data_19518 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19518 _Entry.Title ; Solution NMR assignment of the heavy chain complex of the human cardiac myosin regulatory light chain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-09-23 _Entry.Accession_date 2013-09-23 _Entry.Last_release_date 2013-09-23 _Entry.Original_release_date 2013-09-23 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'Solution NMR assignments for the complex formed of two proteins, the regulatory light chain and its heavy chain binding site.' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Elena Rostkova . . . . 19518 2 Mathias Gautel . . . . 19518 3 Mark Pfuhl . . . . 19518 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 19518 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 788 19518 '15N chemical shifts' 203 19518 '1H chemical shifts' 1347 19518 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 . . 2019-07-12 2013-09-23 update BMRB 'update entry citation' 19518 1 . . 2014-01-29 2013-09-23 original author 'original release' 19518 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19518 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24414277 _Citation.Full_citation . _Citation.Title ; Solution NMR assignment of the heavy chain complex of the human cardiac myosin regulatory light chain ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 9 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 51 _Citation.Page_last 53 _Citation.Year 2014 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Elena Rostkova . . . . 19518 1 2 Mathias Gautel . . . . 19518 1 3 Mark Pfuhl . . . . 19518 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID contraction 19518 1 'heart muscle' 19518 1 'myosin binding protein C' 19518 1 phosphorylation 19518 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19518 _Assembly.ID 1 _Assembly.Name RLC/MyBS _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _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 . _Assembly.Molecular_mass 23000 _Assembly.Enzyme_commission_number . _Assembly.Details heterodimer _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 'light chain' 1 $RLC A . yes native no no . . . 19518 1 2 'heavy chain' 2 $HC B . yes native no no . . . 19518 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'muscle contraction' 19518 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RLC _Entity.Sf_category entity _Entity.Sf_framecode RLC _Entity.Entry_ID 19518 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name RLC _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MAPKKAKKRAGGANSNVFSM FEQTQIQEFKEAFTIMDQNR DGFIDKNDLRDTFAALGRVN VKNEEIDEMIKEAPGPINFT VFLTMFGEKLKGADPEETIL NAFKVFDPEGKGVLKADYVR EMLTTQAERFSKEEVDQMFA AFPPDVTGNLDYKNLVHIIT HGEEKD ; _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 166 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 P10916 . RLC . . . . . . . . . . . . . . 19518 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'regulation of muscle contraction' 19518 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 . 19518 1 2 . ALA . 19518 1 3 . PRO . 19518 1 4 . LYS . 19518 1 5 . LYS . 19518 1 6 . ALA . 19518 1 7 . LYS . 19518 1 8 . LYS . 19518 1 9 . ARG . 19518 1 10 . ALA . 19518 1 11 . GLY . 19518 1 12 . GLY . 19518 1 13 . ALA . 19518 1 14 . ASN . 19518 1 15 . SER . 19518 1 16 . ASN . 19518 1 17 . VAL . 19518 1 18 . PHE . 19518 1 19 . SER . 19518 1 20 . MET . 19518 1 21 . PHE . 19518 1 22 . GLU . 19518 1 23 . GLN . 19518 1 24 . THR . 19518 1 25 . GLN . 19518 1 26 . ILE . 19518 1 27 . GLN . 19518 1 28 . GLU . 19518 1 29 . PHE . 19518 1 30 . LYS . 19518 1 31 . GLU . 19518 1 32 . ALA . 19518 1 33 . PHE . 19518 1 34 . THR . 19518 1 35 . ILE . 19518 1 36 . MET . 19518 1 37 . ASP . 19518 1 38 . GLN . 19518 1 39 . ASN . 19518 1 40 . ARG . 19518 1 41 . ASP . 19518 1 42 . GLY . 19518 1 43 . PHE . 19518 1 44 . ILE . 19518 1 45 . ASP . 19518 1 46 . LYS . 19518 1 47 . ASN . 19518 1 48 . ASP . 19518 1 49 . LEU . 19518 1 50 . ARG . 19518 1 51 . ASP . 19518 1 52 . THR . 19518 1 53 . PHE . 19518 1 54 . ALA . 19518 1 55 . ALA . 19518 1 56 . LEU . 19518 1 57 . GLY . 19518 1 58 . ARG . 19518 1 59 . VAL . 19518 1 60 . ASN . 19518 1 61 . VAL . 19518 1 62 . LYS . 19518 1 63 . ASN . 19518 1 64 . GLU . 19518 1 65 . GLU . 19518 1 66 . ILE . 19518 1 67 . ASP . 19518 1 68 . GLU . 19518 1 69 . MET . 19518 1 70 . ILE . 19518 1 71 . LYS . 19518 1 72 . GLU . 19518 1 73 . ALA . 19518 1 74 . PRO . 19518 1 75 . GLY . 19518 1 76 . PRO . 19518 1 77 . ILE . 19518 1 78 . ASN . 19518 1 79 . PHE . 19518 1 80 . THR . 19518 1 81 . VAL . 19518 1 82 . PHE . 19518 1 83 . LEU . 19518 1 84 . THR . 19518 1 85 . MET . 19518 1 86 . PHE . 19518 1 87 . GLY . 19518 1 88 . GLU . 19518 1 89 . LYS . 19518 1 90 . LEU . 19518 1 91 . LYS . 19518 1 92 . GLY . 19518 1 93 . ALA . 19518 1 94 . ASP . 19518 1 95 . PRO . 19518 1 96 . GLU . 19518 1 97 . GLU . 19518 1 98 . THR . 19518 1 99 . ILE . 19518 1 100 . LEU . 19518 1 101 . ASN . 19518 1 102 . ALA . 19518 1 103 . PHE . 19518 1 104 . LYS . 19518 1 105 . VAL . 19518 1 106 . PHE . 19518 1 107 . ASP . 19518 1 108 . PRO . 19518 1 109 . GLU . 19518 1 110 . GLY . 19518 1 111 . LYS . 19518 1 112 . GLY . 19518 1 113 . VAL . 19518 1 114 . LEU . 19518 1 115 . LYS . 19518 1 116 . ALA . 19518 1 117 . ASP . 19518 1 118 . TYR . 19518 1 119 . VAL . 19518 1 120 . ARG . 19518 1 121 . GLU . 19518 1 122 . MET . 19518 1 123 . LEU . 19518 1 124 . THR . 19518 1 125 . THR . 19518 1 126 . GLN . 19518 1 127 . ALA . 19518 1 128 . GLU . 19518 1 129 . ARG . 19518 1 130 . PHE . 19518 1 131 . SER . 19518 1 132 . LYS . 19518 1 133 . GLU . 19518 1 134 . GLU . 19518 1 135 . VAL . 19518 1 136 . ASP . 19518 1 137 . GLN . 19518 1 138 . MET . 19518 1 139 . PHE . 19518 1 140 . ALA . 19518 1 141 . ALA . 19518 1 142 . PHE . 19518 1 143 . PRO . 19518 1 144 . PRO . 19518 1 145 . ASP . 19518 1 146 . VAL . 19518 1 147 . THR . 19518 1 148 . GLY . 19518 1 149 . ASN . 19518 1 150 . LEU . 19518 1 151 . ASP . 19518 1 152 . TYR . 19518 1 153 . LYS . 19518 1 154 . ASN . 19518 1 155 . LEU . 19518 1 156 . VAL . 19518 1 157 . HIS . 19518 1 158 . ILE . 19518 1 159 . ILE . 19518 1 160 . THR . 19518 1 161 . HIS . 19518 1 162 . GLY . 19518 1 163 . GLU . 19518 1 164 . GLU . 19518 1 165 . LYS . 19518 1 166 . ASP . 19518 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 19518 1 . ALA 2 2 19518 1 . PRO 3 3 19518 1 . LYS 4 4 19518 1 . LYS 5 5 19518 1 . ALA 6 6 19518 1 . LYS 7 7 19518 1 . LYS 8 8 19518 1 . ARG 9 9 19518 1 . ALA 10 10 19518 1 . GLY 11 11 19518 1 . GLY 12 12 19518 1 . ALA 13 13 19518 1 . ASN 14 14 19518 1 . SER 15 15 19518 1 . ASN 16 16 19518 1 . VAL 17 17 19518 1 . PHE 18 18 19518 1 . SER 19 19 19518 1 . MET 20 20 19518 1 . PHE 21 21 19518 1 . GLU 22 22 19518 1 . GLN 23 23 19518 1 . THR 24 24 19518 1 . GLN 25 25 19518 1 . ILE 26 26 19518 1 . GLN 27 27 19518 1 . GLU 28 28 19518 1 . PHE 29 29 19518 1 . LYS 30 30 19518 1 . GLU 31 31 19518 1 . ALA 32 32 19518 1 . PHE 33 33 19518 1 . THR 34 34 19518 1 . ILE 35 35 19518 1 . MET 36 36 19518 1 . ASP 37 37 19518 1 . GLN 38 38 19518 1 . ASN 39 39 19518 1 . ARG 40 40 19518 1 . ASP 41 41 19518 1 . GLY 42 42 19518 1 . PHE 43 43 19518 1 . ILE 44 44 19518 1 . ASP 45 45 19518 1 . LYS 46 46 19518 1 . ASN 47 47 19518 1 . ASP 48 48 19518 1 . LEU 49 49 19518 1 . ARG 50 50 19518 1 . ASP 51 51 19518 1 . THR 52 52 19518 1 . PHE 53 53 19518 1 . ALA 54 54 19518 1 . ALA 55 55 19518 1 . LEU 56 56 19518 1 . GLY 57 57 19518 1 . ARG 58 58 19518 1 . VAL 59 59 19518 1 . ASN 60 60 19518 1 . VAL 61 61 19518 1 . LYS 62 62 19518 1 . ASN 63 63 19518 1 . GLU 64 64 19518 1 . GLU 65 65 19518 1 . ILE 66 66 19518 1 . ASP 67 67 19518 1 . GLU 68 68 19518 1 . MET 69 69 19518 1 . ILE 70 70 19518 1 . LYS 71 71 19518 1 . GLU 72 72 19518 1 . ALA 73 73 19518 1 . PRO 74 74 19518 1 . GLY 75 75 19518 1 . PRO 76 76 19518 1 . ILE 77 77 19518 1 . ASN 78 78 19518 1 . PHE 79 79 19518 1 . THR 80 80 19518 1 . VAL 81 81 19518 1 . PHE 82 82 19518 1 . LEU 83 83 19518 1 . THR 84 84 19518 1 . MET 85 85 19518 1 . PHE 86 86 19518 1 . GLY 87 87 19518 1 . GLU 88 88 19518 1 . LYS 89 89 19518 1 . LEU 90 90 19518 1 . LYS 91 91 19518 1 . GLY 92 92 19518 1 . ALA 93 93 19518 1 . ASP 94 94 19518 1 . PRO 95 95 19518 1 . GLU 96 96 19518 1 . GLU 97 97 19518 1 . THR 98 98 19518 1 . ILE 99 99 19518 1 . LEU 100 100 19518 1 . ASN 101 101 19518 1 . ALA 102 102 19518 1 . PHE 103 103 19518 1 . LYS 104 104 19518 1 . VAL 105 105 19518 1 . PHE 106 106 19518 1 . ASP 107 107 19518 1 . PRO 108 108 19518 1 . GLU 109 109 19518 1 . GLY 110 110 19518 1 . LYS 111 111 19518 1 . GLY 112 112 19518 1 . VAL 113 113 19518 1 . LEU 114 114 19518 1 . LYS 115 115 19518 1 . ALA 116 116 19518 1 . ASP 117 117 19518 1 . TYR 118 118 19518 1 . VAL 119 119 19518 1 . ARG 120 120 19518 1 . GLU 121 121 19518 1 . MET 122 122 19518 1 . LEU 123 123 19518 1 . THR 124 124 19518 1 . THR 125 125 19518 1 . GLN 126 126 19518 1 . ALA 127 127 19518 1 . GLU 128 128 19518 1 . ARG 129 129 19518 1 . PHE 130 130 19518 1 . SER 131 131 19518 1 . LYS 132 132 19518 1 . GLU 133 133 19518 1 . GLU 134 134 19518 1 . VAL 135 135 19518 1 . ASP 136 136 19518 1 . GLN 137 137 19518 1 . MET 138 138 19518 1 . PHE 139 139 19518 1 . ALA 140 140 19518 1 . ALA 141 141 19518 1 . PHE 142 142 19518 1 . PRO 143 143 19518 1 . PRO 144 144 19518 1 . ASP 145 145 19518 1 . VAL 146 146 19518 1 . THR 147 147 19518 1 . GLY 148 148 19518 1 . ASN 149 149 19518 1 . LEU 150 150 19518 1 . ASP 151 151 19518 1 . TYR 152 152 19518 1 . LYS 153 153 19518 1 . ASN 154 154 19518 1 . LEU 155 155 19518 1 . VAL 156 156 19518 1 . HIS 157 157 19518 1 . ILE 158 158 19518 1 . ILE 159 159 19518 1 . THR 160 160 19518 1 . HIS 161 161 19518 1 . GLY 162 162 19518 1 . GLU 163 163 19518 1 . GLU 164 164 19518 1 . LYS 165 165 19518 1 . ASP 166 166 19518 1 stop_ save_ save_HC _Entity.Sf_category entity _Entity.Sf_framecode HC _Entity.Entry_ID 19518 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name HC _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; ERRDSLLVIQWNIRAFMGVK NWPWMKLYFKIK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'sequence starts at residue number 806' _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 32 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'regulatory light chain binding site' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 P12883 . HC . . . . . . . . . . . . . . 19518 2 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'muscle contraction' 19518 2 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 1 806 GLU . 19518 2 2 807 ARG . 19518 2 3 808 ARG . 19518 2 4 809 ASP . 19518 2 5 810 SER . 19518 2 6 811 LEU . 19518 2 7 812 LEU . 19518 2 8 813 VAL . 19518 2 9 814 ILE . 19518 2 10 815 GLN . 19518 2 11 816 TRP . 19518 2 12 817 ASN . 19518 2 13 818 ILE . 19518 2 14 819 ARG . 19518 2 15 820 ALA . 19518 2 16 821 PHE . 19518 2 17 822 MET . 19518 2 18 823 GLY . 19518 2 19 824 VAL . 19518 2 20 825 LYS . 19518 2 21 826 ASN . 19518 2 22 827 TRP . 19518 2 23 828 PRO . 19518 2 24 829 TRP . 19518 2 25 830 MET . 19518 2 26 831 LYS . 19518 2 27 832 LEU . 19518 2 28 833 TYR . 19518 2 29 834 PHE . 19518 2 30 835 LYS . 19518 2 31 836 ILE . 19518 2 32 837 LYS . 19518 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLU 1 1 19518 2 . ARG 2 2 19518 2 . ARG 3 3 19518 2 . ASP 4 4 19518 2 . SER 5 5 19518 2 . LEU 6 6 19518 2 . LEU 7 7 19518 2 . VAL 8 8 19518 2 . ILE 9 9 19518 2 . GLN 10 10 19518 2 . TRP 11 11 19518 2 . ASN 12 12 19518 2 . ILE 13 13 19518 2 . ARG 14 14 19518 2 . ALA 15 15 19518 2 . PHE 16 16 19518 2 . MET 17 17 19518 2 . GLY 18 18 19518 2 . VAL 19 19 19518 2 . LYS 20 20 19518 2 . ASN 21 21 19518 2 . TRP 22 22 19518 2 . PRO 23 23 19518 2 . TRP 24 24 19518 2 . MET 25 25 19518 2 . LYS 26 26 19518 2 . LEU 27 27 19518 2 . TYR 28 28 19518 2 . PHE 29 29 19518 2 . LYS 30 30 19518 2 . ILE 31 31 19518 2 . LYS 32 32 19518 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 19518 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $RLC . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . MYL2 . 19518 1 2 2 $HC . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . MYH7 . 19518 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 19518 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $RLC . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 BL21* . . . . pet8c . . . 19518 1 2 2 $HC . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 BL21* . . . . pet8c . . . 19518 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_N _Sample.Sf_category sample _Sample.Sf_framecode N _Sample.Entry_ID 19518 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 RLC '[U-95% 15N]' . . 1 $RLC . . 0.25 . . mM 0.01 . . . 19518 1 2 HC '[U-95% 15N]' . . 2 $HC . . 0.25 . . mM 0.01 . . . 19518 1 3 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 19518 1 4 Arginine 'natural abundance' . . . . . . 50 . . mM . . . . 19518 1 5 'Glutamic acid' 'natural abundance' . . . . . . 50 . . mM . . . . 19518 1 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 19518 1 7 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 19518 1 stop_ save_ save_NC _Sample.Sf_category sample _Sample.Sf_framecode NC _Sample.Entry_ID 19518 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 2 _Sample.Solvent_system '95% H2O/5% 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 RLC '[U-95% 13C; U-95% 15N]' . . 1 $RLC . . 0.25 . . mM 0.01 . . . 19518 2 2 HC '[U-95% 13C; U-95% 15N]' . . 2 $HC . . 0.25 . . mM 0.01 . . . 19518 2 3 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 19518 2 4 Arginine 'natural abundance' . . . . . . 50 . . mM . . . . 19518 2 5 'Glutamic acid' 'natural abundance' . . . . . . 50 . . mM . . . . 19518 2 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 19518 2 7 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 19518 2 stop_ save_ save_ND _Sample.Sf_category sample _Sample.Sf_framecode ND _Sample.Entry_ID 19518 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 3 _Sample.Solvent_system '95% H2O/5% 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 RLC '[U-95% 15N; U-85% 2H]' . . 1 $RLC . . 0.25 . . mM 0.01 . . . 19518 3 2 HC '[U-95% 15N; U-85% 2H]]' . . 2 $HC . . 0.25 . . mM 0.01 . . . 19518 3 3 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 19518 3 4 Arginine 'natural abundance' . . . . . . 50 . . mM . . . . 19518 3 5 'Glutamic acid' 'natural abundance' . . . . . . 50 . . mM . . . . 19518 3 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 19518 3 7 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 19518 3 stop_ save_ save_NCD _Sample.Sf_category sample _Sample.Sf_framecode NCD _Sample.Entry_ID 19518 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 4 _Sample.Solvent_system '95% H2O/5% 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 RLC '[U-95% 13C; U-90% 15N; U-85% 2H]' . . 1 $RLC . . 0.25 . . mM 0.01 . . . 19518 4 2 HC '[U-95% 13C; U-95% 15N; U-85% 2H]' . . 2 $HC . . 0.25 . . mM 0.01 . . . 19518 4 3 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 19518 4 4 Arginine 'natural abundance' . . . . . . 50 . . mM . . . . 19518 4 5 'Glutamic acid' 'natural abundance' . . . . . . 50 . . mM . . . . 19518 4 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 19518 4 7 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 19518 4 stop_ save_ save_NC_D2O _Sample.Sf_category sample _Sample.Sf_framecode NC_D2O _Sample.Entry_ID 19518 _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 2 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 RLC '[U-95% 13C; U-95% 15N]' . . 1 $RLC . . 0.25 . . mM 0.01 . . . 19518 5 2 HC '[U-95% 13C; U-95% 15N]' . . 2 $HC . . 0.25 . . mM 0.01 . . . 19518 5 3 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 19518 5 4 Arginine 'natural abundance' . . . . . . 50 . . mM . . . . 19518 5 5 'Glutamic acid' 'natural abundance' . . . . . . 50 . . mM . . . . 19518 5 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 19518 5 7 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 19518 5 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 19518 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 50 0.5 mM 19518 1 pH 7.2 0.05 pH 19518 1 pressure 1 0.01 atm 19518 1 temperature 298 0.1 K 19518 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 19518 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.0 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 19518 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 19518 1 processing 19518 1 stop_ save_ save_CCPN_Analysis _Software.Sf_category software _Software.Sf_framecode CCPN_Analysis _Software.Entry_ID 19518 _Software.ID 2 _Software.Type . _Software.Name CCPN_Analysis _Software.Version 2.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 19518 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19518 2 'peak picking' 19518 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_k700 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode k700 _NMR_spectrometer.Entry_ID 19518 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'KCL Centre for Biomolecular Spectroscopy' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_v800 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode v800 _NMR_spectrometer.Entry_ID 19518 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details NIMR _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_v900 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode v900 _NMR_spectrometer.Entry_ID 19518 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details 'Henry Wellcome Building NMR Centre, Birmingham' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 19518 _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 k700 Bruker Avance . 700 'KCL Centre for Biomolecular Spectroscopy' . . 19518 1 2 v800 Varian INOVA . 800 NIMR . . 19518 1 3 v900 Varian INOVA . 900 'Henry Wellcome Building NMR Centre, Birmingham' . . 19518 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 19518 _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 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $N isotropic . . 1 $sample_conditions_1 . . . 1 $k700 . . . . . . . . . . . . . . . . 19518 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $N isotropic . . 1 $sample_conditions_1 . . . 2 $v800 . . . . . . . . . . . . . . . . 19518 1 3 '3D HNCACB' no . . . . . . . . . . 4 $NCD isotropic . . 1 $sample_conditions_1 . . . 3 $v900 . . . . . . . . . . . . . . . . 19518 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 4 $NCD isotropic . . 1 $sample_conditions_1 . . . 1 $k700 . . . . . . . . . . . . . . . . 19518 1 5 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 5 $NC_D2O isotropic . . 1 $sample_conditions_1 . . . 3 $v900 . . . . . . . . . . . . . . . . 19518 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 3 $ND isotropic . . 1 $sample_conditions_1 . . . 2 $v800 . . . . . . . . . . . . . . . . 19518 1 7 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 5 $NC_D2O isotropic . . 1 $sample_conditions_1 . . . 1 $k700 . . . . . . . . . . . . . . . . 19518 1 8 '3D HNCO' no . . . . . . . . . . 2 $NC isotropic . . 1 $sample_conditions_1 . . . 1 $k700 . . . . . . . . . . . . . . . . 19518 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 19518 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.25144953 . . . . . 19518 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal indirect 1.0 . . . . . 19518 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.10132918 . . . . . 19518 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_RLCassignment _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode RLCassignment _Assigned_chem_shift_list.Entry_ID 19518 _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 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.15 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 'averaging over spectra' _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 19518 1 2 '3D 1H-15N NOESY' . . . 19518 1 5 '3D 1H-13C NOESY aliphatic' . . . 19518 1 7 '3D 1H-13C NOESY aromatic' . . . 19518 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 PRO C C 13 176.527 0.000 . 1 . . . . . 3 PRO C . 19518 1 2 . 1 1 4 4 LYS H H 1 8.314 0.003 . 1 . . . . . 4 LYS H . 19518 1 3 . 1 1 4 4 LYS HA H 1 4.259 0.008 . 1 . . . . . 4 LYS HA . 19518 1 4 . 1 1 4 4 LYS HB2 H 1 1.668 0.012 . 1 . . . . . 4 LYS HB2 . 19518 1 5 . 1 1 4 4 LYS HB3 H 1 1.668 0.012 . 1 . . . . . 4 LYS HB3 . 19518 1 6 . 1 1 4 4 LYS HG2 H 1 1.302 0.002 . 1 . . . . . 4 LYS HG2 . 19518 1 7 . 1 1 4 4 LYS HG3 H 1 1.302 0.002 . 1 . . . . . 4 LYS HG3 . 19518 1 8 . 1 1 4 4 LYS HE2 H 1 2.869 0.000 . 1 . . . . . 4 LYS HE2 . 19518 1 9 . 1 1 4 4 LYS HE3 H 1 2.869 0.000 . 1 . . . . . 4 LYS HE3 . 19518 1 10 . 1 1 4 4 LYS C C 13 176.384 0.000 . 1 . . . . . 4 LYS C . 19518 1 11 . 1 1 4 4 LYS CA C 13 56.229 0.074 . 1 . . . . . 4 LYS CA . 19518 1 12 . 1 1 4 4 LYS CB C 13 32.917 0.047 . 1 . . . . . 4 LYS CB . 19518 1 13 . 1 1 4 4 LYS CG C 13 24.758 0.000 . 1 . . . . . 4 LYS CG . 19518 1 14 . 1 1 4 4 LYS CE C 13 41.988 0.000 . 1 . . . . . 4 LYS CE . 19518 1 15 . 1 1 4 4 LYS N N 15 122.153 0.010 . 1 . . . . . 4 LYS N . 19518 1 16 . 1 1 5 5 LYS H H 1 8.220 0.017 . 1 . . . . . 5 LYS H . 19518 1 17 . 1 1 5 5 LYS HA H 1 4.187 0.007 . 1 . . . . . 5 LYS HA . 19518 1 18 . 1 1 5 5 LYS HB2 H 1 1.644 0.005 . 1 . . . . . 5 LYS HB2 . 19518 1 19 . 1 1 5 5 LYS HB3 H 1 1.644 0.005 . 1 . . . . . 5 LYS HB3 . 19518 1 20 . 1 1 5 5 LYS HG2 H 1 1.311 0.000 . 1 . . . . . 5 LYS HG2 . 19518 1 21 . 1 1 5 5 LYS HG3 H 1 1.311 0.000 . 1 . . . . . 5 LYS HG3 . 19518 1 22 . 1 1 5 5 LYS HE2 H 1 2.826 0.000 . 1 . . . . . 5 LYS HE2 . 19518 1 23 . 1 1 5 5 LYS HE3 H 1 2.826 0.000 . 1 . . . . . 5 LYS HE3 . 19518 1 24 . 1 1 5 5 LYS C C 13 176.146 0.000 . 1 . . . . . 5 LYS C . 19518 1 25 . 1 1 5 5 LYS CA C 13 56.039 0.082 . 1 . . . . . 5 LYS CA . 19518 1 26 . 1 1 5 5 LYS CB C 13 32.890 0.116 . 1 . . . . . 5 LYS CB . 19518 1 27 . 1 1 5 5 LYS CG C 13 24.859 0.000 . 1 . . . . . 5 LYS CG . 19518 1 28 . 1 1 5 5 LYS CE C 13 41.844 0.000 . 1 . . . . . 5 LYS CE . 19518 1 29 . 1 1 5 5 LYS N N 15 122.930 0.054 . 1 . . . . . 5 LYS N . 19518 1 30 . 1 1 6 6 ALA H H 1 8.253 0.005 . 1 . . . . . 6 ALA H . 19518 1 31 . 1 1 6 6 ALA HA H 1 4.215 0.012 . 1 . . . . . 6 ALA HA . 19518 1 32 . 1 1 6 6 ALA HB1 H 1 1.216 0.034 . 1 . . . . . 6 ALA HB1 . 19518 1 33 . 1 1 6 6 ALA HB2 H 1 1.216 0.034 . 1 . . . . . 6 ALA HB2 . 19518 1 34 . 1 1 6 6 ALA HB3 H 1 1.216 0.034 . 1 . . . . . 6 ALA HB3 . 19518 1 35 . 1 1 6 6 ALA CA C 13 52.241 0.142 . 1 . . . . . 6 ALA CA . 19518 1 36 . 1 1 6 6 ALA CB C 13 19.349 0.144 . 1 . . . . . 6 ALA CB . 19518 1 37 . 1 1 6 6 ALA N N 15 125.758 0.060 . 1 . . . . . 6 ALA N . 19518 1 38 . 1 1 7 7 LYS H H 1 8.272 0.005 . 1 . . . . . 7 LYS H . 19518 1 39 . 1 1 7 7 LYS HA H 1 4.186 0.013 . 1 . . . . . 7 LYS HA . 19518 1 40 . 1 1 7 7 LYS HB2 H 1 1.641 0.014 . 1 . . . . . 7 LYS HB2 . 19518 1 41 . 1 1 7 7 LYS HB3 H 1 1.645 0.014 . 1 . . . . . 7 LYS HB3 . 19518 1 42 . 1 1 7 7 LYS HG2 H 1 1.309 0.005 . 1 . . . . . 7 LYS HG2 . 19518 1 43 . 1 1 7 7 LYS HG3 H 1 1.309 0.005 . 1 . . . . . 7 LYS HG3 . 19518 1 44 . 1 1 7 7 LYS HD2 H 1 1.661 0.000 . 1 . . . . . 7 LYS HD2 . 19518 1 45 . 1 1 7 7 LYS HD3 H 1 1.661 0.000 . 1 . . . . . 7 LYS HD3 . 19518 1 46 . 1 1 7 7 LYS HE2 H 1 2.874 0.000 . 1 . . . . . 7 LYS HE2 . 19518 1 47 . 1 1 7 7 LYS HE3 H 1 2.874 0.000 . 1 . . . . . 7 LYS HE3 . 19518 1 48 . 1 1 7 7 LYS C C 13 176.375 0.000 . 1 . . . . . 7 LYS C . 19518 1 49 . 1 1 7 7 LYS CA C 13 56.245 0.051 . 1 . . . . . 7 LYS CA . 19518 1 50 . 1 1 7 7 LYS CB C 13 32.938 0.049 . 1 . . . . . 7 LYS CB . 19518 1 51 . 1 1 7 7 LYS CG C 13 25.078 0.000 . 1 . . . . . 7 LYS CG . 19518 1 52 . 1 1 7 7 LYS CD C 13 28.555 0.000 . 1 . . . . . 7 LYS CD . 19518 1 53 . 1 1 7 7 LYS CE C 13 41.828 0.000 . 1 . . . . . 7 LYS CE . 19518 1 54 . 1 1 7 7 LYS N N 15 121.721 0.101 . 1 . . . . . 7 LYS N . 19518 1 55 . 1 1 8 8 LYS H H 1 8.268 0.011 . 1 . . . . . 8 LYS H . 19518 1 56 . 1 1 8 8 LYS HA H 1 4.234 0.006 . 1 . . . . . 8 LYS HA . 19518 1 57 . 1 1 8 8 LYS HB2 H 1 1.627 0.006 . 1 . . . . . 8 LYS HB2 . 19518 1 58 . 1 1 8 8 LYS HB3 H 1 1.627 0.006 . 1 . . . . . 8 LYS HB3 . 19518 1 59 . 1 1 8 8 LYS HG2 H 1 1.353 0.004 . 1 . . . . . 8 LYS HG2 . 19518 1 60 . 1 1 8 8 LYS HG3 H 1 1.353 0.004 . 1 . . . . . 8 LYS HG3 . 19518 1 61 . 1 1 8 8 LYS HD2 H 1 1.564 0.000 . 1 . . . . . 8 LYS HD2 . 19518 1 62 . 1 1 8 8 LYS HD3 H 1 1.564 0.000 . 1 . . . . . 8 LYS HD3 . 19518 1 63 . 1 1 8 8 LYS HE2 H 1 2.867 0.000 . 1 . . . . . 8 LYS HE2 . 19518 1 64 . 1 1 8 8 LYS HE3 H 1 2.867 0.000 . 1 . . . . . 8 LYS HE3 . 19518 1 65 . 1 1 8 8 LYS C C 13 176.375 0.000 . 1 . . . . . 8 LYS C . 19518 1 66 . 1 1 8 8 LYS CA C 13 56.136 0.113 . 1 . . . . . 8 LYS CA . 19518 1 67 . 1 1 8 8 LYS CB C 13 32.869 0.021 . 1 . . . . . 8 LYS CB . 19518 1 68 . 1 1 8 8 LYS CG C 13 25.016 0.039 . 1 . . . . . 8 LYS CG . 19518 1 69 . 1 1 8 8 LYS CD C 13 28.758 0.000 . 1 . . . . . 8 LYS CD . 19518 1 70 . 1 1 8 8 LYS CE C 13 41.828 0.000 . 1 . . . . . 8 LYS CE . 19518 1 71 . 1 1 8 8 LYS N N 15 122.118 0.066 . 1 . . . . . 8 LYS N . 19518 1 72 . 1 1 9 9 ARG H H 1 8.315 0.007 . 1 . . . . . 9 ARG H . 19518 1 73 . 1 1 9 9 ARG HA H 1 4.188 0.018 . 1 . . . . . 9 ARG HA . 19518 1 74 . 1 1 9 9 ARG HB2 H 1 1.663 0.005 . 1 . . . . . 9 ARG HB2 . 19518 1 75 . 1 1 9 9 ARG HB3 H 1 1.663 0.005 . 1 . . . . . 9 ARG HB3 . 19518 1 76 . 1 1 9 9 ARG HG2 H 1 1.444 0.001 . 1 . . . . . 9 ARG HG2 . 19518 1 77 . 1 1 9 9 ARG HG3 H 1 1.444 0.001 . 1 . . . . . 9 ARG HG3 . 19518 1 78 . 1 1 9 9 ARG HD2 H 1 2.978 0.000 . 1 . . . . . 9 ARG HD2 . 19518 1 79 . 1 1 9 9 ARG HD3 H 1 2.978 0.000 . 1 . . . . . 9 ARG HD3 . 19518 1 80 . 1 1 9 9 ARG C C 13 175.957 0.000 . 1 . . . . . 9 ARG C . 19518 1 81 . 1 1 9 9 ARG CA C 13 55.967 0.087 . 1 . . . . . 9 ARG CA . 19518 1 82 . 1 1 9 9 ARG CB C 13 30.560 0.087 . 1 . . . . . 9 ARG CB . 19518 1 83 . 1 1 9 9 ARG CG C 13 27.179 0.015 . 1 . . . . . 9 ARG CG . 19518 1 84 . 1 1 9 9 ARG CD C 13 43.381 0.000 . 1 . . . . . 9 ARG CD . 19518 1 85 . 1 1 9 9 ARG N N 15 123.415 0.090 . 1 . . . . . 9 ARG N . 19518 1 86 . 1 1 10 10 ALA H H 1 8.301 0.016 . 1 . . . . . 10 ALA H . 19518 1 87 . 1 1 10 10 ALA HA H 1 4.200 0.012 . 1 . . . . . 10 ALA HA . 19518 1 88 . 1 1 10 10 ALA HB1 H 1 1.187 0.009 . 1 . . . . . 10 ALA HB1 . 19518 1 89 . 1 1 10 10 ALA HB2 H 1 1.187 0.009 . 1 . . . . . 10 ALA HB2 . 19518 1 90 . 1 1 10 10 ALA HB3 H 1 1.187 0.009 . 1 . . . . . 10 ALA HB3 . 19518 1 91 . 1 1 10 10 ALA C C 13 178.045 0.000 . 1 . . . . . 10 ALA C . 19518 1 92 . 1 1 10 10 ALA CA C 13 52.53 0.15 . 1 . . . . . 10 ALA CA . 19518 1 93 . 1 1 10 10 ALA CB C 13 19.113 0.027 . 1 . . . . . 10 ALA CB . 19518 1 94 . 1 1 10 10 ALA N N 15 126.062 0.074 . 1 . . . . . 10 ALA N . 19518 1 95 . 1 1 11 11 GLY H H 1 8.270 0.009 . 1 . . . . . 11 GLY H . 19518 1 96 . 1 1 11 11 GLY HA2 H 1 4.214 0.002 . 1 . . . . . 11 GLY HA2 . 19518 1 97 . 1 1 11 11 GLY HA3 H 1 4.214 0.002 . 1 . . . . . 11 GLY HA3 . 19518 1 98 . 1 1 11 11 GLY C C 13 174.678 0.000 . 1 . . . . . 11 GLY C . 19518 1 99 . 1 1 11 11 GLY CA C 13 45.391 0.113 . 1 . . . . . 11 GLY CA . 19518 1 100 . 1 1 11 11 GLY N N 15 108.608 0.061 . 1 . . . . . 11 GLY N . 19518 1 101 . 1 1 12 12 GLY H H 1 8.131 0.007 . 1 . . . . . 12 GLY H . 19518 1 102 . 1 1 12 12 GLY HA2 H 1 3.831 0.003 . 1 . . . . . 12 GLY HA2 . 19518 1 103 . 1 1 12 12 GLY HA3 H 1 3.829 0.005 . 1 . . . . . 12 GLY HA3 . 19518 1 104 . 1 1 12 12 GLY C C 13 174.152 0.000 . 1 . . . . . 12 GLY C . 19518 1 105 . 1 1 12 12 GLY CA C 13 45.124 0.105 . 1 . . . . . 12 GLY CA . 19518 1 106 . 1 1 12 12 GLY N N 15 108.704 0.055 . 1 . . . . . 12 GLY N . 19518 1 107 . 1 1 13 13 ALA H H 1 8.201 0.004 . 1 . . . . . 13 ALA H . 19518 1 108 . 1 1 13 13 ALA HA H 1 4.215 0.004 . 1 . . . . . 13 ALA HA . 19518 1 109 . 1 1 13 13 ALA HB1 H 1 1.244 0.006 . 1 . . . . . 13 ALA HB1 . 19518 1 110 . 1 1 13 13 ALA HB2 H 1 1.244 0.006 . 1 . . . . . 13 ALA HB2 . 19518 1 111 . 1 1 13 13 ALA HB3 H 1 1.244 0.006 . 1 . . . . . 13 ALA HB3 . 19518 1 112 . 1 1 13 13 ALA C C 13 177.727 0.000 . 1 . . . . . 13 ALA C . 19518 1 113 . 1 1 13 13 ALA CA C 13 52.897 0.063 . 1 . . . . . 13 ALA CA . 19518 1 114 . 1 1 13 13 ALA CB C 13 18.955 0.179 . 1 . . . . . 13 ALA CB . 19518 1 115 . 1 1 13 13 ALA N N 15 123.813 0.027 . 1 . . . . . 13 ALA N . 19518 1 116 . 1 1 14 14 ASN H H 1 8.296 0.003 . 1 . . . . . 14 ASN H . 19518 1 117 . 1 1 14 14 ASN HA H 1 4.667 0.002 . 1 . . . . . 14 ASN HA . 19518 1 118 . 1 1 14 14 ASN HB2 H 1 3.133 0.000 . 1 . . . . . 14 ASN HB2 . 19518 1 119 . 1 1 14 14 ASN HB3 H 1 3.133 0.000 . 1 . . . . . 14 ASN HB3 . 19518 1 120 . 1 1 14 14 ASN C C 13 175.175 0.000 . 1 . . . . . 14 ASN C . 19518 1 121 . 1 1 14 14 ASN CA C 13 53.397 0.003 . 1 . . . . . 14 ASN CA . 19518 1 122 . 1 1 14 14 ASN CB C 13 38.663 0.000 . 1 . . . . . 14 ASN CB . 19518 1 123 . 1 1 14 14 ASN N N 15 117.454 0.059 . 1 . . . . . 14 ASN N . 19518 1 124 . 1 1 15 15 SER H H 1 8.009 0.006 . 1 . . . . . 15 SER H . 19518 1 125 . 1 1 15 15 SER HA H 1 4.235 0.006 . 1 . . . . . 15 SER HA . 19518 1 126 . 1 1 15 15 SER HB2 H 1 3.733 0.003 . 1 . . . . . 15 SER HB2 . 19518 1 127 . 1 1 15 15 SER HB3 H 1 3.733 0.003 . 1 . . . . . 15 SER HB3 . 19518 1 128 . 1 1 15 15 SER C C 13 174.169 0.000 . 1 . . . . . 15 SER C . 19518 1 129 . 1 1 15 15 SER CA C 13 58.773 0.036 . 1 . . . . . 15 SER CA . 19518 1 130 . 1 1 15 15 SER CB C 13 63.713 0.015 . 1 . . . . . 15 SER CB . 19518 1 131 . 1 1 15 15 SER N N 15 115.676 0.060 . 1 . . . . . 15 SER N . 19518 1 132 . 1 1 16 16 ASN H H 1 8.208 0.005 . 1 . . . . . 16 ASN H . 19518 1 133 . 1 1 16 16 ASN HA H 1 4.667 0.008 . 1 . . . . . 16 ASN HA . 19518 1 134 . 1 1 16 16 ASN HB2 H 1 2.775 0.011 . 1 . . . . . 16 ASN HB2 . 19518 1 135 . 1 1 16 16 ASN HB3 H 1 2.775 0.011 . 1 . . . . . 16 ASN HB3 . 19518 1 136 . 1 1 16 16 ASN HD21 H 1 7.539 0.004 . 1 . . . . . 16 ASN HD21 . 19518 1 137 . 1 1 16 16 ASN HD22 H 1 6.907 0.006 . 1 . . . . . 16 ASN HD22 . 19518 1 138 . 1 1 16 16 ASN C C 13 176.349 0.000 . 1 . . . . . 16 ASN C . 19518 1 139 . 1 1 16 16 ASN CA C 13 52.948 0.060 . 1 . . . . . 16 ASN CA . 19518 1 140 . 1 1 16 16 ASN CB C 13 38.838 0.044 . 1 . . . . . 16 ASN CB . 19518 1 141 . 1 1 16 16 ASN N N 15 120.433 0.064 . 1 . . . . . 16 ASN N . 19518 1 142 . 1 1 16 16 ASN ND2 N 15 112.708 0.132 . 1 . . . . . 16 ASN ND2 . 19518 1 143 . 1 1 17 17 VAL H H 1 8.313 0.007 . 1 . . . . . 17 VAL H . 19518 1 144 . 1 1 17 17 VAL HA H 1 3.796 0.016 . 1 . . . . . 17 VAL HA . 19518 1 145 . 1 1 17 17 VAL HB H 1 1.865 0.013 . 1 . . . . . 17 VAL HB . 19518 1 146 . 1 1 17 17 VAL HG11 H 1 1.065 0.012 . 1 . . . . . 17 VAL HG11 . 19518 1 147 . 1 1 17 17 VAL HG12 H 1 1.065 0.012 . 1 . . . . . 17 VAL HG12 . 19518 1 148 . 1 1 17 17 VAL HG13 H 1 1.065 0.012 . 1 . . . . . 17 VAL HG13 . 19518 1 149 . 1 1 17 17 VAL HG21 H 1 0.631 0.018 . 1 . . . . . 17 VAL HG21 . 19518 1 150 . 1 1 17 17 VAL HG22 H 1 0.631 0.018 . 1 . . . . . 17 VAL HG22 . 19518 1 151 . 1 1 17 17 VAL HG23 H 1 0.631 0.018 . 1 . . . . . 17 VAL HG23 . 19518 1 152 . 1 1 17 17 VAL C C 13 176.033 0.000 . 1 . . . . . 17 VAL C . 19518 1 153 . 1 1 17 17 VAL CA C 13 64.156 0.005 . 1 . . . . . 17 VAL CA . 19518 1 154 . 1 1 17 17 VAL CB C 13 31.812 0.110 . 1 . . . . . 17 VAL CB . 19518 1 155 . 1 1 17 17 VAL CG1 C 13 20.893 0.031 . 1 . . . . . 17 VAL CG1 . 19518 1 156 . 1 1 17 17 VAL CG2 C 13 20.908 0.059 . 1 . . . . . 17 VAL CG2 . 19518 1 157 . 1 1 17 17 VAL N N 15 122.278 0.081 . 1 . . . . . 17 VAL N . 19518 1 158 . 1 1 18 18 PHE H H 1 7.713 0.009 . 1 . . . . . 18 PHE H . 19518 1 159 . 1 1 18 18 PHE HA H 1 4.287 0.003 . 1 . . . . . 18 PHE HA . 19518 1 160 . 1 1 18 18 PHE HB2 H 1 3.147 0.005 . 1 . . . . . 18 PHE HB2 . 19518 1 161 . 1 1 18 18 PHE HB3 H 1 2.956 0.004 . 1 . . . . . 18 PHE HB3 . 19518 1 162 . 1 1 18 18 PHE HD1 H 1 7.200 0.004 . 3 . . . . . 18 PHE HD1 . 19518 1 163 . 1 1 18 18 PHE HD2 H 1 7.200 0.004 . 3 . . . . . 18 PHE HD2 . 19518 1 164 . 1 1 18 18 PHE HE1 H 1 6.783 0.000 . 3 . . . . . 18 PHE HE1 . 19518 1 165 . 1 1 18 18 PHE HE2 H 1 6.783 0.000 . 3 . . . . . 18 PHE HE2 . 19518 1 166 . 1 1 18 18 PHE C C 13 176.527 0.000 . 1 . . . . . 18 PHE C . 19518 1 167 . 1 1 18 18 PHE CA C 13 59.729 0.116 . 1 . . . . . 18 PHE CA . 19518 1 168 . 1 1 18 18 PHE CB C 13 38.004 0.022 . 1 . . . . . 18 PHE CB . 19518 1 169 . 1 1 18 18 PHE N N 15 118.438 0.059 . 1 . . . . . 18 PHE N . 19518 1 170 . 1 1 19 19 SER H H 1 7.760 0.006 . 1 . . . . . 19 SER H . 19518 1 171 . 1 1 19 19 SER HA H 1 4.445 0.004 . 1 . . . . . 19 SER HA . 19518 1 172 . 1 1 19 19 SER HB2 H 1 3.823 0.004 . 1 . . . . . 19 SER HB2 . 19518 1 173 . 1 1 19 19 SER HB3 H 1 3.823 0.004 . 1 . . . . . 19 SER HB3 . 19518 1 174 . 1 1 19 19 SER C C 13 174.826 0.000 . 1 . . . . . 19 SER C . 19518 1 175 . 1 1 19 19 SER CA C 13 59.059 0.044 . 1 . . . . . 19 SER CA . 19518 1 176 . 1 1 19 19 SER CB C 13 63.923 0.061 . 1 . . . . . 19 SER CB . 19518 1 177 . 1 1 19 19 SER N N 15 113.297 0.055 . 1 . . . . . 19 SER N . 19518 1 178 . 1 1 20 20 MET H H 1 7.635 0.005 . 1 . . . . . 20 MET H . 19518 1 179 . 1 1 20 20 MET HA H 1 4.036 0.007 . 1 . . . . . 20 MET HA . 19518 1 180 . 1 1 20 20 MET HB2 H 1 1.484 0.013 . 1 . . . . . 20 MET HB2 . 19518 1 181 . 1 1 20 20 MET HB3 H 1 1.695 0.013 . 1 . . . . . 20 MET HB3 . 19518 1 182 . 1 1 20 20 MET HG2 H 1 2.067 0.009 . 1 . . . . . 20 MET HG2 . 19518 1 183 . 1 1 20 20 MET HG3 H 1 2.067 0.009 . 1 . . . . . 20 MET HG3 . 19518 1 184 . 1 1 20 20 MET C C 13 174.904 0.000 . 1 . . . . . 20 MET C . 19518 1 185 . 1 1 20 20 MET CA C 13 57.010 0.059 . 1 . . . . . 20 MET CA . 19518 1 186 . 1 1 20 20 MET CB C 13 32.963 0.078 . 1 . . . . . 20 MET CB . 19518 1 187 . 1 1 20 20 MET CG C 13 31.945 0.000 . 1 . . . . . 20 MET CG . 19518 1 188 . 1 1 20 20 MET N N 15 119.704 0.033 . 1 . . . . . 20 MET N . 19518 1 189 . 1 1 21 21 PHE H H 1 7.313 0.007 . 1 . . . . . 21 PHE H . 19518 1 190 . 1 1 21 21 PHE HA H 1 4.913 0.009 . 1 . . . . . 21 PHE HA . 19518 1 191 . 1 1 21 21 PHE HB2 H 1 3.163 0.011 . 1 . . . . . 21 PHE HB2 . 19518 1 192 . 1 1 21 21 PHE HB3 H 1 2.593 0.005 . 1 . . . . . 21 PHE HB3 . 19518 1 193 . 1 1 21 21 PHE HD1 H 1 7.041 0.002 . 3 . . . . . 21 PHE HD1 . 19518 1 194 . 1 1 21 21 PHE HD2 H 1 7.041 0.002 . 3 . . . . . 21 PHE HD2 . 19518 1 195 . 1 1 21 21 PHE C C 13 178.231 0.000 . 1 . . . . . 21 PHE C . 19518 1 196 . 1 1 21 21 PHE CA C 13 56.321 0.052 . 1 . . . . . 21 PHE CA . 19518 1 197 . 1 1 21 21 PHE CB C 13 42.310 0.029 . 1 . . . . . 21 PHE CB . 19518 1 198 . 1 1 21 21 PHE N N 15 115.373 0.062 . 1 . . . . . 21 PHE N . 19518 1 199 . 1 1 22 22 GLU H H 1 8.827 0.010 . 1 . . . . . 22 GLU H . 19518 1 200 . 1 1 22 22 GLU HA H 1 4.407 0.008 . 1 . . . . . 22 GLU HA . 19518 1 201 . 1 1 22 22 GLU HB2 H 1 1.930 0.007 . 1 . . . . . 22 GLU HB2 . 19518 1 202 . 1 1 22 22 GLU HB3 H 1 1.930 0.007 . 1 . . . . . 22 GLU HB3 . 19518 1 203 . 1 1 22 22 GLU HG2 H 1 2.341 0.001 . 1 . . . . . 22 GLU HG2 . 19518 1 204 . 1 1 22 22 GLU HG3 H 1 2.392 0.042 . 1 . . . . . 22 GLU HG3 . 19518 1 205 . 1 1 22 22 GLU CA C 13 55.857 0.040 . 1 . . . . . 22 GLU CA . 19518 1 206 . 1 1 22 22 GLU CB C 13 30.314 0.008 . 1 . . . . . 22 GLU CB . 19518 1 207 . 1 1 22 22 GLU CG C 13 36.411 0.035 . 1 . . . . . 22 GLU CG . 19518 1 208 . 1 1 22 22 GLU N N 15 119.495 0.096 . 1 . . . . . 22 GLU N . 19518 1 209 . 1 1 23 23 GLN HA H 1 3.965 0.012 . 1 . . . . . 23 GLN HA . 19518 1 210 . 1 1 23 23 GLN HB2 H 1 2.093 0.001 . 1 . . . . . 23 GLN HB2 . 19518 1 211 . 1 1 23 23 GLN HB3 H 1 2.166 0.010 . 1 . . . . . 23 GLN HB3 . 19518 1 212 . 1 1 23 23 GLN HG2 H 1 2.131 0.010 . 1 . . . . . 23 GLN HG2 . 19518 1 213 . 1 1 23 23 GLN HG3 H 1 2.422 0.007 . 1 . . . . . 23 GLN HG3 . 19518 1 214 . 1 1 23 23 GLN HE21 H 1 7.522 0.007 . 1 . . . . . 23 GLN HE21 . 19518 1 215 . 1 1 23 23 GLN HE22 H 1 6.775 0.009 . 1 . . . . . 23 GLN HE22 . 19518 1 216 . 1 1 23 23 GLN C C 13 178.666 0.000 . 1 . . . . . 23 GLN C . 19518 1 217 . 1 1 23 23 GLN CA C 13 60.010 0.023 . 1 . . . . . 23 GLN CA . 19518 1 218 . 1 1 23 23 GLN CB C 13 28.063 0.110 . 1 . . . . . 23 GLN CB . 19518 1 219 . 1 1 23 23 GLN CG C 13 36.457 0.051 . 1 . . . . . 23 GLN CG . 19518 1 220 . 1 1 23 23 GLN NE2 N 15 112.448 0.092 . 1 . . . . . 23 GLN NE2 . 19518 1 221 . 1 1 24 24 THR H H 1 8.360 0.008 . 1 . . . . . 24 THR H . 19518 1 222 . 1 1 24 24 THR HA H 1 3.956 0.020 . 1 . . . . . 24 THR HA . 19518 1 223 . 1 1 24 24 THR HB H 1 4.062 0.008 . 1 . . . . . 24 THR HB . 19518 1 224 . 1 1 24 24 THR HG21 H 1 1.157 0.009 . 1 . . . . . 24 THR HG21 . 19518 1 225 . 1 1 24 24 THR HG22 H 1 1.157 0.009 . 1 . . . . . 24 THR HG22 . 19518 1 226 . 1 1 24 24 THR HG23 H 1 1.157 0.009 . 1 . . . . . 24 THR HG23 . 19518 1 227 . 1 1 24 24 THR C C 13 176.736 0.000 . 1 . . . . . 24 THR C . 19518 1 228 . 1 1 24 24 THR CA C 13 65.417 0.022 . 1 . . . . . 24 THR CA . 19518 1 229 . 1 1 24 24 THR CB C 13 67.887 0.091 . 1 . . . . . 24 THR CB . 19518 1 230 . 1 1 24 24 THR N N 15 111.341 0.064 . 1 . . . . . 24 THR N . 19518 1 231 . 1 1 25 25 GLN H H 1 7.014 0.007 . 1 . . . . . 25 GLN H . 19518 1 232 . 1 1 25 25 GLN HA H 1 3.978 0.023 . 1 . . . . . 25 GLN HA . 19518 1 233 . 1 1 25 25 GLN HB2 H 1 2.050 0.003 . 1 . . . . . 25 GLN HB2 . 19518 1 234 . 1 1 25 25 GLN HB3 H 1 1.934 0.005 . 1 . . . . . 25 GLN HB3 . 19518 1 235 . 1 1 25 25 GLN HG2 H 1 2.465 0.004 . 1 . . . . . 25 GLN HG2 . 19518 1 236 . 1 1 25 25 GLN HG3 H 1 2.294 0.025 . 1 . . . . . 25 GLN HG3 . 19518 1 237 . 1 1 25 25 GLN HE21 H 1 6.766 0.009 . 1 . . . . . 25 GLN HE21 . 19518 1 238 . 1 1 25 25 GLN HE22 H 1 6.418 0.006 . 1 . . . . . 25 GLN HE22 . 19518 1 239 . 1 1 25 25 GLN C C 13 178.107 0.000 . 1 . . . . . 25 GLN C . 19518 1 240 . 1 1 25 25 GLN CA C 13 57.689 0.052 . 1 . . . . . 25 GLN CA . 19518 1 241 . 1 1 25 25 GLN CB C 13 29.317 0.136 . 1 . . . . . 25 GLN CB . 19518 1 242 . 1 1 25 25 GLN CG C 13 34.286 0.035 . 1 . . . . . 25 GLN CG . 19518 1 243 . 1 1 25 25 GLN N N 15 121.349 0.049 . 1 . . . . . 25 GLN N . 19518 1 244 . 1 1 25 25 GLN NE2 N 15 113.577 0.064 . 1 . . . . . 25 GLN NE2 . 19518 1 245 . 1 1 26 26 ILE H H 1 8.052 0.006 . 1 . . . . . 26 ILE H . 19518 1 246 . 1 1 26 26 ILE HA H 1 3.669 0.008 . 1 . . . . . 26 ILE HA . 19518 1 247 . 1 1 26 26 ILE HB H 1 2.128 0.010 . 1 . . . . . 26 ILE HB . 19518 1 248 . 1 1 26 26 ILE HG12 H 1 1.754 0.006 . 1 . . . . . 26 ILE HG12 . 19518 1 249 . 1 1 26 26 ILE HG13 H 1 1.754 0.006 . 1 . . . . . 26 ILE HG13 . 19518 1 250 . 1 1 26 26 ILE HG21 H 1 1.090 0.011 . 1 . . . . . 26 ILE HG21 . 19518 1 251 . 1 1 26 26 ILE HG22 H 1 1.090 0.011 . 1 . . . . . 26 ILE HG22 . 19518 1 252 . 1 1 26 26 ILE HG23 H 1 1.090 0.011 . 1 . . . . . 26 ILE HG23 . 19518 1 253 . 1 1 26 26 ILE HD11 H 1 0.960 0.006 . 1 . . . . . 26 ILE HD11 . 19518 1 254 . 1 1 26 26 ILE HD12 H 1 0.960 0.006 . 1 . . . . . 26 ILE HD12 . 19518 1 255 . 1 1 26 26 ILE HD13 H 1 0.960 0.006 . 1 . . . . . 26 ILE HD13 . 19518 1 256 . 1 1 26 26 ILE C C 13 177.800 0.000 . 1 . . . . . 26 ILE C . 19518 1 257 . 1 1 26 26 ILE CA C 13 65.855 0.114 . 1 . . . . . 26 ILE CA . 19518 1 258 . 1 1 26 26 ILE CB C 13 36.691 0.085 . 1 . . . . . 26 ILE CB . 19518 1 259 . 1 1 26 26 ILE CG1 C 13 27.617 0.000 . 1 . . . . . 26 ILE CG1 . 19518 1 260 . 1 1 26 26 ILE CG2 C 13 17.421 0.063 . 1 . . . . . 26 ILE CG2 . 19518 1 261 . 1 1 26 26 ILE CD1 C 13 13.055 0.057 . 1 . . . . . 26 ILE CD1 . 19518 1 262 . 1 1 26 26 ILE N N 15 120.592 0.040 . 1 . . . . . 26 ILE N . 19518 1 263 . 1 1 27 27 GLN H H 1 7.926 0.005 . 1 . . . . . 27 GLN H . 19518 1 264 . 1 1 27 27 GLN HA H 1 3.934 0.012 . 1 . . . . . 27 GLN HA . 19518 1 265 . 1 1 27 27 GLN HB2 H 1 2.146 0.004 . 1 . . . . . 27 GLN HB2 . 19518 1 266 . 1 1 27 27 GLN HB3 H 1 2.043 0.013 . 1 . . . . . 27 GLN HB3 . 19518 1 267 . 1 1 27 27 GLN HG2 H 1 2.355 0.008 . 1 . . . . . 27 GLN HG2 . 19518 1 268 . 1 1 27 27 GLN HG3 H 1 2.355 0.008 . 1 . . . . . 27 GLN HG3 . 19518 1 269 . 1 1 27 27 GLN HE21 H 1 6.730 0.005 . 1 . . . . . 27 GLN HE21 . 19518 1 270 . 1 1 27 27 GLN HE22 H 1 7.665 0.003 . 1 . . . . . 27 GLN HE22 . 19518 1 271 . 1 1 27 27 GLN C C 13 178.356 0.000 . 1 . . . . . 27 GLN C . 19518 1 272 . 1 1 27 27 GLN CA C 13 58.909 0.028 . 1 . . . . . 27 GLN CA . 19518 1 273 . 1 1 27 27 GLN CB C 13 27.287 0.050 . 1 . . . . . 27 GLN CB . 19518 1 274 . 1 1 27 27 GLN CG C 13 32.641 0.000 . 1 . . . . . 27 GLN CG . 19518 1 275 . 1 1 27 27 GLN N N 15 118.333 0.076 . 1 . . . . . 27 GLN N . 19518 1 276 . 1 1 27 27 GLN NE2 N 15 112.515 0.091 . 1 . . . . . 27 GLN NE2 . 19518 1 277 . 1 1 28 28 GLU H H 1 7.577 0.007 . 1 . . . . . 28 GLU H . 19518 1 278 . 1 1 28 28 GLU HA H 1 3.970 0.006 . 1 . . . . . 28 GLU HA . 19518 1 279 . 1 1 28 28 GLU HB2 H 1 2.111 0.001 . 1 . . . . . 28 GLU HB2 . 19518 1 280 . 1 1 28 28 GLU HB3 H 1 1.946 0.001 . 1 . . . . . 28 GLU HB3 . 19518 1 281 . 1 1 28 28 GLU HG2 H 1 2.347 0.007 . 1 . . . . . 28 GLU HG2 . 19518 1 282 . 1 1 28 28 GLU HG3 H 1 2.347 0.007 . 1 . . . . . 28 GLU HG3 . 19518 1 283 . 1 1 28 28 GLU C C 13 179.948 0.000 . 1 . . . . . 28 GLU C . 19518 1 284 . 1 1 28 28 GLU CA C 13 60.189 0.063 . 1 . . . . . 28 GLU CA . 19518 1 285 . 1 1 28 28 GLU CB C 13 29.017 0.035 . 1 . . . . . 28 GLU CB . 19518 1 286 . 1 1 28 28 GLU CG C 13 33.323 0.028 . 1 . . . . . 28 GLU CG . 19518 1 287 . 1 1 28 28 GLU N N 15 120.395 0.042 . 1 . . . . . 28 GLU N . 19518 1 288 . 1 1 29 29 PHE H H 1 8.314 0.005 . 1 . . . . . 29 PHE H . 19518 1 289 . 1 1 29 29 PHE HA H 1 4.640 0.004 . 1 . . . . . 29 PHE HA . 19518 1 290 . 1 1 29 29 PHE HB2 H 1 3.248 0.013 . 1 . . . . . 29 PHE HB2 . 19518 1 291 . 1 1 29 29 PHE HB3 H 1 3.052 0.000 . 1 . . . . . 29 PHE HB3 . 19518 1 292 . 1 1 29 29 PHE HD1 H 1 6.401 0.001 . 3 . . . . . 29 PHE HD1 . 19518 1 293 . 1 1 29 29 PHE HD2 H 1 6.401 0.001 . 3 . . . . . 29 PHE HD2 . 19518 1 294 . 1 1 29 29 PHE HE1 H 1 6.975 0.018 . 3 . . . . . 29 PHE HE1 . 19518 1 295 . 1 1 29 29 PHE HE2 H 1 6.975 0.018 . 3 . . . . . 29 PHE HE2 . 19518 1 296 . 1 1 29 29 PHE C C 13 178.562 0.000 . 1 . . . . . 29 PHE C . 19518 1 297 . 1 1 29 29 PHE CA C 13 60.999 0.105 . 1 . . . . . 29 PHE CA . 19518 1 298 . 1 1 29 29 PHE CB C 13 38.151 0.038 . 1 . . . . . 29 PHE CB . 19518 1 299 . 1 1 29 29 PHE N N 15 118.355 0.082 . 1 . . . . . 29 PHE N . 19518 1 300 . 1 1 30 30 LYS H H 1 8.943 0.008 . 1 . . . . . 30 LYS H . 19518 1 301 . 1 1 30 30 LYS HA H 1 3.929 0.011 . 1 . . . . . 30 LYS HA . 19518 1 302 . 1 1 30 30 LYS HB2 H 1 1.790 0.008 . 1 . . . . . 30 LYS HB2 . 19518 1 303 . 1 1 30 30 LYS HB3 H 1 1.790 0.008 . 1 . . . . . 30 LYS HB3 . 19518 1 304 . 1 1 30 30 LYS HG2 H 1 1.482 0.011 . 1 . . . . . 30 LYS HG2 . 19518 1 305 . 1 1 30 30 LYS HG3 H 1 1.482 0.011 . 1 . . . . . 30 LYS HG3 . 19518 1 306 . 1 1 30 30 LYS HD2 H 1 1.978 0.003 . 1 . . . . . 30 LYS HD2 . 19518 1 307 . 1 1 30 30 LYS HD3 H 1 1.978 0.003 . 1 . . . . . 30 LYS HD3 . 19518 1 308 . 1 1 30 30 LYS C C 13 179.691 0.000 . 1 . . . . . 30 LYS C . 19518 1 309 . 1 1 30 30 LYS CA C 13 59.139 0.118 . 1 . . . . . 30 LYS CA . 19518 1 310 . 1 1 30 30 LYS CB C 13 30.849 0.102 . 1 . . . . . 30 LYS CB . 19518 1 311 . 1 1 30 30 LYS CG C 13 25.688 0.000 . 1 . . . . . 30 LYS CG . 19518 1 312 . 1 1 30 30 LYS CD C 13 28.153 0.005 . 1 . . . . . 30 LYS CD . 19518 1 313 . 1 1 30 30 LYS N N 15 122.490 0.039 . 1 . . . . . 30 LYS N . 19518 1 314 . 1 1 31 31 GLU H H 1 8.290 0.007 . 1 . . . . . 31 GLU H . 19518 1 315 . 1 1 31 31 GLU HA H 1 3.947 0.023 . 1 . . . . . 31 GLU HA . 19518 1 316 . 1 1 31 31 GLU HB2 H 1 1.950 0.021 . 1 . . . . . 31 GLU HB2 . 19518 1 317 . 1 1 31 31 GLU HB3 H 1 1.950 0.021 . 1 . . . . . 31 GLU HB3 . 19518 1 318 . 1 1 31 31 GLU HG2 H 1 2.416 0.009 . 1 . . . . . 31 GLU HG2 . 19518 1 319 . 1 1 31 31 GLU HG3 H 1 2.416 0.009 . 1 . . . . . 31 GLU HG3 . 19518 1 320 . 1 1 31 31 GLU C C 13 179.290 0.000 . 1 . . . . . 31 GLU C . 19518 1 321 . 1 1 31 31 GLU CA C 13 59.404 0.000 . 1 . . . . . 31 GLU CA . 19518 1 322 . 1 1 31 31 GLU CB C 13 29.047 0.077 . 1 . . . . . 31 GLU CB . 19518 1 323 . 1 1 31 31 GLU CG C 13 33.633 0.018 . 1 . . . . . 31 GLU CG . 19518 1 324 . 1 1 31 31 GLU N N 15 121.913 0.059 . 1 . . . . . 31 GLU N . 19518 1 325 . 1 1 32 32 ALA H H 1 7.920 0.010 . 1 . . . . . 32 ALA H . 19518 1 326 . 1 1 32 32 ALA HA H 1 3.953 0.015 . 1 . . . . . 32 ALA HA . 19518 1 327 . 1 1 32 32 ALA HB1 H 1 1.619 0.007 . 1 . . . . . 32 ALA HB1 . 19518 1 328 . 1 1 32 32 ALA HB2 H 1 1.619 0.007 . 1 . . . . . 32 ALA HB2 . 19518 1 329 . 1 1 32 32 ALA HB3 H 1 1.619 0.007 . 1 . . . . . 32 ALA HB3 . 19518 1 330 . 1 1 32 32 ALA C C 13 175.165 0.000 . 1 . . . . . 32 ALA C . 19518 1 331 . 1 1 32 32 ALA CA C 13 55.348 0.049 . 1 . . . . . 32 ALA CA . 19518 1 332 . 1 1 32 32 ALA CB C 13 19.162 0.024 . 1 . . . . . 32 ALA CB . 19518 1 333 . 1 1 32 32 ALA N N 15 120.904 0.099 . 1 . . . . . 32 ALA N . 19518 1 334 . 1 1 33 33 PHE H H 1 8.813 0.006 . 1 . . . . . 33 PHE H . 19518 1 335 . 1 1 33 33 PHE HA H 1 4.450 0.000 . 1 . . . . . 33 PHE HA . 19518 1 336 . 1 1 33 33 PHE HB2 H 1 3.298 0.006 . 1 . . . . . 33 PHE HB2 . 19518 1 337 . 1 1 33 33 PHE HB3 H 1 2.988 0.003 . 1 . . . . . 33 PHE HB3 . 19518 1 338 . 1 1 33 33 PHE HD1 H 1 6.650 0.009 . 3 . . . . . 33 PHE HD1 . 19518 1 339 . 1 1 33 33 PHE HD2 H 1 6.650 0.009 . 3 . . . . . 33 PHE HD2 . 19518 1 340 . 1 1 33 33 PHE HE1 H 1 7.017 0.019 . 3 . . . . . 33 PHE HE1 . 19518 1 341 . 1 1 33 33 PHE HE2 H 1 7.017 0.019 . 3 . . . . . 33 PHE HE2 . 19518 1 342 . 1 1 33 33 PHE C C 13 176.090 0.000 . 1 . . . . . 33 PHE C . 19518 1 343 . 1 1 33 33 PHE CA C 13 61.781 0.101 . 1 . . . . . 33 PHE CA . 19518 1 344 . 1 1 33 33 PHE CB C 13 39.621 0.008 . 1 . . . . . 33 PHE CB . 19518 1 345 . 1 1 33 33 PHE N N 15 119.529 0.052 . 1 . . . . . 33 PHE N . 19518 1 346 . 1 1 34 34 THR H H 1 8.014 0.005 . 1 . . . . . 34 THR H . 19518 1 347 . 1 1 34 34 THR HA H 1 3.620 0.003 . 1 . . . . . 34 THR HA . 19518 1 348 . 1 1 34 34 THR HB H 1 4.189 0.013 . 1 . . . . . 34 THR HB . 19518 1 349 . 1 1 34 34 THR HG21 H 1 1.080 0.001 . 1 . . . . . 34 THR HG21 . 19518 1 350 . 1 1 34 34 THR HG22 H 1 1.080 0.001 . 1 . . . . . 34 THR HG22 . 19518 1 351 . 1 1 34 34 THR HG23 H 1 1.080 0.001 . 1 . . . . . 34 THR HG23 . 19518 1 352 . 1 1 34 34 THR C C 13 175.682 0.000 . 1 . . . . . 34 THR C . 19518 1 353 . 1 1 34 34 THR CA C 13 66.557 0.083 . 1 . . . . . 34 THR CA . 19518 1 354 . 1 1 34 34 THR CB C 13 68.998 0.028 . 1 . . . . . 34 THR CB . 19518 1 355 . 1 1 34 34 THR CG2 C 13 21.133 0.000 . 1 . . . . . 34 THR CG2 . 19518 1 356 . 1 1 34 34 THR N N 15 112.684 0.091 . 1 . . . . . 34 THR N . 19518 1 357 . 1 1 35 35 ILE H H 1 7.220 0.008 . 1 . . . . . 35 ILE H . 19518 1 358 . 1 1 35 35 ILE HA H 1 3.461 0.004 . 1 . . . . . 35 ILE HA . 19518 1 359 . 1 1 35 35 ILE HB H 1 1.782 0.011 . 1 . . . . . 35 ILE HB . 19518 1 360 . 1 1 35 35 ILE HG12 H 1 1.026 0.004 . 1 . . . . . 35 ILE HG12 . 19518 1 361 . 1 1 35 35 ILE HG13 H 1 1.572 0.008 . 1 . . . . . 35 ILE HG13 . 19518 1 362 . 1 1 35 35 ILE HG21 H 1 0.698 0.007 . 1 . . . . . 35 ILE HG21 . 19518 1 363 . 1 1 35 35 ILE HG22 H 1 0.698 0.007 . 1 . . . . . 35 ILE HG22 . 19518 1 364 . 1 1 35 35 ILE HG23 H 1 0.698 0.007 . 1 . . . . . 35 ILE HG23 . 19518 1 365 . 1 1 35 35 ILE HD11 H 1 0.706 0.006 . 1 . . . . . 35 ILE HD11 . 19518 1 366 . 1 1 35 35 ILE HD12 H 1 0.706 0.006 . 1 . . . . . 35 ILE HD12 . 19518 1 367 . 1 1 35 35 ILE HD13 H 1 0.706 0.006 . 1 . . . . . 35 ILE HD13 . 19518 1 368 . 1 1 35 35 ILE C C 13 177.543 0.000 . 1 . . . . . 35 ILE C . 19518 1 369 . 1 1 35 35 ILE CA C 13 64.088 0.081 . 1 . . . . . 35 ILE CA . 19518 1 370 . 1 1 35 35 ILE CB C 13 37.436 0.103 . 1 . . . . . 35 ILE CB . 19518 1 371 . 1 1 35 35 ILE CG1 C 13 29.229 0.027 . 1 . . . . . 35 ILE CG1 . 19518 1 372 . 1 1 35 35 ILE CG2 C 13 17.233 0.017 . 1 . . . . . 35 ILE CG2 . 19518 1 373 . 1 1 35 35 ILE CD1 C 13 13.183 0.019 . 1 . . . . . 35 ILE CD1 . 19518 1 374 . 1 1 35 35 ILE N N 15 120.588 0.038 . 1 . . . . . 35 ILE N . 19518 1 375 . 1 1 36 36 MET H H 1 7.363 0.008 . 1 . . . . . 36 MET H . 19518 1 376 . 1 1 36 36 MET HA H 1 4.133 0.000 . 1 . . . . . 36 MET HA . 19518 1 377 . 1 1 36 36 MET HB2 H 1 1.801 0.021 . 1 . . . . . 36 MET HB2 . 19518 1 378 . 1 1 36 36 MET HB3 H 1 1.540 0.006 . 1 . . . . . 36 MET HB3 . 19518 1 379 . 1 1 36 36 MET HG2 H 1 2.634 0.009 . 1 . . . . . 36 MET HG2 . 19518 1 380 . 1 1 36 36 MET HG3 H 1 2.188 0.015 . 1 . . . . . 36 MET HG3 . 19518 1 381 . 1 1 36 36 MET HE1 H 1 2.080 0.011 . 1 . . . . . 36 MET HE1 . 19518 1 382 . 1 1 36 36 MET HE2 H 1 2.080 0.011 . 1 . . . . . 36 MET HE2 . 19518 1 383 . 1 1 36 36 MET HE3 H 1 2.080 0.011 . 1 . . . . . 36 MET HE3 . 19518 1 384 . 1 1 36 36 MET C C 13 174.910 0.000 . 1 . . . . . 36 MET C . 19518 1 385 . 1 1 36 36 MET CA C 13 57.930 0.046 . 1 . . . . . 36 MET CA . 19518 1 386 . 1 1 36 36 MET CB C 13 33.855 0.077 . 1 . . . . . 36 MET CB . 19518 1 387 . 1 1 36 36 MET CG C 13 33.805 0.000 . 1 . . . . . 36 MET CG . 19518 1 388 . 1 1 36 36 MET CE C 13 18.097 0.048 . 1 . . . . . 36 MET CE . 19518 1 389 . 1 1 36 36 MET N N 15 116.668 0.102 . 1 . . . . . 36 MET N . 19518 1 390 . 1 1 37 37 ASP H H 1 7.312 0.005 . 1 . . . . . 37 ASP H . 19518 1 391 . 1 1 37 37 ASP HA H 1 4.303 0.006 . 1 . . . . . 37 ASP HA . 19518 1 392 . 1 1 37 37 ASP HB2 H 1 2.510 0.010 . 1 . . . . . 37 ASP HB2 . 19518 1 393 . 1 1 37 37 ASP HB3 H 1 2.510 0.010 . 1 . . . . . 37 ASP HB3 . 19518 1 394 . 1 1 37 37 ASP C C 13 177.551 0.000 . 1 . . . . . 37 ASP C . 19518 1 395 . 1 1 37 37 ASP CA C 13 52.065 0.090 . 1 . . . . . 37 ASP CA . 19518 1 396 . 1 1 37 37 ASP CB C 13 38.029 0.058 . 1 . . . . . 37 ASP CB . 19518 1 397 . 1 1 37 37 ASP N N 15 115.461 0.066 . 1 . . . . . 37 ASP N . 19518 1 398 . 1 1 38 38 GLN H H 1 7.781 0.008 . 1 . . . . . 38 GLN H . 19518 1 399 . 1 1 38 38 GLN HA H 1 3.700 0.015 . 1 . . . . . 38 GLN HA . 19518 1 400 . 1 1 38 38 GLN HB2 H 1 2.046 0.010 . 1 . . . . . 38 GLN HB2 . 19518 1 401 . 1 1 38 38 GLN HB3 H 1 2.248 0.007 . 1 . . . . . 38 GLN HB3 . 19518 1 402 . 1 1 38 38 GLN HG2 H 1 2.508 0.013 . 1 . . . . . 38 GLN HG2 . 19518 1 403 . 1 1 38 38 GLN HG3 H 1 2.508 0.013 . 1 . . . . . 38 GLN HG3 . 19518 1 404 . 1 1 38 38 GLN HE21 H 1 7.213 0.005 . 1 . . . . . 38 GLN HE21 . 19518 1 405 . 1 1 38 38 GLN HE22 H 1 6.786 0.007 . 1 . . . . . 38 GLN HE22 . 19518 1 406 . 1 1 38 38 GLN C C 13 177.551 0.000 . 1 . . . . . 38 GLN C . 19518 1 407 . 1 1 38 38 GLN CA C 13 58.847 0.052 . 1 . . . . . 38 GLN CA . 19518 1 408 . 1 1 38 38 GLN CB C 13 27.973 0.159 . 1 . . . . . 38 GLN CB . 19518 1 409 . 1 1 38 38 GLN CG C 13 33.672 0.000 . 1 . . . . . 38 GLN CG . 19518 1 410 . 1 1 38 38 GLN N N 15 126.279 0.067 . 1 . . . . . 38 GLN N . 19518 1 411 . 1 1 38 38 GLN NE2 N 15 113.567 0.163 . 1 . . . . . 38 GLN NE2 . 19518 1 412 . 1 1 39 39 ASN H H 1 7.886 0.006 . 1 . . . . . 39 ASN H . 19518 1 413 . 1 1 39 39 ASN HA H 1 4.624 0.010 . 1 . . . . . 39 ASN HA . 19518 1 414 . 1 1 39 39 ASN HB2 H 1 2.756 0.005 . 1 . . . . . 39 ASN HB2 . 19518 1 415 . 1 1 39 39 ASN HB3 H 1 3.158 0.009 . 1 . . . . . 39 ASN HB3 . 19518 1 416 . 1 1 39 39 ASN C C 13 174.832 0.000 . 1 . . . . . 39 ASN C . 19518 1 417 . 1 1 39 39 ASN CA C 13 51.954 0.127 . 1 . . . . . 39 ASN CA . 19518 1 418 . 1 1 39 39 ASN CB C 13 36.712 0.034 . 1 . . . . . 39 ASN CB . 19518 1 419 . 1 1 39 39 ASN N N 15 112.792 0.047 . 1 . . . . . 39 ASN N . 19518 1 420 . 1 1 40 40 ARG H H 1 7.725 0.006 . 1 . . . . . 40 ARG H . 19518 1 421 . 1 1 40 40 ARG HA H 1 3.794 0.008 . 1 . . . . . 40 ARG HA . 19518 1 422 . 1 1 40 40 ARG HB2 H 1 1.824 0.009 . 1 . . . . . 40 ARG HB2 . 19518 1 423 . 1 1 40 40 ARG HB3 H 1 1.824 0.009 . 1 . . . . . 40 ARG HB3 . 19518 1 424 . 1 1 40 40 ARG HG2 H 1 1.472 0.003 . 1 . . . . . 40 ARG HG2 . 19518 1 425 . 1 1 40 40 ARG HG3 H 1 1.472 0.003 . 1 . . . . . 40 ARG HG3 . 19518 1 426 . 1 1 40 40 ARG HD2 H 1 3.186 0.002 . 1 . . . . . 40 ARG HD2 . 19518 1 427 . 1 1 40 40 ARG HD3 H 1 3.186 0.002 . 1 . . . . . 40 ARG HD3 . 19518 1 428 . 1 1 40 40 ARG C C 13 175.658 0.000 . 1 . . . . . 40 ARG C . 19518 1 429 . 1 1 40 40 ARG CA C 13 56.637 0.023 . 1 . . . . . 40 ARG CA . 19518 1 430 . 1 1 40 40 ARG CB C 13 26.715 0.088 . 1 . . . . . 40 ARG CB . 19518 1 431 . 1 1 40 40 ARG CG C 13 26.924 0.034 . 1 . . . . . 40 ARG CG . 19518 1 432 . 1 1 40 40 ARG CD C 13 42.945 0.000 . 1 . . . . . 40 ARG CD . 19518 1 433 . 1 1 40 40 ARG N N 15 115.720 0.084 . 1 . . . . . 40 ARG N . 19518 1 434 . 1 1 41 41 ASP H H 1 8.202 0.004 . 1 . . . . . 41 ASP H . 19518 1 435 . 1 1 41 41 ASP HA H 1 4.683 0.011 . 1 . . . . . 41 ASP HA . 19518 1 436 . 1 1 41 41 ASP HB2 H 1 3.143 0.003 . 1 . . . . . 41 ASP HB2 . 19518 1 437 . 1 1 41 41 ASP HB3 H 1 2.404 0.020 . 1 . . . . . 41 ASP HB3 . 19518 1 438 . 1 1 41 41 ASP C C 13 177.640 0.000 . 1 . . . . . 41 ASP C . 19518 1 439 . 1 1 41 41 ASP CA C 13 53.295 0.042 . 1 . . . . . 41 ASP CA . 19518 1 440 . 1 1 41 41 ASP CB C 13 41.223 0.050 . 1 . . . . . 41 ASP CB . 19518 1 441 . 1 1 41 41 ASP N N 15 118.571 0.044 . 1 . . . . . 41 ASP N . 19518 1 442 . 1 1 42 42 GLY H H 1 10.489 0.005 . 1 . . . . . 42 GLY H . 19518 1 443 . 1 1 42 42 GLY HA2 H 1 4.025 0.002 . 1 . . . . . 42 GLY HA2 . 19518 1 444 . 1 1 42 42 GLY HA3 H 1 3.387 0.004 . 1 . . . . . 42 GLY HA3 . 19518 1 445 . 1 1 42 42 GLY C C 13 173.503 0.000 . 1 . . . . . 42 GLY C . 19518 1 446 . 1 1 42 42 GLY CA C 13 45.156 0.038 . 1 . . . . . 42 GLY CA . 19518 1 447 . 1 1 42 42 GLY N N 15 112.569 0.034 . 1 . . . . . 42 GLY N . 19518 1 448 . 1 1 43 43 PHE H H 1 7.807 0.006 . 1 . . . . . 43 PHE H . 19518 1 449 . 1 1 43 43 PHE HA H 1 5.478 0.062 . 1 . . . . . 43 PHE HA . 19518 1 450 . 1 1 43 43 PHE HB2 H 1 2.627 0.024 . 1 . . . . . 43 PHE HB2 . 19518 1 451 . 1 1 43 43 PHE HB3 H 1 2.627 0.024 . 1 . . . . . 43 PHE HB3 . 19518 1 452 . 1 1 43 43 PHE HD1 H 1 6.860 0.015 . 3 . . . . . 43 PHE HD1 . 19518 1 453 . 1 1 43 43 PHE HD2 H 1 6.860 0.015 . 3 . . . . . 43 PHE HD2 . 19518 1 454 . 1 1 43 43 PHE HE1 H 1 7.281 0.000 . 3 . . . . . 43 PHE HE1 . 19518 1 455 . 1 1 43 43 PHE HE2 H 1 7.281 0.000 . 3 . . . . . 43 PHE HE2 . 19518 1 456 . 1 1 43 43 PHE C C 13 177.444 0.000 . 1 . . . . . 43 PHE C . 19518 1 457 . 1 1 43 43 PHE CA C 13 56.160 0.068 . 1 . . . . . 43 PHE CA . 19518 1 458 . 1 1 43 43 PHE CB C 13 42.945 0.004 . 1 . . . . . 43 PHE CB . 19518 1 459 . 1 1 43 43 PHE CD1 C 13 132.900 0.032 . 3 . . . . . 43 PHE CD1 . 19518 1 460 . 1 1 43 43 PHE CD2 C 13 132.900 0.032 . 3 . . . . . 43 PHE CD2 . 19518 1 461 . 1 1 43 43 PHE N N 15 116.892 0.048 . 1 . . . . . 43 PHE N . 19518 1 462 . 1 1 44 44 ILE H H 1 9.060 0.005 . 1 . . . . . 44 ILE H . 19518 1 463 . 1 1 44 44 ILE HA H 1 4.624 0.004 . 1 . . . . . 44 ILE HA . 19518 1 464 . 1 1 44 44 ILE HB H 1 2.060 0.000 . 1 . . . . . 44 ILE HB . 19518 1 465 . 1 1 44 44 ILE HG21 H 1 0.951 0.006 . 1 . . . . . 44 ILE HG21 . 19518 1 466 . 1 1 44 44 ILE HG22 H 1 0.951 0.006 . 1 . . . . . 44 ILE HG22 . 19518 1 467 . 1 1 44 44 ILE HG23 H 1 0.951 0.006 . 1 . . . . . 44 ILE HG23 . 19518 1 468 . 1 1 44 44 ILE HD11 H 1 0.279 0.005 . 1 . . . . . 44 ILE HD11 . 19518 1 469 . 1 1 44 44 ILE HD12 H 1 0.279 0.005 . 1 . . . . . 44 ILE HD12 . 19518 1 470 . 1 1 44 44 ILE HD13 H 1 0.279 0.005 . 1 . . . . . 44 ILE HD13 . 19518 1 471 . 1 1 44 44 ILE CA C 13 60.664 0.063 . 1 . . . . . 44 ILE CA . 19518 1 472 . 1 1 44 44 ILE CB C 13 37.919 0.009 . 1 . . . . . 44 ILE CB . 19518 1 473 . 1 1 44 44 ILE CG2 C 13 18.193 0.036 . 1 . . . . . 44 ILE CG2 . 19518 1 474 . 1 1 44 44 ILE CD1 C 13 14.638 0.054 . 1 . . . . . 44 ILE CD1 . 19518 1 475 . 1 1 44 44 ILE N N 15 124.898 0.066 . 1 . . . . . 44 ILE N . 19518 1 476 . 1 1 45 45 ASP H H 1 9.124 0.015 . 1 . . . . . 45 ASP H . 19518 1 477 . 1 1 45 45 ASP HA H 1 4.940 0.027 . 1 . . . . . 45 ASP HA . 19518 1 478 . 1 1 45 45 ASP HB2 H 1 3.236 0.007 . 1 . . . . . 45 ASP HB2 . 19518 1 479 . 1 1 45 45 ASP HB3 H 1 2.470 0.002 . 1 . . . . . 45 ASP HB3 . 19518 1 480 . 1 1 45 45 ASP C C 13 176.623 0.000 . 1 . . . . . 45 ASP C . 19518 1 481 . 1 1 45 45 ASP CA C 13 51.450 0.097 . 1 . . . . . 45 ASP CA . 19518 1 482 . 1 1 45 45 ASP CB C 13 43.432 0.079 . 1 . . . . . 45 ASP CB . 19518 1 483 . 1 1 45 45 ASP N N 15 128.672 0.097 . 1 . . . . . 45 ASP N . 19518 1 484 . 1 1 46 46 LYS H H 1 8.347 0.006 . 1 . . . . . 46 LYS H . 19518 1 485 . 1 1 46 46 LYS HA H 1 3.726 0.011 . 1 . . . . . 46 LYS HA . 19518 1 486 . 1 1 46 46 LYS HB2 H 1 1.713 0.010 . 1 . . . . . 46 LYS HB2 . 19518 1 487 . 1 1 46 46 LYS HB3 H 1 1.713 0.010 . 1 . . . . . 46 LYS HB3 . 19518 1 488 . 1 1 46 46 LYS HD2 H 1 1.702 0.001 . 1 . . . . . 46 LYS HD2 . 19518 1 489 . 1 1 46 46 LYS HD3 H 1 1.702 0.001 . 1 . . . . . 46 LYS HD3 . 19518 1 490 . 1 1 46 46 LYS HE2 H 1 3.058 0.002 . 1 . . . . . 46 LYS HE2 . 19518 1 491 . 1 1 46 46 LYS HE3 H 1 3.058 0.002 . 1 . . . . . 46 LYS HE3 . 19518 1 492 . 1 1 46 46 LYS CA C 13 60.032 0.050 . 1 . . . . . 46 LYS CA . 19518 1 493 . 1 1 46 46 LYS CB C 13 31.935 0.175 . 1 . . . . . 46 LYS CB . 19518 1 494 . 1 1 46 46 LYS CD C 13 30.269 0.027 . 1 . . . . . 46 LYS CD . 19518 1 495 . 1 1 46 46 LYS CE C 13 40.617 0.000 . 1 . . . . . 46 LYS CE . 19518 1 496 . 1 1 46 46 LYS N N 15 115.773 0.039 . 1 . . . . . 46 LYS N . 19518 1 497 . 1 1 47 47 ASN H H 1 7.884 0.007 . 1 . . . . . 47 ASN H . 19518 1 498 . 1 1 47 47 ASN HA H 1 4.273 0.013 . 1 . . . . . 47 ASN HA . 19518 1 499 . 1 1 47 47 ASN HB2 H 1 2.742 0.008 . 1 . . . . . 47 ASN HB2 . 19518 1 500 . 1 1 47 47 ASN HB3 H 1 2.934 0.007 . 1 . . . . . 47 ASN HB3 . 19518 1 501 . 1 1 47 47 ASN HD21 H 1 7.739 0.008 . 1 . . . . . 47 ASN HD21 . 19518 1 502 . 1 1 47 47 ASN HD22 H 1 6.845 0.010 . 1 . . . . . 47 ASN HD22 . 19518 1 503 . 1 1 47 47 ASN C C 13 177.459 0.000 . 1 . . . . . 47 ASN C . 19518 1 504 . 1 1 47 47 ASN CA C 13 56.195 0.082 . 1 . . . . . 47 ASN CA . 19518 1 505 . 1 1 47 47 ASN CB C 13 37.622 0.033 . 1 . . . . . 47 ASN CB . 19518 1 506 . 1 1 47 47 ASN N N 15 119.644 0.079 . 1 . . . . . 47 ASN N . 19518 1 507 . 1 1 47 47 ASN ND2 N 15 114.560 0.157 . 1 . . . . . 47 ASN ND2 . 19518 1 508 . 1 1 48 48 ASP H H 1 8.272 0.010 . 1 . . . . . 48 ASP H . 19518 1 509 . 1 1 48 48 ASP HA H 1 3.777 0.008 . 1 . . . . . 48 ASP HA . 19518 1 510 . 1 1 48 48 ASP HB2 H 1 3.047 0.008 . 1 . . . . . 48 ASP HB2 . 19518 1 511 . 1 1 48 48 ASP HB3 H 1 3.045 0.008 . 1 . . . . . 48 ASP HB3 . 19518 1 512 . 1 1 48 48 ASP C C 13 180.781 0.000 . 1 . . . . . 48 ASP C . 19518 1 513 . 1 1 48 48 ASP CA C 13 56.523 0.042 . 1 . . . . . 48 ASP CA . 19518 1 514 . 1 1 48 48 ASP CB C 13 40.720 0.161 . 1 . . . . . 48 ASP CB . 19518 1 515 . 1 1 48 48 ASP N N 15 121.347 0.508 . 1 . . . . . 48 ASP N . 19518 1 516 . 1 1 49 49 LEU H H 1 7.986 0.005 . 1 . . . . . 49 LEU H . 19518 1 517 . 1 1 49 49 LEU HA H 1 3.763 0.012 . 1 . . . . . 49 LEU HA . 19518 1 518 . 1 1 49 49 LEU HB2 H 1 1.564 0.014 . 1 . . . . . 49 LEU HB2 . 19518 1 519 . 1 1 49 49 LEU HB3 H 1 1.564 0.014 . 1 . . . . . 49 LEU HB3 . 19518 1 520 . 1 1 49 49 LEU HD11 H 1 0.634 0.007 . 1 . . . . . 49 LEU HD11 . 19518 1 521 . 1 1 49 49 LEU HD12 H 1 0.634 0.007 . 1 . . . . . 49 LEU HD12 . 19518 1 522 . 1 1 49 49 LEU HD13 H 1 0.634 0.007 . 1 . . . . . 49 LEU HD13 . 19518 1 523 . 1 1 49 49 LEU HD21 H 1 0.392 0.006 . 1 . . . . . 49 LEU HD21 . 19518 1 524 . 1 1 49 49 LEU HD22 H 1 0.392 0.006 . 1 . . . . . 49 LEU HD22 . 19518 1 525 . 1 1 49 49 LEU HD23 H 1 0.392 0.006 . 1 . . . . . 49 LEU HD23 . 19518 1 526 . 1 1 49 49 LEU C C 13 178.025 0.000 . 1 . . . . . 49 LEU C . 19518 1 527 . 1 1 49 49 LEU CA C 13 58.237 0.151 . 1 . . . . . 49 LEU CA . 19518 1 528 . 1 1 49 49 LEU CB C 13 41.584 0.060 . 1 . . . . . 49 LEU CB . 19518 1 529 . 1 1 49 49 LEU CD1 C 13 26.480 0.047 . 1 . . . . . 49 LEU CD1 . 19518 1 530 . 1 1 49 49 LEU CD2 C 13 22.637 0.016 . 1 . . . . . 49 LEU CD2 . 19518 1 531 . 1 1 49 49 LEU N N 15 119.812 0.485 . 1 . . . . . 49 LEU N . 19518 1 532 . 1 1 50 50 ARG H H 1 8.265 0.042 . 1 . . . . . 50 ARG H . 19518 1 533 . 1 1 50 50 ARG HA H 1 3.780 0.013 . 1 . . . . . 50 ARG HA . 19518 1 534 . 1 1 50 50 ARG HB2 H 1 1.902 0.015 . 1 . . . . . 50 ARG HB2 . 19518 1 535 . 1 1 50 50 ARG HB3 H 1 1.894 0.014 . 1 . . . . . 50 ARG HB3 . 19518 1 536 . 1 1 50 50 ARG HG2 H 1 1.474 0.005 . 1 . . . . . 50 ARG HG2 . 19518 1 537 . 1 1 50 50 ARG HG3 H 1 1.474 0.005 . 1 . . . . . 50 ARG HG3 . 19518 1 538 . 1 1 50 50 ARG HD2 H 1 3.024 0.001 . 1 . . . . . 50 ARG HD2 . 19518 1 539 . 1 1 50 50 ARG HD3 H 1 3.024 0.001 . 1 . . . . . 50 ARG HD3 . 19518 1 540 . 1 1 50 50 ARG C C 13 179.353 0.000 . 1 . . . . . 50 ARG C . 19518 1 541 . 1 1 50 50 ARG CA C 13 60.918 0.027 . 1 . . . . . 50 ARG CA . 19518 1 542 . 1 1 50 50 ARG CB C 13 29.233 0.220 . 1 . . . . . 50 ARG CB . 19518 1 543 . 1 1 50 50 ARG CG C 13 26.656 0.000 . 1 . . . . . 50 ARG CG . 19518 1 544 . 1 1 50 50 ARG CD C 13 43.329 0.019 . 1 . . . . . 50 ARG CD . 19518 1 545 . 1 1 50 50 ARG N N 15 121.053 0.086 . 1 . . . . . 50 ARG N . 19518 1 546 . 1 1 51 51 ASP H H 1 8.367 0.034 . 1 . . . . . 51 ASP H . 19518 1 547 . 1 1 51 51 ASP HA H 1 4.407 0.009 . 1 . . . . . 51 ASP HA . 19518 1 548 . 1 1 51 51 ASP HB2 H 1 2.537 0.005 . 1 . . . . . 51 ASP HB2 . 19518 1 549 . 1 1 51 51 ASP HB3 H 1 2.537 0.005 . 1 . . . . . 51 ASP HB3 . 19518 1 550 . 1 1 51 51 ASP CA C 13 57.587 0.114 . 1 . . . . . 51 ASP CA . 19518 1 551 . 1 1 51 51 ASP CB C 13 39.645 0.101 . 1 . . . . . 51 ASP CB . 19518 1 552 . 1 1 51 51 ASP N N 15 119.822 0.129 . 1 . . . . . 51 ASP N . 19518 1 553 . 1 1 52 52 THR H H 1 8.178 0.070 . 1 . . . . . 52 THR H . 19518 1 554 . 1 1 52 52 THR HA H 1 3.726 0.009 . 1 . . . . . 52 THR HA . 19518 1 555 . 1 1 52 52 THR HB H 1 4.067 0.016 . 1 . . . . . 52 THR HB . 19518 1 556 . 1 1 52 52 THR HG21 H 1 0.839 0.006 . 1 . . . . . 52 THR HG21 . 19518 1 557 . 1 1 52 52 THR HG22 H 1 0.839 0.006 . 1 . . . . . 52 THR HG22 . 19518 1 558 . 1 1 52 52 THR HG23 H 1 0.839 0.006 . 1 . . . . . 52 THR HG23 . 19518 1 559 . 1 1 52 52 THR C C 13 176.081 0.000 . 1 . . . . . 52 THR C . 19518 1 560 . 1 1 52 52 THR CA C 13 67.790 0.026 . 1 . . . . . 52 THR CA . 19518 1 561 . 1 1 52 52 THR CB C 13 67.783 0.017 . 1 . . . . . 52 THR CB . 19518 1 562 . 1 1 52 52 THR CG2 C 13 21.998 0.036 . 1 . . . . . 52 THR CG2 . 19518 1 563 . 1 1 52 52 THR N N 15 123.507 0.581 . 1 . . . . . 52 THR N . 19518 1 564 . 1 1 53 53 PHE H H 1 8.544 0.015 . 1 . . . . . 53 PHE H . 19518 1 565 . 1 1 53 53 PHE HA H 1 4.052 0.005 . 1 . . . . . 53 PHE HA . 19518 1 566 . 1 1 53 53 PHE HB2 H 1 2.924 0.003 . 1 . . . . . 53 PHE HB2 . 19518 1 567 . 1 1 53 53 PHE HB3 H 1 3.097 0.011 . 1 . . . . . 53 PHE HB3 . 19518 1 568 . 1 1 53 53 PHE HD1 H 1 6.968 0.020 . 3 . . . . . 53 PHE HD1 . 19518 1 569 . 1 1 53 53 PHE HD2 H 1 6.968 0.020 . 3 . . . . . 53 PHE HD2 . 19518 1 570 . 1 1 53 53 PHE C C 13 178.750 0.000 . 1 . . . . . 53 PHE C . 19518 1 571 . 1 1 53 53 PHE CA C 13 62.794 0.043 . 1 . . . . . 53 PHE CA . 19518 1 572 . 1 1 53 53 PHE CB C 13 37.387 0.054 . 1 . . . . . 53 PHE CB . 19518 1 573 . 1 1 53 53 PHE N N 15 119.340 0.077 . 1 . . . . . 53 PHE N . 19518 1 574 . 1 1 54 54 ALA H H 1 8.005 0.004 . 1 . . . . . 54 ALA H . 19518 1 575 . 1 1 54 54 ALA HA H 1 3.877 0.007 . 1 . . . . . 54 ALA HA . 19518 1 576 . 1 1 54 54 ALA HB1 H 1 1.470 0.005 . 1 . . . . . 54 ALA HB1 . 19518 1 577 . 1 1 54 54 ALA HB2 H 1 1.470 0.005 . 1 . . . . . 54 ALA HB2 . 19518 1 578 . 1 1 54 54 ALA HB3 H 1 1.470 0.005 . 1 . . . . . 54 ALA HB3 . 19518 1 579 . 1 1 54 54 ALA C C 13 181.227 0.000 . 1 . . . . . 54 ALA C . 19518 1 580 . 1 1 54 54 ALA CA C 13 55.496 0.060 . 1 . . . . . 54 ALA CA . 19518 1 581 . 1 1 54 54 ALA CB C 13 17.597 0.114 . 1 . . . . . 54 ALA CB . 19518 1 582 . 1 1 54 54 ALA N N 15 121.067 0.071 . 1 . . . . . 54 ALA N . 19518 1 583 . 1 1 55 55 ALA H H 1 7.796 0.006 . 1 . . . . . 55 ALA H . 19518 1 584 . 1 1 55 55 ALA HA H 1 4.070 0.007 . 1 . . . . . 55 ALA HA . 19518 1 585 . 1 1 55 55 ALA HB1 H 1 1.466 0.003 . 1 . . . . . 55 ALA HB1 . 19518 1 586 . 1 1 55 55 ALA HB2 H 1 1.466 0.003 . 1 . . . . . 55 ALA HB2 . 19518 1 587 . 1 1 55 55 ALA HB3 H 1 1.466 0.003 . 1 . . . . . 55 ALA HB3 . 19518 1 588 . 1 1 55 55 ALA C C 13 179.596 0.000 . 1 . . . . . 55 ALA C . 19518 1 589 . 1 1 55 55 ALA CA C 13 54.610 0.052 . 1 . . . . . 55 ALA CA . 19518 1 590 . 1 1 55 55 ALA CB C 13 17.327 0.062 . 1 . . . . . 55 ALA CB . 19518 1 591 . 1 1 55 55 ALA N N 15 122.857 0.044 . 1 . . . . . 55 ALA N . 19518 1 592 . 1 1 56 56 LEU H H 1 7.430 0.005 . 1 . . . . . 56 LEU H . 19518 1 593 . 1 1 56 56 LEU HA H 1 4.273 0.011 . 1 . . . . . 56 LEU HA . 19518 1 594 . 1 1 56 56 LEU HB2 H 1 1.798 0.019 . 1 . . . . . 56 LEU HB2 . 19518 1 595 . 1 1 56 56 LEU HB3 H 1 1.604 0.007 . 1 . . . . . 56 LEU HB3 . 19518 1 596 . 1 1 56 56 LEU HD11 H 1 0.556 0.002 . 1 . . . . . 56 LEU HD11 . 19518 1 597 . 1 1 56 56 LEU HD12 H 1 0.556 0.002 . 1 . . . . . 56 LEU HD12 . 19518 1 598 . 1 1 56 56 LEU HD13 H 1 0.556 0.002 . 1 . . . . . 56 LEU HD13 . 19518 1 599 . 1 1 56 56 LEU HD21 H 1 0.694 0.006 . 1 . . . . . 56 LEU HD21 . 19518 1 600 . 1 1 56 56 LEU HD22 H 1 0.694 0.006 . 1 . . . . . 56 LEU HD22 . 19518 1 601 . 1 1 56 56 LEU HD23 H 1 0.694 0.006 . 1 . . . . . 56 LEU HD23 . 19518 1 602 . 1 1 56 56 LEU C C 13 177.503 0.000 . 1 . . . . . 56 LEU C . 19518 1 603 . 1 1 56 56 LEU CA C 13 54.715 0.087 . 1 . . . . . 56 LEU CA . 19518 1 604 . 1 1 56 56 LEU CB C 13 41.903 0.040 . 1 . . . . . 56 LEU CB . 19518 1 605 . 1 1 56 56 LEU CD1 C 13 26.553 0.088 . 1 . . . . . 56 LEU CD1 . 19518 1 606 . 1 1 56 56 LEU CD2 C 13 22.750 0.036 . 1 . . . . . 56 LEU CD2 . 19518 1 607 . 1 1 56 56 LEU N N 15 116.888 0.030 . 1 . . . . . 56 LEU N . 19518 1 608 . 1 1 57 57 GLY H H 1 7.782 0.005 . 1 . . . . . 57 GLY H . 19518 1 609 . 1 1 57 57 GLY HA2 H 1 4.203 0.017 . 1 . . . . . 57 GLY HA2 . 19518 1 610 . 1 1 57 57 GLY HA3 H 1 3.625 0.011 . 1 . . . . . 57 GLY HA3 . 19518 1 611 . 1 1 57 57 GLY C C 13 179.859 0.000 . 1 . . . . . 57 GLY C . 19518 1 612 . 1 1 57 57 GLY CA C 13 45.428 0.024 . 1 . . . . . 57 GLY CA . 19518 1 613 . 1 1 57 57 GLY N N 15 107.444 0.031 . 1 . . . . . 57 GLY N . 19518 1 614 . 1 1 58 58 ARG H H 1 8.129 0.005 . 1 . . . . . 58 ARG H . 19518 1 615 . 1 1 58 58 ARG HA H 1 4.425 0.007 . 1 . . . . . 58 ARG HA . 19518 1 616 . 1 1 58 58 ARG HB2 H 1 1.514 0.007 . 1 . . . . . 58 ARG HB2 . 19518 1 617 . 1 1 58 58 ARG HB3 H 1 1.514 0.007 . 1 . . . . . 58 ARG HB3 . 19518 1 618 . 1 1 58 58 ARG HG2 H 1 1.520 0.000 . 1 . . . . . 58 ARG HG2 . 19518 1 619 . 1 1 58 58 ARG HG3 H 1 1.520 0.000 . 1 . . . . . 58 ARG HG3 . 19518 1 620 . 1 1 58 58 ARG HD2 H 1 3.023 0.000 . 1 . . . . . 58 ARG HD2 . 19518 1 621 . 1 1 58 58 ARG HD3 H 1 3.023 0.000 . 1 . . . . . 58 ARG HD3 . 19518 1 622 . 1 1 58 58 ARG C C 13 175.506 0.000 . 1 . . . . . 58 ARG C . 19518 1 623 . 1 1 58 58 ARG CA C 13 55.113 0.072 . 1 . . . . . 58 ARG CA . 19518 1 624 . 1 1 58 58 ARG CB C 13 29.223 0.092 . 1 . . . . . 58 ARG CB . 19518 1 625 . 1 1 58 58 ARG CG C 13 26.773 0.000 . 1 . . . . . 58 ARG CG . 19518 1 626 . 1 1 58 58 ARG CD C 13 43.274 0.000 . 1 . . . . . 58 ARG CD . 19518 1 627 . 1 1 58 58 ARG N N 15 122.393 0.039 . 1 . . . . . 58 ARG N . 19518 1 628 . 1 1 59 59 VAL H H 1 7.840 0.006 . 1 . . . . . 59 VAL H . 19518 1 629 . 1 1 59 59 VAL HA H 1 4.007 0.006 . 1 . . . . . 59 VAL HA . 19518 1 630 . 1 1 59 59 VAL HB H 1 2.081 0.006 . 1 . . . . . 59 VAL HB . 19518 1 631 . 1 1 59 59 VAL HG11 H 1 0.800 0.007 . 1 . . . . . 59 VAL HG11 . 19518 1 632 . 1 1 59 59 VAL HG12 H 1 0.800 0.007 . 1 . . . . . 59 VAL HG12 . 19518 1 633 . 1 1 59 59 VAL HG13 H 1 0.800 0.007 . 1 . . . . . 59 VAL HG13 . 19518 1 634 . 1 1 59 59 VAL HG21 H 1 0.776 0.008 . 1 . . . . . 59 VAL HG21 . 19518 1 635 . 1 1 59 59 VAL HG22 H 1 0.776 0.008 . 1 . . . . . 59 VAL HG22 . 19518 1 636 . 1 1 59 59 VAL HG23 H 1 0.776 0.008 . 1 . . . . . 59 VAL HG23 . 19518 1 637 . 1 1 59 59 VAL C C 13 175.634 0.000 . 1 . . . . . 59 VAL C . 19518 1 638 . 1 1 59 59 VAL CA C 13 61.965 0.067 . 1 . . . . . 59 VAL CA . 19518 1 639 . 1 1 59 59 VAL CB C 13 32.199 0.005 . 1 . . . . . 59 VAL CB . 19518 1 640 . 1 1 59 59 VAL CG1 C 13 21.531 0.030 . 1 . . . . . 59 VAL CG1 . 19518 1 641 . 1 1 59 59 VAL CG2 C 13 19.475 0.054 . 1 . . . . . 59 VAL CG2 . 19518 1 642 . 1 1 59 59 VAL N N 15 118.558 0.075 . 1 . . . . . 59 VAL N . 19518 1 643 . 1 1 60 60 ASN H H 1 8.368 0.004 . 1 . . . . . 60 ASN H . 19518 1 644 . 1 1 60 60 ASN HA H 1 4.511 0.027 . 1 . . . . . 60 ASN HA . 19518 1 645 . 1 1 60 60 ASN HB2 H 1 2.672 0.007 . 1 . . . . . 60 ASN HB2 . 19518 1 646 . 1 1 60 60 ASN HB3 H 1 2.672 0.007 . 1 . . . . . 60 ASN HB3 . 19518 1 647 . 1 1 60 60 ASN HD21 H 1 6.771 0.006 . 1 . . . . . 60 ASN HD21 . 19518 1 648 . 1 1 60 60 ASN HD22 H 1 7.463 0.005 . 1 . . . . . 60 ASN HD22 . 19518 1 649 . 1 1 60 60 ASN C C 13 174.650 0.000 . 1 . . . . . 60 ASN C . 19518 1 650 . 1 1 60 60 ASN CA C 13 52.964 0.074 . 1 . . . . . 60 ASN CA . 19518 1 651 . 1 1 60 60 ASN CB C 13 37.859 0.037 . 1 . . . . . 60 ASN CB . 19518 1 652 . 1 1 60 60 ASN N N 15 119.689 0.063 . 1 . . . . . 60 ASN N . 19518 1 653 . 1 1 60 60 ASN ND2 N 15 112.771 0.115 . 1 . . . . . 60 ASN ND2 . 19518 1 654 . 1 1 61 61 VAL H H 1 7.531 0.005 . 1 . . . . . 61 VAL H . 19518 1 655 . 1 1 61 61 VAL HA H 1 3.611 0.005 . 1 . . . . . 61 VAL HA . 19518 1 656 . 1 1 61 61 VAL HB H 1 1.490 0.007 . 1 . . . . . 61 VAL HB . 19518 1 657 . 1 1 61 61 VAL HG11 H 1 0.282 0.004 . 1 . . . . . 61 VAL HG11 . 19518 1 658 . 1 1 61 61 VAL HG12 H 1 0.282 0.004 . 1 . . . . . 61 VAL HG12 . 19518 1 659 . 1 1 61 61 VAL HG13 H 1 0.282 0.004 . 1 . . . . . 61 VAL HG13 . 19518 1 660 . 1 1 61 61 VAL HG21 H 1 0.453 0.004 . 1 . . . . . 61 VAL HG21 . 19518 1 661 . 1 1 61 61 VAL HG22 H 1 0.453 0.004 . 1 . . . . . 61 VAL HG22 . 19518 1 662 . 1 1 61 61 VAL HG23 H 1 0.453 0.004 . 1 . . . . . 61 VAL HG23 . 19518 1 663 . 1 1 61 61 VAL C C 13 175.835 0.000 . 1 . . . . . 61 VAL C . 19518 1 664 . 1 1 61 61 VAL CA C 13 62.329 0.116 . 1 . . . . . 61 VAL CA . 19518 1 665 . 1 1 61 61 VAL CB C 13 32.010 0.093 . 1 . . . . . 61 VAL CB . 19518 1 666 . 1 1 61 61 VAL CG1 C 13 21.387 0.059 . 1 . . . . . 61 VAL CG1 . 19518 1 667 . 1 1 61 61 VAL CG2 C 13 20.733 0.036 . 1 . . . . . 61 VAL CG2 . 19518 1 668 . 1 1 61 61 VAL N N 15 121.101 0.079 . 1 . . . . . 61 VAL N . 19518 1 669 . 1 1 62 62 LYS H H 1 8.719 0.006 . 1 . . . . . 62 LYS H . 19518 1 670 . 1 1 62 62 LYS HA H 1 4.200 0.007 . 1 . . . . . 62 LYS HA . 19518 1 671 . 1 1 62 62 LYS HB2 H 1 1.625 0.007 . 1 . . . . . 62 LYS HB2 . 19518 1 672 . 1 1 62 62 LYS HB3 H 1 1.625 0.007 . 1 . . . . . 62 LYS HB3 . 19518 1 673 . 1 1 62 62 LYS HG2 H 1 1.373 0.004 . 1 . . . . . 62 LYS HG2 . 19518 1 674 . 1 1 62 62 LYS HG3 H 1 1.373 0.004 . 1 . . . . . 62 LYS HG3 . 19518 1 675 . 1 1 62 62 LYS HD2 H 1 1.528 0.000 . 1 . . . . . 62 LYS HD2 . 19518 1 676 . 1 1 62 62 LYS HD3 H 1 1.528 0.000 . 1 . . . . . 62 LYS HD3 . 19518 1 677 . 1 1 62 62 LYS HE2 H 1 2.862 0.008 . 1 . . . . . 62 LYS HE2 . 19518 1 678 . 1 1 62 62 LYS HE3 H 1 2.862 0.008 . 1 . . . . . 62 LYS HE3 . 19518 1 679 . 1 1 62 62 LYS CA C 13 56.026 0.039 . 1 . . . . . 62 LYS CA . 19518 1 680 . 1 1 62 62 LYS CB C 13 32.704 0.099 . 1 . . . . . 62 LYS CB . 19518 1 681 . 1 1 62 62 LYS CG C 13 25.266 0.000 . 1 . . . . . 62 LYS CG . 19518 1 682 . 1 1 62 62 LYS CD C 13 29.164 0.000 . 1 . . . . . 62 LYS CD . 19518 1 683 . 1 1 62 62 LYS N N 15 128.253 0.129 . 1 . . . . . 62 LYS N . 19518 1 684 . 1 1 63 63 ASN HA H 1 4.089 0.007 . 1 . . . . . 63 ASN HA . 19518 1 685 . 1 1 63 63 ASN HB2 H 1 2.646 0.005 . 1 . . . . . 63 ASN HB2 . 19518 1 686 . 1 1 63 63 ASN HB3 H 1 2.646 0.005 . 1 . . . . . 63 ASN HB3 . 19518 1 687 . 1 1 63 63 ASN HD21 H 1 7.629 0.006 . 1 . . . . . 63 ASN HD21 . 19518 1 688 . 1 1 63 63 ASN HD22 H 1 6.907 0.009 . 1 . . . . . 63 ASN HD22 . 19518 1 689 . 1 1 63 63 ASN C C 13 177.419 0.000 . 1 . . . . . 63 ASN C . 19518 1 690 . 1 1 63 63 ASN CA C 13 56.723 0.074 . 1 . . . . . 63 ASN CA . 19518 1 691 . 1 1 63 63 ASN CB C 13 37.910 0.040 . 1 . . . . . 63 ASN CB . 19518 1 692 . 1 1 63 63 ASN ND2 N 15 113.738 0.159 . 1 . . . . . 63 ASN ND2 . 19518 1 693 . 1 1 64 64 GLU H H 1 9.550 0.015 . 1 . . . . . 64 GLU H . 19518 1 694 . 1 1 64 64 GLU HA H 1 3.978 0.007 . 1 . . . . . 64 GLU HA . 19518 1 695 . 1 1 64 64 GLU HB2 H 1 1.929 0.016 . 1 . . . . . 64 GLU HB2 . 19518 1 696 . 1 1 64 64 GLU HB3 H 1 1.929 0.016 . 1 . . . . . 64 GLU HB3 . 19518 1 697 . 1 1 64 64 GLU HG2 H 1 2.272 0.028 . 1 . . . . . 64 GLU HG2 . 19518 1 698 . 1 1 64 64 GLU HG3 H 1 2.272 0.028 . 1 . . . . . 64 GLU HG3 . 19518 1 699 . 1 1 64 64 GLU C C 13 178.436 0.000 . 1 . . . . . 64 GLU C . 19518 1 700 . 1 1 64 64 GLU CA C 13 60.209 0.050 . 1 . . . . . 64 GLU CA . 19518 1 701 . 1 1 64 64 GLU CB C 13 28.574 0.110 . 1 . . . . . 64 GLU CB . 19518 1 702 . 1 1 64 64 GLU CG C 13 36.871 0.000 . 1 . . . . . 64 GLU CG . 19518 1 703 . 1 1 64 64 GLU N N 15 117.781 0.054 . 1 . . . . . 64 GLU N . 19518 1 704 . 1 1 65 65 GLU H H 1 6.998 0.020 . 1 . . . . . 65 GLU H . 19518 1 705 . 1 1 65 65 GLU HA H 1 3.923 0.009 . 1 . . . . . 65 GLU HA . 19518 1 706 . 1 1 65 65 GLU HB2 H 1 1.827 0.012 . 1 . . . . . 65 GLU HB2 . 19518 1 707 . 1 1 65 65 GLU HB3 H 1 1.827 0.012 . 1 . . . . . 65 GLU HB3 . 19518 1 708 . 1 1 65 65 GLU HG2 H 1 2.220 0.011 . 1 . . . . . 65 GLU HG2 . 19518 1 709 . 1 1 65 65 GLU HG3 H 1 2.220 0.011 . 1 . . . . . 65 GLU HG3 . 19518 1 710 . 1 1 65 65 GLU C C 13 178.844 0.000 . 1 . . . . . 65 GLU C . 19518 1 711 . 1 1 65 65 GLU CA C 13 59.013 0.053 . 1 . . . . . 65 GLU CA . 19518 1 712 . 1 1 65 65 GLU CB C 13 29.325 0.059 . 1 . . . . . 65 GLU CB . 19518 1 713 . 1 1 65 65 GLU CG C 13 36.094 0.000 . 1 . . . . . 65 GLU CG . 19518 1 714 . 1 1 65 65 GLU N N 15 119.287 0.040 . 1 . . . . . 65 GLU N . 19518 1 715 . 1 1 66 66 ILE H H 1 6.909 0.008 . 1 . . . . . 66 ILE H . 19518 1 716 . 1 1 66 66 ILE HA H 1 3.492 0.010 . 1 . . . . . 66 ILE HA . 19518 1 717 . 1 1 66 66 ILE HB H 1 1.843 0.006 . 1 . . . . . 66 ILE HB . 19518 1 718 . 1 1 66 66 ILE HG12 H 1 1.454 0.005 . 1 . . . . . 66 ILE HG12 . 19518 1 719 . 1 1 66 66 ILE HG13 H 1 1.454 0.005 . 1 . . . . . 66 ILE HG13 . 19518 1 720 . 1 1 66 66 ILE HG21 H 1 0.943 0.011 . 1 . . . . . 66 ILE HG21 . 19518 1 721 . 1 1 66 66 ILE HG22 H 1 0.943 0.011 . 1 . . . . . 66 ILE HG22 . 19518 1 722 . 1 1 66 66 ILE HG23 H 1 0.943 0.011 . 1 . . . . . 66 ILE HG23 . 19518 1 723 . 1 1 66 66 ILE HD11 H 1 0.684 0.009 . 1 . . . . . 66 ILE HD11 . 19518 1 724 . 1 1 66 66 ILE HD12 H 1 0.684 0.009 . 1 . . . . . 66 ILE HD12 . 19518 1 725 . 1 1 66 66 ILE HD13 H 1 0.684 0.009 . 1 . . . . . 66 ILE HD13 . 19518 1 726 . 1 1 66 66 ILE C C 13 177.727 0.000 . 1 . . . . . 66 ILE C . 19518 1 727 . 1 1 66 66 ILE CA C 13 64.746 0.056 . 1 . . . . . 66 ILE CA . 19518 1 728 . 1 1 66 66 ILE CB C 13 37.904 0.089 . 1 . . . . . 66 ILE CB . 19518 1 729 . 1 1 66 66 ILE CG1 C 13 29.237 0.041 . 1 . . . . . 66 ILE CG1 . 19518 1 730 . 1 1 66 66 ILE CG2 C 13 19.053 0.053 . 1 . . . . . 66 ILE CG2 . 19518 1 731 . 1 1 66 66 ILE CD1 C 13 12.938 0.078 . 1 . . . . . 66 ILE CD1 . 19518 1 732 . 1 1 66 66 ILE N N 15 119.160 0.061 . 1 . . . . . 66 ILE N . 19518 1 733 . 1 1 67 67 ASP H H 1 8.427 0.008 . 1 . . . . . 67 ASP H . 19518 1 734 . 1 1 67 67 ASP HA H 1 4.228 0.009 . 1 . . . . . 67 ASP HA . 19518 1 735 . 1 1 67 67 ASP HB2 H 1 2.527 0.007 . 1 . . . . . 67 ASP HB2 . 19518 1 736 . 1 1 67 67 ASP HB3 H 1 2.527 0.007 . 1 . . . . . 67 ASP HB3 . 19518 1 737 . 1 1 67 67 ASP C C 13 179.198 0.000 . 1 . . . . . 67 ASP C . 19518 1 738 . 1 1 67 67 ASP CA C 13 57.940 0.072 . 1 . . . . . 67 ASP CA . 19518 1 739 . 1 1 67 67 ASP CB C 13 40.280 0.049 . 1 . . . . . 67 ASP CB . 19518 1 740 . 1 1 67 67 ASP N N 15 119.863 0.094 . 1 . . . . . 67 ASP N . 19518 1 741 . 1 1 68 68 GLU H H 1 7.685 0.006 . 1 . . . . . 68 GLU H . 19518 1 742 . 1 1 68 68 GLU HA H 1 3.896 0.008 . 1 . . . . . 68 GLU HA . 19518 1 743 . 1 1 68 68 GLU HB2 H 1 2.014 0.008 . 1 . . . . . 68 GLU HB2 . 19518 1 744 . 1 1 68 68 GLU HB3 H 1 2.014 0.008 . 1 . . . . . 68 GLU HB3 . 19518 1 745 . 1 1 68 68 GLU HG2 H 1 2.291 0.015 . 1 . . . . . 68 GLU HG2 . 19518 1 746 . 1 1 68 68 GLU HG3 H 1 2.291 0.015 . 1 . . . . . 68 GLU HG3 . 19518 1 747 . 1 1 68 68 GLU C C 13 179.144 0.000 . 1 . . . . . 68 GLU C . 19518 1 748 . 1 1 68 68 GLU CA C 13 59.305 0.056 . 1 . . . . . 68 GLU CA . 19518 1 749 . 1 1 68 68 GLU CB C 13 29.062 0.045 . 1 . . . . . 68 GLU CB . 19518 1 750 . 1 1 68 68 GLU CG C 13 36.346 0.000 . 1 . . . . . 68 GLU CG . 19518 1 751 . 1 1 68 68 GLU N N 15 117.942 0.071 . 1 . . . . . 68 GLU N . 19518 1 752 . 1 1 69 69 MET H H 1 7.328 0.005 . 1 . . . . . 69 MET H . 19518 1 753 . 1 1 69 69 MET HA H 1 4.203 0.007 . 1 . . . . . 69 MET HA . 19518 1 754 . 1 1 69 69 MET HB2 H 1 1.483 0.007 . 1 . . . . . 69 MET HB2 . 19518 1 755 . 1 1 69 69 MET HB3 H 1 1.988 0.001 . 1 . . . . . 69 MET HB3 . 19518 1 756 . 1 1 69 69 MET HG2 H 1 2.011 0.004 . 1 . . . . . 69 MET HG2 . 19518 1 757 . 1 1 69 69 MET HE1 H 1 0.325 0.003 . 1 . . . . . 69 MET HE1 . 19518 1 758 . 1 1 69 69 MET HE2 H 1 0.325 0.003 . 1 . . . . . 69 MET HE2 . 19518 1 759 . 1 1 69 69 MET HE3 H 1 0.325 0.003 . 1 . . . . . 69 MET HE3 . 19518 1 760 . 1 1 69 69 MET C C 13 178.938 0.000 . 1 . . . . . 69 MET C . 19518 1 761 . 1 1 69 69 MET CA C 13 59.920 0.046 . 1 . . . . . 69 MET CA . 19518 1 762 . 1 1 69 69 MET CB C 13 32.744 0.058 . 1 . . . . . 69 MET CB . 19518 1 763 . 1 1 69 69 MET CG C 13 30.197 0.010 . 1 . . . . . 69 MET CG . 19518 1 764 . 1 1 69 69 MET CE C 13 15.126 0.026 . 1 . . . . . 69 MET CE . 19518 1 765 . 1 1 69 69 MET N N 15 118.022 0.084 . 1 . . . . . 69 MET N . 19518 1 766 . 1 1 70 70 ILE H H 1 7.635 0.009 . 1 . . . . . 70 ILE H . 19518 1 767 . 1 1 70 70 ILE HA H 1 4.129 0.014 . 1 . . . . . 70 ILE HA . 19518 1 768 . 1 1 70 70 ILE HB H 1 2.170 0.006 . 1 . . . . . 70 ILE HB . 19518 1 769 . 1 1 70 70 ILE HG12 H 1 1.375 0.001 . 1 . . . . . 70 ILE HG12 . 19518 1 770 . 1 1 70 70 ILE HG13 H 1 1.375 0.001 . 1 . . . . . 70 ILE HG13 . 19518 1 771 . 1 1 70 70 ILE HG21 H 1 0.980 0.006 . 1 . . . . . 70 ILE HG21 . 19518 1 772 . 1 1 70 70 ILE HG22 H 1 0.980 0.006 . 1 . . . . . 70 ILE HG22 . 19518 1 773 . 1 1 70 70 ILE HG23 H 1 0.980 0.006 . 1 . . . . . 70 ILE HG23 . 19518 1 774 . 1 1 70 70 ILE HD11 H 1 0.767 0.009 . 1 . . . . . 70 ILE HD11 . 19518 1 775 . 1 1 70 70 ILE HD12 H 1 0.767 0.009 . 1 . . . . . 70 ILE HD12 . 19518 1 776 . 1 1 70 70 ILE HD13 H 1 0.767 0.009 . 1 . . . . . 70 ILE HD13 . 19518 1 777 . 1 1 70 70 ILE C C 13 179.035 0.000 . 1 . . . . . 70 ILE C . 19518 1 778 . 1 1 70 70 ILE CA C 13 61.853 0.038 . 1 . . . . . 70 ILE CA . 19518 1 779 . 1 1 70 70 ILE CB C 13 36.775 0.277 . 1 . . . . . 70 ILE CB . 19518 1 780 . 1 1 70 70 ILE CG1 C 13 27.739 0.043 . 1 . . . . . 70 ILE CG1 . 19518 1 781 . 1 1 70 70 ILE CG2 C 13 17.790 0.041 . 1 . . . . . 70 ILE CG2 . 19518 1 782 . 1 1 70 70 ILE CD1 C 13 10.423 0.032 . 1 . . . . . 70 ILE CD1 . 19518 1 783 . 1 1 70 70 ILE N N 15 118.049 0.061 . 1 . . . . . 70 ILE N . 19518 1 784 . 1 1 71 71 LYS H H 1 8.172 0.005 . 1 . . . . . 71 LYS H . 19518 1 785 . 1 1 71 71 LYS HA H 1 4.105 0.009 . 1 . . . . . 71 LYS HA . 19518 1 786 . 1 1 71 71 LYS HB2 H 1 1.842 0.005 . 1 . . . . . 71 LYS HB2 . 19518 1 787 . 1 1 71 71 LYS HB3 H 1 1.842 0.005 . 1 . . . . . 71 LYS HB3 . 19518 1 788 . 1 1 71 71 LYS HG2 H 1 1.509 0.005 . 1 . . . . . 71 LYS HG2 . 19518 1 789 . 1 1 71 71 LYS HG3 H 1 1.509 0.005 . 1 . . . . . 71 LYS HG3 . 19518 1 790 . 1 1 71 71 LYS HE2 H 1 2.861 0.008 . 1 . . . . . 71 LYS HE2 . 19518 1 791 . 1 1 71 71 LYS HE3 H 1 2.861 0.008 . 1 . . . . . 71 LYS HE3 . 19518 1 792 . 1 1 71 71 LYS C C 13 176.834 0.000 . 1 . . . . . 71 LYS C . 19518 1 793 . 1 1 71 71 LYS CA C 13 58.283 0.062 . 1 . . . . . 71 LYS CA . 19518 1 794 . 1 1 71 71 LYS CB C 13 32.327 0.177 . 1 . . . . . 71 LYS CB . 19518 1 795 . 1 1 71 71 LYS CG C 13 25.576 0.042 . 1 . . . . . 71 LYS CG . 19518 1 796 . 1 1 71 71 LYS N N 15 119.749 0.059 . 1 . . . . . 71 LYS N . 19518 1 797 . 1 1 72 72 GLU H H 1 7.232 0.005 . 1 . . . . . 72 GLU H . 19518 1 798 . 1 1 72 72 GLU HA H 1 4.127 0.005 . 1 . . . . . 72 GLU HA . 19518 1 799 . 1 1 72 72 GLU HB2 H 1 1.847 0.014 . 1 . . . . . 72 GLU HB2 . 19518 1 800 . 1 1 72 72 GLU HB3 H 1 1.500 0.017 . 1 . . . . . 72 GLU HB3 . 19518 1 801 . 1 1 72 72 GLU HG2 H 1 2.295 0.007 . 1 . . . . . 72 GLU HG2 . 19518 1 802 . 1 1 72 72 GLU HG3 H 1 2.530 0.004 . 1 . . . . . 72 GLU HG3 . 19518 1 803 . 1 1 72 72 GLU C C 13 176.801 0.000 . 1 . . . . . 72 GLU C . 19518 1 804 . 1 1 72 72 GLU CA C 13 57.909 0.034 . 1 . . . . . 72 GLU CA . 19518 1 805 . 1 1 72 72 GLU CB C 13 30.573 0.020 . 1 . . . . . 72 GLU CB . 19518 1 806 . 1 1 72 72 GLU CG C 13 37.060 0.043 . 1 . . . . . 72 GLU CG . 19518 1 807 . 1 1 72 72 GLU N N 15 115.624 0.092 . 1 . . . . . 72 GLU N . 19518 1 808 . 1 1 73 73 ALA H H 1 7.433 0.006 . 1 . . . . . 73 ALA H . 19518 1 809 . 1 1 73 73 ALA HA H 1 4.536 0.009 . 1 . . . . . 73 ALA HA . 19518 1 810 . 1 1 73 73 ALA HB1 H 1 1.520 0.006 . 1 . . . . . 73 ALA HB1 . 19518 1 811 . 1 1 73 73 ALA HB2 H 1 1.520 0.006 . 1 . . . . . 73 ALA HB2 . 19518 1 812 . 1 1 73 73 ALA HB3 H 1 1.520 0.006 . 1 . . . . . 73 ALA HB3 . 19518 1 813 . 1 1 73 73 ALA CA C 13 49.842 0.045 . 1 . . . . . 73 ALA CA . 19518 1 814 . 1 1 73 73 ALA CB C 13 20.745 0.128 . 1 . . . . . 73 ALA CB . 19518 1 815 . 1 1 73 73 ALA N N 15 122.133 0.056 . 1 . . . . . 73 ALA N . 19518 1 816 . 1 1 74 74 PRO HA H 1 4.508 0.011 . 1 . . . . . 74 PRO HA . 19518 1 817 . 1 1 74 74 PRO HB2 H 1 2.052 0.013 . 1 . . . . . 74 PRO HB2 . 19518 1 818 . 1 1 74 74 PRO HB3 H 1 2.043 0.016 . 1 . . . . . 74 PRO HB3 . 19518 1 819 . 1 1 74 74 PRO HG2 H 1 1.990 0.001 . 1 . . . . . 74 PRO HG2 . 19518 1 820 . 1 1 74 74 PRO HG3 H 1 1.831 0.000 . 1 . . . . . 74 PRO HG3 . 19518 1 821 . 1 1 74 74 PRO HD2 H 1 3.687 0.012 . 1 . . . . . 74 PRO HD2 . 19518 1 822 . 1 1 74 74 PRO HD3 H 1 3.482 0.011 . 1 . . . . . 74 PRO HD3 . 19518 1 823 . 1 1 74 74 PRO C C 13 175.665 0.000 . 1 . . . . . 74 PRO C . 19518 1 824 . 1 1 74 74 PRO CA C 13 63.290 0.067 . 1 . . . . . 74 PRO CA . 19518 1 825 . 1 1 74 74 PRO CB C 13 30.986 0.123 . 1 . . . . . 74 PRO CB . 19518 1 826 . 1 1 74 74 PRO CG C 13 26.878 0.050 . 1 . . . . . 74 PRO CG . 19518 1 827 . 1 1 74 74 PRO CD C 13 50.122 0.044 . 1 . . . . . 74 PRO CD . 19518 1 828 . 1 1 75 75 GLY H H 1 7.148 0.015 . 1 . . . . . 75 GLY H . 19518 1 829 . 1 1 75 75 GLY HA2 H 1 3.489 0.007 . 1 . . . . . 75 GLY HA2 . 19518 1 830 . 1 1 75 75 GLY HA3 H 1 3.978 0.001 . 1 . . . . . 75 GLY HA3 . 19518 1 831 . 1 1 75 75 GLY CA C 13 44.315 0.015 . 1 . . . . . 75 GLY CA . 19518 1 832 . 1 1 75 75 GLY N N 15 107.976 0.128 . 1 . . . . . 75 GLY N . 19518 1 833 . 1 1 76 76 PRO HA H 1 4.266 0.033 . 1 . . . . . 76 PRO HA . 19518 1 834 . 1 1 76 76 PRO HB2 H 1 1.984 0.002 . 1 . . . . . 76 PRO HB2 . 19518 1 835 . 1 1 76 76 PRO HB3 H 1 1.984 0.002 . 1 . . . . . 76 PRO HB3 . 19518 1 836 . 1 1 76 76 PRO HG2 H 1 1.800 0.002 . 1 . . . . . 76 PRO HG2 . 19518 1 837 . 1 1 76 76 PRO HG3 H 1 1.800 0.002 . 1 . . . . . 76 PRO HG3 . 19518 1 838 . 1 1 76 76 PRO HD2 H 1 3.507 0.007 . 1 . . . . . 76 PRO HD2 . 19518 1 839 . 1 1 76 76 PRO HD3 H 1 3.619 0.003 . 1 . . . . . 76 PRO HD3 . 19518 1 840 . 1 1 76 76 PRO C C 13 175.808 0.000 . 1 . . . . . 76 PRO C . 19518 1 841 . 1 1 76 76 PRO CA C 13 63.361 0.145 . 1 . . . . . 76 PRO CA . 19518 1 842 . 1 1 76 76 PRO CB C 13 31.921 0.030 . 1 . . . . . 76 PRO CB . 19518 1 843 . 1 1 76 76 PRO CG C 13 27.641 0.000 . 1 . . . . . 76 PRO CG . 19518 1 844 . 1 1 76 76 PRO CD C 13 50.376 0.019 . 1 . . . . . 76 PRO CD . 19518 1 845 . 1 1 77 77 ILE H H 1 9.063 0.006 . 1 . . . . . 77 ILE H . 19518 1 846 . 1 1 77 77 ILE HA H 1 3.937 0.007 . 1 . . . . . 77 ILE HA . 19518 1 847 . 1 1 77 77 ILE HB H 1 2.120 0.015 . 1 . . . . . 77 ILE HB . 19518 1 848 . 1 1 77 77 ILE HG12 H 1 1.052 0.008 . 1 . . . . . 77 ILE HG12 . 19518 1 849 . 1 1 77 77 ILE HG13 H 1 1.052 0.008 . 1 . . . . . 77 ILE HG13 . 19518 1 850 . 1 1 77 77 ILE HG21 H 1 0.899 0.009 . 1 . . . . . 77 ILE HG21 . 19518 1 851 . 1 1 77 77 ILE HG22 H 1 0.899 0.009 . 1 . . . . . 77 ILE HG22 . 19518 1 852 . 1 1 77 77 ILE HG23 H 1 0.899 0.009 . 1 . . . . . 77 ILE HG23 . 19518 1 853 . 1 1 77 77 ILE HD11 H 1 1.052 0.004 . 1 . . . . . 77 ILE HD11 . 19518 1 854 . 1 1 77 77 ILE HD12 H 1 1.052 0.004 . 1 . . . . . 77 ILE HD12 . 19518 1 855 . 1 1 77 77 ILE HD13 H 1 1.052 0.004 . 1 . . . . . 77 ILE HD13 . 19518 1 856 . 1 1 77 77 ILE C C 13 176.100 0.000 . 1 . . . . . 77 ILE C . 19518 1 857 . 1 1 77 77 ILE CA C 13 62.412 0.106 . 1 . . . . . 77 ILE CA . 19518 1 858 . 1 1 77 77 ILE CB C 13 36.149 0.076 . 1 . . . . . 77 ILE CB . 19518 1 859 . 1 1 77 77 ILE CG1 C 13 25.711 0.010 . 1 . . . . . 77 ILE CG1 . 19518 1 860 . 1 1 77 77 ILE CG2 C 13 21.883 0.000 . 1 . . . . . 77 ILE CG2 . 19518 1 861 . 1 1 77 77 ILE N N 15 124.864 0.068 . 1 . . . . . 77 ILE N . 19518 1 862 . 1 1 78 78 ASN H H 1 7.315 0.007 . 1 . . . . . 78 ASN H . 19518 1 863 . 1 1 78 78 ASN HA H 1 5.355 0.010 . 1 . . . . . 78 ASN HA . 19518 1 864 . 1 1 78 78 ASN HB2 H 1 3.032 0.012 . 1 . . . . . 78 ASN HB2 . 19518 1 865 . 1 1 78 78 ASN CA C 13 51.811 0.061 . 1 . . . . . 78 ASN CA . 19518 1 866 . 1 1 78 78 ASN CB C 13 38.193 0.032 . 1 . . . . . 78 ASN CB . 19518 1 867 . 1 1 78 78 ASN N N 15 123.890 0.085 . 1 . . . . . 78 ASN N . 19518 1 868 . 1 1 79 79 PHE H H 1 8.527 0.012 . 1 . . . . . 79 PHE H . 19518 1 869 . 1 1 79 79 PHE HA H 1 4.042 0.009 . 1 . . . . . 79 PHE HA . 19518 1 870 . 1 1 79 79 PHE HB2 H 1 3.053 0.000 . 1 . . . . . 79 PHE HB2 . 19518 1 871 . 1 1 79 79 PHE HD1 H 1 6.634 0.009 . 3 . . . . . 79 PHE HD1 . 19518 1 872 . 1 1 79 79 PHE HD2 H 1 6.634 0.009 . 3 . . . . . 79 PHE HD2 . 19518 1 873 . 1 1 79 79 PHE HE1 H 1 7.091 0.000 . 3 . . . . . 79 PHE HE1 . 19518 1 874 . 1 1 79 79 PHE HE2 H 1 7.091 0.000 . 3 . . . . . 79 PHE HE2 . 19518 1 875 . 1 1 79 79 PHE C C 13 176.100 0.000 . 1 . . . . . 79 PHE C . 19518 1 876 . 1 1 79 79 PHE CA C 13 61.679 0.087 . 1 . . . . . 79 PHE CA . 19518 1 877 . 1 1 79 79 PHE CB C 13 37.787 0.061 . 1 . . . . . 79 PHE CB . 19518 1 878 . 1 1 79 79 PHE N N 15 119.668 0.075 . 1 . . . . . 79 PHE N . 19518 1 879 . 1 1 80 80 THR H H 1 7.512 0.004 . 1 . . . . . 80 THR H . 19518 1 880 . 1 1 80 80 THR HA H 1 3.396 0.011 . 1 . . . . . 80 THR HA . 19518 1 881 . 1 1 80 80 THR HB H 1 4.045 0.010 . 1 . . . . . 80 THR HB . 19518 1 882 . 1 1 80 80 THR HG21 H 1 1.071 0.004 . 1 . . . . . 80 THR HG21 . 19518 1 883 . 1 1 80 80 THR HG22 H 1 1.071 0.004 . 1 . . . . . 80 THR HG22 . 19518 1 884 . 1 1 80 80 THR HG23 H 1 1.071 0.004 . 1 . . . . . 80 THR HG23 . 19518 1 885 . 1 1 80 80 THR C C 13 177.514 0.000 . 1 . . . . . 80 THR C . 19518 1 886 . 1 1 80 80 THR CA C 13 67.125 0.045 . 1 . . . . . 80 THR CA . 19518 1 887 . 1 1 80 80 THR CB C 13 68.159 0.094 . 1 . . . . . 80 THR CB . 19518 1 888 . 1 1 80 80 THR CG2 C 13 21.810 0.102 . 1 . . . . . 80 THR CG2 . 19518 1 889 . 1 1 80 80 THR N N 15 113.460 0.080 . 1 . . . . . 80 THR N . 19518 1 890 . 1 1 81 81 VAL H H 1 8.217 0.006 . 1 . . . . . 81 VAL H . 19518 1 891 . 1 1 81 81 VAL HA H 1 3.402 0.012 . 1 . . . . . 81 VAL HA . 19518 1 892 . 1 1 81 81 VAL HB H 1 2.165 0.013 . 1 . . . . . 81 VAL HB . 19518 1 893 . 1 1 81 81 VAL HG11 H 1 0.894 0.005 . 1 . . . . . 81 VAL HG11 . 19518 1 894 . 1 1 81 81 VAL HG12 H 1 0.894 0.005 . 1 . . . . . 81 VAL HG12 . 19518 1 895 . 1 1 81 81 VAL HG13 H 1 0.894 0.005 . 1 . . . . . 81 VAL HG13 . 19518 1 896 . 1 1 81 81 VAL HG21 H 1 1.061 0.008 . 1 . . . . . 81 VAL HG21 . 19518 1 897 . 1 1 81 81 VAL HG22 H 1 1.061 0.008 . 1 . . . . . 81 VAL HG22 . 19518 1 898 . 1 1 81 81 VAL HG23 H 1 1.061 0.008 . 1 . . . . . 81 VAL HG23 . 19518 1 899 . 1 1 81 81 VAL C C 13 177.407 0.000 . 1 . . . . . 81 VAL C . 19518 1 900 . 1 1 81 81 VAL CA C 13 66.807 0.122 . 1 . . . . . 81 VAL CA . 19518 1 901 . 1 1 81 81 VAL CB C 13 32.312 0.072 . 1 . . . . . 81 VAL CB . 19518 1 902 . 1 1 81 81 VAL CG1 C 13 21.891 0.015 . 1 . . . . . 81 VAL CG1 . 19518 1 903 . 1 1 81 81 VAL CG2 C 13 23.429 0.033 . 1 . . . . . 81 VAL CG2 . 19518 1 904 . 1 1 81 81 VAL N N 15 125.695 0.066 . 1 . . . . . 81 VAL N . 19518 1 905 . 1 1 82 82 PHE H H 1 8.441 0.018 . 1 . . . . . 82 PHE H . 19518 1 906 . 1 1 82 82 PHE HA H 1 3.875 0.012 . 1 . . . . . 82 PHE HA . 19518 1 907 . 1 1 82 82 PHE HB2 H 1 2.941 0.010 . 1 . . . . . 82 PHE HB2 . 19518 1 908 . 1 1 82 82 PHE HB3 H 1 3.187 0.018 . 1 . . . . . 82 PHE HB3 . 19518 1 909 . 1 1 82 82 PHE HD1 H 1 6.670 0.021 . 3 . . . . . 82 PHE HD1 . 19518 1 910 . 1 1 82 82 PHE HD2 H 1 6.670 0.021 . 3 . . . . . 82 PHE HD2 . 19518 1 911 . 1 1 82 82 PHE HE1 H 1 6.811 0.008 . 3 . . . . . 82 PHE HE1 . 19518 1 912 . 1 1 82 82 PHE HE2 H 1 6.811 0.008 . 3 . . . . . 82 PHE HE2 . 19518 1 913 . 1 1 82 82 PHE C C 13 176.208 0.000 . 1 . . . . . 82 PHE C . 19518 1 914 . 1 1 82 82 PHE CA C 13 61.514 0.041 . 1 . . . . . 82 PHE CA . 19518 1 915 . 1 1 82 82 PHE CB C 13 39.721 0.021 . 1 . . . . . 82 PHE CB . 19518 1 916 . 1 1 82 82 PHE N N 15 122.614 0.123 . 1 . . . . . 82 PHE N . 19518 1 917 . 1 1 83 83 LEU H H 1 8.271 0.006 . 1 . . . . . 83 LEU H . 19518 1 918 . 1 1 83 83 LEU HA H 1 3.168 0.014 . 1 . . . . . 83 LEU HA . 19518 1 919 . 1 1 83 83 LEU HB2 H 1 0.944 0.015 . 1 . . . . . 83 LEU HB2 . 19518 1 920 . 1 1 83 83 LEU HB3 H 1 0.941 0.014 . 1 . . . . . 83 LEU HB3 . 19518 1 921 . 1 1 83 83 LEU HG H 1 0.805 0.014 . 1 . . . . . 83 LEU HG . 19518 1 922 . 1 1 83 83 LEU HD11 H 1 0.046 0.018 . 1 . . . . . 83 LEU HD11 . 19518 1 923 . 1 1 83 83 LEU HD12 H 1 0.046 0.018 . 1 . . . . . 83 LEU HD12 . 19518 1 924 . 1 1 83 83 LEU HD13 H 1 0.046 0.018 . 1 . . . . . 83 LEU HD13 . 19518 1 925 . 1 1 83 83 LEU HD21 H 1 0.120 0.016 . 1 . . . . . 83 LEU HD21 . 19518 1 926 . 1 1 83 83 LEU HD22 H 1 0.120 0.016 . 1 . . . . . 83 LEU HD22 . 19518 1 927 . 1 1 83 83 LEU HD23 H 1 0.120 0.016 . 1 . . . . . 83 LEU HD23 . 19518 1 928 . 1 1 83 83 LEU C C 13 179.463 0.000 . 1 . . . . . 83 LEU C . 19518 1 929 . 1 1 83 83 LEU CA C 13 57.416 0.063 . 1 . . . . . 83 LEU CA . 19518 1 930 . 1 1 83 83 LEU CB C 13 41.887 0.072 . 1 . . . . . 83 LEU CB . 19518 1 931 . 1 1 83 83 LEU CG C 13 25.723 0.000 . 1 . . . . . 83 LEU CG . 19518 1 932 . 1 1 83 83 LEU CD1 C 13 25.845 0.018 . 1 . . . . . 83 LEU CD1 . 19518 1 933 . 1 1 83 83 LEU CD2 C 13 24.832 0.046 . 1 . . . . . 83 LEU CD2 . 19518 1 934 . 1 1 83 83 LEU N N 15 117.861 0.067 . 1 . . . . . 83 LEU N . 19518 1 935 . 1 1 84 84 THR H H 1 7.870 0.004 . 1 . . . . . 84 THR H . 19518 1 936 . 1 1 84 84 THR HA H 1 3.624 0.011 . 1 . . . . . 84 THR HA . 19518 1 937 . 1 1 84 84 THR HB H 1 4.270 0.004 . 1 . . . . . 84 THR HB2 . 19518 1 938 . 1 1 84 84 THR HG21 H 1 1.059 0.006 . 1 . . . . . 84 THR HG . 19518 1 939 . 1 1 84 84 THR HG22 H 1 1.059 0.006 . 1 . . . . . 84 THR HG . 19518 1 940 . 1 1 84 84 THR HG23 H 1 1.059 0.006 . 1 . . . . . 84 THR HG . 19518 1 941 . 1 1 84 84 THR C C 13 176.055 0.000 . 1 . . . . . 84 THR C . 19518 1 942 . 1 1 84 84 THR CA C 13 67.199 0.074 . 1 . . . . . 84 THR CA . 19518 1 943 . 1 1 84 84 THR CB C 13 68.440 0.065 . 1 . . . . . 84 THR CB . 19518 1 944 . 1 1 84 84 THR CG2 C 13 21.01 0.15 . 1 . . . . . 84 THR CG2 . 19518 1 945 . 1 1 84 84 THR N N 15 116.200 0.061 . 1 . . . . . 84 THR N . 19518 1 946 . 1 1 85 85 MET H H 1 8.168 0.011 . 1 . . . . . 85 MET H . 19518 1 947 . 1 1 85 85 MET HA H 1 3.874 0.017 . 1 . . . . . 85 MET HA . 19518 1 948 . 1 1 85 85 MET HB2 H 1 2.004 0.018 . 1 . . . . . 85 MET HB2 . 19518 1 949 . 1 1 85 85 MET HB3 H 1 2.004 0.018 . 1 . . . . . 85 MET HB3 . 19518 1 950 . 1 1 85 85 MET HG2 H 1 2.293 0.004 . 1 . . . . . 85 MET HG2 . 19518 1 951 . 1 1 85 85 MET HG3 H 1 2.295 0.006 . 1 . . . . . 85 MET HG3 . 19518 1 952 . 1 1 85 85 MET HE1 H 1 0.888 0.006 . 1 . . . . . 85 MET HE1 . 19518 1 953 . 1 1 85 85 MET HE2 H 1 0.888 0.006 . 1 . . . . . 85 MET HE2 . 19518 1 954 . 1 1 85 85 MET HE3 H 1 0.888 0.006 . 1 . . . . . 85 MET HE3 . 19518 1 955 . 1 1 85 85 MET C C 13 179.073 0.000 . 1 . . . . . 85 MET C . 19518 1 956 . 1 1 85 85 MET CA C 13 59.313 0.049 . 1 . . . . . 85 MET CA . 19518 1 957 . 1 1 85 85 MET CB C 13 33.398 0.081 . 1 . . . . . 85 MET CB . 19518 1 958 . 1 1 85 85 MET CG C 13 30.890 0.066 . 1 . . . . . 85 MET CG . 19518 1 959 . 1 1 85 85 MET CE C 13 14.251 0.033 . 1 . . . . . 85 MET CE . 19518 1 960 . 1 1 85 85 MET N N 15 121.490 0.049 . 1 . . . . . 85 MET N . 19518 1 961 . 1 1 86 86 PHE H H 1 7.595 0.010 . 1 . . . . . 86 PHE H . 19518 1 962 . 1 1 86 86 PHE HA H 1 3.825 0.014 . 1 . . . . . 86 PHE HA . 19518 1 963 . 1 1 86 86 PHE HB2 H 1 2.252 0.020 . 1 . . . . . 86 PHE HB2 . 19518 1 964 . 1 1 86 86 PHE HD1 H 1 6.579 0.013 . 3 . . . . . 86 PHE HD1 . 19518 1 965 . 1 1 86 86 PHE HD2 H 1 6.579 0.013 . 3 . . . . . 86 PHE HD2 . 19518 1 966 . 1 1 86 86 PHE HE1 H 1 6.428 0.000 . 3 . . . . . 86 PHE HE1 . 19518 1 967 . 1 1 86 86 PHE HE2 H 1 6.428 0.000 . 3 . . . . . 86 PHE HE2 . 19518 1 968 . 1 1 86 86 PHE C C 13 178.316 0.000 . 1 . . . . . 86 PHE C . 19518 1 969 . 1 1 86 86 PHE CA C 13 62.459 0.100 . 1 . . . . . 86 PHE CA . 19518 1 970 . 1 1 86 86 PHE CB C 13 38.671 0.043 . 1 . . . . . 86 PHE CB . 19518 1 971 . 1 1 86 86 PHE N N 15 118.098 0.082 . 1 . . . . . 86 PHE N . 19518 1 972 . 1 1 87 87 GLY H H 1 8.914 0.006 . 1 . . . . . 87 GLY H . 19518 1 973 . 1 1 87 87 GLY HA2 H 1 3.555 0.004 . 1 . . . . . 87 GLY HA2 . 19518 1 974 . 1 1 87 87 GLY HA3 H 1 3.662 0.004 . 1 . . . . . 87 GLY HA3 . 19518 1 975 . 1 1 87 87 GLY C C 13 175.252 0.000 . 1 . . . . . 87 GLY C . 19518 1 976 . 1 1 87 87 GLY CA C 13 47.714 0.092 . 1 . . . . . 87 GLY CA . 19518 1 977 . 1 1 87 87 GLY N N 15 107.656 0.088 . 1 . . . . . 87 GLY N . 19518 1 978 . 1 1 88 88 GLU H H 1 7.731 0.009 . 1 . . . . . 88 GLU H . 19518 1 979 . 1 1 88 88 GLU HA H 1 3.823 0.007 . 1 . . . . . 88 GLU HA . 19518 1 980 . 1 1 88 88 GLU HB2 H 1 1.779 0.009 . 1 . . . . . 88 GLU HB2 . 19518 1 981 . 1 1 88 88 GLU HB3 H 1 1.779 0.009 . 1 . . . . . 88 GLU HB3 . 19518 1 982 . 1 1 88 88 GLU HG2 H 1 2.110 0.010 . 1 . . . . . 88 GLU HG2 . 19518 1 983 . 1 1 88 88 GLU HG3 H 1 2.110 0.010 . 1 . . . . . 88 GLU HG3 . 19518 1 984 . 1 1 88 88 GLU C C 13 178.315 0.000 . 1 . . . . . 88 GLU C . 19518 1 985 . 1 1 88 88 GLU CA C 13 58.160 0.037 . 1 . . . . . 88 GLU CA . 19518 1 986 . 1 1 88 88 GLU CB C 13 29.277 0.029 . 1 . . . . . 88 GLU CB . 19518 1 987 . 1 1 88 88 GLU CG C 13 36.469 0.000 . 1 . . . . . 88 GLU CG . 19518 1 988 . 1 1 88 88 GLU N N 15 118.405 0.067 . 1 . . . . . 88 GLU N . 19518 1 989 . 1 1 89 89 LYS H H 1 6.778 0.007 . 1 . . . . . 89 LYS H . 19518 1 990 . 1 1 89 89 LYS HA H 1 3.690 0.007 . 1 . . . . . 89 LYS HA . 19518 1 991 . 1 1 89 89 LYS HB2 H 1 0.967 0.004 . 1 . . . . . 89 LYS HB2 . 19518 1 992 . 1 1 89 89 LYS HB3 H 1 0.967 0.004 . 1 . . . . . 89 LYS HB3 . 19518 1 993 . 1 1 89 89 LYS HG2 H 1 0.694 0.008 . 1 . . . . . 89 LYS HG2 . 19518 1 994 . 1 1 89 89 LYS HG3 H 1 0.694 0.008 . 1 . . . . . 89 LYS HG3 . 19518 1 995 . 1 1 89 89 LYS HD2 H 1 0.097 0.005 . 1 . . . . . 89 LYS HD2 . 19518 1 996 . 1 1 89 89 LYS HD3 H 1 -0.492 0.005 . 1 . . . . . 89 LYS HD3 . 19518 1 997 . 1 1 89 89 LYS HE2 H 1 2.949 0.000 . 1 . . . . . 89 LYS HE2 . 19518 1 998 . 1 1 89 89 LYS HE3 H 1 2.949 0.000 . 1 . . . . . 89 LYS HE3 . 19518 1 999 . 1 1 89 89 LYS C C 13 177.936 0.000 . 1 . . . . . 89 LYS C . 19518 1 1000 . 1 1 89 89 LYS CA C 13 56.408 0.068 . 1 . . . . . 89 LYS CA . 19518 1 1001 . 1 1 89 89 LYS CB C 13 32.379 0.008 . 1 . . . . . 89 LYS CB . 19518 1 1002 . 1 1 89 89 LYS CG C 13 22.711 0.000 . 1 . . . . . 89 LYS CG . 19518 1 1003 . 1 1 89 89 LYS CD C 13 23.225 0.047 . 1 . . . . . 89 LYS CD . 19518 1 1004 . 1 1 89 89 LYS N N 15 116.755 0.062 . 1 . . . . . 89 LYS N . 19518 1 1005 . 1 1 90 90 LEU H H 1 7.783 0.012 . 1 . . . . . 90 LEU H . 19518 1 1006 . 1 1 90 90 LEU HA H 1 4.253 0.012 . 1 . . . . . 90 LEU HA . 19518 1 1007 . 1 1 90 90 LEU HB2 H 1 1.779 0.028 . 1 . . . . . 90 LEU HB2 . 19518 1 1008 . 1 1 90 90 LEU HB3 H 1 1.647 0.003 . 1 . . . . . 90 LEU HB3 . 19518 1 1009 . 1 1 90 90 LEU HG H 1 1.750 0.002 . 1 . . . . . 90 LEU HG . 19518 1 1010 . 1 1 90 90 LEU HD11 H 1 0.948 0.012 . 1 . . . . . 90 LEU HD11 . 19518 1 1011 . 1 1 90 90 LEU HD12 H 1 0.948 0.012 . 1 . . . . . 90 LEU HD12 . 19518 1 1012 . 1 1 90 90 LEU HD13 H 1 0.948 0.012 . 1 . . . . . 90 LEU HD13 . 19518 1 1013 . 1 1 90 90 LEU HD21 H 1 1.036 0.024 . 1 . . . . . 90 LEU HD21 . 19518 1 1014 . 1 1 90 90 LEU HD22 H 1 1.036 0.024 . 1 . . . . . 90 LEU HD22 . 19518 1 1015 . 1 1 90 90 LEU HD23 H 1 1.036 0.024 . 1 . . . . . 90 LEU HD23 . 19518 1 1016 . 1 1 90 90 LEU C C 13 177.054 0.000 . 1 . . . . . 90 LEU C . 19518 1 1017 . 1 1 90 90 LEU CA C 13 55.247 0.109 . 1 . . . . . 90 LEU CA . 19518 1 1018 . 1 1 90 90 LEU CB C 13 40.987 0.060 . 1 . . . . . 90 LEU CB . 19518 1 1019 . 1 1 90 90 LEU CG C 13 27.266 0.000 . 1 . . . . . 90 LEU CG . 19518 1 1020 . 1 1 90 90 LEU CD1 C 13 23.980 0.023 . 1 . . . . . 90 LEU CD1 . 19518 1 1021 . 1 1 90 90 LEU CD2 C 13 26.051 0.046 . 1 . . . . . 90 LEU CD2 . 19518 1 1022 . 1 1 90 90 LEU N N 15 118.474 0.077 . 1 . . . . . 90 LEU N . 19518 1 1023 . 1 1 91 91 LYS H H 1 7.437 0.012 . 1 . . . . . 91 LYS H . 19518 1 1024 . 1 1 91 91 LYS HA H 1 4.191 0.014 . 1 . . . . . 91 LYS HA . 19518 1 1025 . 1 1 91 91 LYS HB2 H 1 1.630 0.002 . 1 . . . . . 91 LYS HB2 . 19518 1 1026 . 1 1 91 91 LYS HB3 H 1 1.753 0.005 . 1 . . . . . 91 LYS HB3 . 19518 1 1027 . 1 1 91 91 LYS HG2 H 1 1.235 0.020 . 1 . . . . . 91 LYS HG2 . 19518 1 1028 . 1 1 91 91 LYS HG3 H 1 1.235 0.020 . 1 . . . . . 91 LYS HG3 . 19518 1 1029 . 1 1 91 91 LYS HD2 H 1 1.558 0.000 . 1 . . . . . 91 LYS HD2 . 19518 1 1030 . 1 1 91 91 LYS HD3 H 1 1.558 0.000 . 1 . . . . . 91 LYS HD3 . 19518 1 1031 . 1 1 91 91 LYS HE2 H 1 2.840 0.014 . 1 . . . . . 91 LYS HE2 . 19518 1 1032 . 1 1 91 91 LYS HE3 H 1 2.840 0.014 . 1 . . . . . 91 LYS HE3 . 19518 1 1033 . 1 1 91 91 LYS C C 13 177.027 0.000 . 1 . . . . . 91 LYS C . 19518 1 1034 . 1 1 91 91 LYS CA C 13 56.611 0.049 . 1 . . . . . 91 LYS CA . 19518 1 1035 . 1 1 91 91 LYS CB C 13 32.333 0.069 . 1 . . . . . 91 LYS CB . 19518 1 1036 . 1 1 91 91 LYS CG C 13 25.064 0.000 . 1 . . . . . 91 LYS CG . 19518 1 1037 . 1 1 91 91 LYS CD C 13 29.180 0.000 . 1 . . . . . 91 LYS CD . 19518 1 1038 . 1 1 91 91 LYS CE C 13 42.133 0.000 . 1 . . . . . 91 LYS CE . 19518 1 1039 . 1 1 91 91 LYS N N 15 119.919 0.123 . 1 . . . . . 91 LYS N . 19518 1 1040 . 1 1 92 92 GLY H H 1 8.188 0.011 . 1 . . . . . 92 GLY H . 19518 1 1041 . 1 1 92 92 GLY HA2 H 1 3.831 0.002 . 1 . . . . . 92 GLY HA2 . 19518 1 1042 . 1 1 92 92 GLY HA3 H 1 3.831 0.002 . 1 . . . . . 92 GLY HA3 . 19518 1 1043 . 1 1 92 92 GLY C C 13 173.244 0.000 . 1 . . . . . 92 GLY C . 19518 1 1044 . 1 1 92 92 GLY CA C 13 45.435 0.156 . 1 . . . . . 92 GLY CA . 19518 1 1045 . 1 1 92 92 GLY N N 15 108.705 0.053 . 1 . . . . . 92 GLY N . 19518 1 1046 . 1 1 93 93 ALA H H 1 7.896 0.010 . 1 . . . . . 93 ALA H . 19518 1 1047 . 1 1 93 93 ALA HA H 1 4.597 0.015 . 1 . . . . . 93 ALA HA . 19518 1 1048 . 1 1 93 93 ALA HB1 H 1 1.423 0.005 . 1 . . . . . 93 ALA HB1 . 19518 1 1049 . 1 1 93 93 ALA HB2 H 1 1.423 0.005 . 1 . . . . . 93 ALA HB2 . 19518 1 1050 . 1 1 93 93 ALA HB3 H 1 1.423 0.005 . 1 . . . . . 93 ALA HB3 . 19518 1 1051 . 1 1 93 93 ALA C C 13 178.082 0.000 . 1 . . . . . 93 ALA C . 19518 1 1052 . 1 1 93 93 ALA CA C 13 51.982 0.058 . 1 . . . . . 93 ALA CA . 19518 1 1053 . 1 1 93 93 ALA CB C 13 20.275 0.125 . 1 . . . . . 93 ALA CB . 19518 1 1054 . 1 1 93 93 ALA N N 15 123.095 0.050 . 1 . . . . . 93 ALA N . 19518 1 1055 . 1 1 94 94 ASP H H 1 8.711 0.009 . 1 . . . . . 94 ASP H . 19518 1 1056 . 1 1 94 94 ASP HA H 1 4.845 0.007 . 1 . . . . . 94 ASP HA . 19518 1 1057 . 1 1 94 94 ASP HB2 H 1 2.440 0.012 . 1 . . . . . 94 ASP HB2 . 19518 1 1058 . 1 1 94 94 ASP HB3 H 1 2.176 0.000 . 1 . . . . . 94 ASP HB3 . 19518 1 1059 . 1 1 94 94 ASP CA C 13 54.339 0.056 . 1 . . . . . 94 ASP CA . 19518 1 1060 . 1 1 94 94 ASP CB C 13 41.006 0.000 . 1 . . . . . 94 ASP CB . 19518 1 1061 . 1 1 94 94 ASP N N 15 121.046 0.117 . 1 . . . . . 94 ASP N . 19518 1 1062 . 1 1 95 95 PRO HA H 1 4.371 0.008 . 1 . . . . . 95 PRO HA . 19518 1 1063 . 1 1 95 95 PRO HB2 H 1 2.425 0.005 . 1 . . . . . 95 PRO HB2 . 19518 1 1064 . 1 1 95 95 PRO HB3 H 1 1.892 0.004 . 1 . . . . . 95 PRO HB3 . 19518 1 1065 . 1 1 95 95 PRO HD2 H 1 3.502 0.011 . 1 . . . . . 95 PRO HD2 . 19518 1 1066 . 1 1 95 95 PRO C C 13 177.380 0.000 . 1 . . . . . 95 PRO C . 19518 1 1067 . 1 1 95 95 PRO CA C 13 62.772 0.150 . 1 . . . . . 95 PRO CA . 19518 1 1068 . 1 1 95 95 PRO CB C 13 32.619 0.172 . 1 . . . . . 95 PRO CB . 19518 1 1069 . 1 1 96 96 GLU H H 1 8.921 0.007 . 1 . . . . . 96 GLU H . 19518 1 1070 . 1 1 96 96 GLU HA H 1 3.574 0.028 . 1 . . . . . 96 GLU HA . 19518 1 1071 . 1 1 96 96 GLU HB2 H 1 1.893 0.000 . 1 . . . . . 96 GLU HB2 . 19518 1 1072 . 1 1 96 96 GLU HG2 H 1 2.130 0.006 . 1 . . . . . 96 GLU HG2 . 19518 1 1073 . 1 1 96 96 GLU HG3 H 1 1.992 0.004 . 1 . . . . . 96 GLU HG3 . 19518 1 1074 . 1 1 96 96 GLU C C 13 177.796 0.000 . 1 . . . . . 96 GLU C . 19518 1 1075 . 1 1 96 96 GLU CA C 13 60.726 0.054 . 1 . . . . . 96 GLU CA . 19518 1 1076 . 1 1 96 96 GLU CB C 13 29.574 0.073 . 1 . . . . . 96 GLU CB . 19518 1 1077 . 1 1 96 96 GLU CG C 13 35.926 0.000 . 1 . . . . . 96 GLU CG . 19518 1 1078 . 1 1 96 96 GLU N N 15 123.963 0.074 . 1 . . . . . 96 GLU N . 19518 1 1079 . 1 1 97 97 GLU H H 1 9.198 0.011 . 1 . . . . . 97 GLU H . 19518 1 1080 . 1 1 97 97 GLU HA H 1 3.908 0.009 . 1 . . . . . 97 GLU HA . 19518 1 1081 . 1 1 97 97 GLU HB2 H 1 1.989 0.003 . 1 . . . . . 97 GLU HB2 . 19518 1 1082 . 1 1 97 97 GLU HB3 H 1 1.893 0.012 . 1 . . . . . 97 GLU HB3 . 19518 1 1083 . 1 1 97 97 GLU HG2 H 1 2.443 0.006 . 1 . . . . . 97 GLU HG2 . 19518 1 1084 . 1 1 97 97 GLU HG3 H 1 2.183 0.017 . 1 . . . . . 97 GLU HG3 . 19518 1 1085 . 1 1 97 97 GLU C C 13 178.183 0.000 . 1 . . . . . 97 GLU C . 19518 1 1086 . 1 1 97 97 GLU CA C 13 59.957 0.036 . 1 . . . . . 97 GLU CA . 19518 1 1087 . 1 1 97 97 GLU CB C 13 29.104 0.012 . 1 . . . . . 97 GLU CB . 19518 1 1088 . 1 1 97 97 GLU CG C 13 36.390 0.000 . 1 . . . . . 97 GLU CG . 19518 1 1089 . 1 1 97 97 GLU N N 15 116.560 0.052 . 1 . . . . . 97 GLU N . 19518 1 1090 . 1 1 98 98 THR H H 1 7.059 0.007 . 1 . . . . . 98 THR H . 19518 1 1091 . 1 1 98 98 THR HA H 1 3.886 0.007 . 1 . . . . . 98 THR HA . 19518 1 1092 . 1 1 98 98 THR HB H 1 4.206 0.017 . 1 . . . . . 98 THR HB . 19518 1 1093 . 1 1 98 98 THR HG21 H 1 1.105 0.012 . 1 . . . . . 98 THR HG21 . 19518 1 1094 . 1 1 98 98 THR HG22 H 1 1.105 0.012 . 1 . . . . . 98 THR HG22 . 19518 1 1095 . 1 1 98 98 THR HG23 H 1 1.105 0.012 . 1 . . . . . 98 THR HG23 . 19518 1 1096 . 1 1 98 98 THR C C 13 176.658 0.000 . 1 . . . . . 98 THR C . 19518 1 1097 . 1 1 98 98 THR CA C 13 66.322 0.086 . 1 . . . . . 98 THR CA . 19518 1 1098 . 1 1 98 98 THR CB C 13 68.920 0.082 . 1 . . . . . 98 THR CB . 19518 1 1099 . 1 1 98 98 THR CG2 C 13 21.778 0.007 . 1 . . . . . 98 THR CG2 . 19518 1 1100 . 1 1 98 98 THR N N 15 115.301 0.060 . 1 . . . . . 98 THR N . 19518 1 1101 . 1 1 99 99 ILE H H 1 7.577 0.009 . 1 . . . . . 99 ILE H . 19518 1 1102 . 1 1 99 99 ILE HA H 1 3.504 0.013 . 1 . . . . . 99 ILE HA . 19518 1 1103 . 1 1 99 99 ILE HB H 1 1.742 0.007 . 1 . . . . . 99 ILE HB . 19518 1 1104 . 1 1 99 99 ILE HG12 H 1 0.949 0.002 . 1 . . . . . 99 ILE HG12 . 19518 1 1105 . 1 1 99 99 ILE HG13 H 1 0.949 0.002 . 1 . . . . . 99 ILE HG13 . 19518 1 1106 . 1 1 99 99 ILE HG21 H 1 0.538 0.009 . 1 . . . . . 99 ILE HG21 . 19518 1 1107 . 1 1 99 99 ILE HG22 H 1 0.538 0.009 . 1 . . . . . 99 ILE HG22 . 19518 1 1108 . 1 1 99 99 ILE HG23 H 1 0.538 0.009 . 1 . . . . . 99 ILE HG23 . 19518 1 1109 . 1 1 99 99 ILE HD11 H 1 0.700 0.002 . 1 . . . . . 99 ILE HD11 . 19518 1 1110 . 1 1 99 99 ILE HD12 H 1 0.700 0.002 . 1 . . . . . 99 ILE HD12 . 19518 1 1111 . 1 1 99 99 ILE HD13 H 1 0.700 0.002 . 1 . . . . . 99 ILE HD13 . 19518 1 1112 . 1 1 99 99 ILE C C 13 178.426 0.000 . 1 . . . . . 99 ILE C . 19518 1 1113 . 1 1 99 99 ILE CA C 13 65.123 0.129 . 1 . . . . . 99 ILE CA . 19518 1 1114 . 1 1 99 99 ILE CB C 13 37.505 0.037 . 1 . . . . . 99 ILE CB . 19518 1 1115 . 1 1 99 99 ILE CG1 C 13 29.834 0.028 . 1 . . . . . 99 ILE CG1 . 19518 1 1116 . 1 1 99 99 ILE CG2 C 13 17.315 0.026 . 1 . . . . . 99 ILE CG2 . 19518 1 1117 . 1 1 99 99 ILE CD1 C 13 12.907 0.054 . 1 . . . . . 99 ILE CD1 . 19518 1 1118 . 1 1 99 99 ILE N N 15 121.436 0.066 . 1 . . . . . 99 ILE N . 19518 1 1119 . 1 1 100 100 LEU H H 1 8.837 0.005 . 1 . . . . . 100 LEU H . 19518 1 1120 . 1 1 100 100 LEU HA H 1 4.110 0.002 . 1 . . . . . 100 LEU HA . 19518 1 1121 . 1 1 100 100 LEU HB2 H 1 1.644 0.016 . 1 . . . . . 100 LEU HB2 . 19518 1 1122 . 1 1 100 100 LEU HB3 H 1 1.803 0.013 . 1 . . . . . 100 LEU HB3 . 19518 1 1123 . 1 1 100 100 LEU HD11 H 1 0.983 0.008 . 1 . . . . . 100 LEU HD11 . 19518 1 1124 . 1 1 100 100 LEU HD12 H 1 0.983 0.008 . 1 . . . . . 100 LEU HD12 . 19518 1 1125 . 1 1 100 100 LEU HD13 H 1 0.983 0.008 . 1 . . . . . 100 LEU HD13 . 19518 1 1126 . 1 1 100 100 LEU C C 13 179.460 0.000 . 1 . . . . . 100 LEU C . 19518 1 1127 . 1 1 100 100 LEU CA C 13 58.941 0.049 . 1 . . . . . 100 LEU CA . 19518 1 1128 . 1 1 100 100 LEU CB C 13 41.562 0.173 . 1 . . . . . 100 LEU CB . 19518 1 1129 . 1 1 100 100 LEU CD1 C 13 24.086 0.008 . 1 . . . . . 100 LEU CD1 . 19518 1 1130 . 1 1 100 100 LEU N N 15 120.196 0.063 . 1 . . . . . 100 LEU N . 19518 1 1131 . 1 1 101 101 ASN H H 1 8.221 0.007 . 1 . . . . . 101 ASN H . 19518 1 1132 . 1 1 101 101 ASN HA H 1 4.308 0.010 . 1 . . . . . 101 ASN HA . 19518 1 1133 . 1 1 101 101 ASN HB2 H 1 2.857 0.004 . 1 . . . . . 101 ASN HB2 . 19518 1 1134 . 1 1 101 101 ASN HB3 H 1 2.645 0.009 . 1 . . . . . 101 ASN HB3 . 19518 1 1135 . 1 1 101 101 ASN HD21 H 1 7.450 0.006 . 1 . . . . . 101 ASN HD21 . 19518 1 1136 . 1 1 101 101 ASN HD22 H 1 6.866 0.007 . 1 . . . . . 101 ASN HD22 . 19518 1 1137 . 1 1 101 101 ASN C C 13 177.461 0.000 . 1 . . . . . 101 ASN C . 19518 1 1138 . 1 1 101 101 ASN CA C 13 55.740 0.067 . 1 . . . . . 101 ASN CA . 19518 1 1139 . 1 1 101 101 ASN CB C 13 37.567 0.055 . 1 . . . . . 101 ASN CB . 19518 1 1140 . 1 1 101 101 ASN N N 15 116.585 0.043 . 1 . . . . . 101 ASN N . 19518 1 1141 . 1 1 101 101 ASN ND2 N 15 111.307 0.117 . 1 . . . . . 101 ASN ND2 . 19518 1 1142 . 1 1 102 102 ALA H H 1 7.313 0.009 . 1 . . . . . 102 ALA H . 19518 1 1143 . 1 1 102 102 ALA HA H 1 4.109 0.011 . 1 . . . . . 102 ALA HA . 19518 1 1144 . 1 1 102 102 ALA HB1 H 1 1.474 0.015 . 1 . . . . . 102 ALA HB1 . 19518 1 1145 . 1 1 102 102 ALA HB2 H 1 1.474 0.015 . 1 . . . . . 102 ALA HB2 . 19518 1 1146 . 1 1 102 102 ALA HB3 H 1 1.474 0.015 . 1 . . . . . 102 ALA HB3 . 19518 1 1147 . 1 1 102 102 ALA C C 13 178.711 0.000 . 1 . . . . . 102 ALA C . 19518 1 1148 . 1 1 102 102 ALA CA C 13 55.011 0.044 . 1 . . . . . 102 ALA CA . 19518 1 1149 . 1 1 102 102 ALA CB C 13 17.991 0.161 . 1 . . . . . 102 ALA CB . 19518 1 1150 . 1 1 102 102 ALA N N 15 122.813 0.067 . 1 . . . . . 102 ALA N . 19518 1 1151 . 1 1 103 103 PHE H H 1 7.488 0.006 . 1 . . . . . 103 PHE H . 19518 1 1152 . 1 1 103 103 PHE HA H 1 3.840 0.008 . 1 . . . . . 103 PHE HA . 19518 1 1153 . 1 1 103 103 PHE HB2 H 1 1.533 0.013 . 1 . . . . . 103 PHE HB2 . 19518 1 1154 . 1 1 103 103 PHE HB3 H 1 2.450 0.007 . 1 . . . . . 103 PHE HB3 . 19518 1 1155 . 1 1 103 103 PHE HD1 H 1 6.659 0.027 . 3 . . . . . 103 PHE HD1 . 19518 1 1156 . 1 1 103 103 PHE HD2 H 1 6.659 0.027 . 3 . . . . . 103 PHE HD2 . 19518 1 1157 . 1 1 103 103 PHE HE1 H 1 6.468 0.019 . 3 . . . . . 103 PHE HE1 . 19518 1 1158 . 1 1 103 103 PHE HE2 H 1 6.468 0.019 . 3 . . . . . 103 PHE HE2 . 19518 1 1159 . 1 1 103 103 PHE C C 13 178.938 0.000 . 1 . . . . . 103 PHE C . 19518 1 1160 . 1 1 103 103 PHE CA C 13 63.050 0.117 . 1 . . . . . 103 PHE CA . 19518 1 1161 . 1 1 103 103 PHE CB C 13 39.902 0.055 . 1 . . . . . 103 PHE CB . 19518 1 1162 . 1 1 103 103 PHE N N 15 114.149 0.059 . 1 . . . . . 103 PHE N . 19518 1 1163 . 1 1 104 104 LYS H H 1 8.129 0.004 . 1 . . . . . 104 LYS H . 19518 1 1164 . 1 1 104 104 LYS HA H 1 3.799 0.009 . 1 . . . . . 104 LYS HA . 19518 1 1165 . 1 1 104 104 LYS HB2 H 1 1.860 0.016 . 1 . . . . . 104 LYS HB2 . 19518 1 1166 . 1 1 104 104 LYS HB3 H 1 1.669 0.014 . 1 . . . . . 104 LYS HB3 . 19518 1 1167 . 1 1 104 104 LYS HG2 H 1 1.537 0.013 . 1 . . . . . 104 LYS HG2 . 19518 1 1168 . 1 1 104 104 LYS HG3 H 1 1.537 0.013 . 1 . . . . . 104 LYS HG3 . 19518 1 1169 . 1 1 104 104 LYS HD2 H 1 1.803 0.003 . 1 . . . . . 104 LYS HD2 . 19518 1 1170 . 1 1 104 104 LYS HD3 H 1 1.803 0.003 . 1 . . . . . 104 LYS HD3 . 19518 1 1171 . 1 1 104 104 LYS HE2 H 1 3.471 0.000 . 1 . . . . . 104 LYS HE2 . 19518 1 1172 . 1 1 104 104 LYS HE3 H 1 3.471 0.000 . 1 . . . . . 104 LYS HE3 . 19518 1 1173 . 1 1 104 104 LYS C C 13 179.337 0.000 . 1 . . . . . 104 LYS C . 19518 1 1174 . 1 1 104 104 LYS CA C 13 60.044 0.048 . 1 . . . . . 104 LYS CA . 19518 1 1175 . 1 1 104 104 LYS CB C 13 32.137 0.119 . 1 . . . . . 104 LYS CB . 19518 1 1176 . 1 1 104 104 LYS CG C 13 27.094 0.000 . 1 . . . . . 104 LYS CG . 19518 1 1177 . 1 1 104 104 LYS CD C 13 27.160 0.027 . 1 . . . . . 104 LYS CD . 19518 1 1178 . 1 1 104 104 LYS N N 15 117.834 0.040 . 1 . . . . . 104 LYS N . 19518 1 1179 . 1 1 105 105 VAL H H 1 6.972 0.004 . 1 . . . . . 105 VAL H . 19518 1 1180 . 1 1 105 105 VAL HA H 1 3.347 0.008 . 1 . . . . . 105 VAL HA . 19518 1 1181 . 1 1 105 105 VAL HB H 1 1.709 0.007 . 1 . . . . . 105 VAL HB . 19518 1 1182 . 1 1 105 105 VAL HG11 H 1 0.716 0.006 . 1 . . . . . 105 VAL HG11 . 19518 1 1183 . 1 1 105 105 VAL HG12 H 1 0.716 0.006 . 1 . . . . . 105 VAL HG12 . 19518 1 1184 . 1 1 105 105 VAL HG13 H 1 0.716 0.006 . 1 . . . . . 105 VAL HG13 . 19518 1 1185 . 1 1 105 105 VAL HG21 H 1 0.121 0.012 . 1 . . . . . 105 VAL HG21 . 19518 1 1186 . 1 1 105 105 VAL HG22 H 1 0.121 0.012 . 1 . . . . . 105 VAL HG22 . 19518 1 1187 . 1 1 105 105 VAL HG23 H 1 0.121 0.012 . 1 . . . . . 105 VAL HG23 . 19518 1 1188 . 1 1 105 105 VAL C C 13 176.669 0.000 . 1 . . . . . 105 VAL C . 19518 1 1189 . 1 1 105 105 VAL CA C 13 65.537 0.150 . 1 . . . . . 105 VAL CA . 19518 1 1190 . 1 1 105 105 VAL CB C 13 31.271 0.168 . 1 . . . . . 105 VAL CB . 19518 1 1191 . 1 1 105 105 VAL CG1 C 13 22.689 0.050 . 1 . . . . . 105 VAL CG1 . 19518 1 1192 . 1 1 105 105 VAL CG2 C 13 20.859 0.054 . 1 . . . . . 105 VAL CG2 . 19518 1 1193 . 1 1 105 105 VAL N N 15 118.696 0.061 . 1 . . . . . 105 VAL N . 19518 1 1194 . 1 1 106 106 PHE H H 1 7.204 0.008 . 1 . . . . . 106 PHE H . 19518 1 1195 . 1 1 106 106 PHE HA H 1 4.363 0.014 . 1 . . . . . 106 PHE HA . 19518 1 1196 . 1 1 106 106 PHE HB2 H 1 3.498 0.008 . 1 . . . . . 106 PHE HB2 . 19518 1 1197 . 1 1 106 106 PHE HB3 H 1 2.766 0.002 . 1 . . . . . 106 PHE HB3 . 19518 1 1198 . 1 1 106 106 PHE HD1 H 1 7.244 0.020 . 3 . . . . . 106 PHE HD1 . 19518 1 1199 . 1 1 106 106 PHE HD2 H 1 7.244 0.020 . 3 . . . . . 106 PHE HD2 . 19518 1 1200 . 1 1 106 106 PHE HE1 H 1 6.882 0.019 . 3 . . . . . 106 PHE HE1 . 19518 1 1201 . 1 1 106 106 PHE HE2 H 1 6.882 0.019 . 3 . . . . . 106 PHE HE2 . 19518 1 1202 . 1 1 106 106 PHE C C 13 173.543 0.000 . 1 . . . . . 106 PHE C . 19518 1 1203 . 1 1 106 106 PHE CA C 13 58.513 0.038 . 1 . . . . . 106 PHE CA . 19518 1 1204 . 1 1 106 106 PHE CB C 13 39.509 0.050 . 1 . . . . . 106 PHE CB . 19518 1 1205 . 1 1 106 106 PHE CD1 C 13 131.746 0.032 . 3 . . . . . 106 PHE CD1 . 19518 1 1206 . 1 1 106 106 PHE CD2 C 13 131.746 0.032 . 3 . . . . . 106 PHE CD2 . 19518 1 1207 . 1 1 106 106 PHE CE1 C 13 132.542 0.021 . 3 . . . . . 106 PHE CE1 . 19518 1 1208 . 1 1 106 106 PHE CE2 C 13 132.542 0.021 . 3 . . . . . 106 PHE CE2 . 19518 1 1209 . 1 1 106 106 PHE N N 15 116.013 0.046 . 1 . . . . . 106 PHE N . 19518 1 1210 . 1 1 107 107 ASP H H 1 7.603 0.007 . 1 . . . . . 107 ASP H . 19518 1 1211 . 1 1 107 107 ASP HA H 1 5.228 0.006 . 1 . . . . . 107 ASP HA . 19518 1 1212 . 1 1 107 107 ASP HB2 H 1 2.455 0.013 . 1 . . . . . 107 ASP HB2 . 19518 1 1213 . 1 1 107 107 ASP HB3 H 1 2.827 0.000 . 1 . . . . . 107 ASP HB3 . 19518 1 1214 . 1 1 107 107 ASP CA C 13 51.270 0.000 . 1 . . . . . 107 ASP CA . 19518 1 1215 . 1 1 107 107 ASP CB C 13 42.015 0.158 . 1 . . . . . 107 ASP CB . 19518 1 1216 . 1 1 107 107 ASP N N 15 118.172 0.062 . 1 . . . . . 107 ASP N . 19518 1 1217 . 1 1 108 108 PRO HA H 1 4.334 0.008 . 1 . . . . . 108 PRO HA . 19518 1 1218 . 1 1 108 108 PRO HB2 H 1 2.208 0.004 . 1 . . . . . 108 PRO HB2 . 19518 1 1219 . 1 1 108 108 PRO HB3 H 1 1.927 0.005 . 1 . . . . . 108 PRO HB3 . 19518 1 1220 . 1 1 108 108 PRO HG2 H 1 1.955 0.004 . 1 . . . . . 108 PRO HG2 . 19518 1 1221 . 1 1 108 108 PRO HG3 H 1 1.955 0.004 . 1 . . . . . 108 PRO HG3 . 19518 1 1222 . 1 1 108 108 PRO HD2 H 1 3.839 0.006 . 1 . . . . . 108 PRO HD2 . 19518 1 1223 . 1 1 108 108 PRO HD3 H 1 3.256 0.008 . 1 . . . . . 108 PRO HD3 . 19518 1 1224 . 1 1 108 108 PRO C C 13 178.742 0.000 . 1 . . . . . 108 PRO C . 19518 1 1225 . 1 1 108 108 PRO CA C 13 65.139 0.072 . 1 . . . . . 108 PRO CA . 19518 1 1226 . 1 1 108 108 PRO CB C 13 31.267 0.140 . 1 . . . . . 108 PRO CB . 19518 1 1227 . 1 1 108 108 PRO CG C 13 27.519 0.011 . 1 . . . . . 108 PRO CG . 19518 1 1228 . 1 1 108 108 PRO CD C 13 50.866 0.054 . 1 . . . . . 108 PRO CD . 19518 1 1229 . 1 1 109 109 GLU H H 1 8.582 0.010 . 1 . . . . . 109 GLU H . 19518 1 1230 . 1 1 109 109 GLU HA H 1 4.157 0.006 . 1 . . . . . 109 GLU HA . 19518 1 1231 . 1 1 109 109 GLU HB2 H 1 1.929 0.005 . 1 . . . . . 109 GLU HB2 . 19518 1 1232 . 1 1 109 109 GLU HB3 H 1 1.929 0.005 . 1 . . . . . 109 GLU HB3 . 19518 1 1233 . 1 1 109 109 GLU HG2 H 1 2.055 0.002 . 1 . . . . . 109 GLU HG2 . 19518 1 1234 . 1 1 109 109 GLU HG3 H 1 2.201 0.006 . 1 . . . . . 109 GLU HG3 . 19518 1 1235 . 1 1 109 109 GLU C C 13 177.630 0.000 . 1 . . . . . 109 GLU C . 19518 1 1236 . 1 1 109 109 GLU CA C 13 57.077 0.054 . 1 . . . . . 109 GLU CA . 19518 1 1237 . 1 1 109 109 GLU CB C 13 29.688 0.187 . 1 . . . . . 109 GLU CB . 19518 1 1238 . 1 1 109 109 GLU CG C 13 37.121 0.046 . 1 . . . . . 109 GLU CG . 19518 1 1239 . 1 1 109 109 GLU N N 15 115.891 0.051 . 1 . . . . . 109 GLU N . 19518 1 1240 . 1 1 110 110 GLY H H 1 7.976 0.007 . 1 . . . . . 110 GLY H . 19518 1 1241 . 1 1 110 110 GLY HA2 H 1 3.733 0.006 . 1 . . . . . 110 GLY HA2 . 19518 1 1242 . 1 1 110 110 GLY HA3 H 1 3.734 0.006 . 1 . . . . . 110 GLY HA3 . 19518 1 1243 . 1 1 110 110 GLY C C 13 176.275 0.000 . 1 . . . . . 110 GLY C . 19518 1 1244 . 1 1 110 110 GLY CA C 13 47.435 0.043 . 1 . . . . . 110 GLY CA . 19518 1 1245 . 1 1 110 110 GLY N N 15 109.706 0.123 . 1 . . . . . 110 GLY N . 19518 1 1246 . 1 1 111 111 LYS H H 1 9.339 0.021 . 1 . . . . . 111 LYS H . 19518 1 1247 . 1 1 111 111 LYS HA H 1 4.002 0.013 . 1 . . . . . 111 LYS HA . 19518 1 1248 . 1 1 111 111 LYS HB2 H 1 1.945 0.008 . 1 . . . . . 111 LYS HB2 . 19518 1 1249 . 1 1 111 111 LYS HB3 H 1 1.945 0.008 . 1 . . . . . 111 LYS HB3 . 19518 1 1250 . 1 1 111 111 LYS HG2 H 1 1.787 0.009 . 1 . . . . . 111 LYS HG2 . 19518 1 1251 . 1 1 111 111 LYS HG3 H 1 1.787 0.009 . 1 . . . . . 111 LYS HG3 . 19518 1 1252 . 1 1 111 111 LYS HD2 H 1 1.574 0.011 . 1 . . . . . 111 LYS HD2 . 19518 1 1253 . 1 1 111 111 LYS HD3 H 1 1.574 0.011 . 1 . . . . . 111 LYS HD3 . 19518 1 1254 . 1 1 111 111 LYS HE2 H 1 2.861 0.005 . 1 . . . . . 111 LYS HE2 . 19518 1 1255 . 1 1 111 111 LYS HE3 H 1 2.861 0.005 . 1 . . . . . 111 LYS HE3 . 19518 1 1256 . 1 1 111 111 LYS C C 13 179.176 0.000 . 1 . . . . . 111 LYS C . 19518 1 1257 . 1 1 111 111 LYS CA C 13 58.018 0.088 . 1 . . . . . 111 LYS CA . 19518 1 1258 . 1 1 111 111 LYS CB C 13 32.766 0.034 . 1 . . . . . 111 LYS CB . 19518 1 1259 . 1 1 111 111 LYS CG C 13 25.977 0.000 . 1 . . . . . 111 LYS CG . 19518 1 1260 . 1 1 111 111 LYS CD C 13 28.555 0.001 . 1 . . . . . 111 LYS CD . 19518 1 1261 . 1 1 111 111 LYS CE C 13 41.785 0.000 . 1 . . . . . 111 LYS CE . 19518 1 1262 . 1 1 111 111 LYS N N 15 121.866 0.055 . 1 . . . . . 111 LYS N . 19518 1 1263 . 1 1 112 112 GLY H H 1 10.057 0.023 . 1 . . . . . 112 GLY H . 19518 1 1264 . 1 1 112 112 GLY HA2 H 1 2.769 0.011 . 1 . . . . . 112 GLY HA2 . 19518 1 1265 . 1 1 112 112 GLY HA3 H 1 3.746 0.012 . 1 . . . . . 112 GLY HA3 . 19518 1 1266 . 1 1 112 112 GLY C C 13 171.775 0.000 . 1 . . . . . 112 GLY C . 19518 1 1267 . 1 1 112 112 GLY CA C 13 45.290 0.066 . 1 . . . . . 112 GLY CA . 19518 1 1268 . 1 1 112 112 GLY N N 15 108.076 0.035 . 1 . . . . . 112 GLY N . 19518 1 1269 . 1 1 113 113 VAL H H 1 6.812 0.007 . 1 . . . . . 113 VAL H . 19518 1 1270 . 1 1 113 113 VAL HA H 1 5.087 0.008 . 1 . . . . . 113 VAL HA . 19518 1 1271 . 1 1 113 113 VAL HB H 1 1.570 0.009 . 1 . . . . . 113 VAL HB . 19518 1 1272 . 1 1 113 113 VAL HG11 H 1 0.608 0.003 . 1 . . . . . 113 VAL HG11 . 19518 1 1273 . 1 1 113 113 VAL HG12 H 1 0.608 0.003 . 1 . . . . . 113 VAL HG12 . 19518 1 1274 . 1 1 113 113 VAL HG13 H 1 0.608 0.003 . 1 . . . . . 113 VAL HG13 . 19518 1 1275 . 1 1 113 113 VAL HG21 H 1 0.463 0.004 . 1 . . . . . 113 VAL HG21 . 19518 1 1276 . 1 1 113 113 VAL HG22 H 1 0.463 0.004 . 1 . . . . . 113 VAL HG22 . 19518 1 1277 . 1 1 113 113 VAL HG23 H 1 0.463 0.004 . 1 . . . . . 113 VAL HG23 . 19518 1 1278 . 1 1 113 113 VAL C C 13 174.727 0.000 . 1 . . . . . 113 VAL C . 19518 1 1279 . 1 1 113 113 VAL CA C 13 57.619 0.049 . 1 . . . . . 113 VAL CA . 19518 1 1280 . 1 1 113 113 VAL CB C 13 36.636 0.226 . 1 . . . . . 113 VAL CB . 19518 1 1281 . 1 1 113 113 VAL CG1 C 13 21.575 0.026 . 1 . . . . . 113 VAL CG1 . 19518 1 1282 . 1 1 113 113 VAL CG2 C 13 18.137 0.040 . 1 . . . . . 113 VAL CG2 . 19518 1 1283 . 1 1 113 113 VAL N N 15 108.457 0.148 . 1 . . . . . 113 VAL N . 19518 1 1284 . 1 1 114 114 LEU H H 1 8.287 0.007 . 1 . . . . . 114 LEU H . 19518 1 1285 . 1 1 114 114 LEU HA H 1 4.784 0.005 . 1 . . . . . 114 LEU HA . 19518 1 1286 . 1 1 114 114 LEU HB2 H 1 1.574 0.008 . 1 . . . . . 114 LEU HB2 . 19518 1 1287 . 1 1 114 114 LEU HD11 H 1 0.812 0.008 . 1 . . . . . 114 LEU HD11 . 19518 1 1288 . 1 1 114 114 LEU HD12 H 1 0.812 0.008 . 1 . . . . . 114 LEU HD12 . 19518 1 1289 . 1 1 114 114 LEU HD13 H 1 0.812 0.008 . 1 . . . . . 114 LEU HD13 . 19518 1 1290 . 1 1 114 114 LEU HD21 H 1 1.117 0.007 . 1 . . . . . 114 LEU HD21 . 19518 1 1291 . 1 1 114 114 LEU HD22 H 1 1.117 0.007 . 1 . . . . . 114 LEU HD22 . 19518 1 1292 . 1 1 114 114 LEU HD23 H 1 1.117 0.007 . 1 . . . . . 114 LEU HD23 . 19518 1 1293 . 1 1 114 114 LEU C C 13 176.071 0.000 . 1 . . . . . 114 LEU C . 19518 1 1294 . 1 1 114 114 LEU CA C 13 52.988 0.072 . 1 . . . . . 114 LEU CA . 19518 1 1295 . 1 1 114 114 LEU CB C 13 48.267 0.080 . 1 . . . . . 114 LEU CB . 19518 1 1296 . 1 1 114 114 LEU CD1 C 13 25.014 0.019 . 1 . . . . . 114 LEU CD1 . 19518 1 1297 . 1 1 114 114 LEU CD2 C 13 24.784 0.054 . 1 . . . . . 114 LEU CD2 . 19518 1 1298 . 1 1 114 114 LEU N N 15 118.869 0.041 . 1 . . . . . 114 LEU N . 19518 1 1299 . 1 1 115 115 LYS H H 1 9.047 0.006 . 1 . . . . . 115 LYS H . 19518 1 1300 . 1 1 115 115 LYS HA H 1 4.502 0.006 . 1 . . . . . 115 LYS HA . 19518 1 1301 . 1 1 115 115 LYS HB2 H 1 2.005 0.016 . 1 . . . . . 115 LYS HB2 . 19518 1 1302 . 1 1 115 115 LYS HB3 H 1 1.857 0.002 . 1 . . . . . 115 LYS HB3 . 19518 1 1303 . 1 1 115 115 LYS HG2 H 1 1.620 0.004 . 1 . . . . . 115 LYS HG2 . 19518 1 1304 . 1 1 115 115 LYS HG3 H 1 1.521 0.011 . 1 . . . . . 115 LYS HG3 . 19518 1 1305 . 1 1 115 115 LYS HD2 H 1 1.661 0.002 . 1 . . . . . 115 LYS HD2 . 19518 1 1306 . 1 1 115 115 LYS HD3 H 1 1.661 0.002 . 1 . . . . . 115 LYS HD3 . 19518 1 1307 . 1 1 115 115 LYS HE2 H 1 2.998 0.031 . 1 . . . . . 115 LYS HE2 . 19518 1 1308 . 1 1 115 115 LYS HE3 H 1 2.998 0.031 . 1 . . . . . 115 LYS HE3 . 19518 1 1309 . 1 1 115 115 LYS C C 13 178.677 0.000 . 1 . . . . . 115 LYS C . 19518 1 1310 . 1 1 115 115 LYS CA C 13 57.072 0.059 . 1 . . . . . 115 LYS CA . 19518 1 1311 . 1 1 115 115 LYS CB C 13 31.936 0.156 . 1 . . . . . 115 LYS CB . 19518 1 1312 . 1 1 115 115 LYS CG C 13 25.357 0.047 . 1 . . . . . 115 LYS CG . 19518 1 1313 . 1 1 115 115 LYS CD C 13 28.727 0.008 . 1 . . . . . 115 LYS CD . 19518 1 1314 . 1 1 115 115 LYS CE C 13 41.916 0.000 . 1 . . . . . 115 LYS CE . 19518 1 1315 . 1 1 115 115 LYS N N 15 123.319 0.057 . 1 . . . . . 115 LYS N . 19518 1 1316 . 1 1 116 116 ALA H H 1 9.207 0.006 . 1 . . . . . 116 ALA H . 19518 1 1317 . 1 1 116 116 ALA HA H 1 3.884 0.005 . 1 . . . . . 116 ALA HA . 19518 1 1318 . 1 1 116 116 ALA HB1 H 1 1.119 0.002 . 1 . . . . . 116 ALA HB1 . 19518 1 1319 . 1 1 116 116 ALA HB2 H 1 1.119 0.002 . 1 . . . . . 116 ALA HB2 . 19518 1 1320 . 1 1 116 116 ALA HB3 H 1 1.119 0.002 . 1 . . . . . 116 ALA HB3 . 19518 1 1321 . 1 1 116 116 ALA C C 13 179.362 0.000 . 1 . . . . . 116 ALA C . 19518 1 1322 . 1 1 116 116 ALA CA C 13 56.173 0.036 . 1 . . . . . 116 ALA CA . 19518 1 1323 . 1 1 116 116 ALA CB C 13 17.833 0.039 . 1 . . . . . 116 ALA CB . 19518 1 1324 . 1 1 116 116 ALA N N 15 128.634 0.122 . 1 . . . . . 116 ALA N . 19518 1 1325 . 1 1 117 117 ASP H H 1 8.900 0.005 . 1 . . . . . 117 ASP H . 19518 1 1326 . 1 1 117 117 ASP HA H 1 4.293 0.009 . 1 . . . . . 117 ASP HA . 19518 1 1327 . 1 1 117 117 ASP HB2 H 1 2.660 0.004 . 1 . . . . . 117 ASP HB2 . 19518 1 1328 . 1 1 117 117 ASP HB3 H 1 2.504 0.007 . 1 . . . . . 117 ASP HB3 . 19518 1 1329 . 1 1 117 117 ASP C C 13 178.517 0.000 . 1 . . . . . 117 ASP C . 19518 1 1330 . 1 1 117 117 ASP CA C 13 57.334 0.053 . 1 . . . . . 117 ASP CA . 19518 1 1331 . 1 1 117 117 ASP CB C 13 39.632 0.057 . 1 . . . . . 117 ASP CB . 19518 1 1332 . 1 1 117 117 ASP N N 15 116.479 0.053 . 1 . . . . . 117 ASP N . 19518 1 1333 . 1 1 118 118 TYR H H 1 7.173 0.006 . 1 . . . . . 118 TYR H . 19518 1 1334 . 1 1 118 118 TYR HA H 1 4.500 0.015 . 1 . . . . . 118 TYR HA . 19518 1 1335 . 1 1 118 118 TYR HB2 H 1 3.251 0.016 . 1 . . . . . 118 TYR HB2 . 19518 1 1336 . 1 1 118 118 TYR HB3 H 1 3.251 0.017 . 1 . . . . . 118 TYR HB3 . 19518 1 1337 . 1 1 118 118 TYR HD1 H 1 7.100 0.019 . 3 . . . . . 118 TYR HD1 . 19518 1 1338 . 1 1 118 118 TYR HD2 H 1 7.100 0.019 . 3 . . . . . 118 TYR HD2 . 19518 1 1339 . 1 1 118 118 TYR HE1 H 1 6.868 0.010 . 3 . . . . . 118 TYR HE1 . 19518 1 1340 . 1 1 118 118 TYR HE2 H 1 6.868 0.010 . 3 . . . . . 118 TYR HE2 . 19518 1 1341 . 1 1 118 118 TYR C C 13 177.346 0.000 . 1 . . . . . 118 TYR C . 19518 1 1342 . 1 1 118 118 TYR CA C 13 59.662 0.046 . 1 . . . . . 118 TYR CA . 19518 1 1343 . 1 1 118 118 TYR CB C 13 38.417 0.003 . 1 . . . . . 118 TYR CB . 19518 1 1344 . 1 1 118 118 TYR CD1 C 13 132.990 0.124 . 3 . . . . . 118 TYR CD1 . 19518 1 1345 . 1 1 118 118 TYR CD2 C 13 132.990 0.124 . 3 . . . . . 118 TYR CD2 . 19518 1 1346 . 1 1 118 118 TYR CE1 C 13 118.813 0.069 . 3 . . . . . 118 TYR CE1 . 19518 1 1347 . 1 1 118 118 TYR CE2 C 13 118.813 0.069 . 3 . . . . . 118 TYR CE2 . 19518 1 1348 . 1 1 118 118 TYR N N 15 122.835 0.055 . 1 . . . . . 118 TYR N . 19518 1 1349 . 1 1 119 119 VAL H H 1 8.086 0.006 . 1 . . . . . 119 VAL H . 19518 1 1350 . 1 1 119 119 VAL HA H 1 3.242 0.010 . 1 . . . . . 119 VAL HA . 19518 1 1351 . 1 1 119 119 VAL HB H 1 2.291 0.005 . 1 . . . . . 119 VAL HB . 19518 1 1352 . 1 1 119 119 VAL HG11 H 1 0.964 0.008 . 1 . . . . . 119 VAL HG11 . 19518 1 1353 . 1 1 119 119 VAL HG12 H 1 0.964 0.008 . 1 . . . . . 119 VAL HG12 . 19518 1 1354 . 1 1 119 119 VAL HG13 H 1 0.964 0.008 . 1 . . . . . 119 VAL HG13 . 19518 1 1355 . 1 1 119 119 VAL HG21 H 1 0.726 0.009 . 1 . . . . . 119 VAL HG21 . 19518 1 1356 . 1 1 119 119 VAL HG22 H 1 0.726 0.009 . 1 . . . . . 119 VAL HG22 . 19518 1 1357 . 1 1 119 119 VAL HG23 H 1 0.726 0.009 . 1 . . . . . 119 VAL HG23 . 19518 1 1358 . 1 1 119 119 VAL C C 13 177.167 0.000 . 1 . . . . . 119 VAL C . 19518 1 1359 . 1 1 119 119 VAL CA C 13 66.605 0.081 . 1 . . . . . 119 VAL CA . 19518 1 1360 . 1 1 119 119 VAL CB C 13 31.540 0.032 . 1 . . . . . 119 VAL CB . 19518 1 1361 . 1 1 119 119 VAL CG1 C 13 24.941 0.035 . 1 . . . . . 119 VAL CG1 . 19518 1 1362 . 1 1 119 119 VAL CG2 C 13 21.630 0.018 . 1 . . . . . 119 VAL CG2 . 19518 1 1363 . 1 1 119 119 VAL N N 15 119.974 0.106 . 1 . . . . . 119 VAL N . 19518 1 1364 . 1 1 120 120 ARG H H 1 8.683 0.005 . 1 . . . . . 120 ARG H . 19518 1 1365 . 1 1 120 120 ARG HA H 1 3.648 0.008 . 1 . . . . . 120 ARG HA . 19518 1 1366 . 1 1 120 120 ARG HB2 H 1 1.988 0.014 . 1 . . . . . 120 ARG HB2 . 19518 1 1367 . 1 1 120 120 ARG HB3 H 1 1.928 0.000 . 1 . . . . . 120 ARG HB3 . 19518 1 1368 . 1 1 120 120 ARG HG2 H 1 1.802 0.003 . 1 . . . . . 120 ARG HG2 . 19518 1 1369 . 1 1 120 120 ARG HG3 H 1 1.802 0.003 . 1 . . . . . 120 ARG HG3 . 19518 1 1370 . 1 1 120 120 ARG C C 13 178.474 0.000 . 1 . . . . . 120 ARG C . 19518 1 1371 . 1 1 120 120 ARG CA C 13 60.268 0.093 . 1 . . . . . 120 ARG CA . 19518 1 1372 . 1 1 120 120 ARG CB C 13 29.800 0.173 . 1 . . . . . 120 ARG CB . 19518 1 1373 . 1 1 120 120 ARG CG C 13 26.106 0.000 . 1 . . . . . 120 ARG CG . 19518 1 1374 . 1 1 120 120 ARG N N 15 119.129 0.042 . 1 . . . . . 120 ARG N . 19518 1 1375 . 1 1 121 121 GLU H H 1 7.803 0.006 . 1 . . . . . 121 GLU H . 19518 1 1376 . 1 1 121 121 GLU HA H 1 3.761 0.007 . 1 . . . . . 121 GLU HA . 19518 1 1377 . 1 1 121 121 GLU HB2 H 1 2.038 0.006 . 1 . . . . . 121 GLU HB2 . 19518 1 1378 . 1 1 121 121 GLU HB3 H 1 2.038 0.006 . 1 . . . . . 121 GLU HB3 . 19518 1 1379 . 1 1 121 121 GLU HG2 H 1 2.119 0.003 . 1 . . . . . 121 GLU HG2 . 19518 1 1380 . 1 1 121 121 GLU HG3 H 1 1.988 0.001 . 1 . . . . . 121 GLU HG3 . 19518 1 1381 . 1 1 121 121 GLU C C 13 179.168 0.000 . 1 . . . . . 121 GLU C . 19518 1 1382 . 1 1 121 121 GLU CA C 13 59.910 0.032 . 1 . . . . . 121 GLU CA . 19518 1 1383 . 1 1 121 121 GLU CB C 13 29.220 0.053 . 1 . . . . . 121 GLU CB . 19518 1 1384 . 1 1 121 121 GLU CG C 13 35.871 0.012 . 1 . . . . . 121 GLU CG . 19518 1 1385 . 1 1 121 121 GLU N N 15 120.944 0.074 . 1 . . . . . 121 GLU N . 19518 1 1386 . 1 1 122 122 MET H H 1 8.360 0.005 . 1 . . . . . 122 MET H . 19518 1 1387 . 1 1 122 122 MET HA H 1 3.683 0.008 . 1 . . . . . 122 MET HA . 19518 1 1388 . 1 1 122 122 MET HB2 H 1 1.580 0.010 . 1 . . . . . 122 MET HB2 . 19518 1 1389 . 1 1 122 122 MET HB3 H 1 1.363 0.007 . 1 . . . . . 122 MET HB3 . 19518 1 1390 . 1 1 122 122 MET HG2 H 1 1.924 0.009 . 1 . . . . . 122 MET HG2 . 19518 1 1391 . 1 1 122 122 MET HE1 H 1 0.918 0.002 . 1 . . . . . 122 MET HE1 . 19518 1 1392 . 1 1 122 122 MET HE2 H 1 0.918 0.002 . 1 . . . . . 122 MET HE2 . 19518 1 1393 . 1 1 122 122 MET HE3 H 1 0.918 0.002 . 1 . . . . . 122 MET HE3 . 19518 1 1394 . 1 1 122 122 MET C C 13 177.254 0.000 . 1 . . . . . 122 MET C . 19518 1 1395 . 1 1 122 122 MET CA C 13 59.226 0.087 . 1 . . . . . 122 MET CA . 19518 1 1396 . 1 1 122 122 MET CB C 13 32.869 0.221 . 1 . . . . . 122 MET CB . 19518 1 1397 . 1 1 122 122 MET CG C 13 30.923 0.062 . 1 . . . . . 122 MET CG . 19518 1 1398 . 1 1 122 122 MET CE C 13 15.593 0.059 . 1 . . . . . 122 MET CE . 19518 1 1399 . 1 1 122 122 MET N N 15 120.441 0.060 . 1 . . . . . 122 MET N . 19518 1 1400 . 1 1 123 123 LEU H H 1 7.962 0.008 . 1 . . . . . 123 LEU H . 19518 1 1401 . 1 1 123 123 LEU HA H 1 3.560 0.007 . 1 . . . . . 123 LEU HA . 19518 1 1402 . 1 1 123 123 LEU HB2 H 1 1.590 0.003 . 1 . . . . . 123 LEU HB2 . 19518 1 1403 . 1 1 123 123 LEU HB3 H 1 1.439 0.004 . 1 . . . . . 123 LEU HB3 . 19518 1 1404 . 1 1 123 123 LEU HG H 1 0.458 0.010 . 1 . . . . . 123 LEU HG . 19518 1 1405 . 1 1 123 123 LEU HD11 H 1 0.190 0.007 . 1 . . . . . 123 LEU HD11 . 19518 1 1406 . 1 1 123 123 LEU HD12 H 1 0.190 0.007 . 1 . . . . . 123 LEU HD12 . 19518 1 1407 . 1 1 123 123 LEU HD13 H 1 0.190 0.007 . 1 . . . . . 123 LEU HD13 . 19518 1 1408 . 1 1 123 123 LEU HD21 H 1 -0.048 0.007 . 1 . . . . . 123 LEU HD21 . 19518 1 1409 . 1 1 123 123 LEU HD22 H 1 -0.048 0.007 . 1 . . . . . 123 LEU HD22 . 19518 1 1410 . 1 1 123 123 LEU HD23 H 1 -0.048 0.007 . 1 . . . . . 123 LEU HD23 . 19518 1 1411 . 1 1 123 123 LEU C C 13 179.326 0.000 . 1 . . . . . 123 LEU C . 19518 1 1412 . 1 1 123 123 LEU CA C 13 57.582 0.059 . 1 . . . . . 123 LEU CA . 19518 1 1413 . 1 1 123 123 LEU CB C 13 41.664 0.000 . 1 . . . . . 123 LEU CB . 19518 1 1414 . 1 1 123 123 LEU CD1 C 13 27.024 0.051 . 1 . . . . . 123 LEU CD1 . 19518 1 1415 . 1 1 123 123 LEU CD2 C 13 22.613 0.029 . 1 . . . . . 123 LEU CD2 . 19518 1 1416 . 1 1 123 123 LEU N N 15 112.400 0.034 . 1 . . . . . 123 LEU N . 19518 1 1417 . 1 1 124 124 THR H H 1 7.432 0.010 . 1 . . . . . 124 THR H . 19518 1 1418 . 1 1 124 124 THR HA H 1 4.742 0.019 . 1 . . . . . 124 THR HA . 19518 1 1419 . 1 1 124 124 THR HB H 1 4.299 0.006 . 1 . . . . . 124 THR HB . 19518 1 1420 . 1 1 124 124 THR HG21 H 1 1.177 0.009 . 1 . . . . . 124 THR HG21 . 19518 1 1421 . 1 1 124 124 THR HG22 H 1 1.177 0.009 . 1 . . . . . 124 THR HG22 . 19518 1 1422 . 1 1 124 124 THR HG23 H 1 1.177 0.009 . 1 . . . . . 124 THR HG23 . 19518 1 1423 . 1 1 124 124 THR C C 13 176.300 0.000 . 1 . . . . . 124 THR C . 19518 1 1424 . 1 1 124 124 THR CA C 13 62.561 0.147 . 1 . . . . . 124 THR CA . 19518 1 1425 . 1 1 124 124 THR CB C 13 71.352 0.060 . 1 . . . . . 124 THR CB . 19518 1 1426 . 1 1 124 124 THR CG2 C 13 21.907 0.041 . 1 . . . . . 124 THR CG2 . 19518 1 1427 . 1 1 124 124 THR N N 15 103.756 0.076 . 1 . . . . . 124 THR N . 19518 1 1428 . 1 1 125 125 THR H H 1 7.154 0.007 . 1 . . . . . 125 THR H . 19518 1 1429 . 1 1 125 125 THR HA H 1 4.551 0.008 . 1 . . . . . 125 THR HA . 19518 1 1430 . 1 1 125 125 THR HB H 1 4.269 0.011 . 1 . . . . . 125 THR HB . 19518 1 1431 . 1 1 125 125 THR HG21 H 1 1.201 0.005 . 1 . . . . . 125 THR HG21 . 19518 1 1432 . 1 1 125 125 THR HG22 H 1 1.201 0.005 . 1 . . . . . 125 THR HG22 . 19518 1 1433 . 1 1 125 125 THR HG23 H 1 1.201 0.005 . 1 . . . . . 125 THR HG23 . 19518 1 1434 . 1 1 125 125 THR C C 13 174.329 0.000 . 1 . . . . . 125 THR C . 19518 1 1435 . 1 1 125 125 THR CA C 13 62.311 0.096 . 1 . . . . . 125 THR CA . 19518 1 1436 . 1 1 125 125 THR CB C 13 71.789 0.081 . 1 . . . . . 125 THR CB . 19518 1 1437 . 1 1 125 125 THR CG2 C 13 21.019 0.024 . 1 . . . . . 125 THR CG2 . 19518 1 1438 . 1 1 125 125 THR N N 15 107.656 0.058 . 1 . . . . . 125 THR N . 19518 1 1439 . 1 1 126 126 GLN H H 1 7.042 0.005 . 1 . . . . . 126 GLN H . 19518 1 1440 . 1 1 126 126 GLN HA H 1 4.569 0.007 . 1 . . . . . 126 GLN HA . 19518 1 1441 . 1 1 126 126 GLN HB2 H 1 1.866 0.010 . 1 . . . . . 126 GLN HB2 . 19518 1 1442 . 1 1 126 126 GLN HB3 H 1 2.246 0.016 . 1 . . . . . 126 GLN HB3 . 19518 1 1443 . 1 1 126 126 GLN HG2 H 1 2.247 0.014 . 1 . . . . . 126 GLN HG2 . 19518 1 1444 . 1 1 126 126 GLN HG3 H 1 2.221 0.012 . 1 . . . . . 126 GLN HG3 . 19518 1 1445 . 1 1 126 126 GLN HE21 H 1 7.207 0.005 . 1 . . . . . 126 GLN HE21 . 19518 1 1446 . 1 1 126 126 GLN HE22 H 1 6.578 0.006 . 1 . . . . . 126 GLN HE22 . 19518 1 1447 . 1 1 126 126 GLN C C 13 173.437 0.000 . 1 . . . . . 126 GLN C . 19518 1 1448 . 1 1 126 126 GLN CA C 13 54.143 0.054 . 1 . . . . . 126 GLN CA . 19518 1 1449 . 1 1 126 126 GLN CB C 13 33.061 0.167 . 1 . . . . . 126 GLN CB . 19518 1 1450 . 1 1 126 126 GLN CG C 13 33.731 0.024 . 1 . . . . . 126 GLN CG . 19518 1 1451 . 1 1 126 126 GLN N N 15 115.882 3.826 . 1 . . . . . 126 GLN N . 19518 1 1452 . 1 1 127 127 ALA H H 1 8.732 0.014 . 1 . . . . . 127 ALA H . 19518 1 1453 . 1 1 127 127 ALA HA H 1 3.825 0.005 . 1 . . . . . 127 ALA HA . 19518 1 1454 . 1 1 127 127 ALA HB1 H 1 1.335 0.002 . 1 . . . . . 127 ALA HB1 . 19518 1 1455 . 1 1 127 127 ALA HB2 H 1 1.335 0.002 . 1 . . . . . 127 ALA HB2 . 19518 1 1456 . 1 1 127 127 ALA HB3 H 1 1.335 0.002 . 1 . . . . . 127 ALA HB3 . 19518 1 1457 . 1 1 127 127 ALA C C 13 177.634 0.000 . 1 . . . . . 127 ALA C . 19518 1 1458 . 1 1 127 127 ALA CA C 13 53.532 0.091 . 1 . . . . . 127 ALA CA . 19518 1 1459 . 1 1 127 127 ALA CB C 13 17.521 0.210 . 1 . . . . . 127 ALA CB . 19518 1 1460 . 1 1 127 127 ALA N N 15 121.803 0.135 . 1 . . . . . 127 ALA N . 19518 1 1461 . 1 1 128 128 GLU H H 1 9.029 0.004 . 1 . . . . . 128 GLU H . 19518 1 1462 . 1 1 128 128 GLU HA H 1 4.446 0.008 . 1 . . . . . 128 GLU HA . 19518 1 1463 . 1 1 128 128 GLU HB2 H 1 1.870 0.012 . 1 . . . . . 128 GLU HB2 . 19518 1 1464 . 1 1 128 128 GLU HB3 H 1 1.749 0.009 . 1 . . . . . 128 GLU HB3 . 19518 1 1465 . 1 1 128 128 GLU HG2 H 1 2.148 0.020 . 1 . . . . . 128 GLU HG2 . 19518 1 1466 . 1 1 128 128 GLU HG3 H 1 2.128 0.011 . 1 . . . . . 128 GLU HG3 . 19518 1 1467 . 1 1 128 128 GLU C C 13 175.801 0.000 . 1 . . . . . 128 GLU C . 19518 1 1468 . 1 1 128 128 GLU CA C 13 55.120 0.064 . 1 . . . . . 128 GLU CA . 19518 1 1469 . 1 1 128 128 GLU CB C 13 26.571 0.134 . 1 . . . . . 128 GLU CB . 19518 1 1470 . 1 1 128 128 GLU CG C 13 36.157 0.039 . 1 . . . . . 128 GLU CG . 19518 1 1471 . 1 1 128 128 GLU N N 15 128.166 0.034 . 1 . . . . . 128 GLU N . 19518 1 1472 . 1 1 129 129 ARG H H 1 7.169 0.006 . 1 . . . . . 129 ARG H . 19518 1 1473 . 1 1 129 129 ARG HA H 1 3.915 0.006 . 1 . . . . . 129 ARG HA . 19518 1 1474 . 1 1 129 129 ARG HB2 H 1 1.436 0.004 . 1 . . . . . 129 ARG HB2 . 19518 1 1475 . 1 1 129 129 ARG HB3 H 1 1.436 0.004 . 1 . . . . . 129 ARG HB3 . 19518 1 1476 . 1 1 129 129 ARG HG2 H 1 1.355 0.009 . 1 . . . . . 129 ARG HG2 . 19518 1 1477 . 1 1 129 129 ARG HG3 H 1 1.355 0.009 . 1 . . . . . 129 ARG HG3 . 19518 1 1478 . 1 1 129 129 ARG HD2 H 1 3.027 0.006 . 1 . . . . . 129 ARG HD2 . 19518 1 1479 . 1 1 129 129 ARG HD3 H 1 3.027 0.006 . 1 . . . . . 129 ARG HD3 . 19518 1 1480 . 1 1 129 129 ARG C C 13 177.519 0.000 . 1 . . . . . 129 ARG C . 19518 1 1481 . 1 1 129 129 ARG CA C 13 57.425 0.076 . 1 . . . . . 129 ARG CA . 19518 1 1482 . 1 1 129 129 ARG CB C 13 30.976 0.192 . 1 . . . . . 129 ARG CB . 19518 1 1483 . 1 1 129 129 ARG CD C 13 42.742 0.000 . 1 . . . . . 129 ARG CD . 19518 1 1484 . 1 1 129 129 ARG N N 15 118.274 0.090 . 1 . . . . . 129 ARG N . 19518 1 1485 . 1 1 130 130 PHE H H 1 9.116 0.005 . 1 . . . . . 130 PHE H . 19518 1 1486 . 1 1 130 130 PHE HA H 1 4.734 0.005 . 1 . . . . . 130 PHE HA . 19518 1 1487 . 1 1 130 130 PHE HB2 H 1 3.108 0.004 . 1 . . . . . 130 PHE HB2 . 19518 1 1488 . 1 1 130 130 PHE HB3 H 1 2.583 0.012 . 1 . . . . . 130 PHE HB3 . 19518 1 1489 . 1 1 130 130 PHE HD1 H 1 7.060 0.026 . 3 . . . . . 130 PHE HD1 . 19518 1 1490 . 1 1 130 130 PHE HD2 H 1 7.060 0.026 . 3 . . . . . 130 PHE HD2 . 19518 1 1491 . 1 1 130 130 PHE HE1 H 1 6.723 0.000 . 3 . . . . . 130 PHE HE1 . 19518 1 1492 . 1 1 130 130 PHE HE2 H 1 6.723 0.000 . 3 . . . . . 130 PHE HE2 . 19518 1 1493 . 1 1 130 130 PHE C C 13 176.729 0.000 . 1 . . . . . 130 PHE C . 19518 1 1494 . 1 1 130 130 PHE CA C 13 55.343 0.088 . 1 . . . . . 130 PHE CA . 19518 1 1495 . 1 1 130 130 PHE CB C 13 38.779 0.034 . 1 . . . . . 130 PHE CB . 19518 1 1496 . 1 1 130 130 PHE N N 15 126.101 0.091 . 1 . . . . . 130 PHE N . 19518 1 1497 . 1 1 131 131 SER H H 1 8.998 0.012 . 1 . . . . . 131 SER H . 19518 1 1498 . 1 1 131 131 SER HA H 1 4.474 0.008 . 1 . . . . . 131 SER HA . 19518 1 1499 . 1 1 131 131 SER HB2 H 1 4.312 0.033 . 1 . . . . . 131 SER HB2 . 19518 1 1500 . 1 1 131 131 SER HB3 H 1 3.934 0.004 . 1 . . . . . 131 SER HB3 . 19518 1 1501 . 1 1 131 131 SER C C 13 175.353 0.000 . 1 . . . . . 131 SER C . 19518 1 1502 . 1 1 131 131 SER CA C 13 56.543 0.105 . 1 . . . . . 131 SER CA . 19518 1 1503 . 1 1 131 131 SER CB C 13 65.367 0.112 . 1 . . . . . 131 SER CB . 19518 1 1504 . 1 1 131 131 SER N N 15 117.230 0.046 . 1 . . . . . 131 SER N . 19518 1 1505 . 1 1 132 132 LYS H H 1 8.784 0.016 . 1 . . . . . 132 LYS H . 19518 1 1506 . 1 1 132 132 LYS HA H 1 3.795 0.011 . 1 . . . . . 132 LYS HA . 19518 1 1507 . 1 1 132 132 LYS HB2 H 1 1.879 0.004 . 1 . . . . . 132 LYS HB2 . 19518 1 1508 . 1 1 132 132 LYS HB3 H 1 1.650 0.005 . 1 . . . . . 132 LYS HB3 . 19518 1 1509 . 1 1 132 132 LYS HG2 H 1 1.638 0.005 . 1 . . . . . 132 LYS HG2 . 19518 1 1510 . 1 1 132 132 LYS HG3 H 1 1.638 0.005 . 1 . . . . . 132 LYS HG3 . 19518 1 1511 . 1 1 132 132 LYS HD2 H 1 1.416 0.000 . 1 . . . . . 132 LYS HD2 . 19518 1 1512 . 1 1 132 132 LYS HD3 H 1 1.416 0.000 . 1 . . . . . 132 LYS HD3 . 19518 1 1513 . 1 1 132 132 LYS HE2 H 1 2.816 0.034 . 1 . . . . . 132 LYS HE2 . 19518 1 1514 . 1 1 132 132 LYS HE3 H 1 2.816 0.034 . 1 . . . . . 132 LYS HE3 . 19518 1 1515 . 1 1 132 132 LYS C C 13 178.145 0.000 . 1 . . . . . 132 LYS C . 19518 1 1516 . 1 1 132 132 LYS CA C 13 60.136 0.053 . 1 . . . . . 132 LYS CA . 19518 1 1517 . 1 1 132 132 LYS CB C 13 31.918 0.026 . 1 . . . . . 132 LYS CB . 19518 1 1518 . 1 1 132 132 LYS CG C 13 26.750 0.000 . 1 . . . . . 132 LYS CG . 19518 1 1519 . 1 1 132 132 LYS CD C 13 28.728 0.009 . 1 . . . . . 132 LYS CD . 19518 1 1520 . 1 1 132 132 LYS N N 15 122.121 0.114 . 1 . . . . . 132 LYS N . 19518 1 1521 . 1 1 133 133 GLU H H 1 8.496 0.012 . 1 . . . . . 133 GLU H . 19518 1 1522 . 1 1 133 133 GLU HA H 1 3.953 0.006 . 1 . . . . . 133 GLU HA . 19518 1 1523 . 1 1 133 133 GLU HB2 H 1 1.774 0.004 . 1 . . . . . 133 GLU HB2 . 19518 1 1524 . 1 1 133 133 GLU HB3 H 1 1.939 0.002 . 1 . . . . . 133 GLU HB3 . 19518 1 1525 . 1 1 133 133 GLU HG2 H 1 2.149 0.001 . 1 . . . . . 133 GLU HG2 . 19518 1 1526 . 1 1 133 133 GLU HG3 H 1 2.297 0.010 . 1 . . . . . 133 GLU HG3 . 19518 1 1527 . 1 1 133 133 GLU C C 13 179.347 0.000 . 1 . . . . . 133 GLU C . 19518 1 1528 . 1 1 133 133 GLU CA C 13 60.502 0.055 . 1 . . . . . 133 GLU CA . 19518 1 1529 . 1 1 133 133 GLU CB C 13 28.494 0.026 . 1 . . . . . 133 GLU CB . 19518 1 1530 . 1 1 133 133 GLU CG C 13 37.194 0.002 . 1 . . . . . 133 GLU CG . 19518 1 1531 . 1 1 133 133 GLU N N 15 117.282 0.060 . 1 . . . . . 133 GLU N . 19518 1 1532 . 1 1 134 134 GLU H H 1 7.809 0.006 . 1 . . . . . 134 GLU H . 19518 1 1533 . 1 1 134 134 GLU HA H 1 3.743 0.014 . 1 . . . . . 134 GLU HA . 19518 1 1534 . 1 1 134 134 GLU HB2 H 1 1.711 0.013 . 1 . . . . . 134 GLU HB2 . 19518 1 1535 . 1 1 134 134 GLU HB3 H 1 1.720 0.003 . 1 . . . . . 134 GLU HB3 . 19518 1 1536 . 1 1 134 134 GLU HG2 H 1 2.220 0.013 . 1 . . . . . 134 GLU HG2 . 19518 1 1537 . 1 1 134 134 GLU HG3 H 1 1.679 0.009 . 1 . . . . . 134 GLU HG3 . 19518 1 1538 . 1 1 134 134 GLU C C 13 180.091 0.000 . 1 . . . . . 134 GLU C . 19518 1 1539 . 1 1 134 134 GLU CA C 13 59.719 0.048 . 1 . . . . . 134 GLU CA . 19518 1 1540 . 1 1 134 134 GLU CB C 13 30.676 0.193 . 1 . . . . . 134 GLU CB . 19518 1 1541 . 1 1 134 134 GLU CG C 13 38.507 0.056 . 1 . . . . . 134 GLU CG . 19518 1 1542 . 1 1 134 134 GLU N N 15 119.363 0.071 . 1 . . . . . 134 GLU N . 19518 1 1543 . 1 1 135 135 VAL H H 1 8.040 0.004 . 1 . . . . . 135 VAL H . 19518 1 1544 . 1 1 135 135 VAL HA H 1 3.692 0.014 . 1 . . . . . 135 VAL HA . 19518 1 1545 . 1 1 135 135 VAL HB H 1 2.104 0.009 . 1 . . . . . 135 VAL HB . 19518 1 1546 . 1 1 135 135 VAL HG11 H 1 1.043 0.007 . 1 . . . . . 135 VAL HG11 . 19518 1 1547 . 1 1 135 135 VAL HG12 H 1 1.043 0.007 . 1 . . . . . 135 VAL HG12 . 19518 1 1548 . 1 1 135 135 VAL HG13 H 1 1.043 0.007 . 1 . . . . . 135 VAL HG13 . 19518 1 1549 . 1 1 135 135 VAL HG21 H 1 0.786 0.003 . 1 . . . . . 135 VAL HG21 . 19518 1 1550 . 1 1 135 135 VAL HG22 H 1 0.786 0.003 . 1 . . . . . 135 VAL HG22 . 19518 1 1551 . 1 1 135 135 VAL HG23 H 1 0.786 0.003 . 1 . . . . . 135 VAL HG23 . 19518 1 1552 . 1 1 135 135 VAL C C 13 177.068 0.000 . 1 . . . . . 135 VAL C . 19518 1 1553 . 1 1 135 135 VAL CA C 13 66.532 0.070 . 1 . . . . . 135 VAL CA . 19518 1 1554 . 1 1 135 135 VAL CB C 13 31.650 0.069 . 1 . . . . . 135 VAL CB . 19518 1 1555 . 1 1 135 135 VAL CG1 C 13 25.046 0.034 . 1 . . . . . 135 VAL CG1 . 19518 1 1556 . 1 1 135 135 VAL CG2 C 13 22.869 0.063 . 1 . . . . . 135 VAL CG2 . 19518 1 1557 . 1 1 135 135 VAL N N 15 119.915 0.047 . 1 . . . . . 135 VAL N . 19518 1 1558 . 1 1 136 136 ASP H H 1 8.658 0.007 . 1 . . . . . 136 ASP H . 19518 1 1559 . 1 1 136 136 ASP HA H 1 4.356 0.005 . 1 . . . . . 136 ASP HA . 19518 1 1560 . 1 1 136 136 ASP HB2 H 1 2.558 0.003 . 1 . . . . . 136 ASP HB2 . 19518 1 1561 . 1 1 136 136 ASP HB3 H 1 2.773 0.003 . 1 . . . . . 136 ASP HB3 . 19518 1 1562 . 1 1 136 136 ASP C C 13 180.364 0.000 . 1 . . . . . 136 ASP C . 19518 1 1563 . 1 1 136 136 ASP CA C 13 57.819 0.063 . 1 . . . . . 136 ASP CA . 19518 1 1564 . 1 1 136 136 ASP CB C 13 39.290 0.042 . 1 . . . . . 136 ASP CB . 19518 1 1565 . 1 1 136 136 ASP N N 15 122.516 0.095 . 1 . . . . . 136 ASP N . 19518 1 1566 . 1 1 137 137 GLN H H 1 8.230 0.006 . 1 . . . . . 137 GLN H . 19518 1 1567 . 1 1 137 137 GLN HA H 1 3.967 0.004 . 1 . . . . . 137 GLN HA . 19518 1 1568 . 1 1 137 137 GLN HB2 H 1 2.008 0.008 . 1 . . . . . 137 GLN HB2 . 19518 1 1569 . 1 1 137 137 GLN HB3 H 1 2.008 0.008 . 1 . . . . . 137 GLN HB3 . 19518 1 1570 . 1 1 137 137 GLN HG2 H 1 2.293 0.004 . 1 . . . . . 137 GLN HG2 . 19518 1 1571 . 1 1 137 137 GLN HG3 H 1 2.469 0.006 . 1 . . . . . 137 GLN HG3 . 19518 1 1572 . 1 1 137 137 GLN HE21 H 1 7.329 0.006 . 1 . . . . . 137 GLN HE21 . 19518 1 1573 . 1 1 137 137 GLN HE22 H 1 6.663 0.005 . 1 . . . . . 137 GLN HE22 . 19518 1 1574 . 1 1 137 137 GLN C C 13 179.204 0.000 . 1 . . . . . 137 GLN C . 19518 1 1575 . 1 1 137 137 GLN CA C 13 58.895 0.024 . 1 . . . . . 137 GLN CA . 19518 1 1576 . 1 1 137 137 GLN CB C 13 28.078 0.100 . 1 . . . . . 137 GLN CB . 19518 1 1577 . 1 1 137 137 GLN CG C 13 34.063 0.000 . 1 . . . . . 137 GLN CG . 19518 1 1578 . 1 1 137 137 GLN N N 15 118.664 3.047 . 1 . . . . . 137 GLN N . 19518 1 1579 . 1 1 137 137 GLN NE2 N 15 111.068 0.091 . 1 . . . . . 137 GLN NE2 . 19518 1 1580 . 1 1 138 138 MET H H 1 7.970 0.007 . 1 . . . . . 138 MET H . 19518 1 1581 . 1 1 138 138 MET HA H 1 4.105 0.001 . 1 . . . . . 138 MET HA . 19518 1 1582 . 1 1 138 138 MET HB2 H 1 2.067 0.010 . 1 . . . . . 138 MET HB2 . 19518 1 1583 . 1 1 138 138 MET HB3 H 1 1.959 0.000 . 1 . . . . . 138 MET HB3 . 19518 1 1584 . 1 1 138 138 MET HG2 H 1 2.529 0.012 . 1 . . . . . 138 MET HG2 . 19518 1 1585 . 1 1 138 138 MET HG3 H 1 2.535 0.003 . 1 . . . . . 138 MET HG3 . 19518 1 1586 . 1 1 138 138 MET HE1 H 1 1.332 0.004 . 1 . . . . . 138 MET HE1 . 19518 1 1587 . 1 1 138 138 MET HE2 H 1 1.332 0.004 . 1 . . . . . 138 MET HE2 . 19518 1 1588 . 1 1 138 138 MET HE3 H 1 1.332 0.004 . 1 . . . . . 138 MET HE3 . 19518 1 1589 . 1 1 138 138 MET C C 13 178.166 0.000 . 1 . . . . . 138 MET C . 19518 1 1590 . 1 1 138 138 MET CA C 13 60.162 0.013 . 1 . . . . . 138 MET CA . 19518 1 1591 . 1 1 138 138 MET CB C 13 31.949 0.078 . 1 . . . . . 138 MET CB . 19518 1 1592 . 1 1 138 138 MET CG C 13 32.909 0.025 . 1 . . . . . 138 MET CG . 19518 1 1593 . 1 1 138 138 MET CE C 13 18.094 0.017 . 1 . . . . . 138 MET CE . 19518 1 1594 . 1 1 138 138 MET N N 15 122.868 0.041 . 1 . . . . . 138 MET N . 19518 1 1595 . 1 1 139 139 PHE H H 1 8.501 0.008 . 1 . . . . . 139 PHE H . 19518 1 1596 . 1 1 139 139 PHE HA H 1 4.735 0.009 . 1 . . . . . 139 PHE HA . 19518 1 1597 . 1 1 139 139 PHE HB2 H 1 3.189 0.002 . 1 . . . . . 139 PHE HB2 . 19518 1 1598 . 1 1 139 139 PHE HB3 H 1 2.968 0.007 . 1 . . . . . 139 PHE HB3 . 19518 1 1599 . 1 1 139 139 PHE HD1 H 1 7.476 0.002 . 3 . . . . . 139 PHE HD1 . 19518 1 1600 . 1 1 139 139 PHE HD2 H 1 7.476 0.002 . 3 . . . . . 139 PHE HD2 . 19518 1 1601 . 1 1 139 139 PHE HE1 H 1 7.553 0.000 . 3 . . . . . 139 PHE HE1 . 19518 1 1602 . 1 1 139 139 PHE HE2 H 1 7.553 0.000 . 3 . . . . . 139 PHE HE2 . 19518 1 1603 . 1 1 139 139 PHE C C 13 177.661 0.000 . 1 . . . . . 139 PHE C . 19518 1 1604 . 1 1 139 139 PHE CA C 13 59.026 0.109 . 1 . . . . . 139 PHE CA . 19518 1 1605 . 1 1 139 139 PHE CB C 13 36.079 3.749 . 1 . . . . . 139 PHE CB . 19518 1 1606 . 1 1 139 139 PHE CD1 C 13 130.695 0.000 . 3 . . . . . 139 PHE CD1 . 19518 1 1607 . 1 1 139 139 PHE CD2 C 13 130.695 0.000 . 3 . . . . . 139 PHE CD2 . 19518 1 1608 . 1 1 139 139 PHE N N 15 117.290 0.060 . 1 . . . . . 139 PHE N . 19518 1 1609 . 1 1 140 140 ALA H H 1 7.676 0.004 . 1 . . . . . 140 ALA H . 19518 1 1610 . 1 1 140 140 ALA HA H 1 4.157 0.009 . 1 . . . . . 140 ALA HA . 19518 1 1611 . 1 1 140 140 ALA HB1 H 1 1.388 0.003 . 1 . . . . . 140 ALA HB1 . 19518 1 1612 . 1 1 140 140 ALA HB2 H 1 1.388 0.003 . 1 . . . . . 140 ALA HB2 . 19518 1 1613 . 1 1 140 140 ALA HB3 H 1 1.388 0.003 . 1 . . . . . 140 ALA HB3 . 19518 1 1614 . 1 1 140 140 ALA C C 13 179.069 0.000 . 1 . . . . . 140 ALA C . 19518 1 1615 . 1 1 140 140 ALA CA C 13 54.633 0.000 . 1 . . . . . 140 ALA CA . 19518 1 1616 . 1 1 140 140 ALA CB C 13 18.017 0.057 . 1 . . . . . 140 ALA CB . 19518 1 1617 . 1 1 140 140 ALA N N 15 121.691 0.056 . 1 . . . . . 140 ALA N . 19518 1 1618 . 1 1 141 141 ALA H H 1 7.155 0.004 . 1 . . . . . 141 ALA H . 19518 1 1619 . 1 1 141 141 ALA HA H 1 3.971 0.009 . 1 . . . . . 141 ALA HA . 19518 1 1620 . 1 1 141 141 ALA HB1 H 1 1.032 0.009 . 1 . . . . . 141 ALA HB1 . 19518 1 1621 . 1 1 141 141 ALA HB2 H 1 1.032 0.009 . 1 . . . . . 141 ALA HB2 . 19518 1 1622 . 1 1 141 141 ALA HB3 H 1 1.032 0.009 . 1 . . . . . 141 ALA HB3 . 19518 1 1623 . 1 1 141 141 ALA C C 13 177.195 0.000 . 1 . . . . . 141 ALA C . 19518 1 1624 . 1 1 141 141 ALA CA C 13 53.789 0.052 . 1 . . . . . 141 ALA CA . 19518 1 1625 . 1 1 141 141 ALA CB C 13 18.487 0.082 . 1 . . . . . 141 ALA CB . 19518 1 1626 . 1 1 141 141 ALA N N 15 120.183 0.114 . 1 . . . . . 141 ALA N . 19518 1 1627 . 1 1 142 142 PHE H H 1 8.181 0.010 . 1 . . . . . 142 PHE H . 19518 1 1628 . 1 1 142 142 PHE HA H 1 4.768 0.009 . 1 . . . . . 142 PHE HA . 19518 1 1629 . 1 1 142 142 PHE HB2 H 1 2.900 0.001 . 1 . . . . . 142 PHE HB2 . 19518 1 1630 . 1 1 142 142 PHE HD1 H 1 7.040 0.021 . 3 . . . . . 142 PHE HD1 . 19518 1 1631 . 1 1 142 142 PHE HD2 H 1 7.040 0.021 . 3 . . . . . 142 PHE HD2 . 19518 1 1632 . 1 1 142 142 PHE CA C 13 54.337 0.056 . 1 . . . . . 142 PHE CA . 19518 1 1633 . 1 1 142 142 PHE CB C 13 38.563 0.000 . 1 . . . . . 142 PHE CB . 19518 1 1634 . 1 1 142 142 PHE N N 15 117.631 0.103 . 1 . . . . . 142 PHE N . 19518 1 1635 . 1 1 143 143 PRO HA H 1 4.327 0.003 . 1 . . . . . 143 PRO HA . 19518 1 1636 . 1 1 143 143 PRO HB2 H 1 1.757 0.007 . 1 . . . . . 143 PRO HB2 . 19518 1 1637 . 1 1 143 143 PRO HB3 H 1 1.831 0.000 . 1 . . . . . 143 PRO HB3 . 19518 1 1638 . 1 1 143 143 PRO HG2 H 1 1.840 0.005 . 1 . . . . . 143 PRO HG2 . 19518 1 1639 . 1 1 143 143 PRO HG3 H 1 1.918 0.003 . 1 . . . . . 143 PRO HG3 . 19518 1 1640 . 1 1 143 143 PRO HD2 H 1 3.412 0.008 . 1 . . . . . 143 PRO HD2 . 19518 1 1641 . 1 1 143 143 PRO HD3 H 1 3.182 0.007 . 1 . . . . . 143 PRO HD3 . 19518 1 1642 . 1 1 143 143 PRO CA C 13 64.805 0.000 . 1 . . . . . 143 PRO CA . 19518 1 1643 . 1 1 143 143 PRO CB C 13 32.148 0.000 . 1 . . . . . 143 PRO CB . 19518 1 1644 . 1 1 143 143 PRO CG C 13 27.690 0.044 . 1 . . . . . 143 PRO CG . 19518 1 1645 . 1 1 143 143 PRO CD C 13 49.752 0.000 . 1 . . . . . 143 PRO CD . 19518 1 1646 . 1 1 144 144 PRO HA H 1 4.538 0.005 . 1 . . . . . 144 PRO HA . 19518 1 1647 . 1 1 144 144 PRO HB2 H 1 1.749 0.016 . 1 . . . . . 144 PRO HB2 . 19518 1 1648 . 1 1 144 144 PRO HB3 H 1 1.603 0.005 . 1 . . . . . 144 PRO HB3 . 19518 1 1649 . 1 1 144 144 PRO HG2 H 1 1.290 0.001 . 1 . . . . . 144 PRO HG2 . 19518 1 1650 . 1 1 144 144 PRO HG3 H 1 1.290 0.001 . 1 . . . . . 144 PRO HG3 . 19518 1 1651 . 1 1 144 144 PRO HD2 H 1 3.526 0.013 . 1 . . . . . 144 PRO HD2 . 19518 1 1652 . 1 1 144 144 PRO HD3 H 1 3.526 0.013 . 1 . . . . . 144 PRO HD3 . 19518 1 1653 . 1 1 144 144 PRO C C 13 176.077 0.000 . 1 . . . . . 144 PRO C . 19518 1 1654 . 1 1 144 144 PRO CA C 13 61.821 0.028 . 1 . . . . . 144 PRO CA . 19518 1 1655 . 1 1 144 144 PRO CB C 13 32.227 0.189 . 1 . . . . . 144 PRO CB . 19518 1 1656 . 1 1 144 144 PRO CG C 13 27.148 0.000 . 1 . . . . . 144 PRO CG . 19518 1 1657 . 1 1 144 144 PRO CD C 13 50.041 0.000 . 1 . . . . . 144 PRO CD . 19518 1 1658 . 1 1 145 145 ASP H H 1 8.614 0.005 . 1 . . . . . 145 ASP H . 19518 1 1659 . 1 1 145 145 ASP HA H 1 4.543 0.006 . 1 . . . . . 145 ASP HA . 19518 1 1660 . 1 1 145 145 ASP HB2 H 1 3.322 0.009 . 1 . . . . . 145 ASP HB2 . 19518 1 1661 . 1 1 145 145 ASP HB3 H 1 2.753 0.002 . 1 . . . . . 145 ASP HB3 . 19518 1 1662 . 1 1 145 145 ASP C C 13 178.763 0.000 . 1 . . . . . 145 ASP C . 19518 1 1663 . 1 1 145 145 ASP CA C 13 52.921 0.074 . 1 . . . . . 145 ASP CA . 19518 1 1664 . 1 1 145 145 ASP CB C 13 41.233 0.054 . 1 . . . . . 145 ASP CB . 19518 1 1665 . 1 1 145 145 ASP N N 15 120.075 0.066 . 1 . . . . . 145 ASP N . 19518 1 1666 . 1 1 146 146 VAL H H 1 8.072 0.006 . 1 . . . . . 146 VAL H . 19518 1 1667 . 1 1 146 146 VAL HA H 1 3.935 0.007 . 1 . . . . . 146 VAL HA . 19518 1 1668 . 1 1 146 146 VAL HB H 1 2.184 0.003 . 1 . . . . . 146 VAL HB . 19518 1 1669 . 1 1 146 146 VAL HG11 H 1 0.938 0.004 . 1 . . . . . 146 VAL HG11 . 19518 1 1670 . 1 1 146 146 VAL HG12 H 1 0.938 0.004 . 1 . . . . . 146 VAL HG12 . 19518 1 1671 . 1 1 146 146 VAL HG13 H 1 0.938 0.004 . 1 . . . . . 146 VAL HG13 . 19518 1 1672 . 1 1 146 146 VAL HG21 H 1 0.938 0.005 . 1 . . . . . 146 VAL HG21 . 19518 1 1673 . 1 1 146 146 VAL HG22 H 1 0.938 0.005 . 1 . . . . . 146 VAL HG22 . 19518 1 1674 . 1 1 146 146 VAL HG23 H 1 0.938 0.005 . 1 . . . . . 146 VAL HG23 . 19518 1 1675 . 1 1 146 146 VAL C C 13 176.976 0.000 . 1 . . . . . 146 VAL C . 19518 1 1676 . 1 1 146 146 VAL CA C 13 64.544 0.076 . 1 . . . . . 146 VAL CA . 19518 1 1677 . 1 1 146 146 VAL CB C 13 31.434 0.051 . 1 . . . . . 146 VAL CB . 19518 1 1678 . 1 1 146 146 VAL CG1 C 13 20.629 0.058 . 1 . . . . . 146 VAL CG1 . 19518 1 1679 . 1 1 146 146 VAL CG2 C 13 20.610 0.037 . 1 . . . . . 146 VAL CG2 . 19518 1 1680 . 1 1 146 146 VAL N N 15 115.486 0.033 . 1 . . . . . 146 VAL N . 19518 1 1681 . 1 1 147 147 THR H H 1 7.938 0.010 . 1 . . . . . 147 THR H . 19518 1 1682 . 1 1 147 147 THR HA H 1 4.338 0.012 . 1 . . . . . 147 THR HA . 19518 1 1683 . 1 1 147 147 THR HB H 1 4.325 0.016 . 1 . . . . . 147 THR HB . 19518 1 1684 . 1 1 147 147 THR HG21 H 1 1.092 0.009 . 1 . . . . . 147 THR HG21 . 19518 1 1685 . 1 1 147 147 THR HG22 H 1 1.092 0.009 . 1 . . . . . 147 THR HG22 . 19518 1 1686 . 1 1 147 147 THR HG23 H 1 1.092 0.009 . 1 . . . . . 147 THR HG23 . 19518 1 1687 . 1 1 147 147 THR C C 13 174.832 0.000 . 1 . . . . . 147 THR C . 19518 1 1688 . 1 1 147 147 THR CA C 13 61.347 0.097 . 1 . . . . . 147 THR CA . 19518 1 1689 . 1 1 147 147 THR CB C 13 69.107 0.066 . 1 . . . . . 147 THR CB . 19518 1 1690 . 1 1 147 147 THR CG2 C 13 22.784 0.043 . 1 . . . . . 147 THR CG2 . 19518 1 1691 . 1 1 147 147 THR N N 15 112.102 0.040 . 1 . . . . . 147 THR N . 19518 1 1692 . 1 1 148 148 GLY H H 1 8.235 0.005 . 1 . . . . . 148 GLY H . 19518 1 1693 . 1 1 148 148 GLY HA2 H 1 4.171 0.008 . 1 . . . . . 148 GLY HA2 . 19518 1 1694 . 1 1 148 148 GLY HA3 H 1 3.571 0.003 . 1 . . . . . 148 GLY HA3 . 19518 1 1695 . 1 1 148 148 GLY C C 13 174.187 0.000 . 1 . . . . . 148 GLY C . 19518 1 1696 . 1 1 148 148 GLY CA C 13 45.491 0.044 . 1 . . . . . 148 GLY CA . 19518 1 1697 . 1 1 148 148 GLY N N 15 109.381 0.042 . 1 . . . . . 148 GLY N . 19518 1 1698 . 1 1 149 149 ASN H H 1 8.318 0.004 . 1 . . . . . 149 ASN H . 19518 1 1699 . 1 1 149 149 ASN HA H 1 5.063 0.009 . 1 . . . . . 149 ASN HA . 19518 1 1700 . 1 1 149 149 ASN HB2 H 1 2.946 0.013 . 1 . . . . . 149 ASN HB2 . 19518 1 1701 . 1 1 149 149 ASN HB3 H 1 2.946 0.012 . 1 . . . . . 149 ASN HB3 . 19518 1 1702 . 1 1 149 149 ASN HD21 H 1 7.891 0.004 . 1 . . . . . 149 ASN HD21 . 19518 1 1703 . 1 1 149 149 ASN HD22 H 1 6.545 0.008 . 1 . . . . . 149 ASN HD22 . 19518 1 1704 . 1 1 149 149 ASN C C 13 173.952 0.000 . 1 . . . . . 149 ASN C . 19518 1 1705 . 1 1 149 149 ASN CA C 13 52.770 0.070 . 1 . . . . . 149 ASN CA . 19518 1 1706 . 1 1 149 149 ASN CB C 13 40.399 0.088 . 1 . . . . . 149 ASN CB . 19518 1 1707 . 1 1 149 149 ASN N N 15 120.262 0.043 . 1 . . . . . 149 ASN N . 19518 1 1708 . 1 1 149 149 ASN ND2 N 15 114.435 0.097 . 1 . . . . . 149 ASN ND2 . 19518 1 1709 . 1 1 150 150 LEU H H 1 9.526 0.006 . 1 . . . . . 150 LEU H . 19518 1 1710 . 1 1 150 150 LEU HA H 1 4.576 0.017 . 1 . . . . . 150 LEU HA . 19518 1 1711 . 1 1 150 150 LEU HB2 H 1 1.888 0.010 . 1 . . . . . 150 LEU HB2 . 19518 1 1712 . 1 1 150 150 LEU HB3 H 1 1.118 0.009 . 1 . . . . . 150 LEU HB3 . 19518 1 1713 . 1 1 150 150 LEU HD11 H 1 0.849 0.004 . 1 . . . . . 150 LEU HD11 . 19518 1 1714 . 1 1 150 150 LEU HD12 H 1 0.849 0.004 . 1 . . . . . 150 LEU HD12 . 19518 1 1715 . 1 1 150 150 LEU HD13 H 1 0.849 0.004 . 1 . . . . . 150 LEU HD13 . 19518 1 1716 . 1 1 150 150 LEU C C 13 175.071 0.000 . 1 . . . . . 150 LEU C . 19518 1 1717 . 1 1 150 150 LEU CA C 13 53.533 0.050 . 1 . . . . . 150 LEU CA . 19518 1 1718 . 1 1 150 150 LEU CB C 13 45.073 0.290 . 1 . . . . . 150 LEU CB . 19518 1 1719 . 1 1 150 150 LEU CD1 C 13 24.457 0.050 . 1 . . . . . 150 LEU CD1 . 19518 1 1720 . 1 1 150 150 LEU N N 15 123.154 0.044 . 1 . . . . . 150 LEU N . 19518 1 1721 . 1 1 151 151 ASP H H 1 8.562 0.011 . 1 . . . . . 151 ASP H . 19518 1 1722 . 1 1 151 151 ASP HA H 1 4.639 0.024 . 1 . . . . . 151 ASP HA . 19518 1 1723 . 1 1 151 151 ASP HB2 H 1 2.838 0.008 . 1 . . . . . 151 ASP HB2 . 19518 1 1724 . 1 1 151 151 ASP HB3 H 1 2.477 0.006 . 1 . . . . . 151 ASP HB3 . 19518 1 1725 . 1 1 151 151 ASP C C 13 176.915 0.000 . 1 . . . . . 151 ASP C . 19518 1 1726 . 1 1 151 151 ASP CA C 13 52.970 0.065 . 1 . . . . . 151 ASP CA . 19518 1 1727 . 1 1 151 151 ASP CB C 13 39.531 0.072 . 1 . . . . . 151 ASP CB . 19518 1 1728 . 1 1 151 151 ASP N N 15 125.817 0.056 . 1 . . . . . 151 ASP N . 19518 1 1729 . 1 1 152 152 TYR H H 1 7.075 0.011 . 1 . . . . . 152 TYR H . 19518 1 1730 . 1 1 152 152 TYR HA H 1 3.950 0.004 . 1 . . . . . 152 TYR HA . 19518 1 1731 . 1 1 152 152 TYR HB2 H 1 1.597 0.040 . 1 . . . . . 152 TYR HB2 . 19518 1 1732 . 1 1 152 152 TYR HB3 H 1 1.544 0.014 . 1 . . . . . 152 TYR HB3 . 19518 1 1733 . 1 1 152 152 TYR HD1 H 1 6.256 0.024 . 3 . . . . . 152 TYR HD1 . 19518 1 1734 . 1 1 152 152 TYR HD2 H 1 6.256 0.024 . 3 . . . . . 152 TYR HD2 . 19518 1 1735 . 1 1 152 152 TYR HE1 H 1 6.451 0.011 . 3 . . . . . 152 TYR HE1 . 19518 1 1736 . 1 1 152 152 TYR HE2 H 1 6.451 0.011 . 3 . . . . . 152 TYR HE2 . 19518 1 1737 . 1 1 152 152 TYR C C 13 175.960 0.000 . 1 . . . . . 152 TYR C . 19518 1 1738 . 1 1 152 152 TYR CA C 13 58.049 0.075 . 1 . . . . . 152 TYR CA . 19518 1 1739 . 1 1 152 152 TYR CB C 13 36.451 0.125 . 1 . . . . . 152 TYR CB . 19518 1 1740 . 1 1 152 152 TYR CD1 C 13 133.120 0.189 . 3 . . . . . 152 TYR CD1 . 19518 1 1741 . 1 1 152 152 TYR CD2 C 13 133.120 0.189 . 3 . . . . . 152 TYR CD2 . 19518 1 1742 . 1 1 152 152 TYR CE1 C 13 117.922 0.184 . 3 . . . . . 152 TYR CE1 . 19518 1 1743 . 1 1 152 152 TYR CE2 C 13 117.922 0.184 . 3 . . . . . 152 TYR CE2 . 19518 1 1744 . 1 1 152 152 TYR N N 15 123.912 0.031 . 1 . . . . . 152 TYR N . 19518 1 1745 . 1 1 153 153 LYS H H 1 7.426 0.007 . 1 . . . . . 153 LYS H . 19518 1 1746 . 1 1 153 153 LYS HA H 1 3.673 0.007 . 1 . . . . . 153 LYS HA . 19518 1 1747 . 1 1 153 153 LYS HB2 H 1 1.689 0.009 . 1 . . . . . 153 LYS HB2 . 19518 1 1748 . 1 1 153 153 LYS HB3 H 1 1.593 0.014 . 1 . . . . . 153 LYS HB3 . 19518 1 1749 . 1 1 153 153 LYS HG2 H 1 0.993 0.006 . 1 . . . . . 153 LYS HG2 . 19518 1 1750 . 1 1 153 153 LYS HG3 H 1 0.993 0.006 . 1 . . . . . 153 LYS HG3 . 19518 1 1751 . 1 1 153 153 LYS HD2 H 1 1.591 0.004 . 1 . . . . . 153 LYS HD2 . 19518 1 1752 . 1 1 153 153 LYS HD3 H 1 1.591 0.004 . 1 . . . . . 153 LYS HD3 . 19518 1 1753 . 1 1 153 153 LYS HE2 H 1 3.109 0.000 . 1 . . . . . 153 LYS HE2 . 19518 1 1754 . 1 1 153 153 LYS HE3 H 1 3.109 0.000 . 1 . . . . . 153 LYS HE3 . 19518 1 1755 . 1 1 153 153 LYS C C 13 179.588 0.000 . 1 . . . . . 153 LYS C . 19518 1 1756 . 1 1 153 153 LYS CA C 13 60.194 0.042 . 1 . . . . . 153 LYS CA . 19518 1 1757 . 1 1 153 153 LYS CB C 13 30.487 0.181 . 1 . . . . . 153 LYS CB . 19518 1 1758 . 1 1 153 153 LYS CG C 13 25.672 0.000 . 1 . . . . . 153 LYS CG . 19518 1 1759 . 1 1 153 153 LYS CD C 13 26.643 0.018 . 1 . . . . . 153 LYS CD . 19518 1 1760 . 1 1 153 153 LYS N N 15 126.846 0.059 . 1 . . . . . 153 LYS N . 19518 1 1761 . 1 1 154 154 ASN H H 1 7.865 0.009 . 1 . . . . . 154 ASN H . 19518 1 1762 . 1 1 154 154 ASN HA H 1 4.222 0.009 . 1 . . . . . 154 ASN HA . 19518 1 1763 . 1 1 154 154 ASN HB2 H 1 2.455 0.010 . 1 . . . . . 154 ASN HB2 . 19518 1 1764 . 1 1 154 154 ASN HB3 H 1 2.455 0.010 . 1 . . . . . 154 ASN HB3 . 19518 1 1765 . 1 1 154 154 ASN HD21 H 1 6.972 0.008 . 1 . . . . . 154 ASN HD21 . 19518 1 1766 . 1 1 154 154 ASN HD22 H 1 8.249 0.003 . 1 . . . . . 154 ASN HD22 . 19518 1 1767 . 1 1 154 154 ASN C C 13 176.063 0.000 . 1 . . . . . 154 ASN C . 19518 1 1768 . 1 1 154 154 ASN CA C 13 56.323 0.130 . 1 . . . . . 154 ASN CA . 19518 1 1769 . 1 1 154 154 ASN CB C 13 39.137 0.065 . 1 . . . . . 154 ASN CB . 19518 1 1770 . 1 1 154 154 ASN N N 15 120.167 0.047 . 1 . . . . . 154 ASN N . 19518 1 1771 . 1 1 154 154 ASN ND2 N 15 115.717 0.075 . 1 . . . . . 154 ASN ND2 . 19518 1 1772 . 1 1 155 155 LEU H H 1 6.799 0.007 . 1 . . . . . 155 LEU H . 19518 1 1773 . 1 1 155 155 LEU HA H 1 3.446 0.008 . 1 . . . . . 155 LEU HA . 19518 1 1774 . 1 1 155 155 LEU HB2 H 1 1.185 0.008 . 1 . . . . . 155 LEU HB2 . 19518 1 1775 . 1 1 155 155 LEU HB3 H 1 1.227 0.002 . 1 . . . . . 155 LEU HB3 . 19518 1 1776 . 1 1 155 155 LEU HG H 1 0.907 0.000 . 1 . . . . . 155 LEU HG . 19518 1 1777 . 1 1 155 155 LEU HD11 H 1 0.171 0.006 . 1 . . . . . 155 LEU HD11 . 19518 1 1778 . 1 1 155 155 LEU HD12 H 1 0.171 0.006 . 1 . . . . . 155 LEU HD12 . 19518 1 1779 . 1 1 155 155 LEU HD13 H 1 0.171 0.006 . 1 . . . . . 155 LEU HD13 . 19518 1 1780 . 1 1 155 155 LEU HD21 H 1 0.349 0.005 . 1 . . . . . 155 LEU HD21 . 19518 1 1781 . 1 1 155 155 LEU HD22 H 1 0.349 0.005 . 1 . . . . . 155 LEU HD22 . 19518 1 1782 . 1 1 155 155 LEU HD23 H 1 0.349 0.005 . 1 . . . . . 155 LEU HD23 . 19518 1 1783 . 1 1 155 155 LEU C C 13 177.829 0.000 . 1 . . . . . 155 LEU C . 19518 1 1784 . 1 1 155 155 LEU CA C 13 59.287 0.060 . 1 . . . . . 155 LEU CA . 19518 1 1785 . 1 1 155 155 LEU CB C 13 41.898 0.244 . 1 . . . . . 155 LEU CB . 19518 1 1786 . 1 1 155 155 LEU CG C 13 27.148 0.000 . 1 . . . . . 155 LEU CG . 19518 1 1787 . 1 1 155 155 LEU CD1 C 13 26.695 0.040 . 1 . . . . . 155 LEU CD1 . 19518 1 1788 . 1 1 155 155 LEU CD2 C 13 25.427 0.035 . 1 . . . . . 155 LEU CD2 . 19518 1 1789 . 1 1 155 155 LEU N N 15 119.427 0.037 . 1 . . . . . 155 LEU N . 19518 1 1790 . 1 1 156 156 VAL H H 1 8.060 0.009 . 1 . . . . . 156 VAL H . 19518 1 1791 . 1 1 156 156 VAL HA H 1 3.197 0.011 . 1 . . . . . 156 VAL HA . 19518 1 1792 . 1 1 156 156 VAL HB H 1 2.112 0.007 . 1 . . . . . 156 VAL HB . 19518 1 1793 . 1 1 156 156 VAL HG11 H 1 1.040 0.013 . 1 . . . . . 156 VAL HG11 . 19518 1 1794 . 1 1 156 156 VAL HG12 H 1 1.040 0.013 . 1 . . . . . 156 VAL HG12 . 19518 1 1795 . 1 1 156 156 VAL HG13 H 1 1.040 0.013 . 1 . . . . . 156 VAL HG13 . 19518 1 1796 . 1 1 156 156 VAL HG21 H 1 1.040 0.013 . 1 . . . . . 156 VAL HG21 . 19518 1 1797 . 1 1 156 156 VAL HG22 H 1 1.040 0.013 . 1 . . . . . 156 VAL HG22 . 19518 1 1798 . 1 1 156 156 VAL HG23 H 1 1.040 0.013 . 1 . . . . . 156 VAL HG23 . 19518 1 1799 . 1 1 156 156 VAL C C 13 178.169 0.000 . 1 . . . . . 156 VAL C . 19518 1 1800 . 1 1 156 156 VAL CA C 13 66.989 0.082 . 1 . . . . . 156 VAL CA . 19518 1 1801 . 1 1 156 156 VAL CB C 13 31.104 0.017 . 1 . . . . . 156 VAL CB . 19518 1 1802 . 1 1 156 156 VAL CG1 C 13 24.221 0.034 . 1 . . . . . 156 VAL CG1 . 19518 1 1803 . 1 1 156 156 VAL CG2 C 13 24.221 0.034 . 1 . . . . . 156 VAL CG2 . 19518 1 1804 . 1 1 156 156 VAL N N 15 117.377 0.084 . 1 . . . . . 156 VAL N . 19518 1 1805 . 1 1 157 157 HIS H H 1 8.020 0.006 . 1 . . . . . 157 HIS H . 19518 1 1806 . 1 1 157 157 HIS HA H 1 4.069 0.009 . 1 . . . . . 157 HIS HA . 19518 1 1807 . 1 1 157 157 HIS HB2 H 1 3.372 0.008 . 1 . . . . . 157 HIS HB2 . 19518 1 1808 . 1 1 157 157 HIS HB3 H 1 3.117 0.012 . 1 . . . . . 157 HIS HB3 . 19518 1 1809 . 1 1 157 157 HIS HD2 H 1 6.169 0.033 . 1 . . . . . 157 HIS HD2 . 19518 1 1810 . 1 1 157 157 HIS HE1 H 1 8.005 0.000 . 1 . . . . . 157 HIS HE1 . 19518 1 1811 . 1 1 157 157 HIS C C 13 176.996 0.000 . 1 . . . . . 157 HIS C . 19518 1 1812 . 1 1 157 157 HIS CA C 13 60.284 0.099 . 1 . . . . . 157 HIS CA . 19518 1 1813 . 1 1 157 157 HIS CB C 13 28.462 0.083 . 1 . . . . . 157 HIS CB . 19518 1 1814 . 1 1 157 157 HIS N N 15 121.121 0.041 . 1 . . . . . 157 HIS N . 19518 1 1815 . 1 1 158 158 ILE H H 1 8.178 0.006 . 1 . . . . . 158 ILE H . 19518 1 1816 . 1 1 158 158 ILE HA H 1 3.610 0.007 . 1 . . . . . 158 ILE HA . 19518 1 1817 . 1 1 158 158 ILE HB H 1 1.941 0.005 . 1 . . . . . 158 ILE HB . 19518 1 1818 . 1 1 158 158 ILE HG12 H 1 1.220 0.004 . 1 . . . . . 158 ILE HG12 . 19518 1 1819 . 1 1 158 158 ILE HG13 H 1 1.220 0.004 . 1 . . . . . 158 ILE HG13 . 19518 1 1820 . 1 1 158 158 ILE HG21 H 1 0.833 0.014 . 1 . . . . . 158 ILE HG21 . 19518 1 1821 . 1 1 158 158 ILE HG22 H 1 0.833 0.014 . 1 . . . . . 158 ILE HG22 . 19518 1 1822 . 1 1 158 158 ILE HG23 H 1 0.833 0.014 . 1 . . . . . 158 ILE HG23 . 19518 1 1823 . 1 1 158 158 ILE HD11 H 1 0.917 0.001 . 1 . . . . . 158 ILE HD11 . 19518 1 1824 . 1 1 158 158 ILE HD12 H 1 0.917 0.001 . 1 . . . . . 158 ILE HD12 . 19518 1 1825 . 1 1 158 158 ILE HD13 H 1 0.917 0.001 . 1 . . . . . 158 ILE HD13 . 19518 1 1826 . 1 1 158 158 ILE C C 13 179.108 0.000 . 1 . . . . . 158 ILE C . 19518 1 1827 . 1 1 158 158 ILE CA C 13 64.649 0.074 . 1 . . . . . 158 ILE CA . 19518 1 1828 . 1 1 158 158 ILE CB C 13 37.145 0.153 . 1 . . . . . 158 ILE CB . 19518 1 1829 . 1 1 158 158 ILE CG1 C 13 29.344 0.000 . 1 . . . . . 158 ILE CG1 . 19518 1 1830 . 1 1 158 158 ILE CG2 C 13 17.934 0.048 . 1 . . . . . 158 ILE CG2 . 19518 1 1831 . 1 1 158 158 ILE CD1 C 13 13.300 0.049 . 1 . . . . . 158 ILE CD1 . 19518 1 1832 . 1 1 158 158 ILE N N 15 120.260 0.079 . 1 . . . . . 158 ILE N . 19518 1 1833 . 1 1 159 159 ILE H H 1 7.974 0.003 . 1 . . . . . 159 ILE H . 19518 1 1834 . 1 1 159 159 ILE HA H 1 3.556 0.007 . 1 . . . . . 159 ILE HA . 19518 1 1835 . 1 1 159 159 ILE HB H 1 1.739 0.009 . 1 . . . . . 159 ILE HB . 19518 1 1836 . 1 1 159 159 ILE HG12 H 1 0.489 0.015 . 1 . . . . . 159 ILE HG12 . 19518 1 1837 . 1 1 159 159 ILE HG13 H 1 0.690 0.003 . 1 . . . . . 159 ILE HG13 . 19518 1 1838 . 1 1 159 159 ILE HG21 H 1 0.505 0.006 . 1 . . . . . 159 ILE HG21 . 19518 1 1839 . 1 1 159 159 ILE HG22 H 1 0.505 0.006 . 1 . . . . . 159 ILE HG22 . 19518 1 1840 . 1 1 159 159 ILE HG23 H 1 0.505 0.006 . 1 . . . . . 159 ILE HG23 . 19518 1 1841 . 1 1 159 159 ILE HD11 H 1 0.516 0.005 . 1 . . . . . 159 ILE HD11 . 19518 1 1842 . 1 1 159 159 ILE HD12 H 1 0.516 0.005 . 1 . . . . . 159 ILE HD12 . 19518 1 1843 . 1 1 159 159 ILE HD13 H 1 0.516 0.005 . 1 . . . . . 159 ILE HD13 . 19518 1 1844 . 1 1 159 159 ILE C C 13 177.086 0.000 . 1 . . . . . 159 ILE C . 19518 1 1845 . 1 1 159 159 ILE CA C 13 65.327 0.000 . 1 . . . . . 159 ILE CA . 19518 1 1846 . 1 1 159 159 ILE CB C 13 37.482 0.148 . 1 . . . . . 159 ILE CB . 19518 1 1847 . 1 1 159 159 ILE CG1 C 13 27.463 0.072 . 1 . . . . . 159 ILE CG1 . 19518 1 1848 . 1 1 159 159 ILE CG2 C 13 17.089 0.066 . 1 . . . . . 159 ILE CG2 . 19518 1 1849 . 1 1 159 159 ILE CD1 C 13 14.163 0.034 . 1 . . . . . 159 ILE CD1 . 19518 1 1850 . 1 1 159 159 ILE N N 15 115.410 0.076 . 1 . . . . . 159 ILE N . 19518 1 1851 . 1 1 160 160 THR H H 1 7.434 0.012 . 1 . . . . . 160 THR H . 19518 1 1852 . 1 1 160 160 THR HA H 1 4.196 0.011 . 1 . . . . . 160 THR HA . 19518 1 1853 . 1 1 160 160 THR HB H 1 4.126 0.005 . 1 . . . . . 160 THR HB . 19518 1 1854 . 1 1 160 160 THR HG21 H 1 1.091 0.009 . 1 . . . . . 160 THR HG21 . 19518 1 1855 . 1 1 160 160 THR HG22 H 1 1.091 0.009 . 1 . . . . . 160 THR HG22 . 19518 1 1856 . 1 1 160 160 THR HG23 H 1 1.091 0.009 . 1 . . . . . 160 THR HG23 . 19518 1 1857 . 1 1 160 160 THR C C 13 175.888 0.000 . 1 . . . . . 160 THR C . 19518 1 1858 . 1 1 160 160 THR CA C 13 63.065 0.165 . 1 . . . . . 160 THR CA . 19518 1 1859 . 1 1 160 160 THR CB C 13 70.573 0.049 . 1 . . . . . 160 THR CB . 19518 1 1860 . 1 1 160 160 THR CG2 C 13 23.038 0.044 . 1 . . . . . 160 THR CG2 . 19518 1 1861 . 1 1 160 160 THR N N 15 106.299 0.138 . 1 . . . . . 160 THR N . 19518 1 1862 . 1 1 161 161 HIS H H 1 8.135 0.008 . 1 . . . . . 161 HIS H . 19518 1 1863 . 1 1 161 161 HIS HA H 1 4.499 0.002 . 1 . . . . . 161 HIS HA . 19518 1 1864 . 1 1 161 161 HIS HB2 H 1 3.070 0.001 . 1 . . . . . 161 HIS HB2 . 19518 1 1865 . 1 1 161 161 HIS HB3 H 1 3.070 0.001 . 1 . . . . . 161 HIS HB3 . 19518 1 1866 . 1 1 161 161 HIS HD2 H 1 7.116 0.000 . 1 . . . . . 161 HIS HD2 . 19518 1 1867 . 1 1 161 161 HIS C C 13 175.421 0.000 . 1 . . . . . 161 HIS C . 19518 1 1868 . 1 1 161 161 HIS CA C 13 57.027 0.096 . 1 . . . . . 161 HIS CA . 19518 1 1869 . 1 1 161 161 HIS CB C 13 28.954 0.053 . 1 . . . . . 161 HIS CB . 19518 1 1870 . 1 1 161 161 HIS N N 15 119.484 0.076 . 1 . . . . . 161 HIS N . 19518 1 1871 . 1 1 162 162 GLY H H 1 8.340 0.005 . 1 . . . . . 162 GLY H . 19518 1 1872 . 1 1 162 162 GLY HA2 H 1 4.030 0.006 . 1 . . . . . 162 GLY HA2 . 19518 1 1873 . 1 1 162 162 GLY HA3 H 1 3.864 0.009 . 1 . . . . . 162 GLY HA3 . 19518 1 1874 . 1 1 162 162 GLY C C 13 173.345 0.000 . 1 . . . . . 162 GLY C . 19518 1 1875 . 1 1 162 162 GLY CA C 13 45.345 0.098 . 1 . . . . . 162 GLY CA . 19518 1 1876 . 1 1 162 162 GLY N N 15 110.520 0.037 . 1 . . . . . 162 GLY N . 19518 1 1877 . 1 1 163 163 GLU H H 1 8.455 0.005 . 1 . . . . . 163 GLU H . 19518 1 1878 . 1 1 163 163 GLU HA H 1 4.295 0.016 . 1 . . . . . 163 GLU HA . 19518 1 1879 . 1 1 163 163 GLU HB2 H 1 2.024 0.014 . 1 . . . . . 163 GLU HB2 . 19518 1 1880 . 1 1 163 163 GLU HB3 H 1 1.898 0.006 . 1 . . . . . 163 GLU HB3 . 19518 1 1881 . 1 1 163 163 GLU HG2 H 1 2.211 0.019 . 1 . . . . . 163 GLU HG2 . 19518 1 1882 . 1 1 163 163 GLU HG3 H 1 2.238 0.009 . 1 . . . . . 163 GLU HG3 . 19518 1 1883 . 1 1 163 163 GLU C C 13 176.606 0.000 . 1 . . . . . 163 GLU C . 19518 1 1884 . 1 1 163 163 GLU CA C 13 56.517 0.050 . 1 . . . . . 163 GLU CA . 19518 1 1885 . 1 1 163 163 GLU CB C 13 30.390 0.138 . 1 . . . . . 163 GLU CB . 19518 1 1886 . 1 1 163 163 GLU CG C 13 36.789 0.000 . 1 . . . . . 163 GLU CG . 19518 1 1887 . 1 1 163 163 GLU N N 15 118.509 0.076 . 1 . . . . . 163 GLU N . 19518 1 1888 . 1 1 164 164 GLU H H 1 8.467 0.011 . 1 . . . . . 164 GLU H . 19518 1 1889 . 1 1 164 164 GLU HA H 1 4.231 0.002 . 1 . . . . . 164 GLU HA . 19518 1 1890 . 1 1 164 164 GLU HB2 H 1 1.911 0.006 . 1 . . . . . 164 GLU HB2 . 19518 1 1891 . 1 1 164 164 GLU HB3 H 1 2.008 0.011 . 1 . . . . . 164 GLU HB3 . 19518 1 1892 . 1 1 164 164 GLU HG2 H 1 2.208 0.011 . 1 . . . . . 164 GLU HG2 . 19518 1 1893 . 1 1 164 164 GLU HG3 H 1 2.222 0.015 . 1 . . . . . 164 GLU HG3 . 19518 1 1894 . 1 1 164 164 GLU C C 13 176.304 0.000 . 1 . . . . . 164 GLU C . 19518 1 1895 . 1 1 164 164 GLU CA C 13 56.616 0.098 . 1 . . . . . 164 GLU CA . 19518 1 1896 . 1 1 164 164 GLU CB C 13 29.969 0.038 . 1 . . . . . 164 GLU CB . 19518 1 1897 . 1 1 164 164 GLU CG C 13 36.602 0.000 . 1 . . . . . 164 GLU CG . 19518 1 1898 . 1 1 164 164 GLU N N 15 122.050 0.051 . 1 . . . . . 164 GLU N . 19518 1 1899 . 1 1 165 165 LYS H H 1 8.246 0.006 . 1 . . . . . 165 LYS H . 19518 1 1900 . 1 1 165 165 LYS HA H 1 4.241 0.016 . 1 . . . . . 165 LYS HA . 19518 1 1901 . 1 1 165 165 LYS HB2 H 1 1.613 0.015 . 1 . . . . . 165 LYS HB2 . 19518 1 1902 . 1 1 165 165 LYS HB3 H 1 1.748 0.006 . 1 . . . . . 165 LYS HB3 . 19518 1 1903 . 1 1 165 165 LYS HG2 H 1 1.311 0.005 . 1 . . . . . 165 LYS HG2 . 19518 1 1904 . 1 1 165 165 LYS HG3 H 1 1.311 0.005 . 1 . . . . . 165 LYS HG3 . 19518 1 1905 . 1 1 165 165 LYS HD2 H 1 1.558 0.003 . 1 . . . . . 165 LYS HD2 . 19518 1 1906 . 1 1 165 165 LYS HD3 H 1 1.558 0.003 . 1 . . . . . 165 LYS HD3 . 19518 1 1907 . 1 1 165 165 LYS HE2 H 1 2.867 0.008 . 1 . . . . . 165 LYS HE2 . 19518 1 1908 . 1 1 165 165 LYS HE3 H 1 2.867 0.008 . 1 . . . . . 165 LYS HE3 . 19518 1 1909 . 1 1 165 165 LYS C C 13 175.353 0.000 . 1 . . . . . 165 LYS C . 19518 1 1910 . 1 1 165 165 LYS CA C 13 56.246 0.013 . 1 . . . . . 165 LYS CA . 19518 1 1911 . 1 1 165 165 LYS CB C 13 33.020 0.039 . 1 . . . . . 165 LYS CB . 19518 1 1912 . 1 1 165 165 LYS CG C 13 24.699 0.027 . 1 . . . . . 165 LYS CG . 19518 1 1913 . 1 1 165 165 LYS CD C 13 28.932 0.020 . 1 . . . . . 165 LYS CD . 19518 1 1914 . 1 1 165 165 LYS N N 15 122.420 0.047 . 1 . . . . . 165 LYS N . 19518 1 1915 . 1 1 166 166 ASP H H 1 7.920 0.005 . 1 . . . . . 166 ASP H . 19518 1 1916 . 1 1 166 166 ASP HA H 1 4.260 0.002 . 1 . . . . . 166 ASP HA . 19518 1 1917 . 1 1 166 166 ASP HB2 H 1 2.453 0.006 . 1 . . . . . 166 ASP HB2 . 19518 1 1918 . 1 1 166 166 ASP HB3 H 1 2.453 0.006 . 1 . . . . . 166 ASP HB3 . 19518 1 1919 . 1 1 166 166 ASP CA C 13 56.026 0.026 . 1 . . . . . 166 ASP CA . 19518 1 1920 . 1 1 166 166 ASP CB C 13 41.990 0.014 . 1 . . . . . 166 ASP CB . 19518 1 1921 . 1 1 166 166 ASP N N 15 127.040 0.068 . 1 . . . . . 166 ASP N . 19518 1 stop_ save_ save_HCassignment _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode HCassignment _Assigned_chem_shift_list.Entry_ID 19518 _Assigned_chem_shift_list.ID 2 _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 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.15 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 'averaging over spectra' _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 19518 2 2 '3D 1H-15N NOESY' . . . 19518 2 5 '3D 1H-13C NOESY aliphatic' . . . 19518 2 7 '3D 1H-13C NOESY aromatic' . . . 19518 2 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 2 1 1 GLU H H 1 8.306 0.010 . 1 . . . . . 806 GLU H . 19518 2 2 . 2 2 1 1 GLU HA H 1 4.064 0.008 . 1 . . . . . 806 GLU HA . 19518 2 3 . 2 2 1 1 GLU HB2 H 1 1.891 0.009 . 1 . . . . . 806 GLU HB2 . 19518 2 4 . 2 2 1 1 GLU HB3 H 1 1.891 0.009 . 1 . . . . . 806 GLU HB3 . 19518 2 5 . 2 2 1 1 GLU HG2 H 1 2.125 0.007 . 1 . . . . . 806 GLU HG2 . 19518 2 6 . 2 2 1 1 GLU HG3 H 1 2.125 0.007 . 1 . . . . . 806 GLU HG3 . 19518 2 7 . 2 2 1 1 GLU C C 13 179.124 0.000 . 1 . . . . . 806 GLU C . 19518 2 8 . 2 2 1 1 GLU CA C 13 59.208 0.106 . 1 . . . . . 806 GLU CA . 19518 2 9 . 2 2 1 1 GLU CB C 13 29.118 0.023 . 1 . . . . . 806 GLU CB . 19518 2 10 . 2 2 1 1 GLU CG C 13 36.522 0.022 . 1 . . . . . 806 GLU CG . 19518 2 11 . 2 2 1 1 GLU N N 15 122.514 0.093 . 1 . . . . . 806 GLU N . 19518 2 12 . 2 2 2 2 ARG H H 1 8.223 0.005 . 1 . . . . . 807 ARG H . 19518 2 13 . 2 2 2 2 ARG HA H 1 3.765 0.005 . 1 . . . . . 807 ARG HA . 19518 2 14 . 2 2 2 2 ARG HB2 H 1 1.703 0.002 . 1 . . . . . 807 ARG HB2 . 19518 2 15 . 2 2 2 2 ARG HB3 H 1 1.703 0.002 . 1 . . . . . 807 ARG HB3 . 19518 2 16 . 2 2 2 2 ARG HG2 H 1 1.494 0.001 . 1 . . . . . 807 ARG HG2 . 19518 2 17 . 2 2 2 2 ARG HG3 H 1 1.494 0.001 . 1 . . . . . 807 ARG HG3 . 19518 2 18 . 2 2 2 2 ARG HD2 H 1 2.727 0.004 . 1 . . . . . 807 ARG HD2 . 19518 2 19 . 2 2 2 2 ARG HD3 H 1 3.079 0.002 . 1 . . . . . 807 ARG HD3 . 19518 2 20 . 2 2 2 2 ARG HE H 1 7.827 0.008 . 1 . . . . . 807 ARG HE . 19518 2 21 . 2 2 2 2 ARG C C 13 177.355 0.000 . 1 . . . . . 807 ARG C . 19518 2 22 . 2 2 2 2 ARG CA C 13 59.719 0.069 . 1 . . . . . 807 ARG CA . 19518 2 23 . 2 2 2 2 ARG CB C 13 29.574 0.114 . 1 . . . . . 807 ARG CB . 19518 2 24 . 2 2 2 2 ARG CG C 13 26.633 0.023 . 1 . . . . . 807 ARG CG . 19518 2 25 . 2 2 2 2 ARG CD C 13 43.248 0.006 . 1 . . . . . 807 ARG CD . 19518 2 26 . 2 2 2 2 ARG N N 15 121.009 0.086 . 1 . . . . . 807 ARG N . 19518 2 27 . 2 2 2 2 ARG NE N 15 87.94 0.085 . 1 . . . . . 807 ARG NE . 19518 2 28 . 2 2 3 3 ARG H H 1 7.920 0.007 . 1 . . . . . 808 ARG H . 19518 2 29 . 2 2 3 3 ARG HA H 1 3.844 0.009 . 1 . . . . . 808 ARG HA . 19518 2 30 . 2 2 3 3 ARG HB2 H 1 1.810 0.005 . 1 . . . . . 808 ARG HB2 . 19518 2 31 . 2 2 3 3 ARG HB3 H 1 1.810 0.005 . 1 . . . . . 808 ARG HB3 . 19518 2 32 . 2 2 3 3 ARG HG2 H 1 1.634 0.001 . 1 . . . . . 808 ARG HG2 . 19518 2 33 . 2 2 3 3 ARG HG3 H 1 1.634 0.001 . 1 . . . . . 808 ARG HG3 . 19518 2 34 . 2 2 3 3 ARG HD2 H 1 3.123 0.010 . 1 . . . . . 808 ARG HD2 . 19518 2 35 . 2 2 3 3 ARG HD3 H 1 3.123 0.010 . 1 . . . . . 808 ARG HD3 . 19518 2 36 . 2 2 3 3 ARG C C 13 177.778 0.000 . 1 . . . . . 808 ARG C . 19518 2 37 . 2 2 3 3 ARG CA C 13 59.784 0.048 . 1 . . . . . 808 ARG CA . 19518 2 38 . 2 2 3 3 ARG CB C 13 29.364 0.087 . 1 . . . . . 808 ARG CB . 19518 2 39 . 2 2 3 3 ARG CG C 13 27.484 0.000 . 1 . . . . . 808 ARG CG . 19518 2 40 . 2 2 3 3 ARG CD C 13 42.945 0.000 . 1 . . . . . 808 ARG CD . 19518 2 41 . 2 2 3 3 ARG N N 15 121.007 0.054 . 1 . . . . . 808 ARG N . 19518 2 42 . 2 2 4 4 ASP H H 1 8.413 0.004 . 1 . . . . . 809 ASP H . 19518 2 43 . 2 2 4 4 ASP HA H 1 4.231 0.004 . 1 . . . . . 809 ASP HA . 19518 2 44 . 2 2 4 4 ASP HB2 H 1 2.540 0.013 . 1 . . . . . 809 ASP HB2 . 19518 2 45 . 2 2 4 4 ASP HB3 H 1 2.540 0.013 . 1 . . . . . 809 ASP HB3 . 19518 2 46 . 2 2 4 4 ASP C C 13 179.407 0.000 . 1 . . . . . 809 ASP C . 19518 2 47 . 2 2 4 4 ASP CA C 13 57.528 0.140 . 1 . . . . . 809 ASP CA . 19518 2 48 . 2 2 4 4 ASP CB C 13 39.718 0.084 . 1 . . . . . 809 ASP CB . 19518 2 49 . 2 2 4 4 ASP N N 15 118.295 0.055 . 1 . . . . . 809 ASP N . 19518 2 50 . 2 2 5 5 SER H H 1 7.849 0.009 . 1 . . . . . 810 SER H . 19518 2 51 . 2 2 5 5 SER HA H 1 4.071 0.010 . 1 . . . . . 810 SER HA . 19518 2 52 . 2 2 5 5 SER HB2 H 1 3.906 0.015 . 1 . . . . . 810 SER HB2 . 19518 2 53 . 2 2 5 5 SER HB3 H 1 3.753 0.023 . 1 . . . . . 810 SER HB3 . 19518 2 54 . 2 2 5 5 SER C C 13 175.585 0.000 . 1 . . . . . 810 SER C . 19518 2 55 . 2 2 5 5 SER CA C 13 62.631 0.044 . 1 . . . . . 810 SER CA . 19518 2 56 . 2 2 5 5 SER CB C 13 62.742 0.000 . 1 . . . . . 810 SER CB . 19518 2 57 . 2 2 5 5 SER N N 15 116.708 0.056 . 1 . . . . . 810 SER N . 19518 2 58 . 2 2 6 6 LEU H H 1 8.125 0.005 . 1 . . . . . 811 LEU H . 19518 2 59 . 2 2 6 6 LEU HA H 1 3.686 0.012 . 1 . . . . . 811 LEU HA . 19518 2 60 . 2 2 6 6 LEU HB2 H 1 1.373 0.007 . 1 . . . . . 811 LEU HB2 . 19518 2 61 . 2 2 6 6 LEU HB3 H 1 1.568 0.025 . 1 . . . . . 811 LEU HB3 . 19518 2 62 . 2 2 6 6 LEU HG H 1 1.360 0.000 . 1 . . . . . 811 LEU HG . 19518 2 63 . 2 2 6 6 LEU HD11 H 1 0.416 0.011 . 1 . . . . . 811 LEU HD11 . 19518 2 64 . 2 2 6 6 LEU HD12 H 1 0.416 0.011 . 1 . . . . . 811 LEU HD12 . 19518 2 65 . 2 2 6 6 LEU HD13 H 1 0.416 0.011 . 1 . . . . . 811 LEU HD13 . 19518 2 66 . 2 2 6 6 LEU HD21 H 1 0.439 0.008 . 1 . . . . . 811 LEU HD21 . 19518 2 67 . 2 2 6 6 LEU HD22 H 1 0.439 0.008 . 1 . . . . . 811 LEU HD22 . 19518 2 68 . 2 2 6 6 LEU HD23 H 1 0.439 0.008 . 1 . . . . . 811 LEU HD23 . 19518 2 69 . 2 2 6 6 LEU C C 13 178.324 0.000 . 1 . . . . . 811 LEU C . 19518 2 70 . 2 2 6 6 LEU CA C 13 57.850 0.039 . 1 . . . . . 811 LEU CA . 19518 2 71 . 2 2 6 6 LEU CB C 13 41.221 0.300 . 1 . . . . . 811 LEU CB . 19518 2 72 . 2 2 6 6 LEU CG C 13 26.919 0.005 . 1 . . . . . 811 LEU CG . 19518 2 73 . 2 2 6 6 LEU CD1 C 13 25.864 0.013 . 1 . . . . . 811 LEU CD1 . 19518 2 74 . 2 2 6 6 LEU CD2 C 13 24.368 0.048 . 1 . . . . . 811 LEU CD2 . 19518 2 75 . 2 2 6 6 LEU N N 15 123.400 0.084 . 1 . . . . . 811 LEU N . 19518 2 76 . 2 2 7 7 LEU H H 1 7.998 0.006 . 1 . . . . . 812 LEU H . 19518 2 77 . 2 2 7 7 LEU HA H 1 4.158 0.006 . 1 . . . . . 812 LEU HA . 19518 2 78 . 2 2 7 7 LEU HB2 H 1 1.821 0.010 . 1 . . . . . 812 LEU HB2 . 19518 2 79 . 2 2 7 7 LEU HB3 H 1 1.821 0.010 . 1 . . . . . 812 LEU HB3 . 19518 2 80 . 2 2 7 7 LEU HG H 1 1.659 0.000 . 1 . . . . . 812 LEU HG . 19518 2 81 . 2 2 7 7 LEU HD11 H 1 0.937 0.006 . 1 . . . . . 812 LEU HD11 . 19518 2 82 . 2 2 7 7 LEU HD12 H 1 0.937 0.006 . 1 . . . . . 812 LEU HD12 . 19518 2 83 . 2 2 7 7 LEU HD13 H 1 0.937 0.006 . 1 . . . . . 812 LEU HD13 . 19518 2 84 . 2 2 7 7 LEU C C 13 180.124 0.000 . 1 . . . . . 812 LEU C . 19518 2 85 . 2 2 7 7 LEU CA C 13 58.044 0.090 . 1 . . . . . 812 LEU CA . 19518 2 86 . 2 2 7 7 LEU CB C 13 41.446 0.114 . 1 . . . . . 812 LEU CB . 19518 2 87 . 2 2 7 7 LEU CG C 13 27.047 0.000 . 1 . . . . . 812 LEU CG . 19518 2 88 . 2 2 7 7 LEU CD1 C 13 24.767 0.018 . 1 . . . . . 812 LEU CD1 . 19518 2 89 . 2 2 7 7 LEU N N 15 118.909 0.050 . 1 . . . . . 812 LEU N . 19518 2 90 . 2 2 8 8 VAL H H 1 7.203 0.010 . 1 . . . . . 813 VAL H . 19518 2 91 . 2 2 8 8 VAL HA H 1 3.614 0.019 . 1 . . . . . 813 VAL HA . 19518 2 92 . 2 2 8 8 VAL HB H 1 2.179 0.003 . 1 . . . . . 813 VAL HB . 19518 2 93 . 2 2 8 8 VAL HG11 H 1 0.942 0.004 . 1 . . . . . 813 VAL HG11 . 19518 2 94 . 2 2 8 8 VAL HG12 H 1 0.942 0.004 . 1 . . . . . 813 VAL HG12 . 19518 2 95 . 2 2 8 8 VAL HG13 H 1 0.942 0.004 . 1 . . . . . 813 VAL HG13 . 19518 2 96 . 2 2 8 8 VAL HG21 H 1 0.712 0.005 . 1 . . . . . 813 VAL HG21 . 19518 2 97 . 2 2 8 8 VAL HG22 H 1 0.712 0.005 . 1 . . . . . 813 VAL HG22 . 19518 2 98 . 2 2 8 8 VAL HG23 H 1 0.712 0.005 . 1 . . . . . 813 VAL HG23 . 19518 2 99 . 2 2 8 8 VAL C C 13 179.834 0.000 . 1 . . . . . 813 VAL C . 19518 2 100 . 2 2 8 8 VAL CA C 13 66.613 0.064 . 1 . . . . . 813 VAL CA . 19518 2 101 . 2 2 8 8 VAL CB C 13 31.978 0.181 . 1 . . . . . 813 VAL CB . 19518 2 102 . 2 2 8 8 VAL CG1 C 13 22.520 0.018 . 1 . . . . . 813 VAL CG1 . 19518 2 103 . 2 2 8 8 VAL CG2 C 13 21.922 0.051 . 1 . . . . . 813 VAL CG2 . 19518 2 104 . 2 2 8 8 VAL N N 15 119.226 0.077 . 1 . . . . . 813 VAL N . 19518 2 105 . 2 2 9 9 ILE H H 1 7.654 0.005 . 1 . . . . . 814 ILE H . 19518 2 106 . 2 2 9 9 ILE HA H 1 3.081 0.012 . 1 . . . . . 814 ILE HA . 19518 2 107 . 2 2 9 9 ILE HB H 1 1.505 0.020 . 1 . . . . . 814 ILE HB . 19518 2 108 . 2 2 9 9 ILE HG12 H 1 0.259 0.001 . 1 . . . . . 814 ILE HG12 . 19518 2 109 . 2 2 9 9 ILE HG21 H 1 0.264 0.004 . 1 . . . . . 814 ILE HG21 . 19518 2 110 . 2 2 9 9 ILE HG22 H 1 0.264 0.004 . 1 . . . . . 814 ILE HG22 . 19518 2 111 . 2 2 9 9 ILE HG23 H 1 0.264 0.004 . 1 . . . . . 814 ILE HG23 . 19518 2 112 . 2 2 9 9 ILE HD11 H 1 -0.327 0.009 . 1 . . . . . 814 ILE HD11 . 19518 2 113 . 2 2 9 9 ILE HD12 H 1 -0.327 0.009 . 1 . . . . . 814 ILE HD12 . 19518 2 114 . 2 2 9 9 ILE HD13 H 1 -0.327 0.009 . 1 . . . . . 814 ILE HD13 . 19518 2 115 . 2 2 9 9 ILE C C 13 177.143 0.000 . 1 . . . . . 814 ILE C . 19518 2 116 . 2 2 9 9 ILE CA C 13 67.270 0.088 . 1 . . . . . 814 ILE CA . 19518 2 117 . 2 2 9 9 ILE CB C 13 38.350 0.167 . 1 . . . . . 814 ILE CB . 19518 2 118 . 2 2 9 9 ILE CG2 C 13 17.917 0.049 . 1 . . . . . 814 ILE CG2 . 19518 2 119 . 2 2 9 9 ILE CD1 C 13 12.948 0.013 . 1 . . . . . 814 ILE CD1 . 19518 2 120 . 2 2 9 9 ILE N N 15 123.472 0.087 . 1 . . . . . 814 ILE N . 19518 2 121 . 2 2 10 10 GLN H H 1 8.909 0.005 . 1 . . . . . 815 GLN H . 19518 2 122 . 2 2 10 10 GLN HA H 1 3.690 0.009 . 1 . . . . . 815 GLN HA . 19518 2 123 . 2 2 10 10 GLN HB2 H 1 1.949 0.005 . 1 . . . . . 815 GLN HB2 . 19518 2 124 . 2 2 10 10 GLN HG2 H 1 2.494 0.008 . 1 . . . . . 815 GLN HG2 . 19518 2 125 . 2 2 10 10 GLN HG3 H 1 2.122 0.006 . 1 . . . . . 815 GLN HG3 . 19518 2 126 . 2 2 10 10 GLN HE21 H 1 6.654 0.005 . 1 . . . . . 815 GLN HE21 . 19518 2 127 . 2 2 10 10 GLN HE22 H 1 5.456 0.006 . 1 . . . . . 815 GLN HE22 . 19518 2 128 . 2 2 10 10 GLN C C 13 178.472 0.000 . 1 . . . . . 815 GLN C . 19518 2 129 . 2 2 10 10 GLN CA C 13 59.298 0.125 . 1 . . . . . 815 GLN CA . 19518 2 130 . 2 2 10 10 GLN CB C 13 28.019 0.073 . 1 . . . . . 815 GLN CB . 19518 2 131 . 2 2 10 10 GLN N N 15 117.214 0.057 . 1 . . . . . 815 GLN N . 19518 2 132 . 2 2 10 10 GLN NE2 N 15 103.754 0.120 . 1 . . . . . 815 GLN NE2 . 19518 2 133 . 2 2 11 11 TRP H H 1 8.625 0.008 . 1 . . . . . 816 TRP H . 19518 2 134 . 2 2 11 11 TRP HA H 1 4.194 0.006 . 1 . . . . . 816 TRP HA . 19518 2 135 . 2 2 11 11 TRP HB2 H 1 3.567 0.011 . 1 . . . . . 816 TRP HB2 . 19518 2 136 . 2 2 11 11 TRP HB3 H 1 3.194 0.007 . 1 . . . . . 816 TRP HB3 . 19518 2 137 . 2 2 11 11 TRP HD1 H 1 7.078 0.018 . 1 . . . . . 816 TRP HD1 . 19518 2 138 . 2 2 11 11 TRP HE1 H 1 10.054 0.010 . 1 . . . . . 816 TRP HE1 . 19518 2 139 . 2 2 11 11 TRP HZ2 H 1 7.328 0.014 . 1 . . . . . 816 TRP HZ2 . 19518 2 140 . 2 2 11 11 TRP HH2 H 1 7.049 0.020 . 1 . . . . . 816 TRP HH2 . 19518 2 141 . 2 2 11 11 TRP C C 13 179.654 0.000 . 1 . . . . . 816 TRP C . 19518 2 142 . 2 2 11 11 TRP CA C 13 61.340 0.114 . 1 . . . . . 816 TRP CA . 19518 2 143 . 2 2 11 11 TRP CB C 13 29.327 0.163 . 1 . . . . . 816 TRP CB . 19518 2 144 . 2 2 11 11 TRP CD1 C 13 127.094 0.000 . 1 . . . . . 816 TRP CD1 . 19518 2 145 . 2 2 11 11 TRP CZ2 C 13 114.708 0.069 . 1 . . . . . 816 TRP CZ2 . 19518 2 146 . 2 2 11 11 TRP CH2 C 13 124.863 0.123 . 1 . . . . . 816 TRP CH2 . 19518 2 147 . 2 2 11 11 TRP N N 15 117.889 2.050 . 1 . . . . . 816 TRP N . 19518 2 148 . 2 2 11 11 TRP NE1 N 15 129.421 0.084 . 1 . . . . . 816 TRP NE1 . 19518 2 149 . 2 2 12 12 ASN H H 1 8.085 0.011 . 1 . . . . . 817 ASN H . 19518 2 150 . 2 2 12 12 ASN HA H 1 4.367 0.011 . 1 . . . . . 817 ASN HA . 19518 2 151 . 2 2 12 12 ASN HB2 H 1 2.751 0.027 . 1 . . . . . 817 ASN HB2 . 19518 2 152 . 2 2 12 12 ASN C C 13 178.331 0.000 . 1 . . . . . 817 ASN C . 19518 2 153 . 2 2 12 12 ASN CA C 13 57.963 0.088 . 1 . . . . . 817 ASN CA . 19518 2 154 . 2 2 12 12 ASN CB C 13 40.056 0.188 . 1 . . . . . 817 ASN CB . 19518 2 155 . 2 2 12 12 ASN N N 15 115.508 0.057 . 1 . . . . . 817 ASN N . 19518 2 156 . 2 2 13 13 ILE H H 1 8.550 0.005 . 1 . . . . . 818 ILE H . 19518 2 157 . 2 2 13 13 ILE HA H 1 3.835 0.035 . 1 . . . . . 818 ILE HA . 19518 2 158 . 2 2 13 13 ILE HB H 1 2.070 0.010 . 1 . . . . . 818 ILE HB . 19518 2 159 . 2 2 13 13 ILE HG12 H 1 0.761 0.007 . 1 . . . . . 818 ILE HG12 . 19518 2 160 . 2 2 13 13 ILE HG13 H 1 0.176 0.003 . 1 . . . . . 818 ILE HG13 . 19518 2 161 . 2 2 13 13 ILE HG21 H 1 1.116 0.006 . 1 . . . . . 818 ILE HG21 . 19518 2 162 . 2 2 13 13 ILE HG22 H 1 1.116 0.006 . 1 . . . . . 818 ILE HG22 . 19518 2 163 . 2 2 13 13 ILE HG23 H 1 1.116 0.006 . 1 . . . . . 818 ILE HG23 . 19518 2 164 . 2 2 13 13 ILE HD11 H 1 1.873 0.000 . 1 . . . . . 818 ILE HD11 . 19518 2 165 . 2 2 13 13 ILE HD12 H 1 1.873 0.000 . 1 . . . . . 818 ILE HD12 . 19518 2 166 . 2 2 13 13 ILE HD13 H 1 0.739 0.005 . 1 . . . . . 818 ILE HD13 . 19518 2 167 . 2 2 13 13 ILE C C 13 177.940 0.000 . 1 . . . . . 818 ILE C . 19518 2 168 . 2 2 13 13 ILE CA C 13 66.353 0.132 . 1 . . . . . 818 ILE CA . 19518 2 169 . 2 2 13 13 ILE CB C 13 37.975 0.280 . 1 . . . . . 818 ILE CB . 19518 2 170 . 2 2 13 13 ILE CG1 C 13 26.814 0.308 . 1 . . . . . 818 ILE CG1 . 19518 2 171 . 2 2 13 13 ILE CG2 C 13 18.123 0.054 . 1 . . . . . 818 ILE CG2 . 19518 2 172 . 2 2 13 13 ILE CD1 C 13 14.052 0.055 . 1 . . . . . 818 ILE CD1 . 19518 2 173 . 2 2 13 13 ILE N N 15 120.762 0.045 . 1 . . . . . 818 ILE N . 19518 2 174 . 2 2 14 14 ARG H H 1 8.130 0.006 . 1 . . . . . 819 ARG H . 19518 2 175 . 2 2 14 14 ARG HA H 1 3.758 0.008 . 1 . . . . . 819 ARG HA . 19518 2 176 . 2 2 14 14 ARG HB2 H 1 1.713 0.016 . 1 . . . . . 819 ARG HB2 . 19518 2 177 . 2 2 14 14 ARG HB3 H 1 2.053 0.012 . 1 . . . . . 819 ARG HB3 . 19518 2 178 . 2 2 14 14 ARG HG2 H 1 1.110 0.003 . 1 . . . . . 819 ARG HG2 . 19518 2 179 . 2 2 14 14 ARG HG3 H 1 1.498 0.016 . 1 . . . . . 819 ARG HG3 . 19518 2 180 . 2 2 14 14 ARG HD2 H 1 3.010 0.001 . 1 . . . . . 819 ARG HD2 . 19518 2 181 . 2 2 14 14 ARG HD3 H 1 3.010 0.001 . 1 . . . . . 819 ARG HD3 . 19518 2 182 . 2 2 14 14 ARG C C 13 174.424 0.000 . 1 . . . . . 819 ARG C . 19518 2 183 . 2 2 14 14 ARG CA C 13 60.910 0.038 . 1 . . . . . 819 ARG CA . 19518 2 184 . 2 2 14 14 ARG CB C 13 29.711 0.076 . 1 . . . . . 819 ARG CB . 19518 2 185 . 2 2 14 14 ARG CG C 13 28.588 0.047 . 1 . . . . . 819 ARG CG . 19518 2 186 . 2 2 14 14 ARG CD C 13 43.453 0.000 . 1 . . . . . 819 ARG CD . 19518 2 187 . 2 2 14 14 ARG N N 15 119.292 0.060 . 1 . . . . . 819 ARG N . 19518 2 188 . 2 2 15 15 ALA H H 1 8.126 0.008 . 1 . . . . . 820 ALA H . 19518 2 189 . 2 2 15 15 ALA HA H 1 3.762 0.012 . 1 . . . . . 820 ALA HA . 19518 2 190 . 2 2 15 15 ALA HB1 H 1 0.978 0.002 . 1 . . . . . 820 ALA HB1 . 19518 2 191 . 2 2 15 15 ALA HB2 H 1 0.978 0.002 . 1 . . . . . 820 ALA HB2 . 19518 2 192 . 2 2 15 15 ALA HB3 H 1 0.978 0.002 . 1 . . . . . 820 ALA HB3 . 19518 2 193 . 2 2 15 15 ALA C C 13 180.132 0.000 . 1 . . . . . 820 ALA C . 19518 2 194 . 2 2 15 15 ALA CA C 13 55.113 0.093 . 1 . . . . . 820 ALA CA . 19518 2 195 . 2 2 15 15 ALA CB C 13 17.331 0.167 . 1 . . . . . 820 ALA CB . 19518 2 196 . 2 2 15 15 ALA N N 15 122.355 0.066 . 1 . . . . . 820 ALA N . 19518 2 197 . 2 2 16 16 PHE H H 1 7.562 0.004 . 1 . . . . . 821 PHE H . 19518 2 198 . 2 2 16 16 PHE HA H 1 4.315 0.012 . 1 . . . . . 821 PHE HA . 19518 2 199 . 2 2 16 16 PHE HB2 H 1 3.122 0.008 . 1 . . . . . 821 PHE HB2 . 19518 2 200 . 2 2 16 16 PHE HB3 H 1 3.418 0.015 . 1 . . . . . 821 PHE HB3 . 19518 2 201 . 2 2 16 16 PHE HD1 H 1 7.292 0.035 . 3 . . . . . 821 PHE HD1 . 19518 2 202 . 2 2 16 16 PHE HD2 H 1 7.292 0.035 . 3 . . . . . 821 PHE HD2 . 19518 2 203 . 2 2 16 16 PHE C C 13 177.827 0.000 . 1 . . . . . 821 PHE C . 19518 2 204 . 2 2 16 16 PHE CA C 13 61.264 0.089 . 1 . . . . . 821 PHE CA . 19518 2 205 . 2 2 16 16 PHE CB C 13 39.591 0.070 . 1 . . . . . 821 PHE CB . 19518 2 206 . 2 2 16 16 PHE CD1 C 13 132.459 0.000 . 3 . . . . . 821 PHE CD1 . 19518 2 207 . 2 2 16 16 PHE CD2 C 13 132.459 0.000 . 3 . . . . . 821 PHE CD2 . 19518 2 208 . 2 2 16 16 PHE N N 15 118.699 0.086 . 1 . . . . . 821 PHE N . 19518 2 209 . 2 2 17 17 MET H H 1 8.669 0.012 . 1 . . . . . 822 MET H . 19518 2 210 . 2 2 17 17 MET HA H 1 3.930 0.011 . 1 . . . . . 822 MET HA . 19518 2 211 . 2 2 17 17 MET HB2 H 1 2.059 0.006 . 1 . . . . . 822 MET HB2 . 19518 2 212 . 2 2 17 17 MET HB3 H 1 2.059 0.006 . 1 . . . . . 822 MET HB3 . 19518 2 213 . 2 2 17 17 MET HG2 H 1 3.039 0.004 . 1 . . . . . 822 MET HG2 . 19518 2 214 . 2 2 17 17 MET HG3 H 1 2.679 0.007 . 1 . . . . . 822 MET HG3 . 19518 2 215 . 2 2 17 17 MET HE1 H 1 1.914 0.004 . 1 . . . . . 822 MET HE1 . 19518 2 216 . 2 2 17 17 MET HE2 H 1 1.914 0.004 . 1 . . . . . 822 MET HE2 . 19518 2 217 . 2 2 17 17 MET HE3 H 1 1.914 0.004 . 1 . . . . . 822 MET HE3 . 19518 2 218 . 2 2 17 17 MET C C 13 178.917 0.000 . 1 . . . . . 822 MET C . 19518 2 219 . 2 2 17 17 MET CA C 13 57.504 0.096 . 1 . . . . . 822 MET CA . 19518 2 220 . 2 2 17 17 MET CB C 13 30.588 0.146 . 1 . . . . . 822 MET CB . 19518 2 221 . 2 2 17 17 MET CG C 13 32.087 0.044 . 1 . . . . . 822 MET CG . 19518 2 222 . 2 2 17 17 MET CE C 13 15.806 0.053 . 1 . . . . . 822 MET CE . 19518 2 223 . 2 2 17 17 MET N N 15 117.934 0.041 . 1 . . . . . 822 MET N . 19518 2 224 . 2 2 18 18 GLY H H 1 8.060 0.013 . 1 . . . . . 823 GLY H . 19518 2 225 . 2 2 18 18 GLY HA2 H 1 3.742 0.005 . 1 . . . . . 823 GLY HA2 . 19518 2 226 . 2 2 18 18 GLY HA3 H 1 3.742 0.005 . 1 . . . . . 823 GLY HA3 . 19518 2 227 . 2 2 18 18 GLY C C 13 175.793 0.000 . 1 . . . . . 823 GLY C . 19518 2 228 . 2 2 18 18 GLY CA C 13 46.410 0.041 . 1 . . . . . 823 GLY CA . 19518 2 229 . 2 2 18 18 GLY N N 15 105.621 0.033 . 1 . . . . . 823 GLY N . 19518 2 230 . 2 2 19 19 VAL H H 1 7.170 0.008 . 1 . . . . . 824 VAL H . 19518 2 231 . 2 2 19 19 VAL HA H 1 3.875 0.027 . 1 . . . . . 824 VAL HA . 19518 2 232 . 2 2 19 19 VAL HB H 1 2.126 0.005 . 1 . . . . . 824 VAL HB . 19518 2 233 . 2 2 19 19 VAL HG11 H 1 0.973 0.002 . 1 . . . . . 824 VAL HG11 . 19518 2 234 . 2 2 19 19 VAL HG12 H 1 0.973 0.002 . 1 . . . . . 824 VAL HG12 . 19518 2 235 . 2 2 19 19 VAL HG13 H 1 0.973 0.002 . 1 . . . . . 824 VAL HG13 . 19518 2 236 . 2 2 19 19 VAL HG21 H 1 0.973 0.002 . 1 . . . . . 824 VAL HG21 . 19518 2 237 . 2 2 19 19 VAL HG22 H 1 0.973 0.002 . 1 . . . . . 824 VAL HG22 . 19518 2 238 . 2 2 19 19 VAL HG23 H 1 0.973 0.002 . 1 . . . . . 824 VAL HG23 . 19518 2 239 . 2 2 19 19 VAL C C 13 177.249 0.000 . 1 . . . . . 824 VAL C . 19518 2 240 . 2 2 19 19 VAL CA C 13 64.801 0.078 . 1 . . . . . 824 VAL CA . 19518 2 241 . 2 2 19 19 VAL CB C 13 31.993 0.075 . 1 . . . . . 824 VAL CB . 19518 2 242 . 2 2 19 19 VAL CG1 C 13 22.977 0.049 . 1 . . . . . 824 VAL CG1 . 19518 2 243 . 2 2 19 19 VAL CG2 C 13 22.977 0.049 . 1 . . . . . 824 VAL CG2 . 19518 2 244 . 2 2 19 19 VAL N N 15 118.259 0.046 . 1 . . . . . 824 VAL N . 19518 2 245 . 2 2 20 20 LYS H H 1 7.474 0.005 . 1 . . . . . 825 LYS H . 19518 2 246 . 2 2 20 20 LYS HA H 1 3.794 0.004 . 1 . . . . . 825 LYS HA . 19518 2 247 . 2 2 20 20 LYS HB2 H 1 1.381 0.006 . 1 . . . . . 825 LYS HB2 . 19518 2 248 . 2 2 20 20 LYS HB3 H 1 1.381 0.006 . 1 . . . . . 825 LYS HB3 . 19518 2 249 . 2 2 20 20 LYS HG2 H 1 1.117 0.018 . 1 . . . . . 825 LYS HG2 . 19518 2 250 . 2 2 20 20 LYS HG3 H 1 1.117 0.018 . 1 . . . . . 825 LYS HG3 . 19518 2 251 . 2 2 20 20 LYS HD2 H 1 1.303 0.000 . 1 . . . . . 825 LYS HD2 . 19518 2 252 . 2 2 20 20 LYS HD3 H 1 1.303 0.000 . 1 . . . . . 825 LYS HD3 . 19518 2 253 . 2 2 20 20 LYS HE2 H 1 2.817 0.000 . 1 . . . . . 825 LYS HE2 . 19518 2 254 . 2 2 20 20 LYS HE3 H 1 2.817 0.000 . 1 . . . . . 825 LYS HE3 . 19518 2 255 . 2 2 20 20 LYS C C 13 177.225 0.000 . 1 . . . . . 825 LYS C . 19518 2 256 . 2 2 20 20 LYS CA C 13 58.615 0.028 . 1 . . . . . 825 LYS CA . 19518 2 257 . 2 2 20 20 LYS CB C 13 31.605 0.070 . 1 . . . . . 825 LYS CB . 19518 2 258 . 2 2 20 20 LYS CG C 13 24.067 0.020 . 1 . . . . . 825 LYS CG . 19518 2 259 . 2 2 20 20 LYS CD C 13 25.117 0.000 . 1 . . . . . 825 LYS CD . 19518 2 260 . 2 2 20 20 LYS N N 15 119.322 0.062 . 1 . . . . . 825 LYS N . 19518 2 261 . 2 2 21 21 ASN H H 1 7.671 0.011 . 1 . . . . . 826 ASN H . 19518 2 262 . 2 2 21 21 ASN HA H 1 4.721 0.031 . 1 . . . . . 826 ASN HA . 19518 2 263 . 2 2 21 21 ASN HB2 H 1 2.566 0.005 . 1 . . . . . 826 ASN HB2 . 19518 2 264 . 2 2 21 21 ASN HB3 H 1 2.885 0.021 . 1 . . . . . 826 ASN HB3 . 19518 2 265 . 2 2 21 21 ASN HD21 H 1 7.461 0.005 . 1 . . . . . 826 ASN HD21 . 19518 2 266 . 2 2 21 21 ASN HD22 H 1 6.866 0.007 . 1 . . . . . 826 ASN HD22 . 19518 2 267 . 2 2 21 21 ASN CA C 13 52.446 0.067 . 1 . . . . . 826 ASN CA . 19518 2 268 . 2 2 21 21 ASN CB C 13 39.228 0.045 . 1 . . . . . 826 ASN CB . 19518 2 269 . 2 2 21 21 ASN N N 15 112.320 0.053 . 1 . . . . . 826 ASN N . 19518 2 270 . 2 2 21 21 ASN ND2 N 15 113.408 0.091 . 1 . . . . . 826 ASN ND2 . 19518 2 271 . 2 2 22 22 TRP H H 1 7.626 0.005 . 1 . . . . . 827 TRP H . 19518 2 272 . 2 2 22 22 TRP HA H 1 5.164 0.011 . 1 . . . . . 827 TRP HA . 19518 2 273 . 2 2 22 22 TRP HB2 H 1 3.563 0.000 . 1 . . . . . 827 TRP HB2 . 19518 2 274 . 2 2 22 22 TRP HB3 H 1 3.455 0.000 . 1 . . . . . 827 TRP HB3 . 19518 2 275 . 2 2 22 22 TRP HD1 H 1 7.799 0.005 . 1 . . . . . 827 TRP HD1 . 19518 2 276 . 2 2 22 22 TRP HZ2 H 1 6.933 0.028 . 1 . . . . . 827 TRP HZ2 . 19518 2 277 . 2 2 22 22 TRP CA C 13 54.036 0.055 . 1 . . . . . 827 TRP CA . 19518 2 278 . 2 2 22 22 TRP CB C 13 28.827 0.000 . 1 . . . . . 827 TRP CB . 19518 2 279 . 2 2 22 22 TRP CD1 C 13 125.898 0.000 . 1 . . . . . 827 TRP CD1 . 19518 2 280 . 2 2 22 22 TRP CZ2 C 13 115.596 0.000 . 1 . . . . . 827 TRP CZ2 . 19518 2 281 . 2 2 22 22 TRP N N 15 125.717 0.064 . 1 . . . . . 827 TRP N . 19518 2 282 . 2 2 23 23 PRO HA H 1 3.934 0.004 . 1 . . . . . 828 PRO HA . 19518 2 283 . 2 2 23 23 PRO HB2 H 1 2.351 0.009 . 1 . . . . . 828 PRO HB2 . 19518 2 284 . 2 2 23 23 PRO HB3 H 1 2.351 0.009 . 1 . . . . . 828 PRO HB3 . 19518 2 285 . 2 2 23 23 PRO HG2 H 1 1.982 0.009 . 1 . . . . . 828 PRO HG2 . 19518 2 286 . 2 2 23 23 PRO HG3 H 1 1.982 0.009 . 1 . . . . . 828 PRO HG3 . 19518 2 287 . 2 2 23 23 PRO HD2 H 1 4.382 0.010 . 1 . . . . . 828 PRO HD2 . 19518 2 288 . 2 2 23 23 PRO HD3 H 1 4.097 0.009 . 1 . . . . . 828 PRO HD3 . 19518 2 289 . 2 2 23 23 PRO CA C 13 65.358 0.050 . 1 . . . . . 828 PRO CA . 19518 2 290 . 2 2 23 23 PRO CB C 13 32.849 0.045 . 1 . . . . . 828 PRO CB . 19518 2 291 . 2 2 23 23 PRO CG C 13 28.261 0.046 . 1 . . . . . 828 PRO CG . 19518 2 292 . 2 2 23 23 PRO CD C 13 52.208 0.029 . 1 . . . . . 828 PRO CD . 19518 2 293 . 2 2 24 24 TRP H H 1 7.140 0.007 . 1 . . . . . 829 TRP H . 19518 2 294 . 2 2 24 24 TRP HA H 1 4.835 0.005 . 1 . . . . . 829 TRP HA . 19518 2 295 . 2 2 24 24 TRP HB2 H 1 3.571 0.005 . 1 . . . . . 829 TRP HB2 . 19518 2 296 . 2 2 24 24 TRP HD1 H 1 6.762 0.039 . 1 . . . . . 829 TRP HD1 . 19518 2 297 . 2 2 24 24 TRP HE1 H 1 9.925 0.004 . 1 . . . . . 829 TRP HE1 . 19518 2 298 . 2 2 24 24 TRP HZ2 H 1 7.028 0.008 . 1 . . . . . 829 TRP HZ2 . 19518 2 299 . 2 2 24 24 TRP HH2 H 1 6.292 0.000 . 1 . . . . . 829 TRP HH2 . 19518 2 300 . 2 2 24 24 TRP C C 13 177.105 0.000 . 1 . . . . . 829 TRP C . 19518 2 301 . 2 2 24 24 TRP CA C 13 60.392 0.000 . 1 . . . . . 829 TRP CA . 19518 2 302 . 2 2 24 24 TRP CB C 13 27.112 0.000 . 1 . . . . . 829 TRP CB . 19518 2 303 . 2 2 24 24 TRP CD1 C 13 126.020 0.000 . 1 . . . . . 829 TRP CD1 . 19518 2 304 . 2 2 24 24 TRP CZ2 C 13 114.558 0.000 . 1 . . . . . 829 TRP CZ2 . 19518 2 305 . 2 2 24 24 TRP N N 15 114.304 0.078 . 1 . . . . . 829 TRP N . 19518 2 306 . 2 2 24 24 TRP NE1 N 15 128.722 0.091 . 1 . . . . . 829 TRP NE1 . 19518 2 307 . 2 2 25 25 MET H H 1 6.592 0.005 . 1 . . . . . 830 MET H . 19518 2 308 . 2 2 25 25 MET HA H 1 4.535 0.002 . 1 . . . . . 830 MET HA . 19518 2 309 . 2 2 25 25 MET HG2 H 1 2.270 0.019 . 1 . . . . . 830 MET HG2 . 19518 2 310 . 2 2 25 25 MET HG3 H 1 2.787 0.004 . 1 . . . . . 830 MET HG3 . 19518 2 311 . 2 2 25 25 MET HE1 H 1 1.991 0.001 . 1 . . . . . 830 MET HE1 . 19518 2 312 . 2 2 25 25 MET HE2 H 1 1.991 0.001 . 1 . . . . . 830 MET HE2 . 19518 2 313 . 2 2 25 25 MET HE3 H 1 1.991 0.001 . 1 . . . . . 830 MET HE3 . 19518 2 314 . 2 2 25 25 MET C C 13 177.562 0.000 . 1 . . . . . 830 MET C . 19518 2 315 . 2 2 25 25 MET CA C 13 56.658 0.066 . 1 . . . . . 830 MET CA . 19518 2 316 . 2 2 25 25 MET CB C 13 32.986 0.013 . 1 . . . . . 830 MET CB . 19518 2 317 . 2 2 25 25 MET CG C 13 33.500 0.000 . 1 . . . . . 830 MET CG . 19518 2 318 . 2 2 25 25 MET CE C 13 18.335 0.045 . 1 . . . . . 830 MET CE . 19518 2 319 . 2 2 25 25 MET N N 15 119.966 0.062 . 1 . . . . . 830 MET N . 19518 2 320 . 2 2 26 26 LYS H H 1 7.683 0.007 . 1 . . . . . 831 LYS H . 19518 2 321 . 2 2 26 26 LYS HA H 1 4.008 0.007 . 1 . . . . . 831 LYS HA . 19518 2 322 . 2 2 26 26 LYS HB2 H 1 1.740 0.005 . 1 . . . . . 831 LYS HB2 . 19518 2 323 . 2 2 26 26 LYS HB3 H 1 1.740 0.005 . 1 . . . . . 831 LYS HB3 . 19518 2 324 . 2 2 26 26 LYS HG2 H 1 1.599 0.004 . 1 . . . . . 831 LYS HG2 . 19518 2 325 . 2 2 26 26 LYS HG3 H 1 1.599 0.004 . 1 . . . . . 831 LYS HG3 . 19518 2 326 . 2 2 26 26 LYS C C 13 179.860 0.000 . 1 . . . . . 831 LYS C . 19518 2 327 . 2 2 26 26 LYS CA C 13 59.769 0.085 . 1 . . . . . 831 LYS CA . 19518 2 328 . 2 2 26 26 LYS CB C 13 31.760 0.149 . 1 . . . . . 831 LYS CB . 19518 2 329 . 2 2 26 26 LYS CG C 13 24.240 0.000 . 1 . . . . . 831 LYS CG . 19518 2 330 . 2 2 26 26 LYS N N 15 116.956 0.053 . 1 . . . . . 831 LYS N . 19518 2 331 . 2 2 27 27 LEU H H 1 7.445 0.006 . 1 . . . . . 832 LEU H . 19518 2 332 . 2 2 27 27 LEU HA H 1 4.009 0.006 . 1 . . . . . 832 LEU HA . 19518 2 333 . 2 2 27 27 LEU HB2 H 1 1.294 0.011 . 1 . . . . . 832 LEU HB2 . 19518 2 334 . 2 2 27 27 LEU HB3 H 1 1.631 0.011 . 1 . . . . . 832 LEU HB3 . 19518 2 335 . 2 2 27 27 LEU HG H 1 1.292 0.004 . 1 . . . . . 832 LEU HG . 19518 2 336 . 2 2 27 27 LEU HD11 H 1 0.314 0.008 . 1 . . . . . 832 LEU HD11 . 19518 2 337 . 2 2 27 27 LEU HD12 H 1 0.314 0.008 . 1 . . . . . 832 LEU HD12 . 19518 2 338 . 2 2 27 27 LEU HD13 H 1 0.314 0.008 . 1 . . . . . 832 LEU HD13 . 19518 2 339 . 2 2 27 27 LEU HD21 H 1 0.349 0.004 . 1 . . . . . 832 LEU HD21 . 19518 2 340 . 2 2 27 27 LEU HD22 H 1 0.349 0.004 . 1 . . . . . 832 LEU HD22 . 19518 2 341 . 2 2 27 27 LEU HD23 H 1 0.349 0.004 . 1 . . . . . 832 LEU HD23 . 19518 2 342 . 2 2 27 27 LEU C C 13 177.627 0.000 . 1 . . . . . 832 LEU C . 19518 2 343 . 2 2 27 27 LEU CA C 13 57.783 0.035 . 1 . . . . . 832 LEU CA . 19518 2 344 . 2 2 27 27 LEU CB C 13 40.845 0.064 . 1 . . . . . 832 LEU CB . 19518 2 345 . 2 2 27 27 LEU CG C 13 27.298 0.056 . 1 . . . . . 832 LEU CG . 19518 2 346 . 2 2 27 27 LEU CD1 C 13 22.641 0.049 . 1 . . . . . 832 LEU CD1 . 19518 2 347 . 2 2 27 27 LEU CD2 C 13 27.074 0.078 . 1 . . . . . 832 LEU CD2 . 19518 2 348 . 2 2 27 27 LEU N N 15 118.456 0.049 . 1 . . . . . 832 LEU N . 19518 2 349 . 2 2 28 28 TYR H H 1 8.025 0.006 . 1 . . . . . 833 TYR H . 19518 2 350 . 2 2 28 28 TYR HA H 1 3.811 0.001 . 1 . . . . . 833 TYR HA . 19518 2 351 . 2 2 28 28 TYR HB2 H 1 3.393 0.001 . 1 . . . . . 833 TYR HB2 . 19518 2 352 . 2 2 28 28 TYR HB3 H 1 3.223 0.011 . 1 . . . . . 833 TYR HB3 . 19518 2 353 . 2 2 28 28 TYR HD1 H 1 6.585 0.014 . 3 . . . . . 833 TYR HD1 . 19518 2 354 . 2 2 28 28 TYR HD2 H 1 6.585 0.014 . 3 . . . . . 833 TYR HD2 . 19518 2 355 . 2 2 28 28 TYR HE1 H 1 6.410 0.010 . 3 . . . . . 833 TYR HE1 . 19518 2 356 . 2 2 28 28 TYR HE2 H 1 6.410 0.010 . 3 . . . . . 833 TYR HE2 . 19518 2 357 . 2 2 28 28 TYR C C 13 176.894 0.000 . 1 . . . . . 833 TYR C . 19518 2 358 . 2 2 28 28 TYR CA C 13 62.739 0.000 . 1 . . . . . 833 TYR CA . 19518 2 359 . 2 2 28 28 TYR CB C 13 38.547 0.079 . 1 . . . . . 833 TYR CB . 19518 2 360 . 2 2 28 28 TYR CD1 C 13 132.449 0.060 . 3 . . . . . 833 TYR CD1 . 19518 2 361 . 2 2 28 28 TYR CD2 C 13 132.449 0.060 . 3 . . . . . 833 TYR CD2 . 19518 2 362 . 2 2 28 28 TYR CE1 C 13 118.424 0.093 . 3 . . . . . 833 TYR CE1 . 19518 2 363 . 2 2 28 28 TYR CE2 C 13 118.424 0.093 . 3 . . . . . 833 TYR CE2 . 19518 2 364 . 2 2 28 28 TYR N N 15 120.185 0.075 . 1 . . . . . 833 TYR N . 19518 2 365 . 2 2 29 29 PHE H H 1 8.332 0.008 . 1 . . . . . 834 PHE H . 19518 2 366 . 2 2 29 29 PHE HA H 1 4.259 0.014 . 1 . . . . . 834 PHE HA . 19518 2 367 . 2 2 29 29 PHE HB2 H 1 3.018 0.016 . 1 . . . . . 834 PHE HB2 . 19518 2 368 . 2 2 29 29 PHE HB3 H 1 3.190 0.008 . 1 . . . . . 834 PHE HB3 . 19518 2 369 . 2 2 29 29 PHE C C 13 178.003 0.000 . 1 . . . . . 834 PHE C . 19518 2 370 . 2 2 29 29 PHE CA C 13 59.446 0.066 . 1 . . . . . 834 PHE CA . 19518 2 371 . 2 2 29 29 PHE CB C 13 38.771 0.039 . 1 . . . . . 834 PHE CB . 19518 2 372 . 2 2 29 29 PHE N N 15 114.946 0.039 . 1 . . . . . 834 PHE N . 19518 2 373 . 2 2 30 30 LYS H H 1 7.490 0.006 . 1 . . . . . 835 LYS H . 19518 2 374 . 2 2 30 30 LYS HA H 1 4.159 0.010 . 1 . . . . . 835 LYS HA . 19518 2 375 . 2 2 30 30 LYS HB2 H 1 1.984 0.014 . 1 . . . . . 835 LYS HB2 . 19518 2 376 . 2 2 30 30 LYS HB3 H 1 1.601 0.011 . 1 . . . . . 835 LYS HB3 . 19518 2 377 . 2 2 30 30 LYS HG2 H 1 1.583 0.001 . 1 . . . . . 835 LYS HG2 . 19518 2 378 . 2 2 30 30 LYS HG3 H 1 1.583 0.001 . 1 . . . . . 835 LYS HG3 . 19518 2 379 . 2 2 30 30 LYS HD2 H 1 1.656 0.003 . 1 . . . . . 835 LYS HD2 . 19518 2 380 . 2 2 30 30 LYS HD3 H 1 1.656 0.003 . 1 . . . . . 835 LYS HD3 . 19518 2 381 . 2 2 30 30 LYS HE2 H 1 2.970 0.000 . 1 . . . . . 835 LYS HE2 . 19518 2 382 . 2 2 30 30 LYS HE3 H 1 2.970 0.000 . 1 . . . . . 835 LYS HE3 . 19518 2 383 . 2 2 30 30 LYS C C 13 177.634 0.000 . 1 . . . . . 835 LYS C . 19518 2 384 . 2 2 30 30 LYS CA C 13 57.073 0.100 . 1 . . . . . 835 LYS CA . 19518 2 385 . 2 2 30 30 LYS CB C 13 32.635 0.071 . 1 . . . . . 835 LYS CB . 19518 2 386 . 2 2 30 30 LYS CG C 13 25.304 0.038 . 1 . . . . . 835 LYS CG . 19518 2 387 . 2 2 30 30 LYS CD C 13 28.395 0.048 . 1 . . . . . 835 LYS CD . 19518 2 388 . 2 2 30 30 LYS CE C 13 42.250 0.000 . 1 . . . . . 835 LYS CE . 19518 2 389 . 2 2 30 30 LYS N N 15 116.915 0.086 . 1 . . . . . 835 LYS N . 19518 2 390 . 2 2 31 31 ILE H H 1 7.403 0.005 . 1 . . . . . 836 ILE H . 19518 2 391 . 2 2 31 31 ILE HA H 1 3.945 0.003 . 1 . . . . . 836 ILE HA . 19518 2 392 . 2 2 31 31 ILE HB H 1 2.371 0.002 . 1 . . . . . 836 ILE HB . 19518 2 393 . 2 2 31 31 ILE HG12 H 1 1.052 0.014 . 1 . . . . . 836 ILE HG12 . 19518 2 394 . 2 2 31 31 ILE HG13 H 1 0.896 0.008 . 1 . . . . . 836 ILE HG13 . 19518 2 395 . 2 2 31 31 ILE HG21 H 1 0.772 0.013 . 1 . . . . . 836 ILE HG21 . 19518 2 396 . 2 2 31 31 ILE HG22 H 1 0.772 0.013 . 1 . . . . . 836 ILE HG22 . 19518 2 397 . 2 2 31 31 ILE HG23 H 1 0.772 0.013 . 1 . . . . . 836 ILE HG23 . 19518 2 398 . 2 2 31 31 ILE HD11 H 1 0.653 0.019 . 1 . . . . . 836 ILE HD11 . 19518 2 399 . 2 2 31 31 ILE HD12 H 1 0.653 0.019 . 1 . . . . . 836 ILE HD12 . 19518 2 400 . 2 2 31 31 ILE HD13 H 1 0.653 0.019 . 1 . . . . . 836 ILE HD13 . 19518 2 401 . 2 2 31 31 ILE C C 13 175.312 0.000 . 1 . . . . . 836 ILE C . 19518 2 402 . 2 2 31 31 ILE CA C 13 61.672 0.080 . 1 . . . . . 836 ILE CA . 19518 2 403 . 2 2 31 31 ILE CB C 13 38.518 0.020 . 1 . . . . . 836 ILE CB . 19518 2 404 . 2 2 31 31 ILE CG1 C 13 28.235 0.048 . 1 . . . . . 836 ILE CG1 . 19518 2 405 . 2 2 31 31 ILE CG2 C 13 17.584 0.089 . 1 . . . . . 836 ILE CG2 . 19518 2 406 . 2 2 31 31 ILE CD1 C 13 14.372 0.044 . 1 . . . . . 836 ILE CD1 . 19518 2 407 . 2 2 31 31 ILE N N 15 116.406 0.086 . 1 . . . . . 836 ILE N . 19518 2 408 . 2 2 32 32 LYS H H 1 7.766 0.008 . 1 . . . . . 837 LYS H . 19518 2 409 . 2 2 32 32 LYS HA H 1 4.264 0.013 . 1 . . . . . 837 LYS HA . 19518 2 410 . 2 2 32 32 LYS HB2 H 1 1.447 0.024 . 1 . . . . . 837 LYS HB2 . 19518 2 411 . 2 2 32 32 LYS HB3 H 1 1.447 0.024 . 1 . . . . . 837 LYS HB3 . 19518 2 412 . 2 2 32 32 LYS HG2 H 1 1.155 0.003 . 1 . . . . . 837 LYS HG2 . 19518 2 413 . 2 2 32 32 LYS HG3 H 1 1.155 0.003 . 1 . . . . . 837 LYS HG3 . 19518 2 414 . 2 2 32 32 LYS CA C 13 53.085 0.091 . 1 . . . . . 837 LYS CA . 19518 2 415 . 2 2 32 32 LYS CB C 13 31.066 0.000 . 1 . . . . . 837 LYS CB . 19518 2 416 . 2 2 32 32 LYS CG C 13 23.371 0.050 . 1 . . . . . 837 LYS CG . 19518 2 417 . 2 2 32 32 LYS N N 15 122.653 0.113 . 1 . . . . . 837 LYS N . 19518 2 stop_ save_