data_11095 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11095 _Entry.Title ; Solution structure of the chimera of the PTB domain of SNT-2 and 19-residue peptide (aa 1571-1589) of hALK ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-02-15 _Entry.Accession_date 2010-02-17 _Entry.Last_release_date 2011-02-14 _Entry.Original_release_date 2011-02-14 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 H. Li . . . 11095 2 S. Koshiba . . . 11095 3 T. Tomizawa . . . 11095 4 S. Watanabe . . . 11095 5 T. Harada . . . 11095 6 T. Kigawa . . . 11095 7 S. Yokoyama . . . 11095 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'NPPSFA, National Project on Protein Structural and Functional Analyses' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11095 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11095 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 603 11095 '15N chemical shifts' 146 11095 '1H chemical shifts' 955 11095 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-02-14 2010-02-15 original author . 11095 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 11094 'Chemical shift assignments of the complex of the PTB domain of SNT-2 and 19-residue peptide (aa 1571-1589) of hALK' 11095 PDB 2ys5 'Solution structure of the complex of the PTB domain of SNT-2 and 19-residue peptide (aa 1571-1589) of hALK' 11095 PDB 2YT2 'BMRB Entry Tracking System' 11095 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11095 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Solution structure of the chimera of the PTB domain of SNT-2 and 19-residue peptide (aa 1571-1589) of hALK ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 H. Li . . . 11095 1 2 S. Koshiba . . . 11095 1 3 T. Tomizawa . . . 11095 1 4 S. Watanabe . . . 11095 1 5 T. Harada . . . 11095 1 6 T. Kigawa . . . 11095 1 7 S. Yokoyama . . . 11095 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11095 _Assembly.ID 1 _Assembly.Name 'Fibroblast growth factor receptor substrate 3 and ALK tyrosine kinase receptor' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'PTB domain and 19-residue peptide' 1 $entity_1 A . yes native no no . . . 11095 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2yt2 . . . . . . 11095 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11095 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'PTB domain and 19-residue peptide' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGLNRDSVPDNHPTK FKVTNVDDEGVELGSGVMEL TQSELVLHLHRREAVRWPYL CLRRYGYDSNLFSFESGRRC QTGQGIFAFKCSRAEEIFNL LQDLMQCNSINVMEEPVIIT SGSSGSSGSSGSSGLFRLRH FPCGNVNYGYQQQ ; _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 153 _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 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 11094 . "PTB domain" . . . . . 80.39 146 98.37 98.37 1.32e-82 . . . . 11095 1 2 no PDB 2KUP . "Solution Structure Of The Complex Of The Ptb Domain Of Snt-2 And 19- Residue Peptide (aa 1571-1589) Of Halk" . . . . . 80.39 146 98.37 98.37 1.32e-82 . . . . 11095 1 3 no PDB 2KUQ . "Solution Structure Of The Chimera Of The Ptb Domain Of Snt-2 And 19- Residue Peptide (aa 1571-1589) Of Halk" . . . . . 100.00 153 100.00 100.00 3.57e-107 . . . . 11095 1 4 no PDB 2YS5 . "Solution Structure Of The Complex Of The Ptb Domain Of Snt-2 And 19- Residue Peptide (aa 1571-1589) Of Halk" . . . . . 80.39 146 98.37 98.37 1.32e-82 . . . . 11095 1 5 no PDB 2YT2 . "Solution Structure Of The Chimera Of The Ptb Domain Of Snt-2 And 19- Residue Peptide (aa 1571-1589) Of Halk" . . . . . 100.00 153 100.00 100.00 3.57e-107 . . . . 11095 1 6 no DBJ BAJ20358 . "fibroblast growth factor receptor substrate 3 [synthetic construct]" . . . . . 77.12 492 97.46 97.46 1.30e-74 . . . . 11095 1 7 no EMBL CAG33307 . "FRS3 [Homo sapiens]" . . . . . 77.12 492 97.46 97.46 1.30e-74 . . . . 11095 1 8 no GB AAB92555 . "FGFR signalling adaptor SNT-2 [Homo sapiens]" . . . . . 77.12 492 97.46 97.46 1.30e-74 . . . . 11095 1 9 no GB AAH10611 . "Fibroblast growth factor receptor substrate 3 [Homo sapiens]" . . . . . 77.12 492 97.46 97.46 1.30e-74 . . . . 11095 1 10 no GB ABM83001 . "fibroblast growth factor receptor substrate 3 [synthetic construct]" . . . . . 77.12 492 97.46 97.46 1.30e-74 . . . . 11095 1 11 no GB ABM86194 . "fibroblast growth factor receptor substrate 3 [synthetic construct]" . . . . . 77.12 492 97.46 97.46 1.30e-74 . . . . 11095 1 12 no GB ABW05536 . "fibroblast growth factor receptor substrate 3 (predicted) [Papio anubis]" . . . . . 77.12 492 97.46 97.46 1.08e-74 . . . . 11095 1 13 no REF NP_001162219 . "fibroblast growth factor receptor substrate 3 [Papio anubis]" . . . . . 77.12 492 97.46 97.46 1.08e-74 . . . . 11095 1 14 no REF NP_001253120 . "fibroblast growth factor receptor substrate 3 [Macaca mulatta]" . . . . . 77.12 492 97.46 97.46 1.18e-74 . . . . 11095 1 15 no REF NP_006644 . "fibroblast growth factor receptor substrate 3 [Homo sapiens]" . . . . . 77.12 492 97.46 97.46 1.30e-74 . . . . 11095 1 16 no REF XP_001501207 . "PREDICTED: fibroblast growth factor receptor substrate 3 isoform X1 [Equus caballus]" . . . . . 77.12 495 97.46 97.46 9.59e-75 . . . . 11095 1 17 no REF XP_002914538 . "PREDICTED: fibroblast growth factor receptor substrate 3 [Ailuropoda melanoleuca]" . . . . . 77.12 495 97.46 97.46 1.42e-74 . . . . 11095 1 18 no SP O43559 . "RecName: Full=Fibroblast growth factor receptor substrate 3; Short=FGFR substrate 3; AltName: Full=FGFR-signaling adaptor SNT2;" . . . . . 77.12 492 97.46 97.46 1.30e-74 . . . . 11095 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 . GLY . 11095 1 2 . SER . 11095 1 3 . SER . 11095 1 4 . GLY . 11095 1 5 . SER . 11095 1 6 . SER . 11095 1 7 . GLY . 11095 1 8 . LEU . 11095 1 9 . ASN . 11095 1 10 . ARG . 11095 1 11 . ASP . 11095 1 12 . SER . 11095 1 13 . VAL . 11095 1 14 . PRO . 11095 1 15 . ASP . 11095 1 16 . ASN . 11095 1 17 . HIS . 11095 1 18 . PRO . 11095 1 19 . THR . 11095 1 20 . LYS . 11095 1 21 . PHE . 11095 1 22 . LYS . 11095 1 23 . VAL . 11095 1 24 . THR . 11095 1 25 . ASN . 11095 1 26 . VAL . 11095 1 27 . ASP . 11095 1 28 . ASP . 11095 1 29 . GLU . 11095 1 30 . GLY . 11095 1 31 . VAL . 11095 1 32 . GLU . 11095 1 33 . LEU . 11095 1 34 . GLY . 11095 1 35 . SER . 11095 1 36 . GLY . 11095 1 37 . VAL . 11095 1 38 . MET . 11095 1 39 . GLU . 11095 1 40 . LEU . 11095 1 41 . THR . 11095 1 42 . GLN . 11095 1 43 . SER . 11095 1 44 . GLU . 11095 1 45 . LEU . 11095 1 46 . VAL . 11095 1 47 . LEU . 11095 1 48 . HIS . 11095 1 49 . LEU . 11095 1 50 . HIS . 11095 1 51 . ARG . 11095 1 52 . ARG . 11095 1 53 . GLU . 11095 1 54 . ALA . 11095 1 55 . VAL . 11095 1 56 . ARG . 11095 1 57 . TRP . 11095 1 58 . PRO . 11095 1 59 . TYR . 11095 1 60 . LEU . 11095 1 61 . CYS . 11095 1 62 . LEU . 11095 1 63 . ARG . 11095 1 64 . ARG . 11095 1 65 . TYR . 11095 1 66 . GLY . 11095 1 67 . TYR . 11095 1 68 . ASP . 11095 1 69 . SER . 11095 1 70 . ASN . 11095 1 71 . LEU . 11095 1 72 . PHE . 11095 1 73 . SER . 11095 1 74 . PHE . 11095 1 75 . GLU . 11095 1 76 . SER . 11095 1 77 . GLY . 11095 1 78 . ARG . 11095 1 79 . ARG . 11095 1 80 . CYS . 11095 1 81 . GLN . 11095 1 82 . THR . 11095 1 83 . GLY . 11095 1 84 . GLN . 11095 1 85 . GLY . 11095 1 86 . ILE . 11095 1 87 . PHE . 11095 1 88 . ALA . 11095 1 89 . PHE . 11095 1 90 . LYS . 11095 1 91 . CYS . 11095 1 92 . SER . 11095 1 93 . ARG . 11095 1 94 . ALA . 11095 1 95 . GLU . 11095 1 96 . GLU . 11095 1 97 . ILE . 11095 1 98 . PHE . 11095 1 99 . ASN . 11095 1 100 . LEU . 11095 1 101 . LEU . 11095 1 102 . GLN . 11095 1 103 . ASP . 11095 1 104 . LEU . 11095 1 105 . MET . 11095 1 106 . GLN . 11095 1 107 . CYS . 11095 1 108 . ASN . 11095 1 109 . SER . 11095 1 110 . ILE . 11095 1 111 . ASN . 11095 1 112 . VAL . 11095 1 113 . MET . 11095 1 114 . GLU . 11095 1 115 . GLU . 11095 1 116 . PRO . 11095 1 117 . VAL . 11095 1 118 . ILE . 11095 1 119 . ILE . 11095 1 120 . THR . 11095 1 121 . SER . 11095 1 122 . GLY . 11095 1 123 . SER . 11095 1 124 . SER . 11095 1 125 . GLY . 11095 1 126 . SER . 11095 1 127 . SER . 11095 1 128 . GLY . 11095 1 129 . SER . 11095 1 130 . SER . 11095 1 131 . GLY . 11095 1 132 . SER . 11095 1 133 . SER . 11095 1 134 . GLY . 11095 1 135 . LEU . 11095 1 136 . PHE . 11095 1 137 . ARG . 11095 1 138 . LEU . 11095 1 139 . ARG . 11095 1 140 . HIS . 11095 1 141 . PHE . 11095 1 142 . PRO . 11095 1 143 . CYS . 11095 1 144 . GLY . 11095 1 145 . ASN . 11095 1 146 . VAL . 11095 1 147 . ASN . 11095 1 148 . TYR . 11095 1 149 . GLY . 11095 1 150 . TYR . 11095 1 151 . GLN . 11095 1 152 . GLN . 11095 1 153 . GLN . 11095 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 11095 1 . SER 2 2 11095 1 . SER 3 3 11095 1 . GLY 4 4 11095 1 . SER 5 5 11095 1 . SER 6 6 11095 1 . GLY 7 7 11095 1 . LEU 8 8 11095 1 . ASN 9 9 11095 1 . ARG 10 10 11095 1 . ASP 11 11 11095 1 . SER 12 12 11095 1 . VAL 13 13 11095 1 . PRO 14 14 11095 1 . ASP 15 15 11095 1 . ASN 16 16 11095 1 . HIS 17 17 11095 1 . PRO 18 18 11095 1 . THR 19 19 11095 1 . LYS 20 20 11095 1 . PHE 21 21 11095 1 . LYS 22 22 11095 1 . VAL 23 23 11095 1 . THR 24 24 11095 1 . ASN 25 25 11095 1 . VAL 26 26 11095 1 . ASP 27 27 11095 1 . ASP 28 28 11095 1 . GLU 29 29 11095 1 . GLY 30 30 11095 1 . VAL 31 31 11095 1 . GLU 32 32 11095 1 . LEU 33 33 11095 1 . GLY 34 34 11095 1 . SER 35 35 11095 1 . GLY 36 36 11095 1 . VAL 37 37 11095 1 . MET 38 38 11095 1 . GLU 39 39 11095 1 . LEU 40 40 11095 1 . THR 41 41 11095 1 . GLN 42 42 11095 1 . SER 43 43 11095 1 . GLU 44 44 11095 1 . LEU 45 45 11095 1 . VAL 46 46 11095 1 . LEU 47 47 11095 1 . HIS 48 48 11095 1 . LEU 49 49 11095 1 . HIS 50 50 11095 1 . ARG 51 51 11095 1 . ARG 52 52 11095 1 . GLU 53 53 11095 1 . ALA 54 54 11095 1 . VAL 55 55 11095 1 . ARG 56 56 11095 1 . TRP 57 57 11095 1 . PRO 58 58 11095 1 . TYR 59 59 11095 1 . LEU 60 60 11095 1 . CYS 61 61 11095 1 . LEU 62 62 11095 1 . ARG 63 63 11095 1 . ARG 64 64 11095 1 . TYR 65 65 11095 1 . GLY 66 66 11095 1 . TYR 67 67 11095 1 . ASP 68 68 11095 1 . SER 69 69 11095 1 . ASN 70 70 11095 1 . LEU 71 71 11095 1 . PHE 72 72 11095 1 . SER 73 73 11095 1 . PHE 74 74 11095 1 . GLU 75 75 11095 1 . SER 76 76 11095 1 . GLY 77 77 11095 1 . ARG 78 78 11095 1 . ARG 79 79 11095 1 . CYS 80 80 11095 1 . GLN 81 81 11095 1 . THR 82 82 11095 1 . GLY 83 83 11095 1 . GLN 84 84 11095 1 . GLY 85 85 11095 1 . ILE 86 86 11095 1 . PHE 87 87 11095 1 . ALA 88 88 11095 1 . PHE 89 89 11095 1 . LYS 90 90 11095 1 . CYS 91 91 11095 1 . SER 92 92 11095 1 . ARG 93 93 11095 1 . ALA 94 94 11095 1 . GLU 95 95 11095 1 . GLU 96 96 11095 1 . ILE 97 97 11095 1 . PHE 98 98 11095 1 . ASN 99 99 11095 1 . LEU 100 100 11095 1 . LEU 101 101 11095 1 . GLN 102 102 11095 1 . ASP 103 103 11095 1 . LEU 104 104 11095 1 . MET 105 105 11095 1 . GLN 106 106 11095 1 . CYS 107 107 11095 1 . ASN 108 108 11095 1 . SER 109 109 11095 1 . ILE 110 110 11095 1 . ASN 111 111 11095 1 . VAL 112 112 11095 1 . MET 113 113 11095 1 . GLU 114 114 11095 1 . GLU 115 115 11095 1 . PRO 116 116 11095 1 . VAL 117 117 11095 1 . ILE 118 118 11095 1 . ILE 119 119 11095 1 . THR 120 120 11095 1 . SER 121 121 11095 1 . GLY 122 122 11095 1 . SER 123 123 11095 1 . SER 124 124 11095 1 . GLY 125 125 11095 1 . SER 126 126 11095 1 . SER 127 127 11095 1 . GLY 128 128 11095 1 . SER 129 129 11095 1 . SER 130 130 11095 1 . GLY 131 131 11095 1 . SER 132 132 11095 1 . SER 133 133 11095 1 . GLY 134 134 11095 1 . LEU 135 135 11095 1 . PHE 136 136 11095 1 . ARG 137 137 11095 1 . LEU 138 138 11095 1 . ARG 139 139 11095 1 . HIS 140 140 11095 1 . PHE 141 141 11095 1 . PRO 142 142 11095 1 . CYS 143 143 11095 1 . GLY 144 144 11095 1 . ASN 145 145 11095 1 . VAL 146 146 11095 1 . ASN 147 147 11095 1 . TYR 148 148 11095 1 . GLY 149 149 11095 1 . TYR 150 150 11095 1 . GLN 151 151 11095 1 . GLN 152 152 11095 1 . GLN 153 153 11095 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 11095 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11095 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 11095 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'cell free synthesis' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . . . . P060724-01 . . . . . . 11095 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11095 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.12mM chimera sample [U-15N, 13C], 20mM d-Tris-HCl, 100mM NaCl, 1mM d-DTT, 0.02% NaN3, 90% H2O, 10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O, 10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'PTB domain and 19-residue peptide' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.12 . . mM . . . . 11095 1 2 TRIS [U-2H] . . . . . buffer 20 . . mM . . . . 11095 1 3 'sodium chloride' 'natural abundance' . . . . . salt 100 . . mM . . . . 11095 1 4 DTT [U-2H] . . . . . salt 1 . . mM . . . . 11095 1 5 'sodium azide' 'natural abundance' . . . . . salt 0.02 . . % . . . . 11095 1 6 H2O . . . . . . solvent 90 . . % . . . . 11095 1 7 D2O . . . . . . solvent 10 . . % . . . . 11095 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 11095 _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' 120 0.1 mM 11095 1 pH 7.0 0.05 pH 11095 1 pressure 1 0.001 atm 11095 1 temperature 298 0.1 K 11095 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11095 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11095 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11095 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11095 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20031121 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11095 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11095 2 stop_ save_ save_NMRVIEW _Software.Sf_category software _Software.Sf_framecode NMRVIEW _Software.Entry_ID 11095 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 11095 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11095 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11095 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9820 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11095 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11095 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11095 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11095 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 11095 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 11095 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _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 11095 _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 spectrometer_1 Bruker AVANCE . 900 . . . 11095 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 11095 _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 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11095 1 2 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11095 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 11095 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 11095 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11095 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11095 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11095 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-15N NOESY' 1 $sample_1 isotropic 11095 1 2 '3D 1H-13C NOESY' 1 $sample_1 isotropic 11095 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XWINNMR . . 11095 1 2 $NMRPipe . . 11095 1 3 $NMRVIEW . . 11095 1 4 $Kujira . . 11095 1 5 $CYANA . . 11095 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 7 7 GLY HA2 H 1 3.943 0.030 . 1 . . . . 7 GLY HA2 . 11095 1 2 . 1 1 7 7 GLY HA3 H 1 3.943 0.030 . 1 . . . . 7 GLY HA3 . 11095 1 3 . 1 1 8 8 LEU H H 1 8.121 0.030 . 1 . . . . 8 LEU H . 11095 1 4 . 1 1 8 8 LEU HA H 1 4.272 0.030 . 1 . . . . 8 LEU HA . 11095 1 5 . 1 1 8 8 LEU HB2 H 1 1.504 0.030 . 1 . . . . 8 LEU HB2 . 11095 1 6 . 1 1 8 8 LEU HB3 H 1 1.504 0.030 . 1 . . . . 8 LEU HB3 . 11095 1 7 . 1 1 8 8 LEU HD11 H 1 0.801 0.030 . 1 . . . . 8 LEU HD1 . 11095 1 8 . 1 1 8 8 LEU HD12 H 1 0.801 0.030 . 1 . . . . 8 LEU HD1 . 11095 1 9 . 1 1 8 8 LEU HD13 H 1 0.801 0.030 . 1 . . . . 8 LEU HD1 . 11095 1 10 . 1 1 8 8 LEU HD21 H 1 0.749 0.030 . 1 . . . . 8 LEU HD2 . 11095 1 11 . 1 1 8 8 LEU HD22 H 1 0.749 0.030 . 1 . . . . 8 LEU HD2 . 11095 1 12 . 1 1 8 8 LEU HD23 H 1 0.749 0.030 . 1 . . . . 8 LEU HD2 . 11095 1 13 . 1 1 8 8 LEU HG H 1 1.464 0.030 . 1 . . . . 8 LEU HG . 11095 1 14 . 1 1 8 8 LEU C C 13 176.890 0.300 . 1 . . . . 8 LEU C . 11095 1 15 . 1 1 8 8 LEU CA C 13 55.180 0.300 . 1 . . . . 8 LEU CA . 11095 1 16 . 1 1 8 8 LEU CB C 13 42.498 0.300 . 1 . . . . 8 LEU CB . 11095 1 17 . 1 1 8 8 LEU CD1 C 13 24.661 0.300 . 2 . . . . 8 LEU CD1 . 11095 1 18 . 1 1 8 8 LEU CD2 C 13 23.618 0.300 . 2 . . . . 8 LEU CD2 . 11095 1 19 . 1 1 8 8 LEU CG C 13 26.762 0.300 . 1 . . . . 8 LEU CG . 11095 1 20 . 1 1 8 8 LEU N N 15 121.604 0.300 . 1 . . . . 8 LEU N . 11095 1 21 . 1 1 9 9 ASN H H 1 8.469 0.030 . 1 . . . . 9 ASN H . 11095 1 22 . 1 1 9 9 ASN C C 13 175.591 0.300 . 1 . . . . 9 ASN C . 11095 1 23 . 1 1 9 9 ASN CA C 13 53.130 0.300 . 1 . . . . 9 ASN CA . 11095 1 24 . 1 1 9 9 ASN CB C 13 38.744 0.300 . 1 . . . . 9 ASN CB . 11095 1 25 . 1 1 9 9 ASN N N 15 120.095 0.300 . 1 . . . . 9 ASN N . 11095 1 26 . 1 1 10 10 ARG H H 1 8.243 0.030 . 1 . . . . 10 ARG H . 11095 1 27 . 1 1 10 10 ARG HA H 1 4.132 0.030 . 1 . . . . 10 ARG HA . 11095 1 28 . 1 1 10 10 ARG HB2 H 1 1.822 0.030 . 2 . . . . 10 ARG HB2 . 11095 1 29 . 1 1 10 10 ARG HB3 H 1 1.741 0.030 . 2 . . . . 10 ARG HB3 . 11095 1 30 . 1 1 10 10 ARG HD2 H 1 3.141 0.030 . 1 . . . . 10 ARG HD2 . 11095 1 31 . 1 1 10 10 ARG HD3 H 1 3.141 0.030 . 1 . . . . 10 ARG HD3 . 11095 1 32 . 1 1 10 10 ARG HG2 H 1 1.571 0.030 . 1 . . . . 10 ARG HG2 . 11095 1 33 . 1 1 10 10 ARG HG3 H 1 1.571 0.030 . 1 . . . . 10 ARG HG3 . 11095 1 34 . 1 1 10 10 ARG C C 13 176.143 0.300 . 1 . . . . 10 ARG C . 11095 1 35 . 1 1 10 10 ARG CA C 13 57.240 0.300 . 1 . . . . 10 ARG CA . 11095 1 36 . 1 1 10 10 ARG CB C 13 30.538 0.300 . 1 . . . . 10 ARG CB . 11095 1 37 . 1 1 10 10 ARG CD C 13 43.512 0.300 . 1 . . . . 10 ARG CD . 11095 1 38 . 1 1 10 10 ARG CG C 13 27.071 0.300 . 1 . . . . 10 ARG CG . 11095 1 39 . 1 1 10 10 ARG N N 15 123.824 0.300 . 1 . . . . 10 ARG N . 11095 1 40 . 1 1 11 11 ASP H H 1 8.273 0.030 . 1 . . . . 11 ASP H . 11095 1 41 . 1 1 11 11 ASP HA H 1 4.556 0.030 . 1 . . . . 11 ASP HA . 11095 1 42 . 1 1 11 11 ASP HB2 H 1 2.582 0.030 . 2 . . . . 11 ASP HB2 . 11095 1 43 . 1 1 11 11 ASP HB3 H 1 2.687 0.030 . 2 . . . . 11 ASP HB3 . 11095 1 44 . 1 1 11 11 ASP C C 13 176.319 0.300 . 1 . . . . 11 ASP C . 11095 1 45 . 1 1 11 11 ASP CA C 13 54.826 0.300 . 1 . . . . 11 ASP CA . 11095 1 46 . 1 1 11 11 ASP CB C 13 41.008 0.300 . 1 . . . . 11 ASP CB . 11095 1 47 . 1 1 11 11 ASP N N 15 119.258 0.300 . 1 . . . . 11 ASP N . 11095 1 48 . 1 1 12 12 SER H H 1 8.006 0.030 . 1 . . . . 12 SER H . 11095 1 49 . 1 1 12 12 SER HA H 1 4.397 0.030 . 1 . . . . 12 SER HA . 11095 1 50 . 1 1 12 12 SER HB2 H 1 3.837 0.030 . 1 . . . . 12 SER HB2 . 11095 1 51 . 1 1 12 12 SER HB3 H 1 3.837 0.030 . 1 . . . . 12 SER HB3 . 11095 1 52 . 1 1 12 12 SER C C 13 174.111 0.300 . 1 . . . . 12 SER C . 11095 1 53 . 1 1 12 12 SER CA C 13 58.400 0.300 . 1 . . . . 12 SER CA . 11095 1 54 . 1 1 12 12 SER CB C 13 63.790 0.300 . 1 . . . . 12 SER CB . 11095 1 55 . 1 1 12 12 SER N N 15 115.305 0.300 . 1 . . . . 12 SER N . 11095 1 56 . 1 1 13 13 VAL H H 1 7.961 0.030 . 1 . . . . 13 VAL H . 11095 1 57 . 1 1 13 13 VAL HA H 1 4.401 0.030 . 1 . . . . 13 VAL HA . 11095 1 58 . 1 1 13 13 VAL HB H 1 1.937 0.030 . 1 . . . . 13 VAL HB . 11095 1 59 . 1 1 13 13 VAL HG11 H 1 0.799 0.030 . 1 . . . . 13 VAL HG1 . 11095 1 60 . 1 1 13 13 VAL HG12 H 1 0.799 0.030 . 1 . . . . 13 VAL HG1 . 11095 1 61 . 1 1 13 13 VAL HG13 H 1 0.799 0.030 . 1 . . . . 13 VAL HG1 . 11095 1 62 . 1 1 13 13 VAL HG21 H 1 0.782 0.030 . 1 . . . . 13 VAL HG2 . 11095 1 63 . 1 1 13 13 VAL HG22 H 1 0.782 0.030 . 1 . . . . 13 VAL HG2 . 11095 1 64 . 1 1 13 13 VAL HG23 H 1 0.782 0.030 . 1 . . . . 13 VAL HG2 . 11095 1 65 . 1 1 13 13 VAL C C 13 173.653 0.300 . 1 . . . . 13 VAL C . 11095 1 66 . 1 1 13 13 VAL CA C 13 59.624 0.300 . 1 . . . . 13 VAL CA . 11095 1 67 . 1 1 13 13 VAL CB C 13 33.207 0.300 . 1 . . . . 13 VAL CB . 11095 1 68 . 1 1 13 13 VAL CG1 C 13 21.214 0.300 . 2 . . . . 13 VAL CG1 . 11095 1 69 . 1 1 13 13 VAL CG2 C 13 21.214 0.300 . 2 . . . . 13 VAL CG2 . 11095 1 70 . 1 1 13 13 VAL N N 15 123.641 0.300 . 1 . . . . 13 VAL N . 11095 1 71 . 1 1 14 14 PRO HA H 1 4.544 0.030 . 1 . . . . 14 PRO HA . 11095 1 72 . 1 1 14 14 PRO HB2 H 1 2.432 0.030 . 2 . . . . 14 PRO HB2 . 11095 1 73 . 1 1 14 14 PRO HB3 H 1 2.022 0.030 . 2 . . . . 14 PRO HB3 . 11095 1 74 . 1 1 14 14 PRO HD2 H 1 3.701 0.030 . 2 . . . . 14 PRO HD2 . 11095 1 75 . 1 1 14 14 PRO HD3 H 1 4.001 0.030 . 2 . . . . 14 PRO HD3 . 11095 1 76 . 1 1 14 14 PRO HG2 H 1 2.109 0.030 . 1 . . . . 14 PRO HG2 . 11095 1 77 . 1 1 14 14 PRO HG3 H 1 2.109 0.030 . 1 . . . . 14 PRO HG3 . 11095 1 78 . 1 1 14 14 PRO CA C 13 62.794 0.300 . 1 . . . . 14 PRO CA . 11095 1 79 . 1 1 14 14 PRO CB C 13 32.684 0.300 . 1 . . . . 14 PRO CB . 11095 1 80 . 1 1 14 14 PRO CD C 13 51.197 0.300 . 1 . . . . 14 PRO CD . 11095 1 81 . 1 1 14 14 PRO CG C 13 27.573 0.300 . 1 . . . . 14 PRO CG . 11095 1 82 . 1 1 15 15 ASP HA H 1 4.412 0.030 . 1 . . . . 15 ASP HA . 11095 1 83 . 1 1 15 15 ASP HB2 H 1 2.562 0.030 . 2 . . . . 15 ASP HB2 . 11095 1 84 . 1 1 15 15 ASP HB3 H 1 2.791 0.030 . 2 . . . . 15 ASP HB3 . 11095 1 85 . 1 1 15 15 ASP C C 13 174.780 0.300 . 1 . . . . 15 ASP C . 11095 1 86 . 1 1 15 15 ASP CA C 13 56.254 0.300 . 1 . . . . 15 ASP CA . 11095 1 87 . 1 1 15 15 ASP CB C 13 40.861 0.300 . 1 . . . . 15 ASP CB . 11095 1 88 . 1 1 16 16 ASN H H 1 7.855 0.030 . 1 . . . . 16 ASN H . 11095 1 89 . 1 1 16 16 ASN HA H 1 4.625 0.030 . 1 . . . . 16 ASN HA . 11095 1 90 . 1 1 16 16 ASN HB2 H 1 2.972 0.030 . 2 . . . . 16 ASN HB2 . 11095 1 91 . 1 1 16 16 ASN HB3 H 1 2.661 0.030 . 2 . . . . 16 ASN HB3 . 11095 1 92 . 1 1 16 16 ASN HD21 H 1 7.584 0.030 . 2 . . . . 16 ASN HD21 . 11095 1 93 . 1 1 16 16 ASN HD22 H 1 6.772 0.030 . 2 . . . . 16 ASN HD22 . 11095 1 94 . 1 1 16 16 ASN C C 13 175.252 0.300 . 1 . . . . 16 ASN C . 11095 1 95 . 1 1 16 16 ASN CA C 13 51.484 0.300 . 1 . . . . 16 ASN CA . 11095 1 96 . 1 1 16 16 ASN CB C 13 37.942 0.300 . 1 . . . . 16 ASN CB . 11095 1 97 . 1 1 16 16 ASN N N 15 114.736 0.300 . 1 . . . . 16 ASN N . 11095 1 98 . 1 1 16 16 ASN ND2 N 15 111.169 0.300 . 1 . . . . 16 ASN ND2 . 11095 1 99 . 1 1 17 17 HIS H H 1 7.500 0.030 . 1 . . . . 17 HIS H . 11095 1 100 . 1 1 17 17 HIS HA H 1 4.301 0.030 . 1 . . . . 17 HIS HA . 11095 1 101 . 1 1 17 17 HIS HB2 H 1 3.372 0.030 . 2 . . . . 17 HIS HB2 . 11095 1 102 . 1 1 17 17 HIS HB3 H 1 2.912 0.030 . 2 . . . . 17 HIS HB3 . 11095 1 103 . 1 1 17 17 HIS HD2 H 1 7.031 0.030 . 1 . . . . 17 HIS HD2 . 11095 1 104 . 1 1 17 17 HIS HE1 H 1 7.820 0.030 . 1 . . . . 17 HIS HE1 . 11095 1 105 . 1 1 17 17 HIS CA C 13 56.642 0.300 . 1 . . . . 17 HIS CA . 11095 1 106 . 1 1 17 17 HIS CB C 13 31.225 0.300 . 1 . . . . 17 HIS CB . 11095 1 107 . 1 1 17 17 HIS CD2 C 13 117.476 0.300 . 1 . . . . 17 HIS CD2 . 11095 1 108 . 1 1 17 17 HIS CE1 C 13 139.533 0.300 . 1 . . . . 17 HIS CE1 . 11095 1 109 . 1 1 17 17 HIS N N 15 123.704 0.300 . 1 . . . . 17 HIS N . 11095 1 110 . 1 1 18 18 PRO HA H 1 4.213 0.030 . 1 . . . . 18 PRO HA . 11095 1 111 . 1 1 18 18 PRO HB2 H 1 2.299 0.030 . 2 . . . . 18 PRO HB2 . 11095 1 112 . 1 1 18 18 PRO HB3 H 1 1.943 0.030 . 2 . . . . 18 PRO HB3 . 11095 1 113 . 1 1 18 18 PRO HD2 H 1 3.420 0.030 . 2 . . . . 18 PRO HD2 . 11095 1 114 . 1 1 18 18 PRO HD3 H 1 2.422 0.030 . 2 . . . . 18 PRO HD3 . 11095 1 115 . 1 1 18 18 PRO HG2 H 1 1.859 0.030 . 2 . . . . 18 PRO HG2 . 11095 1 116 . 1 1 18 18 PRO HG3 H 1 1.794 0.030 . 2 . . . . 18 PRO HG3 . 11095 1 117 . 1 1 18 18 PRO C C 13 177.324 0.300 . 1 . . . . 18 PRO C . 11095 1 118 . 1 1 18 18 PRO CA C 13 64.951 0.300 . 1 . . . . 18 PRO CA . 11095 1 119 . 1 1 18 18 PRO CB C 13 32.985 0.300 . 1 . . . . 18 PRO CB . 11095 1 120 . 1 1 18 18 PRO CD C 13 50.349 0.300 . 1 . . . . 18 PRO CD . 11095 1 121 . 1 1 18 18 PRO CG C 13 27.360 0.300 . 1 . . . . 18 PRO CG . 11095 1 122 . 1 1 19 19 THR H H 1 9.533 0.030 . 1 . . . . 19 THR H . 11095 1 123 . 1 1 19 19 THR HA H 1 4.673 0.030 . 1 . . . . 19 THR HA . 11095 1 124 . 1 1 19 19 THR HB H 1 5.016 0.030 . 1 . . . . 19 THR HB . 11095 1 125 . 1 1 19 19 THR HG21 H 1 1.174 0.030 . 1 . . . . 19 THR HG2 . 11095 1 126 . 1 1 19 19 THR HG22 H 1 1.174 0.030 . 1 . . . . 19 THR HG2 . 11095 1 127 . 1 1 19 19 THR HG23 H 1 1.174 0.030 . 1 . . . . 19 THR HG2 . 11095 1 128 . 1 1 19 19 THR C C 13 172.547 0.300 . 1 . . . . 19 THR C . 11095 1 129 . 1 1 19 19 THR CA C 13 61.433 0.300 . 1 . . . . 19 THR CA . 11095 1 130 . 1 1 19 19 THR CB C 13 70.297 0.300 . 1 . . . . 19 THR CB . 11095 1 131 . 1 1 19 19 THR CG2 C 13 22.693 0.300 . 1 . . . . 19 THR CG2 . 11095 1 132 . 1 1 19 19 THR N N 15 106.116 0.300 . 1 . . . . 19 THR N . 11095 1 133 . 1 1 20 20 LYS H H 1 7.089 0.030 . 1 . . . . 20 LYS H . 11095 1 134 . 1 1 20 20 LYS HA H 1 5.050 0.030 . 1 . . . . 20 LYS HA . 11095 1 135 . 1 1 20 20 LYS HB2 H 1 0.736 0.030 . 2 . . . . 20 LYS HB2 . 11095 1 136 . 1 1 20 20 LYS HB3 H 1 0.968 0.030 . 2 . . . . 20 LYS HB3 . 11095 1 137 . 1 1 20 20 LYS HD2 H 1 1.020 0.030 . 2 . . . . 20 LYS HD2 . 11095 1 138 . 1 1 20 20 LYS HD3 H 1 0.580 0.030 . 2 . . . . 20 LYS HD3 . 11095 1 139 . 1 1 20 20 LYS HE2 H 1 2.367 0.030 . 2 . . . . 20 LYS HE2 . 11095 1 140 . 1 1 20 20 LYS HE3 H 1 2.462 0.030 . 2 . . . . 20 LYS HE3 . 11095 1 141 . 1 1 20 20 LYS HG2 H 1 0.722 0.030 . 2 . . . . 20 LYS HG2 . 11095 1 142 . 1 1 20 20 LYS HG3 H 1 1.033 0.030 . 2 . . . . 20 LYS HG3 . 11095 1 143 . 1 1 20 20 LYS C C 13 174.557 0.300 . 1 . . . . 20 LYS C . 11095 1 144 . 1 1 20 20 LYS CA C 13 55.293 0.300 . 1 . . . . 20 LYS CA . 11095 1 145 . 1 1 20 20 LYS CB C 13 35.618 0.300 . 1 . . . . 20 LYS CB . 11095 1 146 . 1 1 20 20 LYS CD C 13 29.605 0.300 . 1 . . . . 20 LYS CD . 11095 1 147 . 1 1 20 20 LYS CE C 13 41.968 0.300 . 1 . . . . 20 LYS CE . 11095 1 148 . 1 1 20 20 LYS CG C 13 26.238 0.300 . 1 . . . . 20 LYS CG . 11095 1 149 . 1 1 20 20 LYS N N 15 121.095 0.300 . 1 . . . . 20 LYS N . 11095 1 150 . 1 1 21 21 PHE H H 1 9.123 0.030 . 1 . . . . 21 PHE H . 11095 1 151 . 1 1 21 21 PHE HA H 1 4.497 0.030 . 1 . . . . 21 PHE HA . 11095 1 152 . 1 1 21 21 PHE HB2 H 1 2.783 0.030 . 2 . . . . 21 PHE HB2 . 11095 1 153 . 1 1 21 21 PHE HB3 H 1 2.595 0.030 . 2 . . . . 21 PHE HB3 . 11095 1 154 . 1 1 21 21 PHE HD1 H 1 6.909 0.030 . 1 . . . . 21 PHE HD1 . 11095 1 155 . 1 1 21 21 PHE HD2 H 1 6.909 0.030 . 1 . . . . 21 PHE HD2 . 11095 1 156 . 1 1 21 21 PHE HE1 H 1 6.902 0.030 . 1 . . . . 21 PHE HE1 . 11095 1 157 . 1 1 21 21 PHE HE2 H 1 6.902 0.030 . 1 . . . . 21 PHE HE2 . 11095 1 158 . 1 1 21 21 PHE HZ H 1 6.921 0.030 . 1 . . . . 21 PHE HZ . 11095 1 159 . 1 1 21 21 PHE C C 13 175.315 0.300 . 1 . . . . 21 PHE C . 11095 1 160 . 1 1 21 21 PHE CA C 13 56.305 0.300 . 1 . . . . 21 PHE CA . 11095 1 161 . 1 1 21 21 PHE CB C 13 42.772 0.300 . 1 . . . . 21 PHE CB . 11095 1 162 . 1 1 21 21 PHE CD1 C 13 132.296 0.300 . 1 . . . . 21 PHE CD1 . 11095 1 163 . 1 1 21 21 PHE CD2 C 13 132.296 0.300 . 1 . . . . 21 PHE CD2 . 11095 1 164 . 1 1 21 21 PHE CE1 C 13 130.342 0.300 . 1 . . . . 21 PHE CE1 . 11095 1 165 . 1 1 21 21 PHE CE2 C 13 130.342 0.300 . 1 . . . . 21 PHE CE2 . 11095 1 166 . 1 1 21 21 PHE CZ C 13 129.242 0.300 . 1 . . . . 21 PHE CZ . 11095 1 167 . 1 1 21 21 PHE N N 15 120.017 0.300 . 1 . . . . 21 PHE N . 11095 1 168 . 1 1 22 22 LYS H H 1 9.548 0.030 . 1 . . . . 22 LYS H . 11095 1 169 . 1 1 22 22 LYS HA H 1 4.589 0.030 . 1 . . . . 22 LYS HA . 11095 1 170 . 1 1 22 22 LYS HB2 H 1 1.989 0.030 . 2 . . . . 22 LYS HB2 . 11095 1 171 . 1 1 22 22 LYS HB3 H 1 1.929 0.030 . 2 . . . . 22 LYS HB3 . 11095 1 172 . 1 1 22 22 LYS HD2 H 1 1.775 0.030 . 1 . . . . 22 LYS HD2 . 11095 1 173 . 1 1 22 22 LYS HD3 H 1 1.775 0.030 . 1 . . . . 22 LYS HD3 . 11095 1 174 . 1 1 22 22 LYS HE2 H 1 2.978 0.030 . 2 . . . . 22 LYS HE2 . 11095 1 175 . 1 1 22 22 LYS HE3 H 1 2.912 0.030 . 2 . . . . 22 LYS HE3 . 11095 1 176 . 1 1 22 22 LYS HG2 H 1 1.390 0.030 . 2 . . . . 22 LYS HG2 . 11095 1 177 . 1 1 22 22 LYS HG3 H 1 1.601 0.030 . 2 . . . . 22 LYS HG3 . 11095 1 178 . 1 1 22 22 LYS C C 13 176.345 0.300 . 1 . . . . 22 LYS C . 11095 1 179 . 1 1 22 22 LYS CA C 13 57.980 0.300 . 1 . . . . 22 LYS CA . 11095 1 180 . 1 1 22 22 LYS CB C 13 31.456 0.300 . 1 . . . . 22 LYS CB . 11095 1 181 . 1 1 22 22 LYS CD C 13 29.276 0.300 . 1 . . . . 22 LYS CD . 11095 1 182 . 1 1 22 22 LYS CE C 13 42.819 0.300 . 1 . . . . 22 LYS CE . 11095 1 183 . 1 1 22 22 LYS CG C 13 26.144 0.300 . 1 . . . . 22 LYS CG . 11095 1 184 . 1 1 22 22 LYS N N 15 126.640 0.300 . 1 . . . . 22 LYS N . 11095 1 185 . 1 1 23 23 VAL H H 1 8.417 0.030 . 1 . . . . 23 VAL H . 11095 1 186 . 1 1 23 23 VAL HA H 1 5.547 0.030 . 1 . . . . 23 VAL HA . 11095 1 187 . 1 1 23 23 VAL HB H 1 2.323 0.030 . 1 . . . . 23 VAL HB . 11095 1 188 . 1 1 23 23 VAL HG11 H 1 0.871 0.030 . 1 . . . . 23 VAL HG1 . 11095 1 189 . 1 1 23 23 VAL HG12 H 1 0.871 0.030 . 1 . . . . 23 VAL HG1 . 11095 1 190 . 1 1 23 23 VAL HG13 H 1 0.871 0.030 . 1 . . . . 23 VAL HG1 . 11095 1 191 . 1 1 23 23 VAL HG21 H 1 0.636 0.030 . 1 . . . . 23 VAL HG2 . 11095 1 192 . 1 1 23 23 VAL HG22 H 1 0.636 0.030 . 1 . . . . 23 VAL HG2 . 11095 1 193 . 1 1 23 23 VAL HG23 H 1 0.636 0.030 . 1 . . . . 23 VAL HG2 . 11095 1 194 . 1 1 23 23 VAL C C 13 175.418 0.300 . 1 . . . . 23 VAL C . 11095 1 195 . 1 1 23 23 VAL CA C 13 59.049 0.300 . 1 . . . . 23 VAL CA . 11095 1 196 . 1 1 23 23 VAL CB C 13 37.182 0.300 . 1 . . . . 23 VAL CB . 11095 1 197 . 1 1 23 23 VAL CG1 C 13 21.235 0.300 . 2 . . . . 23 VAL CG1 . 11095 1 198 . 1 1 23 23 VAL CG2 C 13 19.313 0.300 . 2 . . . . 23 VAL CG2 . 11095 1 199 . 1 1 23 23 VAL N N 15 116.099 0.300 . 1 . . . . 23 VAL N . 11095 1 200 . 1 1 24 24 THR H H 1 8.469 0.030 . 1 . . . . 24 THR H . 11095 1 201 . 1 1 24 24 THR HA H 1 5.122 0.030 . 1 . . . . 24 THR HA . 11095 1 202 . 1 1 24 24 THR HB H 1 3.874 0.030 . 1 . . . . 24 THR HB . 11095 1 203 . 1 1 24 24 THR HG21 H 1 1.248 0.030 . 1 . . . . 24 THR HG2 . 11095 1 204 . 1 1 24 24 THR HG22 H 1 1.248 0.030 . 1 . . . . 24 THR HG2 . 11095 1 205 . 1 1 24 24 THR HG23 H 1 1.248 0.030 . 1 . . . . 24 THR HG2 . 11095 1 206 . 1 1 24 24 THR C C 13 174.272 0.300 . 1 . . . . 24 THR C . 11095 1 207 . 1 1 24 24 THR CA C 13 61.638 0.300 . 1 . . . . 24 THR CA . 11095 1 208 . 1 1 24 24 THR CB C 13 72.375 0.300 . 1 . . . . 24 THR CB . 11095 1 209 . 1 1 24 24 THR CG2 C 13 21.974 0.300 . 1 . . . . 24 THR CG2 . 11095 1 210 . 1 1 24 24 THR N N 15 116.361 0.300 . 1 . . . . 24 THR N . 11095 1 211 . 1 1 25 25 ASN H H 1 9.529 0.030 . 1 . . . . 25 ASN H . 11095 1 212 . 1 1 25 25 ASN HA H 1 4.593 0.030 . 1 . . . . 25 ASN HA . 11095 1 213 . 1 1 25 25 ASN HB2 H 1 2.857 0.030 . 1 . . . . 25 ASN HB2 . 11095 1 214 . 1 1 25 25 ASN HB3 H 1 2.857 0.030 . 1 . . . . 25 ASN HB3 . 11095 1 215 . 1 1 25 25 ASN HD21 H 1 7.775 0.030 . 2 . . . . 25 ASN HD21 . 11095 1 216 . 1 1 25 25 ASN HD22 H 1 6.083 0.030 . 2 . . . . 25 ASN HD22 . 11095 1 217 . 1 1 25 25 ASN C C 13 172.532 0.300 . 1 . . . . 25 ASN C . 11095 1 218 . 1 1 25 25 ASN CA C 13 54.692 0.300 . 1 . . . . 25 ASN CA . 11095 1 219 . 1 1 25 25 ASN CB C 13 40.857 0.300 . 1 . . . . 25 ASN CB . 11095 1 220 . 1 1 25 25 ASN N N 15 128.017 0.300 . 1 . . . . 25 ASN N . 11095 1 221 . 1 1 25 25 ASN ND2 N 15 110.910 0.300 . 1 . . . . 25 ASN ND2 . 11095 1 222 . 1 1 26 26 VAL H H 1 7.345 0.030 . 1 . . . . 26 VAL H . 11095 1 223 . 1 1 26 26 VAL HA H 1 5.554 0.030 . 1 . . . . 26 VAL HA . 11095 1 224 . 1 1 26 26 VAL HB H 1 1.757 0.030 . 1 . . . . 26 VAL HB . 11095 1 225 . 1 1 26 26 VAL HG11 H 1 0.748 0.030 . 1 . . . . 26 VAL HG1 . 11095 1 226 . 1 1 26 26 VAL HG12 H 1 0.748 0.030 . 1 . . . . 26 VAL HG1 . 11095 1 227 . 1 1 26 26 VAL HG13 H 1 0.748 0.030 . 1 . . . . 26 VAL HG1 . 11095 1 228 . 1 1 26 26 VAL HG21 H 1 0.590 0.030 . 1 . . . . 26 VAL HG2 . 11095 1 229 . 1 1 26 26 VAL HG22 H 1 0.590 0.030 . 1 . . . . 26 VAL HG2 . 11095 1 230 . 1 1 26 26 VAL HG23 H 1 0.590 0.030 . 1 . . . . 26 VAL HG2 . 11095 1 231 . 1 1 26 26 VAL C C 13 174.080 0.300 . 1 . . . . 26 VAL C . 11095 1 232 . 1 1 26 26 VAL CA C 13 58.309 0.300 . 1 . . . . 26 VAL CA . 11095 1 233 . 1 1 26 26 VAL CB C 13 36.503 0.300 . 1 . . . . 26 VAL CB . 11095 1 234 . 1 1 26 26 VAL CG1 C 13 21.810 0.300 . 2 . . . . 26 VAL CG1 . 11095 1 235 . 1 1 26 26 VAL CG2 C 13 18.166 0.300 . 2 . . . . 26 VAL CG2 . 11095 1 236 . 1 1 26 26 VAL N N 15 115.768 0.300 . 1 . . . . 26 VAL N . 11095 1 237 . 1 1 27 27 ASP H H 1 7.248 0.030 . 1 . . . . 27 ASP H . 11095 1 238 . 1 1 27 27 ASP HA H 1 4.118 0.030 . 1 . . . . 27 ASP HA . 11095 1 239 . 1 1 27 27 ASP HB2 H 1 1.552 0.030 . 1 . . . . 27 ASP HB2 . 11095 1 240 . 1 1 27 27 ASP HB3 H 1 1.552 0.030 . 1 . . . . 27 ASP HB3 . 11095 1 241 . 1 1 27 27 ASP C C 13 178.049 0.300 . 1 . . . . 27 ASP C . 11095 1 242 . 1 1 27 27 ASP CA C 13 51.650 0.300 . 1 . . . . 27 ASP CA . 11095 1 243 . 1 1 27 27 ASP CB C 13 40.306 0.300 . 1 . . . . 27 ASP CB . 11095 1 244 . 1 1 27 27 ASP N N 15 117.434 0.300 . 1 . . . . 27 ASP N . 11095 1 245 . 1 1 28 28 ASP H H 1 6.969 0.030 . 1 . . . . 28 ASP H . 11095 1 246 . 1 1 28 28 ASP HA H 1 4.158 0.030 . 1 . . . . 28 ASP HA . 11095 1 247 . 1 1 28 28 ASP HB2 H 1 2.617 0.030 . 2 . . . . 28 ASP HB2 . 11095 1 248 . 1 1 28 28 ASP HB3 H 1 2.695 0.030 . 2 . . . . 28 ASP HB3 . 11095 1 249 . 1 1 28 28 ASP C C 13 177.121 0.300 . 1 . . . . 28 ASP C . 11095 1 250 . 1 1 28 28 ASP CA C 13 57.009 0.300 . 1 . . . . 28 ASP CA . 11095 1 251 . 1 1 28 28 ASP CB C 13 41.510 0.300 . 1 . . . . 28 ASP CB . 11095 1 252 . 1 1 28 28 ASP N N 15 114.173 0.300 . 1 . . . . 28 ASP N . 11095 1 253 . 1 1 29 29 GLU H H 1 8.015 0.030 . 1 . . . . 29 GLU H . 11095 1 254 . 1 1 29 29 GLU HA H 1 4.367 0.030 . 1 . . . . 29 GLU HA . 11095 1 255 . 1 1 29 29 GLU HB2 H 1 2.217 0.030 . 2 . . . . 29 GLU HB2 . 11095 1 256 . 1 1 29 29 GLU HB3 H 1 1.918 0.030 . 2 . . . . 29 GLU HB3 . 11095 1 257 . 1 1 29 29 GLU HG2 H 1 2.139 0.030 . 2 . . . . 29 GLU HG2 . 11095 1 258 . 1 1 29 29 GLU HG3 H 1 2.157 0.030 . 2 . . . . 29 GLU HG3 . 11095 1 259 . 1 1 29 29 GLU C C 13 176.520 0.300 . 1 . . . . 29 GLU C . 11095 1 260 . 1 1 29 29 GLU CA C 13 55.432 0.300 . 1 . . . . 29 GLU CA . 11095 1 261 . 1 1 29 29 GLU CB C 13 30.084 0.300 . 1 . . . . 29 GLU CB . 11095 1 262 . 1 1 29 29 GLU CG C 13 36.680 0.300 . 1 . . . . 29 GLU CG . 11095 1 263 . 1 1 29 29 GLU N N 15 117.785 0.300 . 1 . . . . 29 GLU N . 11095 1 264 . 1 1 30 30 GLY H H 1 7.771 0.030 . 1 . . . . 30 GLY H . 11095 1 265 . 1 1 30 30 GLY HA2 H 1 3.282 0.030 . 2 . . . . 30 GLY HA2 . 11095 1 266 . 1 1 30 30 GLY HA3 H 1 4.079 0.030 . 2 . . . . 30 GLY HA3 . 11095 1 267 . 1 1 30 30 GLY C C 13 173.753 0.300 . 1 . . . . 30 GLY C . 11095 1 268 . 1 1 30 30 GLY CA C 13 45.446 0.300 . 1 . . . . 30 GLY CA . 11095 1 269 . 1 1 30 30 GLY N N 15 108.713 0.300 . 1 . . . . 30 GLY N . 11095 1 270 . 1 1 31 31 VAL H H 1 8.449 0.030 . 1 . . . . 31 VAL H . 11095 1 271 . 1 1 31 31 VAL HA H 1 3.551 0.030 . 1 . . . . 31 VAL HA . 11095 1 272 . 1 1 31 31 VAL HB H 1 1.998 0.030 . 1 . . . . 31 VAL HB . 11095 1 273 . 1 1 31 31 VAL HG11 H 1 0.844 0.030 . 1 . . . . 31 VAL HG1 . 11095 1 274 . 1 1 31 31 VAL HG12 H 1 0.844 0.030 . 1 . . . . 31 VAL HG1 . 11095 1 275 . 1 1 31 31 VAL HG13 H 1 0.844 0.030 . 1 . . . . 31 VAL HG1 . 11095 1 276 . 1 1 31 31 VAL HG21 H 1 0.803 0.030 . 1 . . . . 31 VAL HG2 . 11095 1 277 . 1 1 31 31 VAL HG22 H 1 0.803 0.030 . 1 . . . . 31 VAL HG2 . 11095 1 278 . 1 1 31 31 VAL HG23 H 1 0.803 0.030 . 1 . . . . 31 VAL HG2 . 11095 1 279 . 1 1 31 31 VAL C C 13 175.805 0.300 . 1 . . . . 31 VAL C . 11095 1 280 . 1 1 31 31 VAL CA C 13 63.897 0.300 . 1 . . . . 31 VAL CA . 11095 1 281 . 1 1 31 31 VAL CB C 13 30.688 0.300 . 1 . . . . 31 VAL CB . 11095 1 282 . 1 1 31 31 VAL CG1 C 13 22.942 0.300 . 2 . . . . 31 VAL CG1 . 11095 1 283 . 1 1 31 31 VAL CG2 C 13 21.181 0.300 . 2 . . . . 31 VAL CG2 . 11095 1 284 . 1 1 31 31 VAL N N 15 125.325 0.300 . 1 . . . . 31 VAL N . 11095 1 285 . 1 1 32 32 GLU H H 1 8.166 0.030 . 1 . . . . 32 GLU H . 11095 1 286 . 1 1 32 32 GLU HA H 1 4.038 0.030 . 1 . . . . 32 GLU HA . 11095 1 287 . 1 1 32 32 GLU HB2 H 1 2.003 0.030 . 2 . . . . 32 GLU HB2 . 11095 1 288 . 1 1 32 32 GLU HB3 H 1 1.889 0.030 . 2 . . . . 32 GLU HB3 . 11095 1 289 . 1 1 32 32 GLU HG2 H 1 1.947 0.030 . 2 . . . . 32 GLU HG2 . 11095 1 290 . 1 1 32 32 GLU HG3 H 1 2.492 0.030 . 2 . . . . 32 GLU HG3 . 11095 1 291 . 1 1 32 32 GLU C C 13 176.501 0.300 . 1 . . . . 32 GLU C . 11095 1 292 . 1 1 32 32 GLU CA C 13 57.487 0.300 . 1 . . . . 32 GLU CA . 11095 1 293 . 1 1 32 32 GLU CB C 13 30.113 0.300 . 1 . . . . 32 GLU CB . 11095 1 294 . 1 1 32 32 GLU CG C 13 37.265 0.300 . 1 . . . . 32 GLU CG . 11095 1 295 . 1 1 32 32 GLU N N 15 123.706 0.300 . 1 . . . . 32 GLU N . 11095 1 296 . 1 1 33 33 LEU H H 1 8.752 0.030 . 1 . . . . 33 LEU H . 11095 1 297 . 1 1 33 33 LEU HA H 1 4.566 0.030 . 1 . . . . 33 LEU HA . 11095 1 298 . 1 1 33 33 LEU HB2 H 1 1.675 0.030 . 2 . . . . 33 LEU HB2 . 11095 1 299 . 1 1 33 33 LEU HB3 H 1 1.601 0.030 . 2 . . . . 33 LEU HB3 . 11095 1 300 . 1 1 33 33 LEU HD11 H 1 0.770 0.030 . 1 . . . . 33 LEU HD1 . 11095 1 301 . 1 1 33 33 LEU HD12 H 1 0.770 0.030 . 1 . . . . 33 LEU HD1 . 11095 1 302 . 1 1 33 33 LEU HD13 H 1 0.770 0.030 . 1 . . . . 33 LEU HD1 . 11095 1 303 . 1 1 33 33 LEU HD21 H 1 0.729 0.030 . 1 . . . . 33 LEU HD2 . 11095 1 304 . 1 1 33 33 LEU HD22 H 1 0.729 0.030 . 1 . . . . 33 LEU HD2 . 11095 1 305 . 1 1 33 33 LEU HD23 H 1 0.729 0.030 . 1 . . . . 33 LEU HD2 . 11095 1 306 . 1 1 33 33 LEU HG H 1 1.602 0.030 . 1 . . . . 33 LEU HG . 11095 1 307 . 1 1 33 33 LEU C C 13 176.701 0.300 . 1 . . . . 33 LEU C . 11095 1 308 . 1 1 33 33 LEU CA C 13 53.631 0.300 . 1 . . . . 33 LEU CA . 11095 1 309 . 1 1 33 33 LEU CB C 13 41.375 0.300 . 1 . . . . 33 LEU CB . 11095 1 310 . 1 1 33 33 LEU CD1 C 13 27.105 0.300 . 2 . . . . 33 LEU CD1 . 11095 1 311 . 1 1 33 33 LEU CD2 C 13 22.879 0.300 . 2 . . . . 33 LEU CD2 . 11095 1 312 . 1 1 33 33 LEU CG C 13 26.682 0.300 . 1 . . . . 33 LEU CG . 11095 1 313 . 1 1 33 33 LEU N N 15 126.952 0.300 . 1 . . . . 33 LEU N . 11095 1 314 . 1 1 34 34 GLY H H 1 8.358 0.030 . 1 . . . . 34 GLY H . 11095 1 315 . 1 1 34 34 GLY HA2 H 1 4.275 0.030 . 2 . . . . 34 GLY HA2 . 11095 1 316 . 1 1 34 34 GLY HA3 H 1 3.969 0.030 . 2 . . . . 34 GLY HA3 . 11095 1 317 . 1 1 34 34 GLY C C 13 173.276 0.300 . 1 . . . . 34 GLY C . 11095 1 318 . 1 1 34 34 GLY CA C 13 45.814 0.300 . 1 . . . . 34 GLY CA . 11095 1 319 . 1 1 34 34 GLY N N 15 109.853 0.300 . 1 . . . . 34 GLY N . 11095 1 320 . 1 1 35 35 SER H H 1 8.784 0.030 . 1 . . . . 35 SER H . 11095 1 321 . 1 1 35 35 SER HA H 1 5.606 0.030 . 1 . . . . 35 SER HA . 11095 1 322 . 1 1 35 35 SER HB2 H 1 4.136 0.030 . 2 . . . . 35 SER HB2 . 11095 1 323 . 1 1 35 35 SER HB3 H 1 3.993 0.030 . 2 . . . . 35 SER HB3 . 11095 1 324 . 1 1 35 35 SER C C 13 173.742 0.300 . 1 . . . . 35 SER C . 11095 1 325 . 1 1 35 35 SER CA C 13 57.705 0.300 . 1 . . . . 35 SER CA . 11095 1 326 . 1 1 35 35 SER CB C 13 66.201 0.300 . 1 . . . . 35 SER CB . 11095 1 327 . 1 1 35 35 SER N N 15 117.517 0.300 . 1 . . . . 35 SER N . 11095 1 328 . 1 1 36 36 GLY H H 1 8.758 0.030 . 1 . . . . 36 GLY H . 11095 1 329 . 1 1 36 36 GLY HA2 H 1 4.391 0.030 . 2 . . . . 36 GLY HA2 . 11095 1 330 . 1 1 36 36 GLY HA3 H 1 4.221 0.030 . 2 . . . . 36 GLY HA3 . 11095 1 331 . 1 1 36 36 GLY C C 13 172.099 0.300 . 1 . . . . 36 GLY C . 11095 1 332 . 1 1 36 36 GLY CA C 13 45.978 0.300 . 1 . . . . 36 GLY CA . 11095 1 333 . 1 1 36 36 GLY N N 15 107.281 0.300 . 1 . . . . 36 GLY N . 11095 1 334 . 1 1 37 37 VAL H H 1 8.477 0.030 . 1 . . . . 37 VAL H . 11095 1 335 . 1 1 37 37 VAL HA H 1 4.950 0.030 . 1 . . . . 37 VAL HA . 11095 1 336 . 1 1 37 37 VAL HB H 1 1.958 0.030 . 1 . . . . 37 VAL HB . 11095 1 337 . 1 1 37 37 VAL HG11 H 1 0.728 0.030 . 1 . . . . 37 VAL HG1 . 11095 1 338 . 1 1 37 37 VAL HG12 H 1 0.728 0.030 . 1 . . . . 37 VAL HG1 . 11095 1 339 . 1 1 37 37 VAL HG13 H 1 0.728 0.030 . 1 . . . . 37 VAL HG1 . 11095 1 340 . 1 1 37 37 VAL HG21 H 1 0.902 0.030 . 1 . . . . 37 VAL HG2 . 11095 1 341 . 1 1 37 37 VAL HG22 H 1 0.902 0.030 . 1 . . . . 37 VAL HG2 . 11095 1 342 . 1 1 37 37 VAL HG23 H 1 0.902 0.030 . 1 . . . . 37 VAL HG2 . 11095 1 343 . 1 1 37 37 VAL C C 13 174.094 0.300 . 1 . . . . 37 VAL C . 11095 1 344 . 1 1 37 37 VAL CA C 13 61.018 0.300 . 1 . . . . 37 VAL CA . 11095 1 345 . 1 1 37 37 VAL CB C 13 35.596 0.300 . 1 . . . . 37 VAL CB . 11095 1 346 . 1 1 37 37 VAL CG1 C 13 21.532 0.300 . 2 . . . . 37 VAL CG1 . 11095 1 347 . 1 1 37 37 VAL CG2 C 13 21.676 0.300 . 2 . . . . 37 VAL CG2 . 11095 1 348 . 1 1 37 37 VAL N N 15 122.638 0.300 . 1 . . . . 37 VAL N . 11095 1 349 . 1 1 38 38 MET H H 1 9.989 0.030 . 1 . . . . 38 MET H . 11095 1 350 . 1 1 38 38 MET HA H 1 5.298 0.030 . 1 . . . . 38 MET HA . 11095 1 351 . 1 1 38 38 MET HB2 H 1 2.020 0.030 . 2 . . . . 38 MET HB2 . 11095 1 352 . 1 1 38 38 MET HB3 H 1 1.592 0.030 . 2 . . . . 38 MET HB3 . 11095 1 353 . 1 1 38 38 MET HE1 H 1 1.387 0.030 . 1 . . . . 38 MET HE . 11095 1 354 . 1 1 38 38 MET HE2 H 1 1.387 0.030 . 1 . . . . 38 MET HE . 11095 1 355 . 1 1 38 38 MET HE3 H 1 1.387 0.030 . 1 . . . . 38 MET HE . 11095 1 356 . 1 1 38 38 MET HG2 H 1 2.097 0.030 . 2 . . . . 38 MET HG2 . 11095 1 357 . 1 1 38 38 MET HG3 H 1 1.999 0.030 . 2 . . . . 38 MET HG3 . 11095 1 358 . 1 1 38 38 MET C C 13 173.289 0.300 . 1 . . . . 38 MET C . 11095 1 359 . 1 1 38 38 MET CA C 13 53.842 0.300 . 1 . . . . 38 MET CA . 11095 1 360 . 1 1 38 38 MET CB C 13 36.053 0.300 . 1 . . . . 38 MET CB . 11095 1 361 . 1 1 38 38 MET CE C 13 17.251 0.300 . 1 . . . . 38 MET CE . 11095 1 362 . 1 1 38 38 MET CG C 13 32.638 0.300 . 1 . . . . 38 MET CG . 11095 1 363 . 1 1 38 38 MET N N 15 130.089 0.300 . 1 . . . . 38 MET N . 11095 1 364 . 1 1 39 39 GLU H H 1 10.309 0.030 . 1 . . . . 39 GLU H . 11095 1 365 . 1 1 39 39 GLU HA H 1 5.601 0.030 . 1 . . . . 39 GLU HA . 11095 1 366 . 1 1 39 39 GLU HB2 H 1 2.323 0.030 . 2 . . . . 39 GLU HB2 . 11095 1 367 . 1 1 39 39 GLU HB3 H 1 1.664 0.030 . 2 . . . . 39 GLU HB3 . 11095 1 368 . 1 1 39 39 GLU HG2 H 1 1.990 0.030 . 2 . . . . 39 GLU HG2 . 11095 1 369 . 1 1 39 39 GLU HG3 H 1 2.178 0.030 . 2 . . . . 39 GLU HG3 . 11095 1 370 . 1 1 39 39 GLU C C 13 174.267 0.300 . 1 . . . . 39 GLU C . 11095 1 371 . 1 1 39 39 GLU CA C 13 53.493 0.300 . 1 . . . . 39 GLU CA . 11095 1 372 . 1 1 39 39 GLU CB C 13 33.730 0.300 . 1 . . . . 39 GLU CB . 11095 1 373 . 1 1 39 39 GLU CG C 13 35.772 0.300 . 1 . . . . 39 GLU CG . 11095 1 374 . 1 1 39 39 GLU N N 15 131.059 0.300 . 1 . . . . 39 GLU N . 11095 1 375 . 1 1 40 40 LEU H H 1 8.555 0.030 . 1 . . . . 40 LEU H . 11095 1 376 . 1 1 40 40 LEU HA H 1 5.002 0.030 . 1 . . . . 40 LEU HA . 11095 1 377 . 1 1 40 40 LEU HB2 H 1 1.538 0.030 . 2 . . . . 40 LEU HB2 . 11095 1 378 . 1 1 40 40 LEU HB3 H 1 1.802 0.030 . 2 . . . . 40 LEU HB3 . 11095 1 379 . 1 1 40 40 LEU HD11 H 1 0.736 0.030 . 1 . . . . 40 LEU HD1 . 11095 1 380 . 1 1 40 40 LEU HD12 H 1 0.736 0.030 . 1 . . . . 40 LEU HD1 . 11095 1 381 . 1 1 40 40 LEU HD13 H 1 0.736 0.030 . 1 . . . . 40 LEU HD1 . 11095 1 382 . 1 1 40 40 LEU HD21 H 1 0.720 0.030 . 1 . . . . 40 LEU HD2 . 11095 1 383 . 1 1 40 40 LEU HD22 H 1 0.720 0.030 . 1 . . . . 40 LEU HD2 . 11095 1 384 . 1 1 40 40 LEU HD23 H 1 0.720 0.030 . 1 . . . . 40 LEU HD2 . 11095 1 385 . 1 1 40 40 LEU HG H 1 1.821 0.030 . 1 . . . . 40 LEU HG . 11095 1 386 . 1 1 40 40 LEU C C 13 177.234 0.300 . 1 . . . . 40 LEU C . 11095 1 387 . 1 1 40 40 LEU CA C 13 55.802 0.300 . 1 . . . . 40 LEU CA . 11095 1 388 . 1 1 40 40 LEU CB C 13 41.621 0.300 . 1 . . . . 40 LEU CB . 11095 1 389 . 1 1 40 40 LEU CD1 C 13 25.152 0.300 . 2 . . . . 40 LEU CD1 . 11095 1 390 . 1 1 40 40 LEU CD2 C 13 26.445 0.300 . 2 . . . . 40 LEU CD2 . 11095 1 391 . 1 1 40 40 LEU CG C 13 30.742 0.300 . 1 . . . . 40 LEU CG . 11095 1 392 . 1 1 40 40 LEU N N 15 129.195 0.300 . 1 . . . . 40 LEU N . 11095 1 393 . 1 1 41 41 THR H H 1 8.288 0.030 . 1 . . . . 41 THR H . 11095 1 394 . 1 1 41 41 THR HA H 1 4.932 0.030 . 1 . . . . 41 THR HA . 11095 1 395 . 1 1 41 41 THR HB H 1 4.853 0.030 . 1 . . . . 41 THR HB . 11095 1 396 . 1 1 41 41 THR HG21 H 1 1.154 0.030 . 1 . . . . 41 THR HG2 . 11095 1 397 . 1 1 41 41 THR HG22 H 1 1.154 0.030 . 1 . . . . 41 THR HG2 . 11095 1 398 . 1 1 41 41 THR HG23 H 1 1.154 0.030 . 1 . . . . 41 THR HG2 . 11095 1 399 . 1 1 41 41 THR C C 13 174.733 0.300 . 1 . . . . 41 THR C . 11095 1 400 . 1 1 41 41 THR CA C 13 59.563 0.300 . 1 . . . . 41 THR CA . 11095 1 401 . 1 1 41 41 THR CB C 13 70.147 0.300 . 1 . . . . 41 THR CB . 11095 1 402 . 1 1 41 41 THR CG2 C 13 21.563 0.300 . 1 . . . . 41 THR CG2 . 11095 1 403 . 1 1 41 41 THR N N 15 114.443 0.300 . 1 . . . . 41 THR N . 11095 1 404 . 1 1 42 42 GLN H H 1 8.698 0.030 . 1 . . . . 42 GLN H . 11095 1 405 . 1 1 42 42 GLN HA H 1 4.292 0.030 . 1 . . . . 42 GLN HA . 11095 1 406 . 1 1 42 42 GLN HB2 H 1 2.172 0.030 . 1 . . . . 42 GLN HB2 . 11095 1 407 . 1 1 42 42 GLN HB3 H 1 2.172 0.030 . 1 . . . . 42 GLN HB3 . 11095 1 408 . 1 1 42 42 GLN HE21 H 1 7.522 0.030 . 2 . . . . 42 GLN HE21 . 11095 1 409 . 1 1 42 42 GLN HE22 H 1 6.862 0.030 . 2 . . . . 42 GLN HE22 . 11095 1 410 . 1 1 42 42 GLN HG2 H 1 2.486 0.030 . 2 . . . . 42 GLN HG2 . 11095 1 411 . 1 1 42 42 GLN HG3 H 1 2.519 0.030 . 2 . . . . 42 GLN HG3 . 11095 1 412 . 1 1 42 42 GLN C C 13 176.603 0.300 . 1 . . . . 42 GLN C . 11095 1 413 . 1 1 42 42 GLN CA C 13 59.176 0.300 . 1 . . . . 42 GLN CA . 11095 1 414 . 1 1 42 42 GLN CB C 13 28.452 0.300 . 1 . . . . 42 GLN CB . 11095 1 415 . 1 1 42 42 GLN CG C 13 34.059 0.300 . 1 . . . . 42 GLN CG . 11095 1 416 . 1 1 42 42 GLN N N 15 117.586 0.300 . 1 . . . . 42 GLN N . 11095 1 417 . 1 1 42 42 GLN NE2 N 15 112.362 0.300 . 1 . . . . 42 GLN NE2 . 11095 1 418 . 1 1 43 43 SER H H 1 7.927 0.030 . 1 . . . . 43 SER H . 11095 1 419 . 1 1 43 43 SER HA H 1 4.652 0.030 . 1 . . . . 43 SER HA . 11095 1 420 . 1 1 43 43 SER HB2 H 1 3.807 0.030 . 2 . . . . 43 SER HB2 . 11095 1 421 . 1 1 43 43 SER HB3 H 1 3.639 0.030 . 2 . . . . 43 SER HB3 . 11095 1 422 . 1 1 43 43 SER C C 13 173.641 0.300 . 1 . . . . 43 SER C . 11095 1 423 . 1 1 43 43 SER CA C 13 58.720 0.300 . 1 . . . . 43 SER CA . 11095 1 424 . 1 1 43 43 SER CB C 13 66.147 0.300 . 1 . . . . 43 SER CB . 11095 1 425 . 1 1 43 43 SER N N 15 106.838 0.300 . 1 . . . . 43 SER N . 11095 1 426 . 1 1 44 44 GLU H H 1 7.184 0.030 . 1 . . . . 44 GLU H . 11095 1 427 . 1 1 44 44 GLU HA H 1 4.142 0.030 . 1 . . . . 44 GLU HA . 11095 1 428 . 1 1 44 44 GLU HB2 H 1 1.610 0.030 . 2 . . . . 44 GLU HB2 . 11095 1 429 . 1 1 44 44 GLU HB3 H 1 1.384 0.030 . 2 . . . . 44 GLU HB3 . 11095 1 430 . 1 1 44 44 GLU HG2 H 1 1.729 0.030 . 2 . . . . 44 GLU HG2 . 11095 1 431 . 1 1 44 44 GLU HG3 H 1 1.845 0.030 . 2 . . . . 44 GLU HG3 . 11095 1 432 . 1 1 44 44 GLU C C 13 173.690 0.300 . 1 . . . . 44 GLU C . 11095 1 433 . 1 1 44 44 GLU CA C 13 55.138 0.300 . 1 . . . . 44 GLU CA . 11095 1 434 . 1 1 44 44 GLU CB C 13 33.892 0.300 . 1 . . . . 44 GLU CB . 11095 1 435 . 1 1 44 44 GLU CG C 13 35.374 0.300 . 1 . . . . 44 GLU CG . 11095 1 436 . 1 1 44 44 GLU N N 15 120.778 0.300 . 1 . . . . 44 GLU N . 11095 1 437 . 1 1 45 45 LEU H H 1 8.278 0.030 . 1 . . . . 45 LEU H . 11095 1 438 . 1 1 45 45 LEU HA H 1 4.874 0.030 . 1 . . . . 45 LEU HA . 11095 1 439 . 1 1 45 45 LEU HB2 H 1 1.852 0.030 . 2 . . . . 45 LEU HB2 . 11095 1 440 . 1 1 45 45 LEU HB3 H 1 1.767 0.030 . 2 . . . . 45 LEU HB3 . 11095 1 441 . 1 1 45 45 LEU HD11 H 1 0.294 0.030 . 1 . . . . 45 LEU HD1 . 11095 1 442 . 1 1 45 45 LEU HD12 H 1 0.294 0.030 . 1 . . . . 45 LEU HD1 . 11095 1 443 . 1 1 45 45 LEU HD13 H 1 0.294 0.030 . 1 . . . . 45 LEU HD1 . 11095 1 444 . 1 1 45 45 LEU HD21 H 1 0.677 0.030 . 1 . . . . 45 LEU HD2 . 11095 1 445 . 1 1 45 45 LEU HD22 H 1 0.677 0.030 . 1 . . . . 45 LEU HD2 . 11095 1 446 . 1 1 45 45 LEU HD23 H 1 0.677 0.030 . 1 . . . . 45 LEU HD2 . 11095 1 447 . 1 1 45 45 LEU HG H 1 1.665 0.030 . 1 . . . . 45 LEU HG . 11095 1 448 . 1 1 45 45 LEU C C 13 176.027 0.300 . 1 . . . . 45 LEU C . 11095 1 449 . 1 1 45 45 LEU CA C 13 54.610 0.300 . 1 . . . . 45 LEU CA . 11095 1 450 . 1 1 45 45 LEU CB C 13 44.252 0.300 . 1 . . . . 45 LEU CB . 11095 1 451 . 1 1 45 45 LEU CD1 C 13 25.934 0.300 . 2 . . . . 45 LEU CD1 . 11095 1 452 . 1 1 45 45 LEU CD2 C 13 24.755 0.300 . 2 . . . . 45 LEU CD2 . 11095 1 453 . 1 1 45 45 LEU CG C 13 27.318 0.300 . 1 . . . . 45 LEU CG . 11095 1 454 . 1 1 45 45 LEU N N 15 121.692 0.300 . 1 . . . . 45 LEU N . 11095 1 455 . 1 1 46 46 VAL H H 1 9.334 0.030 . 1 . . . . 46 VAL H . 11095 1 456 . 1 1 46 46 VAL HA H 1 4.541 0.030 . 1 . . . . 46 VAL HA . 11095 1 457 . 1 1 46 46 VAL HB H 1 1.967 0.030 . 1 . . . . 46 VAL HB . 11095 1 458 . 1 1 46 46 VAL HG11 H 1 0.252 0.030 . 1 . . . . 46 VAL HG1 . 11095 1 459 . 1 1 46 46 VAL HG12 H 1 0.252 0.030 . 1 . . . . 46 VAL HG1 . 11095 1 460 . 1 1 46 46 VAL HG13 H 1 0.252 0.030 . 1 . . . . 46 VAL HG1 . 11095 1 461 . 1 1 46 46 VAL HG21 H 1 0.728 0.030 . 1 . . . . 46 VAL HG2 . 11095 1 462 . 1 1 46 46 VAL HG22 H 1 0.728 0.030 . 1 . . . . 46 VAL HG2 . 11095 1 463 . 1 1 46 46 VAL HG23 H 1 0.728 0.030 . 1 . . . . 46 VAL HG2 . 11095 1 464 . 1 1 46 46 VAL C C 13 173.746 0.300 . 1 . . . . 46 VAL C . 11095 1 465 . 1 1 46 46 VAL CA C 13 61.483 0.300 . 1 . . . . 46 VAL CA . 11095 1 466 . 1 1 46 46 VAL CB C 13 34.113 0.300 . 1 . . . . 46 VAL CB . 11095 1 467 . 1 1 46 46 VAL CG1 C 13 20.919 0.300 . 2 . . . . 46 VAL CG1 . 11095 1 468 . 1 1 46 46 VAL CG2 C 13 21.542 0.300 . 2 . . . . 46 VAL CG2 . 11095 1 469 . 1 1 46 46 VAL N N 15 124.918 0.300 . 1 . . . . 46 VAL N . 11095 1 470 . 1 1 47 47 LEU H H 1 9.660 0.030 . 1 . . . . 47 LEU H . 11095 1 471 . 1 1 47 47 LEU HA H 1 5.067 0.030 . 1 . . . . 47 LEU HA . 11095 1 472 . 1 1 47 47 LEU HB2 H 1 1.313 0.030 . 2 . . . . 47 LEU HB2 . 11095 1 473 . 1 1 47 47 LEU HB3 H 1 2.164 0.030 . 2 . . . . 47 LEU HB3 . 11095 1 474 . 1 1 47 47 LEU HD11 H 1 1.182 0.030 . 1 . . . . 47 LEU HD1 . 11095 1 475 . 1 1 47 47 LEU HD12 H 1 1.182 0.030 . 1 . . . . 47 LEU HD1 . 11095 1 476 . 1 1 47 47 LEU HD13 H 1 1.182 0.030 . 1 . . . . 47 LEU HD1 . 11095 1 477 . 1 1 47 47 LEU HD21 H 1 0.632 0.030 . 1 . . . . 47 LEU HD2 . 11095 1 478 . 1 1 47 47 LEU HD22 H 1 0.632 0.030 . 1 . . . . 47 LEU HD2 . 11095 1 479 . 1 1 47 47 LEU HD23 H 1 0.632 0.030 . 1 . . . . 47 LEU HD2 . 11095 1 480 . 1 1 47 47 LEU HG H 1 1.404 0.030 . 1 . . . . 47 LEU HG . 11095 1 481 . 1 1 47 47 LEU C C 13 174.264 0.300 . 1 . . . . 47 LEU C . 11095 1 482 . 1 1 47 47 LEU CA C 13 53.143 0.300 . 1 . . . . 47 LEU CA . 11095 1 483 . 1 1 47 47 LEU CB C 13 45.333 0.300 . 1 . . . . 47 LEU CB . 11095 1 484 . 1 1 47 47 LEU CD1 C 13 29.191 0.300 . 2 . . . . 47 LEU CD1 . 11095 1 485 . 1 1 47 47 LEU CD2 C 13 22.809 0.300 . 2 . . . . 47 LEU CD2 . 11095 1 486 . 1 1 47 47 LEU CG C 13 27.562 0.300 . 1 . . . . 47 LEU CG . 11095 1 487 . 1 1 47 47 LEU N N 15 128.953 0.300 . 1 . . . . 47 LEU N . 11095 1 488 . 1 1 48 48 HIS H H 1 9.412 0.030 . 1 . . . . 48 HIS H . 11095 1 489 . 1 1 48 48 HIS HA H 1 4.642 0.030 . 1 . . . . 48 HIS HA . 11095 1 490 . 1 1 48 48 HIS HB2 H 1 2.975 0.030 . 2 . . . . 48 HIS HB2 . 11095 1 491 . 1 1 48 48 HIS HB3 H 1 3.194 0.030 . 2 . . . . 48 HIS HB3 . 11095 1 492 . 1 1 48 48 HIS HD2 H 1 6.873 0.030 . 1 . . . . 48 HIS HD2 . 11095 1 493 . 1 1 48 48 HIS HE1 H 1 7.670 0.030 . 1 . . . . 48 HIS HE1 . 11095 1 494 . 1 1 48 48 HIS C C 13 176.340 0.300 . 1 . . . . 48 HIS C . 11095 1 495 . 1 1 48 48 HIS CA C 13 55.432 0.300 . 1 . . . . 48 HIS CA . 11095 1 496 . 1 1 48 48 HIS CB C 13 30.935 0.300 . 1 . . . . 48 HIS CB . 11095 1 497 . 1 1 48 48 HIS CD2 C 13 118.438 0.300 . 1 . . . . 48 HIS CD2 . 11095 1 498 . 1 1 48 48 HIS CE1 C 13 138.505 0.300 . 1 . . . . 48 HIS CE1 . 11095 1 499 . 1 1 48 48 HIS N N 15 127.701 0.300 . 1 . . . . 48 HIS N . 11095 1 500 . 1 1 49 49 LEU H H 1 8.707 0.030 . 1 . . . . 49 LEU H . 11095 1 501 . 1 1 49 49 LEU HA H 1 4.712 0.030 . 1 . . . . 49 LEU HA . 11095 1 502 . 1 1 49 49 LEU HB2 H 1 1.617 0.030 . 2 . . . . 49 LEU HB2 . 11095 1 503 . 1 1 49 49 LEU HB3 H 1 1.502 0.030 . 2 . . . . 49 LEU HB3 . 11095 1 504 . 1 1 49 49 LEU HD11 H 1 0.939 0.030 . 1 . . . . 49 LEU HD1 . 11095 1 505 . 1 1 49 49 LEU HD12 H 1 0.939 0.030 . 1 . . . . 49 LEU HD1 . 11095 1 506 . 1 1 49 49 LEU HD13 H 1 0.939 0.030 . 1 . . . . 49 LEU HD1 . 11095 1 507 . 1 1 49 49 LEU HD21 H 1 0.905 0.030 . 1 . . . . 49 LEU HD2 . 11095 1 508 . 1 1 49 49 LEU HD22 H 1 0.905 0.030 . 1 . . . . 49 LEU HD2 . 11095 1 509 . 1 1 49 49 LEU HD23 H 1 0.905 0.030 . 1 . . . . 49 LEU HD2 . 11095 1 510 . 1 1 49 49 LEU HG H 1 1.582 0.030 . 1 . . . . 49 LEU HG . 11095 1 511 . 1 1 49 49 LEU C C 13 176.545 0.300 . 1 . . . . 49 LEU C . 11095 1 512 . 1 1 49 49 LEU CA C 13 53.870 0.300 . 1 . . . . 49 LEU CA . 11095 1 513 . 1 1 49 49 LEU CB C 13 44.581 0.300 . 1 . . . . 49 LEU CB . 11095 1 514 . 1 1 49 49 LEU CD1 C 13 25.893 0.300 . 2 . . . . 49 LEU CD1 . 11095 1 515 . 1 1 49 49 LEU CD2 C 13 23.038 0.300 . 2 . . . . 49 LEU CD2 . 11095 1 516 . 1 1 49 49 LEU CG C 13 26.992 0.300 . 1 . . . . 49 LEU CG . 11095 1 517 . 1 1 49 49 LEU N N 15 127.139 0.300 . 1 . . . . 49 LEU N . 11095 1 518 . 1 1 50 50 HIS H H 1 8.696 0.030 . 1 . . . . 50 HIS H . 11095 1 519 . 1 1 50 50 HIS HA H 1 4.522 0.030 . 1 . . . . 50 HIS HA . 11095 1 520 . 1 1 50 50 HIS HB2 H 1 3.133 0.030 . 1 . . . . 50 HIS HB2 . 11095 1 521 . 1 1 50 50 HIS HB3 H 1 3.133 0.030 . 1 . . . . 50 HIS HB3 . 11095 1 522 . 1 1 50 50 HIS HD2 H 1 7.074 0.030 . 1 . . . . 50 HIS HD2 . 11095 1 523 . 1 1 50 50 HIS HE1 H 1 7.781 0.030 . 1 . . . . 50 HIS HE1 . 11095 1 524 . 1 1 50 50 HIS C C 13 176.100 0.300 . 1 . . . . 50 HIS C . 11095 1 525 . 1 1 50 50 HIS CA C 13 57.980 0.300 . 1 . . . . 50 HIS CA . 11095 1 526 . 1 1 50 50 HIS CB C 13 31.009 0.300 . 1 . . . . 50 HIS CB . 11095 1 527 . 1 1 50 50 HIS CD2 C 13 119.651 0.300 . 1 . . . . 50 HIS CD2 . 11095 1 528 . 1 1 50 50 HIS CE1 C 13 138.642 0.300 . 1 . . . . 50 HIS CE1 . 11095 1 529 . 1 1 50 50 HIS N N 15 121.891 0.300 . 1 . . . . 50 HIS N . 11095 1 530 . 1 1 51 51 ARG H H 1 8.827 0.030 . 1 . . . . 51 ARG H . 11095 1 531 . 1 1 51 51 ARG HA H 1 3.814 0.030 . 1 . . . . 51 ARG HA . 11095 1 532 . 1 1 51 51 ARG HB2 H 1 1.982 0.030 . 2 . . . . 51 ARG HB2 . 11095 1 533 . 1 1 51 51 ARG HB3 H 1 1.788 0.030 . 2 . . . . 51 ARG HB3 . 11095 1 534 . 1 1 51 51 ARG HD2 H 1 3.096 0.030 . 1 . . . . 51 ARG HD2 . 11095 1 535 . 1 1 51 51 ARG HD3 H 1 3.096 0.030 . 1 . . . . 51 ARG HD3 . 11095 1 536 . 1 1 51 51 ARG HG2 H 1 1.211 0.030 . 2 . . . . 51 ARG HG2 . 11095 1 537 . 1 1 51 51 ARG HG3 H 1 0.984 0.030 . 2 . . . . 51 ARG HG3 . 11095 1 538 . 1 1 51 51 ARG CA C 13 57.504 0.300 . 1 . . . . 51 ARG CA . 11095 1 539 . 1 1 51 51 ARG CB C 13 28.107 0.300 . 1 . . . . 51 ARG CB . 11095 1 540 . 1 1 51 51 ARG CD C 13 43.430 0.300 . 1 . . . . 51 ARG CD . 11095 1 541 . 1 1 51 51 ARG CG C 13 27.338 0.300 . 1 . . . . 51 ARG CG . 11095 1 542 . 1 1 51 51 ARG N N 15 119.507 0.300 . 1 . . . . 51 ARG N . 11095 1 543 . 1 1 52 52 ARG H H 1 7.759 0.030 . 1 . . . . 52 ARG H . 11095 1 544 . 1 1 52 52 ARG HA H 1 4.653 0.030 . 1 . . . . 52 ARG HA . 11095 1 545 . 1 1 52 52 ARG HB2 H 1 1.641 0.030 . 2 . . . . 52 ARG HB2 . 11095 1 546 . 1 1 52 52 ARG HB3 H 1 1.963 0.030 . 2 . . . . 52 ARG HB3 . 11095 1 547 . 1 1 52 52 ARG HD2 H 1 3.231 0.030 . 2 . . . . 52 ARG HD2 . 11095 1 548 . 1 1 52 52 ARG HD3 H 1 3.148 0.030 . 2 . . . . 52 ARG HD3 . 11095 1 549 . 1 1 52 52 ARG HG2 H 1 1.592 0.030 . 2 . . . . 52 ARG HG2 . 11095 1 550 . 1 1 52 52 ARG HG3 H 1 1.645 0.030 . 2 . . . . 52 ARG HG3 . 11095 1 551 . 1 1 52 52 ARG CA C 13 54.774 0.300 . 1 . . . . 52 ARG CA . 11095 1 552 . 1 1 52 52 ARG CB C 13 33.456 0.300 . 1 . . . . 52 ARG CB . 11095 1 553 . 1 1 52 52 ARG CD C 13 43.477 0.300 . 1 . . . . 52 ARG CD . 11095 1 554 . 1 1 52 52 ARG CG C 13 26.942 0.300 . 1 . . . . 52 ARG CG . 11095 1 555 . 1 1 52 52 ARG N N 15 116.796 0.300 . 1 . . . . 52 ARG N . 11095 1 556 . 1 1 53 53 GLU H H 1 8.288 0.030 . 1 . . . . 53 GLU H . 11095 1 557 . 1 1 53 53 GLU HA H 1 4.232 0.030 . 1 . . . . 53 GLU HA . 11095 1 558 . 1 1 53 53 GLU HB2 H 1 1.922 0.030 . 2 . . . . 53 GLU HB2 . 11095 1 559 . 1 1 53 53 GLU HB3 H 1 1.982 0.030 . 2 . . . . 53 GLU HB3 . 11095 1 560 . 1 1 53 53 GLU HG2 H 1 2.322 0.030 . 1 . . . . 53 GLU HG2 . 11095 1 561 . 1 1 53 53 GLU HG3 H 1 2.322 0.030 . 1 . . . . 53 GLU HG3 . 11095 1 562 . 1 1 53 53 GLU C C 13 175.741 0.300 . 1 . . . . 53 GLU C . 11095 1 563 . 1 1 53 53 GLU CA C 13 56.377 0.300 . 1 . . . . 53 GLU CA . 11095 1 564 . 1 1 53 53 GLU CB C 13 30.031 0.300 . 1 . . . . 53 GLU CB . 11095 1 565 . 1 1 53 53 GLU CG C 13 36.412 0.300 . 1 . . . . 53 GLU CG . 11095 1 566 . 1 1 53 53 GLU N N 15 120.784 0.300 . 1 . . . . 53 GLU N . 11095 1 567 . 1 1 54 54 ALA H H 1 8.351 0.030 . 1 . . . . 54 ALA H . 11095 1 568 . 1 1 54 54 ALA HA H 1 4.559 0.030 . 1 . . . . 54 ALA HA . 11095 1 569 . 1 1 54 54 ALA HB1 H 1 0.996 0.030 . 1 . . . . 54 ALA HB . 11095 1 570 . 1 1 54 54 ALA HB2 H 1 0.996 0.030 . 1 . . . . 54 ALA HB . 11095 1 571 . 1 1 54 54 ALA HB3 H 1 0.996 0.030 . 1 . . . . 54 ALA HB . 11095 1 572 . 1 1 54 54 ALA C C 13 177.656 0.300 . 1 . . . . 54 ALA C . 11095 1 573 . 1 1 54 54 ALA CA C 13 52.206 0.300 . 1 . . . . 54 ALA CA . 11095 1 574 . 1 1 54 54 ALA CB C 13 19.151 0.300 . 1 . . . . 54 ALA CB . 11095 1 575 . 1 1 54 54 ALA N N 15 124.757 0.300 . 1 . . . . 54 ALA N . 11095 1 576 . 1 1 55 55 VAL H H 1 8.356 0.030 . 1 . . . . 55 VAL H . 11095 1 577 . 1 1 55 55 VAL HA H 1 3.901 0.030 . 1 . . . . 55 VAL HA . 11095 1 578 . 1 1 55 55 VAL HB H 1 1.412 0.030 . 1 . . . . 55 VAL HB . 11095 1 579 . 1 1 55 55 VAL HG11 H 1 -0.262 0.030 . 1 . . . . 55 VAL HG1 . 11095 1 580 . 1 1 55 55 VAL HG12 H 1 -0.262 0.030 . 1 . . . . 55 VAL HG1 . 11095 1 581 . 1 1 55 55 VAL HG13 H 1 -0.262 0.030 . 1 . . . . 55 VAL HG1 . 11095 1 582 . 1 1 55 55 VAL HG21 H 1 0.692 0.030 . 1 . . . . 55 VAL HG2 . 11095 1 583 . 1 1 55 55 VAL HG22 H 1 0.692 0.030 . 1 . . . . 55 VAL HG2 . 11095 1 584 . 1 1 55 55 VAL HG23 H 1 0.692 0.030 . 1 . . . . 55 VAL HG2 . 11095 1 585 . 1 1 55 55 VAL C C 13 173.612 0.300 . 1 . . . . 55 VAL C . 11095 1 586 . 1 1 55 55 VAL CA C 13 61.104 0.300 . 1 . . . . 55 VAL CA . 11095 1 587 . 1 1 55 55 VAL CB C 13 33.586 0.300 . 1 . . . . 55 VAL CB . 11095 1 588 . 1 1 55 55 VAL CG1 C 13 21.540 0.300 . 2 . . . . 55 VAL CG1 . 11095 1 589 . 1 1 55 55 VAL CG2 C 13 21.234 0.300 . 2 . . . . 55 VAL CG2 . 11095 1 590 . 1 1 55 55 VAL N N 15 122.797 0.300 . 1 . . . . 55 VAL N . 11095 1 591 . 1 1 56 56 ARG H H 1 7.662 0.030 . 1 . . . . 56 ARG H . 11095 1 592 . 1 1 56 56 ARG HA H 1 5.263 0.030 . 1 . . . . 56 ARG HA . 11095 1 593 . 1 1 56 56 ARG HB2 H 1 1.473 0.030 . 2 . . . . 56 ARG HB2 . 11095 1 594 . 1 1 56 56 ARG HB3 H 1 1.365 0.030 . 2 . . . . 56 ARG HB3 . 11095 1 595 . 1 1 56 56 ARG HD2 H 1 3.166 0.030 . 2 . . . . 56 ARG HD2 . 11095 1 596 . 1 1 56 56 ARG HD3 H 1 3.012 0.030 . 2 . . . . 56 ARG HD3 . 11095 1 597 . 1 1 56 56 ARG HE H 1 7.541 0.030 . 1 . . . . 56 ARG HE . 11095 1 598 . 1 1 56 56 ARG HG2 H 1 1.254 0.030 . 1 . . . . 56 ARG HG2 . 11095 1 599 . 1 1 56 56 ARG HG3 H 1 1.254 0.030 . 1 . . . . 56 ARG HG3 . 11095 1 600 . 1 1 56 56 ARG C C 13 176.786 0.300 . 1 . . . . 56 ARG C . 11095 1 601 . 1 1 56 56 ARG CA C 13 53.944 0.300 . 1 . . . . 56 ARG CA . 11095 1 602 . 1 1 56 56 ARG CB C 13 33.401 0.300 . 1 . . . . 56 ARG CB . 11095 1 603 . 1 1 56 56 ARG CD C 13 43.149 0.300 . 1 . . . . 56 ARG CD . 11095 1 604 . 1 1 56 56 ARG CG C 13 27.850 0.300 . 1 . . . . 56 ARG CG . 11095 1 605 . 1 1 56 56 ARG N N 15 122.467 0.300 . 1 . . . . 56 ARG N . 11095 1 606 . 1 1 56 56 ARG NE N 15 85.307 0.300 . 1 . . . . 56 ARG NE . 11095 1 607 . 1 1 57 57 TRP H H 1 9.637 0.030 . 1 . . . . 57 TRP H . 11095 1 608 . 1 1 57 57 TRP HA H 1 5.058 0.030 . 1 . . . . 57 TRP HA . 11095 1 609 . 1 1 57 57 TRP HB2 H 1 3.118 0.030 . 2 . . . . 57 TRP HB2 . 11095 1 610 . 1 1 57 57 TRP HB3 H 1 2.549 0.030 . 2 . . . . 57 TRP HB3 . 11095 1 611 . 1 1 57 57 TRP HD1 H 1 7.692 0.030 . 1 . . . . 57 TRP HD1 . 11095 1 612 . 1 1 57 57 TRP HE1 H 1 9.332 0.030 . 1 . . . . 57 TRP HE1 . 11095 1 613 . 1 1 57 57 TRP HE3 H 1 7.422 0.030 . 1 . . . . 57 TRP HE3 . 11095 1 614 . 1 1 57 57 TRP HH2 H 1 6.737 0.030 . 1 . . . . 57 TRP HH2 . 11095 1 615 . 1 1 57 57 TRP HZ2 H 1 6.043 0.030 . 1 . . . . 57 TRP HZ2 . 11095 1 616 . 1 1 57 57 TRP HZ3 H 1 6.750 0.030 . 1 . . . . 57 TRP HZ3 . 11095 1 617 . 1 1 57 57 TRP C C 13 172.588 0.300 . 1 . . . . 57 TRP C . 11095 1 618 . 1 1 57 57 TRP CA C 13 56.037 0.300 . 1 . . . . 57 TRP CA . 11095 1 619 . 1 1 57 57 TRP CB C 13 31.392 0.300 . 1 . . . . 57 TRP CB . 11095 1 620 . 1 1 57 57 TRP CD1 C 13 126.742 0.300 . 1 . . . . 57 TRP CD1 . 11095 1 621 . 1 1 57 57 TRP CE3 C 13 122.153 0.300 . 1 . . . . 57 TRP CE3 . 11095 1 622 . 1 1 57 57 TRP CH2 C 13 123.208 0.300 . 1 . . . . 57 TRP CH2 . 11095 1 623 . 1 1 57 57 TRP CZ2 C 13 114.442 0.300 . 1 . . . . 57 TRP CZ2 . 11095 1 624 . 1 1 57 57 TRP CZ3 C 13 121.515 0.300 . 1 . . . . 57 TRP CZ3 . 11095 1 625 . 1 1 57 57 TRP N N 15 123.652 0.300 . 1 . . . . 57 TRP N . 11095 1 626 . 1 1 57 57 TRP NE1 N 15 126.926 0.300 . 1 . . . . 57 TRP NE1 . 11095 1 627 . 1 1 58 58 PRO HA H 1 4.633 0.030 . 1 . . . . 58 PRO HA . 11095 1 628 . 1 1 58 58 PRO HB2 H 1 1.994 0.030 . 2 . . . . 58 PRO HB2 . 11095 1 629 . 1 1 58 58 PRO HB3 H 1 2.560 0.030 . 2 . . . . 58 PRO HB3 . 11095 1 630 . 1 1 58 58 PRO HD2 H 1 4.096 0.030 . 2 . . . . 58 PRO HD2 . 11095 1 631 . 1 1 58 58 PRO HD3 H 1 3.837 0.030 . 2 . . . . 58 PRO HD3 . 11095 1 632 . 1 1 58 58 PRO HG2 H 1 2.178 0.030 . 2 . . . . 58 PRO HG2 . 11095 1 633 . 1 1 58 58 PRO HG3 H 1 2.288 0.030 . 2 . . . . 58 PRO HG3 . 11095 1 634 . 1 1 58 58 PRO CA C 13 62.008 0.300 . 1 . . . . 58 PRO CA . 11095 1 635 . 1 1 58 58 PRO CB C 13 32.010 0.300 . 1 . . . . 58 PRO CB . 11095 1 636 . 1 1 58 58 PRO CD C 13 51.486 0.300 . 1 . . . . 58 PRO CD . 11095 1 637 . 1 1 58 58 PRO CG C 13 28.222 0.300 . 1 . . . . 58 PRO CG . 11095 1 638 . 1 1 59 59 TYR H H 1 8.400 0.030 . 1 . . . . 59 TYR H . 11095 1 639 . 1 1 59 59 TYR HA H 1 4.479 0.030 . 1 . . . . 59 TYR HA . 11095 1 640 . 1 1 59 59 TYR HB2 H 1 2.836 0.030 . 2 . . . . 59 TYR HB2 . 11095 1 641 . 1 1 59 59 TYR HB3 H 1 3.435 0.030 . 2 . . . . 59 TYR HB3 . 11095 1 642 . 1 1 59 59 TYR HD1 H 1 6.742 0.030 . 1 . . . . 59 TYR HD1 . 11095 1 643 . 1 1 59 59 TYR HD2 H 1 6.742 0.030 . 1 . . . . 59 TYR HD2 . 11095 1 644 . 1 1 59 59 TYR HE1 H 1 6.445 0.030 . 1 . . . . 59 TYR HE1 . 11095 1 645 . 1 1 59 59 TYR HE2 H 1 6.445 0.030 . 1 . . . . 59 TYR HE2 . 11095 1 646 . 1 1 59 59 TYR CA C 13 58.838 0.300 . 1 . . . . 59 TYR CA . 11095 1 647 . 1 1 59 59 TYR CB C 13 35.867 0.300 . 1 . . . . 59 TYR CB . 11095 1 648 . 1 1 59 59 TYR CD1 C 13 129.542 0.300 . 1 . . . . 59 TYR CD1 . 11095 1 649 . 1 1 59 59 TYR CD2 C 13 129.542 0.300 . 1 . . . . 59 TYR CD2 . 11095 1 650 . 1 1 59 59 TYR CE1 C 13 119.784 0.300 . 1 . . . . 59 TYR CE1 . 11095 1 651 . 1 1 59 59 TYR CE2 C 13 119.784 0.300 . 1 . . . . 59 TYR CE2 . 11095 1 652 . 1 1 59 59 TYR N N 15 127.219 0.300 . 1 . . . . 59 TYR N . 11095 1 653 . 1 1 60 60 LEU H H 1 7.880 0.030 . 1 . . . . 60 LEU H . 11095 1 654 . 1 1 60 60 LEU HA H 1 4.102 0.030 . 1 . . . . 60 LEU HA . 11095 1 655 . 1 1 60 60 LEU HB2 H 1 1.615 0.030 . 1 . . . . 60 LEU HB2 . 11095 1 656 . 1 1 60 60 LEU HB3 H 1 1.615 0.030 . 1 . . . . 60 LEU HB3 . 11095 1 657 . 1 1 60 60 LEU HD11 H 1 0.887 0.030 . 1 . . . . 60 LEU HD1 . 11095 1 658 . 1 1 60 60 LEU HD12 H 1 0.887 0.030 . 1 . . . . 60 LEU HD1 . 11095 1 659 . 1 1 60 60 LEU HD13 H 1 0.887 0.030 . 1 . . . . 60 LEU HD1 . 11095 1 660 . 1 1 60 60 LEU HD21 H 1 0.791 0.030 . 1 . . . . 60 LEU HD2 . 11095 1 661 . 1 1 60 60 LEU HD22 H 1 0.791 0.030 . 1 . . . . 60 LEU HD2 . 11095 1 662 . 1 1 60 60 LEU HD23 H 1 0.791 0.030 . 1 . . . . 60 LEU HD2 . 11095 1 663 . 1 1 60 60 LEU HG H 1 1.742 0.030 . 1 . . . . 60 LEU HG . 11095 1 664 . 1 1 60 60 LEU C C 13 177.070 0.300 . 1 . . . . 60 LEU C . 11095 1 665 . 1 1 60 60 LEU CA C 13 57.012 0.300 . 1 . . . . 60 LEU CA . 11095 1 666 . 1 1 60 60 LEU CB C 13 42.361 0.300 . 1 . . . . 60 LEU CB . 11095 1 667 . 1 1 60 60 LEU CD1 C 13 24.854 0.300 . 2 . . . . 60 LEU CD1 . 11095 1 668 . 1 1 60 60 LEU CD2 C 13 23.940 0.300 . 2 . . . . 60 LEU CD2 . 11095 1 669 . 1 1 60 60 LEU CG C 13 27.092 0.300 . 1 . . . . 60 LEU CG . 11095 1 670 . 1 1 60 60 LEU N N 15 113.579 0.300 . 1 . . . . 60 LEU N . 11095 1 671 . 1 1 61 61 CYS H H 1 8.117 0.030 . 1 . . . . 61 CYS H . 11095 1 672 . 1 1 61 61 CYS HA H 1 5.215 0.030 . 1 . . . . 61 CYS HA . 11095 1 673 . 1 1 61 61 CYS HB2 H 1 3.142 0.030 . 2 . . . . 61 CYS HB2 . 11095 1 674 . 1 1 61 61 CYS HB3 H 1 2.938 0.030 . 2 . . . . 61 CYS HB3 . 11095 1 675 . 1 1 61 61 CYS C C 13 175.508 0.300 . 1 . . . . 61 CYS C . 11095 1 676 . 1 1 61 61 CYS CA C 13 57.675 0.300 . 1 . . . . 61 CYS CA . 11095 1 677 . 1 1 61 61 CYS CB C 13 29.041 0.300 . 1 . . . . 61 CYS CB . 11095 1 678 . 1 1 61 61 CYS N N 15 113.570 0.300 . 1 . . . . 61 CYS N . 11095 1 679 . 1 1 62 62 LEU H H 1 7.851 0.030 . 1 . . . . 62 LEU H . 11095 1 680 . 1 1 62 62 LEU HA H 1 4.699 0.030 . 1 . . . . 62 LEU HA . 11095 1 681 . 1 1 62 62 LEU HB2 H 1 2.243 0.030 . 2 . . . . 62 LEU HB2 . 11095 1 682 . 1 1 62 62 LEU HB3 H 1 1.126 0.030 . 2 . . . . 62 LEU HB3 . 11095 1 683 . 1 1 62 62 LEU HD11 H 1 0.780 0.030 . 1 . . . . 62 LEU HD1 . 11095 1 684 . 1 1 62 62 LEU HD12 H 1 0.780 0.030 . 1 . . . . 62 LEU HD1 . 11095 1 685 . 1 1 62 62 LEU HD13 H 1 0.780 0.030 . 1 . . . . 62 LEU HD1 . 11095 1 686 . 1 1 62 62 LEU HD21 H 1 0.610 0.030 . 1 . . . . 62 LEU HD2 . 11095 1 687 . 1 1 62 62 LEU HD22 H 1 0.610 0.030 . 1 . . . . 62 LEU HD2 . 11095 1 688 . 1 1 62 62 LEU HD23 H 1 0.610 0.030 . 1 . . . . 62 LEU HD2 . 11095 1 689 . 1 1 62 62 LEU HG H 1 2.053 0.030 . 1 . . . . 62 LEU HG . 11095 1 690 . 1 1 62 62 LEU C C 13 176.549 0.300 . 1 . . . . 62 LEU C . 11095 1 691 . 1 1 62 62 LEU CA C 13 55.596 0.300 . 1 . . . . 62 LEU CA . 11095 1 692 . 1 1 62 62 LEU CB C 13 41.479 0.300 . 1 . . . . 62 LEU CB . 11095 1 693 . 1 1 62 62 LEU CD1 C 13 26.332 0.300 . 2 . . . . 62 LEU CD1 . 11095 1 694 . 1 1 62 62 LEU CD2 C 13 23.676 0.300 . 2 . . . . 62 LEU CD2 . 11095 1 695 . 1 1 62 62 LEU CG C 13 26.816 0.300 . 1 . . . . 62 LEU CG . 11095 1 696 . 1 1 62 62 LEU N N 15 123.937 0.300 . 1 . . . . 62 LEU N . 11095 1 697 . 1 1 63 63 ARG H H 1 9.329 0.030 . 1 . . . . 63 ARG H . 11095 1 698 . 1 1 63 63 ARG HA H 1 4.483 0.030 . 1 . . . . 63 ARG HA . 11095 1 699 . 1 1 63 63 ARG HB2 H 1 1.933 0.030 . 2 . . . . 63 ARG HB2 . 11095 1 700 . 1 1 63 63 ARG HB3 H 1 1.584 0.030 . 2 . . . . 63 ARG HB3 . 11095 1 701 . 1 1 63 63 ARG HD2 H 1 3.078 0.030 . 2 . . . . 63 ARG HD2 . 11095 1 702 . 1 1 63 63 ARG HD3 H 1 3.168 0.030 . 2 . . . . 63 ARG HD3 . 11095 1 703 . 1 1 63 63 ARG HG2 H 1 1.759 0.030 . 1 . . . . 63 ARG HG2 . 11095 1 704 . 1 1 63 63 ARG HG3 H 1 1.759 0.030 . 1 . . . . 63 ARG HG3 . 11095 1 705 . 1 1 63 63 ARG C C 13 177.884 0.300 . 1 . . . . 63 ARG C . 11095 1 706 . 1 1 63 63 ARG CA C 13 57.859 0.300 . 1 . . . . 63 ARG CA . 11095 1 707 . 1 1 63 63 ARG CB C 13 32.235 0.300 . 1 . . . . 63 ARG CB . 11095 1 708 . 1 1 63 63 ARG CD C 13 43.422 0.300 . 1 . . . . 63 ARG CD . 11095 1 709 . 1 1 63 63 ARG CG C 13 27.729 0.300 . 1 . . . . 63 ARG CG . 11095 1 710 . 1 1 63 63 ARG N N 15 124.517 0.300 . 1 . . . . 63 ARG N . 11095 1 711 . 1 1 64 64 ARG H H 1 7.676 0.030 . 1 . . . . 64 ARG H . 11095 1 712 . 1 1 64 64 ARG HA H 1 5.033 0.030 . 1 . . . . 64 ARG HA . 11095 1 713 . 1 1 64 64 ARG HB2 H 1 1.713 0.030 . 2 . . . . 64 ARG HB2 . 11095 1 714 . 1 1 64 64 ARG HB3 H 1 0.976 0.030 . 2 . . . . 64 ARG HB3 . 11095 1 715 . 1 1 64 64 ARG HD2 H 1 2.466 0.030 . 2 . . . . 64 ARG HD2 . 11095 1 716 . 1 1 64 64 ARG HD3 H 1 1.552 0.030 . 2 . . . . 64 ARG HD3 . 11095 1 717 . 1 1 64 64 ARG HE H 1 7.287 0.030 . 1 . . . . 64 ARG HE . 11095 1 718 . 1 1 64 64 ARG HG2 H 1 1.032 0.030 . 2 . . . . 64 ARG HG2 . 11095 1 719 . 1 1 64 64 ARG HG3 H 1 1.172 0.030 . 2 . . . . 64 ARG HG3 . 11095 1 720 . 1 1 64 64 ARG C C 13 174.037 0.300 . 1 . . . . 64 ARG C . 11095 1 721 . 1 1 64 64 ARG CA C 13 54.840 0.300 . 1 . . . . 64 ARG CA . 11095 1 722 . 1 1 64 64 ARG CB C 13 32.998 0.300 . 1 . . . . 64 ARG CB . 11095 1 723 . 1 1 64 64 ARG CD C 13 42.872 0.300 . 1 . . . . 64 ARG CD . 11095 1 724 . 1 1 64 64 ARG CG C 13 25.922 0.300 . 1 . . . . 64 ARG CG . 11095 1 725 . 1 1 64 64 ARG N N 15 110.416 0.300 . 1 . . . . 64 ARG N . 11095 1 726 . 1 1 64 64 ARG NE N 15 84.783 0.300 . 1 . . . . 64 ARG NE . 11095 1 727 . 1 1 65 65 TYR H H 1 8.612 0.030 . 1 . . . . 65 TYR H . 11095 1 728 . 1 1 65 65 TYR HA H 1 5.671 0.030 . 1 . . . . 65 TYR HA . 11095 1 729 . 1 1 65 65 TYR HB2 H 1 3.270 0.030 . 2 . . . . 65 TYR HB2 . 11095 1 730 . 1 1 65 65 TYR HB3 H 1 3.166 0.030 . 2 . . . . 65 TYR HB3 . 11095 1 731 . 1 1 65 65 TYR HD1 H 1 6.723 0.030 . 1 . . . . 65 TYR HD1 . 11095 1 732 . 1 1 65 65 TYR HD2 H 1 6.723 0.030 . 1 . . . . 65 TYR HD2 . 11095 1 733 . 1 1 65 65 TYR HE1 H 1 6.145 0.030 . 1 . . . . 65 TYR HE1 . 11095 1 734 . 1 1 65 65 TYR HE2 H 1 6.145 0.030 . 1 . . . . 65 TYR HE2 . 11095 1 735 . 1 1 65 65 TYR C C 13 172.833 0.300 . 1 . . . . 65 TYR C . 11095 1 736 . 1 1 65 65 TYR CA C 13 56.952 0.300 . 1 . . . . 65 TYR CA . 11095 1 737 . 1 1 65 65 TYR CB C 13 40.306 0.300 . 1 . . . . 65 TYR CB . 11095 1 738 . 1 1 65 65 TYR CD1 C 13 133.440 0.300 . 1 . . . . 65 TYR CD1 . 11095 1 739 . 1 1 65 65 TYR CD2 C 13 133.440 0.300 . 1 . . . . 65 TYR CD2 . 11095 1 740 . 1 1 65 65 TYR CE1 C 13 117.914 0.300 . 1 . . . . 65 TYR CE1 . 11095 1 741 . 1 1 65 65 TYR CE2 C 13 117.914 0.300 . 1 . . . . 65 TYR CE2 . 11095 1 742 . 1 1 65 65 TYR N N 15 116.561 0.300 . 1 . . . . 65 TYR N . 11095 1 743 . 1 1 66 66 GLY H H 1 9.506 0.030 . 1 . . . . 66 GLY H . 11095 1 744 . 1 1 66 66 GLY HA2 H 1 5.166 0.030 . 2 . . . . 66 GLY HA2 . 11095 1 745 . 1 1 66 66 GLY HA3 H 1 4.210 0.030 . 2 . . . . 66 GLY HA3 . 11095 1 746 . 1 1 66 66 GLY C C 13 170.408 0.300 . 1 . . . . 66 GLY C . 11095 1 747 . 1 1 66 66 GLY CA C 13 47.556 0.300 . 1 . . . . 66 GLY CA . 11095 1 748 . 1 1 66 66 GLY N N 15 107.176 0.300 . 1 . . . . 66 GLY N . 11095 1 749 . 1 1 67 67 TYR H H 1 7.910 0.030 . 1 . . . . 67 TYR H . 11095 1 750 . 1 1 67 67 TYR HA H 1 5.942 0.030 . 1 . . . . 67 TYR HA . 11095 1 751 . 1 1 67 67 TYR HB2 H 1 2.967 0.030 . 2 . . . . 67 TYR HB2 . 11095 1 752 . 1 1 67 67 TYR HB3 H 1 3.343 0.030 . 2 . . . . 67 TYR HB3 . 11095 1 753 . 1 1 67 67 TYR HD1 H 1 6.277 0.030 . 1 . . . . 67 TYR HD1 . 11095 1 754 . 1 1 67 67 TYR HD2 H 1 6.277 0.030 . 1 . . . . 67 TYR HD2 . 11095 1 755 . 1 1 67 67 TYR HE1 H 1 6.301 0.030 . 1 . . . . 67 TYR HE1 . 11095 1 756 . 1 1 67 67 TYR HE2 H 1 6.301 0.030 . 1 . . . . 67 TYR HE2 . 11095 1 757 . 1 1 67 67 TYR C C 13 173.652 0.300 . 1 . . . . 67 TYR C . 11095 1 758 . 1 1 67 67 TYR CA C 13 56.675 0.300 . 1 . . . . 67 TYR CA . 11095 1 759 . 1 1 67 67 TYR CB C 13 42.465 0.300 . 1 . . . . 67 TYR CB . 11095 1 760 . 1 1 67 67 TYR CD1 C 13 132.742 0.300 . 1 . . . . 67 TYR CD1 . 11095 1 761 . 1 1 67 67 TYR CD2 C 13 132.742 0.300 . 1 . . . . 67 TYR CD2 . 11095 1 762 . 1 1 67 67 TYR CE1 C 13 118.042 0.300 . 1 . . . . 67 TYR CE1 . 11095 1 763 . 1 1 67 67 TYR CE2 C 13 118.042 0.300 . 1 . . . . 67 TYR CE2 . 11095 1 764 . 1 1 67 67 TYR N N 15 114.720 0.300 . 1 . . . . 67 TYR N . 11095 1 765 . 1 1 68 68 ASP H H 1 9.241 0.030 . 1 . . . . 68 ASP H . 11095 1 766 . 1 1 68 68 ASP HA H 1 4.230 0.030 . 1 . . . . 68 ASP HA . 11095 1 767 . 1 1 68 68 ASP HB2 H 1 2.470 0.030 . 2 . . . . 68 ASP HB2 . 11095 1 768 . 1 1 68 68 ASP HB3 H 1 2.766 0.030 . 2 . . . . 68 ASP HB3 . 11095 1 769 . 1 1 68 68 ASP C C 13 176.200 0.300 . 1 . . . . 68 ASP C . 11095 1 770 . 1 1 68 68 ASP CA C 13 53.643 0.300 . 1 . . . . 68 ASP CA . 11095 1 771 . 1 1 68 68 ASP CB C 13 45.160 0.300 . 1 . . . . 68 ASP CB . 11095 1 772 . 1 1 68 68 ASP N N 15 121.673 0.300 . 1 . . . . 68 ASP N . 11095 1 773 . 1 1 69 69 SER H H 1 9.080 0.030 . 1 . . . . 69 SER H . 11095 1 774 . 1 1 69 69 SER HA H 1 4.208 0.030 . 1 . . . . 69 SER HA . 11095 1 775 . 1 1 69 69 SER HB2 H 1 3.912 0.030 . 2 . . . . 69 SER HB2 . 11095 1 776 . 1 1 69 69 SER HB3 H 1 3.987 0.030 . 2 . . . . 69 SER HB3 . 11095 1 777 . 1 1 69 69 SER C C 13 174.768 0.300 . 1 . . . . 69 SER C . 11095 1 778 . 1 1 69 69 SER CA C 13 61.128 0.300 . 1 . . . . 69 SER CA . 11095 1 779 . 1 1 69 69 SER CB C 13 62.423 0.300 . 1 . . . . 69 SER CB . 11095 1 780 . 1 1 69 69 SER N N 15 117.278 0.300 . 1 . . . . 69 SER N . 11095 1 781 . 1 1 70 70 ASN H H 1 8.723 0.030 . 1 . . . . 70 ASN H . 11095 1 782 . 1 1 70 70 ASN HA H 1 5.235 0.030 . 1 . . . . 70 ASN HA . 11095 1 783 . 1 1 70 70 ASN HB2 H 1 2.860 0.030 . 2 . . . . 70 ASN HB2 . 11095 1 784 . 1 1 70 70 ASN HB3 H 1 2.962 0.030 . 2 . . . . 70 ASN HB3 . 11095 1 785 . 1 1 70 70 ASN HD21 H 1 6.866 0.030 . 2 . . . . 70 ASN HD21 . 11095 1 786 . 1 1 70 70 ASN HD22 H 1 7.553 0.030 . 2 . . . . 70 ASN HD22 . 11095 1 787 . 1 1 70 70 ASN C C 13 174.906 0.300 . 1 . . . . 70 ASN C . 11095 1 788 . 1 1 70 70 ASN CA C 13 53.295 0.300 . 1 . . . . 70 ASN CA . 11095 1 789 . 1 1 70 70 ASN CB C 13 39.017 0.300 . 1 . . . . 70 ASN CB . 11095 1 790 . 1 1 70 70 ASN N N 15 119.859 0.300 . 1 . . . . 70 ASN N . 11095 1 791 . 1 1 70 70 ASN ND2 N 15 111.930 0.300 . 1 . . . . 70 ASN ND2 . 11095 1 792 . 1 1 71 71 LEU H H 1 8.162 0.030 . 1 . . . . 71 LEU H . 11095 1 793 . 1 1 71 71 LEU HA H 1 5.246 0.030 . 1 . . . . 71 LEU HA . 11095 1 794 . 1 1 71 71 LEU HB2 H 1 1.481 0.030 . 2 . . . . 71 LEU HB2 . 11095 1 795 . 1 1 71 71 LEU HB3 H 1 1.298 0.030 . 2 . . . . 71 LEU HB3 . 11095 1 796 . 1 1 71 71 LEU HD11 H 1 0.609 0.030 . 1 . . . . 71 LEU HD1 . 11095 1 797 . 1 1 71 71 LEU HD12 H 1 0.609 0.030 . 1 . . . . 71 LEU HD1 . 11095 1 798 . 1 1 71 71 LEU HD13 H 1 0.609 0.030 . 1 . . . . 71 LEU HD1 . 11095 1 799 . 1 1 71 71 LEU HD21 H 1 0.728 0.030 . 1 . . . . 71 LEU HD2 . 11095 1 800 . 1 1 71 71 LEU HD22 H 1 0.728 0.030 . 1 . . . . 71 LEU HD2 . 11095 1 801 . 1 1 71 71 LEU HD23 H 1 0.728 0.030 . 1 . . . . 71 LEU HD2 . 11095 1 802 . 1 1 71 71 LEU HG H 1 1.142 0.030 . 1 . . . . 71 LEU HG . 11095 1 803 . 1 1 71 71 LEU C C 13 173.854 0.300 . 1 . . . . 71 LEU C . 11095 1 804 . 1 1 71 71 LEU CA C 13 54.650 0.300 . 1 . . . . 71 LEU CA . 11095 1 805 . 1 1 71 71 LEU CB C 13 47.127 0.300 . 1 . . . . 71 LEU CB . 11095 1 806 . 1 1 71 71 LEU CD1 C 13 25.835 0.300 . 2 . . . . 71 LEU CD1 . 11095 1 807 . 1 1 71 71 LEU CD2 C 13 23.947 0.300 . 2 . . . . 71 LEU CD2 . 11095 1 808 . 1 1 71 71 LEU CG C 13 27.342 0.300 . 1 . . . . 71 LEU CG . 11095 1 809 . 1 1 71 71 LEU N N 15 123.025 0.300 . 1 . . . . 71 LEU N . 11095 1 810 . 1 1 72 72 PHE H H 1 9.397 0.030 . 1 . . . . 72 PHE H . 11095 1 811 . 1 1 72 72 PHE HA H 1 5.579 0.030 . 1 . . . . 72 PHE HA . 11095 1 812 . 1 1 72 72 PHE HB2 H 1 3.205 0.030 . 2 . . . . 72 PHE HB2 . 11095 1 813 . 1 1 72 72 PHE HB3 H 1 2.799 0.030 . 2 . . . . 72 PHE HB3 . 11095 1 814 . 1 1 72 72 PHE HD1 H 1 7.337 0.030 . 1 . . . . 72 PHE HD1 . 11095 1 815 . 1 1 72 72 PHE HD2 H 1 7.337 0.030 . 1 . . . . 72 PHE HD2 . 11095 1 816 . 1 1 72 72 PHE HE1 H 1 7.212 0.030 . 1 . . . . 72 PHE HE1 . 11095 1 817 . 1 1 72 72 PHE HE2 H 1 7.212 0.030 . 1 . . . . 72 PHE HE2 . 11095 1 818 . 1 1 72 72 PHE HZ H 1 6.965 0.030 . 1 . . . . 72 PHE HZ . 11095 1 819 . 1 1 72 72 PHE C C 13 173.758 0.300 . 1 . . . . 72 PHE C . 11095 1 820 . 1 1 72 72 PHE CA C 13 55.740 0.300 . 1 . . . . 72 PHE CA . 11095 1 821 . 1 1 72 72 PHE CB C 13 44.088 0.300 . 1 . . . . 72 PHE CB . 11095 1 822 . 1 1 72 72 PHE CE1 C 13 130.828 0.300 . 1 . . . . 72 PHE CE1 . 11095 1 823 . 1 1 72 72 PHE CE2 C 13 130.828 0.300 . 1 . . . . 72 PHE CE2 . 11095 1 824 . 1 1 72 72 PHE CZ C 13 129.556 0.300 . 1 . . . . 72 PHE CZ . 11095 1 825 . 1 1 72 72 PHE N N 15 125.887 0.300 . 1 . . . . 72 PHE N . 11095 1 826 . 1 1 73 73 SER H H 1 8.159 0.030 . 1 . . . . 73 SER H . 11095 1 827 . 1 1 73 73 SER HA H 1 5.267 0.030 . 1 . . . . 73 SER HA . 11095 1 828 . 1 1 73 73 SER HB2 H 1 2.999 0.030 . 2 . . . . 73 SER HB2 . 11095 1 829 . 1 1 73 73 SER HB3 H 1 2.700 0.030 . 2 . . . . 73 SER HB3 . 11095 1 830 . 1 1 73 73 SER C C 13 171.329 0.300 . 1 . . . . 73 SER C . 11095 1 831 . 1 1 73 73 SER CA C 13 55.432 0.300 . 1 . . . . 73 SER CA . 11095 1 832 . 1 1 73 73 SER CB C 13 66.659 0.300 . 1 . . . . 73 SER CB . 11095 1 833 . 1 1 73 73 SER N N 15 120.796 0.300 . 1 . . . . 73 SER N . 11095 1 834 . 1 1 74 74 PHE H H 1 8.099 0.030 . 1 . . . . 74 PHE H . 11095 1 835 . 1 1 74 74 PHE HA H 1 5.426 0.030 . 1 . . . . 74 PHE HA . 11095 1 836 . 1 1 74 74 PHE HB2 H 1 3.011 0.030 . 2 . . . . 74 PHE HB2 . 11095 1 837 . 1 1 74 74 PHE HB3 H 1 3.239 0.030 . 2 . . . . 74 PHE HB3 . 11095 1 838 . 1 1 74 74 PHE HD1 H 1 6.621 0.030 . 1 . . . . 74 PHE HD1 . 11095 1 839 . 1 1 74 74 PHE HD2 H 1 6.621 0.030 . 1 . . . . 74 PHE HD2 . 11095 1 840 . 1 1 74 74 PHE HE1 H 1 5.941 0.030 . 1 . . . . 74 PHE HE1 . 11095 1 841 . 1 1 74 74 PHE HE2 H 1 5.941 0.030 . 1 . . . . 74 PHE HE2 . 11095 1 842 . 1 1 74 74 PHE HZ H 1 4.482 0.030 . 1 . . . . 74 PHE HZ . 11095 1 843 . 1 1 74 74 PHE C C 13 170.999 0.300 . 1 . . . . 74 PHE C . 11095 1 844 . 1 1 74 74 PHE CA C 13 56.647 0.300 . 1 . . . . 74 PHE CA . 11095 1 845 . 1 1 74 74 PHE CB C 13 41.782 0.300 . 1 . . . . 74 PHE CB . 11095 1 846 . 1 1 74 74 PHE CD1 C 13 131.801 0.300 . 1 . . . . 74 PHE CD1 . 11095 1 847 . 1 1 74 74 PHE CD2 C 13 131.801 0.300 . 1 . . . . 74 PHE CD2 . 11095 1 848 . 1 1 74 74 PHE CE1 C 13 129.895 0.300 . 1 . . . . 74 PHE CE1 . 11095 1 849 . 1 1 74 74 PHE CE2 C 13 129.895 0.300 . 1 . . . . 74 PHE CE2 . 11095 1 850 . 1 1 74 74 PHE CZ C 13 129.342 0.300 . 1 . . . . 74 PHE CZ . 11095 1 851 . 1 1 74 74 PHE N N 15 117.309 0.300 . 1 . . . . 74 PHE N . 11095 1 852 . 1 1 75 75 GLU H H 1 8.897 0.030 . 1 . . . . 75 GLU H . 11095 1 853 . 1 1 75 75 GLU HA H 1 5.897 0.030 . 1 . . . . 75 GLU HA . 11095 1 854 . 1 1 75 75 GLU HB2 H 1 1.713 0.030 . 2 . . . . 75 GLU HB2 . 11095 1 855 . 1 1 75 75 GLU HB3 H 1 2.071 0.030 . 2 . . . . 75 GLU HB3 . 11095 1 856 . 1 1 75 75 GLU HG2 H 1 2.349 0.030 . 2 . . . . 75 GLU HG2 . 11095 1 857 . 1 1 75 75 GLU HG3 H 1 2.097 0.030 . 2 . . . . 75 GLU HG3 . 11095 1 858 . 1 1 75 75 GLU C C 13 175.906 0.300 . 1 . . . . 75 GLU C . 11095 1 859 . 1 1 75 75 GLU CA C 13 52.772 0.300 . 1 . . . . 75 GLU CA . 11095 1 860 . 1 1 75 75 GLU CB C 13 34.635 0.300 . 1 . . . . 75 GLU CB . 11095 1 861 . 1 1 75 75 GLU CG C 13 35.542 0.300 . 1 . . . . 75 GLU CG . 11095 1 862 . 1 1 75 75 GLU N N 15 119.997 0.300 . 1 . . . . 75 GLU N . 11095 1 863 . 1 1 76 76 SER H H 1 9.972 0.030 . 1 . . . . 76 SER H . 11095 1 864 . 1 1 76 76 SER HA H 1 5.243 0.030 . 1 . . . . 76 SER HA . 11095 1 865 . 1 1 76 76 SER HB2 H 1 4.092 0.030 . 2 . . . . 76 SER HB2 . 11095 1 866 . 1 1 76 76 SER HB3 H 1 5.043 0.030 . 2 . . . . 76 SER HB3 . 11095 1 867 . 1 1 76 76 SER C C 13 175.625 0.300 . 1 . . . . 76 SER C . 11095 1 868 . 1 1 76 76 SER CA C 13 57.240 0.300 . 1 . . . . 76 SER CA . 11095 1 869 . 1 1 76 76 SER CB C 13 68.606 0.300 . 1 . . . . 76 SER CB . 11095 1 870 . 1 1 76 76 SER N N 15 123.573 0.300 . 1 . . . . 76 SER N . 11095 1 871 . 1 1 77 77 GLY H H 1 8.718 0.030 . 1 . . . . 77 GLY H . 11095 1 872 . 1 1 77 77 GLY HA2 H 1 4.432 0.030 . 2 . . . . 77 GLY HA2 . 11095 1 873 . 1 1 77 77 GLY HA3 H 1 4.097 0.030 . 2 . . . . 77 GLY HA3 . 11095 1 874 . 1 1 77 77 GLY C C 13 172.566 0.300 . 1 . . . . 77 GLY C . 11095 1 875 . 1 1 77 77 GLY CA C 13 43.626 0.300 . 1 . . . . 77 GLY CA . 11095 1 876 . 1 1 77 77 GLY N N 15 106.966 0.300 . 1 . . . . 77 GLY N . 11095 1 877 . 1 1 78 78 ARG H H 1 8.393 0.030 . 1 . . . . 78 ARG H . 11095 1 878 . 1 1 78 78 ARG HA H 1 4.111 0.030 . 1 . . . . 78 ARG HA . 11095 1 879 . 1 1 78 78 ARG HB2 H 1 1.927 0.030 . 1 . . . . 78 ARG HB2 . 11095 1 880 . 1 1 78 78 ARG HB3 H 1 1.927 0.030 . 1 . . . . 78 ARG HB3 . 11095 1 881 . 1 1 78 78 ARG HD2 H 1 3.272 0.030 . 1 . . . . 78 ARG HD2 . 11095 1 882 . 1 1 78 78 ARG HD3 H 1 3.272 0.030 . 1 . . . . 78 ARG HD3 . 11095 1 883 . 1 1 78 78 ARG HG2 H 1 1.764 0.030 . 2 . . . . 78 ARG HG2 . 11095 1 884 . 1 1 78 78 ARG HG3 H 1 1.792 0.030 . 2 . . . . 78 ARG HG3 . 11095 1 885 . 1 1 78 78 ARG C C 13 178.750 0.300 . 1 . . . . 78 ARG C . 11095 1 886 . 1 1 78 78 ARG CA C 13 58.838 0.300 . 1 . . . . 78 ARG CA . 11095 1 887 . 1 1 78 78 ARG CB C 13 31.466 0.300 . 1 . . . . 78 ARG CB . 11095 1 888 . 1 1 78 78 ARG CD C 13 43.594 0.300 . 1 . . . . 78 ARG CD . 11095 1 889 . 1 1 78 78 ARG CG C 13 28.012 0.300 . 1 . . . . 78 ARG CG . 11095 1 890 . 1 1 78 78 ARG N N 15 113.730 0.300 . 1 . . . . 78 ARG N . 11095 1 891 . 1 1 79 79 ARG H H 1 8.613 0.030 . 1 . . . . 79 ARG H . 11095 1 892 . 1 1 79 79 ARG HA H 1 4.518 0.030 . 1 . . . . 79 ARG HA . 11095 1 893 . 1 1 79 79 ARG HB2 H 1 1.875 0.030 . 2 . . . . 79 ARG HB2 . 11095 1 894 . 1 1 79 79 ARG HB3 H 1 1.762 0.030 . 2 . . . . 79 ARG HB3 . 11095 1 895 . 1 1 79 79 ARG HD2 H 1 3.207 0.030 . 1 . . . . 79 ARG HD2 . 11095 1 896 . 1 1 79 79 ARG HD3 H 1 3.207 0.030 . 1 . . . . 79 ARG HD3 . 11095 1 897 . 1 1 79 79 ARG HG2 H 1 1.683 0.030 . 2 . . . . 79 ARG HG2 . 11095 1 898 . 1 1 79 79 ARG HG3 H 1 1.563 0.030 . 2 . . . . 79 ARG HG3 . 11095 1 899 . 1 1 79 79 ARG C C 13 174.328 0.300 . 1 . . . . 79 ARG C . 11095 1 900 . 1 1 79 79 ARG CA C 13 55.694 0.300 . 1 . . . . 79 ARG CA . 11095 1 901 . 1 1 79 79 ARG CB C 13 27.622 0.300 . 1 . . . . 79 ARG CB . 11095 1 902 . 1 1 79 79 ARG CD C 13 43.594 0.300 . 1 . . . . 79 ARG CD . 11095 1 903 . 1 1 79 79 ARG CG C 13 27.472 0.300 . 1 . . . . 79 ARG CG . 11095 1 904 . 1 1 79 79 ARG N N 15 120.937 0.300 . 1 . . . . 79 ARG N . 11095 1 905 . 1 1 80 80 CYS H H 1 8.373 0.030 . 1 . . . . 80 CYS H . 11095 1 906 . 1 1 80 80 CYS HA H 1 4.852 0.030 . 1 . . . . 80 CYS HA . 11095 1 907 . 1 1 80 80 CYS HB2 H 1 3.917 0.030 . 2 . . . . 80 CYS HB2 . 11095 1 908 . 1 1 80 80 CYS HB3 H 1 3.177 0.030 . 2 . . . . 80 CYS HB3 . 11095 1 909 . 1 1 80 80 CYS C C 13 174.792 0.300 . 1 . . . . 80 CYS C . 11095 1 910 . 1 1 80 80 CYS CA C 13 56.583 0.300 . 1 . . . . 80 CYS CA . 11095 1 911 . 1 1 80 80 CYS CB C 13 30.097 0.300 . 1 . . . . 80 CYS CB . 11095 1 912 . 1 1 80 80 CYS N N 15 114.441 0.300 . 1 . . . . 80 CYS N . 11095 1 913 . 1 1 81 81 GLN H H 1 9.291 0.030 . 1 . . . . 81 GLN H . 11095 1 914 . 1 1 81 81 GLN HA H 1 4.067 0.030 . 1 . . . . 81 GLN HA . 11095 1 915 . 1 1 81 81 GLN HB2 H 1 1.971 0.030 . 2 . . . . 81 GLN HB2 . 11095 1 916 . 1 1 81 81 GLN HB3 H 1 2.183 0.030 . 2 . . . . 81 GLN HB3 . 11095 1 917 . 1 1 81 81 GLN HE21 H 1 6.963 0.030 . 2 . . . . 81 GLN HE21 . 11095 1 918 . 1 1 81 81 GLN HE22 H 1 7.505 0.030 . 2 . . . . 81 GLN HE22 . 11095 1 919 . 1 1 81 81 GLN HG2 H 1 2.282 0.030 . 2 . . . . 81 GLN HG2 . 11095 1 920 . 1 1 81 81 GLN HG3 H 1 2.363 0.030 . 2 . . . . 81 GLN HG3 . 11095 1 921 . 1 1 81 81 GLN C C 13 178.593 0.300 . 1 . . . . 81 GLN C . 11095 1 922 . 1 1 81 81 GLN CA C 13 59.606 0.300 . 1 . . . . 81 GLN CA . 11095 1 923 . 1 1 81 81 GLN CB C 13 28.874 0.300 . 1 . . . . 81 GLN CB . 11095 1 924 . 1 1 81 81 GLN CG C 13 33.981 0.300 . 1 . . . . 81 GLN CG . 11095 1 925 . 1 1 81 81 GLN N N 15 122.771 0.300 . 1 . . . . 81 GLN N . 11095 1 926 . 1 1 81 81 GLN NE2 N 15 111.626 0.300 . 1 . . . . 81 GLN NE2 . 11095 1 927 . 1 1 82 82 THR H H 1 8.464 0.030 . 1 . . . . 82 THR H . 11095 1 928 . 1 1 82 82 THR HA H 1 4.202 0.030 . 1 . . . . 82 THR HA . 11095 1 929 . 1 1 82 82 THR HB H 1 4.514 0.030 . 1 . . . . 82 THR HB . 11095 1 930 . 1 1 82 82 THR HG21 H 1 1.026 0.030 . 1 . . . . 82 THR HG2 . 11095 1 931 . 1 1 82 82 THR HG22 H 1 1.026 0.030 . 1 . . . . 82 THR HG2 . 11095 1 932 . 1 1 82 82 THR HG23 H 1 1.026 0.030 . 1 . . . . 82 THR HG2 . 11095 1 933 . 1 1 82 82 THR C C 13 176.875 0.300 . 1 . . . . 82 THR C . 11095 1 934 . 1 1 82 82 THR CA C 13 63.488 0.300 . 1 . . . . 82 THR CA . 11095 1 935 . 1 1 82 82 THR CB C 13 70.958 0.300 . 1 . . . . 82 THR CB . 11095 1 936 . 1 1 82 82 THR CG2 C 13 20.863 0.300 . 1 . . . . 82 THR CG2 . 11095 1 937 . 1 1 82 82 THR N N 15 106.897 0.300 . 1 . . . . 82 THR N . 11095 1 938 . 1 1 83 83 GLY H H 1 7.884 0.030 . 1 . . . . 83 GLY H . 11095 1 939 . 1 1 83 83 GLY HA2 H 1 4.037 0.030 . 2 . . . . 83 GLY HA2 . 11095 1 940 . 1 1 83 83 GLY HA3 H 1 4.377 0.030 . 2 . . . . 83 GLY HA3 . 11095 1 941 . 1 1 83 83 GLY C C 13 173.322 0.300 . 1 . . . . 83 GLY C . 11095 1 942 . 1 1 83 83 GLY CA C 13 44.835 0.300 . 1 . . . . 83 GLY CA . 11095 1 943 . 1 1 83 83 GLY N N 15 113.654 0.300 . 1 . . . . 83 GLY N . 11095 1 944 . 1 1 84 84 GLN H H 1 8.731 0.030 . 1 . . . . 84 GLN H . 11095 1 945 . 1 1 84 84 GLN HA H 1 4.339 0.030 . 1 . . . . 84 GLN HA . 11095 1 946 . 1 1 84 84 GLN HB2 H 1 2.000 0.030 . 2 . . . . 84 GLN HB2 . 11095 1 947 . 1 1 84 84 GLN HB3 H 1 1.909 0.030 . 2 . . . . 84 GLN HB3 . 11095 1 948 . 1 1 84 84 GLN HE21 H 1 7.762 0.030 . 2 . . . . 84 GLN HE21 . 11095 1 949 . 1 1 84 84 GLN HE22 H 1 6.848 0.030 . 2 . . . . 84 GLN HE22 . 11095 1 950 . 1 1 84 84 GLN HG2 H 1 2.590 0.030 . 2 . . . . 84 GLN HG2 . 11095 1 951 . 1 1 84 84 GLN HG3 H 1 2.555 0.030 . 2 . . . . 84 GLN HG3 . 11095 1 952 . 1 1 84 84 GLN C C 13 176.911 0.300 . 1 . . . . 84 GLN C . 11095 1 953 . 1 1 84 84 GLN CA C 13 55.596 0.300 . 1 . . . . 84 GLN CA . 11095 1 954 . 1 1 84 84 GLN CB C 13 28.881 0.300 . 1 . . . . 84 GLN CB . 11095 1 955 . 1 1 84 84 GLN CG C 13 33.072 0.300 . 1 . . . . 84 GLN CG . 11095 1 956 . 1 1 84 84 GLN N N 15 121.255 0.300 . 1 . . . . 84 GLN N . 11095 1 957 . 1 1 84 84 GLN NE2 N 15 110.880 0.300 . 1 . . . . 84 GLN NE2 . 11095 1 958 . 1 1 85 85 GLY H H 1 8.132 0.030 . 1 . . . . 85 GLY H . 11095 1 959 . 1 1 85 85 GLY HA2 H 1 3.478 0.030 . 2 . . . . 85 GLY HA2 . 11095 1 960 . 1 1 85 85 GLY HA3 H 1 3.841 0.030 . 2 . . . . 85 GLY HA3 . 11095 1 961 . 1 1 85 85 GLY C C 13 168.930 0.300 . 1 . . . . 85 GLY C . 11095 1 962 . 1 1 85 85 GLY CA C 13 45.374 0.300 . 1 . . . . 85 GLY CA . 11095 1 963 . 1 1 85 85 GLY N N 15 112.687 0.300 . 1 . . . . 85 GLY N . 11095 1 964 . 1 1 86 86 ILE H H 1 7.945 0.030 . 1 . . . . 86 ILE H . 11095 1 965 . 1 1 86 86 ILE HA H 1 4.439 0.030 . 1 . . . . 86 ILE HA . 11095 1 966 . 1 1 86 86 ILE HB H 1 1.398 0.030 . 1 . . . . 86 ILE HB . 11095 1 967 . 1 1 86 86 ILE HD11 H 1 0.571 0.030 . 1 . . . . 86 ILE HD1 . 11095 1 968 . 1 1 86 86 ILE HD12 H 1 0.571 0.030 . 1 . . . . 86 ILE HD1 . 11095 1 969 . 1 1 86 86 ILE HD13 H 1 0.571 0.030 . 1 . . . . 86 ILE HD1 . 11095 1 970 . 1 1 86 86 ILE HG12 H 1 1.648 0.030 . 2 . . . . 86 ILE HG12 . 11095 1 971 . 1 1 86 86 ILE HG13 H 1 0.622 0.030 . 2 . . . . 86 ILE HG13 . 11095 1 972 . 1 1 86 86 ILE HG21 H 1 0.532 0.030 . 1 . . . . 86 ILE HG2 . 11095 1 973 . 1 1 86 86 ILE HG22 H 1 0.532 0.030 . 1 . . . . 86 ILE HG2 . 11095 1 974 . 1 1 86 86 ILE HG23 H 1 0.532 0.030 . 1 . . . . 86 ILE HG2 . 11095 1 975 . 1 1 86 86 ILE C C 13 173.277 0.300 . 1 . . . . 86 ILE C . 11095 1 976 . 1 1 86 86 ILE CA C 13 60.450 0.300 . 1 . . . . 86 ILE CA . 11095 1 977 . 1 1 86 86 ILE CB C 13 38.243 0.300 . 1 . . . . 86 ILE CB . 11095 1 978 . 1 1 86 86 ILE CD1 C 13 13.550 0.300 . 1 . . . . 86 ILE CD1 . 11095 1 979 . 1 1 86 86 ILE CG1 C 13 27.813 0.300 . 1 . . . . 86 ILE CG1 . 11095 1 980 . 1 1 86 86 ILE CG2 C 13 18.742 0.300 . 1 . . . . 86 ILE CG2 . 11095 1 981 . 1 1 86 86 ILE N N 15 120.436 0.300 . 1 . . . . 86 ILE N . 11095 1 982 . 1 1 87 87 PHE H H 1 8.286 0.030 . 1 . . . . 87 PHE H . 11095 1 983 . 1 1 87 87 PHE HA H 1 4.794 0.030 . 1 . . . . 87 PHE HA . 11095 1 984 . 1 1 87 87 PHE HB2 H 1 2.462 0.030 . 2 . . . . 87 PHE HB2 . 11095 1 985 . 1 1 87 87 PHE HB3 H 1 1.507 0.030 . 2 . . . . 87 PHE HB3 . 11095 1 986 . 1 1 87 87 PHE HD1 H 1 6.795 0.030 . 1 . . . . 87 PHE HD1 . 11095 1 987 . 1 1 87 87 PHE HD2 H 1 6.795 0.030 . 1 . . . . 87 PHE HD2 . 11095 1 988 . 1 1 87 87 PHE HE1 H 1 7.355 0.030 . 1 . . . . 87 PHE HE1 . 11095 1 989 . 1 1 87 87 PHE HE2 H 1 7.355 0.030 . 1 . . . . 87 PHE HE2 . 11095 1 990 . 1 1 87 87 PHE HZ H 1 7.088 0.030 . 1 . . . . 87 PHE HZ . 11095 1 991 . 1 1 87 87 PHE C C 13 174.685 0.300 . 1 . . . . 87 PHE C . 11095 1 992 . 1 1 87 87 PHE CA C 13 55.268 0.300 . 1 . . . . 87 PHE CA . 11095 1 993 . 1 1 87 87 PHE CB C 13 42.628 0.300 . 1 . . . . 87 PHE CB . 11095 1 994 . 1 1 87 87 PHE CD1 C 13 133.342 0.300 . 1 . . . . 87 PHE CD1 . 11095 1 995 . 1 1 87 87 PHE CD2 C 13 133.342 0.300 . 1 . . . . 87 PHE CD2 . 11095 1 996 . 1 1 87 87 PHE CE1 C 13 130.822 0.300 . 1 . . . . 87 PHE CE1 . 11095 1 997 . 1 1 87 87 PHE CE2 C 13 130.822 0.300 . 1 . . . . 87 PHE CE2 . 11095 1 998 . 1 1 87 87 PHE CZ C 13 128.142 0.300 . 1 . . . . 87 PHE CZ . 11095 1 999 . 1 1 87 87 PHE N N 15 123.012 0.300 . 1 . . . . 87 PHE N . 11095 1 1000 . 1 1 88 88 ALA H H 1 9.462 0.030 . 1 . . . . 88 ALA H . 11095 1 1001 . 1 1 88 88 ALA HA H 1 5.058 0.030 . 1 . . . . 88 ALA HA . 11095 1 1002 . 1 1 88 88 ALA HB1 H 1 1.023 0.030 . 1 . . . . 88 ALA HB . 11095 1 1003 . 1 1 88 88 ALA HB2 H 1 1.023 0.030 . 1 . . . . 88 ALA HB . 11095 1 1004 . 1 1 88 88 ALA HB3 H 1 1.023 0.030 . 1 . . . . 88 ALA HB . 11095 1 1005 . 1 1 88 88 ALA C C 13 175.549 0.300 . 1 . . . . 88 ALA C . 11095 1 1006 . 1 1 88 88 ALA CA C 13 50.703 0.300 . 1 . . . . 88 ALA CA . 11095 1 1007 . 1 1 88 88 ALA CB C 13 23.810 0.300 . 1 . . . . 88 ALA CB . 11095 1 1008 . 1 1 88 88 ALA N N 15 125.346 0.300 . 1 . . . . 88 ALA N . 11095 1 1009 . 1 1 89 89 PHE H H 1 9.298 0.030 . 1 . . . . 89 PHE H . 11095 1 1010 . 1 1 89 89 PHE HA H 1 5.260 0.030 . 1 . . . . 89 PHE HA . 11095 1 1011 . 1 1 89 89 PHE HB2 H 1 2.890 0.030 . 2 . . . . 89 PHE HB2 . 11095 1 1012 . 1 1 89 89 PHE HB3 H 1 3.001 0.030 . 2 . . . . 89 PHE HB3 . 11095 1 1013 . 1 1 89 89 PHE HD1 H 1 7.082 0.030 . 1 . . . . 89 PHE HD1 . 11095 1 1014 . 1 1 89 89 PHE HD2 H 1 7.082 0.030 . 1 . . . . 89 PHE HD2 . 11095 1 1015 . 1 1 89 89 PHE HE1 H 1 7.213 0.030 . 1 . . . . 89 PHE HE1 . 11095 1 1016 . 1 1 89 89 PHE HE2 H 1 7.213 0.030 . 1 . . . . 89 PHE HE2 . 11095 1 1017 . 1 1 89 89 PHE HZ H 1 7.132 0.030 . 1 . . . . 89 PHE HZ . 11095 1 1018 . 1 1 89 89 PHE C C 13 174.766 0.300 . 1 . . . . 89 PHE C . 11095 1 1019 . 1 1 89 89 PHE CA C 13 56.254 0.300 . 1 . . . . 89 PHE CA . 11095 1 1020 . 1 1 89 89 PHE CB C 13 42.783 0.300 . 1 . . . . 89 PHE CB . 11095 1 1021 . 1 1 89 89 PHE CD1 C 13 131.582 0.300 . 1 . . . . 89 PHE CD1 . 11095 1 1022 . 1 1 89 89 PHE CD2 C 13 131.582 0.300 . 1 . . . . 89 PHE CD2 . 11095 1 1023 . 1 1 89 89 PHE CE1 C 13 131.442 0.300 . 1 . . . . 89 PHE CE1 . 11095 1 1024 . 1 1 89 89 PHE CE2 C 13 131.442 0.300 . 1 . . . . 89 PHE CE2 . 11095 1 1025 . 1 1 89 89 PHE CZ C 13 129.023 0.300 . 1 . . . . 89 PHE CZ . 11095 1 1026 . 1 1 89 89 PHE N N 15 117.638 0.300 . 1 . . . . 89 PHE N . 11095 1 1027 . 1 1 90 90 LYS H H 1 9.668 0.030 . 1 . . . . 90 LYS H . 11095 1 1028 . 1 1 90 90 LYS HA H 1 5.113 0.030 . 1 . . . . 90 LYS HA . 11095 1 1029 . 1 1 90 90 LYS HB2 H 1 1.820 0.030 . 2 . . . . 90 LYS HB2 . 11095 1 1030 . 1 1 90 90 LYS HB3 H 1 1.730 0.030 . 2 . . . . 90 LYS HB3 . 11095 1 1031 . 1 1 90 90 LYS HD2 H 1 1.673 0.030 . 1 . . . . 90 LYS HD2 . 11095 1 1032 . 1 1 90 90 LYS HD3 H 1 1.673 0.030 . 1 . . . . 90 LYS HD3 . 11095 1 1033 . 1 1 90 90 LYS HE2 H 1 2.955 0.030 . 2 . . . . 90 LYS HE2 . 11095 1 1034 . 1 1 90 90 LYS HE3 H 1 2.928 0.030 . 2 . . . . 90 LYS HE3 . 11095 1 1035 . 1 1 90 90 LYS HG2 H 1 1.471 0.030 . 2 . . . . 90 LYS HG2 . 11095 1 1036 . 1 1 90 90 LYS HG3 H 1 1.605 0.030 . 2 . . . . 90 LYS HG3 . 11095 1 1037 . 1 1 90 90 LYS C C 13 177.650 0.300 . 1 . . . . 90 LYS C . 11095 1 1038 . 1 1 90 90 LYS CA C 13 56.083 0.300 . 1 . . . . 90 LYS CA . 11095 1 1039 . 1 1 90 90 LYS CB C 13 33.648 0.300 . 1 . . . . 90 LYS CB . 11095 1 1040 . 1 1 90 90 LYS CD C 13 29.803 0.300 . 1 . . . . 90 LYS CD . 11095 1 1041 . 1 1 90 90 LYS CE C 13 41.934 0.300 . 1 . . . . 90 LYS CE . 11095 1 1042 . 1 1 90 90 LYS CG C 13 25.091 0.300 . 1 . . . . 90 LYS CG . 11095 1 1043 . 1 1 90 90 LYS N N 15 126.451 0.300 . 1 . . . . 90 LYS N . 11095 1 1044 . 1 1 91 91 CYS H H 1 8.468 0.030 . 1 . . . . 91 CYS H . 11095 1 1045 . 1 1 91 91 CYS HA H 1 5.550 0.030 . 1 . . . . 91 CYS HA . 11095 1 1046 . 1 1 91 91 CYS HB2 H 1 2.402 0.030 . 2 . . . . 91 CYS HB2 . 11095 1 1047 . 1 1 91 91 CYS HB3 H 1 3.271 0.030 . 2 . . . . 91 CYS HB3 . 11095 1 1048 . 1 1 91 91 CYS CA C 13 58.802 0.300 . 1 . . . . 91 CYS CA . 11095 1 1049 . 1 1 91 91 CYS CB C 13 29.281 0.300 . 1 . . . . 91 CYS CB . 11095 1 1050 . 1 1 91 91 CYS N N 15 125.740 0.300 . 1 . . . . 91 CYS N . 11095 1 1051 . 1 1 92 92 SER HA H 1 4.692 0.030 . 1 . . . . 92 SER HA . 11095 1 1052 . 1 1 92 92 SER HB2 H 1 4.164 0.030 . 1 . . . . 92 SER HB2 . 11095 1 1053 . 1 1 92 92 SER HB3 H 1 4.164 0.030 . 1 . . . . 92 SER HB3 . 11095 1 1054 . 1 1 92 92 SER C C 13 175.038 0.300 . 1 . . . . 92 SER C . 11095 1 1055 . 1 1 92 92 SER CA C 13 61.022 0.300 . 1 . . . . 92 SER CA . 11095 1 1056 . 1 1 92 92 SER CB C 13 62.913 0.300 . 1 . . . . 92 SER CB . 11095 1 1057 . 1 1 93 93 ARG H H 1 7.895 0.030 . 1 . . . . 93 ARG H . 11095 1 1058 . 1 1 93 93 ARG HA H 1 5.040 0.030 . 1 . . . . 93 ARG HA . 11095 1 1059 . 1 1 93 93 ARG HB2 H 1 2.748 0.030 . 2 . . . . 93 ARG HB2 . 11095 1 1060 . 1 1 93 93 ARG HB3 H 1 1.645 0.030 . 2 . . . . 93 ARG HB3 . 11095 1 1061 . 1 1 93 93 ARG HD2 H 1 3.656 0.030 . 2 . . . . 93 ARG HD2 . 11095 1 1062 . 1 1 93 93 ARG HD3 H 1 3.348 0.030 . 2 . . . . 93 ARG HD3 . 11095 1 1063 . 1 1 93 93 ARG HE H 1 7.373 0.030 . 1 . . . . 93 ARG HE . 11095 1 1064 . 1 1 93 93 ARG HG2 H 1 1.882 0.030 . 2 . . . . 93 ARG HG2 . 11095 1 1065 . 1 1 93 93 ARG HG3 H 1 1.764 0.030 . 2 . . . . 93 ARG HG3 . 11095 1 1066 . 1 1 93 93 ARG C C 13 175.714 0.300 . 1 . . . . 93 ARG C . 11095 1 1067 . 1 1 93 93 ARG CA C 13 54.923 0.300 . 1 . . . . 93 ARG CA . 11095 1 1068 . 1 1 93 93 ARG CB C 13 31.512 0.300 . 1 . . . . 93 ARG CB . 11095 1 1069 . 1 1 93 93 ARG CD C 13 44.818 0.300 . 1 . . . . 93 ARG CD . 11095 1 1070 . 1 1 93 93 ARG CG C 13 26.426 0.300 . 1 . . . . 93 ARG CG . 11095 1 1071 . 1 1 93 93 ARG N N 15 121.458 0.300 . 1 . . . . 93 ARG N . 11095 1 1072 . 1 1 93 93 ARG NE N 15 85.043 0.300 . 1 . . . . 93 ARG NE . 11095 1 1073 . 1 1 94 94 ALA H H 1 7.238 0.030 . 1 . . . . 94 ALA H . 11095 1 1074 . 1 1 94 94 ALA HA H 1 3.624 0.030 . 1 . . . . 94 ALA HA . 11095 1 1075 . 1 1 94 94 ALA HB1 H 1 1.799 0.030 . 1 . . . . 94 ALA HB . 11095 1 1076 . 1 1 94 94 ALA HB2 H 1 1.799 0.030 . 1 . . . . 94 ALA HB . 11095 1 1077 . 1 1 94 94 ALA HB3 H 1 1.799 0.030 . 1 . . . . 94 ALA HB . 11095 1 1078 . 1 1 94 94 ALA C C 13 177.577 0.300 . 1 . . . . 94 ALA C . 11095 1 1079 . 1 1 94 94 ALA CA C 13 56.849 0.300 . 1 . . . . 94 ALA CA . 11095 1 1080 . 1 1 94 94 ALA CB C 13 19.840 0.300 . 1 . . . . 94 ALA CB . 11095 1 1081 . 1 1 94 94 ALA N N 15 122.691 0.300 . 1 . . . . 94 ALA N . 11095 1 1082 . 1 1 95 95 GLU H H 1 8.622 0.030 . 1 . . . . 95 GLU H . 11095 1 1083 . 1 1 95 95 GLU HA H 1 2.682 0.030 . 1 . . . . 95 GLU HA . 11095 1 1084 . 1 1 95 95 GLU HB2 H 1 1.751 0.030 . 1 . . . . 95 GLU HB2 . 11095 1 1085 . 1 1 95 95 GLU HB3 H 1 1.751 0.030 . 1 . . . . 95 GLU HB3 . 11095 1 1086 . 1 1 95 95 GLU HG2 H 1 1.650 0.030 . 2 . . . . 95 GLU HG2 . 11095 1 1087 . 1 1 95 95 GLU HG3 H 1 1.964 0.030 . 2 . . . . 95 GLU HG3 . 11095 1 1088 . 1 1 95 95 GLU C C 13 177.564 0.300 . 1 . . . . 95 GLU C . 11095 1 1089 . 1 1 95 95 GLU CA C 13 59.187 0.300 . 1 . . . . 95 GLU CA . 11095 1 1090 . 1 1 95 95 GLU CB C 13 29.537 0.300 . 1 . . . . 95 GLU CB . 11095 1 1091 . 1 1 95 95 GLU CG C 13 35.564 0.300 . 1 . . . . 95 GLU CG . 11095 1 1092 . 1 1 95 95 GLU N N 15 116.066 0.300 . 1 . . . . 95 GLU N . 11095 1 1093 . 1 1 96 96 GLU H H 1 7.332 0.030 . 1 . . . . 96 GLU H . 11095 1 1094 . 1 1 96 96 GLU HA H 1 3.981 0.030 . 1 . . . . 96 GLU HA . 11095 1 1095 . 1 1 96 96 GLU HB2 H 1 2.271 0.030 . 2 . . . . 96 GLU HB2 . 11095 1 1096 . 1 1 96 96 GLU HB3 H 1 2.314 0.030 . 2 . . . . 96 GLU HB3 . 11095 1 1097 . 1 1 96 96 GLU HG2 H 1 2.314 0.030 . 2 . . . . 96 GLU HG2 . 11095 1 1098 . 1 1 96 96 GLU HG3 H 1 2.410 0.030 . 2 . . . . 96 GLU HG3 . 11095 1 1099 . 1 1 96 96 GLU C C 13 179.514 0.300 . 1 . . . . 96 GLU C . 11095 1 1100 . 1 1 96 96 GLU CA C 13 59.457 0.300 . 1 . . . . 96 GLU CA . 11095 1 1101 . 1 1 96 96 GLU CB C 13 30.577 0.300 . 1 . . . . 96 GLU CB . 11095 1 1102 . 1 1 96 96 GLU CG C 13 37.265 0.300 . 1 . . . . 96 GLU CG . 11095 1 1103 . 1 1 96 96 GLU N N 15 117.780 0.300 . 1 . . . . 96 GLU N . 11095 1 1104 . 1 1 97 97 ILE H H 1 7.394 0.030 . 1 . . . . 97 ILE H . 11095 1 1105 . 1 1 97 97 ILE HA H 1 2.674 0.030 . 1 . . . . 97 ILE HA . 11095 1 1106 . 1 1 97 97 ILE HB H 1 0.744 0.030 . 1 . . . . 97 ILE HB . 11095 1 1107 . 1 1 97 97 ILE HD11 H 1 -0.017 0.030 . 1 . . . . 97 ILE HD1 . 11095 1 1108 . 1 1 97 97 ILE HD12 H 1 -0.017 0.030 . 1 . . . . 97 ILE HD1 . 11095 1 1109 . 1 1 97 97 ILE HD13 H 1 -0.017 0.030 . 1 . . . . 97 ILE HD1 . 11095 1 1110 . 1 1 97 97 ILE HG12 H 1 0.478 0.030 . 2 . . . . 97 ILE HG12 . 11095 1 1111 . 1 1 97 97 ILE HG13 H 1 -1.389 0.030 . 2 . . . . 97 ILE HG13 . 11095 1 1112 . 1 1 97 97 ILE HG21 H 1 -0.471 0.030 . 1 . . . . 97 ILE HG2 . 11095 1 1113 . 1 1 97 97 ILE HG22 H 1 -0.471 0.030 . 1 . . . . 97 ILE HG2 . 11095 1 1114 . 1 1 97 97 ILE HG23 H 1 -0.471 0.030 . 1 . . . . 97 ILE HG2 . 11095 1 1115 . 1 1 97 97 ILE C C 13 176.357 0.300 . 1 . . . . 97 ILE C . 11095 1 1116 . 1 1 97 97 ILE CA C 13 65.561 0.300 . 1 . . . . 97 ILE CA . 11095 1 1117 . 1 1 97 97 ILE CB C 13 36.971 0.300 . 1 . . . . 97 ILE CB . 11095 1 1118 . 1 1 97 97 ILE CD1 C 13 13.434 0.300 . 1 . . . . 97 ILE CD1 . 11095 1 1119 . 1 1 97 97 ILE CG1 C 13 25.967 0.300 . 1 . . . . 97 ILE CG1 . 11095 1 1120 . 1 1 97 97 ILE CG2 C 13 15.562 0.300 . 1 . . . . 97 ILE CG2 . 11095 1 1121 . 1 1 97 97 ILE N N 15 119.445 0.300 . 1 . . . . 97 ILE N . 11095 1 1122 . 1 1 98 98 PHE H H 1 7.490 0.030 . 1 . . . . 98 PHE H . 11095 1 1123 . 1 1 98 98 PHE HA H 1 3.904 0.030 . 1 . . . . 98 PHE HA . 11095 1 1124 . 1 1 98 98 PHE HB2 H 1 2.934 0.030 . 2 . . . . 98 PHE HB2 . 11095 1 1125 . 1 1 98 98 PHE HB3 H 1 3.016 0.030 . 2 . . . . 98 PHE HB3 . 11095 1 1126 . 1 1 98 98 PHE HD1 H 1 7.224 0.030 . 1 . . . . 98 PHE HD1 . 11095 1 1127 . 1 1 98 98 PHE HD2 H 1 7.224 0.030 . 1 . . . . 98 PHE HD2 . 11095 1 1128 . 1 1 98 98 PHE HE1 H 1 7.329 0.030 . 1 . . . . 98 PHE HE1 . 11095 1 1129 . 1 1 98 98 PHE HE2 H 1 7.329 0.030 . 1 . . . . 98 PHE HE2 . 11095 1 1130 . 1 1 98 98 PHE HZ H 1 7.157 0.030 . 1 . . . . 98 PHE HZ . 11095 1 1131 . 1 1 98 98 PHE C C 13 175.940 0.300 . 1 . . . . 98 PHE C . 11095 1 1132 . 1 1 98 98 PHE CA C 13 62.419 0.300 . 1 . . . . 98 PHE CA . 11095 1 1133 . 1 1 98 98 PHE CB C 13 40.224 0.300 . 1 . . . . 98 PHE CB . 11095 1 1134 . 1 1 98 98 PHE CD1 C 13 131.979 0.300 . 1 . . . . 98 PHE CD1 . 11095 1 1135 . 1 1 98 98 PHE CD2 C 13 131.979 0.300 . 1 . . . . 98 PHE CD2 . 11095 1 1136 . 1 1 98 98 PHE CE1 C 13 131.974 0.300 . 1 . . . . 98 PHE CE1 . 11095 1 1137 . 1 1 98 98 PHE CE2 C 13 131.974 0.300 . 1 . . . . 98 PHE CE2 . 11095 1 1138 . 1 1 98 98 PHE CZ C 13 130.085 0.300 . 1 . . . . 98 PHE CZ . 11095 1 1139 . 1 1 98 98 PHE N N 15 118.802 0.300 . 1 . . . . 98 PHE N . 11095 1 1140 . 1 1 99 99 ASN H H 1 8.417 0.030 . 1 . . . . 99 ASN H . 11095 1 1141 . 1 1 99 99 ASN HA H 1 4.261 0.030 . 1 . . . . 99 ASN HA . 11095 1 1142 . 1 1 99 99 ASN HB2 H 1 2.752 0.030 . 1 . . . . 99 ASN HB2 . 11095 1 1143 . 1 1 99 99 ASN HB3 H 1 2.752 0.030 . 1 . . . . 99 ASN HB3 . 11095 1 1144 . 1 1 99 99 ASN HD21 H 1 7.008 0.030 . 2 . . . . 99 ASN HD21 . 11095 1 1145 . 1 1 99 99 ASN HD22 H 1 7.505 0.030 . 2 . . . . 99 ASN HD22 . 11095 1 1146 . 1 1 99 99 ASN C C 13 178.029 0.300 . 1 . . . . 99 ASN C . 11095 1 1147 . 1 1 99 99 ASN CA C 13 55.850 0.300 . 1 . . . . 99 ASN CA . 11095 1 1148 . 1 1 99 99 ASN CB C 13 38.251 0.300 . 1 . . . . 99 ASN CB . 11095 1 1149 . 1 1 99 99 ASN N N 15 116.392 0.300 . 1 . . . . 99 ASN N . 11095 1 1150 . 1 1 99 99 ASN ND2 N 15 110.756 0.300 . 1 . . . . 99 ASN ND2 . 11095 1 1151 . 1 1 100 100 LEU H H 1 7.919 0.030 . 1 . . . . 100 LEU H . 11095 1 1152 . 1 1 100 100 LEU HA H 1 4.195 0.030 . 1 . . . . 100 LEU HA . 11095 1 1153 . 1 1 100 100 LEU HB2 H 1 1.652 0.030 . 1 . . . . 100 LEU HB2 . 11095 1 1154 . 1 1 100 100 LEU HB3 H 1 1.652 0.030 . 1 . . . . 100 LEU HB3 . 11095 1 1155 . 1 1 100 100 LEU HD11 H 1 1.045 0.030 . 1 . . . . 100 LEU HD1 . 11095 1 1156 . 1 1 100 100 LEU HD12 H 1 1.045 0.030 . 1 . . . . 100 LEU HD1 . 11095 1 1157 . 1 1 100 100 LEU HD13 H 1 1.045 0.030 . 1 . . . . 100 LEU HD1 . 11095 1 1158 . 1 1 100 100 LEU HD21 H 1 1.130 0.030 . 1 . . . . 100 LEU HD2 . 11095 1 1159 . 1 1 100 100 LEU HD22 H 1 1.130 0.030 . 1 . . . . 100 LEU HD2 . 11095 1 1160 . 1 1 100 100 LEU HD23 H 1 1.130 0.030 . 1 . . . . 100 LEU HD2 . 11095 1 1161 . 1 1 100 100 LEU HG H 1 1.602 0.030 . 1 . . . . 100 LEU HG . 11095 1 1162 . 1 1 100 100 LEU C C 13 178.135 0.300 . 1 . . . . 100 LEU C . 11095 1 1163 . 1 1 100 100 LEU CA C 13 57.546 0.300 . 1 . . . . 100 LEU CA . 11095 1 1164 . 1 1 100 100 LEU CB C 13 41.537 0.300 . 1 . . . . 100 LEU CB . 11095 1 1165 . 1 1 100 100 LEU CD1 C 13 23.480 0.300 . 2 . . . . 100 LEU CD1 . 11095 1 1166 . 1 1 100 100 LEU CD2 C 13 26.297 0.300 . 2 . . . . 100 LEU CD2 . 11095 1 1167 . 1 1 100 100 LEU CG C 13 27.042 0.300 . 1 . . . . 100 LEU CG . 11095 1 1168 . 1 1 100 100 LEU N N 15 122.439 0.300 . 1 . . . . 100 LEU N . 11095 1 1169 . 1 1 101 101 LEU H H 1 8.360 0.030 . 1 . . . . 101 LEU H . 11095 1 1170 . 1 1 101 101 LEU HA H 1 3.487 0.030 . 1 . . . . 101 LEU HA . 11095 1 1171 . 1 1 101 101 LEU HB2 H 1 1.056 0.030 . 2 . . . . 101 LEU HB2 . 11095 1 1172 . 1 1 101 101 LEU HB3 H 1 1.194 0.030 . 2 . . . . 101 LEU HB3 . 11095 1 1173 . 1 1 101 101 LEU HD11 H 1 0.138 0.030 . 1 . . . . 101 LEU HD1 . 11095 1 1174 . 1 1 101 101 LEU HD12 H 1 0.138 0.030 . 1 . . . . 101 LEU HD1 . 11095 1 1175 . 1 1 101 101 LEU HD13 H 1 0.138 0.030 . 1 . . . . 101 LEU HD1 . 11095 1 1176 . 1 1 101 101 LEU HD21 H 1 0.133 0.030 . 1 . . . . 101 LEU HD2 . 11095 1 1177 . 1 1 101 101 LEU HD22 H 1 0.133 0.030 . 1 . . . . 101 LEU HD2 . 11095 1 1178 . 1 1 101 101 LEU HD23 H 1 0.133 0.030 . 1 . . . . 101 LEU HD2 . 11095 1 1179 . 1 1 101 101 LEU HG H 1 0.598 0.030 . 1 . . . . 101 LEU HG . 11095 1 1180 . 1 1 101 101 LEU C C 13 177.783 0.300 . 1 . . . . 101 LEU C . 11095 1 1181 . 1 1 101 101 LEU CA C 13 57.868 0.300 . 1 . . . . 101 LEU CA . 11095 1 1182 . 1 1 101 101 LEU CB C 13 41.128 0.300 . 1 . . . . 101 LEU CB . 11095 1 1183 . 1 1 101 101 LEU CD1 C 13 24.605 0.300 . 2 . . . . 101 LEU CD1 . 11095 1 1184 . 1 1 101 101 LEU CD2 C 13 25.833 0.300 . 2 . . . . 101 LEU CD2 . 11095 1 1185 . 1 1 101 101 LEU CG C 13 26.242 0.300 . 1 . . . . 101 LEU CG . 11095 1 1186 . 1 1 101 101 LEU N N 15 120.750 0.300 . 1 . . . . 101 LEU N . 11095 1 1187 . 1 1 102 102 GLN H H 1 8.078 0.030 . 1 . . . . 102 GLN H . 11095 1 1188 . 1 1 102 102 GLN HA H 1 3.915 0.030 . 1 . . . . 102 GLN HA . 11095 1 1189 . 1 1 102 102 GLN HB2 H 1 1.938 0.030 . 2 . . . . 102 GLN HB2 . 11095 1 1190 . 1 1 102 102 GLN HB3 H 1 1.789 0.030 . 2 . . . . 102 GLN HB3 . 11095 1 1191 . 1 1 102 102 GLN HE21 H 1 7.504 0.030 . 2 . . . . 102 GLN HE21 . 11095 1 1192 . 1 1 102 102 GLN HE22 H 1 6.832 0.030 . 2 . . . . 102 GLN HE22 . 11095 1 1193 . 1 1 102 102 GLN HG2 H 1 2.068 0.030 . 2 . . . . 102 GLN HG2 . 11095 1 1194 . 1 1 102 102 GLN HG3 H 1 2.192 0.030 . 2 . . . . 102 GLN HG3 . 11095 1 1195 . 1 1 102 102 GLN C C 13 178.627 0.300 . 1 . . . . 102 GLN C . 11095 1 1196 . 1 1 102 102 GLN CA C 13 59.243 0.300 . 1 . . . . 102 GLN CA . 11095 1 1197 . 1 1 102 102 GLN CB C 13 29.337 0.300 . 1 . . . . 102 GLN CB . 11095 1 1198 . 1 1 102 102 GLN CG C 13 34.552 0.300 . 1 . . . . 102 GLN CG . 11095 1 1199 . 1 1 102 102 GLN N N 15 116.801 0.300 . 1 . . . . 102 GLN N . 11095 1 1200 . 1 1 102 102 GLN NE2 N 15 111.245 0.300 . 1 . . . . 102 GLN NE2 . 11095 1 1201 . 1 1 103 103 ASP H H 1 7.313 0.030 . 1 . . . . 103 ASP H . 11095 1 1202 . 1 1 103 103 ASP HA H 1 4.413 0.030 . 1 . . . . 103 ASP HA . 11095 1 1203 . 1 1 103 103 ASP HB2 H 1 2.823 0.030 . 2 . . . . 103 ASP HB2 . 11095 1 1204 . 1 1 103 103 ASP HB3 H 1 2.707 0.030 . 2 . . . . 103 ASP HB3 . 11095 1 1205 . 1 1 103 103 ASP C C 13 179.108 0.300 . 1 . . . . 103 ASP C . 11095 1 1206 . 1 1 103 103 ASP CA C 13 57.158 0.300 . 1 . . . . 103 ASP CA . 11095 1 1207 . 1 1 103 103 ASP CB C 13 41.046 0.300 . 1 . . . . 103 ASP CB . 11095 1 1208 . 1 1 103 103 ASP N N 15 119.105 0.300 . 1 . . . . 103 ASP N . 11095 1 1209 . 1 1 104 104 LEU H H 1 8.431 0.030 . 1 . . . . 104 LEU H . 11095 1 1210 . 1 1 104 104 LEU HA H 1 4.056 0.030 . 1 . . . . 104 LEU HA . 11095 1 1211 . 1 1 104 104 LEU HB2 H 1 1.261 0.030 . 2 . . . . 104 LEU HB2 . 11095 1 1212 . 1 1 104 104 LEU HB3 H 1 1.544 0.030 . 2 . . . . 104 LEU HB3 . 11095 1 1213 . 1 1 104 104 LEU HD11 H 1 0.798 0.030 . 1 . . . . 104 LEU HD1 . 11095 1 1214 . 1 1 104 104 LEU HD12 H 1 0.798 0.030 . 1 . . . . 104 LEU HD1 . 11095 1 1215 . 1 1 104 104 LEU HD13 H 1 0.798 0.030 . 1 . . . . 104 LEU HD1 . 11095 1 1216 . 1 1 104 104 LEU HD21 H 1 0.870 0.030 . 1 . . . . 104 LEU HD2 . 11095 1 1217 . 1 1 104 104 LEU HD22 H 1 0.870 0.030 . 1 . . . . 104 LEU HD2 . 11095 1 1218 . 1 1 104 104 LEU HD23 H 1 0.870 0.030 . 1 . . . . 104 LEU HD2 . 11095 1 1219 . 1 1 104 104 LEU HG H 1 1.762 0.030 . 1 . . . . 104 LEU HG . 11095 1 1220 . 1 1 104 104 LEU C C 13 180.222 0.300 . 1 . . . . 104 LEU C . 11095 1 1221 . 1 1 104 104 LEU CA C 13 57.698 0.300 . 1 . . . . 104 LEU CA . 11095 1 1222 . 1 1 104 104 LEU CB C 13 42.165 0.300 . 1 . . . . 104 LEU CB . 11095 1 1223 . 1 1 104 104 LEU CD1 C 13 26.496 0.300 . 2 . . . . 104 LEU CD1 . 11095 1 1224 . 1 1 104 104 LEU CD2 C 13 22.650 0.300 . 2 . . . . 104 LEU CD2 . 11095 1 1225 . 1 1 104 104 LEU CG C 13 26.742 0.300 . 1 . . . . 104 LEU CG . 11095 1 1226 . 1 1 104 104 LEU N N 15 121.272 0.300 . 1 . . . . 104 LEU N . 11095 1 1227 . 1 1 105 105 MET H H 1 8.527 0.030 . 1 . . . . 105 MET H . 11095 1 1228 . 1 1 105 105 MET HA H 1 4.099 0.030 . 1 . . . . 105 MET HA . 11095 1 1229 . 1 1 105 105 MET HB2 H 1 1.990 0.030 . 2 . . . . 105 MET HB2 . 11095 1 1230 . 1 1 105 105 MET HB3 H 1 1.922 0.030 . 2 . . . . 105 MET HB3 . 11095 1 1231 . 1 1 105 105 MET HE1 H 1 1.882 0.030 . 1 . . . . 105 MET HE . 11095 1 1232 . 1 1 105 105 MET HE2 H 1 1.882 0.030 . 1 . . . . 105 MET HE . 11095 1 1233 . 1 1 105 105 MET HE3 H 1 1.882 0.030 . 1 . . . . 105 MET HE . 11095 1 1234 . 1 1 105 105 MET HG2 H 1 2.044 0.030 . 2 . . . . 105 MET HG2 . 11095 1 1235 . 1 1 105 105 MET HG3 H 1 2.103 0.030 . 2 . . . . 105 MET HG3 . 11095 1 1236 . 1 1 105 105 MET C C 13 178.241 0.300 . 1 . . . . 105 MET C . 11095 1 1237 . 1 1 105 105 MET CA C 13 57.475 0.300 . 1 . . . . 105 MET CA . 11095 1 1238 . 1 1 105 105 MET CB C 13 32.003 0.300 . 1 . . . . 105 MET CB . 11095 1 1239 . 1 1 105 105 MET CE C 13 17.022 0.300 . 1 . . . . 105 MET CE . 11095 1 1240 . 1 1 105 105 MET CG C 13 32.874 0.300 . 1 . . . . 105 MET CG . 11095 1 1241 . 1 1 105 105 MET N N 15 117.898 0.300 . 1 . . . . 105 MET N . 11095 1 1242 . 1 1 106 106 GLN H H 1 7.639 0.030 . 1 . . . . 106 GLN H . 11095 1 1243 . 1 1 106 106 GLN HA H 1 4.272 0.030 . 1 . . . . 106 GLN HA . 11095 1 1244 . 1 1 106 106 GLN HB2 H 1 2.254 0.030 . 2 . . . . 106 GLN HB2 . 11095 1 1245 . 1 1 106 106 GLN HB3 H 1 2.210 0.030 . 2 . . . . 106 GLN HB3 . 11095 1 1246 . 1 1 106 106 GLN HE21 H 1 7.626 0.030 . 2 . . . . 106 GLN HE21 . 11095 1 1247 . 1 1 106 106 GLN HE22 H 1 6.863 0.030 . 2 . . . . 106 GLN HE22 . 11095 1 1248 . 1 1 106 106 GLN HG2 H 1 2.532 0.030 . 2 . . . . 106 GLN HG2 . 11095 1 1249 . 1 1 106 106 GLN HG3 H 1 2.471 0.030 . 2 . . . . 106 GLN HG3 . 11095 1 1250 . 1 1 106 106 GLN C C 13 177.288 0.300 . 1 . . . . 106 GLN C . 11095 1 1251 . 1 1 106 106 GLN CA C 13 57.521 0.300 . 1 . . . . 106 GLN CA . 11095 1 1252 . 1 1 106 106 GLN CB C 13 28.551 0.300 . 1 . . . . 106 GLN CB . 11095 1 1253 . 1 1 106 106 GLN CG C 13 34.059 0.300 . 1 . . . . 106 GLN CG . 11095 1 1254 . 1 1 106 106 GLN N N 15 118.094 0.300 . 1 . . . . 106 GLN N . 11095 1 1255 . 1 1 106 106 GLN NE2 N 15 112.639 0.300 . 1 . . . . 106 GLN NE2 . 11095 1 1256 . 1 1 107 107 CYS H H 1 7.992 0.030 . 1 . . . . 107 CYS H . 11095 1 1257 . 1 1 107 107 CYS HA H 1 4.421 0.030 . 1 . . . . 107 CYS HA . 11095 1 1258 . 1 1 107 107 CYS HB2 H 1 2.997 0.030 . 1 . . . . 107 CYS HB2 . 11095 1 1259 . 1 1 107 107 CYS HB3 H 1 2.997 0.030 . 1 . . . . 107 CYS HB3 . 11095 1 1260 . 1 1 107 107 CYS C C 13 175.046 0.300 . 1 . . . . 107 CYS C . 11095 1 1261 . 1 1 107 107 CYS CA C 13 59.940 0.300 . 1 . . . . 107 CYS CA . 11095 1 1262 . 1 1 107 107 CYS CB C 13 27.505 0.300 . 1 . . . . 107 CYS CB . 11095 1 1263 . 1 1 107 107 CYS N N 15 117.739 0.300 . 1 . . . . 107 CYS N . 11095 1 1264 . 1 1 108 108 ASN H H 1 8.166 0.030 . 1 . . . . 108 ASN H . 11095 1 1265 . 1 1 108 108 ASN HA H 1 4.780 0.030 . 1 . . . . 108 ASN HA . 11095 1 1266 . 1 1 108 108 ASN HB2 H 1 2.895 0.030 . 1 . . . . 108 ASN HB2 . 11095 1 1267 . 1 1 108 108 ASN HB3 H 1 2.895 0.030 . 1 . . . . 108 ASN HB3 . 11095 1 1268 . 1 1 108 108 ASN HD21 H 1 7.082 0.030 . 2 . . . . 108 ASN HD21 . 11095 1 1269 . 1 1 108 108 ASN HD22 H 1 7.667 0.030 . 2 . . . . 108 ASN HD22 . 11095 1 1270 . 1 1 108 108 ASN C C 13 175.107 0.300 . 1 . . . . 108 ASN C . 11095 1 1271 . 1 1 108 108 ASN CA C 13 53.788 0.300 . 1 . . . . 108 ASN CA . 11095 1 1272 . 1 1 108 108 ASN CB C 13 39.381 0.300 . 1 . . . . 108 ASN CB . 11095 1 1273 . 1 1 108 108 ASN N N 15 119.659 0.300 . 1 . . . . 108 ASN N . 11095 1 1274 . 1 1 108 108 ASN ND2 N 15 112.842 0.300 . 1 . . . . 108 ASN ND2 . 11095 1 1275 . 1 1 109 109 SER H H 1 8.132 0.030 . 1 . . . . 109 SER H . 11095 1 1276 . 1 1 109 109 SER HA H 1 4.355 0.030 . 1 . . . . 109 SER HA . 11095 1 1277 . 1 1 109 109 SER HB2 H 1 3.904 0.030 . 1 . . . . 109 SER HB2 . 11095 1 1278 . 1 1 109 109 SER HB3 H 1 3.904 0.030 . 1 . . . . 109 SER HB3 . 11095 1 1279 . 1 1 109 109 SER C C 13 174.546 0.300 . 1 . . . . 109 SER C . 11095 1 1280 . 1 1 109 109 SER CA C 13 59.074 0.300 . 1 . . . . 109 SER CA . 11095 1 1281 . 1 1 109 109 SER CB C 13 63.488 0.300 . 1 . . . . 109 SER CB . 11095 1 1282 . 1 1 109 109 SER N N 15 115.651 0.300 . 1 . . . . 109 SER N . 11095 1 1283 . 1 1 110 110 ILE H H 1 7.814 0.030 . 1 . . . . 110 ILE H . 11095 1 1284 . 1 1 110 110 ILE HA H 1 4.170 0.030 . 1 . . . . 110 ILE HA . 11095 1 1285 . 1 1 110 110 ILE HB H 1 1.890 0.030 . 1 . . . . 110 ILE HB . 11095 1 1286 . 1 1 110 110 ILE HD11 H 1 0.860 0.030 . 1 . . . . 110 ILE HD1 . 11095 1 1287 . 1 1 110 110 ILE HD12 H 1 0.860 0.030 . 1 . . . . 110 ILE HD1 . 11095 1 1288 . 1 1 110 110 ILE HD13 H 1 0.860 0.030 . 1 . . . . 110 ILE HD1 . 11095 1 1289 . 1 1 110 110 ILE HG12 H 1 1.437 0.030 . 2 . . . . 110 ILE HG12 . 11095 1 1290 . 1 1 110 110 ILE HG13 H 1 1.185 0.030 . 2 . . . . 110 ILE HG13 . 11095 1 1291 . 1 1 110 110 ILE HG21 H 1 0.885 0.030 . 1 . . . . 110 ILE HG2 . 11095 1 1292 . 1 1 110 110 ILE HG22 H 1 0.885 0.030 . 1 . . . . 110 ILE HG2 . 11095 1 1293 . 1 1 110 110 ILE HG23 H 1 0.885 0.030 . 1 . . . . 110 ILE HG2 . 11095 1 1294 . 1 1 110 110 ILE C C 13 175.785 0.300 . 1 . . . . 110 ILE C . 11095 1 1295 . 1 1 110 110 ILE CA C 13 61.433 0.300 . 1 . . . . 110 ILE CA . 11095 1 1296 . 1 1 110 110 ILE CB C 13 38.626 0.300 . 1 . . . . 110 ILE CB . 11095 1 1297 . 1 1 110 110 ILE CD1 C 13 13.316 0.300 . 1 . . . . 110 ILE CD1 . 11095 1 1298 . 1 1 110 110 ILE CG1 C 13 27.306 0.300 . 1 . . . . 110 ILE CG1 . 11095 1 1299 . 1 1 110 110 ILE CG2 C 13 17.618 0.300 . 1 . . . . 110 ILE CG2 . 11095 1 1300 . 1 1 110 110 ILE N N 15 120.615 0.300 . 1 . . . . 110 ILE N . 11095 1 1301 . 1 1 111 111 ASN H H 1 8.272 0.030 . 1 . . . . 111 ASN H . 11095 1 1302 . 1 1 111 111 ASN HA H 1 4.661 0.030 . 1 . . . . 111 ASN HA . 11095 1 1303 . 1 1 111 111 ASN HB2 H 1 2.838 0.030 . 2 . . . . 111 ASN HB2 . 11095 1 1304 . 1 1 111 111 ASN HB3 H 1 2.711 0.030 . 2 . . . . 111 ASN HB3 . 11095 1 1305 . 1 1 111 111 ASN HD21 H 1 6.920 0.030 . 2 . . . . 111 ASN HD21 . 11095 1 1306 . 1 1 111 111 ASN HD22 H 1 7.589 0.030 . 2 . . . . 111 ASN HD22 . 11095 1 1307 . 1 1 111 111 ASN C C 13 175.051 0.300 . 1 . . . . 111 ASN C . 11095 1 1308 . 1 1 111 111 ASN CA C 13 53.212 0.300 . 1 . . . . 111 ASN CA . 11095 1 1309 . 1 1 111 111 ASN CB C 13 39.035 0.300 . 1 . . . . 111 ASN CB . 11095 1 1310 . 1 1 111 111 ASN N N 15 121.710 0.300 . 1 . . . . 111 ASN N . 11095 1 1311 . 1 1 111 111 ASN ND2 N 15 112.821 0.300 . 1 . . . . 111 ASN ND2 . 11095 1 1312 . 1 1 112 112 VAL H H 1 8.008 0.030 . 1 . . . . 112 VAL H . 11095 1 1313 . 1 1 112 112 VAL HA H 1 4.096 0.030 . 1 . . . . 112 VAL HA . 11095 1 1314 . 1 1 112 112 VAL HB H 1 2.104 0.030 . 1 . . . . 112 VAL HB . 11095 1 1315 . 1 1 112 112 VAL HG11 H 1 0.912 0.030 . 1 . . . . 112 VAL HG1 . 11095 1 1316 . 1 1 112 112 VAL HG12 H 1 0.912 0.030 . 1 . . . . 112 VAL HG1 . 11095 1 1317 . 1 1 112 112 VAL HG13 H 1 0.912 0.030 . 1 . . . . 112 VAL HG1 . 11095 1 1318 . 1 1 112 112 VAL HG21 H 1 0.912 0.030 . 1 . . . . 112 VAL HG2 . 11095 1 1319 . 1 1 112 112 VAL HG22 H 1 0.912 0.030 . 1 . . . . 112 VAL HG2 . 11095 1 1320 . 1 1 112 112 VAL HG23 H 1 0.912 0.030 . 1 . . . . 112 VAL HG2 . 11095 1 1321 . 1 1 112 112 VAL C C 13 175.940 0.300 . 1 . . . . 112 VAL C . 11095 1 1322 . 1 1 112 112 VAL CA C 13 62.337 0.300 . 1 . . . . 112 VAL CA . 11095 1 1323 . 1 1 112 112 VAL CB C 13 32.579 0.300 . 1 . . . . 112 VAL CB . 11095 1 1324 . 1 1 112 112 VAL CG1 C 13 20.568 0.300 . 2 . . . . 112 VAL CG1 . 11095 1 1325 . 1 1 112 112 VAL CG2 C 13 20.568 0.300 . 2 . . . . 112 VAL CG2 . 11095 1 1326 . 1 1 112 112 VAL N N 15 120.044 0.300 . 1 . . . . 112 VAL N . 11095 1 1327 . 1 1 113 113 MET H H 1 8.301 0.030 . 1 . . . . 113 MET H . 11095 1 1328 . 1 1 113 113 MET HA H 1 4.487 0.030 . 1 . . . . 113 MET HA . 11095 1 1329 . 1 1 113 113 MET HB2 H 1 2.083 0.030 . 2 . . . . 113 MET HB2 . 11095 1 1330 . 1 1 113 113 MET HB3 H 1 2.002 0.030 . 2 . . . . 113 MET HB3 . 11095 1 1331 . 1 1 113 113 MET HE1 H 1 2.082 0.030 . 1 . . . . 113 MET HE . 11095 1 1332 . 1 1 113 113 MET HE2 H 1 2.082 0.030 . 1 . . . . 113 MET HE . 11095 1 1333 . 1 1 113 113 MET HE3 H 1 2.082 0.030 . 1 . . . . 113 MET HE . 11095 1 1334 . 1 1 113 113 MET HG2 H 1 2.591 0.030 . 2 . . . . 113 MET HG2 . 11095 1 1335 . 1 1 113 113 MET HG3 H 1 2.518 0.030 . 2 . . . . 113 MET HG3 . 11095 1 1336 . 1 1 113 113 MET C C 13 175.893 0.300 . 1 . . . . 113 MET C . 11095 1 1337 . 1 1 113 113 MET CA C 13 55.331 0.300 . 1 . . . . 113 MET CA . 11095 1 1338 . 1 1 113 113 MET CB C 13 32.908 0.300 . 1 . . . . 113 MET CB . 11095 1 1339 . 1 1 113 113 MET CE C 13 17.055 0.300 . 1 . . . . 113 MET CE . 11095 1 1340 . 1 1 113 113 MET CG C 13 32.086 0.300 . 1 . . . . 113 MET CG . 11095 1 1341 . 1 1 113 113 MET N N 15 123.247 0.300 . 1 . . . . 113 MET N . 11095 1 1342 . 1 1 114 114 GLU H H 1 8.244 0.030 . 1 . . . . 114 GLU H . 11095 1 1343 . 1 1 114 114 GLU HA H 1 4.281 0.030 . 1 . . . . 114 GLU HA . 11095 1 1344 . 1 1 114 114 GLU HB2 H 1 1.999 0.030 . 2 . . . . 114 GLU HB2 . 11095 1 1345 . 1 1 114 114 GLU HB3 H 1 1.894 0.030 . 2 . . . . 114 GLU HB3 . 11095 1 1346 . 1 1 114 114 GLU HG2 H 1 2.244 0.030 . 2 . . . . 114 GLU HG2 . 11095 1 1347 . 1 1 114 114 GLU HG3 H 1 2.202 0.030 . 2 . . . . 114 GLU HG3 . 11095 1 1348 . 1 1 114 114 GLU C C 13 175.944 0.300 . 1 . . . . 114 GLU C . 11095 1 1349 . 1 1 114 114 GLU CA C 13 56.190 0.300 . 1 . . . . 114 GLU CA . 11095 1 1350 . 1 1 114 114 GLU CB C 13 30.606 0.300 . 1 . . . . 114 GLU CB . 11095 1 1351 . 1 1 114 114 GLU CG C 13 36.196 0.300 . 1 . . . . 114 GLU CG . 11095 1 1352 . 1 1 114 114 GLU N N 15 122.137 0.300 . 1 . . . . 114 GLU N . 11095 1 1353 . 1 1 115 115 GLU H H 1 8.386 0.030 . 1 . . . . 115 GLU H . 11095 1 1354 . 1 1 115 115 GLU HA H 1 4.528 0.030 . 1 . . . . 115 GLU HA . 11095 1 1355 . 1 1 115 115 GLU HB2 H 1 1.880 0.030 . 2 . . . . 115 GLU HB2 . 11095 1 1356 . 1 1 115 115 GLU HB3 H 1 2.007 0.030 . 2 . . . . 115 GLU HB3 . 11095 1 1357 . 1 1 115 115 GLU HG2 H 1 2.267 0.030 . 1 . . . . 115 GLU HG2 . 11095 1 1358 . 1 1 115 115 GLU HG3 H 1 2.267 0.030 . 1 . . . . 115 GLU HG3 . 11095 1 1359 . 1 1 115 115 GLU C C 13 174.380 0.300 . 1 . . . . 115 GLU C . 11095 1 1360 . 1 1 115 115 GLU CA C 13 54.445 0.300 . 1 . . . . 115 GLU CA . 11095 1 1361 . 1 1 115 115 GLU CB C 13 29.987 0.300 . 1 . . . . 115 GLU CB . 11095 1 1362 . 1 1 115 115 GLU CG C 13 35.942 0.300 . 1 . . . . 115 GLU CG . 11095 1 1363 . 1 1 115 115 GLU N N 15 123.831 0.300 . 1 . . . . 115 GLU N . 11095 1 1364 . 1 1 116 116 PRO HA H 1 4.422 0.030 . 1 . . . . 116 PRO HA . 11095 1 1365 . 1 1 116 116 PRO HB2 H 1 2.243 0.030 . 2 . . . . 116 PRO HB2 . 11095 1 1366 . 1 1 116 116 PRO HB3 H 1 1.825 0.030 . 2 . . . . 116 PRO HB3 . 11095 1 1367 . 1 1 116 116 PRO HD2 H 1 3.666 0.030 . 2 . . . . 116 PRO HD2 . 11095 1 1368 . 1 1 116 116 PRO HD3 H 1 3.792 0.030 . 2 . . . . 116 PRO HD3 . 11095 1 1369 . 1 1 116 116 PRO HG2 H 1 1.981 0.030 . 1 . . . . 116 PRO HG2 . 11095 1 1370 . 1 1 116 116 PRO HG3 H 1 1.981 0.030 . 1 . . . . 116 PRO HG3 . 11095 1 1371 . 1 1 116 116 PRO CA C 13 62.963 0.300 . 1 . . . . 116 PRO CA . 11095 1 1372 . 1 1 116 116 PRO CB C 13 32.138 0.300 . 1 . . . . 116 PRO CB . 11095 1 1373 . 1 1 116 116 PRO CD C 13 50.745 0.300 . 1 . . . . 116 PRO CD . 11095 1 1374 . 1 1 116 116 PRO CG C 13 27.406 0.300 . 1 . . . . 116 PRO CG . 11095 1 1375 . 1 1 117 117 VAL H H 1 8.220 0.030 . 1 . . . . 117 VAL H . 11095 1 1376 . 1 1 117 117 VAL HA H 1 4.017 0.030 . 1 . . . . 117 VAL HA . 11095 1 1377 . 1 1 117 117 VAL HB H 1 1.990 0.030 . 1 . . . . 117 VAL HB . 11095 1 1378 . 1 1 117 117 VAL HG11 H 1 0.880 0.030 . 1 . . . . 117 VAL HG1 . 11095 1 1379 . 1 1 117 117 VAL HG12 H 1 0.880 0.030 . 1 . . . . 117 VAL HG1 . 11095 1 1380 . 1 1 117 117 VAL HG13 H 1 0.880 0.030 . 1 . . . . 117 VAL HG1 . 11095 1 1381 . 1 1 117 117 VAL HG21 H 1 0.943 0.030 . 1 . . . . 117 VAL HG2 . 11095 1 1382 . 1 1 117 117 VAL HG22 H 1 0.943 0.030 . 1 . . . . 117 VAL HG2 . 11095 1 1383 . 1 1 117 117 VAL HG23 H 1 0.943 0.030 . 1 . . . . 117 VAL HG2 . 11095 1 1384 . 1 1 117 117 VAL C C 13 175.944 0.300 . 1 . . . . 117 VAL C . 11095 1 1385 . 1 1 117 117 VAL CA C 13 62.485 0.300 . 1 . . . . 117 VAL CA . 11095 1 1386 . 1 1 117 117 VAL CB C 13 32.651 0.300 . 1 . . . . 117 VAL CB . 11095 1 1387 . 1 1 117 117 VAL CG1 C 13 20.988 0.300 . 2 . . . . 117 VAL CG1 . 11095 1 1388 . 1 1 117 117 VAL CG2 C 13 20.988 0.300 . 2 . . . . 117 VAL CG2 . 11095 1 1389 . 1 1 117 117 VAL N N 15 121.047 0.300 . 1 . . . . 117 VAL N . 11095 1 1390 . 1 1 118 118 ILE H H 1 8.263 0.030 . 1 . . . . 118 ILE H . 11095 1 1391 . 1 1 118 118 ILE HA H 1 4.164 0.030 . 1 . . . . 118 ILE HA . 11095 1 1392 . 1 1 118 118 ILE HB H 1 1.792 0.030 . 1 . . . . 118 ILE HB . 11095 1 1393 . 1 1 118 118 ILE HD11 H 1 0.812 0.030 . 1 . . . . 118 ILE HD1 . 11095 1 1394 . 1 1 118 118 ILE HD12 H 1 0.812 0.030 . 1 . . . . 118 ILE HD1 . 11095 1 1395 . 1 1 118 118 ILE HD13 H 1 0.812 0.030 . 1 . . . . 118 ILE HD1 . 11095 1 1396 . 1 1 118 118 ILE HG12 H 1 1.438 0.030 . 2 . . . . 118 ILE HG12 . 11095 1 1397 . 1 1 118 118 ILE HG13 H 1 1.134 0.030 . 2 . . . . 118 ILE HG13 . 11095 1 1398 . 1 1 118 118 ILE HG21 H 1 0.817 0.030 . 1 . . . . 118 ILE HG2 . 11095 1 1399 . 1 1 118 118 ILE HG22 H 1 0.817 0.030 . 1 . . . . 118 ILE HG2 . 11095 1 1400 . 1 1 118 118 ILE HG23 H 1 0.817 0.030 . 1 . . . . 118 ILE HG2 . 11095 1 1401 . 1 1 118 118 ILE C C 13 175.887 0.300 . 1 . . . . 118 ILE C . 11095 1 1402 . 1 1 118 118 ILE CA C 13 60.664 0.300 . 1 . . . . 118 ILE CA . 11095 1 1403 . 1 1 118 118 ILE CB C 13 38.613 0.300 . 1 . . . . 118 ILE CB . 11095 1 1404 . 1 1 118 118 ILE CD1 C 13 12.598 0.300 . 1 . . . . 118 ILE CD1 . 11095 1 1405 . 1 1 118 118 ILE CG1 C 13 27.153 0.300 . 1 . . . . 118 ILE CG1 . 11095 1 1406 . 1 1 118 118 ILE CG2 C 13 17.442 0.300 . 1 . . . . 118 ILE CG2 . 11095 1 1407 . 1 1 118 118 ILE N N 15 125.965 0.300 . 1 . . . . 118 ILE N . 11095 1 1408 . 1 1 119 119 ILE H H 1 8.381 0.030 . 1 . . . . 119 ILE H . 11095 1 1409 . 1 1 119 119 ILE HA H 1 4.242 0.030 . 1 . . . . 119 ILE HA . 11095 1 1410 . 1 1 119 119 ILE HB H 1 1.850 0.030 . 1 . . . . 119 ILE HB . 11095 1 1411 . 1 1 119 119 ILE HD11 H 1 0.811 0.030 . 1 . . . . 119 ILE HD1 . 11095 1 1412 . 1 1 119 119 ILE HD12 H 1 0.811 0.030 . 1 . . . . 119 ILE HD1 . 11095 1 1413 . 1 1 119 119 ILE HD13 H 1 0.811 0.030 . 1 . . . . 119 ILE HD1 . 11095 1 1414 . 1 1 119 119 ILE HG12 H 1 1.449 0.030 . 2 . . . . 119 ILE HG12 . 11095 1 1415 . 1 1 119 119 ILE HG13 H 1 1.182 0.030 . 2 . . . . 119 ILE HG13 . 11095 1 1416 . 1 1 119 119 ILE HG21 H 1 0.882 0.030 . 1 . . . . 119 ILE HG2 . 11095 1 1417 . 1 1 119 119 ILE HG22 H 1 0.882 0.030 . 1 . . . . 119 ILE HG2 . 11095 1 1418 . 1 1 119 119 ILE HG23 H 1 0.882 0.030 . 1 . . . . 119 ILE HG2 . 11095 1 1419 . 1 1 119 119 ILE C C 13 176.374 0.300 . 1 . . . . 119 ILE C . 11095 1 1420 . 1 1 119 119 ILE CA C 13 60.714 0.300 . 1 . . . . 119 ILE CA . 11095 1 1421 . 1 1 119 119 ILE CB C 13 38.522 0.300 . 1 . . . . 119 ILE CB . 11095 1 1422 . 1 1 119 119 ILE CD1 C 13 12.521 0.300 . 1 . . . . 119 ILE CD1 . 11095 1 1423 . 1 1 119 119 ILE CG1 C 13 27.207 0.300 . 1 . . . . 119 ILE CG1 . 11095 1 1424 . 1 1 119 119 ILE CG2 C 13 17.634 0.300 . 1 . . . . 119 ILE CG2 . 11095 1 1425 . 1 1 119 119 ILE N N 15 126.679 0.300 . 1 . . . . 119 ILE N . 11095 1 1426 . 1 1 120 120 THR H H 1 8.304 0.030 . 1 . . . . 120 THR H . 11095 1 1427 . 1 1 120 120 THR HA H 1 4.417 0.030 . 1 . . . . 120 THR HA . 11095 1 1428 . 1 1 120 120 THR HB H 1 4.245 0.030 . 1 . . . . 120 THR HB . 11095 1 1429 . 1 1 120 120 THR HG21 H 1 1.178 0.030 . 1 . . . . 120 THR HG2 . 11095 1 1430 . 1 1 120 120 THR HG22 H 1 1.178 0.030 . 1 . . . . 120 THR HG2 . 11095 1 1431 . 1 1 120 120 THR HG23 H 1 1.178 0.030 . 1 . . . . 120 THR HG2 . 11095 1 1432 . 1 1 120 120 THR C C 13 174.492 0.300 . 1 . . . . 120 THR C . 11095 1 1433 . 1 1 120 120 THR CA C 13 61.479 0.300 . 1 . . . . 120 THR CA . 11095 1 1434 . 1 1 120 120 THR CB C 13 69.876 0.300 . 1 . . . . 120 THR CB . 11095 1 1435 . 1 1 120 120 THR CG2 C 13 21.481 0.300 . 1 . . . . 120 THR CG2 . 11095 1 1436 . 1 1 120 120 THR N N 15 118.911 0.300 . 1 . . . . 120 THR N . 11095 1 1437 . 1 1 121 121 SER H H 1 8.370 0.030 . 1 . . . . 121 SER H . 11095 1 1438 . 1 1 121 121 SER C C 13 174.986 0.300 . 1 . . . . 121 SER C . 11095 1 1439 . 1 1 121 121 SER CA C 13 58.145 0.300 . 1 . . . . 121 SER CA . 11095 1 1440 . 1 1 121 121 SER CB C 13 63.981 0.300 . 1 . . . . 121 SER CB . 11095 1 1441 . 1 1 121 121 SER N N 15 118.168 0.300 . 1 . . . . 121 SER N . 11095 1 1442 . 1 1 133 133 SER HA H 1 4.219 0.030 . 1 . . . . 133 SER HA . 11095 1 1443 . 1 1 133 133 SER HB2 H 1 3.841 0.030 . 2 . . . . 133 SER HB2 . 11095 1 1444 . 1 1 133 133 SER HB3 H 1 3.944 0.030 . 2 . . . . 133 SER HB3 . 11095 1 1445 . 1 1 133 133 SER CA C 13 60.100 0.300 . 1 . . . . 133 SER CA . 11095 1 1446 . 1 1 133 133 SER CB C 13 63.527 0.300 . 1 . . . . 133 SER CB . 11095 1 1447 . 1 1 134 134 GLY H H 1 8.242 0.030 . 1 . . . . 134 GLY H . 11095 1 1448 . 1 1 134 134 GLY HA2 H 1 3.894 0.030 . 2 . . . . 134 GLY HA2 . 11095 1 1449 . 1 1 134 134 GLY HA3 H 1 4.023 0.030 . 2 . . . . 134 GLY HA3 . 11095 1 1450 . 1 1 134 134 GLY C C 13 174.423 0.300 . 1 . . . . 134 GLY C . 11095 1 1451 . 1 1 134 134 GLY CA C 13 45.292 0.300 . 1 . . . . 134 GLY CA . 11095 1 1452 . 1 1 134 134 GLY N N 15 108.296 0.300 . 1 . . . . 134 GLY N . 11095 1 1453 . 1 1 135 135 LEU H H 1 7.671 0.030 . 1 . . . . 135 LEU H . 11095 1 1454 . 1 1 135 135 LEU HA H 1 4.398 0.030 . 1 . . . . 135 LEU HA . 11095 1 1455 . 1 1 135 135 LEU HB2 H 1 1.952 0.030 . 2 . . . . 135 LEU HB2 . 11095 1 1456 . 1 1 135 135 LEU HB3 H 1 1.456 0.030 . 2 . . . . 135 LEU HB3 . 11095 1 1457 . 1 1 135 135 LEU HD11 H 1 0.977 0.030 . 1 . . . . 135 LEU HD1 . 11095 1 1458 . 1 1 135 135 LEU HD12 H 1 0.977 0.030 . 1 . . . . 135 LEU HD1 . 11095 1 1459 . 1 1 135 135 LEU HD13 H 1 0.977 0.030 . 1 . . . . 135 LEU HD1 . 11095 1 1460 . 1 1 135 135 LEU HD21 H 1 0.986 0.030 . 1 . . . . 135 LEU HD2 . 11095 1 1461 . 1 1 135 135 LEU HD22 H 1 0.986 0.030 . 1 . . . . 135 LEU HD2 . 11095 1 1462 . 1 1 135 135 LEU HD23 H 1 0.986 0.030 . 1 . . . . 135 LEU HD2 . 11095 1 1463 . 1 1 135 135 LEU HG H 1 1.738 0.030 . 1 . . . . 135 LEU HG . 11095 1 1464 . 1 1 135 135 LEU C C 13 176.262 0.300 . 1 . . . . 135 LEU C . 11095 1 1465 . 1 1 135 135 LEU CA C 13 54.363 0.300 . 1 . . . . 135 LEU CA . 11095 1 1466 . 1 1 135 135 LEU CB C 13 43.963 0.300 . 1 . . . . 135 LEU CB . 11095 1 1467 . 1 1 135 135 LEU CD1 C 13 26.825 0.300 . 2 . . . . 135 LEU CD1 . 11095 1 1468 . 1 1 135 135 LEU CD2 C 13 23.151 0.300 . 2 . . . . 135 LEU CD2 . 11095 1 1469 . 1 1 135 135 LEU CG C 13 27.092 0.300 . 1 . . . . 135 LEU CG . 11095 1 1470 . 1 1 135 135 LEU N N 15 120.371 0.300 . 1 . . . . 135 LEU N . 11095 1 1471 . 1 1 136 136 PHE H H 1 8.678 0.030 . 1 . . . . 136 PHE H . 11095 1 1472 . 1 1 136 136 PHE HA H 1 4.316 0.030 . 1 . . . . 136 PHE HA . 11095 1 1473 . 1 1 136 136 PHE HB2 H 1 2.920 0.030 . 2 . . . . 136 PHE HB2 . 11095 1 1474 . 1 1 136 136 PHE HB3 H 1 2.791 0.030 . 2 . . . . 136 PHE HB3 . 11095 1 1475 . 1 1 136 136 PHE HD1 H 1 7.078 0.030 . 1 . . . . 136 PHE HD1 . 11095 1 1476 . 1 1 136 136 PHE HD2 H 1 7.078 0.030 . 1 . . . . 136 PHE HD2 . 11095 1 1477 . 1 1 136 136 PHE HE1 H 1 7.452 0.030 . 1 . . . . 136 PHE HE1 . 11095 1 1478 . 1 1 136 136 PHE HE2 H 1 7.452 0.030 . 1 . . . . 136 PHE HE2 . 11095 1 1479 . 1 1 136 136 PHE HZ H 1 7.442 0.030 . 1 . . . . 136 PHE HZ . 11095 1 1480 . 1 1 136 136 PHE C C 13 174.743 0.300 . 1 . . . . 136 PHE C . 11095 1 1481 . 1 1 136 136 PHE CA C 13 58.676 0.300 . 1 . . . . 136 PHE CA . 11095 1 1482 . 1 1 136 136 PHE CB C 13 41.004 0.300 . 1 . . . . 136 PHE CB . 11095 1 1483 . 1 1 136 136 PHE CD1 C 13 132.071 0.300 . 1 . . . . 136 PHE CD1 . 11095 1 1484 . 1 1 136 136 PHE CD2 C 13 132.071 0.300 . 1 . . . . 136 PHE CD2 . 11095 1 1485 . 1 1 136 136 PHE CE1 C 13 132.024 0.300 . 1 . . . . 136 PHE CE1 . 11095 1 1486 . 1 1 136 136 PHE CE2 C 13 132.024 0.300 . 1 . . . . 136 PHE CE2 . 11095 1 1487 . 1 1 136 136 PHE CZ C 13 130.607 0.300 . 1 . . . . 136 PHE CZ . 11095 1 1488 . 1 1 136 136 PHE N N 15 125.944 0.300 . 1 . . . . 136 PHE N . 11095 1 1489 . 1 1 137 137 ARG H H 1 7.779 0.030 . 1 . . . . 137 ARG H . 11095 1 1490 . 1 1 137 137 ARG HA H 1 4.322 0.030 . 1 . . . . 137 ARG HA . 11095 1 1491 . 1 1 137 137 ARG HB2 H 1 1.404 0.030 . 2 . . . . 137 ARG HB2 . 11095 1 1492 . 1 1 137 137 ARG HB3 H 1 1.726 0.030 . 2 . . . . 137 ARG HB3 . 11095 1 1493 . 1 1 137 137 ARG HD2 H 1 3.182 0.030 . 2 . . . . 137 ARG HD2 . 11095 1 1494 . 1 1 137 137 ARG HD3 H 1 3.124 0.030 . 2 . . . . 137 ARG HD3 . 11095 1 1495 . 1 1 137 137 ARG HG2 H 1 1.427 0.030 . 2 . . . . 137 ARG HG2 . 11095 1 1496 . 1 1 137 137 ARG HG3 H 1 1.242 0.030 . 2 . . . . 137 ARG HG3 . 11095 1 1497 . 1 1 137 137 ARG C C 13 175.189 0.300 . 1 . . . . 137 ARG C . 11095 1 1498 . 1 1 137 137 ARG CA C 13 55.083 0.300 . 1 . . . . 137 ARG CA . 11095 1 1499 . 1 1 137 137 ARG CB C 13 30.365 0.300 . 1 . . . . 137 ARG CB . 11095 1 1500 . 1 1 137 137 ARG CD C 13 43.594 0.300 . 1 . . . . 137 ARG CD . 11095 1 1501 . 1 1 137 137 ARG CG C 13 28.344 0.300 . 1 . . . . 137 ARG CG . 11095 1 1502 . 1 1 137 137 ARG N N 15 128.711 0.300 . 1 . . . . 137 ARG N . 11095 1 1503 . 1 1 138 138 LEU H H 1 8.626 0.030 . 1 . . . . 138 LEU H . 11095 1 1504 . 1 1 138 138 LEU HA H 1 4.446 0.030 . 1 . . . . 138 LEU HA . 11095 1 1505 . 1 1 138 138 LEU HB2 H 1 1.610 0.030 . 2 . . . . 138 LEU HB2 . 11095 1 1506 . 1 1 138 138 LEU HB3 H 1 1.204 0.030 . 2 . . . . 138 LEU HB3 . 11095 1 1507 . 1 1 138 138 LEU HD11 H 1 0.664 0.030 . 1 . . . . 138 LEU HD1 . 11095 1 1508 . 1 1 138 138 LEU HD12 H 1 0.664 0.030 . 1 . . . . 138 LEU HD1 . 11095 1 1509 . 1 1 138 138 LEU HD13 H 1 0.664 0.030 . 1 . . . . 138 LEU HD1 . 11095 1 1510 . 1 1 138 138 LEU HD21 H 1 0.738 0.030 . 1 . . . . 138 LEU HD2 . 11095 1 1511 . 1 1 138 138 LEU HD22 H 1 0.738 0.030 . 1 . . . . 138 LEU HD2 . 11095 1 1512 . 1 1 138 138 LEU HD23 H 1 0.738 0.030 . 1 . . . . 138 LEU HD2 . 11095 1 1513 . 1 1 138 138 LEU HG H 1 1.742 0.030 . 1 . . . . 138 LEU HG . 11095 1 1514 . 1 1 138 138 LEU C C 13 177.880 0.300 . 1 . . . . 138 LEU C . 11095 1 1515 . 1 1 138 138 LEU CA C 13 54.746 0.300 . 1 . . . . 138 LEU CA . 11095 1 1516 . 1 1 138 138 LEU CB C 13 43.101 0.300 . 1 . . . . 138 LEU CB . 11095 1 1517 . 1 1 138 138 LEU CD1 C 13 27.027 0.300 . 2 . . . . 138 LEU CD1 . 11095 1 1518 . 1 1 138 138 LEU CD2 C 13 23.362 0.300 . 2 . . . . 138 LEU CD2 . 11095 1 1519 . 1 1 138 138 LEU CG C 13 27.192 0.300 . 1 . . . . 138 LEU CG . 11095 1 1520 . 1 1 138 138 LEU N N 15 124.097 0.300 . 1 . . . . 138 LEU N . 11095 1 1521 . 1 1 139 139 ARG H H 1 9.554 0.030 . 1 . . . . 139 ARG H . 11095 1 1522 . 1 1 139 139 ARG HA H 1 4.070 0.030 . 1 . . . . 139 ARG HA . 11095 1 1523 . 1 1 139 139 ARG HB2 H 1 1.686 0.030 . 2 . . . . 139 ARG HB2 . 11095 1 1524 . 1 1 139 139 ARG HB3 H 1 1.544 0.030 . 2 . . . . 139 ARG HB3 . 11095 1 1525 . 1 1 139 139 ARG HD2 H 1 3.110 0.030 . 1 . . . . 139 ARG HD2 . 11095 1 1526 . 1 1 139 139 ARG HD3 H 1 3.110 0.030 . 1 . . . . 139 ARG HD3 . 11095 1 1527 . 1 1 139 139 ARG HG2 H 1 1.540 0.030 . 2 . . . . 139 ARG HG2 . 11095 1 1528 . 1 1 139 139 ARG HG3 H 1 1.394 0.030 . 2 . . . . 139 ARG HG3 . 11095 1 1529 . 1 1 139 139 ARG C C 13 176.462 0.300 . 1 . . . . 139 ARG C . 11095 1 1530 . 1 1 139 139 ARG CA C 13 57.405 0.300 . 1 . . . . 139 ARG CA . 11095 1 1531 . 1 1 139 139 ARG CB C 13 31.015 0.300 . 1 . . . . 139 ARG CB . 11095 1 1532 . 1 1 139 139 ARG CD C 13 43.348 0.300 . 1 . . . . 139 ARG CD . 11095 1 1533 . 1 1 139 139 ARG CG C 13 27.562 0.300 . 1 . . . . 139 ARG CG . 11095 1 1534 . 1 1 139 139 ARG N N 15 119.411 0.300 . 1 . . . . 139 ARG N . 11095 1 1535 . 1 1 140 140 HIS H H 1 7.591 0.030 . 1 . . . . 140 HIS H . 11095 1 1536 . 1 1 140 140 HIS HA H 1 4.722 0.030 . 1 . . . . 140 HIS HA . 11095 1 1537 . 1 1 140 140 HIS HB2 H 1 2.825 0.030 . 2 . . . . 140 HIS HB2 . 11095 1 1538 . 1 1 140 140 HIS HB3 H 1 2.941 0.030 . 2 . . . . 140 HIS HB3 . 11095 1 1539 . 1 1 140 140 HIS HD2 H 1 6.896 0.030 . 1 . . . . 140 HIS HD2 . 11095 1 1540 . 1 1 140 140 HIS HE1 H 1 7.819 0.030 . 1 . . . . 140 HIS HE1 . 11095 1 1541 . 1 1 140 140 HIS C C 13 173.169 0.300 . 1 . . . . 140 HIS C . 11095 1 1542 . 1 1 140 140 HIS CA C 13 53.541 0.300 . 1 . . . . 140 HIS CA . 11095 1 1543 . 1 1 140 140 HIS CB C 13 32.990 0.300 . 1 . . . . 140 HIS CB . 11095 1 1544 . 1 1 140 140 HIS CD2 C 13 120.467 0.300 . 1 . . . . 140 HIS CD2 . 11095 1 1545 . 1 1 140 140 HIS CE1 C 13 138.012 0.300 . 1 . . . . 140 HIS CE1 . 11095 1 1546 . 1 1 140 140 HIS N N 15 115.668 0.300 . 1 . . . . 140 HIS N . 11095 1 1547 . 1 1 141 141 PHE HA H 1 4.285 0.030 . 1 . . . . 141 PHE HA . 11095 1 1548 . 1 1 141 141 PHE HB2 H 1 2.802 0.030 . 2 . . . . 141 PHE HB2 . 11095 1 1549 . 1 1 141 141 PHE HB3 H 1 3.053 0.030 . 2 . . . . 141 PHE HB3 . 11095 1 1550 . 1 1 141 141 PHE HD1 H 1 7.056 0.030 . 1 . . . . 141 PHE HD1 . 11095 1 1551 . 1 1 141 141 PHE HD2 H 1 7.056 0.030 . 1 . . . . 141 PHE HD2 . 11095 1 1552 . 1 1 141 141 PHE HE1 H 1 6.878 0.030 . 1 . . . . 141 PHE HE1 . 11095 1 1553 . 1 1 141 141 PHE HE2 H 1 6.878 0.030 . 1 . . . . 141 PHE HE2 . 11095 1 1554 . 1 1 141 141 PHE HZ H 1 6.649 0.030 . 1 . . . . 141 PHE HZ . 11095 1 1555 . 1 1 141 141 PHE CA C 13 56.622 0.300 . 1 . . . . 141 PHE CA . 11095 1 1556 . 1 1 141 141 PHE CB C 13 39.811 0.300 . 1 . . . . 141 PHE CB . 11095 1 1557 . 1 1 141 141 PHE CD1 C 13 131.457 0.300 . 1 . . . . 141 PHE CD1 . 11095 1 1558 . 1 1 141 141 PHE CD2 C 13 131.457 0.300 . 1 . . . . 141 PHE CD2 . 11095 1 1559 . 1 1 141 141 PHE CE1 C 13 131.354 0.300 . 1 . . . . 141 PHE CE1 . 11095 1 1560 . 1 1 141 141 PHE CE2 C 13 131.354 0.300 . 1 . . . . 141 PHE CE2 . 11095 1 1561 . 1 1 141 141 PHE CZ C 13 128.042 0.300 . 1 . . . . 141 PHE CZ . 11095 1 1562 . 1 1 142 142 PRO HA H 1 4.359 0.030 . 1 . . . . 142 PRO HA . 11095 1 1563 . 1 1 142 142 PRO HB2 H 1 1.766 0.030 . 2 . . . . 142 PRO HB2 . 11095 1 1564 . 1 1 142 142 PRO HB3 H 1 1.718 0.030 . 2 . . . . 142 PRO HB3 . 11095 1 1565 . 1 1 142 142 PRO HD2 H 1 3.521 0.030 . 2 . . . . 142 PRO HD2 . 11095 1 1566 . 1 1 142 142 PRO HD3 H 1 2.263 0.030 . 2 . . . . 142 PRO HD3 . 11095 1 1567 . 1 1 142 142 PRO HG2 H 1 1.383 0.030 . 2 . . . . 142 PRO HG2 . 11095 1 1568 . 1 1 142 142 PRO HG3 H 1 1.493 0.030 . 2 . . . . 142 PRO HG3 . 11095 1 1569 . 1 1 142 142 PRO C C 13 175.706 0.300 . 1 . . . . 142 PRO C . 11095 1 1570 . 1 1 142 142 PRO CA C 13 64.682 0.300 . 1 . . . . 142 PRO CA . 11095 1 1571 . 1 1 142 142 PRO CB C 13 32.086 0.300 . 1 . . . . 142 PRO CB . 11095 1 1572 . 1 1 142 142 PRO CD C 13 49.886 0.300 . 1 . . . . 142 PRO CD . 11095 1 1573 . 1 1 142 142 PRO CG C 13 26.512 0.300 . 1 . . . . 142 PRO CG . 11095 1 1574 . 1 1 143 143 CYS H H 1 5.827 0.030 . 1 . . . . 143 CYS H . 11095 1 1575 . 1 1 143 143 CYS HA H 1 4.568 0.030 . 1 . . . . 143 CYS HA . 11095 1 1576 . 1 1 143 143 CYS HB2 H 1 2.763 0.030 . 2 . . . . 143 CYS HB2 . 11095 1 1577 . 1 1 143 143 CYS HB3 H 1 2.138 0.030 . 2 . . . . 143 CYS HB3 . 11095 1 1578 . 1 1 143 143 CYS C C 13 174.100 0.300 . 1 . . . . 143 CYS C . 11095 1 1579 . 1 1 143 143 CYS CA C 13 57.898 0.300 . 1 . . . . 143 CYS CA . 11095 1 1580 . 1 1 143 143 CYS CB C 13 31.264 0.300 . 1 . . . . 143 CYS CB . 11095 1 1581 . 1 1 143 143 CYS N N 15 115.459 0.300 . 1 . . . . 143 CYS N . 11095 1 1582 . 1 1 144 144 GLY H H 1 9.018 0.030 . 1 . . . . 144 GLY H . 11095 1 1583 . 1 1 144 144 GLY HA2 H 1 3.655 0.030 . 2 . . . . 144 GLY HA2 . 11095 1 1584 . 1 1 144 144 GLY HA3 H 1 3.984 0.030 . 2 . . . . 144 GLY HA3 . 11095 1 1585 . 1 1 144 144 GLY C C 13 173.414 0.300 . 1 . . . . 144 GLY C . 11095 1 1586 . 1 1 144 144 GLY CA C 13 45.134 0.300 . 1 . . . . 144 GLY CA . 11095 1 1587 . 1 1 144 144 GLY N N 15 109.477 0.300 . 1 . . . . 144 GLY N . 11095 1 1588 . 1 1 145 145 ASN H H 1 7.120 0.030 . 1 . . . . 145 ASN H . 11095 1 1589 . 1 1 145 145 ASN HA H 1 4.642 0.030 . 1 . . . . 145 ASN HA . 11095 1 1590 . 1 1 145 145 ASN HB2 H 1 2.102 0.030 . 2 . . . . 145 ASN HB2 . 11095 1 1591 . 1 1 145 145 ASN HB3 H 1 2.343 0.030 . 2 . . . . 145 ASN HB3 . 11095 1 1592 . 1 1 145 145 ASN HD21 H 1 6.169 0.030 . 2 . . . . 145 ASN HD21 . 11095 1 1593 . 1 1 145 145 ASN HD22 H 1 6.704 0.030 . 2 . . . . 145 ASN HD22 . 11095 1 1594 . 1 1 145 145 ASN C C 13 173.102 0.300 . 1 . . . . 145 ASN C . 11095 1 1595 . 1 1 145 145 ASN CA C 13 52.698 0.300 . 1 . . . . 145 ASN CA . 11095 1 1596 . 1 1 145 145 ASN CB C 13 38.924 0.300 . 1 . . . . 145 ASN CB . 11095 1 1597 . 1 1 145 145 ASN N N 15 118.012 0.300 . 1 . . . . 145 ASN N . 11095 1 1598 . 1 1 145 145 ASN ND2 N 15 115.768 0.300 . 1 . . . . 145 ASN ND2 . 11095 1 1599 . 1 1 146 146 VAL H H 1 8.090 0.030 . 1 . . . . 146 VAL H . 11095 1 1600 . 1 1 146 146 VAL HA H 1 4.701 0.030 . 1 . . . . 146 VAL HA . 11095 1 1601 . 1 1 146 146 VAL HB H 1 1.677 0.030 . 1 . . . . 146 VAL HB . 11095 1 1602 . 1 1 146 146 VAL HG11 H 1 0.370 0.030 . 1 . . . . 146 VAL HG1 . 11095 1 1603 . 1 1 146 146 VAL HG12 H 1 0.370 0.030 . 1 . . . . 146 VAL HG1 . 11095 1 1604 . 1 1 146 146 VAL HG13 H 1 0.370 0.030 . 1 . . . . 146 VAL HG1 . 11095 1 1605 . 1 1 146 146 VAL HG21 H 1 0.444 0.030 . 1 . . . . 146 VAL HG2 . 11095 1 1606 . 1 1 146 146 VAL HG22 H 1 0.444 0.030 . 1 . . . . 146 VAL HG2 . 11095 1 1607 . 1 1 146 146 VAL HG23 H 1 0.444 0.030 . 1 . . . . 146 VAL HG2 . 11095 1 1608 . 1 1 146 146 VAL C C 13 174.087 0.300 . 1 . . . . 146 VAL C . 11095 1 1609 . 1 1 146 146 VAL CA C 13 60.876 0.300 . 1 . . . . 146 VAL CA . 11095 1 1610 . 1 1 146 146 VAL CB C 13 34.963 0.300 . 1 . . . . 146 VAL CB . 11095 1 1611 . 1 1 146 146 VAL CG1 C 13 20.442 0.300 . 2 . . . . 146 VAL CG1 . 11095 1 1612 . 1 1 146 146 VAL CG2 C 13 22.407 0.300 . 2 . . . . 146 VAL CG2 . 11095 1 1613 . 1 1 146 146 VAL N N 15 119.708 0.300 . 1 . . . . 146 VAL N . 11095 1 1614 . 1 1 147 147 ASN H H 1 8.685 0.030 . 1 . . . . 147 ASN H . 11095 1 1615 . 1 1 147 147 ASN HA H 1 4.822 0.030 . 1 . . . . 147 ASN HA . 11095 1 1616 . 1 1 147 147 ASN HB2 H 1 1.647 0.030 . 2 . . . . 147 ASN HB2 . 11095 1 1617 . 1 1 147 147 ASN HB3 H 1 2.237 0.030 . 2 . . . . 147 ASN HB3 . 11095 1 1618 . 1 1 147 147 ASN HD21 H 1 6.914 0.030 . 2 . . . . 147 ASN HD21 . 11095 1 1619 . 1 1 147 147 ASN HD22 H 1 7.099 0.030 . 2 . . . . 147 ASN HD22 . 11095 1 1620 . 1 1 147 147 ASN C C 13 173.745 0.300 . 1 . . . . 147 ASN C . 11095 1 1621 . 1 1 147 147 ASN CA C 13 50.335 0.300 . 1 . . . . 147 ASN CA . 11095 1 1622 . 1 1 147 147 ASN CB C 13 41.353 0.300 . 1 . . . . 147 ASN CB . 11095 1 1623 . 1 1 147 147 ASN N N 15 124.540 0.300 . 1 . . . . 147 ASN N . 11095 1 1624 . 1 1 147 147 ASN ND2 N 15 110.477 0.300 . 1 . . . . 147 ASN ND2 . 11095 1 1625 . 1 1 148 148 TYR H H 1 8.575 0.030 . 1 . . . . 148 TYR H . 11095 1 1626 . 1 1 148 148 TYR HA H 1 4.547 0.030 . 1 . . . . 148 TYR HA . 11095 1 1627 . 1 1 148 148 TYR HB2 H 1 3.042 0.030 . 2 . . . . 148 TYR HB2 . 11095 1 1628 . 1 1 148 148 TYR HB3 H 1 2.754 0.030 . 2 . . . . 148 TYR HB3 . 11095 1 1629 . 1 1 148 148 TYR HD1 H 1 7.116 0.030 . 1 . . . . 148 TYR HD1 . 11095 1 1630 . 1 1 148 148 TYR HD2 H 1 7.116 0.030 . 1 . . . . 148 TYR HD2 . 11095 1 1631 . 1 1 148 148 TYR HE1 H 1 6.649 0.030 . 1 . . . . 148 TYR HE1 . 11095 1 1632 . 1 1 148 148 TYR HE2 H 1 6.649 0.030 . 1 . . . . 148 TYR HE2 . 11095 1 1633 . 1 1 148 148 TYR C C 13 176.287 0.300 . 1 . . . . 148 TYR C . 11095 1 1634 . 1 1 148 148 TYR CA C 13 58.309 0.300 . 1 . . . . 148 TYR CA . 11095 1 1635 . 1 1 148 148 TYR CB C 13 40.065 0.300 . 1 . . . . 148 TYR CB . 11095 1 1636 . 1 1 148 148 TYR CD1 C 13 133.097 0.300 . 1 . . . . 148 TYR CD1 . 11095 1 1637 . 1 1 148 148 TYR CD2 C 13 133.097 0.300 . 1 . . . . 148 TYR CD2 . 11095 1 1638 . 1 1 148 148 TYR CE1 C 13 117.783 0.300 . 1 . . . . 148 TYR CE1 . 11095 1 1639 . 1 1 148 148 TYR CE2 C 13 117.783 0.300 . 1 . . . . 148 TYR CE2 . 11095 1 1640 . 1 1 148 148 TYR N N 15 118.412 0.300 . 1 . . . . 148 TYR N . 11095 1 1641 . 1 1 149 149 GLY H H 1 7.912 0.030 . 1 . . . . 149 GLY H . 11095 1 1642 . 1 1 149 149 GLY HA2 H 1 3.723 0.030 . 2 . . . . 149 GLY HA2 . 11095 1 1643 . 1 1 149 149 GLY HA3 H 1 4.183 0.030 . 2 . . . . 149 GLY HA3 . 11095 1 1644 . 1 1 149 149 GLY C C 13 173.215 0.300 . 1 . . . . 149 GLY C . 11095 1 1645 . 1 1 149 149 GLY CA C 13 44.169 0.300 . 1 . . . . 149 GLY CA . 11095 1 1646 . 1 1 149 149 GLY N N 15 108.415 0.300 . 1 . . . . 149 GLY N . 11095 1 1647 . 1 1 150 150 TYR H H 1 8.563 0.030 . 1 . . . . 150 TYR H . 11095 1 1648 . 1 1 150 150 TYR HA H 1 4.582 0.030 . 1 . . . . 150 TYR HA . 11095 1 1649 . 1 1 150 150 TYR HB2 H 1 2.877 0.030 . 2 . . . . 150 TYR HB2 . 11095 1 1650 . 1 1 150 150 TYR HB3 H 1 3.143 0.030 . 2 . . . . 150 TYR HB3 . 11095 1 1651 . 1 1 150 150 TYR HD1 H 1 7.223 0.030 . 1 . . . . 150 TYR HD1 . 11095 1 1652 . 1 1 150 150 TYR HD2 H 1 7.223 0.030 . 1 . . . . 150 TYR HD2 . 11095 1 1653 . 1 1 150 150 TYR HE1 H 1 6.807 0.030 . 1 . . . . 150 TYR HE1 . 11095 1 1654 . 1 1 150 150 TYR HE2 H 1 6.807 0.030 . 1 . . . . 150 TYR HE2 . 11095 1 1655 . 1 1 150 150 TYR C C 13 176.337 0.300 . 1 . . . . 150 TYR C . 11095 1 1656 . 1 1 150 150 TYR CA C 13 58.062 0.300 . 1 . . . . 150 TYR CA . 11095 1 1657 . 1 1 150 150 TYR CB C 13 38.946 0.300 . 1 . . . . 150 TYR CB . 11095 1 1658 . 1 1 150 150 TYR CD1 C 13 133.545 0.300 . 1 . . . . 150 TYR CD1 . 11095 1 1659 . 1 1 150 150 TYR CD2 C 13 133.545 0.300 . 1 . . . . 150 TYR CD2 . 11095 1 1660 . 1 1 150 150 TYR CE1 C 13 118.221 0.300 . 1 . . . . 150 TYR CE1 . 11095 1 1661 . 1 1 150 150 TYR CE2 C 13 118.221 0.300 . 1 . . . . 150 TYR CE2 . 11095 1 1662 . 1 1 150 150 TYR N N 15 122.429 0.300 . 1 . . . . 150 TYR N . 11095 1 1663 . 1 1 151 151 GLN H H 1 8.592 0.030 . 1 . . . . 151 GLN H . 11095 1 1664 . 1 1 151 151 GLN HA H 1 4.349 0.030 . 1 . . . . 151 GLN HA . 11095 1 1665 . 1 1 151 151 GLN HB2 H 1 2.148 0.030 . 2 . . . . 151 GLN HB2 . 11095 1 1666 . 1 1 151 151 GLN HB3 H 1 2.011 0.030 . 2 . . . . 151 GLN HB3 . 11095 1 1667 . 1 1 151 151 GLN HE21 H 1 7.532 0.030 . 2 . . . . 151 GLN HE21 . 11095 1 1668 . 1 1 151 151 GLN HE22 H 1 6.882 0.030 . 2 . . . . 151 GLN HE22 . 11095 1 1669 . 1 1 151 151 GLN HG2 H 1 2.354 0.030 . 1 . . . . 151 GLN HG2 . 11095 1 1670 . 1 1 151 151 GLN HG3 H 1 2.354 0.030 . 1 . . . . 151 GLN HG3 . 11095 1 1671 . 1 1 151 151 GLN C C 13 175.730 0.300 . 1 . . . . 151 GLN C . 11095 1 1672 . 1 1 151 151 GLN CA C 13 56.054 0.300 . 1 . . . . 151 GLN CA . 11095 1 1673 . 1 1 151 151 GLN CB C 13 29.476 0.300 . 1 . . . . 151 GLN CB . 11095 1 1674 . 1 1 151 151 GLN CG C 13 34.141 0.300 . 1 . . . . 151 GLN CG . 11095 1 1675 . 1 1 151 151 GLN N N 15 121.410 0.300 . 1 . . . . 151 GLN N . 11095 1 1676 . 1 1 151 151 GLN NE2 N 15 112.801 0.300 . 1 . . . . 151 GLN NE2 . 11095 1 1677 . 1 1 152 152 GLN H H 1 8.460 0.030 . 1 . . . . 152 GLN H . 11095 1 1678 . 1 1 152 152 GLN HA H 1 4.388 0.030 . 1 . . . . 152 GLN HA . 11095 1 1679 . 1 1 152 152 GLN HB2 H 1 2.215 0.030 . 2 . . . . 152 GLN HB2 . 11095 1 1680 . 1 1 152 152 GLN HB3 H 1 2.012 0.030 . 2 . . . . 152 GLN HB3 . 11095 1 1681 . 1 1 152 152 GLN HE21 H 1 7.536 0.030 . 2 . . . . 152 GLN HE21 . 11095 1 1682 . 1 1 152 152 GLN HE22 H 1 6.883 0.030 . 2 . . . . 152 GLN HE22 . 11095 1 1683 . 1 1 152 152 GLN HG2 H 1 2.376 0.030 . 1 . . . . 152 GLN HG2 . 11095 1 1684 . 1 1 152 152 GLN HG3 H 1 2.376 0.030 . 1 . . . . 152 GLN HG3 . 11095 1 1685 . 1 1 152 152 GLN C C 13 175.001 0.300 . 1 . . . . 152 GLN C . 11095 1 1686 . 1 1 152 152 GLN CA C 13 55.700 0.300 . 1 . . . . 152 GLN CA . 11095 1 1687 . 1 1 152 152 GLN CB C 13 29.514 0.300 . 1 . . . . 152 GLN CB . 11095 1 1688 . 1 1 152 152 GLN CG C 13 33.812 0.300 . 1 . . . . 152 GLN CG . 11095 1 1689 . 1 1 152 152 GLN N N 15 121.812 0.300 . 1 . . . . 152 GLN N . 11095 1 1690 . 1 1 152 152 GLN NE2 N 15 112.801 0.300 . 1 . . . . 152 GLN NE2 . 11095 1 1691 . 1 1 153 153 GLN H H 1 8.082 0.030 . 1 . . . . 153 GLN H . 11095 1 1692 . 1 1 153 153 GLN HA H 1 4.182 0.030 . 1 . . . . 153 GLN HA . 11095 1 1693 . 1 1 153 153 GLN HB2 H 1 1.966 0.030 . 2 . . . . 153 GLN HB2 . 11095 1 1694 . 1 1 153 153 GLN HB3 H 1 2.132 0.030 . 2 . . . . 153 GLN HB3 . 11095 1 1695 . 1 1 153 153 GLN HE21 H 1 6.782 0.030 . 2 . . . . 153 GLN HE21 . 11095 1 1696 . 1 1 153 153 GLN HE22 H 1 7.550 0.030 . 2 . . . . 153 GLN HE22 . 11095 1 1697 . 1 1 153 153 GLN HG2 H 1 2.302 0.030 . 1 . . . . 153 GLN HG2 . 11095 1 1698 . 1 1 153 153 GLN HG3 H 1 2.302 0.030 . 1 . . . . 153 GLN HG3 . 11095 1 1699 . 1 1 153 153 GLN C C 13 180.509 0.300 . 1 . . . . 153 GLN C . 11095 1 1700 . 1 1 153 153 GLN CA C 13 57.316 0.300 . 1 . . . . 153 GLN CA . 11095 1 1701 . 1 1 153 153 GLN CB C 13 30.242 0.300 . 1 . . . . 153 GLN CB . 11095 1 1702 . 1 1 153 153 GLN CG C 13 34.117 0.300 . 1 . . . . 153 GLN CG . 11095 1 1703 . 1 1 153 153 GLN N N 15 126.492 0.300 . 1 . . . . 153 GLN N . 11095 1 1704 . 1 1 153 153 GLN NE2 N 15 112.405 0.300 . 1 . . . . 153 GLN NE2 . 11095 1 stop_ save_