 . 2 . 1229 . . 136 ASP HB3 . 18663 1 1415 . 1 1 136 136 ASP CA C 13 54.687 . . 1 . 1224 . . 136 ASP CA . 18663 1 1416 . 1 1 136 136 ASP CB C 13 39.894 0.003 . 1 . 1225 . . 136 ASP CB . 18663 1 1417 . 1 1 136 136 ASP N N 15 117.989 0.145 . 1 . 1230 . . 136 ASP N . 18663 1 1418 . 1 1 137 137 CYS H H 1 7.563 0.003 . 1 . 1233 . . 137 CYS H . 18663 1 1419 . 1 1 137 137 CYS HA H 1 4.534 0.002 . 1 . 1234 . . 137 CYS HA . 18663 1 1420 . 1 1 137 137 CYS HB2 H 1 2.878 0.004 . 2 . 1235 . . 137 CYS HB2 . 18663 1 1421 . 1 1 137 137 CYS HB3 H 1 2.865 0.003 . 2 . 1236 . . 137 CYS HB3 . 18663 1 1422 . 1 1 137 137 CYS CA C 13 57.926 . . 1 . 1231 . . 137 CYS CA . 18663 1 1423 . 1 1 137 137 CYS CB C 13 28.696 . . 1 . 1232 . . 137 CYS CB . 18663 1 1424 . 1 1 137 137 CYS N N 15 115.095 0.067 . 1 . 1237 . . 137 CYS N . 18663 1 1425 . 1 1 138 138 ALA H H 1 7.222 0.002 . 1 . 1240 . . 138 ALA H . 18663 1 1426 . 1 1 138 138 ALA HA H 1 4.708 0.006 . 1 . 1241 . . 138 ALA HA . 18663 1 1427 . 1 1 138 138 ALA HB1 H 1 1.378 0.001 . 1 . 1243 . . 138 ALA HB1 . 18663 1 1428 . 1 1 138 138 ALA HB2 H 1 1.378 0.001 . 1 . 1243 . . 138 ALA HB2 . 18663 1 1429 . 1 1 138 138 ALA HB3 H 1 1.378 0.001 . 1 . 1243 . . 138 ALA HB3 . 18663 1 1430 . 1 1 138 138 ALA CA C 13 49.981 . . 1 . 1238 . . 138 ALA CA . 18663 1 1431 . 1 1 138 138 ALA CB C 13 20.150 . . 1 . 1239 . . 138 ALA CB . 18663 1 1432 . 1 1 138 138 ALA N N 15 121.666 0.037 . 1 . 1242 . . 138 ALA N . 18663 1 1433 . 1 1 139 139 ALA H H 1 9.502 0.005 . 1 . 1246 . . 139 ALA H . 18663 1 1434 . 1 1 139 139 ALA HA H 1 4.227 0.003 . 1 . 1247 . . 139 ALA HA . 18663 1 1435 . 1 1 139 139 ALA HB1 H 1 1.538 0.004 . 1 . 1249 . . 139 ALA HB1 . 18663 1 1436 . 1 1 139 139 ALA HB2 H 1 1.538 0.004 . 1 . 1249 . . 139 ALA HB2 . 18663 1 1437 . 1 1 139 139 ALA HB3 H 1 1.538 0.004 . 1 . 1249 . . 139 ALA HB3 . 18663 1 1438 . 1 1 139 139 ALA CA C 13 51.985 . . 1 . 1244 . . 139 ALA CA . 18663 1 1439 . 1 1 139 139 ALA CB C 13 20.436 . . 1 . 1245 . . 139 ALA CB . 18663 1 1440 . 1 1 139 139 ALA N N 15 123.585 0.047 . 1 . 1248 . . 139 ALA N . 18663 1 1441 . 1 1 140 140 ALA H H 1 8.723 0.005 . 1 . 1252 . . 140 ALA H . 18663 1 1442 . 1 1 140 140 ALA HA H 1 4.143 0.003 . 1 . 1253 . . 140 ALA HA . 18663 1 1443 . 1 1 140 140 ALA HB1 H 1 1.442 0.003 . 1 . 1255 . . 140 ALA HB1 . 18663 1 1444 . 1 1 140 140 ALA HB2 H 1 1.442 0.003 . 1 . 1255 . . 140 ALA HB2 . 18663 1 1445 . 1 1 140 140 ALA HB3 H 1 1.442 0.003 . 1 . 1255 . . 140 ALA HB3 . 18663 1 1446 . 1 1 140 140 ALA CA C 13 54.971 . . 1 . 1250 . . 140 ALA CA . 18663 1 1447 . 1 1 140 140 ALA CB C 13 17.577 . . 1 . 1251 . . 140 ALA CB . 18663 1 1448 . 1 1 140 140 ALA N N 15 124.233 0.025 . 1 . 1254 . . 140 ALA N . 18663 1 1449 . 1 1 141 141 ASP H H 1 8.095 0.009 . 1 . 1258 . . 141 ASP H . 18663 1 1450 . 1 1 141 141 ASP HA H 1 4.748 0.002 . 1 . 1259 . . 141 ASP HA . 18663 1 1451 . 1 1 141 141 ASP HB2 H 1 2.829 0.001 . 2 . 1260 . . 141 ASP HB2 . 18663 1 1452 . 1 1 141 141 ASP HB3 H 1 2.491 0.003 . 2 . 1261 . . 141 ASP HB3 . 18663 1 1453 . 1 1 141 141 ASP CA C 13 54.526 . . 1 . 1256 . . 141 ASP CA . 18663 1 1454 . 1 1 141 141 ASP CB C 13 39.831 0.016 . 1 . 1257 . . 141 ASP CB . 18663 1 1455 . 1 1 141 141 ASP N N 15 112.272 0.061 . 1 . 1262 . . 141 ASP N . 18663 1 1456 . 1 1 142 142 ASP H H 1 8.018 0.005 . 1 . 1265 . . 142 ASP H . 18663 1 1457 . 1 1 142 142 ASP HA H 1 4.991 0.001 . 1 . 1266 . . 142 ASP HA . 18663 1 1458 . 1 1 142 142 ASP HB2 H 1 2.946 0.007 . 2 . 1267 . . 142 ASP HB2 . 18663 1 1459 . 1 1 142 142 ASP HB3 H 1 2.448 0.007 . 2 . 1268 . . 142 ASP HB3 . 18663 1 1460 . 1 1 142 142 ASP CA C 13 51.445 . . 1 . 1263 . . 142 ASP CA . 18663 1 1461 . 1 1 142 142 ASP CB C 13 44.437 0.016 . 1 . 1264 . . 142 ASP CB . 18663 1 1462 . 1 1 142 142 ASP N N 15 121.921 0.083 . 1 . 1269 . . 142 ASP N . 18663 1 1463 . 1 1 143 143 GLU H H 1 9.268 0.004 . 1 . 1273 . . 143 GLU H . 18663 1 1464 . 1 1 143 143 GLU HA H 1 4.363 0.003 . 1 . 1274 . . 143 GLU HA . 18663 1 1465 . 1 1 143 143 GLU HB2 H 1 1.991 0.004 . 2 . 1275 . . 143 GLU HB2 . 18663 1 1466 . 1 1 143 143 GLU HB3 H 1 1.861 0.002 . 2 . 1276 . . 143 GLU HB3 . 18663 1 1467 . 1 1 143 143 GLU HG2 H 1 2.214 0.002 . 2 . 1277 . . 143 GLU HG2 . 18663 1 1468 . 1 1 143 143 GLU HG3 H 1 2.076 0.003 . 2 . 1278 . . 143 GLU HG3 . 18663 1 1469 . 1 1 143 143 GLU CA C 13 56.401 . . 1 . 1270 . . 143 GLU CA . 18663 1 1470 . 1 1 143 143 GLU CB C 13 33.382 0.016 . 1 . 1271 . . 143 GLU CB . 18663 1 1471 . 1 1 143 143 GLU CG C 13 35.779 0.001 . 1 . 1272 . . 143 GLU CG . 18663 1 1472 . 1 1 143 143 GLU N N 15 119.973 0.085 . 1 . 1279 . . 143 GLU N . 18663 1 1473 . 1 1 144 144 ILE H H 1 9.107 0.006 . 1 . 1285 . . 144 ILE H . 18663 1 1474 . 1 1 144 144 ILE HA H 1 5.185 0.005 . 1 . 1286 . . 144 ILE HA . 18663 1 1475 . 1 1 144 144 ILE HB H 1 2.215 0.007 . 1 . 1287 . . 144 ILE HB . 18663 1 1476 . 1 1 144 144 ILE HG12 H 1 1.607 0.003 . 2 . 1288 . . 144 ILE HG12 . 18663 1 1477 . 1 1 144 144 ILE HG13 H 1 1.257 0.003 . 2 . 1289 . . 144 ILE HG13 . 18663 1 1478 . 1 1 144 144 ILE HG21 H 1 1.181 0.004 . 1 . 1292 . . 144 ILE HG21 . 18663 1 1479 . 1 1 144 144 ILE HG22 H 1 1.181 0.004 . 1 . 1292 . . 144 ILE HG22 . 18663 1 1480 . 1 1 144 144 ILE HG23 H 1 1.181 0.004 . 1 . 1292 . . 144 ILE HG23 . 18663 1 1481 . 1 1 144 144 ILE HD11 H 1 0.805 0.003 . 1 . 1291 . . 144 ILE HD11 . 18663 1 1482 . 1 1 144 144 ILE HD12 H 1 0.805 0.003 . 1 . 1291 . . 144 ILE HD12 . 18663 1 1483 . 1 1 144 144 ILE HD13 H 1 0.805 0.003 . 1 . 1291 . . 144 ILE HD13 . 18663 1 1484 . 1 1 144 144 ILE CA C 13 58.529 0.001 . 1 . 1280 . . 144 ILE CA . 18663 1 1485 . 1 1 144 144 ILE CB C 13 34.923 . . 1 . 1281 . . 144 ILE CB . 18663 1 1486 . 1 1 144 144 ILE CG1 C 13 27.651 . . 1 . 1283 . . 144 ILE CG1 . 18663 1 1487 . 1 1 144 144 ILE CG2 C 13 17.958 . . 1 . 1284 . . 144 ILE CG2 . 18663 1 1488 . 1 1 144 144 ILE CD1 C 13 10.299 . . 1 . 1282 . . 144 ILE CD1 . 18663 1 1489 . 1 1 144 144 ILE N N 15 125.413 0.01 . 1 . 1290 . . 144 ILE N . 18663 1 1490 . 1 1 145 145 ILE H H 1 8.683 0.008 . 1 . 1298 . . 145 ILE H . 18663 1 1491 . 1 1 145 145 ILE HA H 1 4.632 0.006 . 1 . 1299 . . 145 ILE HA . 18663 1 1492 . 1 1 145 145 ILE HB H 1 2.127 0.01 . 1 . 1300 . . 145 ILE HB . 18663 1 1493 . 1 1 145 145 ILE HG12 H 1 1.202 0.004 . 2 . 1301 . . 145 ILE HG12 . 18663 1 1494 . 1 1 145 145 ILE HG13 H 1 1.166 0.003 . 2 . 1302 . . 145 ILE HG13 . 18663 1 1495 . 1 1 145 145 ILE HG21 H 1 0.762 0.006 . 1 . 1305 . . 145 ILE HG21 . 18663 1 1496 . 1 1 145 145 ILE HG22 H 1 0.762 0.006 . 1 . 1305 . . 145 ILE HG22 . 18663 1 1497 . 1 1 145 145 ILE HG23 H 1 0.762 0.006 . 1 . 1305 . . 145 ILE HG23 . 18663 1 1498 . 1 1 145 145 ILE HD11 H 1 0.907 0.003 . 1 . 1304 . . 145 ILE HD11 . 18663 1 1499 . 1 1 145 145 ILE HD12 H 1 0.907 0.003 . 1 . 1304 . . 145 ILE HD12 . 18663 1 1500 . 1 1 145 145 ILE HD13 H 1 0.907 0.003 . 1 . 1304 . . 145 ILE HD13 . 18663 1 1501 . 1 1 145 145 ILE CA C 13 61.166 . . 1 . 1293 . . 145 ILE CA . 18663 1 1502 . 1 1 145 145 ILE CB C 13 39.751 . . 1 . 1294 . . 145 ILE CB . 18663 1 1503 . 1 1 145 145 ILE CG1 C 13 24.980 0.005 . 1 . 1296 . . 145 ILE CG1 . 18663 1 1504 . 1 1 145 145 ILE CG2 C 13 18.657 . . 1 . 1297 . . 145 ILE CG2 . 18663 1 1505 . 1 1 145 145 ILE CD1 C 13 14.677 . . 1 . 1295 . . 145 ILE CD1 . 18663 1 1506 . 1 1 145 145 ILE N N 15 117.678 0.005 . 1 . 1303 . . 145 ILE N . 18663 1 1507 . 1 1 146 146 GLY H H 1 7.615 0.005 . 1 . 1307 . . 146 GLY H . 18663 1 1508 . 1 1 146 146 GLY HA2 H 1 5.182 0.006 . 2 . 1308 . . 146 GLY HA2 . 18663 1 1509 . 1 1 146 146 GLY HA3 H 1 4.672 0.004 . 2 . 1309 . . 146 GLY HA3 . 18663 1 1510 . 1 1 146 146 GLY CA C 13 47.471 . . 1 . 1306 . . 146 GLY CA . 18663 1 1511 . 1 1 146 146 GLY N N 15 108.496 0.042 . 1 . 1310 . . 146 GLY N . 18663 1 1512 . 1 1 147 147 VAL H H 1 9.178 0.005 . 1 . 1315 . . 147 VAL H . 18663 1 1513 . 1 1 147 147 VAL HA H 1 5.979 0.004 . 1 . 1316 . . 147 VAL HA . 18663 1 1514 . 1 1 147 147 VAL HB H 1 2.394 0.005 . 1 . 1317 . . 147 VAL HB . 18663 1 1515 . 1 1 147 147 VAL HG11 H 1 1.110 0.001 . 2 . 1319 . . 147 VAL HG11 . 18663 1 1516 . 1 1 147 147 VAL HG12 H 1 1.110 0.001 . 2 . 1319 . . 147 VAL HG12 . 18663 1 1517 . 1 1 147 147 VAL HG13 H 1 1.110 0.001 . 2 . 1319 . . 147 VAL HG13 . 18663 1 1518 . 1 1 147 147 VAL HG21 H 1 1.197 0.001 . 2 . 1320 . . 147 VAL HG21 . 18663 1 1519 . 1 1 147 147 VAL HG22 H 1 1.197 0.001 . 2 . 1320 . . 147 VAL HG22 . 18663 1 1520 . 1 1 147 147 VAL HG23 H 1 1.197 0.001 . 2 . 1320 . . 147 VAL HG23 . 18663 1 1521 . 1 1 147 147 VAL CA C 13 60.181 . . 1 . 1311 . . 147 VAL CA . 18663 1 1522 . 1 1 147 147 VAL CB C 13 36.003 . . 1 . 1312 . . 147 VAL CB . 18663 1 1523 . 1 1 147 147 VAL CG1 C 13 21.262 . . 2 . 1313 . . 147 VAL CG1 . 18663 1 1524 . 1 1 147 147 VAL CG2 C 13 22.533 . . 2 . 1314 . . 147 VAL CG2 . 18663 1 1525 . 1 1 147 147 VAL N N 15 117.947 0.09 . 1 . 1318 . . 147 VAL N . 18663 1 1526 . 1 1 148 148 SER H H 1 9.595 0.008 . 1 . 1323 . . 148 SER H . 18663 1 1527 . 1 1 148 148 SER HA H 1 6.039 0.003 . 1 . 1324 . . 148 SER HA . 18663 1 1528 . 1 1 148 148 SER HB2 H 1 4.225 0.003 . 2 . 1325 . . 148 SER HB2 . 18663 1 1529 . 1 1 148 148 SER HB3 H 1 4.154 0.002 . 2 . 1326 . . 148 SER HB3 . 18663 1 1530 . 1 1 148 148 SER CA C 13 58.116 . . 1 . 1321 . . 148 SER CA . 18663 1 1531 . 1 1 148 148 SER CB C 13 65.438 0.004 . 1 . 1322 . . 148 SER CB . 18663 1 1532 . 1 1 148 148 SER N N 15 118.805 0.05 . 1 . 1327 . . 148 SER N . 18663 1 1533 . 1 1 149 149 VAL H H 1 8.656 0.005 . 1 . 1332 . . 149 VAL H . 18663 1 1534 . 1 1 149 149 VAL HA H 1 5.158 0.004 . 1 . 1333 . . 149 VAL HA . 18663 1 1535 . 1 1 149 149 VAL HB H 1 1.549 0.005 . 1 . 1334 . . 149 VAL HB . 18663 1 1536 . 1 1 149 149 VAL HG11 H 1 -0.429 0.004 . 2 . 1336 . . 149 VAL HG11 . 18663 1 1537 . 1 1 149 149 VAL HG12 H 1 -0.429 0.004 . 2 . 1336 . . 149 VAL HG12 . 18663 1 1538 . 1 1 149 149 VAL HG13 H 1 -0.429 0.004 . 2 . 1336 . . 149 VAL HG13 . 18663 1 1539 . 1 1 149 149 VAL HG21 H 1 0.538 0.004 . 2 . 1337 . . 149 VAL HG21 . 18663 1 1540 . 1 1 149 149 VAL HG22 H 1 0.538 0.004 . 2 . 1337 . . 149 VAL HG22 . 18663 1 1541 . 1 1 149 149 VAL HG23 H 1 0.538 0.004 . 2 . 1337 . . 149 VAL HG23 . 18663 1 1542 . 1 1 149 149 VAL CA C 13 59.006 . . 1 . 1328 . . 149 VAL CA . 18663 1 1543 . 1 1 149 149 VAL CB C 13 33.809 . . 1 . 1329 . . 149 VAL CB . 18663 1 1544 . 1 1 149 149 VAL CG1 C 13 17.704 . . 2 . 1330 . . 149 VAL CG1 . 18663 1 1545 . 1 1 149 149 VAL CG2 C 13 21.421 . . 2 . 1331 . . 149 VAL CG2 . 18663 1 1546 . 1 1 149 149 VAL N N 15 120.334 0.054 . 1 . 1335 . . 149 VAL N . 18663 1 1547 . 1 1 150 150 SER H H 1 9.021 0.005 . 1 . 1340 . . 150 SER H . 18663 1 1548 . 1 1 150 150 SER HA H 1 5.058 0.003 . 1 . 1341 . . 150 SER HA . 18663 1 1549 . 1 1 150 150 SER HB2 H 1 3.575 0.003 . 2 . 1342 . . 150 SER HB2 . 18663 1 1550 . 1 1 150 150 SER HB3 H 1 3.479 0.001 . 2 . 1343 . . 150 SER HB3 . 18663 1 1551 . 1 1 150 150 SER CA C 13 55.924 . . 1 . 1338 . . 150 SER CA . 18663 1 1552 . 1 1 150 150 SER CB C 13 64.915 0.031 . 1 . 1339 . . 150 SER CB . 18663 1 1553 . 1 1 150 150 SER N N 15 120.649 0.032 . 1 . 1344 . . 150 SER N . 18663 1 1554 . 1 1 151 151 VAL H H 1 7.781 0.005 . 1 . 1349 . . 151 VAL H . 18663 1 1555 . 1 1 151 151 VAL HA H 1 4.561 0.004 . 1 . 1350 . . 151 VAL HA . 18663 1 1556 . 1 1 151 151 VAL HB H 1 1.982 0.001 . 1 . 1351 . . 151 VAL HB . 18663 1 1557 . 1 1 151 151 VAL HG11 H 1 0.839 0.002 . 2 . 1353 . . 151 VAL HG11 . 18663 1 1558 . 1 1 151 151 VAL HG12 H 1 0.839 0.002 . 2 . 1353 . . 151 VAL HG12 . 18663 1 1559 . 1 1 151 151 VAL HG13 H 1 0.839 0.002 . 2 . 1353 . . 151 VAL HG13 . 18663 1 1560 . 1 1 151 151 VAL HG21 H 1 0.840 0.003 . 2 . 1354 . . 151 VAL HG21 . 18663 1 1561 . 1 1 151 151 VAL HG22 H 1 0.840 0.003 . 2 . 1354 . . 151 VAL HG22 . 18663 1 1562 . 1 1 151 151 VAL HG23 H 1 0.840 0.003 . 2 . 1354 . . 151 VAL HG23 . 18663 1 1563 . 1 1 151 151 VAL CA C 13 61.754 0.016 . 1 . 1345 . . 151 VAL CA . 18663 1 1564 . 1 1 151 151 VAL CB C 13 31.682 . . 1 . 1346 . . 151 VAL CB . 18663 1 1565 . 1 1 151 151 VAL CG1 C 13 21.643 . . 2 . 1347 . . 151 VAL CG1 . 18663 1 1566 . 1 1 151 151 VAL CG2 C 13 21.242 . . 2 . 1348 . . 151 VAL CG2 . 18663 1 1567 . 1 1 151 151 VAL N N 15 125.713 0.072 . 1 . 1352 . . 151 VAL N . 18663 1 1568 . 1 1 152 152 ARG H H 1 8.527 0.006 . 1 . 1359 . . 152 ARG H . 18663 1 1569 . 1 1 152 152 ARG HA H 1 4.896 0.003 . 1 . 1360 . . 152 ARG HA . 18663 1 1570 . 1 1 152 152 ARG HB2 H 1 2.427 0.004 . 2 . 1361 . . 152 ARG HB2 . 18663 1 1571 . 1 1 152 152 ARG HB3 H 1 2.087 0.003 . 2 . 1362 . . 152 ARG HB3 . 18663 1 1572 . 1 1 152 152 ARG HG2 H 1 1.655 0.001 . 2 . 1365 . . 152 ARG HG2 . 18663 1 1573 . 1 1 152 152 ARG HG3 H 1 1.493 0.003 . 2 . 1366 . . 152 ARG HG3 . 18663 1 1574 . 1 1 152 152 ARG HD2 H 1 3.231 0.003 . 2 . 1363 . . 152 ARG HD2 . 18663 1 1575 . 1 1 152 152 ARG HD3 H 1 3.143 0.002 . 2 . 1364 . . 152 ARG HD3 . 18663 1 1576 . 1 1 152 152 ARG CA C 13 53.192 . . 1 . 1355 . . 152 ARG CA . 18663 1 1577 . 1 1 152 152 ARG CB C 13 31.347 0.012 . 1 . 1356 . . 152 ARG CB . 18663 1 1578 . 1 1 152 152 ARG CG C 13 27.001 0.012 . 1 . 1358 . . 152 ARG CG . 18663 1 1579 . 1 1 152 152 ARG CD C 13 43.230 0.016 . 1 . 1357 . . 152 ARG CD . 18663 1 1580 . 1 1 152 152 ARG N N 15 127.220 0.069 . 1 . 1367 . . 152 ARG N . 18663 1 1581 . 1 1 153 153 ASP H H 1 8.373 0.003 . 1 . 1370 . . 153 ASP H . 18663 1 1582 . 1 1 153 153 ASP HA H 1 4.340 0.001 . 1 . 1371 . . 153 ASP HA . 18663 1 1583 . 1 1 153 153 ASP HB2 H 1 2.635 . . 2 . 1372 . . 153 ASP HB2 . 18663 1 1584 . 1 1 153 153 ASP HB3 H 1 2.631 0.003 . 2 . 1373 . . 153 ASP HB3 . 18663 1 1585 . 1 1 153 153 ASP CA C 13 57.100 . . 1 . 1368 . . 153 ASP CA . 18663 1 1586 . 1 1 153 153 ASP CB C 13 41.149 . . 1 . 1369 . . 153 ASP CB . 18663 1 1587 . 1 1 153 153 ASP N N 15 118.756 0.019 . 1 . 1374 . . 153 ASP N . 18663 1 1588 . 1 1 154 154 ARG H H 1 8.718 0.005 . 1 . 1379 . . 154 ARG H . 18663 1 1589 . 1 1 154 154 ARG HA H 1 4.188 0.003 . 1 . 1380 . . 154 ARG HA . 18663 1 1590 . 1 1 154 154 ARG HB2 H 1 1.949 0.001 . 1 . 1886 . . 154 ARG HB2 . 18663 1 1591 . 1 1 154 154 ARG HB3 H 1 1.949 0.001 . 1 . 1386 . . 154 ARG HB3 . 18663 1 1592 . 1 1 154 154 ARG HG2 H 1 1.621 0.001 . 2 . 1383 . . 154 ARG HG2 . 18663 1 1593 . 1 1 154 154 ARG HG3 H 1 1.562 0.004 . 2 . 1384 . . 154 ARG HG3 . 18663 1 1594 . 1 1 154 154 ARG HD2 H 1 3.213 0.003 . 2 . 1381 . . 154 ARG HD2 . 18663 1 1595 . 1 1 154 154 ARG HD3 H 1 3.197 0.005 . 2 . 1382 . . 154 ARG HD3 . 18663 1 1596 . 1 1 154 154 ARG CA C 13 58.021 . . 1 . 1375 . . 154 ARG CA . 18663 1 1597 . 1 1 154 154 ARG CB C 13 30.353 . . 1 . 1376 . . 154 ARG CB . 18663 1 1598 . 1 1 154 154 ARG CG C 13 27.517 0.009 . 1 . 1378 . . 154 ARG CG . 18663 1 1599 . 1 1 154 154 ARG CD C 13 42.778 . . 1 . 1377 . . 154 ARG CD . 18663 1 1600 . 1 1 154 154 ARG N N 15 116.569 0.026 . 1 . 1385 . . 154 ARG N . 18663 1 1601 . 1 1 155 155 GLU H H 1 7.978 0.003 . 1 . 1390 . . 155 GLU H . 18663 1 1602 . 1 1 155 155 GLU HA H 1 4.456 0.002 . 1 . 1391 . . 155 GLU HA . 18663 1 1603 . 1 1 155 155 GLU HB2 H 1 2.055 0.005 . 2 . 1392 . . 155 GLU HB2 . 18663 1 1604 . 1 1 155 155 GLU HB3 H 1 1.896 0.002 . 2 . 1393 . . 155 GLU HB3 . 18663 1 1605 . 1 1 155 155 GLU HG2 H 1 2.012 . . 1 . 1887 . . 155 GLU HG2 . 18663 1 1606 . 1 1 155 155 GLU HG3 H 1 2.012 . . 1 . 1395 . . 155 GLU HG3 . 18663 1 1607 . 1 1 155 155 GLU CA C 13 55.321 . . 1 . 1387 . . 155 GLU CA . 18663 1 1608 . 1 1 155 155 GLU CB C 13 30.983 . . 1 . 1388 . . 155 GLU CB . 18663 1 1609 . 1 1 155 155 GLU CG C 13 35.080 . . 1 . 1389 . . 155 GLU CG . 18663 1 1610 . 1 1 155 155 GLU N N 15 118.221 0.043 . 1 . 1394 . . 155 GLU N . 18663 1 1611 . 1 1 156 156 ASP H H 1 8.246 0.008 . 1 . 1398 . . 156 ASP H . 18663 1 1612 . 1 1 156 156 ASP HA H 1 5.197 0.003 . 1 . 1399 . . 156 ASP HA . 18663 1 1613 . 1 1 156 156 ASP HB2 H 1 2.530 0.002 . 2 . 1400 . . 156 ASP HB2 . 18663 1 1614 . 1 1 156 156 ASP HB3 H 1 2.495 0.004 . 2 . 1401 . . 156 ASP HB3 . 18663 1 1615 . 1 1 156 156 ASP CA C 13 53.891 . . 1 . 1396 . . 156 ASP CA . 18663 1 1616 . 1 1 156 156 ASP CB C 13 41.975 . . 1 . 1397 . . 156 ASP CB . 18663 1 1617 . 1 1 156 156 ASP N N 15 119.597 0.027 . 1 . 1402 . . 156 ASP N . 18663 1 1618 . 1 1 157 157 VAL H H 1 8.687 0.004 . 1 . 1407 . . 157 VAL H . 18663 1 1619 . 1 1 157 157 VAL HA H 1 5.158 0.001 . 1 . 1408 . . 157 VAL HA . 18663 1 1620 . 1 1 157 157 VAL HB H 1 1.794 0.001 . 1 . 1409 . . 157 VAL HB . 18663 1 1621 . 1 1 157 157 VAL HG11 H 1 0.828 0.001 . 2 . 1411 . . 157 VAL HG11 . 18663 1 1622 . 1 1 157 157 VAL HG12 H 1 0.828 0.001 . 2 . 1411 . . 157 VAL HG12 . 18663 1 1623 . 1 1 157 157 VAL HG13 H 1 0.828 0.001 . 2 . 1411 . . 157 VAL HG13 . 18663 1 1624 . 1 1 157 157 VAL HG21 H 1 0.896 0.003 . 2 . 1412 . . 157 VAL HG21 . 18663 1 1625 . 1 1 157 157 VAL HG22 H 1 0.896 0.003 . 2 . 1412 . . 157 VAL HG22 . 18663 1 1626 . 1 1 157 157 VAL HG23 H 1 0.896 0.003 . 2 . 1412 . . 157 VAL HG23 . 18663 1 1627 . 1 1 157 157 VAL CA C 13 60.880 . . 1 . 1403 . . 157 VAL CA . 18663 1 1628 . 1 1 157 157 VAL CB C 13 35.209 . . 1 . 1404 . . 157 VAL CB . 18663 1 1629 . 1 1 157 157 VAL CG1 C 13 20.913 . . 2 . 1405 . . 157 VAL CG1 . 18663 1 1630 . 1 1 157 157 VAL CG2 C 13 21.262 . . 2 . 1406 . . 157 VAL CG2 . 18663 1 1631 . 1 1 157 157 VAL N N 15 118.382 0.055 . 1 . 1410 . . 157 VAL N . 18663 1 1632 . 1 1 158 158 VAL H H 1 9.093 0.004 . 1 . 1417 . . 158 VAL H . 18663 1 1633 . 1 1 158 158 VAL HA H 1 5.412 0.002 . 1 . 1418 . . 158 VAL HA . 18663 1 1634 . 1 1 158 158 VAL HB H 1 1.999 0.006 . 1 . 1419 . . 158 VAL HB . 18663 1 1635 . 1 1 158 158 VAL HG11 H 1 1.065 0.001 . 2 . 1421 . . 158 VAL HG11 . 18663 1 1636 . 1 1 158 158 VAL HG12 H 1 1.065 0.001 . 2 . 1421 . . 158 VAL HG12 . 18663 1 1637 . 1 1 158 158 VAL HG13 H 1 1.065 0.001 . 2 . 1421 . . 158 VAL HG13 . 18663 1 1638 . 1 1 158 158 VAL HG21 H 1 1.181 0.001 . 2 . 1422 . . 158 VAL HG21 . 18663 1 1639 . 1 1 158 158 VAL HG22 H 1 1.181 0.001 . 2 . 1422 . . 158 VAL HG22 . 18663 1 1640 . 1 1 158 158 VAL HG23 H 1 1.181 0.001 . 2 . 1422 . . 158 VAL HG23 . 18663 1 1641 . 1 1 158 158 VAL CA C 13 59.514 . . 1 . 1413 . . 158 VAL CA . 18663 1 1642 . 1 1 158 158 VAL CB C 13 34.414 . . 1 . 1414 . . 158 VAL CB . 18663 1 1643 . 1 1 158 158 VAL CG1 C 13 21.104 . . 2 . 1415 . . 158 VAL CG1 . 18663 1 1644 . 1 1 158 158 VAL CG2 C 13 21.341 0.015 . 2 . 1416 . . 158 VAL CG2 . 18663 1 1645 . 1 1 158 158 VAL N N 15 126.989 0.012 . 1 . 1420 . . 158 VAL N . 18663 1 1646 . 1 1 159 159 GLN H H 1 9.005 0.003 . 1 . 1426 . . 159 GLN H . 18663 1 1647 . 1 1 159 159 GLN HA H 1 6.041 0.006 . 1 . 1427 . . 159 GLN HA . 18663 1 1648 . 1 1 159 159 GLN HB2 H 1 2.062 0.001 . 2 . 1428 . . 159 GLN HB2 . 18663 1 1649 . 1 1 159 159 GLN HB3 H 1 1.965 0.002 . 2 . 1429 . . 159 GLN HB3 . 18663 1 1650 . 1 1 159 159 GLN HG2 H 1 1.792 0.006 . 2 . 1432 . . 159 GLN HG2 . 18663 1 1651 . 1 1 159 159 GLN HG3 H 1 1.711 0.001 . 2 . 1433 . . 159 GLN HG3 . 18663 1 1652 . 1 1 159 159 GLN HE21 H 1 6.482 0.002 . 1 . 1430 . . 159 GLN HE21 . 18663 1 1653 . 1 1 159 159 GLN HE22 H 1 7.072 0.003 . 1 . 1431 . . 159 GLN HE22 . 18663 1 1654 . 1 1 159 159 GLN CA C 13 53.065 . . 1 . 1423 . . 159 GLN CA . 18663 1 1655 . 1 1 159 159 GLN CB C 13 32.766 0.018 . 1 . 1424 . . 159 GLN CB . 18663 1 1656 . 1 1 159 159 GLN CG C 13 33.152 . . 1 . 1425 . . 159 GLN CG . 18663 1 1657 . 1 1 159 159 GLN N N 15 120.621 0.02 . 1 . 1434 . . 159 GLN N . 18663 1 1658 . 1 1 159 159 GLN NE2 N 15 107.218 . . 1 . 1435 . . 159 GLN NE2 . 18663 1 1659 . 1 1 160 160 VAL H H 1 8.831 0.007 . 1 . 1440 . . 160 VAL H . 18663 1 1660 . 1 1 160 160 VAL HA H 1 5.163 0.005 . 1 . 1441 . . 160 VAL HA . 18663 1 1661 . 1 1 160 160 VAL HB H 1 2.081 0.002 . 1 . 1442 . . 160 VAL HB . 18663 1 1662 . 1 1 160 160 VAL HG11 H 1 0.837 0.006 . 2 . 1444 . . 160 VAL HG11 . 18663 1 1663 . 1 1 160 160 VAL HG12 H 1 0.837 0.006 . 2 . 1444 . . 160 VAL HG12 . 18663 1 1664 . 1 1 160 160 VAL HG13 H 1 0.837 0.006 . 2 . 1444 . . 160 VAL HG13 . 18663 1 1665 . 1 1 160 160 VAL HG21 H 1 0.951 0.003 . 2 . 1445 . . 160 VAL HG21 . 18663 1 1666 . 1 1 160 160 VAL HG22 H 1 0.951 0.003 . 2 . 1445 . . 160 VAL HG22 . 18663 1 1667 . 1 1 160 160 VAL HG23 H 1 0.951 0.003 . 2 . 1445 . . 160 VAL HG23 . 18663 1 1668 . 1 1 160 160 VAL CA C 13 61.674 . . 1 . 1436 . . 160 VAL CA . 18663 1 1669 . 1 1 160 160 VAL CB C 13 34.668 . . 1 . 1437 . . 160 VAL CB . 18663 1 1670 . 1 1 160 160 VAL CG1 C 13 20.658 . . 2 . 1438 . . 160 VAL CG1 . 18663 1 1671 . 1 1 160 160 VAL CG2 C 13 21.199 . . 2 . 1439 . . 160 VAL CG2 . 18663 1 1672 . 1 1 160 160 VAL N N 15 121.635 0.052 . 1 . 1443 . . 160 VAL N . 18663 1 1673 . 1 1 161 161 TRP H H 1 9.480 0.005 . 1 . 1450 . . 161 TRP H . 18663 1 1674 . 1 1 161 161 TRP HA H 1 5.531 0.002 . 1 . 1451 . . 161 TRP HA . 18663 1 1675 . 1 1 161 161 TRP HB2 H 1 3.293 0.002 . 2 . 1452 . . 161 TRP HB2 . 18663 1 1676 . 1 1 161 161 TRP HB3 H 1 3.223 0.002 . 2 . 1453 . . 161 TRP HB3 . 18663 1 1677 . 1 1 161 161 TRP HD1 H 1 7.072 0.001 . 1 . 1454 . . 161 TRP HD1 . 18663 1 1678 . 1 1 161 161 TRP HE1 H 1 11.626 0.012 . 1 . 1455 . . 161 TRP HE1 . 18663 1 1679 . 1 1 161 161 TRP HZ2 H 1 7.042 0.002 . 1 . 1456 . . 161 TRP HZ2 . 18663 1 1680 . 1 1 161 161 TRP CA C 13 56.401 . . 1 . 1446 . . 161 TRP CA . 18663 1 1681 . 1 1 161 161 TRP CB C 13 30.967 0.016 . 1 . 1447 . . 161 TRP CB . 18663 1 1682 . 1 1 161 161 TRP CD1 C 13 131.055 . . 1 . 1448 . . 161 TRP CD1 . 18663 1 1683 . 1 1 161 161 TRP CZ2 C 13 113.328 . . 1 . 1449 . . 161 TRP CZ2 . 18663 1 1684 . 1 1 161 161 TRP N N 15 127.994 0.024 . 1 . 1457 . . 161 TRP N . 18663 1 1685 . 1 1 161 161 TRP NE1 N 15 132.699 . . 1 . 1458 . . 161 TRP NE1 . 18663 1 1686 . 1 1 162 162 ASN H H 1 9.304 0.004 . 1 . 1461 . . 162 ASN H . 18663 1 1687 . 1 1 162 162 ASN HA H 1 6.333 0.005 . 1 . 1462 . . 162 ASN HA . 18663 1 1688 . 1 1 162 162 ASN HB2 H 1 2.953 0.005 . 1 . 1888 . . 162 ASN HB2 . 18663 1 1689 . 1 1 162 162 ASN HB3 H 1 2.953 0.005 . 1 . 1467 . . 162 ASN HB3 . 18663 1 1690 . 1 1 162 162 ASN HD21 H 1 7.075 . . 1 . 1463 . . 162 ASN HD21 . 18663 1 1691 . 1 1 162 162 ASN HD22 H 1 6.481 . . 1 . 1464 . . 162 ASN HD22 . 18663 1 1692 . 1 1 162 162 ASN CA C 13 50.902 . . 1 . 1459 . . 162 ASN CA . 18663 1 1693 . 1 1 162 162 ASN CB C 13 39.925 . . 1 . 1460 . . 162 ASN CB . 18663 1 1694 . 1 1 162 162 ASN N N 15 123.468 0.014 . 1 . 1465 . . 162 ASN N . 18663 1 1695 . 1 1 162 162 ASN ND2 N 15 107.218 . . 1 . 1466 . . 162 ASN ND2 . 18663 1 1696 . 1 1 163 163 VAL H H 1 8.065 0.001 . 1 . 1472 . . 163 VAL H . 18663 1 1697 . 1 1 163 163 VAL HA H 1 4.616 0.001 . 1 . 1473 . . 163 VAL HA . 18663 1 1698 . 1 1 163 163 VAL HB H 1 2.350 0.001 . 1 . 1474 . . 163 VAL HB . 18663 1 1699 . 1 1 163 163 VAL HG11 H 1 1.232 0.003 . 2 . 1476 . . 163 VAL HG11 . 18663 1 1700 . 1 1 163 163 VAL HG12 H 1 1.232 0.003 . 2 . 1476 . . 163 VAL HG12 . 18663 1 1701 . 1 1 163 163 VAL HG13 H 1 1.232 0.003 . 2 . 1476 . . 163 VAL HG13 . 18663 1 1702 . 1 1 163 163 VAL HG21 H 1 1.305 0.001 . 2 . 1477 . . 163 VAL HG21 . 18663 1 1703 . 1 1 163 163 VAL HG22 H 1 1.305 0.001 . 2 . 1477 . . 163 VAL HG22 . 18663 1 1704 . 1 1 163 163 VAL HG23 H 1 1.305 0.001 . 2 . 1477 . . 163 VAL HG23 . 18663 1 1705 . 1 1 163 163 VAL CA C 13 62.167 . . 1 . 1468 . . 163 VAL CA . 18663 1 1706 . 1 1 163 163 VAL CB C 13 34.811 . . 1 . 1469 . . 163 VAL CB . 18663 1 1707 . 1 1 163 163 VAL CG1 C 13 21.548 . . 2 . 1470 . . 163 VAL CG1 . 18663 1 1708 . 1 1 163 163 VAL CG2 C 13 22.835 . . 2 . 1471 . . 163 VAL CG2 . 18663 1 1709 . 1 1 163 163 VAL N N 15 115.078 0.042 . 1 . 1475 . . 163 VAL N . 18663 1 1710 . 1 1 164 164 ASN H H 1 8.335 0.006 . 1 . 1480 . . 164 ASN H . 18663 1 1711 . 1 1 164 164 ASN HA H 1 4.876 0.008 . 1 . 1481 . . 164 ASN HA . 18663 1 1712 . 1 1 164 164 ASN HB2 H 1 2.945 0.003 . 2 . 1482 . . 164 ASN HB2 . 18663 1 1713 . 1 1 164 164 ASN HB3 H 1 2.452 0.006 . 2 . 1483 . . 164 ASN HB3 . 18663 1 1714 . 1 1 164 164 ASN HD21 H 1 7.213 0.002 . 1 . 1484 . . 164 ASN HD21 . 18663 1 1715 . 1 1 164 164 ASN HD22 H 1 7.659 0.002 . 1 . 1485 . . 164 ASN HD22 . 18663 1 1716 . 1 1 164 164 ASN CA C 13 51.200 . . 1 . 1478 . . 164 ASN CA . 18663 1 1717 . 1 1 164 164 ASN CB C 13 38.755 0.007 . 1 . 1479 . . 164 ASN CB . 18663 1 1718 . 1 1 164 164 ASN N N 15 121.515 0.065 . 1 . 1486 . . 164 ASN N . 18663 1 1719 . 1 1 164 164 ASN ND2 N 15 111.864 . . 1 . 1487 . . 164 ASN ND2 . 18663 1 1720 . 1 1 165 165 ALA H H 1 9.565 0.006 . 1 . 1490 . . 165 ALA H . 18663 1 1721 . 1 1 165 165 ALA HA H 1 4.276 0.002 . 1 . 1491 . . 165 ALA HA . 18663 1 1722 . 1 1 165 165 ALA HB1 H 1 1.497 0.003 . 1 . 1493 . . 165 ALA HB1 . 18663 1 1723 . 1 1 165 165 ALA HB2 H 1 1.497 0.003 . 1 . 1493 . . 165 ALA HB2 . 18663 1 1724 . 1 1 165 165 ALA HB3 H 1 1.497 0.003 . 1 . 1493 . . 165 ALA HB3 . 18663 1 1725 . 1 1 165 165 ALA CA C 13 54.415 . . 1 . 1488 . . 165 ALA CA . 18663 1 1726 . 1 1 165 165 ALA CB C 13 18.673 . . 1 . 1489 . . 165 ALA CB . 18663 1 1727 . 1 1 165 165 ALA N N 15 127.656 0.043 . 1 . 1492 . . 165 ALA N . 18663 1 1728 . 1 1 166 166 SER H H 1 8.419 0.004 . 1 . 1496 . . 166 SER H . 18663 1 1729 . 1 1 166 166 SER HA H 1 4.334 0.003 . 1 . 1497 . . 166 SER HA . 18663 1 1730 . 1 1 166 166 SER HB2 H 1 4.016 . . 2 . 1498 . . 166 SER HB2 . 18663 1 1731 . 1 1 166 166 SER HB3 H 1 3.988 0.004 . 2 . 1499 . . 166 SER HB3 . 18663 1 1732 . 1 1 166 166 SER CA C 13 60.610 . . 1 . 1494 . . 166 SER CA . 18663 1 1733 . 1 1 166 166 SER CB C 13 62.620 0.023 . 1 . 1495 . . 166 SER CB . 18663 1 1734 . 1 1 166 166 SER N N 15 113.439 0.051 . 1 . 1500 . . 166 SER N . 18663 1 1735 . 1 1 167 167 LEU H H 1 7.210 0.003 . 1 . 1506 . . 167 LEU H . 18663 1 1736 . 1 1 167 167 LEU HA H 1 4.717 0.001 . 1 . 1507 . . 167 LEU HA . 18663 1 1737 . 1 1 167 167 LEU HB2 H 1 1.800 0.004 . 2 . 1508 . . 167 LEU HB2 . 18663 1 1738 . 1 1 167 167 LEU HB3 H 1 1.495 0.004 . 2 . 1509 . . 167 LEU HB3 . 18663 1 1739 . 1 1 167 167 LEU HG H 1 1.308 0.003 . 1 . 1510 . . 167 LEU HG . 18663 1 1740 . 1 1 167 167 LEU HD11 H 1 0.785 0.004 . 2 . 1512 . . 167 LEU HD11 . 18663 1 1741 . 1 1 167 167 LEU HD12 H 1 0.785 0.004 . 2 . 1512 . . 167 LEU HD12 . 18663 1 1742 . 1 1 167 167 LEU HD13 H 1 0.785 0.004 . 2 . 1512 . . 167 LEU HD13 . 18663 1 1743 . 1 1 167 167 LEU HD21 H 1 0.808 0.001 . 2 . 1513 . . 167 LEU HD21 . 18663 1 1744 . 1 1 167 167 LEU HD22 H 1 0.808 0.001 . 2 . 1513 . . 167 LEU HD22 . 18663 1 1745 . 1 1 167 167 LEU HD23 H 1 0.808 0.001 . 2 . 1513 . . 167 LEU HD23 . 18663 1 1746 . 1 1 167 167 LEU CA C 13 53.716 0.001 . 1 . 1501 . . 167 LEU CA . 18663 1 1747 . 1 1 167 167 LEU CB C 13 41.006 . . 1 . 1502 . . 167 LEU CB . 18663 1 1748 . 1 1 167 167 LEU CG C 13 26.028 . . 1 . 1505 . . 167 LEU CG . 18663 1 1749 . 1 1 167 167 LEU CD1 C 13 21.739 . . 2 . 1503 . . 167 LEU CD1 . 18663 1 1750 . 1 1 167 167 LEU CD2 C 13 26.980 . . 2 . 1504 . . 167 LEU CD2 . 18663 1 1751 . 1 1 167 167 LEU N N 15 119.557 0.031 . 1 . 1511 . . 167 LEU N . 18663 1 1752 . 1 1 168 168 VAL H H 1 7.230 0.004 . 1 . 1518 . . 168 VAL H . 18663 1 1753 . 1 1 168 168 VAL HA H 1 3.755 0.003 . 1 . 1519 . . 168 VAL HA . 18663 1 1754 . 1 1 168 168 VAL HB H 1 1.659 0.004 . 1 . 1520 . . 168 VAL HB . 18663 1 1755 . 1 1 168 168 VAL HG11 H 1 0.089 0.001 . 2 . 1522 . . 168 VAL HG11 . 18663 1 1756 . 1 1 168 168 VAL HG12 H 1 0.089 0.001 . 2 . 1522 . . 168 VAL HG12 . 18663 1 1757 . 1 1 168 168 VAL HG13 H 1 0.089 0.001 . 2 . 1522 . . 168 VAL HG13 . 18663 1 1758 . 1 1 168 168 VAL HG21 H 1 0.402 0.003 . 2 . 1523 . . 168 VAL HG21 . 18663 1 1759 . 1 1 168 168 VAL HG22 H 1 0.402 0.003 . 2 . 1523 . . 168 VAL HG22 . 18663 1 1760 . 1 1 168 168 VAL HG23 H 1 0.402 0.003 . 2 . 1523 . . 168 VAL HG23 . 18663 1 1761 . 1 1 168 168 VAL CA C 13 65.074 . . 1 . 1514 . . 168 VAL CA . 18663 1 1762 . 1 1 168 168 VAL CB C 13 31.428 . . 1 . 1515 . . 168 VAL CB . 18663 1 1763 . 1 1 168 168 VAL CG1 C 13 19.864 . . 2 . 1516 . . 168 VAL CG1 . 18663 1 1764 . 1 1 168 168 VAL CG2 C 13 19.880 . . 2 . 1517 . . 168 VAL CG2 . 18663 1 1765 . 1 1 168 168 VAL N N 15 119.916 0.076 . 1 . 1521 . . 168 VAL N . 18663 1 1766 . 1 1 169 169 GLY H H 1 8.897 0.004 . 1 . 1525 . . 169 GLY H . 18663 1 1767 . 1 1 169 169 GLY HA2 H 1 3.962 0.006 . 2 . 1526 . . 169 GLY HA2 . 18663 1 1768 . 1 1 169 169 GLY HA3 H 1 3.836 0.002 . 2 . 1527 . . 169 GLY HA3 . 18663 1 1769 . 1 1 169 169 GLY CA C 13 46.328 0.015 . 1 . 1524 . . 169 GLY CA . 18663 1 1770 . 1 1 169 169 GLY N N 15 111.091 0.072 . 1 . 1528 . . 169 GLY N . 18663 1 1771 . 1 1 170 170 GLU H H 1 7.394 0.003 . 1 . 1532 . . 170 GLU H . 18663 1 1772 . 1 1 170 170 GLU HA H 1 4.463 0.005 . 1 . 1533 . . 170 GLU HA . 18663 1 1773 . 1 1 170 170 GLU HB2 H 1 2.297 0.001 . 2 . 1534 . . 170 GLU HB2 . 18663 1 1774 . 1 1 170 170 GLU HB3 H 1 1.923 0.002 . 2 . 1535 . . 170 GLU HB3 . 18663 1 1775 . 1 1 170 170 GLU HG2 H 1 2.222 0.002 . 1 . 1889 . . 170 GLU HG2 . 18663 1 1776 . 1 1 170 170 GLU HG3 H 1 2.222 0.002 . 1 . 1537 . . 170 GLU HG3 . 18663 1 1777 . 1 1 170 170 GLU CA C 13 55.385 . . 1 . 1529 . . 170 GLU CA . 18663 1 1778 . 1 1 170 170 GLU CB C 13 30.650 0.016 . 1 . 1530 . . 170 GLU CB . 18663 1 1779 . 1 1 170 170 GLU CG C 13 36.004 . . 1 . 1531 . . 170 GLU CG . 18663 1 1780 . 1 1 170 170 GLU N N 15 116.314 0.046 . 1 . 1536 . . 170 GLU N . 18663 1 1781 . 1 1 171 171 ALA H H 1 7.673 0.005 . 1 . 1540 . . 171 ALA H . 18663 1 1782 . 1 1 171 171 ALA HA H 1 4.739 0.005 . 1 . 1541 . . 171 ALA HA . 18663 1 1783 . 1 1 171 171 ALA HB1 H 1 1.956 0.006 . 1 . 1543 . . 171 ALA HB1 . 18663 1 1784 . 1 1 171 171 ALA HB2 H 1 1.956 0.006 . 1 . 1543 . . 171 ALA HB2 . 18663 1 1785 . 1 1 171 171 ALA HB3 H 1 1.956 0.006 . 1 . 1543 . . 171 ALA HB3 . 18663 1 1786 . 1 1 171 171 ALA CA C 13 51.985 . . 1 . 1538 . . 171 ALA CA . 18663 1 1787 . 1 1 171 171 ALA CB C 13 20.547 . . 1 . 1539 . . 171 ALA CB . 18663 1 1788 . 1 1 171 171 ALA N N 15 122.388 0.015 . 1 . 1542 . . 171 ALA N . 18663 1 1789 . 1 1 172 172 THR H H 1 9.130 0.005 . 1 . 1547 . . 172 THR H . 18663 1 1790 . 1 1 172 172 THR HA H 1 4.913 0.002 . 1 . 1548 . . 172 THR HA . 18663 1 1791 . 1 1 172 172 THR HB H 1 4.599 0.004 . 1 . 1549 . . 172 THR HB . 18663 1 1792 . 1 1 172 172 THR HG21 H 1 1.097 0.007 . 1 . 1551 . . 172 THR HG21 . 18663 1 1793 . 1 1 172 172 THR HG22 H 1 1.097 0.007 . 1 . 1551 . . 172 THR HG22 . 18663 1 1794 . 1 1 172 172 THR HG23 H 1 1.097 0.007 . 1 . 1551 . . 172 THR HG23 . 18663 1 1795 . 1 1 172 172 THR CA C 13 60.435 . . 1 . 1544 . . 172 THR CA . 18663 1 1796 . 1 1 172 172 THR CB C 13 67.679 . . 1 . 1545 . . 172 THR CB . 18663 1 1797 . 1 1 172 172 THR CG2 C 13 21.786 . . 1 . 1546 . . 172 THR CG2 . 18663 1 1798 . 1 1 172 172 THR N N 15 112.246 0.08 . 1 . 1550 . . 172 THR N . 18663 1 1799 . 1 1 173 173 VAL H H 1 6.491 0.004 . 1 . 1556 . . 173 VAL H . 18663 1 1800 . 1 1 173 173 VAL HA H 1 3.204 0.006 . 1 . 1557 . . 173 VAL HA . 18663 1 1801 . 1 1 173 173 VAL HB H 1 0.233 0.004 . 1 . 1558 . . 173 VAL HB . 18663 1 1802 . 1 1 173 173 VAL HG11 H 1 -0.356 0.001 . 2 . 1560 . . 173 VAL HG11 . 18663 1 1803 . 1 1 173 173 VAL HG12 H 1 -0.356 0.001 . 2 . 1560 . . 173 VAL HG12 . 18663 1 1804 . 1 1 173 173 VAL HG13 H 1 -0.356 0.001 . 2 . 1560 . . 173 VAL HG13 . 18663 1 1805 . 1 1 173 173 VAL HG21 H 1 0.364 0.004 . 2 . 1561 . . 173 VAL HG21 . 18663 1 1806 . 1 1 173 173 VAL HG22 H 1 0.364 0.004 . 2 . 1561 . . 173 VAL HG22 . 18663 1 1807 . 1 1 173 173 VAL HG23 H 1 0.364 0.004 . 2 . 1561 . . 173 VAL HG23 . 18663 1 1808 . 1 1 173 173 VAL CA C 13 66.059 . . 1 . 1552 . . 173 VAL CA . 18663 1 1809 . 1 1 173 173 VAL CB C 13 32.794 . . 1 . 1553 . . 173 VAL CB . 18663 1 1810 . 1 1 173 173 VAL CG1 C 13 18.848 . . 2 . 1554 . . 173 VAL CG1 . 18663 1 1811 . 1 1 173 173 VAL CG2 C 13 22.310 . . 2 . 1555 . . 173 VAL CG2 . 18663 1 1812 . 1 1 173 173 VAL N N 15 124.286 0.005 . 1 . 1559 . . 173 VAL N . 18663 1 1813 . 1 1 174 174 LEU H H 1 8.391 0.005 . 1 . 1567 . . 174 LEU H . 18663 1 1814 . 1 1 174 174 LEU HA H 1 3.546 0.003 . 1 . 1568 . . 174 LEU HA . 18663 1 1815 . 1 1 174 174 LEU HB2 H 1 1.645 0.002 . 2 . 1569 . . 174 LEU HB2 . 18663 1 1816 . 1 1 174 174 LEU HB3 H 1 1.260 0.011 . 2 . 1570 . . 174 LEU HB3 . 18663 1 1817 . 1 1 174 174 LEU HG H 1 1.310 0.002 . 1 . 1571 . . 174 LEU HG . 18663 1 1818 . 1 1 174 174 LEU HD11 H 1 0.526 0.002 . 2 . 1573 . . 174 LEU HD11 . 18663 1 1819 . 1 1 174 174 LEU HD12 H 1 0.526 0.002 . 2 . 1573 . . 174 LEU HD12 . 18663 1 1820 . 1 1 174 174 LEU HD13 H 1 0.526 0.002 . 2 . 1573 . . 174 LEU HD13 . 18663 1 1821 . 1 1 174 174 LEU HD21 H 1 0.897 0.003 . 2 . 1574 . . 174 LEU HD21 . 18663 1 1822 . 1 1 174 174 LEU HD22 H 1 0.897 0.003 . 2 . 1574 . . 174 LEU HD22 . 18663 1 1823 . 1 1 174 174 LEU HD23 H 1 0.897 0.003 . 2 . 1574 . . 174 LEU HD23 . 18663 1 1824 . 1 1 174 174 LEU CA C 13 57.814 . . 1 . 1562 . . 174 LEU CA . 18663 1 1825 . 1 1 174 174 LEU CB C 13 39.846 0.048 . 1 . 1563 . . 174 LEU CB . 18663 1 1826 . 1 1 174 174 LEU CG C 13 26.567 . . 1 . 1566 . . 174 LEU CG . 18663 1 1827 . 1 1 174 174 LEU CD1 C 13 22.549 . . 2 . 1564 . . 174 LEU CD1 . 18663 1 1828 . 1 1 174 174 LEU CD2 C 13 25.265 . . 2 . 1565 . . 174 LEU CD2 . 18663 1 1829 . 1 1 174 174 LEU N N 15 118.008 0.018 . 1 . 1572 . . 174 LEU N . 18663 1 1830 . 1 1 175 175 GLU H H 1 8.549 0.011 . 1 . 1578 . . 175 GLU H . 18663 1 1831 . 1 1 175 175 GLU HA H 1 3.969 0.002 . 1 . 1579 . . 175 GLU HA . 18663 1 1832 . 1 1 175 175 GLU HB2 H 1 2.119 0.003 . 2 . 1580 . . 175 GLU HB2 . 18663 1 1833 . 1 1 175 175 GLU HB3 H 1 1.921 0.003 . 2 . 1581 . . 175 GLU HB3 . 18663 1 1834 . 1 1 175 175 GLU HG2 H 1 2.432 0.001 . 2 . 1582 . . 175 GLU HG2 . 18663 1 1835 . 1 1 175 175 GLU HG3 H 1 2.248 0.003 . 2 . 1583 . . 175 GLU HG3 . 18663 1 1836 . 1 1 175 175 GLU CA C 13 60.086 . . 1 . 1575 . . 175 GLU CA . 18663 1 1837 . 1 1 175 175 GLU CB C 13 28.260 0.033 . 1 . 1576 . . 175 GLU CB . 18663 1 1838 . 1 1 175 175 GLU CG C 13 37.018 0.013 . 1 . 1577 . . 175 GLU CG . 18663 1 1839 . 1 1 175 175 GLU N N 15 120.711 0.032 . 1 . 1584 . . 175 GLU N . 18663 1 1840 . 1 1 176 176 LYS H H 1 7.850 0.005 . 1 . 1589 . . 176 LYS H . 18663 1 1841 . 1 1 176 176 LYS HA H 1 4.147 0.005 . 1 . 1590 . . 176 LYS HA . 18663 1 1842 . 1 1 176 176 LYS HB2 H 1 2.191 0.005 . 2 . 1591 . . 176 LYS HB2 . 18663 1 1843 . 1 1 176 176 LYS HB3 H 1 2.066 0.002 . 2 . 1592 . . 176 LYS HB3 . 18663 1 1844 . 1 1 176 176 LYS HG2 H 1 1.717 0.001 . 2 . 1595 . . 176 LYS HG2 . 18663 1 1845 . 1 1 176 176 LYS HG3 H 1 1.559 0.002 . 2 . 1596 . . 176 LYS HG3 . 18663 1 1846 . 1 1 176 176 LYS HE2 H 1 2.746 0.003 . 2 . 1593 . . 176 LYS HE2 . 18663 1 1847 . 1 1 176 176 LYS HE3 H 1 2.590 0.003 . 2 . 1594 . . 176 LYS HE3 . 18663 1 1848 . 1 1 176 176 LYS CA C 13 57.274 . . 1 . 1585 . . 176 LYS CA . 18663 1 1849 . 1 1 176 176 LYS CB C 13 30.475 0.016 . 1 . 1586 . . 176 LYS CB . 18663 1 1850 . 1 1 176 176 LYS CG C 13 27.037 . . 1 . 1588 . . 176 LYS CG . 18663 1 1851 . 1 1 176 176 LYS CE C 13 41.761 0.015 . 1 . 1587 . . 176 LYS CE . 18663 1 1852 . 1 1 176 176 LYS N N 15 121.775 . . 1 . 1597 . . 176 LYS N . 18663 1 1853 . 1 1 177 177 ILE H H 1 8.410 0.002 . 1 . 1603 . . 177 ILE H . 18663 1 1854 . 1 1 177 177 ILE HA H 1 3.447 0.003 . 1 . 1604 . . 177 ILE HA . 18663 1 1855 . 1 1 177 177 ILE HB H 1 1.736 0.007 . 1 . 1605 . . 177 ILE HB . 18663 1 1856 . 1 1 177 177 ILE HG12 H 1 1.924 0.002 . 2 . 1606 . . 177 ILE HG12 . 18663 1 1857 . 1 1 177 177 ILE HG13 H 1 0.790 0.005 . 2 . 1607 . . 177 ILE HG13 . 18663 1 1858 . 1 1 177 177 ILE HG21 H 1 0.619 0.004 . 1 . 1610 . . 177 ILE HG21 . 18663 1 1859 . 1 1 177 177 ILE HG22 H 1 0.619 0.004 . 1 . 1610 . . 177 ILE HG22 . 18663 1 1860 . 1 1 177 177 ILE HG23 H 1 0.619 0.004 . 1 . 1610 . . 177 ILE HG23 . 18663 1 1861 . 1 1 177 177 ILE HD11 H 1 0.439 0.003 . 1 . 1609 . . 177 ILE HD11 . 18663 1 1862 . 1 1 177 177 ILE HD12 H 1 0.439 0.003 . 1 . 1609 . . 177 ILE HD12 . 18663 1 1863 . 1 1 177 177 ILE HD13 H 1 0.439 0.003 . 1 . 1609 . . 177 ILE HD13 . 18663 1 1864 . 1 1 177 177 ILE CA C 13 66.821 . . 1 . 1598 . . 177 ILE CA . 18663 1 1865 . 1 1 177 177 ILE CB C 13 37.337 . . 1 . 1599 . . 177 ILE CB . 18663 1 1866 . 1 1 177 177 ILE CG1 C 13 30.105 0.084 . 1 . 1601 . . 177 ILE CG1 . 18663 1 1867 . 1 1 177 177 ILE CG2 C 13 17.196 . . 1 . 1602 . . 177 ILE CG2 . 18663 1 1868 . 1 1 177 177 ILE CD1 C 13 13.413 . . 1 . 1600 . . 177 ILE CD1 . 18663 1 1869 . 1 1 177 177 ILE N N 15 120.313 0.03 . 1 . 1608 . . 177 ILE N . 18663 1 1870 . 1 1 178 178 HIS H H 1 7.827 0.002 . 1 . 1614 . . 178 HIS H . 18663 1 1871 . 1 1 178 178 HIS HA H 1 4.216 0.006 . 1 . 1615 . . 178 HIS HA . 18663 1 1872 . 1 1 178 178 HIS HB2 H 1 3.251 0.001 . 2 . 1616 . . 178 HIS HB2 . 18663 1 1873 . 1 1 178 178 HIS HB3 H 1 3.158 0.002 . 2 . 1617 . . 178 HIS HB3 . 18663 1 1874 . 1 1 178 178 HIS HD2 H 1 7.075 0.002 . 1 . 1618 . . 178 HIS HD2 . 18663 1 1875 . 1 1 178 178 HIS CA C 13 59.355 . . 1 . 1611 . . 178 HIS CA . 18663 1 1876 . 1 1 178 178 HIS CB C 13 28.537 0.016 . 1 . 1612 . . 178 HIS CB . 18663 1 1877 . 1 1 178 178 HIS CD2 C 13 122.732 . . 1 . 1613 . . 178 HIS CD2 . 18663 1 1878 . 1 1 178 178 HIS N N 15 116.094 0.033 . 1 . 1619 . . 178 HIS N . 18663 1 1879 . 1 1 179 179 GLN H H 1 7.782 0.003 . 1 . 1623 . . 179 GLN H . 18663 1 1880 . 1 1 179 179 GLN HA H 1 3.937 0.003 . 1 . 1624 . . 179 GLN HA . 18663 1 1881 . 1 1 179 179 GLN HB2 H 1 2.216 0.005 . 2 . 1625 . . 179 GLN HB2 . 18663 1 1882 . 1 1 179 179 GLN HB3 H 1 2.205 0.002 . 2 . 1626 . . 179 GLN HB3 . 18663 1 1883 . 1 1 179 179 GLN HG2 H 1 2.570 0.005 . 2 . 1629 . . 179 GLN HG2 . 18663 1 1884 . 1 1 179 179 GLN HG3 H 1 2.316 0.006 . 2 . 1630 . . 179 GLN HG3 . 18663 1 1885 . 1 1 179 179 GLN HE21 H 1 6.839 . . 1 . 1627 . . 179 GLN HE21 . 18663 1 1886 . 1 1 179 179 GLN HE22 H 1 7.464 0.002 . 1 . 1628 . . 179 GLN HE22 . 18663 1 1887 . 1 1 179 179 GLN CA C 13 58.084 . . 1 . 1620 . . 179 GLN CA . 18663 1 1888 . 1 1 179 179 GLN CB C 13 28.314 . . 1 . 1621 . . 179 GLN CB . 18663 1 1889 . 1 1 179 179 GLN CG C 13 33.594 . . 1 . 1622 . . 179 GLN CG . 18663 1 1890 . 1 1 179 179 GLN N N 15 117.530 . . 1 . 1631 . . 179 GLN N . 18663 1 1891 . 1 1 179 179 GLN NE2 N 15 111.527 0.02 . 1 . 1632 . . 179 GLN NE2 . 18663 1 1892 . 1 1 180 180 LEU H H 1 8.216 0.001 . 1 . 1638 . . 180 LEU H . 18663 1 1893 . 1 1 180 180 LEU HA H 1 4.098 0.001 . 1 . 1639 . . 180 LEU HA . 18663 1 1894 . 1 1 180 180 LEU HB2 H 1 1.924 0.002 . 2 . 1640 . . 180 LEU HB2 . 18663 1 1895 . 1 1 180 180 LEU HB3 H 1 1.439 0.002 . 2 . 1641 . . 180 LEU HB3 . 18663 1 1896 . 1 1 180 180 LEU HG H 1 1.797 0.003 . 1 . 1642 . . 180 LEU HG . 18663 1 1897 . 1 1 180 180 LEU HD11 H 1 0.597 0.003 . 2 . 1644 . . 180 LEU HD11 . 18663 1 1898 . 1 1 180 180 LEU HD12 H 1 0.597 0.003 . 2 . 1644 . . 180 LEU HD12 . 18663 1 1899 . 1 1 180 180 LEU HD13 H 1 0.597 0.003 . 2 . 1644 . . 180 LEU HD13 . 18663 1 1900 . 1 1 180 180 LEU HD21 H 1 0.807 0.003 . 2 . 1645 . . 180 LEU HD21 . 18663 1 1901 . 1 1 180 180 LEU HD22 H 1 0.807 0.003 . 2 . 1645 . . 180 LEU HD22 . 18663 1 1902 . 1 1 180 180 LEU HD23 H 1 0.807 0.003 . 2 . 1645 . . 180 LEU HD23 . 18663 1 1903 . 1 1 180 180 LEU CA C 13 56.504 . . 1 . 1633 . . 180 LEU CA . 18663 1 1904 . 1 1 180 180 LEU CB C 13 43.104 0.007 . 1 . 1634 . . 180 LEU CB . 18663 1 1905 . 1 1 180 180 LEU CG C 13 26.178 . . 1 . 1637 . . 180 LEU CG . 18663 1 1906 . 1 1 180 180 LEU CD1 C 13 25.854 . . 2 . 1635 . . 180 LEU CD1 . 18663 1 1907 . 1 1 180 180 LEU CD2 C 13 22.274 . . 2 . 1636 . . 180 LEU CD2 . 18663 1 1908 . 1 1 180 180 LEU N N 15 118.893 . . 1 . 1643 . . 180 LEU N . 18663 1 1909 . 1 1 181 181 LEU H H 1 7.836 0.001 . 1 . 1651 . . 181 LEU H . 18663 1 1910 . 1 1 181 181 LEU HA H 1 4.814 0.002 . 1 . 1652 . . 181 LEU HA . 18663 1 1911 . 1 1 181 181 LEU HB2 H 1 1.978 0.005 . 2 . 1653 . . 181 LEU HB2 . 18663 1 1912 . 1 1 181 181 LEU HB3 H 1 1.946 0.005 . 2 . 1654 . . 181 LEU HB3 . 18663 1 1913 . 1 1 181 181 LEU HG H 1 1.167 . . 1 . 1655 . . 181 LEU HG . 18663 1 1914 . 1 1 181 181 LEU HD11 H 1 0.951 0.002 . 2 . 1657 . . 181 LEU HD11 . 18663 1 1915 . 1 1 181 181 LEU HD12 H 1 0.951 0.002 . 2 . 1657 . . 181 LEU HD12 . 18663 1 1916 . 1 1 181 181 LEU HD13 H 1 0.951 0.002 . 2 . 1657 . . 181 LEU HD13 . 18663 1 1917 . 1 1 181 181 LEU HD21 H 1 1.162 0.001 . 2 . 1658 . . 181 LEU HD21 . 18663 1 1918 . 1 1 181 181 LEU HD22 H 1 1.162 0.001 . 2 . 1658 . . 181 LEU HD22 . 18663 1 1919 . 1 1 181 181 LEU HD23 H 1 1.162 0.001 . 2 . 1658 . . 181 LEU HD23 . 18663 1 1920 . 1 1 181 181 LEU CA C 13 52.071 . . 1 . 1646 . . 181 LEU CA . 18663 1 1921 . 1 1 181 181 LEU CB C 13 41.998 0.006 . 1 . 1647 . . 181 LEU CB . 18663 1 1922 . 1 1 181 181 LEU CG C 13 28.056 . . 1 . 1650 . . 181 LEU CG . 18663 1 1923 . 1 1 181 181 LEU CD1 C 13 23.873 . . 2 . 1648 . . 181 LEU CD1 . 18663 1 1924 . 1 1 181 181 LEU CD2 C 13 28.081 0.061 . 2 . 1649 . . 181 LEU CD2 . 18663 1 1925 . 1 1 181 181 LEU N N 15 118.726 . . 1 . 1656 . . 181 LEU N . 18663 1 1926 . 1 1 182 182 PRO HA H 1 4.464 0.001 . 1 . 1663 . . 182 PRO HA . 18663 1 1927 . 1 1 182 182 PRO HB2 H 1 2.155 0.002 . 2 . 1664 . . 182 PRO HB2 . 18663 1 1928 . 1 1 182 182 PRO HB3 H 1 1.625 0.002 . 2 . 1665 . . 182 PRO HB3 . 18663 1 1929 . 1 1 182 182 PRO HG2 H 1 2.129 0.002 . 2 . 1668 . . 182 PRO HG2 . 18663 1 1930 . 1 1 182 182 PRO HG3 H 1 1.956 0.001 . 2 . 1669 . . 182 PRO HG3 . 18663 1 1931 . 1 1 182 182 PRO HD2 H 1 3.583 . . 2 . 1666 . . 182 PRO HD2 . 18663 1 1932 . 1 1 182 182 PRO HD3 H 1 3.466 0.001 . 2 . 1667 . . 182 PRO HD3 . 18663 1 1933 . 1 1 182 182 PRO CA C 13 65.049 . . 1 . 1659 . . 182 PRO CA . 18663 1 1934 . 1 1 182 182 PRO CB C 13 31.304 0.006 . 1 . 1660 . . 182 PRO CB . 18663 1 1935 . 1 1 182 182 PRO CG C 13 27.072 0.002 . 1 . 1662 . . 182 PRO CG . 18663 1 1936 . 1 1 182 182 PRO CD C 13 49.825 . . 1 . 1661 . . 182 PRO CD . 18663 1 1937 . 1 1 183 183 HIS H H 1 8.764 0.004 . 1 . 1673 . . 183 HIS H . 18663 1 1938 . 1 1 183 183 HIS HA H 1 4.756 0.004 . 1 . 1674 . . 183 HIS HA . 18663 1 1939 . 1 1 183 183 HIS HB2 H 1 3.129 0.004 . 2 . 1675 . . 183 HIS HB2 . 18663 1 1940 . 1 1 183 183 HIS HB3 H 1 3.104 0.002 . 2 . 1676 . . 183 HIS HB3 . 18663 1 1941 . 1 1 183 183 HIS HD2 H 1 6.992 . . 1 . 1677 . . 183 HIS HD2 . 18663 1 1942 . 1 1 183 183 HIS CA C 13 55.131 . . 1 . 1670 . . 183 HIS CA . 18663 1 1943 . 1 1 183 183 HIS CB C 13 29.887 . . 1 . 1671 . . 183 HIS CB . 18663 1 1944 . 1 1 183 183 HIS CD2 C 13 119.237 . . 1 . 1672 . . 183 HIS CD2 . 18663 1 1945 . 1 1 183 183 HIS N N 15 115.481 0.065 . 1 . 1678 . . 183 HIS N . 18663 1 1946 . 1 1 184 184 ILE H H 1 6.846 0.005 . 1 . 1684 . . 184 ILE H . 18663 1 1947 . 1 1 184 184 ILE HA H 1 3.913 0.003 . 1 . 1685 . . 184 ILE HA . 18663 1 1948 . 1 1 184 184 ILE HB H 1 1.536 0.006 . 1 . 1686 . . 184 ILE HB . 18663 1 1949 . 1 1 184 184 ILE HG12 H 1 0.929 0.002 . 2 . 1687 . . 184 ILE HG12 . 18663 1 1950 . 1 1 184 184 ILE HG13 H 1 0.995 0.005 . 2 . 1688 . . 184 ILE HG13 . 18663 1 1951 . 1 1 184 184 ILE HG21 H 1 -0.118 0.005 . 1 . 1691 . . 184 ILE HG21 . 18663 1 1952 . 1 1 184 184 ILE HG22 H 1 -0.118 0.005 . 1 . 1691 . . 184 ILE HG22 . 18663 1 1953 . 1 1 184 184 ILE HG23 H 1 -0.118 0.005 . 1 . 1691 . . 184 ILE HG23 . 18663 1 1954 . 1 1 184 184 ILE HD11 H 1 0.522 0.005 . 1 . 1690 . . 184 ILE HD11 . 18663 1 1955 . 1 1 184 184 ILE HD12 H 1 0.522 0.005 . 1 . 1690 . . 184 ILE HD12 . 18663 1 1956 . 1 1 184 184 ILE HD13 H 1 0.522 0.005 . 1 . 1690 . . 184 ILE HD13 . 18663 1 1957 . 1 1 184 184 ILE CA C 13 57.671 0.001 . 1 . 1679 . . 184 ILE CA . 18663 1 1958 . 1 1 184 184 ILE CB C 13 35.874 . . 1 . 1680 . . 184 ILE CB . 18663 1 1959 . 1 1 184 184 ILE CG1 C 13 27.695 0.016 . 1 . 1682 . . 184 ILE CG1 . 18663 1 1960 . 1 1 184 184 ILE CG2 C 13 15.385 . . 1 . 1683 . . 184 ILE CG2 . 18663 1 1961 . 1 1 184 184 ILE CD1 C 13 8.931 . . 1 . 1681 . . 184 ILE CD1 . 18663 1 1962 . 1 1 184 184 ILE N N 15 121.485 0.04 . 1 . 1689 . . 184 ILE N . 18663 1 1963 . 1 1 185 185 ALA H H 1 8.527 0.003 . 1 . 1694 . . 185 ALA H . 18663 1 1964 . 1 1 185 185 ALA HA H 1 4.570 0.004 . 1 . 1695 . . 185 ALA HA . 18663 1 1965 . 1 1 185 185 ALA HB1 H 1 1.255 0.003 . 1 . 1697 . . 185 ALA HB1 . 18663 1 1966 . 1 1 185 185 ALA HB2 H 1 1.255 0.003 . 1 . 1697 . . 185 ALA HB2 . 18663 1 1967 . 1 1 185 185 ALA HB3 H 1 1.255 0.003 . 1 . 1697 . . 185 ALA HB3 . 18663 1 1968 . 1 1 185 185 ALA CA C 13 49.855 0.003 . 1 . 1692 . . 185 ALA CA . 18663 1 1969 . 1 1 185 185 ALA CB C 13 17.055 . . 1 . 1693 . . 185 ALA CB . 18663 1 1970 . 1 1 185 185 ALA N N 15 132.710 0.044 . 1 . 1696 . . 185 ALA N . 18663 1 1971 . 1 1 186 186 PHE H H 1 7.895 0.002 . 1 . 1703 . . 186 PHE H . 18663 1 1972 . 1 1 186 186 PHE HA H 1 4.519 0.002 . 1 . 1704 . . 186 PHE HA . 18663 1 1973 . 1 1 186 186 PHE HB2 H 1 2.952 0.008 . 2 . 1705 . . 186 PHE HB2 . 18663 1 1974 . 1 1 186 186 PHE HB3 H 1 2.852 0.003 . 2 . 1706 . . 186 PHE HB3 . 18663 1 1975 . 1 1 186 186 PHE HD1 H 1 7.210 . . 3 . 1709 . . 186 PHE HD1 . 18663 1 1976 . 1 1 186 186 PHE HD2 H 1 7.210 . . 3 . 1709 . . 186 PHE HD2 . 18663 1 1977 . 1 1 186 186 PHE HE1 H 1 7.156 . . 3 . 1710 . . 186 PHE HE1 . 18663 1 1978 . 1 1 186 186 PHE HE2 H 1 7.156 . . 3 . 1710 . . 186 PHE HE2 . 18663 1 1979 . 1 1 186 186 PHE HZ H 1 6.982 0.001 . 1 . 1707 . . 186 PHE HZ . 18663 1 1980 . 1 1 186 186 PHE CA C 13 59.276 . . 1 . 1698 . . 186 PHE CA . 18663 1 1981 . 1 1 186 186 PHE CB C 13 39.940 0.014 . 1 . 1699 . . 186 PHE CB . 18663 1 1982 . 1 1 186 186 PHE CD1 C 13 131.245 . . 3 . 1700 . . 186 PHE CD1 . 18663 1 1983 . 1 1 186 186 PHE CE1 C 13 131.182 . . 3 . 1701 . . 186 PHE CE1 . 18663 1 1984 . 1 1 186 186 PHE CZ C 13 128.831 . . 1 . 1702 . . 186 PHE CZ . 18663 1 1985 . 1 1 186 186 PHE N N 15 120.794 0.01 . 1 . 1708 . . 186 PHE N . 18663 1 1986 . 1 1 187 187 LYS H H 1 8.803 0.002 . 1 . 1715 . . 187 LYS H . 18663 1 1987 . 1 1 187 187 LYS HA H 1 4.510 0.002 . 1 . 1716 . . 187 LYS HA . 18663 1 1988 . 1 1 187 187 LYS HB2 H 1 3.023 0.004 . 2 . 1717 . . 187 LYS HB2 . 18663 1 1989 . 1 1 187 187 LYS HB3 H 1 2.927 0.003 . 2 . 1718 . . 187 LYS HB3 . 18663 1 1990 . 1 1 187 187 LYS HG2 H 1 1.512 0.003 . 1 . 1891 . . 187 LYS HG2 . 18663 1 1991 . 1 1 187 187 LYS HG3 H 1 1.512 0.003 . 1 . 1721 . . 187 LYS HG3 . 18663 1 1992 . 1 1 187 187 LYS HD2 H 1 1.682 0.002 . 1 . 1890 . . 187 LYS HD2 . 18663 1 1993 . 1 1 187 187 LYS HD3 H 1 1.682 0.002 . 1 . 1720 . . 187 LYS HD3 . 18663 1 1994 . 1 1 187 187 LYS CA C 13 55.781 . . 1 . 1711 . . 187 LYS CA . 18663 1 1995 . 1 1 187 187 LYS CB C 13 30.268 . . 1 . 1712 . . 187 LYS CB . 18663 1 1996 . 1 1 187 187 LYS CG C 13 24.436 . . 1 . 1714 . . 187 LYS CG . 18663 1 1997 . 1 1 187 187 LYS CD C 13 28.683 . . 1 . 1713 . . 187 LYS CD . 18663 1 1998 . 1 1 187 187 LYS N N 15 121.756 0.061 . 1 . 1719 . . 187 LYS N . 18663 1 1999 . 1 1 188 188 ALA H H 1 8.002 0.006 . 1 . 1724 . . 188 ALA H . 18663 1 2000 . 1 1 188 188 ALA HA H 1 4.333 0.002 . 1 . 1725 . . 188 ALA HA . 18663 1 2001 . 1 1 188 188 ALA HB1 H 1 1.468 0.001 . 1 . 1727 . . 188 ALA HB1 . 18663 1 2002 . 1 1 188 188 ALA HB2 H 1 1.468 0.001 . 1 . 1727 . . 188 ALA HB2 . 18663 1 2003 . 1 1 188 188 ALA HB3 H 1 1.468 0.001 . 1 . 1727 . . 188 ALA HB3 . 18663 1 2004 . 1 1 188 188 ALA CA C 13 52.541 . . 1 . 1722 . . 188 ALA CA . 18663 1 2005 . 1 1 188 188 ALA CB C 13 19.658 . . 1 . 1723 . . 188 ALA CB . 18663 1 2006 . 1 1 188 188 ALA N N 15 120.268 0.01 . 1 . 1726 . . 188 ALA N . 18663 1 2007 . 1 1 189 189 VAL H H 1 8.263 0.006 . 1 . 1732 . . 189 VAL H . 18663 1 2008 . 1 1 189 189 VAL HA H 1 5.020 0.006 . 1 . 1733 . . 189 VAL HA . 18663 1 2009 . 1 1 189 189 VAL HB H 1 2.012 0.005 . 1 . 1734 . . 189 VAL HB . 18663 1 2010 . 1 1 189 189 VAL HG11 H 1 0.816 0.002 . 2 . 1736 . . 189 VAL HG11 . 18663 1 2011 . 1 1 189 189 VAL HG12 H 1 0.816 0.002 . 2 . 1736 . . 189 VAL HG12 . 18663 1 2012 . 1 1 189 189 VAL HG13 H 1 0.816 0.002 . 2 . 1736 . . 189 VAL HG13 . 18663 1 2013 . 1 1 189 189 VAL HG21 H 1 0.848 0.003 . 2 . 1737 . . 189 VAL HG21 . 18663 1 2014 . 1 1 189 189 VAL HG22 H 1 0.848 0.003 . 2 . 1737 . . 189 VAL HG22 . 18663 1 2015 . 1 1 189 189 VAL HG23 H 1 0.848 0.003 . 2 . 1737 . . 189 VAL HG23 . 18663 1 2016 . 1 1 189 189 VAL CA C 13 61.436 . . 1 . 1728 . . 189 VAL CA . 18663 1 2017 . 1 1 189 189 VAL CB C 13 33.461 . . 1 . 1729 . . 189 VAL CB . 18663 1 2018 . 1 1 189 189 VAL CG1 C 13 21.405 . . 2 . 1730 . . 189 VAL CG1 . 18663 1 2019 . 1 1 189 189 VAL CG2 C 13 22.009 . . 2 . 1731 . . 189 VAL CG2 . 18663 1 2020 . 1 1 189 189 VAL N N 15 118.814 0.046 . 1 . 1735 . . 189 VAL N . 18663 1 2021 . 1 1 190 190 PHE H H 1 8.691 0.005 . 1 . 1741 . . 190 PHE H . 18663 1 2022 . 1 1 190 190 PHE HA H 1 4.941 0.003 . 1 . 1742 . . 190 PHE HA . 18663 1 2023 . 1 1 190 190 PHE HB2 H 1 3.409 0.007 . 2 . 1743 . . 190 PHE HB2 . 18663 1 2024 . 1 1 190 190 PHE HB3 H 1 2.964 0.003 . 2 . 1744 . . 190 PHE HB3 . 18663 1 2025 . 1 1 190 190 PHE HD1 H 1 6.971 0.001 . 3 . 1746 . . 190 PHE HD1 . 18663 1 2026 . 1 1 190 190 PHE HD2 H 1 6.971 0.001 . 3 . 1746 . . 190 PHE HD2 . 18663 1 2027 . 1 1 190 190 PHE CA C 13 56.305 . . 1 . 1738 . . 190 PHE CA . 18663 1 2028 . 1 1 190 190 PHE CB C 13 40.227 0.063 . 1 . 1739 . . 190 PHE CB . 18663 1 2029 . 1 1 190 190 PHE CD1 C 13 132.358 . . 3 . 1740 . . 190 PHE CD1 . 18663 1 2030 . 1 1 190 190 PHE N N 15 122.921 0.035 . 1 . 1745 . . 190 PHE N . 18663 1 2031 . 1 1 191 191 TYR H H 1 8.801 0.003 . 1 . 1749 . . 191 TYR H . 18663 1 2032 . 1 1 191 191 TYR HA H 1 4.801 0.002 . 1 . 1750 . . 191 TYR HA . 18663 1 2033 . 1 1 191 191 TYR HB2 H 1 2.563 0.001 . 2 . 1751 . . 191 TYR HB2 . 18663 1 2034 . 1 1 191 191 TYR HB3 H 1 2.538 0.002 . 2 . 1752 . . 191 TYR HB3 . 18663 1 2035 . 1 1 191 191 TYR CA C 13 57.052 . . 1 . 1747 . . 191 TYR CA . 18663 1 2036 . 1 1 191 191 TYR CB C 13 39.114 0.017 . 1 . 1748 . . 191 TYR CB . 18663 1 2037 . 1 1 191 191 TYR N N 15 120.704 0.024 . 1 . 1753 . . 191 TYR N . 18663 1 2038 . 1 1 192 192 LYS H H 1 8.286 0.004 . 1 . 1759 . . 192 LYS H . 18663 1 2039 . 1 1 192 192 LYS HA H 1 4.622 0.002 . 1 . 1760 . . 192 LYS HA . 18663 1 2040 . 1 1 192 192 LYS HB2 H 1 1.423 0.005 . 2 . 1761 . . 192 LYS HB2 . 18663 1 2041 . 1 1 192 192 LYS HB3 H 1 1.200 0.003 . 2 . 1762 . . 192 LYS HB3 . 18663 1 2042 . 1 1 192 192 LYS HG2 H 1 0.998 . . 1 . 1893 . . 192 LYS HG2 . 18663 1 2043 . 1 1 192 192 LYS HG3 H 1 0.998 . . 1 . 1767 . . 192 LYS HG3 . 18663 1 2044 . 1 1 192 192 LYS HD2 H 1 1.473 0.001 . 2 . 1763 . . 192 LYS HD2 . 18663 1 2045 . 1 1 192 192 LYS HD3 H 1 1.309 0.003 . 2 . 1764 . . 192 LYS HD3 . 18663 1 2046 . 1 1 192 192 LYS HE2 H 1 2.667 0.003 . 1 . 1892 . . 192 LYS HE2 . 18663 1 2047 . 1 1 192 192 LYS HE3 H 1 2.667 0.003 . 1 . 1766 . . 192 LYS HE3 . 18663 1 2048 . 1 1 192 192 LYS CA C 13 51.335 . . 1 . 1754 . . 192 LYS CA . 18663 1 2049 . 1 1 192 192 LYS CB C 13 35.276 . . 1 . 1755 . . 192 LYS CB . 18663 1 2050 . 1 1 192 192 LYS CG C 13 25.835 . . 1 . 1758 . . 192 LYS CG . 18663 1 2051 . 1 1 192 192 LYS CD C 13 29.077 . . 1 . 1756 . . 192 LYS CD . 18663 1 2052 . 1 1 192 192 LYS CE C 13 41.574 . . 1 . 1757 . . 192 LYS CE . 18663 1 2053 . 1 1 192 192 LYS N N 15 130.476 0.055 . 1 . 1765 . . 192 LYS N . 18663 1 2054 . 1 1 193 193 PRO HA H 1 4.157 0.002 . 1 . 1769 . . 193 PRO HA . 18663 1 2055 . 1 1 193 193 PRO CA C 13 61.772 . . 1 . 1768 . . 193 PRO CA . 18663 1 2056 . 1 1 194 194 HIS H H 1 8.443 0.003 . 1 . 1773 . . 194 HIS H . 18663 1 2057 . 1 1 194 194 HIS HA H 1 4.205 0.001 . 1 . 1774 . . 194 HIS HA . 18663 1 2058 . 1 1 194 194 HIS HB2 H 1 2.917 0.003 . 2 . 1775 . . 194 HIS HB2 . 18663 1 2059 . 1 1 194 194 HIS HB3 H 1 2.731 0.007 . 2 . 1776 . . 194 HIS HB3 . 18663 1 2060 . 1 1 194 194 HIS HD2 H 1 6.751 0.002 . 1 . 1777 . . 194 HIS HD2 . 18663 1 2061 . 1 1 194 194 HIS CA C 13 57.425 . . 1 . 1770 . . 194 HIS CA . 18663 1 2062 . 1 1 194 194 HIS CB C 13 30.438 . . 1 . 1771 . . 194 HIS CB . 18663 1 2063 . 1 1 194 194 HIS CD2 C 13 119.460 . . 1 . 1772 . . 194 HIS CD2 . 18663 1 2064 . 1 1 194 194 HIS N N 15 122.840 . . 1 . 1778 . . 194 HIS N . 18663 1 2065 . 1 1 195 195 GLU H H 1 8.270 0.004 . 1 . 1782 . . 195 GLU H . 18663 1 2066 . 1 1 195 195 GLU HA H 1 4.124 0.004 . 1 . 1783 . . 195 GLU HA . 18663 1 2067 . 1 1 195 195 GLU HB2 H 1 1.891 0.002 . 2 . 1784 . . 195 GLU HB2 . 18663 1 2068 . 1 1 195 195 GLU HB3 H 1 1.884 0.001 . 2 . 1785 . . 195 GLU HB3 . 18663 1 2069 . 1 1 195 195 GLU HG2 H 1 2.330 . . 2 . 1786 . . 195 GLU HG2 . 18663 1 2070 . 1 1 195 195 GLU HG3 H 1 2.155 0.003 . 2 . 1787 . . 195 GLU HG3 . 18663 1 2071 . 1 1 195 195 GLU CA C 13 56.185 0.012 . 1 . 1779 . . 195 GLU CA . 18663 1 2072 . 1 1 195 195 GLU CB C 13 30.041 0.005 . 1 . 1780 . . 195 GLU CB . 18663 1 2073 . 1 1 195 195 GLU CG C 13 36.406 . . 1 . 1781 . . 195 GLU CG . 18663 1 2074 . 1 1 195 195 GLU N N 15 117.265 0.019 . 1 . 1788 . . 195 GLU N . 18663 1 2075 . 1 1 196 196 GLU H H 1 7.915 0.009 . 1 . 1792 . . 196 GLU H . 18663 1 2076 . 1 1 196 196 GLU HA H 1 4.111 0.004 . 1 . 1793 . . 196 GLU HA . 18663 1 2077 . 1 1 196 196 GLU HB2 H 1 1.906 0.005 . 2 . 1794 . . 196 GLU HB2 . 18663 1 2078 . 1 1 196 196 GLU HB3 H 1 1.724 0.002 . 2 . 1795 . . 196 GLU HB3 . 18663 1 2079 . 1 1 196 196 GLU HG2 H 1 2.315 0.002 . 2 . 1796 . . 196 GLU HG2 . 18663 1 2080 . 1 1 196 196 GLU HG3 H 1 2.130 0.006 . 2 . 1797 . . 196 GLU HG3 . 18663 1 2081 . 1 1 196 196 GLU CA C 13 56.407 . . 1 . 1789 . . 196 GLU CA . 18663 1 2082 . 1 1 196 196 GLU CB C 13 30.094 0.025 . 1 . 1790 . . 196 GLU CB . 18663 1 2083 . 1 1 196 196 GLU CG C 13 36.320 0.012 . 1 . 1791 . . 196 GLU CG . 18663 1 2084 . 1 1 196 196 GLU N N 15 120.826 0.089 . 1 . 1798 . . 196 GLU N . 18663 1 2085 . 1 1 197 197 HIS H H 1 8.186 0.006 . 1 . 1802 . . 197 HIS H . 18663 1 2086 . 1 1 197 197 HIS HA H 1 4.410 0.002 . 1 . 1803 . . 197 HIS HA . 18663 1 2087 . 1 1 197 197 HIS HB2 H 1 2.867 0.001 . 2 . 1804 . . 197 HIS HB2 . 18663 1 2088 . 1 1 197 197 HIS HB3 H 1 2.799 0.003 . 2 . 1805 . . 197 HIS HB3 . 18663 1 2089 . 1 1 197 197 HIS HD2 H 1 6.773 0.001 . 1 . 1806 . . 197 HIS HD2 . 18663 1 2090 . 1 1 197 197 HIS CA C 13 56.578 0.012 . 1 . 1799 . . 197 HIS CA . 18663 1 2091 . 1 1 197 197 HIS CB C 13 30.168 0.013 . 1 . 1800 . . 197 HIS CB . 18663 1 2092 . 1 1 197 197 HIS CD2 C 13 119.428 . . 1 . 1801 . . 197 HIS CD2 . 18663 1 2093 . 1 1 197 197 HIS N N 15 120.259 0.056 . 1 . 1807 . . 197 HIS N . 18663 1 2094 . 1 1 199 199 ALA H H 1 8.242 0.007 . 1 . 1810 . . 199 ALA H . 18663 1 2095 . 1 1 199 199 ALA HA H 1 4.239 0.001 . 1 . 1811 . . 199 ALA HA . 18663 1 2096 . 1 1 199 199 ALA HB1 H 1 1.333 0.008 . 1 . 1813 . . 199 ALA HB1 . 18663 1 2097 . 1 1 199 199 ALA HB2 H 1 1.333 0.008 . 1 . 1813 . . 199 ALA HB2 . 18663 1 2098 . 1 1 199 199 ALA HB3 H 1 1.333 0.008 . 1 . 1813 . . 199 ALA HB3 . 18663 1 2099 . 1 1 199 199 ALA CA C 13 52.542 0.004 . 1 . 1808 . . 199 ALA CA . 18663 1 2100 . 1 1 199 199 ALA CB C 13 18.547 0.006 . 1 . 1809 . . 199 ALA CB . 18663 1 2101 . 1 1 199 199 ALA N N 15 125.034 0.024 . 1 . 1812 . . 199 ALA N . 18663 1 2102 . 1 1 200 200 PHE H H 1 8.267 0.003 . 1 . 1818 . . 200 PHE H . 18663 1 2103 . 1 1 200 200 PHE HA H 1 4.573 0.002 . 1 . 1819 . . 200 PHE HA . 18663 1 2104 . 1 1 200 200 PHE HB2 H 1 3.096 0.003 . 2 . 1820 . . 200 PHE HB2 . 18663 1 2105 . 1 1 200 200 PHE HB3 H 1 3.040 0.004 . 2 . 1821 . . 200 PHE HB3 . 18663 1 2106 . 1 1 200 200 PHE HD1 H 1 7.222 0.004 . 3 . 1823 . . 200 PHE HD1 . 18663 1 2107 . 1 1 200 200 PHE HD2 H 1 7.222 0.004 . 3 . 1823 . . 200 PHE HD2 . 18663 1 2108 . 1 1 200 200 PHE HE1 H 1 7.310 0.004 . 3 . 1824 . . 200 PHE HE1 . 18663 1 2109 . 1 1 200 200 PHE HE2 H 1 7.310 0.004 . 3 . 1824 . . 200 PHE HE2 . 18663 1 2110 . 1 1 200 200 PHE CA C 13 57.560 . . 1 . 1814 . . 200 PHE CA . 18663 1 2111 . 1 1 200 200 PHE CB C 13 39.164 . . 1 . 1815 . . 200 PHE CB . 18663 1 2112 . 1 1 200 200 PHE CD1 C 13 131.338 0.182 . 3 . 1816 . . 200 PHE CD1 . 18663 1 2113 . 1 1 200 200 PHE CE1 C 13 131.444 0.165 . 3 . 1817 . . 200 PHE CE1 . 18663 1 2114 . 1 1 200 200 PHE N N 15 119.544 0.049 . 1 . 1822 . . 200 PHE N . 18663 1 2115 . 1 1 201 201 GLU H H 1 8.404 0.007 . 1 . 1828 . . 201 GLU H . 18663 1 2116 . 1 1 201 201 GLU HA H 1 4.201 0.002 . 1 . 1829 . . 201 GLU HA . 18663 1 2117 . 1 1 201 201 GLU HB2 H 1 2.015 0.003 . 2 . 1830 . . 201 GLU HB2 . 18663 1 2118 . 1 1 201 201 GLU HB3 H 1 1.889 0.004 . 2 . 1831 . . 201 GLU HB3 . 18663 1 2119 . 1 1 201 201 GLU HG2 H 1 2.175 0.003 . 1 . 1894 . . 201 GLU HG2 . 18663 1 2120 . 1 1 201 201 GLU HG3 H 1 2.175 0.003 . 1 . 1833 . . 201 GLU HG3 . 18663 1 2121 . 1 1 201 201 GLU CA C 13 56.607 . . 1 . 1825 . . 201 GLU CA . 18663 1 2122 . 1 1 201 201 GLU CB C 13 29.538 . . 1 . 1826 . . 201 GLU CB . 18663 1 2123 . 1 1 201 201 GLU CG C 13 36.037 . . 1 . 1827 . . 201 GLU CG . 18663 1 2124 . 1 1 201 201 GLU N N 15 123.180 0.058 . 1 . 1832 . . 201 GLU N . 18663 1 2125 . 1 1 202 202 GLY H H 1 8.099 0.004 . 1 . 1835 . . 202 GLY H . 18663 1 2126 . 1 1 202 202 GLY HA2 H 1 3.910 0.006 . 2 . 1836 . . 202 GLY HA2 . 18663 1 2127 . 1 1 202 202 GLY HA3 H 1 3.901 0.006 . 2 . 1837 . . 202 GLY HA3 . 18663 1 2128 . 1 1 202 202 GLY CA C 13 45.438 . . 1 . 1834 . . 202 GLY CA . 18663 1 2129 . 1 1 202 202 GLY N N 15 109.590 0.031 . 1 . 1838 . . 202 GLY N . 18663 1 2130 . 1 1 203 203 GLY H H 1 8.285 0.005 . 1 . 1839 . . 203 GLY H . 18663 1 2131 . 1 1 203 203 GLY N N 15 108.748 0.079 . 1 . 1840 . . 203 GLY N . 18663 1 2132 . 1 1 204 204 ARG H H 1 8.222 0.002 . 1 . 1841 . . 204 ARG H . 18663 1 2133 . 1 1 204 204 ARG N N 15 120.506 0.034 . 1 . 1842 . . 204 ARG N . 18663 1 2134 . 1 1 205 205 GLY H H 1 8.489 0.004 . 1 . 1844 . . 205 GLY H . 18663 1 2135 . 1 1 205 205 GLY HA2 H 1 3.893 0.002 . 1 . 1895 . . 205 GLY HA2 . 18663 1 2136 . 1 1 205 205 GLY HA3 H 1 3.893 0.002 . 1 . 1846 . . 205 GLY HA3 . 18663 1 2137 . 1 1 205 205 GLY CA C 13 45.025 . . 1 . 1843 . . 205 GLY CA . 18663 1 2138 . 1 1 205 205 GLY N N 15 109.827 0.115 . 1 . 1845 . . 205 GLY N . 18663 1 2139 . 1 1 206 206 LYS H H 1 8.109 0.007 . 1 . 1849 . . 206 LYS H . 18663 1 2140 . 1 1 206 206 LYS HA H 1 4.256 0.005 . 1 . 1850 . . 206 LYS HA . 18663 1 2141 . 1 1 206 206 LYS HB2 H 1 1.749 0.001 . 2 . 1851 . . 206 LYS HB2 . 18663 1 2142 . 1 1 206 206 LYS HB3 H 1 1.638 0.001 . 2 . 1852 . . 206 LYS HB3 . 18663 1 2143 . 1 1 206 206 LYS CA C 13 56.194 . . 1 . 1847 . . 206 LYS CA . 18663 1 2144 . 1 1 206 206 LYS CB C 13 32.853 . . 1 . 1848 . . 206 LYS CB . 18663 1 2145 . 1 1 206 206 LYS N N 15 121.224 0.072 . 1 . 1853 . . 206 LYS N . 18663 1 2146 . 1 1 207 207 HIS H H 1 8.000 0.003 . 1 . 1857 . . 207 HIS H . 18663 1 2147 . 1 1 207 207 HIS HA H 1 4.421 0.003 . 1 . 1858 . . 207 HIS HA . 18663 1 2148 . 1 1 207 207 HIS HB2 H 1 3.147 0.005 . 2 . 1859 . . 207 HIS HB2 . 18663 1 2149 . 1 1 207 207 HIS HB3 H 1 2.990 0.003 . 2 . 1860 . . 207 HIS HB3 . 18663 1 2150 . 1 1 207 207 HIS HD2 H 1 7.015 0.001 . 1 . 1861 . . 207 HIS HD2 . 18663 1 2151 . 1 1 207 207 HIS CA C 13 57.497 . . 1 . 1854 . . 207 HIS CA . 18663 1 2152 . 1 1 207 207 HIS CB C 13 30.316 0.016 . 1 . 1855 . . 207 HIS CB . 18663 1 2153 . 1 1 207 207 HIS CD2 C 13 120.222 . . 1 . 1856 . . 207 HIS CD2 . 18663 1 2154 . 1 1 207 207 HIS N N 15 125.658 0.07 . 1 . 1862 . . 207 HIS N . 18663 1 stop_ save_