data_4082 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4082 _Entry.Title ; Characterization of the Three-Dimensional Solution Structure of Human Profilin: 1H, 13C, and 15N NMR Assignments amd Global Folding Pattern ; _Entry.Type macromolecule _Entry.Version_type update _Entry.Submission_date 1997-12-22 _Entry.Accession_date 1997-12-22 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination BMRB _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 William Metzler . J. . 4082 2 Keith Constantine . L. . 4082 3 Mark Friedrichs . S. . 4082 4 Aneka Bell . J. . 4082 5 Eileen Ernst . G. . 4082 6 Thomas Lavoie . B. . 4082 7 Luciano Mueller . . . 4082 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4082 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 440 4082 '15N chemical shifts' 144 4082 '1H chemical shifts' 937 4082 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2001-02-17 . reformat BMRB 'Format updated to NMR-STAR version 2.1' 4082 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4082 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; Metzler, W. J., Constantine, K. L., Friedrichs, M. S., Bell, A. J., Ernst, E. G., Lavoie, T. S., and Mueller, L., "Characterization of the Three-Dimensional Solution Structure of Human Profilin: 1H, 13C, and 15N Assignments and Global Folding Pattern," Biochemistry 32, 13818-13829 (1993). ; _Citation.Title ; Characterization of the Three-Dimensional Solution Structure of Human Profilin: 1H, 13C, and 15N Assignments and Global Folding Pattern ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full . _Citation.Journal_volume 32 _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 13818 _Citation.Page_last 13829 _Citation.Year 1993 _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 William Metzler . J. . 4082 1 2 Keith Constantine . L. . 4082 1 3 Mark Friedrichs . S. . 4082 1 4 Aneka Bell . J. . 4082 1 5 Eileen Ernst . G. . 4082 1 6 Thomas Lavoie . B. . 4082 1 7 Luciano Mueller . . . 4082 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID glucoamylase 4082 1 NMR 4082 1 'nuclear magnetic resonance' 4082 1 'phosphatidylinositol 4,5-biphosphate' 4082 1 PIP2 4082 1 'resonance assignments' 4082 1 SBD 4082 1 'secondary structure' 4082 1 'starch binding domain' 4082 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_profilin _Assembly.Sf_category assembly _Assembly.Sf_framecode system_profilin _Assembly.Entry_ID 4082 _Assembly.ID 1 _Assembly.Name profilin _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not reported' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details ; Interacts reversibly with actin and phosphoinositides ; _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4082 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 profilin 1 $profilin . . . native . . . . . 4082 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID profilin abbreviation 4082 1 profilin system 4082 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID ; Plays a major role in the signaling pathway leading to cytoskeletal rearrangement ; 4082 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_profilin _Entity.Sf_category entity _Entity.Sf_framecode profilin _Entity.Entry_ID 4082 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name profilin _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AGWNAYIDNLMADGTCQDAA IVGYKDSPSVWAAVPGKTFV NITPAEVGVLVGKDRSSFYV NGLTLGGQKCSVIRDSLLQD GEFSMDLRTKSTGGAPTFNV TVTKTDKTLVLLMGKEGVHG GLINKKCYEMASHLRRSQY ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 139 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not reported' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15000 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1AWI . "Human Platelet Profilin Complexed With The L-Pro10 Peptide" . . . . . 99.28 138 100.00 100.00 1.88e-96 . . . . 4082 1 2 no PDB 1CF0 . "Human Platelet Profilin Complexed With An L-Pro10- Iodotyrosine Peptide" . . . . . 99.28 138 100.00 100.00 1.88e-96 . . . . 4082 1 3 no PDB 1CJF . "Profilin Binds Proline-Rich Ligands In Two Distinct Amide Backbone Orientations" . . . . . 100.00 139 100.00 100.00 3.31e-97 . . . . 4082 1 4 no PDB 1FIK . "Human Platelet Profilin I Crystallized In Low Salt" . . . . . 100.00 139 100.00 100.00 3.31e-97 . . . . 4082 1 5 no PDB 1FIL . "Human Platelet Profilin I Crystallized In High Salt Actin- Binding Protein" . . . . . 100.00 139 100.00 100.00 3.31e-97 . . . . 4082 1 6 no PDB 1PFL . "Refined Solution Structure Of Human Profilin I" . . . . . 99.28 139 100.00 100.00 4.04e-96 . . . . 4082 1 7 no PDB 2PAV . "Ternary Complex Of Profilin-actin With The Last Poly-pro Of Human Vasp" . . . . . 100.00 139 100.00 100.00 3.31e-97 . . . . 4082 1 8 no PDB 2PBD . "Ternary Complex Of Profilin-actin With The Poly-pro-gab Domain Of Vasp*" . . . . . 100.00 139 100.00 100.00 3.31e-97 . . . . 4082 1 9 no PDB 3CHW . "Complex Of Dictyostelium Discoideum Actin With Profilin And The Last Poly-Pro Of Human Vasp" . . . . . 100.00 139 100.00 100.00 3.31e-97 . . . . 4082 1 10 no PDB 4X1L . "Structural Basis For Mutation-induced Destabilization Of Profilin 1 In Als" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 11 no PDB 4X1M . "Structural Basis For Mutation-induced Destabilization Of Profilin 1 In Als" . . . . . 100.00 140 99.28 99.28 8.31e-96 . . . . 4082 1 12 no PDB 4X25 . "Structural Basis For Mutation-induced Destabilization Of Profilin 1 In Als" . . . . . 100.00 140 99.28 99.28 3.14e-96 . . . . 4082 1 13 no DBJ BAE87684 . "unnamed protein product [Macaca fascicularis]" . . . . . 84.89 122 100.00 100.00 8.29e-79 . . . . 4082 1 14 no DBJ BAG35102 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 15 no DBJ BAG73580 . "profilin 1 [synthetic construct]" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 16 no EMBL CAG28598 . "PFN1 [Homo sapiens]" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 17 no GB AAA36486 . "profilin [Homo sapiens]" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 18 no GB AAH02475 . "Profilin 1 [Homo sapiens]" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 19 no GB AAH06768 . "Profilin 1 [Homo sapiens]" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 20 no GB AAH13439 . "Profilin 1 [Homo sapiens]" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 21 no GB AAH15164 . "Profilin 1 [Homo sapiens]" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 22 no REF NP_001270319 . "profilin 1 [Macaca fascicularis]" . . . . . 84.89 122 100.00 100.00 8.29e-79 . . . . 4082 1 23 no REF NP_005013 . "profilin-1 [Homo sapiens]" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 24 no REF XP_001099416 . "PREDICTED: profilin-1 isoform 1 [Macaca mulatta]" . . . . . 100.00 221 100.00 100.00 8.36e-98 . . . . 4082 1 25 no REF XP_002800300 . "PREDICTED: profilin-1 isoform 2 [Macaca mulatta]" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 26 no REF XP_003733022 . "PREDICTED: profilin-1 [Callithrix jacchus]" . . . . . 100.00 140 99.28 100.00 1.07e-96 . . . . 4082 1 27 no SP P07737 . "RecName: Full=Profilin-1; AltName: Full=Epididymis tissue protein Li 184a; AltName: Full=Profilin I" . . . . . 100.00 140 100.00 100.00 3.10e-97 . . . . 4082 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID profilin common 4082 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 . ALA . 4082 1 2 . GLY . 4082 1 3 . TRP . 4082 1 4 . ASN . 4082 1 5 . ALA . 4082 1 6 . TYR . 4082 1 7 . ILE . 4082 1 8 . ASP . 4082 1 9 . ASN . 4082 1 10 . LEU . 4082 1 11 . MET . 4082 1 12 . ALA . 4082 1 13 . ASP . 4082 1 14 . GLY . 4082 1 15 . THR . 4082 1 16 . CYS . 4082 1 17 . GLN . 4082 1 18 . ASP . 4082 1 19 . ALA . 4082 1 20 . ALA . 4082 1 21 . ILE . 4082 1 22 . VAL . 4082 1 23 . GLY . 4082 1 24 . TYR . 4082 1 25 . LYS . 4082 1 26 . ASP . 4082 1 27 . SER . 4082 1 28 . PRO . 4082 1 29 . SER . 4082 1 30 . VAL . 4082 1 31 . TRP . 4082 1 32 . ALA . 4082 1 33 . ALA . 4082 1 34 . VAL . 4082 1 35 . PRO . 4082 1 36 . GLY . 4082 1 37 . LYS . 4082 1 38 . THR . 4082 1 39 . PHE . 4082 1 40 . VAL . 4082 1 41 . ASN . 4082 1 42 . ILE . 4082 1 43 . THR . 4082 1 44 . PRO . 4082 1 45 . ALA . 4082 1 46 . GLU . 4082 1 47 . VAL . 4082 1 48 . GLY . 4082 1 49 . VAL . 4082 1 50 . LEU . 4082 1 51 . VAL . 4082 1 52 . GLY . 4082 1 53 . LYS . 4082 1 54 . ASP . 4082 1 55 . ARG . 4082 1 56 . SER . 4082 1 57 . SER . 4082 1 58 . PHE . 4082 1 59 . TYR . 4082 1 60 . VAL . 4082 1 61 . ASN . 4082 1 62 . GLY . 4082 1 63 . LEU . 4082 1 64 . THR . 4082 1 65 . LEU . 4082 1 66 . GLY . 4082 1 67 . GLY . 4082 1 68 . GLN . 4082 1 69 . LYS . 4082 1 70 . CYS . 4082 1 71 . SER . 4082 1 72 . VAL . 4082 1 73 . ILE . 4082 1 74 . ARG . 4082 1 75 . ASP . 4082 1 76 . SER . 4082 1 77 . LEU . 4082 1 78 . LEU . 4082 1 79 . GLN . 4082 1 80 . ASP . 4082 1 81 . GLY . 4082 1 82 . GLU . 4082 1 83 . PHE . 4082 1 84 . SER . 4082 1 85 . MET . 4082 1 86 . ASP . 4082 1 87 . LEU . 4082 1 88 . ARG . 4082 1 89 . THR . 4082 1 90 . LYS . 4082 1 91 . SER . 4082 1 92 . THR . 4082 1 93 . GLY . 4082 1 94 . GLY . 4082 1 95 . ALA . 4082 1 96 . PRO . 4082 1 97 . THR . 4082 1 98 . PHE . 4082 1 99 . ASN . 4082 1 100 . VAL . 4082 1 101 . THR . 4082 1 102 . VAL . 4082 1 103 . THR . 4082 1 104 . LYS . 4082 1 105 . THR . 4082 1 106 . ASP . 4082 1 107 . LYS . 4082 1 108 . THR . 4082 1 109 . LEU . 4082 1 110 . VAL . 4082 1 111 . LEU . 4082 1 112 . LEU . 4082 1 113 . MET . 4082 1 114 . GLY . 4082 1 115 . LYS . 4082 1 116 . GLU . 4082 1 117 . GLY . 4082 1 118 . VAL . 4082 1 119 . HIS . 4082 1 120 . GLY . 4082 1 121 . GLY . 4082 1 122 . LEU . 4082 1 123 . ILE . 4082 1 124 . ASN . 4082 1 125 . LYS . 4082 1 126 . LYS . 4082 1 127 . CYS . 4082 1 128 . TYR . 4082 1 129 . GLU . 4082 1 130 . MET . 4082 1 131 . ALA . 4082 1 132 . SER . 4082 1 133 . HIS . 4082 1 134 . LEU . 4082 1 135 . ARG . 4082 1 136 . ARG . 4082 1 137 . SER . 4082 1 138 . GLN . 4082 1 139 . TYR . 4082 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 . ALA 1 1 4082 1 . GLY 2 2 4082 1 . TRP 3 3 4082 1 . ASN 4 4 4082 1 . ALA 5 5 4082 1 . TYR 6 6 4082 1 . ILE 7 7 4082 1 . ASP 8 8 4082 1 . ASN 9 9 4082 1 . LEU 10 10 4082 1 . MET 11 11 4082 1 . ALA 12 12 4082 1 . ASP 13 13 4082 1 . GLY 14 14 4082 1 . THR 15 15 4082 1 . CYS 16 16 4082 1 . GLN 17 17 4082 1 . ASP 18 18 4082 1 . ALA 19 19 4082 1 . ALA 20 20 4082 1 . ILE 21 21 4082 1 . VAL 22 22 4082 1 . GLY 23 23 4082 1 . TYR 24 24 4082 1 . LYS 25 25 4082 1 . ASP 26 26 4082 1 . SER 27 27 4082 1 . PRO 28 28 4082 1 . SER 29 29 4082 1 . VAL 30 30 4082 1 . TRP 31 31 4082 1 . ALA 32 32 4082 1 . ALA 33 33 4082 1 . VAL 34 34 4082 1 . PRO 35 35 4082 1 . GLY 36 36 4082 1 . LYS 37 37 4082 1 . THR 38 38 4082 1 . PHE 39 39 4082 1 . VAL 40 40 4082 1 . ASN 41 41 4082 1 . ILE 42 42 4082 1 . THR 43 43 4082 1 . PRO 44 44 4082 1 . ALA 45 45 4082 1 . GLU 46 46 4082 1 . VAL 47 47 4082 1 . GLY 48 48 4082 1 . VAL 49 49 4082 1 . LEU 50 50 4082 1 . VAL 51 51 4082 1 . GLY 52 52 4082 1 . LYS 53 53 4082 1 . ASP 54 54 4082 1 . ARG 55 55 4082 1 . SER 56 56 4082 1 . SER 57 57 4082 1 . PHE 58 58 4082 1 . TYR 59 59 4082 1 . VAL 60 60 4082 1 . ASN 61 61 4082 1 . GLY 62 62 4082 1 . LEU 63 63 4082 1 . THR 64 64 4082 1 . LEU 65 65 4082 1 . GLY 66 66 4082 1 . GLY 67 67 4082 1 . GLN 68 68 4082 1 . LYS 69 69 4082 1 . CYS 70 70 4082 1 . SER 71 71 4082 1 . VAL 72 72 4082 1 . ILE 73 73 4082 1 . ARG 74 74 4082 1 . ASP 75 75 4082 1 . SER 76 76 4082 1 . LEU 77 77 4082 1 . LEU 78 78 4082 1 . GLN 79 79 4082 1 . ASP 80 80 4082 1 . GLY 81 81 4082 1 . GLU 82 82 4082 1 . PHE 83 83 4082 1 . SER 84 84 4082 1 . MET 85 85 4082 1 . ASP 86 86 4082 1 . LEU 87 87 4082 1 . ARG 88 88 4082 1 . THR 89 89 4082 1 . LYS 90 90 4082 1 . SER 91 91 4082 1 . THR 92 92 4082 1 . GLY 93 93 4082 1 . GLY 94 94 4082 1 . ALA 95 95 4082 1 . PRO 96 96 4082 1 . THR 97 97 4082 1 . PHE 98 98 4082 1 . ASN 99 99 4082 1 . VAL 100 100 4082 1 . THR 101 101 4082 1 . VAL 102 102 4082 1 . THR 103 103 4082 1 . LYS 104 104 4082 1 . THR 105 105 4082 1 . ASP 106 106 4082 1 . LYS 107 107 4082 1 . THR 108 108 4082 1 . LEU 109 109 4082 1 . VAL 110 110 4082 1 . LEU 111 111 4082 1 . LEU 112 112 4082 1 . MET 113 113 4082 1 . GLY 114 114 4082 1 . LYS 115 115 4082 1 . GLU 116 116 4082 1 . GLY 117 117 4082 1 . VAL 118 118 4082 1 . HIS 119 119 4082 1 . GLY 120 120 4082 1 . GLY 121 121 4082 1 . LEU 122 122 4082 1 . ILE 123 123 4082 1 . ASN 124 124 4082 1 . LYS 125 125 4082 1 . LYS 126 126 4082 1 . CYS 127 127 4082 1 . TYR 128 128 4082 1 . GLU 129 129 4082 1 . MET 130 130 4082 1 . ALA 131 131 4082 1 . SER 132 132 4082 1 . HIS 133 133 4082 1 . LEU 134 134 4082 1 . ARG 135 135 4082 1 . ARG 136 136 4082 1 . SER 137 137 4082 1 . GLN 138 138 4082 1 . TYR 139 139 4082 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 4082 _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 $profilin . 9606 . . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 4082 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 4082 _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 $profilin . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli . . . . . . . . . . . . . plasmid . . pGTL-1 . . . . . . 4082 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Sample.Sf_category sample _Sample.Sf_framecode sample_one _Sample.Entry_ID 4082 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 profilin [U-15N] . . 1 $profilin . . 2.0 . . mM . . . . 4082 1 2 phosphate . . . . . . . 10 . . mM . . . . 4082 1 3 KCl . . . . . . . 25 . . mM . . . . 4082 1 4 B-mercaptoethanol . . . . . . . 20 . . mM . . . . 4082 1 5 EDTA . . . . . . . 1.0 . . mM . . . . 4082 1 6 H2O . . . . . . . 90 . . % . . . . 4082 1 7 D2O . . . . . . . 10 . . % . . . . 4082 1 stop_ save_ save_sample_two _Sample.Sf_category sample _Sample.Sf_framecode sample_two _Sample.Entry_ID 4082 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 profilin [U-15N] . . 1 $profilin . . 2.0 . . mM . . . . 4082 2 2 phosphate . . . . . . . 10 . . mM . . . . 4082 2 3 KCl . . . . . . . 25 . . mM . . . . 4082 2 4 B-mercaptoethanol . . . . . . . 20 . . mM . . . . 4082 2 5 EDTA . . . . . . . 1.0 . . mM . . . . 4082 2 6 D2O . . . . . . . 100 . . % . . . . 4082 2 stop_ save_ save_sample_three _Sample.Sf_category sample _Sample.Sf_framecode sample_three _Sample.Entry_ID 4082 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 profilin [U-13C] . . 1 $profilin . . 2.0 . . mM . . . . 4082 3 2 phosphate . . . . . . . 10 . . mM . . . . 4082 3 3 KCl . . . . . . . 25 . . mM . . . . 4082 3 4 B-mercaptoethanol . . . . . . . 20 . . mM . . . . 4082 3 5 EDTA . . . . . . . 1.0 . . mM . . . . 4082 3 6 H2O . . . . . . . 90 . . % . . . . 4082 3 7 D2O . . . . . . . 10 . . % . . . . 4082 3 stop_ save_ save_sample_four _Sample.Sf_category sample _Sample.Sf_framecode sample_four _Sample.Entry_ID 4082 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 profilin [U-13C] . . 1 $profilin . . 2.0 . . mM . . . . 4082 4 2 phosphate . . . . . . . 10 . . mM . . . . 4082 4 3 KCl . . . . . . . 25 . . mM . . . . 4082 4 4 B-mercaptoethanol . . . . . . . 20 . . mM . . . . 4082 4 5 EDTA . . . . . . . 1.0 . . mM . . . . 4082 4 6 D2O . . . . . . . 100 . . % . . . . 4082 4 stop_ save_ save_sample_five _Sample.Sf_category sample _Sample.Sf_framecode sample_five _Sample.Entry_ID 4082 _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 profilin '[U-15N], [U-13C]' . . 1 $profilin . . 2.0 . . mM . . . . 4082 5 2 phosphate . . . . . . . 10 . . mM . . . . 4082 5 3 KCl . . . . . . . 25 . . mM . . . . 4082 5 4 B-mercaptoethanol . . . . . . . 20 . . mM . . . . 4082 5 5 EDTA . . . . . . . 1.0 . . mM . . . . 4082 5 6 H2O . . . . . . . 90 . . % . . . . 4082 5 7 D2O . . . . . . . 10 . . % . . . . 4082 5 stop_ save_ save_sample_six _Sample.Sf_category sample _Sample.Sf_framecode sample_six _Sample.Entry_ID 4082 _Sample.ID 6 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 profilin '[U-15N], [U-13C]' . . 1 $profilin . . 2.0 . . mM . . . . 4082 6 2 phosphate . . . . . . . 10 . . mM . . . . 4082 6 3 KCl . . . . . . . 25 . . mM . . . . 4082 6 4 B-mercaptoethanol . . . . . . . 20 . . mM . . . . 4082 6 5 EDTA . . . . . . . 1.0 . . mM . . . . 4082 6 6 D2O . . . . . . . 100 . . % . . . . 4082 6 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions _Sample_condition_list.Entry_ID 4082 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.4 . n/a 4082 1 temperature 293 . K 4082 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_one _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_one _NMR_spectrometer.Entry_ID 4082 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Unity _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 4082 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_one Varian Unity . 600 . . . 4082 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 4082 _Experiment_list.ID 1 _Experiment_list.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference _Chem_shift_reference.Entry_ID 4082 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 . . . . . . ppm . . . . . . . . . . . . . 4082 1 H 1 water protons . . . . ppm 4.85 . . . . . . . . . . . . 4082 1 N 15 . . . . . . ppm . . . . . . . . . . . . . 4082 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_chem_shift_assignment_profilin _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_assignment_profilin _Assigned_chem_shift_list.Entry_ID 4082 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference _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 ; Actual stereospecific assignments probably were not as extensive as indicated in this list of assigned chemical shifts. ; _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 . . 5 $sample_five . 4082 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 GLY HA2 H 1 3.79 . . 1 . . . . . . . . 4082 1 2 . 1 1 2 2 GLY HA3 H 1 3.79 . . 1 . . . . . . . . 4082 1 3 . 1 1 2 2 GLY CA C 13 45.9 . . 1 . . . . . . . . 4082 1 4 . 1 1 3 3 TRP H H 1 8.00 . . 1 . . . . . . . . 4082 1 5 . 1 1 3 3 TRP HA H 1 4.59 . . 1 . . . . . . . . 4082 1 6 . 1 1 3 3 TRP HB2 H 1 3.42 . . 1 . . . . . . . . 4082 1 7 . 1 1 3 3 TRP HB3 H 1 3.02 . . 1 . . . . . . . . 4082 1 8 . 1 1 3 3 TRP HD1 H 1 7.34 . . 1 . . . . . . . . 4082 1 9 . 1 1 3 3 TRP HE1 H 1 9.56 . . 1 . . . . . . . . 4082 1 10 . 1 1 3 3 TRP HE3 H 1 6.81 . . 1 . . . . . . . . 4082 1 11 . 1 1 3 3 TRP HZ2 H 1 7.52 . . 3 . . . . . . . . 4082 1 12 . 1 1 3 3 TRP HZ3 H 1 5.98 . . 3 . . . . . . . . 4082 1 13 . 1 1 3 3 TRP HH2 H 1 6.61 . . 1 . . . . . . . . 4082 1 14 . 1 1 3 3 TRP CA C 13 59.1 . . 1 . . . . . . . . 4082 1 15 . 1 1 3 3 TRP CB C 13 30.2 . . 1 . . . . . . . . 4082 1 16 . 1 1 3 3 TRP CE3 C 13 115.1 . . 1 . . . . . . . . 4082 1 17 . 1 1 3 3 TRP CZ2 C 13 119.2 . . 3 . . . . . . . . 4082 1 18 . 1 1 3 3 TRP CZ3 C 13 123.7 . . 3 . . . . . . . . 4082 1 19 . 1 1 3 3 TRP CH2 C 13 121.2 . . 1 . . . . . . . . 4082 1 20 . 1 1 3 3 TRP N N 15 122.0 . . 1 . . . . . . . . 4082 1 21 . 1 1 3 3 TRP NE1 N 15 129.7 . . 1 . . . . . . . . 4082 1 22 . 1 1 4 4 ASN H H 1 8.56 . . 1 . . . . . . . . 4082 1 23 . 1 1 4 4 ASN HA H 1 4.29 . . 1 . . . . . . . . 4082 1 24 . 1 1 4 4 ASN HB2 H 1 2.90 . . 1 . . . . . . . . 4082 1 25 . 1 1 4 4 ASN HB3 H 1 2.82 . . 1 . . . . . . . . 4082 1 26 . 1 1 4 4 ASN HD21 H 1 7.91 . . 1 . . . . . . . . 4082 1 27 . 1 1 4 4 ASN HD22 H 1 7.09 . . 1 . . . . . . . . 4082 1 28 . 1 1 4 4 ASN CA C 13 56.6 . . 1 . . . . . . . . 4082 1 29 . 1 1 4 4 ASN CB C 13 37.7 . . 1 . . . . . . . . 4082 1 30 . 1 1 4 4 ASN N N 15 116.8 . . 1 . . . . . . . . 4082 1 31 . 1 1 4 4 ASN ND2 N 15 114.7 . . 1 . . . . . . . . 4082 1 32 . 1 1 5 5 ALA H H 1 7.70 . . 1 . . . . . . . . 4082 1 33 . 1 1 5 5 ALA HA H 1 4.09 . . 1 . . . . . . . . 4082 1 34 . 1 1 5 5 ALA HB1 H 1 1.16 . . 1 . . . . . . . . 4082 1 35 . 1 1 5 5 ALA HB2 H 1 1.16 . . 1 . . . . . . . . 4082 1 36 . 1 1 5 5 ALA HB3 H 1 1.16 . . 1 . . . . . . . . 4082 1 37 . 1 1 5 5 ALA CA C 13 54.8 . . 1 . . . . . . . . 4082 1 38 . 1 1 5 5 ALA CB C 13 17.7 . . 1 . . . . . . . . 4082 1 39 . 1 1 5 5 ALA N N 15 122.6 . . 1 . . . . . . . . 4082 1 40 . 1 1 6 6 TYR H H 1 7.28 . . 1 . . . . . . . . 4082 1 41 . 1 1 6 6 TYR HA H 1 4.28 . . 1 . . . . . . . . 4082 1 42 . 1 1 6 6 TYR HB2 H 1 3.22 . . 1 . . . . . . . . 4082 1 43 . 1 1 6 6 TYR HB3 H 1 3.22 . . 1 . . . . . . . . 4082 1 44 . 1 1 6 6 TYR HD1 H 1 7.33 . . 1 . . . . . . . . 4082 1 45 . 1 1 6 6 TYR HD2 H 1 7.33 . . 1 . . . . . . . . 4082 1 46 . 1 1 6 6 TYR HE1 H 1 6.56 . . 1 . . . . . . . . 4082 1 47 . 1 1 6 6 TYR HE2 H 1 6.56 . . 1 . . . . . . . . 4082 1 48 . 1 1 6 6 TYR CA C 13 60.9 . . 1 . . . . . . . . 4082 1 49 . 1 1 6 6 TYR CB C 13 37.7 . . 1 . . . . . . . . 4082 1 50 . 1 1 6 6 TYR CD1 C 13 132.5 . . 1 . . . . . . . . 4082 1 51 . 1 1 6 6 TYR CD2 C 13 132.5 . . 1 . . . . . . . . 4082 1 52 . 1 1 6 6 TYR CE1 C 13 117.9 . . 1 . . . . . . . . 4082 1 53 . 1 1 6 6 TYR CE2 C 13 117.9 . . 1 . . . . . . . . 4082 1 54 . 1 1 6 6 TYR N N 15 117.0 . . 1 . . . . . . . . 4082 1 55 . 1 1 7 7 ILE H H 1 7.14 . . 1 . . . . . . . . 4082 1 56 . 1 1 7 7 ILE HA H 1 3.64 . . 1 . . . . . . . . 4082 1 57 . 1 1 7 7 ILE HB H 1 2.44 . . 1 . . . . . . . . 4082 1 58 . 1 1 7 7 ILE HG12 H 1 1.83 . . 1 . . . . . . . . 4082 1 59 . 1 1 7 7 ILE HG13 H 1 1.18 . . 1 . . . . . . . . 4082 1 60 . 1 1 7 7 ILE HG21 H 1 0.82 . . 1 . . . . . . . . 4082 1 61 . 1 1 7 7 ILE HG22 H 1 0.82 . . 1 . . . . . . . . 4082 1 62 . 1 1 7 7 ILE HG23 H 1 0.82 . . 1 . . . . . . . . 4082 1 63 . 1 1 7 7 ILE HD11 H 1 0.60 . . 1 . . . . . . . . 4082 1 64 . 1 1 7 7 ILE HD12 H 1 0.60 . . 1 . . . . . . . . 4082 1 65 . 1 1 7 7 ILE HD13 H 1 0.60 . . 1 . . . . . . . . 4082 1 66 . 1 1 7 7 ILE CA C 13 62.0 . . 1 . . . . . . . . 4082 1 67 . 1 1 7 7 ILE CB C 13 34.5 . . 1 . . . . . . . . 4082 1 68 . 1 1 7 7 ILE CG1 C 13 28.4 . . 1 . . . . . . . . 4082 1 69 . 1 1 7 7 ILE CG2 C 13 19.1 . . 1 . . . . . . . . 4082 1 70 . 1 1 7 7 ILE CD1 C 13 8.6 . . 1 . . . . . . . . 4082 1 71 . 1 1 7 7 ILE N N 15 119.3 . . 1 . . . . . . . . 4082 1 72 . 1 1 8 8 ASP H H 1 8.10 . . 1 . . . . . . . . 4082 1 73 . 1 1 8 8 ASP HA H 1 4.22 . . 1 . . . . . . . . 4082 1 74 . 1 1 8 8 ASP HB2 H 1 2.71 . . 1 . . . . . . . . 4082 1 75 . 1 1 8 8 ASP HB3 H 1 2.60 . . 1 . . . . . . . . 4082 1 76 . 1 1 8 8 ASP CA C 13 57.7 . . 1 . . . . . . . . 4082 1 77 . 1 1 8 8 ASP CB C 13 39.7 . . 1 . . . . . . . . 4082 1 78 . 1 1 8 8 ASP N N 15 120.2 . . 1 . . . . . . . . 4082 1 79 . 1 1 9 9 ASN H H 1 7.76 . . 1 . . . . . . . . 4082 1 80 . 1 1 9 9 ASN HA H 1 4.36 . . 1 . . . . . . . . 4082 1 81 . 1 1 9 9 ASN HB2 H 1 2.87 . . 1 . . . . . . . . 4082 1 82 . 1 1 9 9 ASN HB3 H 1 2.68 . . 1 . . . . . . . . 4082 1 83 . 1 1 9 9 ASN HD21 H 1 7.44 . . 1 . . . . . . . . 4082 1 84 . 1 1 9 9 ASN HD22 H 1 6.82 . . 1 . . . . . . . . 4082 1 85 . 1 1 9 9 ASN CA C 13 56.9 . . 1 . . . . . . . . 4082 1 86 . 1 1 9 9 ASN CB C 13 38.9 . . 1 . . . . . . . . 4082 1 87 . 1 1 9 9 ASN N N 15 118.5 . . 1 . . . . . . . . 4082 1 88 . 1 1 9 9 ASN ND2 N 15 112.0 . . 1 . . . . . . . . 4082 1 89 . 1 1 10 10 LEU H H 1 8.03 . . 1 . . . . . . . . 4082 1 90 . 1 1 10 10 LEU HA H 1 4.08 . . 1 . . . . . . . . 4082 1 91 . 1 1 10 10 LEU HB2 H 1 2.06 . . 1 . . . . . . . . 4082 1 92 . 1 1 10 10 LEU HB3 H 1 2.06 . . 1 . . . . . . . . 4082 1 93 . 1 1 10 10 LEU HG H 1 2.00 . . 1 . . . . . . . . 4082 1 94 . 1 1 10 10 LEU HD11 H 1 0.96 . . 1 . . . . . . . . 4082 1 95 . 1 1 10 10 LEU HD12 H 1 0.96 . . 1 . . . . . . . . 4082 1 96 . 1 1 10 10 LEU HD13 H 1 0.96 . . 1 . . . . . . . . 4082 1 97 . 1 1 10 10 LEU HD21 H 1 0.86 . . 1 . . . . . . . . 4082 1 98 . 1 1 10 10 LEU HD22 H 1 0.86 . . 1 . . . . . . . . 4082 1 99 . 1 1 10 10 LEU HD23 H 1 0.86 . . 1 . . . . . . . . 4082 1 100 . 1 1 10 10 LEU CA C 13 57.9 . . 1 . . . . . . . . 4082 1 101 . 1 1 10 10 LEU CB C 13 42.5 . . 1 . . . . . . . . 4082 1 102 . 1 1 10 10 LEU CG C 13 26.9 . . 1 . . . . . . . . 4082 1 103 . 1 1 10 10 LEU CD1 C 13 23.3 . . 1 . . . . . . . . 4082 1 104 . 1 1 10 10 LEU CD2 C 13 25.6 . . 1 . . . . . . . . 4082 1 105 . 1 1 10 10 LEU N N 15 121.7 . . 1 . . . . . . . . 4082 1 106 . 1 1 11 11 MET H H 1 7.80 . . 1 . . . . . . . . 4082 1 107 . 1 1 11 11 MET HA H 1 4.65 . . 1 . . . . . . . . 4082 1 108 . 1 1 11 11 MET HB2 H 1 2.04 . . 1 . . . . . . . . 4082 1 109 . 1 1 11 11 MET HB3 H 1 2.04 . . 1 . . . . . . . . 4082 1 110 . 1 1 11 11 MET HG2 H 1 2.50 . . 1 . . . . . . . . 4082 1 111 . 1 1 11 11 MET HG3 H 1 2.31 . . 1 . . . . . . . . 4082 1 112 . 1 1 11 11 MET CA C 13 54.5 . . 1 . . . . . . . . 4082 1 113 . 1 1 11 11 MET CB C 13 32.1 . . 1 . . . . . . . . 4082 1 114 . 1 1 11 11 MET CG C 13 33.2 . . 1 . . . . . . . . 4082 1 115 . 1 1 11 11 MET N N 15 115.0 . . 1 . . . . . . . . 4082 1 116 . 1 1 12 12 ALA H H 1 7.45 . . 1 . . . . . . . . 4082 1 117 . 1 1 12 12 ALA HA H 1 4.06 . . 1 . . . . . . . . 4082 1 118 . 1 1 12 12 ALA HB1 H 1 1.53 . . 1 . . . . . . . . 4082 1 119 . 1 1 12 12 ALA HB2 H 1 1.53 . . 1 . . . . . . . . 4082 1 120 . 1 1 12 12 ALA HB3 H 1 1.53 . . 1 . . . . . . . . 4082 1 121 . 1 1 12 12 ALA CA C 13 56.0 . . 1 . . . . . . . . 4082 1 122 . 1 1 12 12 ALA CB C 13 19.0 . . 1 . . . . . . . . 4082 1 123 . 1 1 12 12 ALA N N 15 124.8 . . 1 . . . . . . . . 4082 1 124 . 1 1 13 13 ASP H H 1 8.59 . . 1 . . . . . . . . 4082 1 125 . 1 1 13 13 ASP HA H 1 4.47 . . 1 . . . . . . . . 4082 1 126 . 1 1 13 13 ASP HB2 H 1 3.18 . . 1 . . . . . . . . 4082 1 127 . 1 1 13 13 ASP HB3 H 1 2.68 . . 1 . . . . . . . . 4082 1 128 . 1 1 13 13 ASP CA C 13 54.2 . . 1 . . . . . . . . 4082 1 129 . 1 1 13 13 ASP CB C 13 40.1 . . 1 . . . . . . . . 4082 1 130 . 1 1 13 13 ASP N N 15 114.8 . . 1 . . . . . . . . 4082 1 131 . 1 1 14 14 GLY H H 1 7.57 . . 1 . . . . . . . . 4082 1 132 . 1 1 14 14 GLY HA2 H 1 4.18 . . 1 . . . . . . . . 4082 1 133 . 1 1 14 14 GLY HA3 H 1 4.18 . . 1 . . . . . . . . 4082 1 134 . 1 1 14 14 GLY CA C 13 46.7 . . 1 . . . . . . . . 4082 1 135 . 1 1 14 14 GLY N N 15 107.1 . . 1 . . . . . . . . 4082 1 136 . 1 1 15 15 THR H H 1 8.00 . . 1 . . . . . . . . 4082 1 137 . 1 1 15 15 THR HA H 1 4.28 . . 1 . . . . . . . . 4082 1 138 . 1 1 15 15 THR HB H 1 4.29 . . 1 . . . . . . . . 4082 1 139 . 1 1 15 15 THR HG21 H 1 1.17 . . 1 . . . . . . . . 4082 1 140 . 1 1 15 15 THR HG22 H 1 1.17 . . 1 . . . . . . . . 4082 1 141 . 1 1 15 15 THR HG23 H 1 1.17 . . 1 . . . . . . . . 4082 1 142 . 1 1 15 15 THR CA C 13 64.0 . . 1 . . . . . . . . 4082 1 143 . 1 1 15 15 THR CB C 13 71.1 . . 1 . . . . . . . . 4082 1 144 . 1 1 15 15 THR CG2 C 13 22.1 . . 1 . . . . . . . . 4082 1 145 . 1 1 15 15 THR N N 15 111.1 . . 1 . . . . . . . . 4082 1 146 . 1 1 16 16 CYS H H 1 8.24 . . 1 . . . . . . . . 4082 1 147 . 1 1 16 16 CYS HA H 1 5.08 . . 1 . . . . . . . . 4082 1 148 . 1 1 16 16 CYS HB2 H 1 3.05 . . 1 . . . . . . . . 4082 1 149 . 1 1 16 16 CYS HB3 H 1 2.72 . . 1 . . . . . . . . 4082 1 150 . 1 1 16 16 CYS CA C 13 59.4 . . 1 . . . . . . . . 4082 1 151 . 1 1 16 16 CYS CB C 13 30.7 . . 1 . . . . . . . . 4082 1 152 . 1 1 16 16 CYS N N 15 117.9 . . 1 . . . . . . . . 4082 1 153 . 1 1 17 17 GLN H H 1 8.77 . . 1 . . . . . . . . 4082 1 154 . 1 1 17 17 GLN HA H 1 4.69 . . 1 . . . . . . . . 4082 1 155 . 1 1 17 17 GLN HB2 H 1 2.00 . . 1 . . . . . . . . 4082 1 156 . 1 1 17 17 GLN HB3 H 1 1.51 . . 1 . . . . . . . . 4082 1 157 . 1 1 17 17 GLN HG2 H 1 1.40 . . 1 . . . . . . . . 4082 1 158 . 1 1 17 17 GLN HG3 H 1 1.40 . . 1 . . . . . . . . 4082 1 159 . 1 1 17 17 GLN HE21 H 1 6.82 . . 1 . . . . . . . . 4082 1 160 . 1 1 17 17 GLN HE22 H 1 6.82 . . 1 . . . . . . . . 4082 1 161 . 1 1 17 17 GLN CA C 13 53.7 . . 1 . . . . . . . . 4082 1 162 . 1 1 17 17 GLN CB C 13 30.7 . . 1 . . . . . . . . 4082 1 163 . 1 1 17 17 GLN CG C 13 38.0 . . 1 . . . . . . . . 4082 1 164 . 1 1 17 17 GLN N N 15 116.2 . . 1 . . . . . . . . 4082 1 165 . 1 1 17 17 GLN NE2 N 15 111.1 . . 1 . . . . . . . . 4082 1 166 . 1 1 18 18 ASP H H 1 7.66 . . 1 . . . . . . . . 4082 1 167 . 1 1 18 18 ASP HA H 1 4.69 . . 1 . . . . . . . . 4082 1 168 . 1 1 18 18 ASP HB2 H 1 2.12 . . 1 . . . . . . . . 4082 1 169 . 1 1 18 18 ASP HB3 H 1 1.81 . . 1 . . . . . . . . 4082 1 170 . 1 1 18 18 ASP CA C 13 53.4 . . 1 . . . . . . . . 4082 1 171 . 1 1 18 18 ASP CB C 13 44.4 . . 1 . . . . . . . . 4082 1 172 . 1 1 18 18 ASP N N 15 120.7 . . 1 . . . . . . . . 4082 1 173 . 1 1 19 19 ALA H H 1 9.19 . . 1 . . . . . . . . 4082 1 174 . 1 1 19 19 ALA HA H 1 5.55 . . 1 . . . . . . . . 4082 1 175 . 1 1 19 19 ALA HB1 H 1 1.41 . . 1 . . . . . . . . 4082 1 176 . 1 1 19 19 ALA HB2 H 1 1.41 . . 1 . . . . . . . . 4082 1 177 . 1 1 19 19 ALA HB3 H 1 1.41 . . 1 . . . . . . . . 4082 1 178 . 1 1 19 19 ALA CA C 13 51.8 . . 1 . . . . . . . . 4082 1 179 . 1 1 19 19 ALA CB C 13 23.7 . . 1 . . . . . . . . 4082 1 180 . 1 1 19 19 ALA N N 15 127.4 . . 1 . . . . . . . . 4082 1 181 . 1 1 20 20 ALA H H 1 8.78 . . 1 . . . . . . . . 4082 1 182 . 1 1 20 20 ALA HA H 1 5.13 . . 1 . . . . . . . . 4082 1 183 . 1 1 20 20 ALA HB1 H 1 1.28 . . 1 . . . . . . . . 4082 1 184 . 1 1 20 20 ALA HB2 H 1 1.28 . . 1 . . . . . . . . 4082 1 185 . 1 1 20 20 ALA HB3 H 1 1.28 . . 1 . . . . . . . . 4082 1 186 . 1 1 20 20 ALA CA C 13 51.8 . . 1 . . . . . . . . 4082 1 187 . 1 1 20 20 ALA CB C 13 24.1 . . 1 . . . . . . . . 4082 1 188 . 1 1 20 20 ALA N N 15 118.9 . . 1 . . . . . . . . 4082 1 189 . 1 1 21 21 ILE H H 1 8.65 . . 1 . . . . . . . . 4082 1 190 . 1 1 21 21 ILE HA H 1 4.69 . . 1 . . . . . . . . 4082 1 191 . 1 1 21 21 ILE HB H 1 1.45 . . 1 . . . . . . . . 4082 1 192 . 1 1 21 21 ILE HG12 H 1 1.60 . . 1 . . . . . . . . 4082 1 193 . 1 1 21 21 ILE HG13 H 1 1.60 . . 1 . . . . . . . . 4082 1 194 . 1 1 21 21 ILE HG21 H 1 0.39 . . 1 . . . . . . . . 4082 1 195 . 1 1 21 21 ILE HG22 H 1 0.39 . . 1 . . . . . . . . 4082 1 196 . 1 1 21 21 ILE HG23 H 1 0.39 . . 1 . . . . . . . . 4082 1 197 . 1 1 21 21 ILE HD11 H 1 1.02 . . 1 . . . . . . . . 4082 1 198 . 1 1 21 21 ILE HD12 H 1 1.02 . . 1 . . . . . . . . 4082 1 199 . 1 1 21 21 ILE HD13 H 1 1.02 . . 1 . . . . . . . . 4082 1 200 . 1 1 21 21 ILE CA C 13 60.6 . . 1 . . . . . . . . 4082 1 201 . 1 1 21 21 ILE CB C 13 41.2 . . 1 . . . . . . . . 4082 1 202 . 1 1 21 21 ILE CG1 C 13 28.6 . . 1 . . . . . . . . 4082 1 203 . 1 1 21 21 ILE CG2 C 13 17.7 . . 1 . . . . . . . . 4082 1 204 . 1 1 21 21 ILE CD1 C 13 14.9 . . 1 . . . . . . . . 4082 1 205 . 1 1 21 21 ILE N N 15 119.7 . . 1 . . . . . . . . 4082 1 206 . 1 1 22 22 VAL H H 1 9.10 . . 1 . . . . . . . . 4082 1 207 . 1 1 22 22 VAL HA H 1 4.09 . . 1 . . . . . . . . 4082 1 208 . 1 1 22 22 VAL HB H 1 1.60 . . 1 . . . . . . . . 4082 1 209 . 1 1 22 22 VAL HG11 H 1 0.59 . . 1 . . . . . . . . 4082 1 210 . 1 1 22 22 VAL HG12 H 1 0.59 . . 1 . . . . . . . . 4082 1 211 . 1 1 22 22 VAL HG13 H 1 0.59 . . 1 . . . . . . . . 4082 1 212 . 1 1 22 22 VAL HG21 H 1 0.47 . . 1 . . . . . . . . 4082 1 213 . 1 1 22 22 VAL HG22 H 1 0.47 . . 1 . . . . . . . . 4082 1 214 . 1 1 22 22 VAL HG23 H 1 0.47 . . 1 . . . . . . . . 4082 1 215 . 1 1 22 22 VAL CA C 13 60.1 . . 1 . . . . . . . . 4082 1 216 . 1 1 22 22 VAL CB C 13 36.5 . . 1 . . . . . . . . 4082 1 217 . 1 1 22 22 VAL CG1 C 13 22.6 . . 1 . . . . . . . . 4082 1 218 . 1 1 22 22 VAL CG2 C 13 20.7 . . 1 . . . . . . . . 4082 1 219 . 1 1 22 22 VAL N N 15 129.3 . . 1 . . . . . . . . 4082 1 220 . 1 1 23 23 GLY H H 1 8.04 . . 1 . . . . . . . . 4082 1 221 . 1 1 23 23 GLY HA2 H 1 3.66 . . 1 . . . . . . . . 4082 1 222 . 1 1 23 23 GLY HA3 H 1 2.99 . . 1 . . . . . . . . 4082 1 223 . 1 1 23 23 GLY CA C 13 45.7 . . 1 . . . . . . . . 4082 1 224 . 1 1 23 23 GLY N N 15 115.4 . . 1 . . . . . . . . 4082 1 225 . 1 1 24 24 TYR H H 1 6.73 . . 1 . . . . . . . . 4082 1 226 . 1 1 24 24 TYR HA H 1 4.72 . . 1 . . . . . . . . 4082 1 227 . 1 1 24 24 TYR HB2 H 1 2.97 . . 1 . . . . . . . . 4082 1 228 . 1 1 24 24 TYR HB3 H 1 2.05 . . 1 . . . . . . . . 4082 1 229 . 1 1 24 24 TYR HD1 H 1 6.60 . . 1 . . . . . . . . 4082 1 230 . 1 1 24 24 TYR HD2 H 1 6.60 . . 1 . . . . . . . . 4082 1 231 . 1 1 24 24 TYR HE1 H 1 6.70 . . 1 . . . . . . . . 4082 1 232 . 1 1 24 24 TYR HE2 H 1 6.70 . . 1 . . . . . . . . 4082 1 233 . 1 1 24 24 TYR CA C 13 56.0 . . 1 . . . . . . . . 4082 1 234 . 1 1 24 24 TYR CB C 13 40.6 . . 1 . . . . . . . . 4082 1 235 . 1 1 24 24 TYR CD1 C 13 133.1 . . 1 . . . . . . . . 4082 1 236 . 1 1 24 24 TYR CD2 C 13 133.1 . . 1 . . . . . . . . 4082 1 237 . 1 1 24 24 TYR CE1 C 13 118.0 . . 1 . . . . . . . . 4082 1 238 . 1 1 24 24 TYR CE2 C 13 118.0 . . 1 . . . . . . . . 4082 1 239 . 1 1 24 24 TYR N N 15 116.4 . . 1 . . . . . . . . 4082 1 240 . 1 1 25 25 LYS H H 1 7.59 . . 1 . . . . . . . . 4082 1 241 . 1 1 25 25 LYS HA H 1 3.98 . . 1 . . . . . . . . 4082 1 242 . 1 1 25 25 LYS HB2 H 1 1.52 . . 1 . . . . . . . . 4082 1 243 . 1 1 25 25 LYS HB3 H 1 1.46 . . 1 . . . . . . . . 4082 1 244 . 1 1 25 25 LYS HG2 H 1 0.81 . . 1 . . . . . . . . 4082 1 245 . 1 1 25 25 LYS HG3 H 1 0.81 . . 1 . . . . . . . . 4082 1 246 . 1 1 25 25 LYS HD2 H 1 1.17 . . 1 . . . . . . . . 4082 1 247 . 1 1 25 25 LYS HD3 H 1 1.17 . . 1 . . . . . . . . 4082 1 248 . 1 1 25 25 LYS HE2 H 1 2.88 . . 1 . . . . . . . . 4082 1 249 . 1 1 25 25 LYS HE3 H 1 2.88 . . 1 . . . . . . . . 4082 1 250 . 1 1 25 25 LYS CA C 13 55.9 . . 1 . . . . . . . . 4082 1 251 . 1 1 25 25 LYS CB C 13 32.4 . . 1 . . . . . . . . 4082 1 252 . 1 1 25 25 LYS CG C 13 25.3 . . 1 . . . . . . . . 4082 1 253 . 1 1 25 25 LYS CD C 13 22.0 . . 1 . . . . . . . . 4082 1 254 . 1 1 25 25 LYS CE C 13 41.8 . . 1 . . . . . . . . 4082 1 255 . 1 1 25 25 LYS N N 15 123.8 . . 1 . . . . . . . . 4082 1 256 . 1 1 26 26 ASP H H 1 8.39 . . 1 . . . . . . . . 4082 1 257 . 1 1 26 26 ASP HA H 1 4.15 . . 1 . . . . . . . . 4082 1 258 . 1 1 26 26 ASP HB2 H 1 2.78 . . 1 . . . . . . . . 4082 1 259 . 1 1 26 26 ASP HB3 H 1 2.67 . . 1 . . . . . . . . 4082 1 260 . 1 1 26 26 ASP CA C 13 56.6 . . 1 . . . . . . . . 4082 1 261 . 1 1 26 26 ASP CB C 13 40.1 . . 1 . . . . . . . . 4082 1 262 . 1 1 26 26 ASP N N 15 118.0 . . 1 . . . . . . . . 4082 1 263 . 1 1 27 27 SER H H 1 8.10 . . 1 . . . . . . . . 4082 1 264 . 1 1 27 27 SER HA H 1 4.68 . . 1 . . . . . . . . 4082 1 265 . 1 1 27 27 SER HB2 H 1 3.89 . . 1 . . . . . . . . 4082 1 266 . 1 1 27 27 SER HB3 H 1 3.74 . . 1 . . . . . . . . 4082 1 267 . 1 1 27 27 SER CA C 13 55.4 . . 1 . . . . . . . . 4082 1 268 . 1 1 27 27 SER CB C 13 63.1 . . 1 . . . . . . . . 4082 1 269 . 1 1 27 27 SER N N 15 118.7 . . 1 . . . . . . . . 4082 1 270 . 1 1 28 28 PRO HA H 1 4.52 . . 1 . . . . . . . . 4082 1 271 . 1 1 28 28 PRO HB2 H 1 2.13 . . 1 . . . . . . . . 4082 1 272 . 1 1 28 28 PRO HB3 H 1 1.62 . . 1 . . . . . . . . 4082 1 273 . 1 1 28 28 PRO HG2 H 1 1.98 . . 1 . . . . . . . . 4082 1 274 . 1 1 28 28 PRO HG3 H 1 1.81 . . 1 . . . . . . . . 4082 1 275 . 1 1 28 28 PRO HD2 H 1 3.77 . . 1 . . . . . . . . 4082 1 276 . 1 1 28 28 PRO HD3 H 1 3.73 . . 1 . . . . . . . . 4082 1 277 . 1 1 28 28 PRO CA C 13 63.2 . . 1 . . . . . . . . 4082 1 278 . 1 1 28 28 PRO CB C 13 32.7 . . 1 . . . . . . . . 4082 1 279 . 1 1 28 28 PRO CG C 13 27.8 . . 1 . . . . . . . . 4082 1 280 . 1 1 28 28 PRO CD C 13 50.3 . . 1 . . . . . . . . 4082 1 281 . 1 1 29 29 SER H H 1 7.96 . . 1 . . . . . . . . 4082 1 282 . 1 1 29 29 SER HA H 1 4.51 . . 1 . . . . . . . . 4082 1 283 . 1 1 29 29 SER HB2 H 1 3.97 . . 1 . . . . . . . . 4082 1 284 . 1 1 29 29 SER HB3 H 1 3.82 . . 1 . . . . . . . . 4082 1 285 . 1 1 29 29 SER CA C 13 57.5 . . 1 . . . . . . . . 4082 1 286 . 1 1 29 29 SER CB C 13 65.5 . . 1 . . . . . . . . 4082 1 287 . 1 1 29 29 SER N N 15 114.2 . . 1 . . . . . . . . 4082 1 288 . 1 1 30 30 VAL H H 1 8.91 . . 1 . . . . . . . . 4082 1 289 . 1 1 30 30 VAL HA H 1 3.75 . . 1 . . . . . . . . 4082 1 290 . 1 1 30 30 VAL HB H 1 2.17 . . 1 . . . . . . . . 4082 1 291 . 1 1 30 30 VAL HG11 H 1 0.95 . . 1 . . . . . . . . 4082 1 292 . 1 1 30 30 VAL HG12 H 1 0.95 . . 1 . . . . . . . . 4082 1 293 . 1 1 30 30 VAL HG13 H 1 0.95 . . 1 . . . . . . . . 4082 1 294 . 1 1 30 30 VAL HG21 H 1 0.80 . . 1 . . . . . . . . 4082 1 295 . 1 1 30 30 VAL HG22 H 1 0.80 . . 1 . . . . . . . . 4082 1 296 . 1 1 30 30 VAL HG23 H 1 0.80 . . 1 . . . . . . . . 4082 1 297 . 1 1 30 30 VAL CA C 13 64.2 . . 1 . . . . . . . . 4082 1 298 . 1 1 30 30 VAL CB C 13 32.1 . . 1 . . . . . . . . 4082 1 299 . 1 1 30 30 VAL CG1 C 13 22.5 . . 1 . . . . . . . . 4082 1 300 . 1 1 30 30 VAL CG2 C 13 23.0 . . 1 . . . . . . . . 4082 1 301 . 1 1 30 30 VAL N N 15 123.6 . . 1 . . . . . . . . 4082 1 302 . 1 1 31 31 TRP H H 1 9.07 . . 1 . . . . . . . . 4082 1 303 . 1 1 31 31 TRP HA H 1 4.76 . . 1 . . . . . . . . 4082 1 304 . 1 1 31 31 TRP HB2 H 1 2.46 . . 1 . . . . . . . . 4082 1 305 . 1 1 31 31 TRP HB3 H 1 2.46 . . 1 . . . . . . . . 4082 1 306 . 1 1 31 31 TRP HD1 H 1 6.81 . . 1 . . . . . . . . 4082 1 307 . 1 1 31 31 TRP HE1 H 1 10.00 . . 1 . . . . . . . . 4082 1 308 . 1 1 31 31 TRP HE3 H 1 5.25 . . 1 . . . . . . . . 4082 1 309 . 1 1 31 31 TRP HZ2 H 1 7.32 . . 3 . . . . . . . . 4082 1 310 . 1 1 31 31 TRP HZ3 H 1 6.21 . . 3 . . . . . . . . 4082 1 311 . 1 1 31 31 TRP HH2 H 1 6.97 . . 1 . . . . . . . . 4082 1 312 . 1 1 31 31 TRP CA C 13 57.0 . . 1 . . . . . . . . 4082 1 313 . 1 1 31 31 TRP CB C 13 28.4 . . 1 . . . . . . . . 4082 1 314 . 1 1 31 31 TRP CD1 C 13 124.4 . . 1 . . . . . . . . 4082 1 315 . 1 1 31 31 TRP CZ3 C 13 122.0 . . 1 . . . . . . . . 4082 1 316 . 1 1 31 31 TRP CH2 C 13 123.2 . . 1 . . . . . . . . 4082 1 317 . 1 1 31 31 TRP N N 15 107.2 . . 1 . . . . . . . . 4082 1 318 . 1 1 31 31 TRP NE1 N 15 127.4 . . 1 . . . . . . . . 4082 1 319 . 1 1 32 32 ALA H H 1 7.92 . . 1 . . . . . . . . 4082 1 320 . 1 1 32 32 ALA HA H 1 4.61 . . 1 . . . . . . . . 4082 1 321 . 1 1 32 32 ALA HB1 H 1 1.48 . . 1 . . . . . . . . 4082 1 322 . 1 1 32 32 ALA HB2 H 1 1.48 . . 1 . . . . . . . . 4082 1 323 . 1 1 32 32 ALA HB3 H 1 1.48 . . 1 . . . . . . . . 4082 1 324 . 1 1 32 32 ALA CA C 13 52.7 . . 1 . . . . . . . . 4082 1 325 . 1 1 32 32 ALA CB C 13 23.2 . . 1 . . . . . . . . 4082 1 326 . 1 1 32 32 ALA N N 15 119.3 . . 1 . . . . . . . . 4082 1 327 . 1 1 33 33 ALA H H 1 8.43 . . 1 . . . . . . . . 4082 1 328 . 1 1 33 33 ALA HA H 1 5.20 . . 1 . . . . . . . . 4082 1 329 . 1 1 33 33 ALA HB1 H 1 1.46 . . 1 . . . . . . . . 4082 1 330 . 1 1 33 33 ALA HB2 H 1 1.46 . . 1 . . . . . . . . 4082 1 331 . 1 1 33 33 ALA HB3 H 1 1.46 . . 1 . . . . . . . . 4082 1 332 . 1 1 33 33 ALA CA C 13 51.7 . . 1 . . . . . . . . 4082 1 333 . 1 1 33 33 ALA CB C 13 22.3 . . 1 . . . . . . . . 4082 1 334 . 1 1 33 33 ALA N N 15 122.0 . . 1 . . . . . . . . 4082 1 335 . 1 1 34 34 VAL H H 1 7.49 . . 1 . . . . . . . . 4082 1 336 . 1 1 34 34 VAL HA H 1 4.24 . . 1 . . . . . . . . 4082 1 337 . 1 1 34 34 VAL HB H 1 2.35 . . 1 . . . . . . . . 4082 1 338 . 1 1 34 34 VAL HG11 H 1 1.29 . . 1 . . . . . . . . 4082 1 339 . 1 1 34 34 VAL HG12 H 1 1.29 . . 1 . . . . . . . . 4082 1 340 . 1 1 34 34 VAL HG13 H 1 1.29 . . 1 . . . . . . . . 4082 1 341 . 1 1 34 34 VAL HG21 H 1 1.00 . . 1 . . . . . . . . 4082 1 342 . 1 1 34 34 VAL HG22 H 1 1.00 . . 1 . . . . . . . . 4082 1 343 . 1 1 34 34 VAL HG23 H 1 1.00 . . 1 . . . . . . . . 4082 1 344 . 1 1 34 34 VAL CA C 13 61.2 . . 1 . . . . . . . . 4082 1 345 . 1 1 34 34 VAL CB C 13 32.4 . . 1 . . . . . . . . 4082 1 346 . 1 1 34 34 VAL CG1 C 13 23.4 . . 1 . . . . . . . . 4082 1 347 . 1 1 34 34 VAL CG2 C 13 21.3 . . 1 . . . . . . . . 4082 1 348 . 1 1 34 34 VAL N N 15 123.5 . . 1 . . . . . . . . 4082 1 349 . 1 1 35 35 PRO HA H 1 4.24 . . 1 . . . . . . . . 4082 1 350 . 1 1 35 35 PRO HB2 H 1 2.28 . . 1 . . . . . . . . 4082 1 351 . 1 1 35 35 PRO HB3 H 1 1.88 . . 1 . . . . . . . . 4082 1 352 . 1 1 35 35 PRO HG2 H 1 2.11 . . 1 . . . . . . . . 4082 1 353 . 1 1 35 35 PRO HG3 H 1 2.02 . . 1 . . . . . . . . 4082 1 354 . 1 1 35 35 PRO HD2 H 1 4.14 . . 1 . . . . . . . . 4082 1 355 . 1 1 35 35 PRO HD3 H 1 3.77 . . 1 . . . . . . . . 4082 1 356 . 1 1 35 35 PRO CA C 13 63.4 . . 1 . . . . . . . . 4082 1 357 . 1 1 35 35 PRO CB C 13 31.1 . . 1 . . . . . . . . 4082 1 358 . 1 1 35 35 PRO CG C 13 27.7 . . 1 . . . . . . . . 4082 1 359 . 1 1 35 35 PRO CD C 13 51.2 . . 1 . . . . . . . . 4082 1 360 . 1 1 36 36 GLY H H 1 8.77 . . 1 . . . . . . . . 4082 1 361 . 1 1 36 36 GLY HA2 H 1 3.99 . . 1 . . . . . . . . 4082 1 362 . 1 1 36 36 GLY HA3 H 1 3.77 . . 1 . . . . . . . . 4082 1 363 . 1 1 36 36 GLY CA C 13 46.2 . . 1 . . . . . . . . 4082 1 364 . 1 1 36 36 GLY N N 15 108.3 . . 1 . . . . . . . . 4082 1 365 . 1 1 37 37 LYS H H 1 6.57 . . 1 . . . . . . . . 4082 1 366 . 1 1 37 37 LYS HA H 1 4.71 . . 1 . . . . . . . . 4082 1 367 . 1 1 37 37 LYS HB2 H 1 1.85 . . 1 . . . . . . . . 4082 1 368 . 1 1 37 37 LYS HB3 H 1 1.85 . . 1 . . . . . . . . 4082 1 369 . 1 1 37 37 LYS HG2 H 1 1.27 . . 1 . . . . . . . . 4082 1 370 . 1 1 37 37 LYS HG3 H 1 1.20 . . 1 . . . . . . . . 4082 1 371 . 1 1 37 37 LYS HD2 H 1 1.56 . . 1 . . . . . . . . 4082 1 372 . 1 1 37 37 LYS HD3 H 1 1.44 . . 1 . . . . . . . . 4082 1 373 . 1 1 37 37 LYS CA C 13 53.2 . . 1 . . . . . . . . 4082 1 374 . 1 1 37 37 LYS CB C 13 27.9 . . 1 . . . . . . . . 4082 1 375 . 1 1 37 37 LYS N N 15 119.7 . . 1 . . . . . . . . 4082 1 376 . 1 1 38 38 THR H H 1 8.28 . . 1 . . . . . . . . 4082 1 377 . 1 1 38 38 THR HA H 1 4.33 . . 1 . . . . . . . . 4082 1 378 . 1 1 38 38 THR HB H 1 3.62 . . 1 . . . . . . . . 4082 1 379 . 1 1 38 38 THR HG21 H 1 1.03 . . 1 . . . . . . . . 4082 1 380 . 1 1 38 38 THR HG22 H 1 1.03 . . 1 . . . . . . . . 4082 1 381 . 1 1 38 38 THR HG23 H 1 1.03 . . 1 . . . . . . . . 4082 1 382 . 1 1 38 38 THR CA C 13 65.1 . . 1 . . . . . . . . 4082 1 383 . 1 1 38 38 THR CB C 13 70.1 . . 1 . . . . . . . . 4082 1 384 . 1 1 38 38 THR CG2 C 13 23.2 . . 1 . . . . . . . . 4082 1 385 . 1 1 38 38 THR N N 15 120.1 . . 1 . . . . . . . . 4082 1 386 . 1 1 39 39 PHE H H 1 9.84 . . 1 . . . . . . . . 4082 1 387 . 1 1 39 39 PHE HA H 1 4.18 . . 1 . . . . . . . . 4082 1 388 . 1 1 39 39 PHE HB2 H 1 2.97 . . 1 . . . . . . . . 4082 1 389 . 1 1 39 39 PHE HB3 H 1 2.86 . . 1 . . . . . . . . 4082 1 390 . 1 1 39 39 PHE HD1 H 1 6.67 . . 1 . . . . . . . . 4082 1 391 . 1 1 39 39 PHE HD2 H 1 6.67 . . 1 . . . . . . . . 4082 1 392 . 1 1 39 39 PHE HE1 H 1 6.86 . . 1 . . . . . . . . 4082 1 393 . 1 1 39 39 PHE HE2 H 1 6.86 . . 1 . . . . . . . . 4082 1 394 . 1 1 39 39 PHE HZ H 1 6.93 . . 1 . . . . . . . . 4082 1 395 . 1 1 39 39 PHE CA C 13 57.3 . . 1 . . . . . . . . 4082 1 396 . 1 1 39 39 PHE CB C 13 37.7 . . 1 . . . . . . . . 4082 1 397 . 1 1 39 39 PHE CD1 C 13 129.2 . . 1 . . . . . . . . 4082 1 398 . 1 1 39 39 PHE CD2 C 13 129.2 . . 1 . . . . . . . . 4082 1 399 . 1 1 39 39 PHE CE1 C 13 130.6 . . 1 . . . . . . . . 4082 1 400 . 1 1 39 39 PHE CE2 C 13 130.6 . . 1 . . . . . . . . 4082 1 401 . 1 1 39 39 PHE CZ C 13 128.4 . . 1 . . . . . . . . 4082 1 402 . 1 1 39 39 PHE N N 15 125.9 . . 1 . . . . . . . . 4082 1 403 . 1 1 40 40 VAL H H 1 9.75 . . 1 . . . . . . . . 4082 1 404 . 1 1 40 40 VAL HA H 1 3.64 . . 1 . . . . . . . . 4082 1 405 . 1 1 40 40 VAL HB H 1 2.02 . . 1 . . . . . . . . 4082 1 406 . 1 1 40 40 VAL HG11 H 1 0.99 . . 1 . . . . . . . . 4082 1 407 . 1 1 40 40 VAL HG12 H 1 0.99 . . 1 . . . . . . . . 4082 1 408 . 1 1 40 40 VAL HG13 H 1 0.99 . . 1 . . . . . . . . 4082 1 409 . 1 1 40 40 VAL HG21 H 1 0.75 . . 1 . . . . . . . . 4082 1 410 . 1 1 40 40 VAL HG22 H 1 0.75 . . 1 . . . . . . . . 4082 1 411 . 1 1 40 40 VAL HG23 H 1 0.75 . . 1 . . . . . . . . 4082 1 412 . 1 1 40 40 VAL CA C 13 63.5 . . 1 . . . . . . . . 4082 1 413 . 1 1 40 40 VAL CB C 13 31.2 . . 1 . . . . . . . . 4082 1 414 . 1 1 40 40 VAL CG1 C 13 22.0 . . 1 . . . . . . . . 4082 1 415 . 1 1 40 40 VAL CG2 C 13 19.4 . . 1 . . . . . . . . 4082 1 416 . 1 1 40 40 VAL N N 15 120.3 . . 1 . . . . . . . . 4082 1 417 . 1 1 41 41 ASN H H 1 7.68 . . 1 . . . . . . . . 4082 1 418 . 1 1 41 41 ASN HA H 1 4.85 . . 1 . . . . . . . . 4082 1 419 . 1 1 41 41 ASN HB2 H 1 2.94 . . 1 . . . . . . . . 4082 1 420 . 1 1 41 41 ASN HB3 H 1 2.79 . . 1 . . . . . . . . 4082 1 421 . 1 1 41 41 ASN HD21 H 1 7.74 . . 1 . . . . . . . . 4082 1 422 . 1 1 41 41 ASN HD22 H 1 6.91 . . 1 . . . . . . . . 4082 1 423 . 1 1 41 41 ASN CA C 13 52.8 . . 1 . . . . . . . . 4082 1 424 . 1 1 41 41 ASN CB C 13 39.1 . . 1 . . . . . . . . 4082 1 425 . 1 1 41 41 ASN N N 15 117.2 . . 1 . . . . . . . . 4082 1 426 . 1 1 41 41 ASN ND2 N 15 118.3 . . 1 . . . . . . . . 4082 1 427 . 1 1 42 42 ILE H H 1 7.79 . . 1 . . . . . . . . 4082 1 428 . 1 1 42 42 ILE HA H 1 4.21 . . 1 . . . . . . . . 4082 1 429 . 1 1 42 42 ILE HB H 1 1.58 . . 1 . . . . . . . . 4082 1 430 . 1 1 42 42 ILE HG12 H 1 1.89 . . 1 . . . . . . . . 4082 1 431 . 1 1 42 42 ILE HG13 H 1 1.07 . . 1 . . . . . . . . 4082 1 432 . 1 1 42 42 ILE HG21 H 1 0.72 . . 1 . . . . . . . . 4082 1 433 . 1 1 42 42 ILE HG22 H 1 0.72 . . 1 . . . . . . . . 4082 1 434 . 1 1 42 42 ILE HG23 H 1 0.72 . . 1 . . . . . . . . 4082 1 435 . 1 1 42 42 ILE HD11 H 1 0.58 . . 1 . . . . . . . . 4082 1 436 . 1 1 42 42 ILE HD12 H 1 0.58 . . 1 . . . . . . . . 4082 1 437 . 1 1 42 42 ILE HD13 H 1 0.58 . . 1 . . . . . . . . 4082 1 438 . 1 1 42 42 ILE CA C 13 63.2 . . 1 . . . . . . . . 4082 1 439 . 1 1 42 42 ILE CB C 13 38.4 . . 1 . . . . . . . . 4082 1 440 . 1 1 42 42 ILE CG1 C 13 31.0 . . 1 . . . . . . . . 4082 1 441 . 1 1 42 42 ILE CG2 C 13 17.9 . . 1 . . . . . . . . 4082 1 442 . 1 1 42 42 ILE CD1 C 13 15.8 . . 1 . . . . . . . . 4082 1 443 . 1 1 42 42 ILE N N 15 124.5 . . 1 . . . . . . . . 4082 1 444 . 1 1 43 43 THR H H 1 8.36 . . 1 . . . . . . . . 4082 1 445 . 1 1 43 43 THR HA H 1 4.89 . . 1 . . . . . . . . 4082 1 446 . 1 1 43 43 THR HB H 1 4.66 . . 1 . . . . . . . . 4082 1 447 . 1 1 43 43 THR HG21 H 1 1.24 . . 1 . . . . . . . . 4082 1 448 . 1 1 43 43 THR HG22 H 1 1.24 . . 1 . . . . . . . . 4082 1 449 . 1 1 43 43 THR HG23 H 1 1.24 . . 1 . . . . . . . . 4082 1 450 . 1 1 43 43 THR CA C 13 58.9 . . 1 . . . . . . . . 4082 1 451 . 1 1 43 43 THR CB C 13 69.7 . . 1 . . . . . . . . 4082 1 452 . 1 1 43 43 THR CG2 C 13 22.4 . . 1 . . . . . . . . 4082 1 453 . 1 1 43 43 THR N N 15 119.5 . . 1 . . . . . . . . 4082 1 454 . 1 1 44 44 PRO HA H 1 3.92 . . 1 . . . . . . . . 4082 1 455 . 1 1 44 44 PRO HB2 H 1 2.23 . . 1 . . . . . . . . 4082 1 456 . 1 1 44 44 PRO HB3 H 1 1.96 . . 1 . . . . . . . . 4082 1 457 . 1 1 44 44 PRO HG2 H 1 1.09 . . 1 . . . . . . . . 4082 1 458 . 1 1 44 44 PRO HG3 H 1 1.82 . . 1 . . . . . . . . 4082 1 459 . 1 1 44 44 PRO CA C 13 65.7 . . 1 . . . . . . . . 4082 1 460 . 1 1 44 44 PRO CB C 13 32.3 . . 1 . . . . . . . . 4082 1 461 . 1 1 45 45 ALA H H 1 8.21 . . 1 . . . . . . . . 4082 1 462 . 1 1 45 45 ALA HA H 1 4.08 . . 1 . . . . . . . . 4082 1 463 . 1 1 45 45 ALA HB1 H 1 1.36 . . 1 . . . . . . . . 4082 1 464 . 1 1 45 45 ALA HB2 H 1 1.36 . . 1 . . . . . . . . 4082 1 465 . 1 1 45 45 ALA HB3 H 1 1.36 . . 1 . . . . . . . . 4082 1 466 . 1 1 45 45 ALA CA C 13 55.8 . . 1 . . . . . . . . 4082 1 467 . 1 1 45 45 ALA CB C 13 18.1 . . 1 . . . . . . . . 4082 1 468 . 1 1 45 45 ALA N N 15 121.4 . . 1 . . . . . . . . 4082 1 469 . 1 1 46 46 GLU H H 1 7.82 . . 1 . . . . . . . . 4082 1 470 . 1 1 46 46 GLU HA H 1 3.99 . . 1 . . . . . . . . 4082 1 471 . 1 1 46 46 GLU HB2 H 1 1.79 . . 1 . . . . . . . . 4082 1 472 . 1 1 46 46 GLU HB3 H 1 1.69 . . 1 . . . . . . . . 4082 1 473 . 1 1 46 46 GLU CA C 13 59.4 . . 1 . . . . . . . . 4082 1 474 . 1 1 46 46 GLU CB C 13 33.8 . . 1 . . . . . . . . 4082 1 475 . 1 1 46 46 GLU N N 15 120.1 . . 1 . . . . . . . . 4082 1 476 . 1 1 47 47 VAL H H 1 8.03 . . 1 . . . . . . . . 4082 1 477 . 1 1 47 47 VAL HA H 1 3.23 . . 1 . . . . . . . . 4082 1 478 . 1 1 47 47 VAL HB H 1 2.06 . . 1 . . . . . . . . 4082 1 479 . 1 1 47 47 VAL HG11 H 1 0.83 . . 1 . . . . . . . . 4082 1 480 . 1 1 47 47 VAL HG12 H 1 0.83 . . 1 . . . . . . . . 4082 1 481 . 1 1 47 47 VAL HG13 H 1 0.83 . . 1 . . . . . . . . 4082 1 482 . 1 1 47 47 VAL HG21 H 1 0.76 . . 1 . . . . . . . . 4082 1 483 . 1 1 47 47 VAL HG22 H 1 0.76 . . 1 . . . . . . . . 4082 1 484 . 1 1 47 47 VAL HG23 H 1 0.76 . . 1 . . . . . . . . 4082 1 485 . 1 1 47 47 VAL CA C 13 67.7 . . 1 . . . . . . . . 4082 1 486 . 1 1 47 47 VAL CB C 13 31.0 . . 1 . . . . . . . . 4082 1 487 . 1 1 47 47 VAL CG1 C 13 21.8 . . 1 . . . . . . . . 4082 1 488 . 1 1 47 47 VAL CG2 C 13 24.0 . . 1 . . . . . . . . 4082 1 489 . 1 1 47 47 VAL N N 15 121.6 . . 1 . . . . . . . . 4082 1 490 . 1 1 48 48 GLY H H 1 8.16 . . 1 . . . . . . . . 4082 1 491 . 1 1 48 48 GLY HA2 H 1 3.75 . . 1 . . . . . . . . 4082 1 492 . 1 1 48 48 GLY HA3 H 1 3.75 . . 1 . . . . . . . . 4082 1 493 . 1 1 48 48 GLY CA C 13 46.7 . . 1 . . . . . . . . 4082 1 494 . 1 1 48 48 GLY N N 15 112.1 . . 1 . . . . . . . . 4082 1 495 . 1 1 49 49 VAL H H 1 7.33 . . 1 . . . . . . . . 4082 1 496 . 1 1 49 49 VAL HA H 1 3.73 . . 1 . . . . . . . . 4082 1 497 . 1 1 49 49 VAL HB H 1 2.09 . . 1 . . . . . . . . 4082 1 498 . 1 1 49 49 VAL HG11 H 1 1.08 . . 1 . . . . . . . . 4082 1 499 . 1 1 49 49 VAL HG12 H 1 1.08 . . 1 . . . . . . . . 4082 1 500 . 1 1 49 49 VAL HG13 H 1 1.08 . . 1 . . . . . . . . 4082 1 501 . 1 1 49 49 VAL HG21 H 1 1.08 . . 1 . . . . . . . . 4082 1 502 . 1 1 49 49 VAL HG22 H 1 1.08 . . 1 . . . . . . . . 4082 1 503 . 1 1 49 49 VAL HG23 H 1 1.08 . . 1 . . . . . . . . 4082 1 504 . 1 1 49 49 VAL CA C 13 66.0 . . 1 . . . . . . . . 4082 1 505 . 1 1 49 49 VAL CB C 13 32.1 . . 1 . . . . . . . . 4082 1 506 . 1 1 49 49 VAL CG1 C 13 22.6 . . 1 . . . . . . . . 4082 1 507 . 1 1 49 49 VAL CG2 C 13 22.1 . . 1 . . . . . . . . 4082 1 508 . 1 1 49 49 VAL N N 15 120.9 . . 1 . . . . . . . . 4082 1 509 . 1 1 50 50 LEU H H 1 7.35 . . 1 . . . . . . . . 4082 1 510 . 1 1 50 50 LEU HA H 1 3.73 . . 1 . . . . . . . . 4082 1 511 . 1 1 50 50 LEU HB2 H 1 2.05 . . 1 . . . . . . . . 4082 1 512 . 1 1 50 50 LEU HB3 H 1 1.06 . . 1 . . . . . . . . 4082 1 513 . 1 1 50 50 LEU HG H 1 1.68 . . 1 . . . . . . . . 4082 1 514 . 1 1 50 50 LEU HD11 H 1 0.59 . . 1 . . . . . . . . 4082 1 515 . 1 1 50 50 LEU HD12 H 1 0.59 . . 1 . . . . . . . . 4082 1 516 . 1 1 50 50 LEU HD13 H 1 0.59 . . 1 . . . . . . . . 4082 1 517 . 1 1 50 50 LEU HD21 H 1 0.59 . . 1 . . . . . . . . 4082 1 518 . 1 1 50 50 LEU HD22 H 1 0.59 . . 1 . . . . . . . . 4082 1 519 . 1 1 50 50 LEU HD23 H 1 0.59 . . 1 . . . . . . . . 4082 1 520 . 1 1 50 50 LEU CA C 13 58.9 . . 1 . . . . . . . . 4082 1 521 . 1 1 50 50 LEU CB C 13 42.5 . . 1 . . . . . . . . 4082 1 522 . 1 1 50 50 LEU CG C 13 26.8 . . 1 . . . . . . . . 4082 1 523 . 1 1 50 50 LEU CD1 C 13 24.8 . . 1 . . . . . . . . 4082 1 524 . 1 1 50 50 LEU CD2 C 13 26.0 . . 1 . . . . . . . . 4082 1 525 . 1 1 50 50 LEU N N 15 119.4 . . 1 . . . . . . . . 4082 1 526 . 1 1 51 51 VAL H H 1 7.55 . . 1 . . . . . . . . 4082 1 527 . 1 1 51 51 VAL HA H 1 4.32 . . 1 . . . . . . . . 4082 1 528 . 1 1 51 51 VAL HB H 1 2.25 . . 1 . . . . . . . . 4082 1 529 . 1 1 51 51 VAL HG11 H 1 0.79 . . 1 . . . . . . . . 4082 1 530 . 1 1 51 51 VAL HG12 H 1 0.79 . . 1 . . . . . . . . 4082 1 531 . 1 1 51 51 VAL HG13 H 1 0.79 . . 1 . . . . . . . . 4082 1 532 . 1 1 51 51 VAL HG21 H 1 0.24 . . 1 . . . . . . . . 4082 1 533 . 1 1 51 51 VAL HG22 H 1 0.24 . . 1 . . . . . . . . 4082 1 534 . 1 1 51 51 VAL HG23 H 1 0.24 . . 1 . . . . . . . . 4082 1 535 . 1 1 51 51 VAL CA C 13 60.8 . . 1 . . . . . . . . 4082 1 536 . 1 1 51 51 VAL CB C 13 31.2 . . 1 . . . . . . . . 4082 1 537 . 1 1 51 51 VAL CG1 C 13 18.1 . . 1 . . . . . . . . 4082 1 538 . 1 1 51 51 VAL CG2 C 13 21.6 . . 1 . . . . . . . . 4082 1 539 . 1 1 51 51 VAL N N 15 132.5 . . 1 . . . . . . . . 4082 1 540 . 1 1 52 52 GLY H H 1 7.18 . . 1 . . . . . . . . 4082 1 541 . 1 1 52 52 GLY HA2 H 1 4.09 . . 1 . . . . . . . . 4082 1 542 . 1 1 52 52 GLY HA3 H 1 3.95 . . 1 . . . . . . . . 4082 1 543 . 1 1 52 52 GLY CA C 13 45.7 . . 1 . . . . . . . . 4082 1 544 . 1 1 52 52 GLY N N 15 111.1 . . 1 . . . . . . . . 4082 1 545 . 1 1 53 53 LYS H H 1 8.04 . . 1 . . . . . . . . 4082 1 546 . 1 1 53 53 LYS HA H 1 3.96 . . 1 . . . . . . . . 4082 1 547 . 1 1 53 53 LYS HB2 H 1 1.74 . . 1 . . . . . . . . 4082 1 548 . 1 1 53 53 LYS HB3 H 1 1.74 . . 1 . . . . . . . . 4082 1 549 . 1 1 53 53 LYS HG2 H 1 1.44 . . 1 . . . . . . . . 4082 1 550 . 1 1 53 53 LYS HG3 H 1 1.44 . . 1 . . . . . . . . 4082 1 551 . 1 1 53 53 LYS HD2 H 1 1.65 . . 1 . . . . . . . . 4082 1 552 . 1 1 53 53 LYS HD3 H 1 1.65 . . 1 . . . . . . . . 4082 1 553 . 1 1 53 53 LYS HE2 H 1 2.94 . . 1 . . . . . . . . 4082 1 554 . 1 1 53 53 LYS HE3 H 1 2.94 . . 1 . . . . . . . . 4082 1 555 . 1 1 53 53 LYS CA C 13 57.9 . . 1 . . . . . . . . 4082 1 556 . 1 1 53 53 LYS CB C 13 33.2 . . 1 . . . . . . . . 4082 1 557 . 1 1 53 53 LYS CG C 13 25.1 . . 1 . . . . . . . . 4082 1 558 . 1 1 53 53 LYS CD C 13 29.2 . . 1 . . . . . . . . 4082 1 559 . 1 1 53 53 LYS CE C 13 42.1 . . 1 . . . . . . . . 4082 1 560 . 1 1 53 53 LYS N N 15 117.0 . . 1 . . . . . . . . 4082 1 561 . 1 1 54 54 ASP H H 1 7.74 . . 1 . . . . . . . . 4082 1 562 . 1 1 54 54 ASP HA H 1 4.50 . . 1 . . . . . . . . 4082 1 563 . 1 1 54 54 ASP HB2 H 1 2.78 . . 1 . . . . . . . . 4082 1 564 . 1 1 54 54 ASP HB3 H 1 2.52 . . 1 . . . . . . . . 4082 1 565 . 1 1 54 54 ASP CA C 13 53.8 . . 1 . . . . . . . . 4082 1 566 . 1 1 54 54 ASP CB C 13 40.1 . . 1 . . . . . . . . 4082 1 567 . 1 1 54 54 ASP N N 15 117.9 . . 1 . . . . . . . . 4082 1 568 . 1 1 55 55 ARG H H 1 8.63 . . 1 . . . . . . . . 4082 1 569 . 1 1 55 55 ARG HA H 1 3.86 . . 1 . . . . . . . . 4082 1 570 . 1 1 55 55 ARG HB2 H 1 2.10 . . 1 . . . . . . . . 4082 1 571 . 1 1 55 55 ARG HB3 H 1 1.52 . . 1 . . . . . . . . 4082 1 572 . 1 1 55 55 ARG HG2 H 1 1.09 . . 1 . . . . . . . . 4082 1 573 . 1 1 55 55 ARG HG3 H 1 1.09 . . 1 . . . . . . . . 4082 1 574 . 1 1 55 55 ARG HD2 H 1 3.08 . . 1 . . . . . . . . 4082 1 575 . 1 1 55 55 ARG HD3 H 1 2.92 . . 1 . . . . . . . . 4082 1 576 . 1 1 55 55 ARG CA C 13 52.5 . . 1 . . . . . . . . 4082 1 577 . 1 1 55 55 ARG CB C 13 28.0 . . 1 . . . . . . . . 4082 1 578 . 1 1 55 55 ARG CD C 13 41.9 . . 1 . . . . . . . . 4082 1 579 . 1 1 55 55 ARG N N 15 127.2 . . 1 . . . . . . . . 4082 1 580 . 1 1 56 56 SER H H 1 8.29 . . 1 . . . . . . . . 4082 1 581 . 1 1 56 56 SER HA H 1 4.53 . . 1 . . . . . . . . 4082 1 582 . 1 1 56 56 SER HB2 H 1 3.84 . . 1 . . . . . . . . 4082 1 583 . 1 1 56 56 SER HB3 H 1 3.84 . . 1 . . . . . . . . 4082 1 584 . 1 1 56 56 SER CA C 13 60.1 . . 1 . . . . . . . . 4082 1 585 . 1 1 56 56 SER CB C 13 64.3 . . 1 . . . . . . . . 4082 1 586 . 1 1 56 56 SER N N 15 114.4 . . 1 . . . . . . . . 4082 1 587 . 1 1 57 57 SER H H 1 8.86 . . 1 . . . . . . . . 4082 1 588 . 1 1 57 57 SER HA H 1 4.31 . . 1 . . . . . . . . 4082 1 589 . 1 1 57 57 SER HB2 H 1 3.92 . . 1 . . . . . . . . 4082 1 590 . 1 1 57 57 SER HB3 H 1 3.82 . . 1 . . . . . . . . 4082 1 591 . 1 1 57 57 SER CA C 13 61.7 . . 1 . . . . . . . . 4082 1 592 . 1 1 57 57 SER CB C 13 64.0 . . 1 . . . . . . . . 4082 1 593 . 1 1 57 57 SER N N 15 122.0 . . 1 . . . . . . . . 4082 1 594 . 1 1 58 58 PHE H H 1 7.86 . . 1 . . . . . . . . 4082 1 595 . 1 1 58 58 PHE HA H 1 3.97 . . 1 . . . . . . . . 4082 1 596 . 1 1 58 58 PHE HB2 H 1 2.95 . . 1 . . . . . . . . 4082 1 597 . 1 1 58 58 PHE HB3 H 1 2.74 . . 1 . . . . . . . . 4082 1 598 . 1 1 58 58 PHE HD1 H 1 6.72 . . 1 . . . . . . . . 4082 1 599 . 1 1 58 58 PHE HD2 H 1 6.72 . . 1 . . . . . . . . 4082 1 600 . 1 1 58 58 PHE HE1 H 1 7.01 . . 1 . . . . . . . . 4082 1 601 . 1 1 58 58 PHE HE2 H 1 7.01 . . 1 . . . . . . . . 4082 1 602 . 1 1 58 58 PHE HZ H 1 7.21 . . 1 . . . . . . . . 4082 1 603 . 1 1 58 58 PHE CA C 13 58.8 . . 1 . . . . . . . . 4082 1 604 . 1 1 58 58 PHE CB C 13 37.7 . . 1 . . . . . . . . 4082 1 605 . 1 1 58 58 PHE CD1 C 13 130.3 . . 1 . . . . . . . . 4082 1 606 . 1 1 58 58 PHE CD2 C 13 130.3 . . 1 . . . . . . . . 4082 1 607 . 1 1 58 58 PHE CE1 C 13 131.4 . . 1 . . . . . . . . 4082 1 608 . 1 1 58 58 PHE CE2 C 13 131.4 . . 1 . . . . . . . . 4082 1 609 . 1 1 58 58 PHE CZ C 13 132.9 . . 1 . . . . . . . . 4082 1 610 . 1 1 58 58 PHE N N 15 118.7 . . 1 . . . . . . . . 4082 1 611 . 1 1 59 59 TYR H H 1 8.05 . . 1 . . . . . . . . 4082 1 612 . 1 1 59 59 TYR HA H 1 4.46 . . 1 . . . . . . . . 4082 1 613 . 1 1 59 59 TYR HB2 H 1 3.26 . . 1 . . . . . . . . 4082 1 614 . 1 1 59 59 TYR HB3 H 1 3.04 . . 1 . . . . . . . . 4082 1 615 . 1 1 59 59 TYR HD1 H 1 7.39 . . 1 . . . . . . . . 4082 1 616 . 1 1 59 59 TYR HD2 H 1 7.39 . . 1 . . . . . . . . 4082 1 617 . 1 1 59 59 TYR HE1 H 1 6.96 . . 1 . . . . . . . . 4082 1 618 . 1 1 59 59 TYR HE2 H 1 6.96 . . 1 . . . . . . . . 4082 1 619 . 1 1 59 59 TYR CA C 13 61.6 . . 1 . . . . . . . . 4082 1 620 . 1 1 59 59 TYR CB C 13 37.7 . . 1 . . . . . . . . 4082 1 621 . 1 1 59 59 TYR CD1 C 13 132.9 . . 1 . . . . . . . . 4082 1 622 . 1 1 59 59 TYR CD2 C 13 132.9 . . 1 . . . . . . . . 4082 1 623 . 1 1 59 59 TYR CE1 C 13 118.5 . . 1 . . . . . . . . 4082 1 624 . 1 1 59 59 TYR CE2 C 13 118.5 . . 1 . . . . . . . . 4082 1 625 . 1 1 59 59 TYR N N 15 121.6 . . 1 . . . . . . . . 4082 1 626 . 1 1 60 60 VAL H H 1 7.58 . . 1 . . . . . . . . 4082 1 627 . 1 1 60 60 VAL HA H 1 4.05 . . 1 . . . . . . . . 4082 1 628 . 1 1 60 60 VAL HB H 1 2.06 . . 1 . . . . . . . . 4082 1 629 . 1 1 60 60 VAL HG11 H 1 0.98 . . 1 . . . . . . . . 4082 1 630 . 1 1 60 60 VAL HG12 H 1 0.98 . . 1 . . . . . . . . 4082 1 631 . 1 1 60 60 VAL HG13 H 1 0.98 . . 1 . . . . . . . . 4082 1 632 . 1 1 60 60 VAL HG21 H 1 0.98 . . 1 . . . . . . . . 4082 1 633 . 1 1 60 60 VAL HG22 H 1 0.98 . . 1 . . . . . . . . 4082 1 634 . 1 1 60 60 VAL HG23 H 1 0.98 . . 1 . . . . . . . . 4082 1 635 . 1 1 60 60 VAL CA C 13 64.0 . . 1 . . . . . . . . 4082 1 636 . 1 1 60 60 VAL CB C 13 33.0 . . 1 . . . . . . . . 4082 1 637 . 1 1 60 60 VAL CG1 C 13 21.5 . . 1 . . . . . . . . 4082 1 638 . 1 1 60 60 VAL CG2 C 13 21.2 . . 1 . . . . . . . . 4082 1 639 . 1 1 60 60 VAL N N 15 118.3 . . 1 . . . . . . . . 4082 1 640 . 1 1 61 61 ASN H H 1 8.19 . . 1 . . . . . . . . 4082 1 641 . 1 1 61 61 ASN HA H 1 4.80 . . 1 . . . . . . . . 4082 1 642 . 1 1 61 61 ASN HB2 H 1 2.85 . . 1 . . . . . . . . 4082 1 643 . 1 1 61 61 ASN HB3 H 1 2.67 . . 1 . . . . . . . . 4082 1 644 . 1 1 61 61 ASN HD21 H 1 7.60 . . 1 . . . . . . . . 4082 1 645 . 1 1 61 61 ASN HD22 H 1 7.07 . . 1 . . . . . . . . 4082 1 646 . 1 1 61 61 ASN CA C 13 53.9 . . 1 . . . . . . . . 4082 1 647 . 1 1 61 61 ASN CB C 13 40.2 . . 1 . . . . . . . . 4082 1 648 . 1 1 61 61 ASN N N 15 115.8 . . 1 . . . . . . . . 4082 1 649 . 1 1 61 61 ASN ND2 N 15 113.9 . . 1 . . . . . . . . 4082 1 650 . 1 1 62 62 GLY H H 1 7.46 . . 1 . . . . . . . . 4082 1 651 . 1 1 62 62 GLY HA2 H 1 4.42 . . 1 . . . . . . . . 4082 1 652 . 1 1 62 62 GLY HA3 H 1 3.97 . . 1 . . . . . . . . 4082 1 653 . 1 1 62 62 GLY CA C 13 45.4 . . 1 . . . . . . . . 4082 1 654 . 1 1 62 62 GLY N N 15 108.8 . . 1 . . . . . . . . 4082 1 655 . 1 1 63 63 LEU H H 1 8.07 . . 1 . . . . . . . . 4082 1 656 . 1 1 63 63 LEU HA H 1 4.66 . . 1 . . . . . . . . 4082 1 657 . 1 1 63 63 LEU HB2 H 1 1.66 . . 1 . . . . . . . . 4082 1 658 . 1 1 63 63 LEU HB3 H 1 1.66 . . 1 . . . . . . . . 4082 1 659 . 1 1 63 63 LEU HG H 1 1.04 . . 1 . . . . . . . . 4082 1 660 . 1 1 63 63 LEU HD11 H 1 0.33 . . 1 . . . . . . . . 4082 1 661 . 1 1 63 63 LEU HD12 H 1 0.33 . . 1 . . . . . . . . 4082 1 662 . 1 1 63 63 LEU HD13 H 1 0.33 . . 1 . . . . . . . . 4082 1 663 . 1 1 63 63 LEU HD21 H 1 0.10 . . 1 . . . . . . . . 4082 1 664 . 1 1 63 63 LEU HD22 H 1 0.10 . . 1 . . . . . . . . 4082 1 665 . 1 1 63 63 LEU HD23 H 1 0.10 . . 1 . . . . . . . . 4082 1 666 . 1 1 63 63 LEU CA C 13 54.3 . . 1 . . . . . . . . 4082 1 667 . 1 1 63 63 LEU CB C 13 42.9 . . 1 . . . . . . . . 4082 1 668 . 1 1 63 63 LEU CG C 13 25.9 . . 1 . . . . . . . . 4082 1 669 . 1 1 63 63 LEU CD1 C 13 24.2 . . 1 . . . . . . . . 4082 1 670 . 1 1 63 63 LEU CD2 C 13 27.1 . . 1 . . . . . . . . 4082 1 671 . 1 1 63 63 LEU N N 15 115.1 . . 1 . . . . . . . . 4082 1 672 . 1 1 64 64 THR H H 1 8.30 . . 1 . . . . . . . . 4082 1 673 . 1 1 64 64 THR HA H 1 5.30 . . 1 . . . . . . . . 4082 1 674 . 1 1 64 64 THR HB H 1 3.50 . . 1 . . . . . . . . 4082 1 675 . 1 1 64 64 THR HG21 H 1 0.91 . . 1 . . . . . . . . 4082 1 676 . 1 1 64 64 THR HG22 H 1 0.91 . . 1 . . . . . . . . 4082 1 677 . 1 1 64 64 THR HG23 H 1 0.91 . . 1 . . . . . . . . 4082 1 678 . 1 1 64 64 THR CA C 13 59.9 . . 1 . . . . . . . . 4082 1 679 . 1 1 64 64 THR CB C 13 72.0 . . 1 . . . . . . . . 4082 1 680 . 1 1 64 64 THR CG2 C 13 21.5 . . 1 . . . . . . . . 4082 1 681 . 1 1 64 64 THR N N 15 111.1 . . 1 . . . . . . . . 4082 1 682 . 1 1 65 65 LEU H H 1 7.92 . . 1 . . . . . . . . 4082 1 683 . 1 1 65 65 LEU HA H 1 4.29 . . 1 . . . . . . . . 4082 1 684 . 1 1 65 65 LEU HB2 H 1 1.64 . . 1 . . . . . . . . 4082 1 685 . 1 1 65 65 LEU HB3 H 1 0.88 . . 1 . . . . . . . . 4082 1 686 . 1 1 65 65 LEU HG H 1 1.30 . . 1 . . . . . . . . 4082 1 687 . 1 1 65 65 LEU HD11 H 1 0.63 . . 1 . . . . . . . . 4082 1 688 . 1 1 65 65 LEU HD12 H 1 0.63 . . 1 . . . . . . . . 4082 1 689 . 1 1 65 65 LEU HD13 H 1 0.63 . . 1 . . . . . . . . 4082 1 690 . 1 1 65 65 LEU HD21 H 1 0.63 . . 1 . . . . . . . . 4082 1 691 . 1 1 65 65 LEU HD22 H 1 0.63 . . 1 . . . . . . . . 4082 1 692 . 1 1 65 65 LEU HD23 H 1 0.63 . . 1 . . . . . . . . 4082 1 693 . 1 1 65 65 LEU CA C 13 53.3 . . 1 . . . . . . . . 4082 1 694 . 1 1 65 65 LEU CB C 13 45.3 . . 1 . . . . . . . . 4082 1 695 . 1 1 65 65 LEU CG C 13 26.0 . . 1 . . . . . . . . 4082 1 696 . 1 1 65 65 LEU CD1 C 13 24.3 . . 1 . . . . . . . . 4082 1 697 . 1 1 65 65 LEU CD2 C 13 27.1 . . 1 . . . . . . . . 4082 1 698 . 1 1 65 65 LEU N N 15 119.7 . . 1 . . . . . . . . 4082 1 699 . 1 1 66 66 GLY H H 1 10.98 . . 1 . . . . . . . . 4082 1 700 . 1 1 66 66 GLY HA2 H 1 3.87 . . 1 . . . . . . . . 4082 1 701 . 1 1 66 66 GLY HA3 H 1 3.40 . . 1 . . . . . . . . 4082 1 702 . 1 1 66 66 GLY CA C 13 46.5 . . 1 . . . . . . . . 4082 1 703 . 1 1 66 66 GLY N N 15 118.5 . . 1 . . . . . . . . 4082 1 704 . 1 1 67 67 GLY H H 1 9.45 . . 1 . . . . . . . . 4082 1 705 . 1 1 67 67 GLY HA2 H 1 4.25 . . 1 . . . . . . . . 4082 1 706 . 1 1 67 67 GLY HA3 H 1 3.36 . . 1 . . . . . . . . 4082 1 707 . 1 1 67 67 GLY CA C 13 44.8 . . 1 . . . . . . . . 4082 1 708 . 1 1 67 67 GLY N N 15 106.3 . . 1 . . . . . . . . 4082 1 709 . 1 1 68 68 GLN H H 1 7.72 . . 1 . . . . . . . . 4082 1 710 . 1 1 68 68 GLN HA H 1 4.36 . . 1 . . . . . . . . 4082 1 711 . 1 1 68 68 GLN HB2 H 1 2.40 . . 1 . . . . . . . . 4082 1 712 . 1 1 68 68 GLN HB3 H 1 2.10 . . 1 . . . . . . . . 4082 1 713 . 1 1 68 68 GLN HG2 H 1 2.14 . . 1 . . . . . . . . 4082 1 714 . 1 1 68 68 GLN HG3 H 1 2.14 . . 1 . . . . . . . . 4082 1 715 . 1 1 68 68 GLN HE21 H 1 8.11 . . 1 . . . . . . . . 4082 1 716 . 1 1 68 68 GLN HE22 H 1 7.02 . . 1 . . . . . . . . 4082 1 717 . 1 1 68 68 GLN CA C 13 54.0 . . 1 . . . . . . . . 4082 1 718 . 1 1 68 68 GLN CB C 13 29.3 . . 1 . . . . . . . . 4082 1 719 . 1 1 68 68 GLN CG C 13 37.0 . . 1 . . . . . . . . 4082 1 720 . 1 1 68 68 GLN N N 15 122.2 . . 1 . . . . . . . . 4082 1 721 . 1 1 68 68 GLN NE2 N 15 117.0 . . 1 . . . . . . . . 4082 1 722 . 1 1 69 69 LYS H H 1 9.25 . . 1 . . . . . . . . 4082 1 723 . 1 1 69 69 LYS HA H 1 4.30 . . 1 . . . . . . . . 4082 1 724 . 1 1 69 69 LYS HB2 H 1 1.03 . . 1 . . . . . . . . 4082 1 725 . 1 1 69 69 LYS HB3 H 1 1.03 . . 1 . . . . . . . . 4082 1 726 . 1 1 69 69 LYS HG2 H 1 1.53 . . 1 . . . . . . . . 4082 1 727 . 1 1 69 69 LYS HG3 H 1 1.37 . . 1 . . . . . . . . 4082 1 728 . 1 1 69 69 LYS HD2 H 1 1.81 . . 1 . . . . . . . . 4082 1 729 . 1 1 69 69 LYS HD3 H 1 1.62 . . 1 . . . . . . . . 4082 1 730 . 1 1 69 69 LYS HE2 H 1 2.91 . . 1 . . . . . . . . 4082 1 731 . 1 1 69 69 LYS HE3 H 1 2.91 . . 1 . . . . . . . . 4082 1 732 . 1 1 69 69 LYS CA C 13 58.2 . . 1 . . . . . . . . 4082 1 733 . 1 1 69 69 LYS CB C 13 32.5 . . 1 . . . . . . . . 4082 1 734 . 1 1 69 69 LYS CG C 13 25.6 . . 1 . . . . . . . . 4082 1 735 . 1 1 69 69 LYS CD C 13 29.1 . . 1 . . . . . . . . 4082 1 736 . 1 1 69 69 LYS CE C 13 41.7 . . 1 . . . . . . . . 4082 1 737 . 1 1 69 69 LYS N N 15 131.3 . . 1 . . . . . . . . 4082 1 738 . 1 1 70 70 CYS H H 1 9.16 . . 1 . . . . . . . . 4082 1 739 . 1 1 70 70 CYS HA H 1 5.18 . . 1 . . . . . . . . 4082 1 740 . 1 1 70 70 CYS HB2 H 1 2.57 . . 1 . . . . . . . . 4082 1 741 . 1 1 70 70 CYS HB3 H 1 2.43 . . 1 . . . . . . . . 4082 1 742 . 1 1 70 70 CYS CA C 13 58.2 . . 1 . . . . . . . . 4082 1 743 . 1 1 70 70 CYS CB C 13 33.3 . . 1 . . . . . . . . 4082 1 744 . 1 1 70 70 CYS N N 15 121.4 . . 1 . . . . . . . . 4082 1 745 . 1 1 71 71 SER H H 1 9.51 . . 1 . . . . . . . . 4082 1 746 . 1 1 71 71 SER HA H 1 4.86 . . 1 . . . . . . . . 4082 1 747 . 1 1 71 71 SER HB2 H 1 3.75 . . 1 . . . . . . . . 4082 1 748 . 1 1 71 71 SER HB3 H 1 3.63 . . 1 . . . . . . . . 4082 1 749 . 1 1 71 71 SER CA C 13 57.1 . . 1 . . . . . . . . 4082 1 750 . 1 1 71 71 SER CB C 13 65.0 . . 1 . . . . . . . . 4082 1 751 . 1 1 71 71 SER N N 15 118.5 . . 1 . . . . . . . . 4082 1 752 . 1 1 72 72 VAL H H 1 9.09 . . 1 . . . . . . . . 4082 1 753 . 1 1 72 72 VAL HA H 1 3.76 . . 1 . . . . . . . . 4082 1 754 . 1 1 72 72 VAL HB H 1 1.58 . . 1 . . . . . . . . 4082 1 755 . 1 1 72 72 VAL HG11 H 1 0.44 . . 1 . . . . . . . . 4082 1 756 . 1 1 72 72 VAL HG12 H 1 0.44 . . 1 . . . . . . . . 4082 1 757 . 1 1 72 72 VAL HG13 H 1 0.44 . . 1 . . . . . . . . 4082 1 758 . 1 1 72 72 VAL HG21 H 1 0.28 . . 1 . . . . . . . . 4082 1 759 . 1 1 72 72 VAL HG22 H 1 0.28 . . 1 . . . . . . . . 4082 1 760 . 1 1 72 72 VAL HG23 H 1 0.28 . . 1 . . . . . . . . 4082 1 761 . 1 1 72 72 VAL CA C 13 63.5 . . 1 . . . . . . . . 4082 1 762 . 1 1 72 72 VAL CB C 13 32.1 . . 1 . . . . . . . . 4082 1 763 . 1 1 72 72 VAL CG1 C 13 21.5 . . 1 . . . . . . . . 4082 1 764 . 1 1 72 72 VAL CG2 C 13 21.4 . . 1 . . . . . . . . 4082 1 765 . 1 1 72 72 VAL N N 15 125.3 . . 1 . . . . . . . . 4082 1 766 . 1 1 73 73 ILE H H 1 8.85 . . 1 . . . . . . . . 4082 1 767 . 1 1 73 73 ILE HA H 1 4.12 . . 1 . . . . . . . . 4082 1 768 . 1 1 73 73 ILE HB H 1 1.58 . . 1 . . . . . . . . 4082 1 769 . 1 1 73 73 ILE HG12 H 1 1.32 . . 1 . . . . . . . . 4082 1 770 . 1 1 73 73 ILE HG13 H 1 1.11 . . 1 . . . . . . . . 4082 1 771 . 1 1 73 73 ILE HG21 H 1 0.91 . . 1 . . . . . . . . 4082 1 772 . 1 1 73 73 ILE HG22 H 1 0.91 . . 1 . . . . . . . . 4082 1 773 . 1 1 73 73 ILE HG23 H 1 0.91 . . 1 . . . . . . . . 4082 1 774 . 1 1 73 73 ILE HD11 H 1 0.65 . . 1 . . . . . . . . 4082 1 775 . 1 1 73 73 ILE HD12 H 1 0.65 . . 1 . . . . . . . . 4082 1 776 . 1 1 73 73 ILE HD13 H 1 0.65 . . 1 . . . . . . . . 4082 1 777 . 1 1 73 73 ILE CA C 13 61.8 . . 1 . . . . . . . . 4082 1 778 . 1 1 73 73 ILE CB C 13 38.0 . . 1 . . . . . . . . 4082 1 779 . 1 1 73 73 ILE CG1 C 13 27.8 . . 1 . . . . . . . . 4082 1 780 . 1 1 73 73 ILE CG2 C 13 17.5 . . 1 . . . . . . . . 4082 1 781 . 1 1 73 73 ILE CD1 C 13 11.8 . . 1 . . . . . . . . 4082 1 782 . 1 1 73 73 ILE N N 15 129.1 . . 1 . . . . . . . . 4082 1 783 . 1 1 74 74 ARG H H 1 7.85 . . 1 . . . . . . . . 4082 1 784 . 1 1 74 74 ARG HA H 1 4.65 . . 1 . . . . . . . . 4082 1 785 . 1 1 74 74 ARG HB2 H 1 1.82 . . 1 . . . . . . . . 4082 1 786 . 1 1 74 74 ARG HB3 H 1 1.82 . . 1 . . . . . . . . 4082 1 787 . 1 1 74 74 ARG HG2 H 1 1.58 . . 1 . . . . . . . . 4082 1 788 . 1 1 74 74 ARG HG3 H 1 1.43 . . 1 . . . . . . . . 4082 1 789 . 1 1 74 74 ARG HD2 H 1 3.21 . . 1 . . . . . . . . 4082 1 790 . 1 1 74 74 ARG HD3 H 1 3.08 . . 1 . . . . . . . . 4082 1 791 . 1 1 74 74 ARG CA C 13 56.2 . . 1 . . . . . . . . 4082 1 792 . 1 1 74 74 ARG CB C 13 33.8 . . 1 . . . . . . . . 4082 1 793 . 1 1 74 74 ARG CG C 13 26.9 . . 1 . . . . . . . . 4082 1 794 . 1 1 74 74 ARG CD C 13 42.9 . . 1 . . . . . . . . 4082 1 795 . 1 1 74 74 ARG N N 15 118.7 . . 1 . . . . . . . . 4082 1 796 . 1 1 75 75 ASP H H 1 9.03 . . 1 . . . . . . . . 4082 1 797 . 1 1 75 75 ASP HA H 1 5.03 . . 1 . . . . . . . . 4082 1 798 . 1 1 75 75 ASP HB2 H 1 3.06 . . 1 . . . . . . . . 4082 1 799 . 1 1 75 75 ASP HB3 H 1 2.34 . . 1 . . . . . . . . 4082 1 800 . 1 1 75 75 ASP CA C 13 53.7 . . 1 . . . . . . . . 4082 1 801 . 1 1 75 75 ASP CB C 13 42.8 . . 1 . . . . . . . . 4082 1 802 . 1 1 75 75 ASP N N 15 125.3 . . 1 . . . . . . . . 4082 1 803 . 1 1 76 76 SER H H 1 8.21 . . 1 . . . . . . . . 4082 1 804 . 1 1 76 76 SER HA H 1 4.92 . . 1 . . . . . . . . 4082 1 805 . 1 1 76 76 SER HB2 H 1 4.07 . . 1 . . . . . . . . 4082 1 806 . 1 1 76 76 SER HB3 H 1 3.83 . . 1 . . . . . . . . 4082 1 807 . 1 1 76 76 SER CA C 13 56.5 . . 1 . . . . . . . . 4082 1 808 . 1 1 76 76 SER CB C 13 64.3 . . 1 . . . . . . . . 4082 1 809 . 1 1 76 76 SER N N 15 124.4 . . 1 . . . . . . . . 4082 1 810 . 1 1 77 77 LEU H H 1 7.91 . . 1 . . . . . . . . 4082 1 811 . 1 1 77 77 LEU HA H 1 3.67 . . 1 . . . . . . . . 4082 1 812 . 1 1 77 77 LEU HB2 H 1 1.64 . . 1 . . . . . . . . 4082 1 813 . 1 1 77 77 LEU HB3 H 1 1.33 . . 1 . . . . . . . . 4082 1 814 . 1 1 77 77 LEU HG H 1 1.53 . . 1 . . . . . . . . 4082 1 815 . 1 1 77 77 LEU HD11 H 1 0.63 . . 1 . . . . . . . . 4082 1 816 . 1 1 77 77 LEU HD12 H 1 0.63 . . 1 . . . . . . . . 4082 1 817 . 1 1 77 77 LEU HD13 H 1 0.63 . . 1 . . . . . . . . 4082 1 818 . 1 1 77 77 LEU HD21 H 1 0.63 . . 1 . . . . . . . . 4082 1 819 . 1 1 77 77 LEU HD22 H 1 0.63 . . 1 . . . . . . . . 4082 1 820 . 1 1 77 77 LEU HD23 H 1 0.63 . . 1 . . . . . . . . 4082 1 821 . 1 1 77 77 LEU CA C 13 57.8 . . 1 . . . . . . . . 4082 1 822 . 1 1 77 77 LEU CB C 13 43.8 . . 1 . . . . . . . . 4082 1 823 . 1 1 77 77 LEU CG C 13 27.0 . . 1 . . . . . . . . 4082 1 824 . 1 1 77 77 LEU CD1 C 13 24.9 . . 1 . . . . . . . . 4082 1 825 . 1 1 77 77 LEU CD2 C 13 26.5 . . 1 . . . . . . . . 4082 1 826 . 1 1 77 77 LEU N N 15 124.8 . . 1 . . . . . . . . 4082 1 827 . 1 1 78 78 LEU H H 1 7.59 . . 1 . . . . . . . . 4082 1 828 . 1 1 78 78 LEU HA H 1 4.48 . . 1 . . . . . . . . 4082 1 829 . 1 1 78 78 LEU HB2 H 1 1.76 . . 1 . . . . . . . . 4082 1 830 . 1 1 78 78 LEU HB3 H 1 1.64 . . 1 . . . . . . . . 4082 1 831 . 1 1 78 78 LEU HG H 1 1.56 . . 1 . . . . . . . . 4082 1 832 . 1 1 78 78 LEU HD11 H 1 0.82 . . 1 . . . . . . . . 4082 1 833 . 1 1 78 78 LEU HD12 H 1 0.82 . . 1 . . . . . . . . 4082 1 834 . 1 1 78 78 LEU HD13 H 1 0.82 . . 1 . . . . . . . . 4082 1 835 . 1 1 78 78 LEU HD21 H 1 0.66 . . 1 . . . . . . . . 4082 1 836 . 1 1 78 78 LEU HD22 H 1 0.66 . . 1 . . . . . . . . 4082 1 837 . 1 1 78 78 LEU HD23 H 1 0.66 . . 1 . . . . . . . . 4082 1 838 . 1 1 78 78 LEU CA C 13 52.9 . . 1 . . . . . . . . 4082 1 839 . 1 1 78 78 LEU CB C 13 40.7 . . 1 . . . . . . . . 4082 1 840 . 1 1 78 78 LEU CG C 13 29.5 . . 1 . . . . . . . . 4082 1 841 . 1 1 78 78 LEU CD1 C 13 25.9 . . 1 . . . . . . . . 4082 1 842 . 1 1 78 78 LEU CD2 C 13 22.0 . . 1 . . . . . . . . 4082 1 843 . 1 1 78 78 LEU N N 15 123.5 . . 1 . . . . . . . . 4082 1 844 . 1 1 79 79 GLN H H 1 7.34 . . 1 . . . . . . . . 4082 1 845 . 1 1 79 79 GLN HA H 1 4.23 . . 1 . . . . . . . . 4082 1 846 . 1 1 79 79 GLN HB2 H 1 2.07 . . 1 . . . . . . . . 4082 1 847 . 1 1 79 79 GLN HB3 H 1 1.98 . . 1 . . . . . . . . 4082 1 848 . 1 1 79 79 GLN HG2 H 1 2.26 . . 1 . . . . . . . . 4082 1 849 . 1 1 79 79 GLN HG3 H 1 2.26 . . 1 . . . . . . . . 4082 1 850 . 1 1 79 79 GLN HE21 H 1 7.58 . . 1 . . . . . . . . 4082 1 851 . 1 1 79 79 GLN HE22 H 1 6.86 . . 1 . . . . . . . . 4082 1 852 . 1 1 79 79 GLN CA C 13 55.9 . . 1 . . . . . . . . 4082 1 853 . 1 1 79 79 GLN CB C 13 30.1 . . 1 . . . . . . . . 4082 1 854 . 1 1 79 79 GLN CG C 13 33.9 . . 1 . . . . . . . . 4082 1 855 . 1 1 79 79 GLN N N 15 122.0 . . 1 . . . . . . . . 4082 1 856 . 1 1 79 79 GLN NE2 N 15 113.3 . . 1 . . . . . . . . 4082 1 857 . 1 1 80 80 ASP H H 1 8.63 . . 1 . . . . . . . . 4082 1 858 . 1 1 80 80 ASP HA H 1 3.87 . . 1 . . . . . . . . 4082 1 859 . 1 1 80 80 ASP HB2 H 1 2.52 . . 1 . . . . . . . . 4082 1 860 . 1 1 80 80 ASP HB3 H 1 2.52 . . 1 . . . . . . . . 4082 1 861 . 1 1 80 80 ASP CA C 13 55.9 . . 1 . . . . . . . . 4082 1 862 . 1 1 80 80 ASP CB C 13 41.0 . . 1 . . . . . . . . 4082 1 863 . 1 1 80 80 ASP N N 15 128.2 . . 1 . . . . . . . . 4082 1 864 . 1 1 81 81 GLY H H 1 6.88 . . 1 . . . . . . . . 4082 1 865 . 1 1 81 81 GLY HA2 H 1 4.12 . . 1 . . . . . . . . 4082 1 866 . 1 1 81 81 GLY HA3 H 1 3.62 . . 1 . . . . . . . . 4082 1 867 . 1 1 81 81 GLY CA C 13 45.3 . . 1 . . . . . . . . 4082 1 868 . 1 1 82 82 GLU H H 1 7.36 . . 1 . . . . . . . . 4082 1 869 . 1 1 82 82 GLU HA H 1 4.42 . . 1 . . . . . . . . 4082 1 870 . 1 1 82 82 GLU HB2 H 1 2.07 . . 1 . . . . . . . . 4082 1 871 . 1 1 82 82 GLU HB3 H 1 1.82 . . 1 . . . . . . . . 4082 1 872 . 1 1 82 82 GLU HG2 H 1 2.10 . . 1 . . . . . . . . 4082 1 873 . 1 1 82 82 GLU HG3 H 1 2.10 . . 1 . . . . . . . . 4082 1 874 . 1 1 82 82 GLU CA C 13 58.0 . . 1 . . . . . . . . 4082 1 875 . 1 1 82 82 GLU CB C 13 32.1 . . 1 . . . . . . . . 4082 1 876 . 1 1 82 82 GLU CG C 13 36.5 . . 1 . . . . . . . . 4082 1 877 . 1 1 82 82 GLU N N 15 121.6 . . 1 . . . . . . . . 4082 1 878 . 1 1 83 83 PHE H H 1 8.02 . . 1 . . . . . . . . 4082 1 879 . 1 1 83 83 PHE HA H 1 4.88 . . 1 . . . . . . . . 4082 1 880 . 1 1 83 83 PHE HB2 H 1 3.60 . . 1 . . . . . . . . 4082 1 881 . 1 1 83 83 PHE HB3 H 1 3.38 . . 1 . . . . . . . . 4082 1 882 . 1 1 83 83 PHE HD1 H 1 7.33 . . 1 . . . . . . . . 4082 1 883 . 1 1 83 83 PHE HD2 H 1 7.33 . . 1 . . . . . . . . 4082 1 884 . 1 1 83 83 PHE HE1 H 1 7.02 . . 1 . . . . . . . . 4082 1 885 . 1 1 83 83 PHE HE2 H 1 7.02 . . 1 . . . . . . . . 4082 1 886 . 1 1 83 83 PHE CA C 13 57.5 . . 1 . . . . . . . . 4082 1 887 . 1 1 83 83 PHE CB C 13 37.7 . . 1 . . . . . . . . 4082 1 888 . 1 1 83 83 PHE N N 15 114.0 . . 1 . . . . . . . . 4082 1 889 . 1 1 84 84 SER H H 1 7.04 . . 1 . . . . . . . . 4082 1 890 . 1 1 84 84 SER HA H 1 5.78 . . 1 . . . . . . . . 4082 1 891 . 1 1 84 84 SER HB2 H 1 3.73 . . 1 . . . . . . . . 4082 1 892 . 1 1 84 84 SER HB3 H 1 3.66 . . 1 . . . . . . . . 4082 1 893 . 1 1 84 84 SER CA C 13 57.3 . . 1 . . . . . . . . 4082 1 894 . 1 1 84 84 SER CB C 13 68.2 . . 1 . . . . . . . . 4082 1 895 . 1 1 84 84 SER N N 15 110.8 . . 1 . . . . . . . . 4082 1 896 . 1 1 85 85 MET H H 1 9.37 . . 1 . . . . . . . . 4082 1 897 . 1 1 85 85 MET HA H 1 5.01 . . 1 . . . . . . . . 4082 1 898 . 1 1 85 85 MET HB2 H 1 2.21 . . 1 . . . . . . . . 4082 1 899 . 1 1 85 85 MET HB3 H 1 1.89 . . 1 . . . . . . . . 4082 1 900 . 1 1 85 85 MET HG2 H 1 2.46 . . 1 . . . . . . . . 4082 1 901 . 1 1 85 85 MET HG3 H 1 2.26 . . 1 . . . . . . . . 4082 1 902 . 1 1 85 85 MET HE1 H 1 1.51 . . 1 . . . . . . . . 4082 1 903 . 1 1 85 85 MET HE2 H 1 1.51 . . 1 . . . . . . . . 4082 1 904 . 1 1 85 85 MET HE3 H 1 1.51 . . 1 . . . . . . . . 4082 1 905 . 1 1 85 85 MET CA C 13 54.8 . . 1 . . . . . . . . 4082 1 906 . 1 1 85 85 MET CB C 13 39.6 . . 1 . . . . . . . . 4082 1 907 . 1 1 85 85 MET CG C 13 32.3 . . 1 . . . . . . . . 4082 1 908 . 1 1 85 85 MET CE C 13 37.4 . . 1 . . . . . . . . 4082 1 909 . 1 1 85 85 MET N N 15 122.3 . . 1 . . . . . . . . 4082 1 910 . 1 1 86 86 ASP H H 1 8.89 . . 1 . . . . . . . . 4082 1 911 . 1 1 86 86 ASP HA H 1 5.80 . . 1 . . . . . . . . 4082 1 912 . 1 1 86 86 ASP HB2 H 1 3.16 . . 1 . . . . . . . . 4082 1 913 . 1 1 86 86 ASP HB3 H 1 2.41 . . 1 . . . . . . . . 4082 1 914 . 1 1 86 86 ASP CA C 13 53.1 . . 1 . . . . . . . . 4082 1 915 . 1 1 86 86 ASP CB C 13 42.3 . . 1 . . . . . . . . 4082 1 916 . 1 1 86 86 ASP N N 15 125.6 . . 1 . . . . . . . . 4082 1 917 . 1 1 87 87 LEU H H 1 9.90 . . 1 . . . . . . . . 4082 1 918 . 1 1 87 87 LEU HA H 1 5.34 . . 1 . . . . . . . . 4082 1 919 . 1 1 87 87 LEU HB2 H 1 1.75 . . 1 . . . . . . . . 4082 1 920 . 1 1 87 87 LEU HB3 H 1 1.35 . . 1 . . . . . . . . 4082 1 921 . 1 1 87 87 LEU HG H 1 1.44 . . 1 . . . . . . . . 4082 1 922 . 1 1 87 87 LEU HD11 H 1 0.66 . . 1 . . . . . . . . 4082 1 923 . 1 1 87 87 LEU HD12 H 1 0.66 . . 1 . . . . . . . . 4082 1 924 . 1 1 87 87 LEU HD13 H 1 0.66 . . 1 . . . . . . . . 4082 1 925 . 1 1 87 87 LEU HD21 H 1 0.66 . . 1 . . . . . . . . 4082 1 926 . 1 1 87 87 LEU HD22 H 1 0.66 . . 1 . . . . . . . . 4082 1 927 . 1 1 87 87 LEU HD23 H 1 0.66 . . 1 . . . . . . . . 4082 1 928 . 1 1 87 87 LEU CA C 13 54.3 . . 1 . . . . . . . . 4082 1 929 . 1 1 87 87 LEU CB C 13 47.1 . . 1 . . . . . . . . 4082 1 930 . 1 1 87 87 LEU CG C 13 28.1 . . 1 . . . . . . . . 4082 1 931 . 1 1 87 87 LEU CD1 C 13 28.1 . . 1 . . . . . . . . 4082 1 932 . 1 1 87 87 LEU CD2 C 13 28.1 . . 1 . . . . . . . . 4082 1 933 . 1 1 87 87 LEU N N 15 123.2 . . 1 . . . . . . . . 4082 1 934 . 1 1 88 88 ARG H H 1 8.69 . . 1 . . . . . . . . 4082 1 935 . 1 1 88 88 ARG HA H 1 5.43 . . 1 . . . . . . . . 4082 1 936 . 1 1 88 88 ARG HB2 H 1 1.76 . . 1 . . . . . . . . 4082 1 937 . 1 1 88 88 ARG HB3 H 1 1.68 . . 1 . . . . . . . . 4082 1 938 . 1 1 88 88 ARG HG2 H 1 1.85 . . 1 . . . . . . . . 4082 1 939 . 1 1 88 88 ARG HG3 H 1 1.52 . . 1 . . . . . . . . 4082 1 940 . 1 1 88 88 ARG HD2 H 1 3.12 . . 1 . . . . . . . . 4082 1 941 . 1 1 88 88 ARG HD3 H 1 3.12 . . 1 . . . . . . . . 4082 1 942 . 1 1 88 88 ARG CA C 13 54.8 . . 1 . . . . . . . . 4082 1 943 . 1 1 88 88 ARG CB C 13 34.3 . . 1 . . . . . . . . 4082 1 944 . 1 1 88 88 ARG CG C 13 27.4 . . 1 . . . . . . . . 4082 1 945 . 1 1 88 88 ARG CD C 13 43.7 . . 1 . . . . . . . . 4082 1 946 . 1 1 88 88 ARG N N 15 121.4 . . 1 . . . . . . . . 4082 1 947 . 1 1 89 89 THR H H 1 9.19 . . 1 . . . . . . . . 4082 1 948 . 1 1 89 89 THR HA H 1 4.69 . . 1 . . . . . . . . 4082 1 949 . 1 1 89 89 THR HB H 1 4.50 . . 1 . . . . . . . . 4082 1 950 . 1 1 89 89 THR HG21 H 1 1.43 . . 1 . . . . . . . . 4082 1 951 . 1 1 89 89 THR HG22 H 1 1.43 . . 1 . . . . . . . . 4082 1 952 . 1 1 89 89 THR HG23 H 1 1.43 . . 1 . . . . . . . . 4082 1 953 . 1 1 89 89 THR CA C 13 63.4 . . 1 . . . . . . . . 4082 1 954 . 1 1 89 89 THR CB C 13 69.7 . . 1 . . . . . . . . 4082 1 955 . 1 1 89 89 THR CG2 C 13 23.4 . . 1 . . . . . . . . 4082 1 956 . 1 1 89 89 THR N N 15 117.2 . . 1 . . . . . . . . 4082 1 957 . 1 1 90 90 LYS H H 1 8.08 . . 1 . . . . . . . . 4082 1 958 . 1 1 90 90 LYS HA H 1 4.50 . . 1 . . . . . . . . 4082 1 959 . 1 1 90 90 LYS HB2 H 1 1.70 . . 1 . . . . . . . . 4082 1 960 . 1 1 90 90 LYS HB3 H 1 1.43 . . 1 . . . . . . . . 4082 1 961 . 1 1 90 90 LYS HG2 H 1 1.29 . . 1 . . . . . . . . 4082 1 962 . 1 1 90 90 LYS HG3 H 1 1.29 . . 1 . . . . . . . . 4082 1 963 . 1 1 90 90 LYS HD2 H 1 1.56 . . 1 . . . . . . . . 4082 1 964 . 1 1 90 90 LYS HD3 H 1 1.56 . . 1 . . . . . . . . 4082 1 965 . 1 1 90 90 LYS HE2 H 1 2.80 . . 1 . . . . . . . . 4082 1 966 . 1 1 90 90 LYS HE3 H 1 2.80 . . 1 . . . . . . . . 4082 1 967 . 1 1 90 90 LYS CA C 13 55.5 . . 1 . . . . . . . . 4082 1 968 . 1 1 90 90 LYS CB C 13 34.0 . . 1 . . . . . . . . 4082 1 969 . 1 1 90 90 LYS CG C 13 25.6 . . 1 . . . . . . . . 4082 1 970 . 1 1 90 90 LYS CD C 13 29.5 . . 1 . . . . . . . . 4082 1 971 . 1 1 90 90 LYS CE C 13 42.1 . . 1 . . . . . . . . 4082 1 972 . 1 1 90 90 LYS N N 15 120.4 . . 1 . . . . . . . . 4082 1 973 . 1 1 91 91 SER H H 1 8.44 . . 1 . . . . . . . . 4082 1 974 . 1 1 91 91 SER HA H 1 4.63 . . 1 . . . . . . . . 4082 1 975 . 1 1 91 91 SER HB2 H 1 3.72 . . 1 . . . . . . . . 4082 1 976 . 1 1 91 91 SER HB3 H 1 3.53 . . 1 . . . . . . . . 4082 1 977 . 1 1 91 91 SER CA C 13 56.7 . . 1 . . . . . . . . 4082 1 978 . 1 1 91 91 SER CB C 13 65.4 . . 1 . . . . . . . . 4082 1 979 . 1 1 91 91 SER N N 15 120.1 . . 1 . . . . . . . . 4082 1 980 . 1 1 92 92 THR H H 1 8.28 . . 1 . . . . . . . . 4082 1 981 . 1 1 92 92 THR HA H 1 4.59 . . 1 . . . . . . . . 4082 1 982 . 1 1 92 92 THR HB H 1 4.16 . . 1 . . . . . . . . 4082 1 983 . 1 1 92 92 THR HG21 H 1 1.16 . . 1 . . . . . . . . 4082 1 984 . 1 1 92 92 THR HG22 H 1 1.16 . . 1 . . . . . . . . 4082 1 985 . 1 1 92 92 THR HG23 H 1 1.16 . . 1 . . . . . . . . 4082 1 986 . 1 1 92 92 THR CA C 13 61.5 . . 1 . . . . . . . . 4082 1 987 . 1 1 92 92 THR CB C 13 70.6 . . 1 . . . . . . . . 4082 1 988 . 1 1 92 92 THR CG2 C 13 21.6 . . 1 . . . . . . . . 4082 1 989 . 1 1 92 92 THR N N 15 115.8 . . 1 . . . . . . . . 4082 1 990 . 1 1 93 93 GLY H H 1 8.88 . . 1 . . . . . . . . 4082 1 991 . 1 1 93 93 GLY HA2 H 1 3.87 . . 1 . . . . . . . . 4082 1 992 . 1 1 93 93 GLY HA3 H 1 3.87 . . 1 . . . . . . . . 4082 1 993 . 1 1 93 93 GLY CA C 13 46.6 . . 1 . . . . . . . . 4082 1 994 . 1 1 93 93 GLY N N 15 112.2 . . 1 . . . . . . . . 4082 1 995 . 1 1 94 94 GLY H H 1 8.68 . . 1 . . . . . . . . 4082 1 996 . 1 1 94 94 GLY HA2 H 1 3.95 . . 1 . . . . . . . . 4082 1 997 . 1 1 94 94 GLY HA3 H 1 3.67 . . 1 . . . . . . . . 4082 1 998 . 1 1 94 94 GLY CA C 13 45.3 . . 1 . . . . . . . . 4082 1 999 . 1 1 94 94 GLY N N 15 109.9 . . 1 . . . . . . . . 4082 1 1000 . 1 1 95 95 ALA H H 1 7.18 . . 1 . . . . . . . . 4082 1 1001 . 1 1 95 95 ALA HA H 1 4.49 . . 1 . . . . . . . . 4082 1 1002 . 1 1 95 95 ALA HB1 H 1 1.49 . . 1 . . . . . . . . 4082 1 1003 . 1 1 95 95 ALA HB2 H 1 1.49 . . 1 . . . . . . . . 4082 1 1004 . 1 1 95 95 ALA HB3 H 1 1.49 . . 1 . . . . . . . . 4082 1 1005 . 1 1 95 95 ALA CA C 13 51.0 . . 1 . . . . . . . . 4082 1 1006 . 1 1 95 95 ALA CB C 13 17.6 . . 1 . . . . . . . . 4082 1 1007 . 1 1 95 95 ALA N N 15 124.3 . . 1 . . . . . . . . 4082 1 1008 . 1 1 96 96 PRO HA H 1 4.25 . . 1 . . . . . . . . 4082 1 1009 . 1 1 96 96 PRO HB2 H 1 2.00 . . 1 . . . . . . . . 4082 1 1010 . 1 1 96 96 PRO HB3 H 1 1.33 . . 1 . . . . . . . . 4082 1 1011 . 1 1 96 96 PRO HG2 H 1 1.92 . . 1 . . . . . . . . 4082 1 1012 . 1 1 96 96 PRO HG3 H 1 1.92 . . 1 . . . . . . . . 4082 1 1013 . 1 1 96 96 PRO HD2 H 1 3.75 . . 1 . . . . . . . . 4082 1 1014 . 1 1 96 96 PRO HD3 H 1 3.54 . . 1 . . . . . . . . 4082 1 1015 . 1 1 96 96 PRO CA C 13 63.2 . . 1 . . . . . . . . 4082 1 1016 . 1 1 96 96 PRO CB C 13 32.5 . . 1 . . . . . . . . 4082 1 1017 . 1 1 96 96 PRO CG C 13 27.5 . . 1 . . . . . . . . 4082 1 1018 . 1 1 96 96 PRO CD C 13 50.3 . . 1 . . . . . . . . 4082 1 1019 . 1 1 97 97 THR H H 1 7.69 . . 1 . . . . . . . . 4082 1 1020 . 1 1 97 97 THR HA H 1 3.67 . . 1 . . . . . . . . 4082 1 1021 . 1 1 97 97 THR HB H 1 4.11 . . 1 . . . . . . . . 4082 1 1022 . 1 1 97 97 THR HG21 H 1 1.00 . . 1 . . . . . . . . 4082 1 1023 . 1 1 97 97 THR HG22 H 1 1.00 . . 1 . . . . . . . . 4082 1 1024 . 1 1 97 97 THR HG23 H 1 1.00 . . 1 . . . . . . . . 4082 1 1025 . 1 1 97 97 THR CA C 13 59.7 . . 1 . . . . . . . . 4082 1 1026 . 1 1 97 97 THR CB C 13 71.5 . . 1 . . . . . . . . 4082 1 1027 . 1 1 97 97 THR CG2 C 13 21.9 . . 1 . . . . . . . . 4082 1 1028 . 1 1 97 97 THR N N 15 111.5 . . 1 . . . . . . . . 4082 1 1029 . 1 1 98 98 PHE H H 1 8.35 . . 1 . . . . . . . . 4082 1 1030 . 1 1 98 98 PHE HA H 1 4.90 . . 1 . . . . . . . . 4082 1 1031 . 1 1 98 98 PHE HB2 H 1 3.43 . . 1 . . . . . . . . 4082 1 1032 . 1 1 98 98 PHE HB3 H 1 2.65 . . 1 . . . . . . . . 4082 1 1033 . 1 1 98 98 PHE HD1 H 1 7.08 . . 1 . . . . . . . . 4082 1 1034 . 1 1 98 98 PHE HD2 H 1 7.08 . . 1 . . . . . . . . 4082 1 1035 . 1 1 98 98 PHE HE1 H 1 7.22 . . 1 . . . . . . . . 4082 1 1036 . 1 1 98 98 PHE HE2 H 1 7.22 . . 1 . . . . . . . . 4082 1 1037 . 1 1 98 98 PHE HZ H 1 7.31 . . 1 . . . . . . . . 4082 1 1038 . 1 1 98 98 PHE CA C 13 55.5 . . 1 . . . . . . . . 4082 1 1039 . 1 1 98 98 PHE CB C 13 41.8 . . 1 . . . . . . . . 4082 1 1040 . 1 1 98 98 PHE CE1 C 13 130.6 . . 1 . . . . . . . . 4082 1 1041 . 1 1 98 98 PHE CE2 C 13 130.6 . . 1 . . . . . . . . 4082 1 1042 . 1 1 98 98 PHE N N 15 119.7 . . 1 . . . . . . . . 4082 1 1043 . 1 1 99 99 ASN H H 1 8.90 . . 1 . . . . . . . . 4082 1 1044 . 1 1 99 99 ASN HA H 1 5.25 . . 1 . . . . . . . . 4082 1 1045 . 1 1 99 99 ASN HB2 H 1 3.11 . . 1 . . . . . . . . 4082 1 1046 . 1 1 99 99 ASN HB3 H 1 2.48 . . 1 . . . . . . . . 4082 1 1047 . 1 1 99 99 ASN HD21 H 1 7.71 . . 1 . . . . . . . . 4082 1 1048 . 1 1 99 99 ASN HD22 H 1 6.99 . . 1 . . . . . . . . 4082 1 1049 . 1 1 99 99 ASN CA C 13 54.7 . . 1 . . . . . . . . 4082 1 1050 . 1 1 99 99 ASN CB C 13 40.3 . . 1 . . . . . . . . 4082 1 1051 . 1 1 99 99 ASN N N 15 121.4 . . 1 . . . . . . . . 4082 1 1052 . 1 1 99 99 ASN ND2 N 15 115.1 . . 1 . . . . . . . . 4082 1 1053 . 1 1 100 100 VAL H H 1 8.59 . . 1 . . . . . . . . 4082 1 1054 . 1 1 100 100 VAL HA H 1 5.56 . . 1 . . . . . . . . 4082 1 1055 . 1 1 100 100 VAL HB H 1 1.79 . . 1 . . . . . . . . 4082 1 1056 . 1 1 100 100 VAL HG11 H 1 1.05 . . 1 . . . . . . . . 4082 1 1057 . 1 1 100 100 VAL HG12 H 1 1.05 . . 1 . . . . . . . . 4082 1 1058 . 1 1 100 100 VAL HG13 H 1 1.05 . . 1 . . . . . . . . 4082 1 1059 . 1 1 100 100 VAL HG21 H 1 0.88 . . 1 . . . . . . . . 4082 1 1060 . 1 1 100 100 VAL HG22 H 1 0.88 . . 1 . . . . . . . . 4082 1 1061 . 1 1 100 100 VAL HG23 H 1 0.88 . . 1 . . . . . . . . 4082 1 1062 . 1 1 100 100 VAL CA C 13 59.5 . . 1 . . . . . . . . 4082 1 1063 . 1 1 100 100 VAL CB C 13 37.5 . . 1 . . . . . . . . 4082 1 1064 . 1 1 100 100 VAL CG1 C 13 23.0 . . 1 . . . . . . . . 4082 1 1065 . 1 1 100 100 VAL CG2 C 13 21.5 . . 1 . . . . . . . . 4082 1 1066 . 1 1 100 100 VAL N N 15 123.6 . . 1 . . . . . . . . 4082 1 1067 . 1 1 101 101 THR H H 1 8.45 . . 1 . . . . . . . . 4082 1 1068 . 1 1 101 101 THR HA H 1 5.62 . . 1 . . . . . . . . 4082 1 1069 . 1 1 101 101 THR HB H 1 3.54 . . 1 . . . . . . . . 4082 1 1070 . 1 1 101 101 THR HG21 H 1 1.43 . . 1 . . . . . . . . 4082 1 1071 . 1 1 101 101 THR HG22 H 1 1.43 . . 1 . . . . . . . . 4082 1 1072 . 1 1 101 101 THR HG23 H 1 1.43 . . 1 . . . . . . . . 4082 1 1073 . 1 1 101 101 THR CA C 13 63.1 . . 1 . . . . . . . . 4082 1 1074 . 1 1 101 101 THR CB C 13 73.8 . . 1 . . . . . . . . 4082 1 1075 . 1 1 101 101 THR CG2 C 13 23.6 . . 1 . . . . . . . . 4082 1 1076 . 1 1 101 101 THR N N 15 123.0 . . 1 . . . . . . . . 4082 1 1077 . 1 1 102 102 VAL H H 1 9.08 . . 1 . . . . . . . . 4082 1 1078 . 1 1 102 102 VAL HA H 1 5.15 . . 1 . . . . . . . . 4082 1 1079 . 1 1 102 102 VAL HB H 1 1.76 . . 1 . . . . . . . . 4082 1 1080 . 1 1 102 102 VAL HG11 H 1 0.74 . . 1 . . . . . . . . 4082 1 1081 . 1 1 102 102 VAL HG12 H 1 0.74 . . 1 . . . . . . . . 4082 1 1082 . 1 1 102 102 VAL HG13 H 1 0.74 . . 1 . . . . . . . . 4082 1 1083 . 1 1 102 102 VAL HG21 H 1 0.67 . . 1 . . . . . . . . 4082 1 1084 . 1 1 102 102 VAL HG22 H 1 0.67 . . 1 . . . . . . . . 4082 1 1085 . 1 1 102 102 VAL HG23 H 1 0.67 . . 1 . . . . . . . . 4082 1 1086 . 1 1 102 102 VAL CA C 13 59.7 . . 1 . . . . . . . . 4082 1 1087 . 1 1 102 102 VAL CB C 13 35.0 . . 1 . . . . . . . . 4082 1 1088 . 1 1 102 102 VAL CG1 C 13 22.4 . . 1 . . . . . . . . 4082 1 1089 . 1 1 102 102 VAL CG2 C 13 21.5 . . 1 . . . . . . . . 4082 1 1090 . 1 1 102 102 VAL N N 15 127.8 . . 1 . . . . . . . . 4082 1 1091 . 1 1 103 103 THR H H 1 9.25 . . 1 . . . . . . . . 4082 1 1092 . 1 1 103 103 THR HA H 1 5.39 . . 1 . . . . . . . . 4082 1 1093 . 1 1 103 103 THR HB H 1 3.88 . . 1 . . . . . . . . 4082 1 1094 . 1 1 103 103 THR HG21 H 1 1.15 . . 1 . . . . . . . . 4082 1 1095 . 1 1 103 103 THR HG22 H 1 1.15 . . 1 . . . . . . . . 4082 1 1096 . 1 1 103 103 THR HG23 H 1 1.15 . . 1 . . . . . . . . 4082 1 1097 . 1 1 103 103 THR CA C 13 60.3 . . 1 . . . . . . . . 4082 1 1098 . 1 1 103 103 THR CB C 13 72.0 . . 1 . . . . . . . . 4082 1 1099 . 1 1 103 103 THR CG2 C 13 22.9 . . 1 . . . . . . . . 4082 1 1100 . 1 1 103 103 THR N N 15 120.5 . . 1 . . . . . . . . 4082 1 1101 . 1 1 104 104 LYS H H 1 8.20 . . 1 . . . . . . . . 4082 1 1102 . 1 1 104 104 LYS HA H 1 5.09 . . 1 . . . . . . . . 4082 1 1103 . 1 1 104 104 LYS HB2 H 1 1.68 . . 1 . . . . . . . . 4082 1 1104 . 1 1 104 104 LYS HB3 H 1 1.14 . . 1 . . . . . . . . 4082 1 1105 . 1 1 104 104 LYS HG2 H 1 1.52 . . 1 . . . . . . . . 4082 1 1106 . 1 1 104 104 LYS HG3 H 1 0.95 . . 1 . . . . . . . . 4082 1 1107 . 1 1 104 104 LYS HD2 H 1 1.27 . . 1 . . . . . . . . 4082 1 1108 . 1 1 104 104 LYS HD3 H 1 1.04 . . 1 . . . . . . . . 4082 1 1109 . 1 1 104 104 LYS HE2 H 1 2.73 . . 1 . . . . . . . . 4082 1 1110 . 1 1 104 104 LYS HE3 H 1 2.60 . . 1 . . . . . . . . 4082 1 1111 . 1 1 104 104 LYS CA C 13 55.1 . . 1 . . . . . . . . 4082 1 1112 . 1 1 104 104 LYS CB C 13 37.4 . . 1 . . . . . . . . 4082 1 1113 . 1 1 104 104 LYS CG C 13 23.9 . . 1 . . . . . . . . 4082 1 1114 . 1 1 104 104 LYS CD C 13 30.0 . . 1 . . . . . . . . 4082 1 1115 . 1 1 104 104 LYS CE C 13 41.0 . . 1 . . . . . . . . 4082 1 1116 . 1 1 104 104 LYS N N 15 124.7 . . 1 . . . . . . . . 4082 1 1117 . 1 1 105 105 THR H H 1 9.63 . . 1 . . . . . . . . 4082 1 1118 . 1 1 105 105 THR HA H 1 4.51 . . 1 . . . . . . . . 4082 1 1119 . 1 1 105 105 THR HB H 1 4.79 . . 1 . . . . . . . . 4082 1 1120 . 1 1 105 105 THR HG21 H 1 1.02 . . 1 . . . . . . . . 4082 1 1121 . 1 1 105 105 THR HG22 H 1 1.02 . . 1 . . . . . . . . 4082 1 1122 . 1 1 105 105 THR HG23 H 1 1.02 . . 1 . . . . . . . . 4082 1 1123 . 1 1 105 105 THR CA C 13 60.8 . . 1 . . . . . . . . 4082 1 1124 . 1 1 105 105 THR CB C 13 67.5 . . 1 . . . . . . . . 4082 1 1125 . 1 1 105 105 THR CG2 C 13 22.5 . . 1 . . . . . . . . 4082 1 1126 . 1 1 105 105 THR N N 15 121.0 . . 1 . . . . . . . . 4082 1 1127 . 1 1 106 106 ASP H H 1 9.08 . . 1 . . . . . . . . 4082 1 1128 . 1 1 106 106 ASP HA H 1 4.39 . . 1 . . . . . . . . 4082 1 1129 . 1 1 106 106 ASP HB2 H 1 2.57 . . 1 . . . . . . . . 4082 1 1130 . 1 1 106 106 ASP HB3 H 1 2.34 . . 1 . . . . . . . . 4082 1 1131 . 1 1 106 106 ASP CA C 13 59.0 . . 1 . . . . . . . . 4082 1 1132 . 1 1 106 106 ASP CB C 13 41.9 . . 1 . . . . . . . . 4082 1 1133 . 1 1 106 106 ASP N N 15 122.2 . . 1 . . . . . . . . 4082 1 1134 . 1 1 107 107 LYS H H 1 8.50 . . 1 . . . . . . . . 4082 1 1135 . 1 1 107 107 LYS HA H 1 4.04 . . 1 . . . . . . . . 4082 1 1136 . 1 1 107 107 LYS HB2 H 1 1.95 . . 1 . . . . . . . . 4082 1 1137 . 1 1 107 107 LYS HB3 H 1 1.95 . . 1 . . . . . . . . 4082 1 1138 . 1 1 107 107 LYS HG2 H 1 1.39 . . 1 . . . . . . . . 4082 1 1139 . 1 1 107 107 LYS HG3 H 1 1.24 . . 1 . . . . . . . . 4082 1 1140 . 1 1 107 107 LYS HD2 H 1 1.83 . . 1 . . . . . . . . 4082 1 1141 . 1 1 107 107 LYS HD3 H 1 1.65 . . 1 . . . . . . . . 4082 1 1142 . 1 1 107 107 LYS HE2 H 1 3.00 . . 1 . . . . . . . . 4082 1 1143 . 1 1 107 107 LYS HE3 H 1 3.00 . . 1 . . . . . . . . 4082 1 1144 . 1 1 107 107 LYS CA C 13 55.6 . . 1 . . . . . . . . 4082 1 1145 . 1 1 107 107 LYS CB C 13 36.4 . . 1 . . . . . . . . 4082 1 1146 . 1 1 107 107 LYS CG C 13 26.0 . . 1 . . . . . . . . 4082 1 1147 . 1 1 107 107 LYS CD C 13 29.2 . . 1 . . . . . . . . 4082 1 1148 . 1 1 107 107 LYS CE C 13 42.1 . . 1 . . . . . . . . 4082 1 1149 . 1 1 107 107 LYS N N 15 111.9 . . 1 . . . . . . . . 4082 1 1150 . 1 1 108 108 THR H H 1 7.77 . . 1 . . . . . . . . 4082 1 1151 . 1 1 108 108 THR HA H 1 5.27 . . 1 . . . . . . . . 4082 1 1152 . 1 1 108 108 THR HB H 1 3.27 . . 1 . . . . . . . . 4082 1 1153 . 1 1 108 108 THR HG21 H 1 0.25 . . 1 . . . . . . . . 4082 1 1154 . 1 1 108 108 THR HG22 H 1 0.25 . . 1 . . . . . . . . 4082 1 1155 . 1 1 108 108 THR HG23 H 1 0.25 . . 1 . . . . . . . . 4082 1 1156 . 1 1 108 108 THR CA C 13 60.0 . . 1 . . . . . . . . 4082 1 1157 . 1 1 108 108 THR CB C 13 72.1 . . 1 . . . . . . . . 4082 1 1158 . 1 1 108 108 THR CG2 C 13 21.5 . . 1 . . . . . . . . 4082 1 1159 . 1 1 108 108 THR N N 15 112.7 . . 1 . . . . . . . . 4082 1 1160 . 1 1 109 109 LEU H H 1 9.04 . . 1 . . . . . . . . 4082 1 1161 . 1 1 109 109 LEU HA H 1 5.14 . . 1 . . . . . . . . 4082 1 1162 . 1 1 109 109 LEU HB2 H 1 1.34 . . 1 . . . . . . . . 4082 1 1163 . 1 1 109 109 LEU HB3 H 1 0.82 . . 1 . . . . . . . . 4082 1 1164 . 1 1 109 109 LEU HG H 1 1.38 . . 1 . . . . . . . . 4082 1 1165 . 1 1 109 109 LEU HD11 H 1 0.44 . . 1 . . . . . . . . 4082 1 1166 . 1 1 109 109 LEU HD12 H 1 0.44 . . 1 . . . . . . . . 4082 1 1167 . 1 1 109 109 LEU HD13 H 1 0.44 . . 1 . . . . . . . . 4082 1 1168 . 1 1 109 109 LEU HD21 H 1 0.28 . . 1 . . . . . . . . 4082 1 1169 . 1 1 109 109 LEU HD22 H 1 0.28 . . 1 . . . . . . . . 4082 1 1170 . 1 1 109 109 LEU HD23 H 1 0.28 . . 1 . . . . . . . . 4082 1 1171 . 1 1 109 109 LEU CA C 13 55.3 . . 1 . . . . . . . . 4082 1 1172 . 1 1 109 109 LEU CB C 13 44.3 . . 1 . . . . . . . . 4082 1 1173 . 1 1 109 109 LEU CG C 13 26.7 . . 1 . . . . . . . . 4082 1 1174 . 1 1 109 109 LEU CD1 C 13 27.3 . . 1 . . . . . . . . 4082 1 1175 . 1 1 109 109 LEU CD2 C 13 23.2 . . 1 . . . . . . . . 4082 1 1176 . 1 1 109 109 LEU N N 15 117.2 . . 1 . . . . . . . . 4082 1 1177 . 1 1 110 110 VAL H H 1 8.73 . . 1 . . . . . . . . 4082 1 1178 . 1 1 110 110 VAL HA H 1 4.53 . . 1 . . . . . . . . 4082 1 1179 . 1 1 110 110 VAL HB H 1 2.00 . . 1 . . . . . . . . 4082 1 1180 . 1 1 110 110 VAL HG11 H 1 0.82 . . 1 . . . . . . . . 4082 1 1181 . 1 1 110 110 VAL HG12 H 1 0.82 . . 1 . . . . . . . . 4082 1 1182 . 1 1 110 110 VAL HG13 H 1 0.82 . . 1 . . . . . . . . 4082 1 1183 . 1 1 110 110 VAL HG21 H 1 0.64 . . 1 . . . . . . . . 4082 1 1184 . 1 1 110 110 VAL HG22 H 1 0.64 . . 1 . . . . . . . . 4082 1 1185 . 1 1 110 110 VAL HG23 H 1 0.64 . . 1 . . . . . . . . 4082 1 1186 . 1 1 110 110 VAL CA C 13 61.2 . . 1 . . . . . . . . 4082 1 1187 . 1 1 110 110 VAL CB C 13 32.2 . . 1 . . . . . . . . 4082 1 1188 . 1 1 110 110 VAL CG1 C 13 22.0 . . 1 . . . . . . . . 4082 1 1189 . 1 1 110 110 VAL CG2 C 13 21.9 . . 1 . . . . . . . . 4082 1 1190 . 1 1 110 110 VAL N N 15 123.5 . . 1 . . . . . . . . 4082 1 1191 . 1 1 111 111 LEU H H 1 8.83 . . 1 . . . . . . . . 4082 1 1192 . 1 1 111 111 LEU HA H 1 5.09 . . 1 . . . . . . . . 4082 1 1193 . 1 1 111 111 LEU HB2 H 1 0.48 . . 1 . . . . . . . . 4082 1 1194 . 1 1 111 111 LEU HB3 H 1 0.48 . . 1 . . . . . . . . 4082 1 1195 . 1 1 111 111 LEU HG H 1 1.16 . . 1 . . . . . . . . 4082 1 1196 . 1 1 111 111 LEU HD11 H 1 0.33 . . 1 . . . . . . . . 4082 1 1197 . 1 1 111 111 LEU HD12 H 1 0.33 . . 1 . . . . . . . . 4082 1 1198 . 1 1 111 111 LEU HD13 H 1 0.33 . . 1 . . . . . . . . 4082 1 1199 . 1 1 111 111 LEU HD21 H 1 0.04 . . 1 . . . . . . . . 4082 1 1200 . 1 1 111 111 LEU HD22 H 1 0.04 . . 1 . . . . . . . . 4082 1 1201 . 1 1 111 111 LEU HD23 H 1 0.04 . . 1 . . . . . . . . 4082 1 1202 . 1 1 111 111 LEU CA C 13 55.6 . . 1 . . . . . . . . 4082 1 1203 . 1 1 111 111 LEU CB C 13 44.3 . . 1 . . . . . . . . 4082 1 1204 . 1 1 111 111 LEU CG C 13 29.2 . . 1 . . . . . . . . 4082 1 1205 . 1 1 111 111 LEU CD1 C 13 27.2 . . 1 . . . . . . . . 4082 1 1206 . 1 1 111 111 LEU CD2 C 13 29.2 . . 1 . . . . . . . . 4082 1 1207 . 1 1 111 111 LEU N N 15 125.9 . . 1 . . . . . . . . 4082 1 1208 . 1 1 112 112 LEU H H 1 8.21 . . 1 . . . . . . . . 4082 1 1209 . 1 1 112 112 LEU HA H 1 5.20 . . 1 . . . . . . . . 4082 1 1210 . 1 1 112 112 LEU HB2 H 1 1.82 . . 1 . . . . . . . . 4082 1 1211 . 1 1 112 112 LEU HB3 H 1 1.44 . . 1 . . . . . . . . 4082 1 1212 . 1 1 112 112 LEU HG H 1 1.73 . . 1 . . . . . . . . 4082 1 1213 . 1 1 112 112 LEU HD11 H 1 1.23 . . 1 . . . . . . . . 4082 1 1214 . 1 1 112 112 LEU HD12 H 1 1.23 . . 1 . . . . . . . . 4082 1 1215 . 1 1 112 112 LEU HD13 H 1 1.23 . . 1 . . . . . . . . 4082 1 1216 . 1 1 112 112 LEU HD21 H 1 1.20 . . 1 . . . . . . . . 4082 1 1217 . 1 1 112 112 LEU HD22 H 1 1.20 . . 1 . . . . . . . . 4082 1 1218 . 1 1 112 112 LEU HD23 H 1 1.20 . . 1 . . . . . . . . 4082 1 1219 . 1 1 112 112 LEU CA C 13 54.1 . . 1 . . . . . . . . 4082 1 1220 . 1 1 112 112 LEU CB C 13 49.0 . . 1 . . . . . . . . 4082 1 1221 . 1 1 112 112 LEU CG C 13 27.8 . . 1 . . . . . . . . 4082 1 1222 . 1 1 112 112 LEU CD1 C 13 27.1 . . 1 . . . . . . . . 4082 1 1223 . 1 1 112 112 LEU CD2 C 13 25.6 . . 1 . . . . . . . . 4082 1 1224 . 1 1 112 112 LEU N N 15 120.7 . . 1 . . . . . . . . 4082 1 1225 . 1 1 113 113 MET H H 1 8.60 . . 1 . . . . . . . . 4082 1 1226 . 1 1 113 113 MET HA H 1 5.44 . . 1 . . . . . . . . 4082 1 1227 . 1 1 113 113 MET HB2 H 1 1.98 . . 1 . . . . . . . . 4082 1 1228 . 1 1 113 113 MET HB3 H 1 1.64 . . 1 . . . . . . . . 4082 1 1229 . 1 1 113 113 MET HG2 H 1 2.46 . . 1 . . . . . . . . 4082 1 1230 . 1 1 113 113 MET HG3 H 1 2.32 . . 1 . . . . . . . . 4082 1 1231 . 1 1 113 113 MET HE1 H 1 2.18 . . 1 . . . . . . . . 4082 1 1232 . 1 1 113 113 MET HE2 H 1 2.18 . . 1 . . . . . . . . 4082 1 1233 . 1 1 113 113 MET HE3 H 1 2.18 . . 1 . . . . . . . . 4082 1 1234 . 1 1 113 113 MET CA C 13 53.9 . . 1 . . . . . . . . 4082 1 1235 . 1 1 113 113 MET CB C 13 38.0 . . 1 . . . . . . . . 4082 1 1236 . 1 1 113 113 MET CG C 13 30.2 . . 1 . . . . . . . . 4082 1 1237 . 1 1 113 113 MET CE C 13 35.1 . . 1 . . . . . . . . 4082 1 1238 . 1 1 113 113 MET N N 15 123.8 . . 1 . . . . . . . . 4082 1 1239 . 1 1 114 114 GLY H H 1 9.58 . . 1 . . . . . . . . 4082 1 1240 . 1 1 114 114 GLY HA2 H 1 4.72 . . 1 . . . . . . . . 4082 1 1241 . 1 1 114 114 GLY HA3 H 1 4.01 . . 1 . . . . . . . . 4082 1 1242 . 1 1 114 114 GLY CA C 13 46.3 . . 1 . . . . . . . . 4082 1 1243 . 1 1 114 114 GLY N N 15 115.9 . . 1 . . . . . . . . 4082 1 1244 . 1 1 115 115 LYS H H 1 7.84 . . 1 . . . . . . . . 4082 1 1245 . 1 1 115 115 LYS HA H 1 4.10 . . 1 . . . . . . . . 4082 1 1246 . 1 1 115 115 LYS HB2 H 1 1.98 . . 1 . . . . . . . . 4082 1 1247 . 1 1 115 115 LYS HB3 H 1 1.68 . . 1 . . . . . . . . 4082 1 1248 . 1 1 115 115 LYS HG2 H 1 1.14 . . 1 . . . . . . . . 4082 1 1249 . 1 1 115 115 LYS HG3 H 1 1.03 . . 1 . . . . . . . . 4082 1 1250 . 1 1 115 115 LYS HD2 H 1 1.68 . . 1 . . . . . . . . 4082 1 1251 . 1 1 115 115 LYS HD3 H 1 1.59 . . 1 . . . . . . . . 4082 1 1252 . 1 1 115 115 LYS HE2 H 1 2.81 . . 1 . . . . . . . . 4082 1 1253 . 1 1 115 115 LYS HE3 H 1 2.61 . . 1 . . . . . . . . 4082 1 1254 . 1 1 115 115 LYS CA C 13 57.5 . . 1 . . . . . . . . 4082 1 1255 . 1 1 115 115 LYS CB C 13 34.3 . . 1 . . . . . . . . 4082 1 1256 . 1 1 115 115 LYS CG C 13 28.2 . . 1 . . . . . . . . 4082 1 1257 . 1 1 115 115 LYS CD C 13 29.5 . . 1 . . . . . . . . 4082 1 1258 . 1 1 115 115 LYS CE C 13 42.0 . . 1 . . . . . . . . 4082 1 1259 . 1 1 115 115 LYS N N 15 118.7 . . 1 . . . . . . . . 4082 1 1260 . 1 1 116 116 GLU H H 1 9.20 . . 1 . . . . . . . . 4082 1 1261 . 1 1 116 116 GLU HA H 1 4.13 . . 1 . . . . . . . . 4082 1 1262 . 1 1 116 116 GLU HB2 H 1 2.21 . . 1 . . . . . . . . 4082 1 1263 . 1 1 116 116 GLU HB3 H 1 2.02 . . 1 . . . . . . . . 4082 1 1264 . 1 1 116 116 GLU HG2 H 1 2.29 . . 1 . . . . . . . . 4082 1 1265 . 1 1 116 116 GLU HG3 H 1 2.29 . . 1 . . . . . . . . 4082 1 1266 . 1 1 116 116 GLU CA C 13 58.4 . . 1 . . . . . . . . 4082 1 1267 . 1 1 116 116 GLU CB C 13 29.8 . . 1 . . . . . . . . 4082 1 1268 . 1 1 116 116 GLU N N 15 123.9 . . 1 . . . . . . . . 4082 1 1269 . 1 1 117 117 GLY H H 1 9.26 . . 1 . . . . . . . . 4082 1 1270 . 1 1 117 117 GLY HA2 H 1 4.15 . . 1 . . . . . . . . 4082 1 1271 . 1 1 117 117 GLY HA3 H 1 3.72 . . 1 . . . . . . . . 4082 1 1272 . 1 1 117 117 GLY CA C 13 45.7 . . 1 . . . . . . . . 4082 1 1273 . 1 1 117 117 GLY N N 15 115.1 . . 1 . . . . . . . . 4082 1 1274 . 1 1 118 118 VAL H H 1 7.44 . . 1 . . . . . . . . 4082 1 1275 . 1 1 118 118 VAL HA H 1 4.01 . . 1 . . . . . . . . 4082 1 1276 . 1 1 118 118 VAL HB H 1 2.08 . . 1 . . . . . . . . 4082 1 1277 . 1 1 118 118 VAL HG11 H 1 1.19 . . 1 . . . . . . . . 4082 1 1278 . 1 1 118 118 VAL HG12 H 1 1.19 . . 1 . . . . . . . . 4082 1 1279 . 1 1 118 118 VAL HG13 H 1 1.19 . . 1 . . . . . . . . 4082 1 1280 . 1 1 118 118 VAL HG21 H 1 1.11 . . 1 . . . . . . . . 4082 1 1281 . 1 1 118 118 VAL HG22 H 1 1.11 . . 1 . . . . . . . . 4082 1 1282 . 1 1 118 118 VAL HG23 H 1 1.11 . . 1 . . . . . . . . 4082 1 1283 . 1 1 118 118 VAL CA C 13 63.7 . . 1 . . . . . . . . 4082 1 1284 . 1 1 118 118 VAL CB C 13 32.1 . . 1 . . . . . . . . 4082 1 1285 . 1 1 118 118 VAL CG1 C 13 18.1 . . 1 . . . . . . . . 4082 1 1286 . 1 1 118 118 VAL CG2 C 13 22.1 . . 1 . . . . . . . . 4082 1 1287 . 1 1 118 118 VAL N N 15 122.4 . . 1 . . . . . . . . 4082 1 1288 . 1 1 119 119 HIS H H 1 8.82 . . 1 . . . . . . . . 4082 1 1289 . 1 1 119 119 HIS HA H 1 4.25 . . 1 . . . . . . . . 4082 1 1290 . 1 1 119 119 HIS HB2 H 1 3.28 . . 1 . . . . . . . . 4082 1 1291 . 1 1 119 119 HIS HB3 H 1 3.12 . . 1 . . . . . . . . 4082 1 1292 . 1 1 119 119 HIS CA C 13 58.4 . . 1 . . . . . . . . 4082 1 1293 . 1 1 119 119 HIS CB C 13 32.1 . . 1 . . . . . . . . 4082 1 1294 . 1 1 119 119 HIS N N 15 130.6 . . 1 . . . . . . . . 4082 1 1295 . 1 1 120 120 GLY H H 1 8.81 . . 1 . . . . . . . . 4082 1 1296 . 1 1 120 120 GLY HA2 H 1 3.89 . . 1 . . . . . . . . 4082 1 1297 . 1 1 120 120 GLY HA3 H 1 3.63 . . 1 . . . . . . . . 4082 1 1298 . 1 1 120 120 GLY CA C 13 47.3 . . 1 . . . . . . . . 4082 1 1299 . 1 1 120 120 GLY N N 15 113.5 . . 1 . . . . . . . . 4082 1 1300 . 1 1 121 121 GLY H H 1 9.73 . . 1 . . . . . . . . 4082 1 1301 . 1 1 121 121 GLY HA2 H 1 3.93 . . 1 . . . . . . . . 4082 1 1302 . 1 1 121 121 GLY HA3 H 1 3.93 . . 1 . . . . . . . . 4082 1 1303 . 1 1 121 121 GLY CA C 13 46.9 . . 1 . . . . . . . . 4082 1 1304 . 1 1 121 121 GLY N N 15 113.3 . . 1 . . . . . . . . 4082 1 1305 . 1 1 122 122 LEU H H 1 7.15 . . 1 . . . . . . . . 4082 1 1306 . 1 1 122 122 LEU HA H 1 4.18 . . 1 . . . . . . . . 4082 1 1307 . 1 1 122 122 LEU HB2 H 1 1.75 . . 1 . . . . . . . . 4082 1 1308 . 1 1 122 122 LEU HB3 H 1 1.75 . . 1 . . . . . . . . 4082 1 1309 . 1 1 122 122 LEU HG H 1 1.59 . . 1 . . . . . . . . 4082 1 1310 . 1 1 122 122 LEU HD11 H 1 1.00 . . 1 . . . . . . . . 4082 1 1311 . 1 1 122 122 LEU HD12 H 1 1.00 . . 1 . . . . . . . . 4082 1 1312 . 1 1 122 122 LEU HD13 H 1 1.00 . . 1 . . . . . . . . 4082 1 1313 . 1 1 122 122 LEU HD21 H 1 0.90 . . 1 . . . . . . . . 4082 1 1314 . 1 1 122 122 LEU HD22 H 1 0.90 . . 1 . . . . . . . . 4082 1 1315 . 1 1 122 122 LEU HD23 H 1 0.90 . . 1 . . . . . . . . 4082 1 1316 . 1 1 122 122 LEU CA C 13 58.0 . . 1 . . . . . . . . 4082 1 1317 . 1 1 122 122 LEU CB C 13 41.9 . . 1 . . . . . . . . 4082 1 1318 . 1 1 122 122 LEU CG C 13 27.5 . . 1 . . . . . . . . 4082 1 1319 . 1 1 122 122 LEU CD1 C 13 24.4 . . 1 . . . . . . . . 4082 1 1320 . 1 1 122 122 LEU CD2 C 13 25.2 . . 1 . . . . . . . . 4082 1 1321 . 1 1 122 122 LEU N N 15 124.7 . . 1 . . . . . . . . 4082 1 1322 . 1 1 123 123 ILE H H 1 7.00 . . 1 . . . . . . . . 4082 1 1323 . 1 1 123 123 ILE HA H 1 3.57 . . 1 . . . . . . . . 4082 1 1324 . 1 1 123 123 ILE HB H 1 2.13 . . 1 . . . . . . . . 4082 1 1325 . 1 1 123 123 ILE HG12 H 1 1.55 . . 1 . . . . . . . . 4082 1 1326 . 1 1 123 123 ILE HG13 H 1 1.29 . . 1 . . . . . . . . 4082 1 1327 . 1 1 123 123 ILE HG21 H 1 0.88 . . 1 . . . . . . . . 4082 1 1328 . 1 1 123 123 ILE HG22 H 1 0.88 . . 1 . . . . . . . . 4082 1 1329 . 1 1 123 123 ILE HG23 H 1 0.88 . . 1 . . . . . . . . 4082 1 1330 . 1 1 123 123 ILE HD11 H 1 0.80 . . 1 . . . . . . . . 4082 1 1331 . 1 1 123 123 ILE HD12 H 1 0.80 . . 1 . . . . . . . . 4082 1 1332 . 1 1 123 123 ILE HD13 H 1 0.80 . . 1 . . . . . . . . 4082 1 1333 . 1 1 123 123 ILE CA C 13 62.2 . . 1 . . . . . . . . 4082 1 1334 . 1 1 123 123 ILE CB C 13 36.4 . . 1 . . . . . . . . 4082 1 1335 . 1 1 123 123 ILE CG1 C 13 27.6 . . 1 . . . . . . . . 4082 1 1336 . 1 1 123 123 ILE CG2 C 13 18.7 . . 1 . . . . . . . . 4082 1 1337 . 1 1 123 123 ILE CD1 C 13 12.9 . . 1 . . . . . . . . 4082 1 1338 . 1 1 123 123 ILE N N 15 119.9 . . 1 . . . . . . . . 4082 1 1339 . 1 1 124 124 ASN H H 1 8.24 . . 1 . . . . . . . . 4082 1 1340 . 1 1 124 124 ASN HA H 1 4.30 . . 1 . . . . . . . . 4082 1 1341 . 1 1 124 124 ASN HB2 H 1 2.85 . . 1 . . . . . . . . 4082 1 1342 . 1 1 124 124 ASN HB3 H 1 2.62 . . 1 . . . . . . . . 4082 1 1343 . 1 1 124 124 ASN HD21 H 1 9.36 . . 1 . . . . . . . . 4082 1 1344 . 1 1 124 124 ASN HD22 H 1 6.30 . . 1 . . . . . . . . 4082 1 1345 . 1 1 124 124 ASN CA C 13 57.6 . . 1 . . . . . . . . 4082 1 1346 . 1 1 124 124 ASN CB C 13 40.0 . . 1 . . . . . . . . 4082 1 1347 . 1 1 124 124 ASN N N 15 120.1 . . 1 . . . . . . . . 4082 1 1348 . 1 1 124 124 ASN ND2 N 15 116.6 . . 1 . . . . . . . . 4082 1 1349 . 1 1 125 125 LYS H H 1 7.81 . . 1 . . . . . . . . 4082 1 1350 . 1 1 125 125 LYS HA H 1 4.01 . . 1 . . . . . . . . 4082 1 1351 . 1 1 125 125 LYS HB2 H 1 1.94 . . 1 . . . . . . . . 4082 1 1352 . 1 1 125 125 LYS HB3 H 1 1.94 . . 1 . . . . . . . . 4082 1 1353 . 1 1 125 125 LYS HG2 H 1 1.53 . . 1 . . . . . . . . 4082 1 1354 . 1 1 125 125 LYS HG3 H 1 1.53 . . 1 . . . . . . . . 4082 1 1355 . 1 1 125 125 LYS HD2 H 1 2.20 . . 1 . . . . . . . . 4082 1 1356 . 1 1 125 125 LYS HD3 H 1 2.07 . . 1 . . . . . . . . 4082 1 1357 . 1 1 125 125 LYS HE2 H 1 2.63 . . 1 . . . . . . . . 4082 1 1358 . 1 1 125 125 LYS HE3 H 1 2.36 . . 1 . . . . . . . . 4082 1 1359 . 1 1 125 125 LYS CA C 13 59.5 . . 1 . . . . . . . . 4082 1 1360 . 1 1 125 125 LYS CB C 13 32.6 . . 1 . . . . . . . . 4082 1 1361 . 1 1 125 125 LYS CD C 13 29.6 . . 1 . . . . . . . . 4082 1 1362 . 1 1 125 125 LYS CE C 13 37.0 . . 1 . . . . . . . . 4082 1 1363 . 1 1 125 125 LYS N N 15 120.0 . . 1 . . . . . . . . 4082 1 1364 . 1 1 126 126 LYS H H 1 8.04 . . 1 . . . . . . . . 4082 1 1365 . 1 1 126 126 LYS HA H 1 4.04 . . 1 . . . . . . . . 4082 1 1366 . 1 1 126 126 LYS HB2 H 1 1.76 . . 1 . . . . . . . . 4082 1 1367 . 1 1 126 126 LYS HB3 H 1 1.68 . . 1 . . . . . . . . 4082 1 1368 . 1 1 126 126 LYS HG2 H 1 1.44 . . 1 . . . . . . . . 4082 1 1369 . 1 1 126 126 LYS HG3 H 1 1.44 . . 1 . . . . . . . . 4082 1 1370 . 1 1 126 126 LYS HD2 H 1 1.66 . . 1 . . . . . . . . 4082 1 1371 . 1 1 126 126 LYS HD3 H 1 1.66 . . 1 . . . . . . . . 4082 1 1372 . 1 1 126 126 LYS HE2 H 1 2.95 . . 1 . . . . . . . . 4082 1 1373 . 1 1 126 126 LYS HE3 H 1 2.95 . . 1 . . . . . . . . 4082 1 1374 . 1 1 126 126 LYS CA C 13 59.7 . . 1 . . . . . . . . 4082 1 1375 . 1 1 126 126 LYS CB C 13 33.5 . . 1 . . . . . . . . 4082 1 1376 . 1 1 126 126 LYS CG C 13 25.1 . . 1 . . . . . . . . 4082 1 1377 . 1 1 126 126 LYS CD C 13 29.1 . . 1 . . . . . . . . 4082 1 1378 . 1 1 126 126 LYS CE C 13 41.9 . . 1 . . . . . . . . 4082 1 1379 . 1 1 126 126 LYS N N 15 119.5 . . 1 . . . . . . . . 4082 1 1380 . 1 1 127 127 CYS H H 1 8.35 . . 1 . . . . . . . . 4082 1 1381 . 1 1 127 127 CYS HA H 1 3.81 . . 1 . . . . . . . . 4082 1 1382 . 1 1 127 127 CYS HB2 H 1 3.02 . . 1 . . . . . . . . 4082 1 1383 . 1 1 127 127 CYS HB3 H 1 2.92 . . 1 . . . . . . . . 4082 1 1384 . 1 1 127 127 CYS CA C 13 62.3 . . 1 . . . . . . . . 4082 1 1385 . 1 1 127 127 CYS CB C 13 26.5 . . 1 . . . . . . . . 4082 1 1386 . 1 1 127 127 CYS N N 15 121.2 . . 1 . . . . . . . . 4082 1 1387 . 1 1 128 128 TYR H H 1 9.13 . . 1 . . . . . . . . 4082 1 1388 . 1 1 128 128 TYR HA H 1 4.04 . . 1 . . . . . . . . 4082 1 1389 . 1 1 128 128 TYR HB2 H 1 3.18 . . 1 . . . . . . . . 4082 1 1390 . 1 1 128 128 TYR HB3 H 1 3.18 . . 1 . . . . . . . . 4082 1 1391 . 1 1 128 128 TYR HD1 H 1 7.07 . . 1 . . . . . . . . 4082 1 1392 . 1 1 128 128 TYR HD2 H 1 7.07 . . 1 . . . . . . . . 4082 1 1393 . 1 1 128 128 TYR HE1 H 1 6.88 . . 1 . . . . . . . . 4082 1 1394 . 1 1 128 128 TYR HE2 H 1 6.88 . . 1 . . . . . . . . 4082 1 1395 . 1 1 128 128 TYR CA C 13 62.0 . . 1 . . . . . . . . 4082 1 1396 . 1 1 128 128 TYR CB C 13 38.7 . . 1 . . . . . . . . 4082 1 1397 . 1 1 128 128 TYR CD1 C 13 133.2 . . 1 . . . . . . . . 4082 1 1398 . 1 1 128 128 TYR CD2 C 13 133.2 . . 1 . . . . . . . . 4082 1 1399 . 1 1 128 128 TYR CE1 C 13 118.2 . . 1 . . . . . . . . 4082 1 1400 . 1 1 128 128 TYR CE2 C 13 118.2 . . 1 . . . . . . . . 4082 1 1401 . 1 1 128 128 TYR N N 15 121.6 . . 1 . . . . . . . . 4082 1 1402 . 1 1 129 129 GLU H H 1 8.75 . . 1 . . . . . . . . 4082 1 1403 . 1 1 129 129 GLU HA H 1 3.99 . . 1 . . . . . . . . 4082 1 1404 . 1 1 129 129 GLU HB2 H 1 2.20 . . 1 . . . . . . . . 4082 1 1405 . 1 1 129 129 GLU HB3 H 1 2.08 . . 1 . . . . . . . . 4082 1 1406 . 1 1 129 129 GLU HG2 H 1 2.61 . . 1 . . . . . . . . 4082 1 1407 . 1 1 129 129 GLU HG3 H 1 2.36 . . 1 . . . . . . . . 4082 1 1408 . 1 1 129 129 GLU CA C 13 59.9 . . 1 . . . . . . . . 4082 1 1409 . 1 1 129 129 GLU CB C 13 29.3 . . 1 . . . . . . . . 4082 1 1410 . 1 1 129 129 GLU CG C 13 37.1 . . 1 . . . . . . . . 4082 1 1411 . 1 1 129 129 GLU N N 15 121.3 . . 1 . . . . . . . . 4082 1 1412 . 1 1 130 130 MET H H 1 7.57 . . 1 . . . . . . . . 4082 1 1413 . 1 1 130 130 MET HA H 1 4.72 . . 1 . . . . . . . . 4082 1 1414 . 1 1 130 130 MET HB2 H 1 2.18 . . 1 . . . . . . . . 4082 1 1415 . 1 1 130 130 MET HB3 H 1 2.18 . . 1 . . . . . . . . 4082 1 1416 . 1 1 130 130 MET HG2 H 1 2.63 . . 1 . . . . . . . . 4082 1 1417 . 1 1 130 130 MET HG3 H 1 2.28 . . 1 . . . . . . . . 4082 1 1418 . 1 1 130 130 MET CA C 13 56.9 . . 1 . . . . . . . . 4082 1 1419 . 1 1 130 130 MET CB C 13 31.2 . . 1 . . . . . . . . 4082 1 1420 . 1 1 130 130 MET CG C 13 31.9 . . 1 . . . . . . . . 4082 1 1421 . 1 1 130 130 MET N N 15 120.4 . . 1 . . . . . . . . 4082 1 1422 . 1 1 131 131 ALA H H 1 8.45 . . 1 . . . . . . . . 4082 1 1423 . 1 1 131 131 ALA HA H 1 3.77 . . 1 . . . . . . . . 4082 1 1424 . 1 1 131 131 ALA HB1 H 1 1.38 . . 1 . . . . . . . . 4082 1 1425 . 1 1 131 131 ALA HB2 H 1 1.38 . . 1 . . . . . . . . 4082 1 1426 . 1 1 131 131 ALA HB3 H 1 1.38 . . 1 . . . . . . . . 4082 1 1427 . 1 1 131 131 ALA CA C 13 55.6 . . 1 . . . . . . . . 4082 1 1428 . 1 1 131 131 ALA CB C 13 17.6 . . 1 . . . . . . . . 4082 1 1429 . 1 1 131 131 ALA N N 15 123.0 . . 1 . . . . . . . . 4082 1 1430 . 1 1 132 132 SER H H 1 8.38 . . 1 . . . . . . . . 4082 1 1431 . 1 1 132 132 SER HA H 1 3.98 . . 1 . . . . . . . . 4082 1 1432 . 1 1 132 132 SER HB2 H 1 3.83 . . 1 . . . . . . . . 4082 1 1433 . 1 1 132 132 SER HB3 H 1 3.83 . . 1 . . . . . . . . 4082 1 1434 . 1 1 132 132 SER CA C 13 61.7 . . 1 . . . . . . . . 4082 1 1435 . 1 1 132 132 SER CB C 13 63.6 . . 1 . . . . . . . . 4082 1 1436 . 1 1 132 132 SER N N 15 113.7 . . 1 . . . . . . . . 4082 1 1437 . 1 1 133 133 HIS H H 1 7.73 . . 1 . . . . . . . . 4082 1 1438 . 1 1 133 133 HIS HA H 1 4.31 . . 1 . . . . . . . . 4082 1 1439 . 1 1 133 133 HIS HB2 H 1 3.48 . . 1 . . . . . . . . 4082 1 1440 . 1 1 133 133 HIS HB3 H 1 3.28 . . 1 . . . . . . . . 4082 1 1441 . 1 1 133 133 HIS CA C 13 59.8 . . 1 . . . . . . . . 4082 1 1442 . 1 1 133 133 HIS CB C 13 30.0 . . 1 . . . . . . . . 4082 1 1443 . 1 1 133 133 HIS N N 15 122.7 . . 1 . . . . . . . . 4082 1 1444 . 1 1 134 134 LEU H H 1 8.30 . . 1 . . . . . . . . 4082 1 1445 . 1 1 134 134 LEU HA H 1 3.97 . . 1 . . . . . . . . 4082 1 1446 . 1 1 134 134 LEU HB2 H 1 1.97 . . 1 . . . . . . . . 4082 1 1447 . 1 1 134 134 LEU HB3 H 1 1.36 . . 1 . . . . . . . . 4082 1 1448 . 1 1 134 134 LEU HG H 1 1.68 . . 1 . . . . . . . . 4082 1 1449 . 1 1 134 134 LEU HD11 H 1 0.67 . . 1 . . . . . . . . 4082 1 1450 . 1 1 134 134 LEU HD12 H 1 0.67 . . 1 . . . . . . . . 4082 1 1451 . 1 1 134 134 LEU HD13 H 1 0.67 . . 1 . . . . . . . . 4082 1 1452 . 1 1 134 134 LEU HD21 H 1 0.67 . . 1 . . . . . . . . 4082 1 1453 . 1 1 134 134 LEU HD22 H 1 0.67 . . 1 . . . . . . . . 4082 1 1454 . 1 1 134 134 LEU HD23 H 1 0.67 . . 1 . . . . . . . . 4082 1 1455 . 1 1 134 134 LEU CA C 13 59.1 . . 1 . . . . . . . . 4082 1 1456 . 1 1 134 134 LEU CB C 13 41.4 . . 1 . . . . . . . . 4082 1 1457 . 1 1 134 134 LEU CG C 13 28.0 . . 1 . . . . . . . . 4082 1 1458 . 1 1 134 134 LEU CD1 C 13 26.3 . . 1 . . . . . . . . 4082 1 1459 . 1 1 134 134 LEU CD2 C 13 23.4 . . 1 . . . . . . . . 4082 1 1460 . 1 1 134 134 LEU N N 15 121.8 . . 1 . . . . . . . . 4082 1 1461 . 1 1 135 135 ARG H H 1 8.75 . . 1 . . . . . . . . 4082 1 1462 . 1 1 135 135 ARG HA H 1 4.41 . . 1 . . . . . . . . 4082 1 1463 . 1 1 135 135 ARG HB2 H 1 1.88 . . 1 . . . . . . . . 4082 1 1464 . 1 1 135 135 ARG HB3 H 1 1.88 . . 1 . . . . . . . . 4082 1 1465 . 1 1 135 135 ARG HG2 H 1 1.61 . . 1 . . . . . . . . 4082 1 1466 . 1 1 135 135 ARG HG3 H 1 1.56 . . 1 . . . . . . . . 4082 1 1467 . 1 1 135 135 ARG HD2 H 1 3.11 . . 1 . . . . . . . . 4082 1 1468 . 1 1 135 135 ARG HD3 H 1 2.96 . . 1 . . . . . . . . 4082 1 1469 . 1 1 135 135 ARG CA C 13 59.9 . . 1 . . . . . . . . 4082 1 1470 . 1 1 135 135 ARG CB C 13 29.6 . . 1 . . . . . . . . 4082 1 1471 . 1 1 135 135 ARG CG C 13 27.4 . . 1 . . . . . . . . 4082 1 1472 . 1 1 135 135 ARG CD C 13 43.1 . . 1 . . . . . . . . 4082 1 1473 . 1 1 135 135 ARG N N 15 121.0 . . 1 . . . . . . . . 4082 1 1474 . 1 1 136 136 ARG H H 1 7.90 . . 1 . . . . . . . . 4082 1 1475 . 1 1 136 136 ARG HA H 1 4.16 . . 1 . . . . . . . . 4082 1 1476 . 1 1 136 136 ARG HB2 H 1 1.98 . . 1 . . . . . . . . 4082 1 1477 . 1 1 136 136 ARG HB3 H 1 1.98 . . 1 . . . . . . . . 4082 1 1478 . 1 1 136 136 ARG HG2 H 1 1.89 . . 1 . . . . . . . . 4082 1 1479 . 1 1 136 136 ARG HG3 H 1 1.67 . . 1 . . . . . . . . 4082 1 1480 . 1 1 136 136 ARG HD2 H 1 3.26 . . 1 . . . . . . . . 4082 1 1481 . 1 1 136 136 ARG HD3 H 1 3.19 . . 1 . . . . . . . . 4082 1 1482 . 1 1 136 136 ARG CA C 13 58.9 . . 1 . . . . . . . . 4082 1 1483 . 1 1 136 136 ARG CB C 13 30.2 . . 1 . . . . . . . . 4082 1 1484 . 1 1 136 136 ARG CG C 13 28.4 . . 1 . . . . . . . . 4082 1 1485 . 1 1 136 136 ARG CD C 13 43.4 . . 1 . . . . . . . . 4082 1 1486 . 1 1 136 136 ARG N N 15 120.7 . . 1 . . . . . . . . 4082 1 1487 . 1 1 137 137 SER H H 1 7.50 . . 1 . . . . . . . . 4082 1 1488 . 1 1 137 137 SER HA H 1 4.57 . . 1 . . . . . . . . 4082 1 1489 . 1 1 137 137 SER HB2 H 1 4.14 . . 1 . . . . . . . . 4082 1 1490 . 1 1 137 137 SER HB3 H 1 4.01 . . 1 . . . . . . . . 4082 1 1491 . 1 1 137 137 SER CA C 13 58.1 . . 1 . . . . . . . . 4082 1 1492 . 1 1 137 137 SER CB C 13 63.8 . . 1 . . . . . . . . 4082 1 1493 . 1 1 137 137 SER N N 15 115.4 . . 1 . . . . . . . . 4082 1 1494 . 1 1 138 138 GLN H H 1 7.74 . . 1 . . . . . . . . 4082 1 1495 . 1 1 138 138 GLN HA H 1 3.96 . . 1 . . . . . . . . 4082 1 1496 . 1 1 138 138 GLN HB2 H 1 2.19 . . 1 . . . . . . . . 4082 1 1497 . 1 1 138 138 GLN HB3 H 1 2.19 . . 1 . . . . . . . . 4082 1 1498 . 1 1 138 138 GLN HG2 H 1 2.20 . . 1 . . . . . . . . 4082 1 1499 . 1 1 138 138 GLN HG3 H 1 2.20 . . 1 . . . . . . . . 4082 1 1500 . 1 1 138 138 GLN HE21 H 1 7.45 . . 1 . . . . . . . . 4082 1 1501 . 1 1 138 138 GLN HE22 H 1 6.75 . . 1 . . . . . . . . 4082 1 1502 . 1 1 138 138 GLN CA C 13 58.0 . . 1 . . . . . . . . 4082 1 1503 . 1 1 138 138 GLN CB C 13 25.5 . . 1 . . . . . . . . 4082 1 1504 . 1 1 138 138 GLN CG C 13 34.7 . . 1 . . . . . . . . 4082 1 1505 . 1 1 138 138 GLN N N 15 111.9 . . 1 . . . . . . . . 4082 1 1506 . 1 1 138 138 GLN NE2 N 15 113.1 . . 1 . . . . . . . . 4082 1 1507 . 1 1 139 139 TYR H H 1 8.12 . . 1 . . . . . . . . 4082 1 1508 . 1 1 139 139 TYR HA H 1 4.45 . . 1 . . . . . . . . 4082 1 1509 . 1 1 139 139 TYR HB2 H 1 2.63 . . 1 . . . . . . . . 4082 1 1510 . 1 1 139 139 TYR HB3 H 1 2.63 . . 1 . . . . . . . . 4082 1 1511 . 1 1 139 139 TYR HD1 H 1 7.21 . . 1 . . . . . . . . 4082 1 1512 . 1 1 139 139 TYR HD2 H 1 7.21 . . 1 . . . . . . . . 4082 1 1513 . 1 1 139 139 TYR HE1 H 1 6.98 . . 1 . . . . . . . . 4082 1 1514 . 1 1 139 139 TYR HE2 H 1 6.98 . . 1 . . . . . . . . 4082 1 1515 . 1 1 139 139 TYR CA C 13 59.9 . . 1 . . . . . . . . 4082 1 1516 . 1 1 139 139 TYR CB C 13 41.5 . . 1 . . . . . . . . 4082 1 1517 . 1 1 139 139 TYR CD1 C 13 132.9 . . 1 . . . . . . . . 4082 1 1518 . 1 1 139 139 TYR CD2 C 13 132.9 . . 1 . . . . . . . . 4082 1 1519 . 1 1 139 139 TYR CE1 C 13 117.9 . . 1 . . . . . . . . 4082 1 1520 . 1 1 139 139 TYR CE2 C 13 117.9 . . 1 . . . . . . . . 4082 1 1521 . 1 1 139 139 TYR N N 15 124.9 . . 1 . . . . . . . . 4082 1 stop_ save_