data_6902 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6902 _Entry.Title ; Complete 1H and 15N assignment of the FK506-binding domain of human FKBP38 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-11-16 _Entry.Accession_date 2005-11-16 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details 'The data from this entry were used to determine the solution structure of hFKBP38D' _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 Mitcheell Maestre-Martinez . . . 6902 2 Frank Edlich . . . 6902 3 Franziska Jarczowski . . . 6902 4 Matthias Weiwad . . . 6902 5 Gunter Fischer . . . 6902 6 Christian Luecke . . . 6902 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6902 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 119 6902 '1H chemical shifts' 868 6902 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 3 . . 2007-06-18 2005-11-16 update author 'correct system name to hFKBP38D' 6902 2 . . 2006-05-03 2005-11-16 update author 'add author sequence code in chemical shift table' 6902 1 . . 2006-04-24 2005-11-16 original author 'original release' 6902 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6902 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16604427 _Citation.Full_citation . _Citation.Title 'NMR Structure Note: Solution structure of the FK506-binding domain of human FKBP38' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 34 _Citation.Journal_issue 3 _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 197 _Citation.Page_last 202 _Citation.Year 2006 _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 Mitcheell Maestre-Martinez . . . 6902 1 2 Frank Edlich . . . 6902 1 3 Franziska Jarczowski . . . 6902 1 4 Matthias Weiwad . . . 6902 1 5 Gunter Fischer . . . 6902 1 6 Christian Luecke . . . 6902 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID immunophilin 6902 1 PPIase 6902 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6902 _Assembly.ID 1 _Assembly.Name hFKBP38D _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 13056 _Assembly.Enzyme_commission_number . _Assembly.Details 'FK506-binding domain of human FKBP38' _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID protein 6902 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 hFKBP38D 1 $hFKBP38D . . yes native no no . . 'the N-terminal residues Met1 and Arg2 are artifacts of recombinant expression' 6902 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_hFKBP38D _Entity.Sf_category entity _Entity.Sf_framecode hFKBP38D _Entity.Entry_ID 6902 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name hFKBP38D _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 ; MREWLDILGNGLLRKKTLVP GPPGSSRPVKGQVVTVHLQT SLENGTRVQEEPELVFTLGD CDVIQALDLSVPLMDVGETA MVTADSKYCYGPQGRSPYIP PHAALCLEVTLKTAVDGPDL E ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; According to Swiss-Prot entry Q14318, the residue numbers have to be increased by 32 relative to the BMRB numbering ; _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 121 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13056 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'The N-terminal residues Met1 and Arg2 are artifacts of recombinant expression' _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 6923 . FKBP38 . . . . . 95.87 157 98.28 98.28 6.73e-74 . . . . 6902 1 2 no PDB 2AWG . "Structure Of The Ppiase Domain Of The Human Fk506-Binding Protein 8" . . . . . 95.04 118 99.13 99.13 1.55e-75 . . . . 6902 1 3 no PDB 2D9F . "Solution Structure Of Ruh-047, An Fkbp Domain From Human Cdna" . . . . . 100.00 135 97.52 97.52 1.06e-76 . . . . 6902 1 4 no PDB 2F2D . "Solution Structure Of The Fk506-Binding Domain Of Human Fkbp38" . . . . . 100.00 121 100.00 100.00 3.49e-81 . . . . 6902 1 5 no PDB 2MF9 . "Solution Structure Of The N-terminal Domain Of Human Fkbp38 (fkbp38ntd)" . . . . . 95.87 157 98.28 98.28 6.73e-74 . . . . 6902 1 6 no PDB 3EY6 . "Crystal Structure Of The Fk506-Binding Domain Of Human Fkbp38" . . . . . 100.00 121 100.00 100.00 3.49e-81 . . . . 6902 1 7 no DBJ BAD96558 . "FK506-binding protein 8 variant [Homo sapiens]" . . . . . 99.17 372 98.33 98.33 2.70e-75 . . . . 6902 1 8 no DBJ BAG36163 . "unnamed protein product [Homo sapiens]" . . . . . 99.17 356 99.17 99.17 8.64e-77 . . . . 6902 1 9 no DBJ BAG72557 . "FK506 binding protein 8 [synthetic construct]" . . . . . 99.17 413 99.17 99.17 8.89e-76 . . . . 6902 1 10 no DBJ BAH13306 . "unnamed protein product [Homo sapiens]" . . . . . 98.35 441 100.00 100.00 4.57e-77 . . . . 6902 1 11 no EMBL CAD98028 . "hypothetical protein [Homo sapiens]" . . . . . 99.17 451 97.50 97.50 2.19e-73 . . . . 6902 1 12 no EMBL CAL37783 . "hypothetical protein [synthetic construct]" . . . . . 99.17 413 99.17 99.17 9.68e-76 . . . . 6902 1 13 no GB AAB00102 . "FK-506 binding protein homologue [Homo sapiens]" . . . . . 98.35 355 100.00 100.00 1.81e-78 . . . . 6902 1 14 no GB AAC28753 . "FK-506 binding protein homologue [Homo sapiens]" . . . . . 98.35 355 100.00 100.00 1.81e-78 . . . . 6902 1 15 no GB AAH09966 . "FKBP8 protein [Homo sapiens]" . . . . . 98.35 355 100.00 100.00 1.81e-78 . . . . 6902 1 16 no GB AAI22595 . "FKBP8 protein [Bos taurus]" . . . . . 98.35 382 97.48 98.32 1.53e-75 . . . . 6902 1 17 no GB AAO39020 . "FK506-binding protein 38 [Homo sapiens]" . . . . . 98.35 412 100.00 100.00 1.54e-77 . . . . 6902 1 18 no REF NP_001247999 . "peptidyl-prolyl cis-trans isomerase FKBP8 [Macaca mulatta]" . . . . . 99.17 413 99.17 99.17 1.14e-75 . . . . 6902 1 19 no REF NP_001272500 . "FK506 binding protein 8, 38kDa [Capra hircus]" . . . . . 98.35 411 97.48 97.48 1.16e-74 . . . . 6902 1 20 no REF NP_036313 . "peptidyl-prolyl cis-trans isomerase FKBP8 [Homo sapiens]" . . . . . 99.17 413 99.17 99.17 8.89e-76 . . . . 6902 1 21 no REF XP_002761955 . "PREDICTED: peptidyl-prolyl cis-trans isomerase FKBP8 [Callithrix jacchus]" . . . . . 100.00 413 97.52 97.52 8.24e-75 . . . . 6902 1 22 no REF XP_002828980 . "PREDICTED: peptidyl-prolyl cis-trans isomerase FKBP8 isoform X3 [Pongo abelii]" . . . . . 98.35 441 100.00 100.00 4.77e-77 . . . . 6902 1 23 no SP Q14318 . "RecName: Full=Peptidyl-prolyl cis-trans isomerase FKBP8; Short=PPIase FKBP8; AltName: Full=38 kDa FK506-binding protein; Short=" . . . . . 98.35 412 100.00 100.00 1.54e-77 . . . . 6902 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID immunosuppresion 6902 1 'prolyl isomerization' 6902 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID hFKBP38D . 6902 1 stop_ loop_ _Entity_keyword.Keyword _Entity_keyword.Entry_ID _Entity_keyword.Entity_ID immunophilin 6902 1 PPIase 6902 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 33 MET . 6902 1 2 34 ARG . 6902 1 3 35 GLU . 6902 1 4 36 TRP . 6902 1 5 37 LEU . 6902 1 6 38 ASP . 6902 1 7 39 ILE . 6902 1 8 40 LEU . 6902 1 9 41 GLY . 6902 1 10 42 ASN . 6902 1 11 43 GLY . 6902 1 12 44 LEU . 6902 1 13 45 LEU . 6902 1 14 46 ARG . 6902 1 15 47 LYS . 6902 1 16 48 LYS . 6902 1 17 49 THR . 6902 1 18 50 LEU . 6902 1 19 51 VAL . 6902 1 20 52 PRO . 6902 1 21 53 GLY . 6902 1 22 54 PRO . 6902 1 23 55 PRO . 6902 1 24 56 GLY . 6902 1 25 57 SER . 6902 1 26 58 SER . 6902 1 27 59 ARG . 6902 1 28 60 PRO . 6902 1 29 61 VAL . 6902 1 30 62 LYS . 6902 1 31 63 GLY . 6902 1 32 64 GLN . 6902 1 33 65 VAL . 6902 1 34 66 VAL . 6902 1 35 67 THR . 6902 1 36 68 VAL . 6902 1 37 69 HIS . 6902 1 38 70 LEU . 6902 1 39 71 GLN . 6902 1 40 72 THR . 6902 1 41 73 SER . 6902 1 42 74 LEU . 6902 1 43 75 GLU . 6902 1 44 76 ASN . 6902 1 45 77 GLY . 6902 1 46 78 THR . 6902 1 47 79 ARG . 6902 1 48 80 VAL . 6902 1 49 81 GLN . 6902 1 50 82 GLU . 6902 1 51 83 GLU . 6902 1 52 84 PRO . 6902 1 53 85 GLU . 6902 1 54 86 LEU . 6902 1 55 87 VAL . 6902 1 56 88 PHE . 6902 1 57 89 THR . 6902 1 58 90 LEU . 6902 1 59 91 GLY . 6902 1 60 92 ASP . 6902 1 61 93 CYS . 6902 1 62 94 ASP . 6902 1 63 95 VAL . 6902 1 64 96 ILE . 6902 1 65 97 GLN . 6902 1 66 98 ALA . 6902 1 67 99 LEU . 6902 1 68 100 ASP . 6902 1 69 101 LEU . 6902 1 70 102 SER . 6902 1 71 103 VAL . 6902 1 72 104 PRO . 6902 1 73 105 LEU . 6902 1 74 106 MET . 6902 1 75 107 ASP . 6902 1 76 108 VAL . 6902 1 77 109 GLY . 6902 1 78 110 GLU . 6902 1 79 111 THR . 6902 1 80 112 ALA . 6902 1 81 113 MET . 6902 1 82 114 VAL . 6902 1 83 115 THR . 6902 1 84 116 ALA . 6902 1 85 117 ASP . 6902 1 86 118 SER . 6902 1 87 119 LYS . 6902 1 88 120 TYR . 6902 1 89 121 CYS . 6902 1 90 122 TYR . 6902 1 91 123 GLY . 6902 1 92 124 PRO . 6902 1 93 125 GLN . 6902 1 94 126 GLY . 6902 1 95 127 ARG . 6902 1 96 128 SER . 6902 1 97 129 PRO . 6902 1 98 130 TYR . 6902 1 99 131 ILE . 6902 1 100 132 PRO . 6902 1 101 133 PRO . 6902 1 102 134 HIS . 6902 1 103 135 ALA . 6902 1 104 136 ALA . 6902 1 105 137 LEU . 6902 1 106 138 CYS . 6902 1 107 139 LEU . 6902 1 108 140 GLU . 6902 1 109 141 VAL . 6902 1 110 142 THR . 6902 1 111 143 LEU . 6902 1 112 144 LYS . 6902 1 113 145 THR . 6902 1 114 146 ALA . 6902 1 115 147 VAL . 6902 1 116 148 ASP . 6902 1 117 149 GLY . 6902 1 118 150 PRO . 6902 1 119 151 ASP . 6902 1 120 152 LEU . 6902 1 121 153 GLU . 6902 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 6902 1 . ARG 2 2 6902 1 . GLU 3 3 6902 1 . TRP 4 4 6902 1 . LEU 5 5 6902 1 . ASP 6 6 6902 1 . ILE 7 7 6902 1 . LEU 8 8 6902 1 . GLY 9 9 6902 1 . ASN 10 10 6902 1 . GLY 11 11 6902 1 . LEU 12 12 6902 1 . LEU 13 13 6902 1 . ARG 14 14 6902 1 . LYS 15 15 6902 1 . LYS 16 16 6902 1 . THR 17 17 6902 1 . LEU 18 18 6902 1 . VAL 19 19 6902 1 . PRO 20 20 6902 1 . GLY 21 21 6902 1 . PRO 22 22 6902 1 . PRO 23 23 6902 1 . GLY 24 24 6902 1 . SER 25 25 6902 1 . SER 26 26 6902 1 . ARG 27 27 6902 1 . PRO 28 28 6902 1 . VAL 29 29 6902 1 . LYS 30 30 6902 1 . GLY 31 31 6902 1 . GLN 32 32 6902 1 . VAL 33 33 6902 1 . VAL 34 34 6902 1 . THR 35 35 6902 1 . VAL 36 36 6902 1 . HIS 37 37 6902 1 . LEU 38 38 6902 1 . GLN 39 39 6902 1 . THR 40 40 6902 1 . SER 41 41 6902 1 . LEU 42 42 6902 1 . GLU 43 43 6902 1 . ASN 44 44 6902 1 . GLY 45 45 6902 1 . THR 46 46 6902 1 . ARG 47 47 6902 1 . VAL 48 48 6902 1 . GLN 49 49 6902 1 . GLU 50 50 6902 1 . GLU 51 51 6902 1 . PRO 52 52 6902 1 . GLU 53 53 6902 1 . LEU 54 54 6902 1 . VAL 55 55 6902 1 . PHE 56 56 6902 1 . THR 57 57 6902 1 . LEU 58 58 6902 1 . GLY 59 59 6902 1 . ASP 60 60 6902 1 . CYS 61 61 6902 1 . ASP 62 62 6902 1 . VAL 63 63 6902 1 . ILE 64 64 6902 1 . GLN 65 65 6902 1 . ALA 66 66 6902 1 . LEU 67 67 6902 1 . ASP 68 68 6902 1 . LEU 69 69 6902 1 . SER 70 70 6902 1 . VAL 71 71 6902 1 . PRO 72 72 6902 1 . LEU 73 73 6902 1 . MET 74 74 6902 1 . ASP 75 75 6902 1 . VAL 76 76 6902 1 . GLY 77 77 6902 1 . GLU 78 78 6902 1 . THR 79 79 6902 1 . ALA 80 80 6902 1 . MET 81 81 6902 1 . VAL 82 82 6902 1 . THR 83 83 6902 1 . ALA 84 84 6902 1 . ASP 85 85 6902 1 . SER 86 86 6902 1 . LYS 87 87 6902 1 . TYR 88 88 6902 1 . CYS 89 89 6902 1 . TYR 90 90 6902 1 . GLY 91 91 6902 1 . PRO 92 92 6902 1 . GLN 93 93 6902 1 . GLY 94 94 6902 1 . ARG 95 95 6902 1 . SER 96 96 6902 1 . PRO 97 97 6902 1 . TYR 98 98 6902 1 . ILE 99 99 6902 1 . PRO 100 100 6902 1 . PRO 101 101 6902 1 . HIS 102 102 6902 1 . ALA 103 103 6902 1 . ALA 104 104 6902 1 . LEU 105 105 6902 1 . CYS 106 106 6902 1 . LEU 107 107 6902 1 . GLU 108 108 6902 1 . VAL 109 109 6902 1 . THR 110 110 6902 1 . LEU 111 111 6902 1 . LYS 112 112 6902 1 . THR 113 113 6902 1 . ALA 114 114 6902 1 . VAL 115 115 6902 1 . ASP 116 116 6902 1 . GLY 117 117 6902 1 . PRO 118 118 6902 1 . ASP 119 119 6902 1 . LEU 120 120 6902 1 . GLU 121 121 6902 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 6902 _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 $hFKBP38D . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 6902 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 6902 _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 $hFKBP38D . 'recombinant technology' . 'E. coli' . . Escherichia coli BL21(DE3) . . . . . . . . . . . . plasmid . . pET28a . . . . . . 6902 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6902 _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 hFKBP38D . . . 1 $hFKBP38D . protein 1.3 . . mM 0.1 . . . 6902 1 2 'sodium phosphate' . . . . . . buffer 20 . . mM 0.5 . . . 6902 1 3 'sodium azide' . . . . . . salt 0.05 . . % 0.001 . . . 6902 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 6902 _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 hFKBP38D [U-15N] . . 1 $hFKBP38D . protein 1.3 . . mM 0.1 . . . 6902 2 2 'sodium phosphate' . . . . . . buffer 20 . . mM 0.5 . . . 6902 2 3 'sodium azide' . . . . . . salt 0.05 . . % 0.001 . . . 6902 2 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6902 _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 6.7 0.1 pH 6902 1 temperature 298 0.1 K 6902 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 6902 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 6902 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 6902 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 6902 _Software.ID 2 _Software.Name AURELIA _Software.Version 2.5.9 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 6902 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID analysis 6902 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 6902 _Software.ID 3 _Software.Name FELIX _Software.Version 2000 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Accelrys . . 6902 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID analysis 6902 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_500MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 500MHz_spectrometer _NMR_spectrometer.Entry_ID 6902 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_700MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 700MHz_spectrometer _NMR_spectrometer.Entry_ID 6902 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_1H1H_TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H1H_TOCSY _NMR_spec_expt.Entry_ID 6902 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name 1H1H_TOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $700MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_1H1H_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H1H_NOESY _NMR_spec_expt.Entry_ID 6902 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name 1H1H_NOESY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $700MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_1H15N_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_HSQC _NMR_spec_expt.Entry_ID 6902 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name 1H15N_HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_1H15N_HTQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_HTQC _NMR_spec_expt.Entry_ID 6902 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name 1H15N_HTQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_1H15N_TOCSY_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_TOCSY_HSQC _NMR_spec_expt.Entry_ID 6902 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name 1H15N_TOCSY_HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_1H15N_NOESY_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 1H15N_NOESY_HSQC _NMR_spec_expt.Entry_ID 6902 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name 1H15N_NOESY_HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $500MHz_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $software_1 _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6902 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6902 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6902 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_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6902 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 isotropic 6902 1 . . 2 $sample_2 isotropic 6902 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 3.93 0.01 . 9 . . . . 33 MET HA . 6902 1 2 . 1 1 1 1 MET HB2 H 1 2.11 0.01 . 9 . . . . 33 MET HB2 . 6902 1 3 . 1 1 1 1 MET HB3 H 1 2.06 0.01 . 9 . . . . 33 MET HB3 . 6902 1 4 . 1 1 1 1 MET HG2 H 1 2.60 0.01 . 9 . . . . 33 MET HG2 . 6902 1 5 . 1 1 1 1 MET HG3 H 1 2.60 0.01 . 9 . . . . 33 MET HG3 . 6902 1 6 . 1 1 1 1 MET HE1 H 1 2.10 0.01 . 9 . . . . 33 MET HE . 6902 1 7 . 1 1 1 1 MET HE2 H 1 2.10 0.01 . 9 . . . . 33 MET HE . 6902 1 8 . 1 1 1 1 MET HE3 H 1 2.10 0.01 . 9 . . . . 33 MET HE . 6902 1 9 . 1 1 2 2 ARG HA H 1 4.37 0.01 . 9 . . . . 34 ARG HA . 6902 1 10 . 1 1 2 2 ARG HB2 H 1 1.90 0.01 . 9 . . . . 34 ARG HB2 . 6902 1 11 . 1 1 2 2 ARG HB3 H 1 1.77 0.01 . 9 . . . . 34 ARG HB3 . 6902 1 12 . 1 1 2 2 ARG HG2 H 1 1.68 0.01 . 9 . . . . 34 ARG HG2 . 6902 1 13 . 1 1 2 2 ARG HG3 H 1 1.63 0.01 . 9 . . . . 34 ARG HG3 . 6902 1 14 . 1 1 2 2 ARG HD2 H 1 3.22 0.01 . 9 . . . . 34 ARG HD2 . 6902 1 15 . 1 1 2 2 ARG HD3 H 1 3.20 0.01 . 9 . . . . 34 ARG HD3 . 6902 1 16 . 1 1 3 3 GLU H H 1 8.60 0.01 . 1 . . . . 35 GLU H . 6902 1 17 . 1 1 3 3 GLU HA H 1 4.25 0.01 . 1 . . . . 35 GLU HA . 6902 1 18 . 1 1 3 3 GLU HB2 H 1 1.95 0.01 . 1 . . . . 35 GLU HB2 . 6902 1 19 . 1 1 3 3 GLU HB3 H 1 2.06 0.01 . 1 . . . . 35 GLU HB3 . 6902 1 20 . 1 1 3 3 GLU HG2 H 1 2.26 0.01 . 2 . . . . 35 GLU HG2 . 6902 1 21 . 1 1 3 3 GLU HG3 H 1 2.09 0.01 . 2 . . . . 35 GLU HG3 . 6902 1 22 . 1 1 3 3 GLU N N 15 121.3 0.1 . 9 . . . . 35 GLU N . 6902 1 23 . 1 1 4 4 TRP H H 1 8.29 0.01 . 1 . . . . 36 TRP H . 6902 1 24 . 1 1 4 4 TRP HA H 1 4.63 0.01 . 1 . . . . 36 TRP HA . 6902 1 25 . 1 1 4 4 TRP HB2 H 1 3.09 0.01 . 1 . . . . 36 TRP HB2 . 6902 1 26 . 1 1 4 4 TRP HB3 H 1 2.87 0.01 . 1 . . . . 36 TRP HB3 . 6902 1 27 . 1 1 4 4 TRP HD1 H 1 7.33 0.01 . 1 . . . . 36 TRP HD1 . 6902 1 28 . 1 1 4 4 TRP HE1 H 1 10.15 0.01 . 1 . . . . 36 TRP HE1 . 6902 1 29 . 1 1 4 4 TRP HE3 H 1 7.22 0.01 . 1 . . . . 36 TRP HE3 . 6902 1 30 . 1 1 4 4 TRP HZ2 H 1 7.45 0.01 . 1 . . . . 36 TRP HZ2 . 6902 1 31 . 1 1 4 4 TRP HZ3 H 1 7.00 0.01 . 1 . . . . 36 TRP HZ3 . 6902 1 32 . 1 1 4 4 TRP HH2 H 1 7.00 0.01 . 1 . . . . 36 TRP HH2 . 6902 1 33 . 1 1 4 4 TRP N N 15 119.2 0.1 . 1 . . . . 36 TRP N . 6902 1 34 . 1 1 4 4 TRP NE1 N 15 129.5 0.1 . 1 . . . . 36 TRP NE1 . 6902 1 35 . 1 1 5 5 LEU H H 1 9.62 0.01 . 1 . . . . 37 LEU H . 6902 1 36 . 1 1 5 5 LEU HA H 1 4.60 0.01 . 1 . . . . 37 LEU HA . 6902 1 37 . 1 1 5 5 LEU HB2 H 1 1.71 0.01 . 1 . . . . 37 LEU HB2 . 6902 1 38 . 1 1 5 5 LEU HB3 H 1 1.94 0.01 . 1 . . . . 37 LEU HB3 . 6902 1 39 . 1 1 5 5 LEU HG H 1 1.48 0.01 . 1 . . . . 37 LEU HG . 6902 1 40 . 1 1 5 5 LEU HD11 H 1 0.99 0.01 . 2 . . . . 37 LEU HD1 . 6902 1 41 . 1 1 5 5 LEU HD12 H 1 0.99 0.01 . 2 . . . . 37 LEU HD1 . 6902 1 42 . 1 1 5 5 LEU HD13 H 1 0.99 0.01 . 2 . . . . 37 LEU HD1 . 6902 1 43 . 1 1 5 5 LEU HD21 H 1 0.95 0.01 . 2 . . . . 37 LEU HD2 . 6902 1 44 . 1 1 5 5 LEU HD22 H 1 0.95 0.01 . 2 . . . . 37 LEU HD2 . 6902 1 45 . 1 1 5 5 LEU HD23 H 1 0.95 0.01 . 2 . . . . 37 LEU HD2 . 6902 1 46 . 1 1 5 5 LEU N N 15 126.3 0.1 . 1 . . . . 37 LEU N . 6902 1 47 . 1 1 6 6 ASP H H 1 9.00 0.01 . 1 . . . . 38 ASP H . 6902 1 48 . 1 1 6 6 ASP HA H 1 4.78 0.01 . 1 . . . . 38 ASP HA . 6902 1 49 . 1 1 6 6 ASP HB2 H 1 3.12 0.01 . 2 . . . . 38 ASP HB2 . 6902 1 50 . 1 1 6 6 ASP HB3 H 1 2.57 0.01 . 2 . . . . 38 ASP HB3 . 6902 1 51 . 1 1 6 6 ASP N N 15 127.5 0.1 . 1 . . . . 38 ASP N . 6902 1 52 . 1 1 7 7 ILE H H 1 8.33 0.01 . 1 . . . . 39 ILE H . 6902 1 53 . 1 1 7 7 ILE HA H 1 3.47 0.01 . 1 . . . . 39 ILE HA . 6902 1 54 . 1 1 7 7 ILE HB H 1 1.60 0.01 . 1 . . . . 39 ILE HB . 6902 1 55 . 1 1 7 7 ILE HG12 H 1 1.79 0.01 . 1 . . . . 39 ILE HG12 . 6902 1 56 . 1 1 7 7 ILE HG13 H 1 1.79 0.01 . 1 . . . . 39 ILE HG13 . 6902 1 57 . 1 1 7 7 ILE HG21 H 1 0.77 0.01 . 1 . . . . 39 ILE HG2 . 6902 1 58 . 1 1 7 7 ILE HG22 H 1 0.77 0.01 . 1 . . . . 39 ILE HG2 . 6902 1 59 . 1 1 7 7 ILE HG23 H 1 0.77 0.01 . 1 . . . . 39 ILE HG2 . 6902 1 60 . 1 1 7 7 ILE HD11 H 1 0.73 0.01 . 1 . . . . 39 ILE HD1 . 6902 1 61 . 1 1 7 7 ILE HD12 H 1 0.73 0.01 . 1 . . . . 39 ILE HD1 . 6902 1 62 . 1 1 7 7 ILE HD13 H 1 0.73 0.01 . 1 . . . . 39 ILE HD1 . 6902 1 63 . 1 1 7 7 ILE N N 15 124.9 0.1 . 1 . . . . 39 ILE N . 6902 1 64 . 1 1 8 8 LEU H H 1 8.62 0.01 . 1 . . . . 40 LEU H . 6902 1 65 . 1 1 8 8 LEU HA H 1 4.60 0.01 . 1 . . . . 40 LEU HA . 6902 1 66 . 1 1 8 8 LEU HB2 H 1 1.80 0.01 . 2 . . . . 40 LEU HB2 . 6902 1 67 . 1 1 8 8 LEU HB3 H 1 1.60 0.01 . 2 . . . . 40 LEU HB3 . 6902 1 68 . 1 1 8 8 LEU HG H 1 1.35 0.01 . 1 . . . . 40 LEU HG . 6902 1 69 . 1 1 8 8 LEU HD11 H 1 0.81 0.01 . 1 . . . . 40 LEU HD1 . 6902 1 70 . 1 1 8 8 LEU HD12 H 1 0.81 0.01 . 1 . . . . 40 LEU HD1 . 6902 1 71 . 1 1 8 8 LEU HD13 H 1 0.81 0.01 . 1 . . . . 40 LEU HD1 . 6902 1 72 . 1 1 8 8 LEU HD21 H 1 0.58 0.01 . 1 . . . . 40 LEU HD2 . 6902 1 73 . 1 1 8 8 LEU HD22 H 1 0.58 0.01 . 1 . . . . 40 LEU HD2 . 6902 1 74 . 1 1 8 8 LEU HD23 H 1 0.58 0.01 . 1 . . . . 40 LEU HD2 . 6902 1 75 . 1 1 8 8 LEU N N 15 114.9 0.1 . 1 . . . . 40 LEU N . 6902 1 76 . 1 1 9 9 GLY H H 1 7.58 0.01 . 1 . . . . 41 GLY H . 6902 1 77 . 1 1 9 9 GLY HA2 H 1 4.12 0.01 . 2 . . . . 41 GLY HA2 . 6902 1 78 . 1 1 9 9 GLY HA3 H 1 3.60 0.01 . 2 . . . . 41 GLY HA3 . 6902 1 79 . 1 1 9 9 GLY N N 15 108.2 0.1 . 1 . . . . 41 GLY N . 6902 1 80 . 1 1 10 10 ASN H H 1 7.07 0.01 . 1 . . . . 42 ASN H . 6902 1 81 . 1 1 10 10 ASN HA H 1 4.86 0.01 . 1 . . . . 42 ASN HA . 6902 1 82 . 1 1 10 10 ASN HB2 H 1 2.77 0.01 . 1 . . . . 42 ASN HB2 . 6902 1 83 . 1 1 10 10 ASN HB3 H 1 3.29 0.01 . 1 . . . . 42 ASN HB3 . 6902 1 84 . 1 1 10 10 ASN HD21 H 1 6.51 0.01 . 1 . . . . 42 ASN HD21 . 6902 1 85 . 1 1 10 10 ASN HD22 H 1 7.89 0.01 . 1 . . . . 42 ASN HD22 . 6902 1 86 . 1 1 10 10 ASN N N 15 114.1 0.1 . 1 . . . . 42 ASN N . 6902 1 87 . 1 1 10 10 ASN ND2 N 15 110.6 0.1 . 1 . . . . 42 ASN ND2 . 6902 1 88 . 1 1 11 11 GLY H H 1 9.84 0.01 . 1 . . . . 43 GLY H . 6902 1 89 . 1 1 11 11 GLY HA2 H 1 4.05 0.01 . 1 . . . . 43 GLY HA2 . 6902 1 90 . 1 1 11 11 GLY HA3 H 1 3.47 0.01 . 1 . . . . 43 GLY HA3 . 6902 1 91 . 1 1 11 11 GLY N N 15 111.3 0.1 . 1 . . . . 43 GLY N . 6902 1 92 . 1 1 12 12 LEU H H 1 7.68 0.01 . 1 . . . . 44 LEU H . 6902 1 93 . 1 1 12 12 LEU HA H 1 4.37 0.01 . 1 . . . . 44 LEU HA . 6902 1 94 . 1 1 12 12 LEU HB2 H 1 1.69 0.01 . 1 . . . . 44 LEU HB2 . 6902 1 95 . 1 1 12 12 LEU HB3 H 1 1.95 0.01 . 1 . . . . 44 LEU HB3 . 6902 1 96 . 1 1 12 12 LEU HG H 1 1.57 0.01 . 1 . . . . 44 LEU HG . 6902 1 97 . 1 1 12 12 LEU HD11 H 1 0.94 0.01 . 1 . . . . 44 LEU HD1 . 6902 1 98 . 1 1 12 12 LEU HD12 H 1 0.94 0.01 . 1 . . . . 44 LEU HD1 . 6902 1 99 . 1 1 12 12 LEU HD13 H 1 0.94 0.01 . 1 . . . . 44 LEU HD1 . 6902 1 100 . 1 1 12 12 LEU HD21 H 1 0.83 0.01 . 1 . . . . 44 LEU HD2 . 6902 1 101 . 1 1 12 12 LEU HD22 H 1 0.83 0.01 . 1 . . . . 44 LEU HD2 . 6902 1 102 . 1 1 12 12 LEU HD23 H 1 0.83 0.01 . 1 . . . . 44 LEU HD2 . 6902 1 103 . 1 1 12 12 LEU N N 15 117.7 0.1 . 1 . . . . 44 LEU N . 6902 1 104 . 1 1 13 13 LEU H H 1 8.33 0.01 . 1 . . . . 45 LEU H . 6902 1 105 . 1 1 13 13 LEU HA H 1 5.22 0.01 . 1 . . . . 45 LEU HA . 6902 1 106 . 1 1 13 13 LEU HB2 H 1 1.68 0.01 . 1 . . . . 45 LEU HB2 . 6902 1 107 . 1 1 13 13 LEU HB3 H 1 1.68 0.01 . 1 . . . . 45 LEU HB3 . 6902 1 108 . 1 1 13 13 LEU HG H 1 1.27 0.01 . 1 . . . . 45 LEU HG . 6902 1 109 . 1 1 13 13 LEU HD11 H 1 0.79 0.01 . 1 . . . . 45 LEU HD1 . 6902 1 110 . 1 1 13 13 LEU HD12 H 1 0.79 0.01 . 1 . . . . 45 LEU HD1 . 6902 1 111 . 1 1 13 13 LEU HD13 H 1 0.79 0.01 . 1 . . . . 45 LEU HD1 . 6902 1 112 . 1 1 13 13 LEU HD21 H 1 0.50 0.01 . 1 . . . . 45 LEU HD2 . 6902 1 113 . 1 1 13 13 LEU HD22 H 1 0.50 0.01 . 1 . . . . 45 LEU HD2 . 6902 1 114 . 1 1 13 13 LEU HD23 H 1 0.50 0.01 . 1 . . . . 45 LEU HD2 . 6902 1 115 . 1 1 13 13 LEU N N 15 123.9 0.1 . 1 . . . . 45 LEU N . 6902 1 116 . 1 1 14 14 ARG H H 1 8.86 0.01 . 1 . . . . 46 ARG H . 6902 1 117 . 1 1 14 14 ARG HA H 1 5.90 0.01 . 1 . . . . 46 ARG HA . 6902 1 118 . 1 1 14 14 ARG HB2 H 1 1.78 0.01 . 1 . . . . 46 ARG HB2 . 6902 1 119 . 1 1 14 14 ARG HB3 H 1 1.78 0.01 . 1 . . . . 46 ARG HB3 . 6902 1 120 . 1 1 14 14 ARG HG2 H 1 1.32 0.01 . 1 . . . . 46 ARG HG2 . 6902 1 121 . 1 1 14 14 ARG HG3 H 1 1.32 0.01 . 1 . . . . 46 ARG HG3 . 6902 1 122 . 1 1 14 14 ARG HD2 H 1 2.74 0.01 . 1 . . . . 46 ARG HD2 . 6902 1 123 . 1 1 14 14 ARG HD3 H 1 2.74 0.01 . 1 . . . . 46 ARG HD3 . 6902 1 124 . 1 1 14 14 ARG HE H 1 6.40 0.01 . 1 . . . . 46 ARG HE . 6902 1 125 . 1 1 14 14 ARG N N 15 125.5 0.1 . 1 . . . . 46 ARG N . 6902 1 126 . 1 1 14 14 ARG NE N 15 82.6 0.1 . 1 . . . . 46 ARG NE . 6902 1 127 . 1 1 15 15 LYS H H 1 9.04 0.01 . 1 . . . . 47 LYS H . 6902 1 128 . 1 1 15 15 LYS HA H 1 5.95 0.01 . 1 . . . . 47 LYS HA . 6902 1 129 . 1 1 15 15 LYS HB2 H 1 1.79 0.01 . 2 . . . . 47 LYS HB2 . 6902 1 130 . 1 1 15 15 LYS HB3 H 1 1.75 0.01 . 2 . . . . 47 LYS HB3 . 6902 1 131 . 1 1 15 15 LYS HG2 H 1 1.36 0.01 . 1 . . . . 47 LYS HG2 . 6902 1 132 . 1 1 15 15 LYS HG3 H 1 1.36 0.01 . 1 . . . . 47 LYS HG3 . 6902 1 133 . 1 1 15 15 LYS HD2 H 1 1.44 0.01 . 1 . . . . 47 LYS HD2 . 6902 1 134 . 1 1 15 15 LYS HD3 H 1 1.49 0.01 . 1 . . . . 47 LYS HD3 . 6902 1 135 . 1 1 15 15 LYS HE2 H 1 2.61 0.01 . 2 . . . . 47 LYS HE2 . 6902 1 136 . 1 1 15 15 LYS HE3 H 1 2.55 0.01 . 2 . . . . 47 LYS HE3 . 6902 1 137 . 1 1 15 15 LYS N N 15 120.8 0.1 . 1 . . . . 47 LYS N . 6902 1 138 . 1 1 16 16 LYS H H 1 9.58 0.01 . 1 . . . . 48 LYS H . 6902 1 139 . 1 1 16 16 LYS HA H 1 4.62 0.01 . 1 . . . . 48 LYS HA . 6902 1 140 . 1 1 16 16 LYS HB2 H 1 0.60 0.01 . 1 . . . . 48 LYS HB2 . 6902 1 141 . 1 1 16 16 LYS HB3 H 1 0.57 0.01 . 1 . . . . 48 LYS HB3 . 6902 1 142 . 1 1 16 16 LYS HG2 H 1 0.10 0.01 . 1 . . . . 48 LYS HG2 . 6902 1 143 . 1 1 16 16 LYS HG3 H 1 0.10 0.01 . 1 . . . . 48 LYS HG3 . 6902 1 144 . 1 1 16 16 LYS HD2 H 1 0.64 0.01 . 1 . . . . 48 LYS HD2 . 6902 1 145 . 1 1 16 16 LYS HD3 H 1 0.72 0.01 . 1 . . . . 48 LYS HD3 . 6902 1 146 . 1 1 16 16 LYS HE2 H 1 2.17 0.01 . 1 . . . . 48 LYS HE2 . 6902 1 147 . 1 1 16 16 LYS HE3 H 1 2.37 0.01 . 1 . . . . 48 LYS HE3 . 6902 1 148 . 1 1 16 16 LYS N N 15 129.9 0.1 . 1 . . . . 48 LYS N . 6902 1 149 . 1 1 17 17 THR H H 1 9.13 0.01 . 1 . . . . 49 THR H . 6902 1 150 . 1 1 17 17 THR HA H 1 3.93 0.01 . 1 . . . . 49 THR HA . 6902 1 151 . 1 1 17 17 THR HB H 1 3.80 0.01 . 1 . . . . 49 THR HB . 6902 1 152 . 1 1 17 17 THR HG21 H 1 1.02 0.01 . 1 . . . . 49 THR HG2 . 6902 1 153 . 1 1 17 17 THR HG22 H 1 1.02 0.01 . 1 . . . . 49 THR HG2 . 6902 1 154 . 1 1 17 17 THR HG23 H 1 1.02 0.01 . 1 . . . . 49 THR HG2 . 6902 1 155 . 1 1 17 17 THR N N 15 125.9 0.1 . 1 . . . . 49 THR N . 6902 1 156 . 1 1 18 18 LEU H H 1 9.14 0.01 . 1 . . . . 50 LEU H . 6902 1 157 . 1 1 18 18 LEU HA H 1 4.43 0.01 . 1 . . . . 50 LEU HA . 6902 1 158 . 1 1 18 18 LEU HB2 H 1 1.45 0.01 . 1 . . . . 50 LEU HB2 . 6902 1 159 . 1 1 18 18 LEU HB3 H 1 1.45 0.01 . 1 . . . . 50 LEU HB3 . 6902 1 160 . 1 1 18 18 LEU HG H 1 1.57 0.01 . 1 . . . . 50 LEU HG . 6902 1 161 . 1 1 18 18 LEU HD11 H 1 0.82 0.01 . 1 . . . . 50 LEU HD1 . 6902 1 162 . 1 1 18 18 LEU HD12 H 1 0.82 0.01 . 1 . . . . 50 LEU HD1 . 6902 1 163 . 1 1 18 18 LEU HD13 H 1 0.82 0.01 . 1 . . . . 50 LEU HD1 . 6902 1 164 . 1 1 18 18 LEU HD21 H 1 0.72 0.01 . 1 . . . . 50 LEU HD2 . 6902 1 165 . 1 1 18 18 LEU HD22 H 1 0.72 0.01 . 1 . . . . 50 LEU HD2 . 6902 1 166 . 1 1 18 18 LEU HD23 H 1 0.72 0.01 . 1 . . . . 50 LEU HD2 . 6902 1 167 . 1 1 18 18 LEU N N 15 128.1 0.1 . 1 . . . . 50 LEU N . 6902 1 168 . 1 1 19 19 VAL H H 1 8.17 0.01 . 1 . . . . 51 VAL H . 6902 1 169 . 1 1 19 19 VAL HA H 1 4.49 0.01 . 1 . . . . 51 VAL HA . 6902 1 170 . 1 1 19 19 VAL HB H 1 2.07 0.01 . 1 . . . . 51 VAL HB . 6902 1 171 . 1 1 19 19 VAL HG11 H 1 1.05 0.01 . 1 . . . . 51 VAL HG1 . 6902 1 172 . 1 1 19 19 VAL HG12 H 1 1.05 0.01 . 1 . . . . 51 VAL HG1 . 6902 1 173 . 1 1 19 19 VAL HG13 H 1 1.05 0.01 . 1 . . . . 51 VAL HG1 . 6902 1 174 . 1 1 19 19 VAL HG21 H 1 0.89 0.01 . 1 . . . . 51 VAL HG2 . 6902 1 175 . 1 1 19 19 VAL HG22 H 1 0.89 0.01 . 1 . . . . 51 VAL HG2 . 6902 1 176 . 1 1 19 19 VAL HG23 H 1 0.89 0.01 . 1 . . . . 51 VAL HG2 . 6902 1 177 . 1 1 19 19 VAL N N 15 120.0 0.1 . 1 . . . . 51 VAL N . 6902 1 178 . 1 1 20 20 PRO HA H 1 4.37 0.01 . 1 . . . . 52 PRO HA . 6902 1 179 . 1 1 20 20 PRO HB2 H 1 2.30 0.01 . 1 . . . . 52 PRO HB2 . 6902 1 180 . 1 1 20 20 PRO HB3 H 1 2.30 0.01 . 1 . . . . 52 PRO HB3 . 6902 1 181 . 1 1 20 20 PRO HG2 H 1 2.02 0.01 . 1 . . . . 52 PRO HG2 . 6902 1 182 . 1 1 20 20 PRO HG3 H 1 1.91 0.01 . 1 . . . . 52 PRO HG3 . 6902 1 183 . 1 1 20 20 PRO HD2 H 1 3.57 0.01 . 1 . . . . 52 PRO HD2 . 6902 1 184 . 1 1 20 20 PRO HD3 H 1 3.78 0.01 . 1 . . . . 52 PRO HD3 . 6902 1 185 . 1 1 21 21 GLY H H 1 9.22 0.01 . 1 . . . . 53 GLY H . 6902 1 186 . 1 1 21 21 GLY HA2 H 1 3.43 0.01 . 1 . . . . 53 GLY HA2 . 6902 1 187 . 1 1 21 21 GLY HA3 H 1 4.01 0.01 . 1 . . . . 53 GLY HA3 . 6902 1 188 . 1 1 21 21 GLY N N 15 107.2 0.1 . 1 . . . . 53 GLY N . 6902 1 189 . 1 1 22 22 PRO HA H 1 4.71 0.01 . 1 . . . . 54 PRO HA . 6902 1 190 . 1 1 22 22 PRO HB2 H 1 2.34 0.01 . 1 . . . . 54 PRO HB2 . 6902 1 191 . 1 1 22 22 PRO HB3 H 1 2.34 0.01 . 1 . . . . 54 PRO HB3 . 6902 1 192 . 1 1 22 22 PRO HG2 H 1 2.10 0.01 . 2 . . . . 54 PRO HG2 . 6902 1 193 . 1 1 22 22 PRO HG3 H 1 1.97 0.01 . 2 . . . . 54 PRO HG3 . 6902 1 194 . 1 1 22 22 PRO HD2 H 1 3.74 0.01 . 1 . . . . 54 PRO HD2 . 6902 1 195 . 1 1 22 22 PRO HD3 H 1 3.74 0.01 . 1 . . . . 54 PRO HD3 . 6902 1 196 . 1 1 23 23 PRO HA H 1 4.37 0.01 . 1 . . . . 55 PRO HA . 6902 1 197 . 1 1 23 23 PRO HB2 H 1 2.30 0.01 . 2 . . . . 55 PRO HB2 . 6902 1 198 . 1 1 23 23 PRO HB3 H 1 1.87 0.01 . 2 . . . . 55 PRO HB3 . 6902 1 199 . 1 1 23 23 PRO HG2 H 1 2.12 0.01 . 2 . . . . 55 PRO HG2 . 6902 1 200 . 1 1 23 23 PRO HG3 H 1 2.01 0.01 . 2 . . . . 55 PRO HG3 . 6902 1 201 . 1 1 23 23 PRO HD2 H 1 3.58 0.01 . 1 . . . . 55 PRO HD2 . 6902 1 202 . 1 1 23 23 PRO HD3 H 1 3.85 0.01 . 1 . . . . 55 PRO HD3 . 6902 1 203 . 1 1 24 24 GLY H H 1 8.88 0.01 . 1 . . . . 56 GLY H . 6902 1 204 . 1 1 24 24 GLY HA2 H 1 4.17 0.01 . 2 . . . . 56 GLY HA2 . 6902 1 205 . 1 1 24 24 GLY HA3 H 1 3.73 0.01 . 2 . . . . 56 GLY HA3 . 6902 1 206 . 1 1 24 24 GLY N N 15 112.5 0.1 . 1 . . . . 56 GLY N . 6902 1 207 . 1 1 25 25 SER H H 1 7.83 0.01 . 1 . . . . 57 SER H . 6902 1 208 . 1 1 25 25 SER HA H 1 4.34 0.01 . 1 . . . . 57 SER HA . 6902 1 209 . 1 1 25 25 SER HB2 H 1 4.05 0.01 . 2 . . . . 57 SER HB2 . 6902 1 210 . 1 1 25 25 SER HB3 H 1 3.95 0.01 . 2 . . . . 57 SER HB3 . 6902 1 211 . 1 1 25 25 SER HG H 1 6.01 0.01 . 1 . . . . 57 SER HG . 6902 1 212 . 1 1 25 25 SER N N 15 115.9 0.1 . 1 . . . . 57 SER N . 6902 1 213 . 1 1 26 26 SER H H 1 8.26 0.01 . 1 . . . . 58 SER H . 6902 1 214 . 1 1 26 26 SER HA H 1 4.77 0.01 . 1 . . . . 58 SER HA . 6902 1 215 . 1 1 26 26 SER HB2 H 1 3.79 0.01 . 1 . . . . 58 SER HB2 . 6902 1 216 . 1 1 26 26 SER HB3 H 1 3.87 0.01 . 1 . . . . 58 SER HB3 . 6902 1 217 . 1 1 26 26 SER N N 15 116.2 0.1 . 1 . . . . 58 SER N . 6902 1 218 . 1 1 27 27 ARG H H 1 8.06 0.01 . 1 . . . . 59 ARG H . 6902 1 219 . 1 1 27 27 ARG HA H 1 5.21 0.01 . 1 . . . . 59 ARG HA . 6902 1 220 . 1 1 27 27 ARG HB2 H 1 1.52 0.01 . 1 . . . . 59 ARG HB2 . 6902 1 221 . 1 1 27 27 ARG HB3 H 1 1.91 0.01 . 1 . . . . 59 ARG HB3 . 6902 1 222 . 1 1 27 27 ARG HG2 H 1 1.54 0.01 . 1 . . . . 59 ARG HG2 . 6902 1 223 . 1 1 27 27 ARG HG3 H 1 1.76 0.01 . 1 . . . . 59 ARG HG3 . 6902 1 224 . 1 1 27 27 ARG HD2 H 1 3.06 0.01 . 1 . . . . 59 ARG HD2 . 6902 1 225 . 1 1 27 27 ARG HD3 H 1 3.18 0.01 . 1 . . . . 59 ARG HD3 . 6902 1 226 . 1 1 27 27 ARG HE H 1 7.07 0.01 . 1 . . . . 59 ARG HE . 6902 1 227 . 1 1 27 27 ARG N N 15 120.8 0.1 . 1 . . . . 59 ARG N . 6902 1 228 . 1 1 27 27 ARG NE N 15 86.3 0.1 . 1 . . . . 59 ARG NE . 6902 1 229 . 1 1 28 28 PRO HA H 1 4.67 0.01 . 1 . . . . 60 PRO HA . 6902 1 230 . 1 1 28 28 PRO HB2 H 1 1.63 0.01 . 1 . . . . 60 PRO HB2 . 6902 1 231 . 1 1 28 28 PRO HB3 H 1 1.63 0.01 . 1 . . . . 60 PRO HB3 . 6902 1 232 . 1 1 28 28 PRO HG2 H 1 1.69 0.01 . 1 . . . . 60 PRO HG2 . 6902 1 233 . 1 1 28 28 PRO HG3 H 1 1.69 0.01 . 1 . . . . 60 PRO HG3 . 6902 1 234 . 1 1 28 28 PRO HD2 H 1 4.03 0.01 . 1 . . . . 60 PRO HD2 . 6902 1 235 . 1 1 28 28 PRO HD3 H 1 3.70 0.01 . 1 . . . . 60 PRO HD3 . 6902 1 236 . 1 1 29 29 VAL H H 1 8.02 0.01 . 1 . . . . 61 VAL H . 6902 1 237 . 1 1 29 29 VAL HA H 1 4.45 0.01 . 1 . . . . 61 VAL HA . 6902 1 238 . 1 1 29 29 VAL HB H 1 2.03 0.01 . 1 . . . . 61 VAL HB . 6902 1 239 . 1 1 29 29 VAL HG11 H 1 0.91 0.01 . 1 . . . . 61 VAL HG1 . 6902 1 240 . 1 1 29 29 VAL HG12 H 1 0.91 0.01 . 1 . . . . 61 VAL HG1 . 6902 1 241 . 1 1 29 29 VAL HG13 H 1 0.91 0.01 . 1 . . . . 61 VAL HG1 . 6902 1 242 . 1 1 29 29 VAL HG21 H 1 0.76 0.01 . 1 . . . . 61 VAL HG2 . 6902 1 243 . 1 1 29 29 VAL HG22 H 1 0.76 0.01 . 1 . . . . 61 VAL HG2 . 6902 1 244 . 1 1 29 29 VAL HG23 H 1 0.76 0.01 . 1 . . . . 61 VAL HG2 . 6902 1 245 . 1 1 29 29 VAL N N 15 113.6 0.1 . 1 . . . . 61 VAL N . 6902 1 246 . 1 1 30 30 LYS H H 1 8.27 0.01 . 1 . . . . 62 LYS H . 6902 1 247 . 1 1 30 30 LYS HA H 1 3.61 0.01 . 1 . . . . 62 LYS HA . 6902 1 248 . 1 1 30 30 LYS HB2 H 1 1.82 0.01 . 1 . . . . 62 LYS HB2 . 6902 1 249 . 1 1 30 30 LYS HB3 H 1 1.68 0.01 . 1 . . . . 62 LYS HB3 . 6902 1 250 . 1 1 30 30 LYS HG2 H 1 1.33 0.01 . 1 . . . . 62 LYS HG2 . 6902 1 251 . 1 1 30 30 LYS HG3 H 1 1.50 0.01 . 1 . . . . 62 LYS HG3 . 6902 1 252 . 1 1 30 30 LYS HD2 H 1 1.75 0.01 . 2 . . . . 62 LYS HD2 . 6902 1 253 . 1 1 30 30 LYS HD3 H 1 1.69 0.01 . 2 . . . . 62 LYS HD3 . 6902 1 254 . 1 1 30 30 LYS HE2 H 1 3.03 0.01 . 1 . . . . 62 LYS HE2 . 6902 1 255 . 1 1 30 30 LYS HE3 H 1 3.03 0.01 . 1 . . . . 62 LYS HE3 . 6902 1 256 . 1 1 30 30 LYS N N 15 122.0 0.1 . 1 . . . . 62 LYS N . 6902 1 257 . 1 1 31 31 GLY H H 1 8.71 0.01 . 1 . . . . 63 GLY H . 6902 1 258 . 1 1 31 31 GLY HA2 H 1 4.44 0.01 . 1 . . . . 63 GLY HA2 . 6902 1 259 . 1 1 31 31 GLY HA3 H 1 3.49 0.01 . 1 . . . . 63 GLY HA3 . 6902 1 260 . 1 1 31 31 GLY N N 15 114.1 0.1 . 1 . . . . 63 GLY N . 6902 1 261 . 1 1 32 32 GLN H H 1 8.16 0.01 . 1 . . . . 64 GLN H . 6902 1 262 . 1 1 32 32 GLN HA H 1 4.48 0.01 . 1 . . . . 64 GLN HA . 6902 1 263 . 1 1 32 32 GLN HB2 H 1 2.26 0.01 . 2 . . . . 64 GLN HB2 . 6902 1 264 . 1 1 32 32 GLN HB3 H 1 2.24 0.01 . 2 . . . . 64 GLN HB3 . 6902 1 265 . 1 1 32 32 GLN HG2 H 1 2.50 0.01 . 1 . . . . 64 GLN HG2 . 6902 1 266 . 1 1 32 32 GLN HG3 H 1 2.50 0.01 . 1 . . . . 64 GLN HG3 . 6902 1 267 . 1 1 32 32 GLN HE21 H 1 7.28 0.01 . 1 . . . . 64 GLN HE21 . 6902 1 268 . 1 1 32 32 GLN HE22 H 1 6.32 0.01 . 1 . . . . 64 GLN HE22 . 6902 1 269 . 1 1 32 32 GLN N N 15 117.9 0.1 . 1 . . . . 64 GLN N . 6902 1 270 . 1 1 32 32 GLN NE2 N 15 110.1 0.1 . 1 . . . . 64 GLN NE2 . 6902 1 271 . 1 1 33 33 VAL H H 1 8.89 0.01 . 1 . . . . 65 VAL H . 6902 1 272 . 1 1 33 33 VAL HA H 1 4.25 0.01 . 1 . . . . 65 VAL HA . 6902 1 273 . 1 1 33 33 VAL HB H 1 1.79 0.01 . 1 . . . . 65 VAL HB . 6902 1 274 . 1 1 33 33 VAL HG11 H 1 0.63 0.01 . 1 . . . . 65 VAL HG1 . 6902 1 275 . 1 1 33 33 VAL HG12 H 1 0.63 0.01 . 1 . . . . 65 VAL HG1 . 6902 1 276 . 1 1 33 33 VAL HG13 H 1 0.63 0.01 . 1 . . . . 65 VAL HG1 . 6902 1 277 . 1 1 33 33 VAL HG21 H 1 0.91 0.01 . 1 . . . . 65 VAL HG2 . 6902 1 278 . 1 1 33 33 VAL HG22 H 1 0.91 0.01 . 1 . . . . 65 VAL HG2 . 6902 1 279 . 1 1 33 33 VAL HG23 H 1 0.91 0.01 . 1 . . . . 65 VAL HG2 . 6902 1 280 . 1 1 33 33 VAL N N 15 121.9 0.1 . 1 . . . . 65 VAL N . 6902 1 281 . 1 1 34 34 VAL H H 1 9.22 0.01 . 1 . . . . 66 VAL H . 6902 1 282 . 1 1 34 34 VAL HA H 1 5.06 0.01 . 1 . . . . 66 VAL HA . 6902 1 283 . 1 1 34 34 VAL HB H 1 1.69 0.01 . 1 . . . . 66 VAL HB . 6902 1 284 . 1 1 34 34 VAL HG11 H 1 0.67 0.01 . 1 . . . . 66 VAL HG1 . 6902 1 285 . 1 1 34 34 VAL HG12 H 1 0.67 0.01 . 1 . . . . 66 VAL HG1 . 6902 1 286 . 1 1 34 34 VAL HG13 H 1 0.67 0.01 . 1 . . . . 66 VAL HG1 . 6902 1 287 . 1 1 34 34 VAL HG21 H 1 0.02 0.01 . 1 . . . . 66 VAL HG2 . 6902 1 288 . 1 1 34 34 VAL HG22 H 1 0.02 0.01 . 1 . . . . 66 VAL HG2 . 6902 1 289 . 1 1 34 34 VAL HG23 H 1 0.02 0.01 . 1 . . . . 66 VAL HG2 . 6902 1 290 . 1 1 34 34 VAL N N 15 125.0 0.1 . 1 . . . . 66 VAL N . 6902 1 291 . 1 1 35 35 THR H H 1 7.86 0.01 . 1 . . . . 67 THR H . 6902 1 292 . 1 1 35 35 THR HA H 1 5.29 0.01 . 1 . . . . 67 THR HA . 6902 1 293 . 1 1 35 35 THR HB H 1 4.00 0.01 . 1 . . . . 67 THR HB . 6902 1 294 . 1 1 35 35 THR HG21 H 1 1.06 0.01 . 1 . . . . 67 THR HG2 . 6902 1 295 . 1 1 35 35 THR HG22 H 1 1.06 0.01 . 1 . . . . 67 THR HG2 . 6902 1 296 . 1 1 35 35 THR HG23 H 1 1.06 0.01 . 1 . . . . 67 THR HG2 . 6902 1 297 . 1 1 35 35 THR N N 15 115.1 0.1 . 1 . . . . 67 THR N . 6902 1 298 . 1 1 36 36 VAL H H 1 9.58 0.01 . 1 . . . . 68 VAL H . 6902 1 299 . 1 1 36 36 VAL HA H 1 5.57 0.01 . 1 . . . . 68 VAL HA . 6902 1 300 . 1 1 36 36 VAL HB H 1 2.19 0.01 . 1 . . . . 68 VAL HB . 6902 1 301 . 1 1 36 36 VAL HG11 H 1 0.94 0.01 . 1 . . . . 68 VAL HG1 . 6902 1 302 . 1 1 36 36 VAL HG12 H 1 0.94 0.01 . 1 . . . . 68 VAL HG1 . 6902 1 303 . 1 1 36 36 VAL HG13 H 1 0.94 0.01 . 1 . . . . 68 VAL HG1 . 6902 1 304 . 1 1 36 36 VAL HG21 H 1 1.07 0.01 . 1 . . . . 68 VAL HG2 . 6902 1 305 . 1 1 36 36 VAL HG22 H 1 1.07 0.01 . 1 . . . . 68 VAL HG2 . 6902 1 306 . 1 1 36 36 VAL HG23 H 1 1.07 0.01 . 1 . . . . 68 VAL HG2 . 6902 1 307 . 1 1 36 36 VAL N N 15 119.9 0.1 . 1 . . . . 68 VAL N . 6902 1 308 . 1 1 37 37 HIS H H 1 8.79 0.01 . 1 . . . . 69 HIS H . 6902 1 309 . 1 1 37 37 HIS HA H 1 5.34 0.01 . 1 . . . . 69 HIS HA . 6902 1 310 . 1 1 37 37 HIS HB2 H 1 3.16 0.01 . 1 . . . . 69 HIS HB2 . 6902 1 311 . 1 1 37 37 HIS HB3 H 1 3.08 0.01 . 1 . . . . 69 HIS HB3 . 6902 1 312 . 1 1 37 37 HIS HD2 H 1 7.01 0.01 . 1 . . . . 69 HIS HD2 . 6902 1 313 . 1 1 37 37 HIS HE1 H 1 7.92 0.01 . 1 . . . . 69 HIS HE1 . 6902 1 314 . 1 1 37 37 HIS N N 15 121.8 0.1 . 1 . . . . 69 HIS N . 6902 1 315 . 1 1 38 38 LEU H H 1 9.00 0.01 . 1 . . . . 70 LEU H . 6902 1 316 . 1 1 38 38 LEU HA H 1 5.37 0.01 . 1 . . . . 70 LEU HA . 6902 1 317 . 1 1 38 38 LEU HB2 H 1 1.21 0.01 . 1 . . . . 70 LEU HB2 . 6902 1 318 . 1 1 38 38 LEU HB3 H 1 1.87 0.01 . 1 . . . . 70 LEU HB3 . 6902 1 319 . 1 1 38 38 LEU HG H 1 1.47 0.01 . 1 . . . . 70 LEU HG . 6902 1 320 . 1 1 38 38 LEU HD11 H 1 0.93 0.01 . 1 . . . . 70 LEU HD1 . 6902 1 321 . 1 1 38 38 LEU HD12 H 1 0.93 0.01 . 1 . . . . 70 LEU HD1 . 6902 1 322 . 1 1 38 38 LEU HD13 H 1 0.93 0.01 . 1 . . . . 70 LEU HD1 . 6902 1 323 . 1 1 38 38 LEU HD21 H 1 0.83 0.01 . 1 . . . . 70 LEU HD2 . 6902 1 324 . 1 1 38 38 LEU HD22 H 1 0.83 0.01 . 1 . . . . 70 LEU HD2 . 6902 1 325 . 1 1 38 38 LEU HD23 H 1 0.83 0.01 . 1 . . . . 70 LEU HD2 . 6902 1 326 . 1 1 38 38 LEU N N 15 129.4 0.1 . 1 . . . . 70 LEU N . 6902 1 327 . 1 1 39 39 GLN H H 1 9.01 0.01 . 1 . . . . 71 GLN H . 6902 1 328 . 1 1 39 39 GLN HA H 1 4.92 0.01 . 1 . . . . 71 GLN HA . 6902 1 329 . 1 1 39 39 GLN HB2 H 1 2.13 0.01 . 2 . . . . 71 GLN HB2 . 6902 1 330 . 1 1 39 39 GLN HB3 H 1 2.09 0.01 . 2 . . . . 71 GLN HB3 . 6902 1 331 . 1 1 39 39 GLN HG2 H 1 2.21 0.01 . 1 . . . . 71 GLN HG2 . 6902 1 332 . 1 1 39 39 GLN HG3 H 1 2.32 0.01 . 1 . . . . 71 GLN HG3 . 6902 1 333 . 1 1 39 39 GLN HE21 H 1 7.55 0.01 . 1 . . . . 71 GLN HE21 . 6902 1 334 . 1 1 39 39 GLN HE22 H 1 6.73 0.01 . 1 . . . . 71 GLN HE22 . 6902 1 335 . 1 1 39 39 GLN N N 15 126.3 0.1 . 1 . . . . 71 GLN N . 6902 1 336 . 1 1 39 39 GLN NE2 N 15 111.5 0.1 . 1 . . . . 71 GLN NE2 . 6902 1 337 . 1 1 40 40 THR H H 1 9.20 0.01 . 1 . . . . 72 THR H . 6902 1 338 . 1 1 40 40 THR HA H 1 4.84 0.01 . 1 . . . . 72 THR HA . 6902 1 339 . 1 1 40 40 THR HB H 1 3.96 0.01 . 1 . . . . 72 THR HB . 6902 1 340 . 1 1 40 40 THR HG21 H 1 1.18 0.01 . 1 . . . . 72 THR HG2 . 6902 1 341 . 1 1 40 40 THR HG22 H 1 1.18 0.01 . 1 . . . . 72 THR HG2 . 6902 1 342 . 1 1 40 40 THR HG23 H 1 1.18 0.01 . 1 . . . . 72 THR HG2 . 6902 1 343 . 1 1 40 40 THR N N 15 124.1 0.1 . 1 . . . . 72 THR N . 6902 1 344 . 1 1 41 41 SER H H 1 9.20 0.01 . 1 . . . . 73 SER H . 6902 1 345 . 1 1 41 41 SER HA H 1 5.57 0.01 . 1 . . . . 73 SER HA . 6902 1 346 . 1 1 41 41 SER HB2 H 1 3.69 0.01 . 1 . . . . 73 SER HB2 . 6902 1 347 . 1 1 41 41 SER HB3 H 1 3.69 0.01 . 1 . . . . 73 SER HB3 . 6902 1 348 . 1 1 41 41 SER HG H 1 6.02 0.01 . 1 . . . . 73 SER HG . 6902 1 349 . 1 1 41 41 SER N N 15 122.8 0.1 . 1 . . . . 73 SER N . 6902 1 350 . 1 1 42 42 LEU H H 1 8.55 0.01 . 1 . . . . 74 LEU H . 6902 1 351 . 1 1 42 42 LEU HA H 1 4.74 0.01 . 1 . . . . 74 LEU HA . 6902 1 352 . 1 1 42 42 LEU HB2 H 1 1.98 0.01 . 2 . . . . 74 LEU HB2 . 6902 1 353 . 1 1 42 42 LEU HB3 H 1 1.95 0.01 . 2 . . . . 74 LEU HB3 . 6902 1 354 . 1 1 42 42 LEU HG H 1 1.79 0.01 . 1 . . . . 74 LEU HG . 6902 1 355 . 1 1 42 42 LEU HD11 H 1 0.95 0.01 . 1 . . . . 74 LEU HD1 . 6902 1 356 . 1 1 42 42 LEU HD12 H 1 0.95 0.01 . 1 . . . . 74 LEU HD1 . 6902 1 357 . 1 1 42 42 LEU HD13 H 1 0.95 0.01 . 1 . . . . 74 LEU HD1 . 6902 1 358 . 1 1 42 42 LEU HD21 H 1 1.05 0.01 . 1 . . . . 74 LEU HD2 . 6902 1 359 . 1 1 42 42 LEU HD22 H 1 1.05 0.01 . 1 . . . . 74 LEU HD2 . 6902 1 360 . 1 1 42 42 LEU HD23 H 1 1.05 0.01 . 1 . . . . 74 LEU HD2 . 6902 1 361 . 1 1 42 42 LEU N N 15 119.7 0.1 . 1 . . . . 74 LEU N . 6902 1 362 . 1 1 43 43 GLU H H 1 8.78 0.01 . 1 . . . . 75 GLU H . 6902 1 363 . 1 1 43 43 GLU HA H 1 3.96 0.01 . 1 . . . . 75 GLU HA . 6902 1 364 . 1 1 43 43 GLU HB2 H 1 2.06 0.01 . 2 . . . . 75 GLU HB2 . 6902 1 365 . 1 1 43 43 GLU HB3 H 1 2.01 0.01 . 2 . . . . 75 GLU HB3 . 6902 1 366 . 1 1 43 43 GLU HG2 H 1 2.21 0.01 . 1 . . . . 75 GLU HG2 . 6902 1 367 . 1 1 43 43 GLU HG3 H 1 2.28 0.01 . 1 . . . . 75 GLU HG3 . 6902 1 368 . 1 1 43 43 GLU N N 15 121.9 0.1 . 1 . . . . 75 GLU N . 6902 1 369 . 1 1 44 44 ASN H H 1 7.80 0.01 . 1 . . . . 76 ASN H . 6902 1 370 . 1 1 44 44 ASN HA H 1 4.55 0.01 . 1 . . . . 76 ASN HA . 6902 1 371 . 1 1 44 44 ASN HB2 H 1 3.31 0.01 . 2 . . . . 76 ASN HB2 . 6902 1 372 . 1 1 44 44 ASN HB3 H 1 2.87 0.01 . 2 . . . . 76 ASN HB3 . 6902 1 373 . 1 1 44 44 ASN HD21 H 1 6.89 0.01 . 1 . . . . 76 ASN HD21 . 6902 1 374 . 1 1 44 44 ASN HD22 H 1 7.66 0.01 . 1 . . . . 76 ASN HD22 . 6902 1 375 . 1 1 44 44 ASN N N 15 113.5 0.1 . 1 . . . . 76 ASN N . 6902 1 376 . 1 1 44 44 ASN ND2 N 15 110.7 0.1 . 1 . . . . 76 ASN ND2 . 6902 1 377 . 1 1 45 45 GLY H H 1 8.24 0.01 . 1 . . . . 77 GLY H . 6902 1 378 . 1 1 45 45 GLY HA2 H 1 4.39 0.01 . 2 . . . . 77 GLY HA2 . 6902 1 379 . 1 1 45 45 GLY HA3 H 1 3.77 0.01 . 2 . . . . 77 GLY HA3 . 6902 1 380 . 1 1 45 45 GLY N N 15 108.2 0.1 . 1 . . . . 77 GLY N . 6902 1 381 . 1 1 46 46 THR H H 1 7.81 0.01 . 1 . . . . 78 THR H . 6902 1 382 . 1 1 46 46 THR HA H 1 4.05 0.01 . 1 . . . . 78 THR HA . 6902 1 383 . 1 1 46 46 THR HB H 1 4.05 0.01 . 1 . . . . 78 THR HB . 6902 1 384 . 1 1 46 46 THR HG21 H 1 1.19 0.01 . 1 . . . . 78 THR HG2 . 6902 1 385 . 1 1 46 46 THR HG22 H 1 1.19 0.01 . 1 . . . . 78 THR HG2 . 6902 1 386 . 1 1 46 46 THR HG23 H 1 1.19 0.01 . 1 . . . . 78 THR HG2 . 6902 1 387 . 1 1 46 46 THR N N 15 118.0 0.1 . 1 . . . . 78 THR N . 6902 1 388 . 1 1 47 47 ARG H H 1 8.89 0.01 . 1 . . . . 79 ARG H . 6902 1 389 . 1 1 47 47 ARG HA H 1 4.54 0.01 . 1 . . . . 79 ARG HA . 6902 1 390 . 1 1 47 47 ARG HB2 H 1 1.82 0.01 . 1 . . . . 79 ARG HB2 . 6902 1 391 . 1 1 47 47 ARG HB3 H 1 1.82 0.01 . 1 . . . . 79 ARG HB3 . 6902 1 392 . 1 1 47 47 ARG HG2 H 1 1.61 0.01 . 1 . . . . 79 ARG HG2 . 6902 1 393 . 1 1 47 47 ARG HG3 H 1 1.67 0.01 . 1 . . . . 79 ARG HG3 . 6902 1 394 . 1 1 47 47 ARG HD2 H 1 3.20 0.01 . 1 . . . . 79 ARG HD2 . 6902 1 395 . 1 1 47 47 ARG HD3 H 1 3.20 0.01 . 1 . . . . 79 ARG HD3 . 6902 1 396 . 1 1 47 47 ARG HE H 1 7.17 0.01 . 1 . . . . 79 ARG HE . 6902 1 397 . 1 1 47 47 ARG N N 15 129.9 0.1 . 1 . . . . 79 ARG N . 6902 1 398 . 1 1 47 47 ARG NE N 15 83.8 0.1 . 1 . . . . 79 ARG NE . 6902 1 399 . 1 1 48 48 VAL H H 1 8.76 0.01 . 1 . . . . 80 VAL H . 6902 1 400 . 1 1 48 48 VAL HA H 1 4.34 0.01 . 1 . . . . 80 VAL HA . 6902 1 401 . 1 1 48 48 VAL HB H 1 2.09 0.01 . 1 . . . . 80 VAL HB . 6902 1 402 . 1 1 48 48 VAL HG11 H 1 0.92 0.01 . 1 . . . . 80 VAL HG1 . 6902 1 403 . 1 1 48 48 VAL HG12 H 1 0.92 0.01 . 1 . . . . 80 VAL HG1 . 6902 1 404 . 1 1 48 48 VAL HG13 H 1 0.92 0.01 . 1 . . . . 80 VAL HG1 . 6902 1 405 . 1 1 48 48 VAL HG21 H 1 0.76 0.01 . 1 . . . . 80 VAL HG2 . 6902 1 406 . 1 1 48 48 VAL HG22 H 1 0.76 0.01 . 1 . . . . 80 VAL HG2 . 6902 1 407 . 1 1 48 48 VAL HG23 H 1 0.76 0.01 . 1 . . . . 80 VAL HG2 . 6902 1 408 . 1 1 48 48 VAL N N 15 119.8 0.1 . 1 . . . . 80 VAL N . 6902 1 409 . 1 1 49 49 GLN H H 1 7.64 0.01 . 1 . . . . 81 GLN H . 6902 1 410 . 1 1 49 49 GLN HA H 1 4.45 0.01 . 1 . . . . 81 GLN HA . 6902 1 411 . 1 1 49 49 GLN HB2 H 1 1.90 0.01 . 1 . . . . 81 GLN HB2 . 6902 1 412 . 1 1 49 49 GLN HB3 H 1 1.90 0.01 . 1 . . . . 81 GLN HB3 . 6902 1 413 . 1 1 49 49 GLN HG2 H 1 2.21 0.01 . 1 . . . . 81 GLN HG2 . 6902 1 414 . 1 1 49 49 GLN HG3 H 1 2.21 0.01 . 1 . . . . 81 GLN HG3 . 6902 1 415 . 1 1 49 49 GLN HE21 H 1 7.52 0.01 . 1 . . . . 81 GLN HE21 . 6902 1 416 . 1 1 49 49 GLN HE22 H 1 6.54 0.01 . 1 . . . . 81 GLN HE22 . 6902 1 417 . 1 1 49 49 GLN N N 15 120.8 0.1 . 1 . . . . 81 GLN N . 6902 1 418 . 1 1 49 49 GLN NE2 N 15 110.7 0.1 . 1 . . . . 81 GLN NE2 . 6902 1 419 . 1 1 50 50 GLU H H 1 8.49 0.01 . 1 . . . . 82 GLU H . 6902 1 420 . 1 1 50 50 GLU HA H 1 4.87 0.01 . 1 . . . . 82 GLU HA . 6902 1 421 . 1 1 50 50 GLU HB2 H 1 2.02 0.01 . 2 . . . . 82 GLU HB2 . 6902 1 422 . 1 1 50 50 GLU HB3 H 1 1.92 0.01 . 2 . . . . 82 GLU HB3 . 6902 1 423 . 1 1 50 50 GLU HG2 H 1 2.24 0.01 . 1 . . . . 82 GLU HG2 . 6902 1 424 . 1 1 50 50 GLU HG3 H 1 2.24 0.01 . 1 . . . . 82 GLU HG3 . 6902 1 425 . 1 1 50 50 GLU N N 15 124.8 0.1 . 1 . . . . 82 GLU N . 6902 1 426 . 1 1 51 51 GLU H H 1 8.93 0.01 . 1 . . . . 83 GLU H . 6902 1 427 . 1 1 51 51 GLU HA H 1 4.88 0.01 . 1 . . . . 83 GLU HA . 6902 1 428 . 1 1 51 51 GLU HB2 H 1 1.98 0.01 . 1 . . . . 83 GLU HB2 . 6902 1 429 . 1 1 51 51 GLU HB3 H 1 2.12 0.01 . 1 . . . . 83 GLU HB3 . 6902 1 430 . 1 1 51 51 GLU HG2 H 1 2.22 0.01 . 1 . . . . 83 GLU HG2 . 6902 1 431 . 1 1 51 51 GLU HG3 H 1 2.22 0.01 . 1 . . . . 83 GLU HG3 . 6902 1 432 . 1 1 51 51 GLU N N 15 125.4 0.1 . 1 . . . . 83 GLU N . 6902 1 433 . 1 1 52 52 PRO HA H 1 4.06 0.01 . 1 . . . . 84 PRO HA . 6902 1 434 . 1 1 52 52 PRO HB2 H 1 2.13 0.01 . 1 . . . . 84 PRO HB2 . 6902 1 435 . 1 1 52 52 PRO HB3 H 1 2.13 0.01 . 1 . . . . 84 PRO HB3 . 6902 1 436 . 1 1 52 52 PRO HG2 H 1 2.00 0.01 . 2 . . . . 84 PRO HG2 . 6902 1 437 . 1 1 52 52 PRO HG3 H 1 1.89 0.01 . 2 . . . . 84 PRO HG3 . 6902 1 438 . 1 1 52 52 PRO HD2 H 1 3.91 0.01 . 1 . . . . 84 PRO HD2 . 6902 1 439 . 1 1 52 52 PRO HD3 H 1 3.60 0.01 . 1 . . . . 84 PRO HD3 . 6902 1 440 . 1 1 53 53 GLU H H 1 8.18 0.01 . 1 . . . . 85 GLU H . 6902 1 441 . 1 1 53 53 GLU HA H 1 4.53 0.01 . 1 . . . . 85 GLU HA . 6902 1 442 . 1 1 53 53 GLU HB2 H 1 1.97 0.01 . 1 . . . . 85 GLU HB2 . 6902 1 443 . 1 1 53 53 GLU HB3 H 1 1.77 0.01 . 1 . . . . 85 GLU HB3 . 6902 1 444 . 1 1 53 53 GLU HG2 H 1 2.06 0.01 . 1 . . . . 85 GLU HG2 . 6902 1 445 . 1 1 53 53 GLU HG3 H 1 2.06 0.01 . 1 . . . . 85 GLU HG3 . 6902 1 446 . 1 1 53 53 GLU N N 15 118.4 0.1 . 1 . . . . 85 GLU N . 6902 1 447 . 1 1 54 54 LEU H H 1 8.81 0.01 . 1 . . . . 86 LEU H . 6902 1 448 . 1 1 54 54 LEU HA H 1 4.65 0.01 . 1 . . . . 86 LEU HA . 6902 1 449 . 1 1 54 54 LEU HB2 H 1 1.38 0.01 . 1 . . . . 86 LEU HB2 . 6902 1 450 . 1 1 54 54 LEU HB3 H 1 1.94 0.01 . 1 . . . . 86 LEU HB3 . 6902 1 451 . 1 1 54 54 LEU HG H 1 1.60 0.01 . 1 . . . . 86 LEU HG . 6902 1 452 . 1 1 54 54 LEU HD11 H 1 0.94 0.01 . 1 . . . . 86 LEU HD1 . 6902 1 453 . 1 1 54 54 LEU HD12 H 1 0.94 0.01 . 1 . . . . 86 LEU HD1 . 6902 1 454 . 1 1 54 54 LEU HD13 H 1 0.94 0.01 . 1 . . . . 86 LEU HD1 . 6902 1 455 . 1 1 54 54 LEU HD21 H 1 0.78 0.01 . 1 . . . . 86 LEU HD2 . 6902 1 456 . 1 1 54 54 LEU HD22 H 1 0.78 0.01 . 1 . . . . 86 LEU HD2 . 6902 1 457 . 1 1 54 54 LEU HD23 H 1 0.78 0.01 . 1 . . . . 86 LEU HD2 . 6902 1 458 . 1 1 54 54 LEU N N 15 128.1 0.1 . 1 . . . . 86 LEU N . 6902 1 459 . 1 1 55 55 VAL H H 1 8.38 0.01 . 1 . . . . 87 VAL H . 6902 1 460 . 1 1 55 55 VAL HA H 1 5.37 0.01 . 1 . . . . 87 VAL HA . 6902 1 461 . 1 1 55 55 VAL HB H 1 1.89 0.01 . 1 . . . . 87 VAL HB . 6902 1 462 . 1 1 55 55 VAL HG11 H 1 0.76 0.01 . 1 . . . . 87 VAL HG1 . 6902 1 463 . 1 1 55 55 VAL HG12 H 1 0.76 0.01 . 1 . . . . 87 VAL HG1 . 6902 1 464 . 1 1 55 55 VAL HG13 H 1 0.76 0.01 . 1 . . . . 87 VAL HG1 . 6902 1 465 . 1 1 55 55 VAL HG21 H 1 0.97 0.01 . 1 . . . . 87 VAL HG2 . 6902 1 466 . 1 1 55 55 VAL HG22 H 1 0.97 0.01 . 1 . . . . 87 VAL HG2 . 6902 1 467 . 1 1 55 55 VAL HG23 H 1 0.97 0.01 . 1 . . . . 87 VAL HG2 . 6902 1 468 . 1 1 55 55 VAL N N 15 128.0 0.1 . 1 . . . . 87 VAL N . 6902 1 469 . 1 1 56 56 PHE H H 1 8.92 0.01 . 1 . . . . 88 PHE H . 6902 1 470 . 1 1 56 56 PHE HA H 1 4.99 0.01 . 1 . . . . 88 PHE HA . 6902 1 471 . 1 1 56 56 PHE HB2 H 1 3.14 0.01 . 1 . . . . 88 PHE HB2 . 6902 1 472 . 1 1 56 56 PHE HB3 H 1 3.14 0.01 . 1 . . . . 88 PHE HB3 . 6902 1 473 . 1 1 56 56 PHE HD1 H 1 6.95 0.01 . 1 . . . . 88 PHE HD1 . 6902 1 474 . 1 1 56 56 PHE HD2 H 1 6.95 0.01 . 1 . . . . 88 PHE HD2 . 6902 1 475 . 1 1 56 56 PHE HE1 H 1 7.15 0.01 . 1 . . . . 88 PHE HE1 . 6902 1 476 . 1 1 56 56 PHE HE2 H 1 7.15 0.01 . 1 . . . . 88 PHE HE2 . 6902 1 477 . 1 1 56 56 PHE HZ H 1 6.83 0.01 . 1 . . . . 88 PHE HZ . 6902 1 478 . 1 1 56 56 PHE N N 15 123.2 0.1 . 1 . . . . 88 PHE N . 6902 1 479 . 1 1 57 57 THR H H 1 9.15 0.01 . 1 . . . . 89 THR H . 6902 1 480 . 1 1 57 57 THR HA H 1 4.66 0.01 . 1 . . . . 89 THR HA . 6902 1 481 . 1 1 57 57 THR HB H 1 4.15 0.01 . 1 . . . . 89 THR HB . 6902 1 482 . 1 1 57 57 THR HG21 H 1 1.00 0.01 . 1 . . . . 89 THR HG2 . 6902 1 483 . 1 1 57 57 THR HG22 H 1 1.00 0.01 . 1 . . . . 89 THR HG2 . 6902 1 484 . 1 1 57 57 THR HG23 H 1 1.00 0.01 . 1 . . . . 89 THR HG2 . 6902 1 485 . 1 1 57 57 THR N N 15 118.0 0.1 . 1 . . . . 89 THR N . 6902 1 486 . 1 1 58 58 LEU H H 1 9.02 0.01 . 1 . . . . 90 LEU H . 6902 1 487 . 1 1 58 58 LEU HA H 1 4.36 0.01 . 1 . . . . 90 LEU HA . 6902 1 488 . 1 1 58 58 LEU HB2 H 1 1.44 0.01 . 1 . . . . 90 LEU HB2 . 6902 1 489 . 1 1 58 58 LEU HB3 H 1 1.92 0.01 . 1 . . . . 90 LEU HB3 . 6902 1 490 . 1 1 58 58 LEU HG H 1 1.60 0.01 . 1 . . . . 90 LEU HG . 6902 1 491 . 1 1 58 58 LEU HD11 H 1 1.01 0.01 . 1 . . . . 90 LEU HD1 . 6902 1 492 . 1 1 58 58 LEU HD12 H 1 1.01 0.01 . 1 . . . . 90 LEU HD1 . 6902 1 493 . 1 1 58 58 LEU HD13 H 1 1.01 0.01 . 1 . . . . 90 LEU HD1 . 6902 1 494 . 1 1 58 58 LEU HD21 H 1 0.75 0.01 . 1 . . . . 90 LEU HD2 . 6902 1 495 . 1 1 58 58 LEU HD22 H 1 0.75 0.01 . 1 . . . . 90 LEU HD2 . 6902 1 496 . 1 1 58 58 LEU HD23 H 1 0.75 0.01 . 1 . . . . 90 LEU HD2 . 6902 1 497 . 1 1 58 58 LEU N N 15 131.1 0.1 . 1 . . . . 90 LEU N . 6902 1 498 . 1 1 59 59 GLY H H 1 10.63 0.01 . 1 . . . . 91 GLY H . 6902 1 499 . 1 1 59 59 GLY HA2 H 1 3.92 0.01 . 1 . . . . 91 GLY HA2 . 6902 1 500 . 1 1 59 59 GLY HA3 H 1 4.29 0.01 . 1 . . . . 91 GLY HA3 . 6902 1 501 . 1 1 59 59 GLY N N 15 119.9 0.1 . 1 . . . . 91 GLY N . 6902 1 502 . 1 1 60 60 ASP H H 1 7.93 0.01 . 1 . . . . 92 ASP H . 6902 1 503 . 1 1 60 60 ASP HA H 1 4.83 0.01 . 1 . . . . 92 ASP HA . 6902 1 504 . 1 1 60 60 ASP HB2 H 1 2.89 0.01 . 1 . . . . 92 ASP HB2 . 6902 1 505 . 1 1 60 60 ASP HB3 H 1 2.73 0.01 . 1 . . . . 92 ASP HB3 . 6902 1 506 . 1 1 60 60 ASP N N 15 121.7 0.1 . 1 . . . . 92 ASP N . 6902 1 507 . 1 1 61 61 CYS H H 1 8.93 0.01 . 1 . . . . 93 CYS H . 6902 1 508 . 1 1 61 61 CYS HA H 1 4.31 0.01 . 1 . . . . 93 CYS HA . 6902 1 509 . 1 1 61 61 CYS HB2 H 1 3.18 0.01 . 2 . . . . 93 CYS HB2 . 6902 1 510 . 1 1 61 61 CYS HB3 H 1 3.15 0.01 . 2 . . . . 93 CYS HB3 . 6902 1 511 . 1 1 61 61 CYS N N 15 117.9 0.1 . 1 . . . . 93 CYS N . 6902 1 512 . 1 1 62 62 ASP H H 1 9.04 0.01 . 1 . . . . 94 ASP H . 6902 1 513 . 1 1 62 62 ASP HA H 1 4.67 0.01 . 1 . . . . 94 ASP HA . 6902 1 514 . 1 1 62 62 ASP HB2 H 1 2.78 0.01 . 1 . . . . 94 ASP HB2 . 6902 1 515 . 1 1 62 62 ASP HB3 H 1 2.71 0.01 . 1 . . . . 94 ASP HB3 . 6902 1 516 . 1 1 62 62 ASP N N 15 120.0 0.1 . 1 . . . . 94 ASP N . 6902 1 517 . 1 1 63 63 VAL H H 1 6.83 0.01 . 1 . . . . 95 VAL H . 6902 1 518 . 1 1 63 63 VAL HA H 1 4.23 0.01 . 1 . . . . 95 VAL HA . 6902 1 519 . 1 1 63 63 VAL HB H 1 1.78 0.01 . 1 . . . . 95 VAL HB . 6902 1 520 . 1 1 63 63 VAL HG11 H 1 0.34 0.01 . 1 . . . . 95 VAL HG1 . 6902 1 521 . 1 1 63 63 VAL HG12 H 1 0.34 0.01 . 1 . . . . 95 VAL HG1 . 6902 1 522 . 1 1 63 63 VAL HG13 H 1 0.34 0.01 . 1 . . . . 95 VAL HG1 . 6902 1 523 . 1 1 63 63 VAL HG21 H 1 0.13 0.01 . 1 . . . . 95 VAL HG2 . 6902 1 524 . 1 1 63 63 VAL HG22 H 1 0.13 0.01 . 1 . . . . 95 VAL HG2 . 6902 1 525 . 1 1 63 63 VAL HG23 H 1 0.13 0.01 . 1 . . . . 95 VAL HG2 . 6902 1 526 . 1 1 63 63 VAL N N 15 112.5 0.1 . 1 . . . . 95 VAL N . 6902 1 527 . 1 1 64 64 ILE H H 1 7.66 0.01 . 1 . . . . 96 ILE H . 6902 1 528 . 1 1 64 64 ILE HA H 1 4.03 0.01 . 1 . . . . 96 ILE HA . 6902 1 529 . 1 1 64 64 ILE HB H 1 2.11 0.01 . 1 . . . . 96 ILE HB . 6902 1 530 . 1 1 64 64 ILE HG12 H 1 1.25 0.01 . 2 . . . . 96 ILE HG12 . 6902 1 531 . 1 1 64 64 ILE HG13 H 1 1.14 0.01 . 2 . . . . 96 ILE HG13 . 6902 1 532 . 1 1 64 64 ILE HG21 H 1 0.23 0.01 . 1 . . . . 96 ILE HG2 . 6902 1 533 . 1 1 64 64 ILE HG22 H 1 0.23 0.01 . 1 . . . . 96 ILE HG2 . 6902 1 534 . 1 1 64 64 ILE HG23 H 1 0.23 0.01 . 1 . . . . 96 ILE HG2 . 6902 1 535 . 1 1 64 64 ILE HD11 H 1 0.70 0.01 . 1 . . . . 96 ILE HD1 . 6902 1 536 . 1 1 64 64 ILE HD12 H 1 0.70 0.01 . 1 . . . . 96 ILE HD1 . 6902 1 537 . 1 1 64 64 ILE HD13 H 1 0.70 0.01 . 1 . . . . 96 ILE HD1 . 6902 1 538 . 1 1 64 64 ILE N N 15 113.4 0.1 . 1 . . . . 96 ILE N . 6902 1 539 . 1 1 65 65 GLN H H 1 9.12 0.01 . 1 . . . . 97 GLN H . 6902 1 540 . 1 1 65 65 GLN HA H 1 4.00 0.01 . 1 . . . . 97 GLN HA . 6902 1 541 . 1 1 65 65 GLN HB2 H 1 2.25 0.01 . 1 . . . . 97 GLN HB2 . 6902 1 542 . 1 1 65 65 GLN HB3 H 1 2.25 0.01 . 1 . . . . 97 GLN HB3 . 6902 1 543 . 1 1 65 65 GLN HG2 H 1 2.50 0.01 . 1 . . . . 97 GLN HG2 . 6902 1 544 . 1 1 65 65 GLN HG3 H 1 2.65 0.01 . 1 . . . . 97 GLN HG3 . 6902 1 545 . 1 1 65 65 GLN HE21 H 1 7.78 0.01 . 1 . . . . 97 GLN HE21 . 6902 1 546 . 1 1 65 65 GLN HE22 H 1 6.80 0.01 . 1 . . . . 97 GLN HE22 . 6902 1 547 . 1 1 65 65 GLN N N 15 125.0 0.1 . 1 . . . . 97 GLN N . 6902 1 548 . 1 1 65 65 GLN NE2 N 15 111.8 0.1 . 1 . . . . 97 GLN NE2 . 6902 1 549 . 1 1 66 66 ALA H H 1 9.02 0.01 . 1 . . . . 98 ALA H . 6902 1 550 . 1 1 66 66 ALA HA H 1 3.84 0.01 . 1 . . . . 98 ALA HA . 6902 1 551 . 1 1 66 66 ALA HB1 H 1 1.11 0.01 . 1 . . . . 98 ALA HB . 6902 1 552 . 1 1 66 66 ALA HB2 H 1 1.11 0.01 . 1 . . . . 98 ALA HB . 6902 1 553 . 1 1 66 66 ALA HB3 H 1 1.11 0.01 . 1 . . . . 98 ALA HB . 6902 1 554 . 1 1 66 66 ALA N N 15 116.0 0.1 . 1 . . . . 98 ALA N . 6902 1 555 . 1 1 67 67 LEU H H 1 7.24 0.01 . 1 . . . . 99 LEU H . 6902 1 556 . 1 1 67 67 LEU HA H 1 4.21 0.01 . 1 . . . . 99 LEU HA . 6902 1 557 . 1 1 67 67 LEU HB2 H 1 1.27 0.01 . 1 . . . . 99 LEU HB2 . 6902 1 558 . 1 1 67 67 LEU HB3 H 1 1.54 0.01 . 1 . . . . 99 LEU HB3 . 6902 1 559 . 1 1 67 67 LEU HG H 1 1.37 0.01 . 1 . . . . 99 LEU HG . 6902 1 560 . 1 1 67 67 LEU HD11 H 1 0.75 0.01 . 1 . . . . 99 LEU HD1 . 6902 1 561 . 1 1 67 67 LEU HD12 H 1 0.75 0.01 . 1 . . . . 99 LEU HD1 . 6902 1 562 . 1 1 67 67 LEU HD13 H 1 0.75 0.01 . 1 . . . . 99 LEU HD1 . 6902 1 563 . 1 1 67 67 LEU HD21 H 1 0.75 0.01 . 1 . . . . 99 LEU HD2 . 6902 1 564 . 1 1 67 67 LEU HD22 H 1 0.75 0.01 . 1 . . . . 99 LEU HD2 . 6902 1 565 . 1 1 67 67 LEU HD23 H 1 0.75 0.01 . 1 . . . . 99 LEU HD2 . 6902 1 566 . 1 1 67 67 LEU N N 15 114.0 0.1 . 1 . . . . 99 LEU N . 6902 1 567 . 1 1 68 68 ASP H H 1 7.31 0.01 . 1 . . . . 100 ASP H . 6902 1 568 . 1 1 68 68 ASP HA H 1 4.56 0.01 . 1 . . . . 100 ASP HA . 6902 1 569 . 1 1 68 68 ASP HB2 H 1 2.41 0.01 . 1 . . . . 100 ASP HB2 . 6902 1 570 . 1 1 68 68 ASP HB3 H 1 2.58 0.01 . 1 . . . . 100 ASP HB3 . 6902 1 571 . 1 1 68 68 ASP N N 15 121.2 0.1 . 1 . . . . 100 ASP N . 6902 1 572 . 1 1 69 69 LEU H H 1 8.21 0.01 . 1 . . . . 101 LEU H . 6902 1 573 . 1 1 69 69 LEU HA H 1 4.27 0.01 . 1 . . . . 101 LEU HA . 6902 1 574 . 1 1 69 69 LEU HB2 H 1 1.59 0.01 . 1 . . . . 101 LEU HB2 . 6902 1 575 . 1 1 69 69 LEU HB3 H 1 1.17 0.01 . 1 . . . . 101 LEU HB3 . 6902 1 576 . 1 1 69 69 LEU HG H 1 1.80 0.01 . 1 . . . . 101 LEU HG . 6902 1 577 . 1 1 69 69 LEU HD11 H 1 0.67 0.01 . 1 . . . . 101 LEU HD1 . 6902 1 578 . 1 1 69 69 LEU HD12 H 1 0.67 0.01 . 1 . . . . 101 LEU HD1 . 6902 1 579 . 1 1 69 69 LEU HD13 H 1 0.67 0.01 . 1 . . . . 101 LEU HD1 . 6902 1 580 . 1 1 69 69 LEU HD21 H 1 0.83 0.01 . 1 . . . . 101 LEU HD2 . 6902 1 581 . 1 1 69 69 LEU HD22 H 1 0.83 0.01 . 1 . . . . 101 LEU HD2 . 6902 1 582 . 1 1 69 69 LEU HD23 H 1 0.83 0.01 . 1 . . . . 101 LEU HD2 . 6902 1 583 . 1 1 69 69 LEU N N 15 109.7 0.1 . 1 . . . . 101 LEU N . 6902 1 584 . 1 1 70 70 SER H H 1 7.16 0.01 . 1 . . . . 102 SER H . 6902 1 585 . 1 1 70 70 SER HA H 1 4.45 0.01 . 1 . . . . 102 SER HA . 6902 1 586 . 1 1 70 70 SER HB2 H 1 3.62 0.01 . 1 . . . . 102 SER HB2 . 6902 1 587 . 1 1 70 70 SER HB3 H 1 3.53 0.01 . 1 . . . . 102 SER HB3 . 6902 1 588 . 1 1 70 70 SER HG H 1 5.26 0.01 . 1 . . . . 102 SER HG . 6902 1 589 . 1 1 70 70 SER N N 15 111.8 0.1 . 1 . . . . 102 SER N . 6902 1 590 . 1 1 71 71 VAL H H 1 8.06 0.01 . 1 . . . . 103 VAL H . 6902 1 591 . 1 1 71 71 VAL HA H 1 3.95 0.01 . 1 . . . . 103 VAL HA . 6902 1 592 . 1 1 71 71 VAL HB H 1 2.30 0.01 . 1 . . . . 103 VAL HB . 6902 1 593 . 1 1 71 71 VAL HG11 H 1 1.01 0.01 . 1 . . . . 103 VAL HG1 . 6902 1 594 . 1 1 71 71 VAL HG12 H 1 1.01 0.01 . 1 . . . . 103 VAL HG1 . 6902 1 595 . 1 1 71 71 VAL HG13 H 1 1.01 0.01 . 1 . . . . 103 VAL HG1 . 6902 1 596 . 1 1 71 71 VAL HG21 H 1 1.28 0.01 . 1 . . . . 103 VAL HG2 . 6902 1 597 . 1 1 71 71 VAL HG22 H 1 1.28 0.01 . 1 . . . . 103 VAL HG2 . 6902 1 598 . 1 1 71 71 VAL HG23 H 1 1.28 0.01 . 1 . . . . 103 VAL HG2 . 6902 1 599 . 1 1 71 71 VAL N N 15 125.1 0.1 . 1 . . . . 103 VAL N . 6902 1 600 . 1 1 72 72 PRO HA H 1 4.32 0.01 . 1 . . . . 104 PRO HA . 6902 1 601 . 1 1 72 72 PRO HB2 H 1 2.43 0.01 . 1 . . . . 104 PRO HB2 . 6902 1 602 . 1 1 72 72 PRO HB3 H 1 2.43 0.01 . 1 . . . . 104 PRO HB3 . 6902 1 603 . 1 1 72 72 PRO HG2 H 1 2.12 0.01 . 1 . . . . 104 PRO HG2 . 6902 1 604 . 1 1 72 72 PRO HG3 H 1 1.80 0.01 . 1 . . . . 104 PRO HG3 . 6902 1 605 . 1 1 72 72 PRO HD2 H 1 3.12 0.01 . 1 . . . . 104 PRO HD2 . 6902 1 606 . 1 1 72 72 PRO HD3 H 1 3.62 0.01 . 1 . . . . 104 PRO HD3 . 6902 1 607 . 1 1 73 73 LEU H H 1 7.38 0.01 . 1 . . . . 105 LEU H . 6902 1 608 . 1 1 73 73 LEU HA H 1 4.35 0.01 . 1 . . . . 105 LEU HA . 6902 1 609 . 1 1 73 73 LEU HB2 H 1 1.74 0.01 . 2 . . . . 105 LEU HB2 . 6902 1 610 . 1 1 73 73 LEU HB3 H 1 1.70 0.01 . 2 . . . . 105 LEU HB3 . 6902 1 611 . 1 1 73 73 LEU HG H 1 1.60 0.01 . 1 . . . . 105 LEU HG . 6902 1 612 . 1 1 73 73 LEU HD11 H 1 0.96 0.01 . 1 . . . . 105 LEU HD1 . 6902 1 613 . 1 1 73 73 LEU HD12 H 1 0.96 0.01 . 1 . . . . 105 LEU HD1 . 6902 1 614 . 1 1 73 73 LEU HD13 H 1 0.96 0.01 . 1 . . . . 105 LEU HD1 . 6902 1 615 . 1 1 73 73 LEU HD21 H 1 0.85 0.01 . 1 . . . . 105 LEU HD2 . 6902 1 616 . 1 1 73 73 LEU HD22 H 1 0.85 0.01 . 1 . . . . 105 LEU HD2 . 6902 1 617 . 1 1 73 73 LEU HD23 H 1 0.85 0.01 . 1 . . . . 105 LEU HD2 . 6902 1 618 . 1 1 73 73 LEU N N 15 114.8 0.1 . 1 . . . . 105 LEU N . 6902 1 619 . 1 1 74 74 MET H H 1 7.91 0.01 . 1 . . . . 106 MET H . 6902 1 620 . 1 1 74 74 MET HA H 1 4.35 0.01 . 1 . . . . 106 MET HA . 6902 1 621 . 1 1 74 74 MET HB2 H 1 2.09 0.01 . 1 . . . . 106 MET HB2 . 6902 1 622 . 1 1 74 74 MET HB3 H 1 2.09 0.01 . 1 . . . . 106 MET HB3 . 6902 1 623 . 1 1 74 74 MET HG2 H 1 2.49 0.01 . 1 . . . . 106 MET HG2 . 6902 1 624 . 1 1 74 74 MET HG3 H 1 2.49 0.01 . 1 . . . . 106 MET HG3 . 6902 1 625 . 1 1 74 74 MET HE1 H 1 2.10 0.01 . 1 . . . . 106 MET HE . 6902 1 626 . 1 1 74 74 MET HE2 H 1 2.10 0.01 . 1 . . . . 106 MET HE . 6902 1 627 . 1 1 74 74 MET HE3 H 1 2.10 0.01 . 1 . . . . 106 MET HE . 6902 1 628 . 1 1 74 74 MET N N 15 121.7 0.1 . 1 . . . . 106 MET N . 6902 1 629 . 1 1 75 75 ASP H H 1 7.61 0.01 . 1 . . . . 107 ASP H . 6902 1 630 . 1 1 75 75 ASP HA H 1 4.74 0.01 . 1 . . . . 107 ASP HA . 6902 1 631 . 1 1 75 75 ASP HB2 H 1 2.27 0.01 . 1 . . . . 107 ASP HB2 . 6902 1 632 . 1 1 75 75 ASP HB3 H 1 2.58 0.01 . 1 . . . . 107 ASP HB3 . 6902 1 633 . 1 1 75 75 ASP N N 15 117.1 0.1 . 1 . . . . 107 ASP N . 6902 1 634 . 1 1 76 76 VAL H H 1 8.50 0.01 . 1 . . . . 108 VAL H . 6902 1 635 . 1 1 76 76 VAL HA H 1 3.32 0.01 . 1 . . . . 108 VAL HA . 6902 1 636 . 1 1 76 76 VAL HB H 1 2.05 0.01 . 1 . . . . 108 VAL HB . 6902 1 637 . 1 1 76 76 VAL HG11 H 1 0.83 0.01 . 1 . . . . 108 VAL HG1 . 6902 1 638 . 1 1 76 76 VAL HG12 H 1 0.83 0.01 . 1 . . . . 108 VAL HG1 . 6902 1 639 . 1 1 76 76 VAL HG13 H 1 0.83 0.01 . 1 . . . . 108 VAL HG1 . 6902 1 640 . 1 1 76 76 VAL HG21 H 1 0.95 0.01 . 1 . . . . 108 VAL HG2 . 6902 1 641 . 1 1 76 76 VAL HG22 H 1 0.95 0.01 . 1 . . . . 108 VAL HG2 . 6902 1 642 . 1 1 76 76 VAL HG23 H 1 0.95 0.01 . 1 . . . . 108 VAL HG2 . 6902 1 643 . 1 1 76 76 VAL N N 15 121.9 0.1 . 1 . . . . 108 VAL N . 6902 1 644 . 1 1 77 77 GLY H H 1 8.81 0.01 . 1 . . . . 109 GLY H . 6902 1 645 . 1 1 77 77 GLY HA2 H 1 3.73 0.01 . 1 . . . . 109 GLY HA2 . 6902 1 646 . 1 1 77 77 GLY HA3 H 1 4.39 0.01 . 1 . . . . 109 GLY HA3 . 6902 1 647 . 1 1 77 77 GLY N N 15 116.4 0.1 . 1 . . . . 109 GLY N . 6902 1 648 . 1 1 78 78 GLU H H 1 8.50 0.01 . 1 . . . . 110 GLU H . 6902 1 649 . 1 1 78 78 GLU HA H 1 4.63 0.01 . 1 . . . . 110 GLU HA . 6902 1 650 . 1 1 78 78 GLU HB2 H 1 2.04 0.01 . 2 . . . . 110 GLU HB2 . 6902 1 651 . 1 1 78 78 GLU HB3 H 1 1.98 0.01 . 2 . . . . 110 GLU HB3 . 6902 1 652 . 1 1 78 78 GLU HG2 H 1 2.40 0.01 . 1 . . . . 110 GLU HG2 . 6902 1 653 . 1 1 78 78 GLU HG3 H 1 2.24 0.01 . 1 . . . . 110 GLU HG3 . 6902 1 654 . 1 1 78 78 GLU N N 15 124.5 0.1 . 1 . . . . 110 GLU N . 6902 1 655 . 1 1 79 79 THR H H 1 8.98 0.01 . 1 . . . . 111 THR H . 6902 1 656 . 1 1 79 79 THR HA H 1 5.62 0.01 . 1 . . . . 111 THR HA . 6902 1 657 . 1 1 79 79 THR HB H 1 3.77 0.01 . 1 . . . . 111 THR HB . 6902 1 658 . 1 1 79 79 THR HG1 H 1 6.57 0.01 . 1 . . . . 111 THR HG1 . 6902 1 659 . 1 1 79 79 THR HG21 H 1 1.18 0.01 . 1 . . . . 111 THR HG2 . 6902 1 660 . 1 1 79 79 THR HG22 H 1 1.18 0.01 . 1 . . . . 111 THR HG2 . 6902 1 661 . 1 1 79 79 THR HG23 H 1 1.18 0.01 . 1 . . . . 111 THR HG2 . 6902 1 662 . 1 1 79 79 THR N N 15 119.4 0.1 . 1 . . . . 111 THR N . 6902 1 663 . 1 1 80 80 ALA H H 1 9.97 0.01 . 1 . . . . 112 ALA H . 6902 1 664 . 1 1 80 80 ALA HA H 1 5.16 0.01 . 1 . . . . 112 ALA HA . 6902 1 665 . 1 1 80 80 ALA HB1 H 1 1.51 0.01 . 1 . . . . 112 ALA HB . 6902 1 666 . 1 1 80 80 ALA HB2 H 1 1.51 0.01 . 1 . . . . 112 ALA HB . 6902 1 667 . 1 1 80 80 ALA HB3 H 1 1.51 0.01 . 1 . . . . 112 ALA HB . 6902 1 668 . 1 1 80 80 ALA N N 15 131.4 0.1 . 1 . . . . 112 ALA N . 6902 1 669 . 1 1 81 81 MET H H 1 9.14 0.01 . 1 . . . . 113 MET H . 6902 1 670 . 1 1 81 81 MET HA H 1 5.50 0.01 . 1 . . . . 113 MET HA . 6902 1 671 . 1 1 81 81 MET HB2 H 1 1.90 0.01 . 1 . . . . 113 MET HB2 . 6902 1 672 . 1 1 81 81 MET HB3 H 1 2.00 0.01 . 1 . . . . 113 MET HB3 . 6902 1 673 . 1 1 81 81 MET HG2 H 1 2.66 0.01 . 1 . . . . 113 MET HG2 . 6902 1 674 . 1 1 81 81 MET HG3 H 1 2.50 0.01 . 1 . . . . 113 MET HG3 . 6902 1 675 . 1 1 81 81 MET HE1 H 1 2.12 0.01 . 1 . . . . 113 MET HE . 6902 1 676 . 1 1 81 81 MET HE2 H 1 2.12 0.01 . 1 . . . . 113 MET HE . 6902 1 677 . 1 1 81 81 MET HE3 H 1 2.12 0.01 . 1 . . . . 113 MET HE . 6902 1 678 . 1 1 81 81 MET N N 15 120.2 0.1 . 1 . . . . 113 MET N . 6902 1 679 . 1 1 82 82 VAL H H 1 9.74 0.01 . 1 . . . . 114 VAL H . 6902 1 680 . 1 1 82 82 VAL HA H 1 5.61 0.01 . 1 . . . . 114 VAL HA . 6902 1 681 . 1 1 82 82 VAL HB H 1 2.03 0.01 . 1 . . . . 114 VAL HB . 6902 1 682 . 1 1 82 82 VAL HG11 H 1 0.85 0.01 . 1 . . . . 114 VAL HG1 . 6902 1 683 . 1 1 82 82 VAL HG12 H 1 0.85 0.01 . 1 . . . . 114 VAL HG1 . 6902 1 684 . 1 1 82 82 VAL HG13 H 1 0.85 0.01 . 1 . . . . 114 VAL HG1 . 6902 1 685 . 1 1 82 82 VAL HG21 H 1 0.91 0.01 . 1 . . . . 114 VAL HG2 . 6902 1 686 . 1 1 82 82 VAL HG22 H 1 0.91 0.01 . 1 . . . . 114 VAL HG2 . 6902 1 687 . 1 1 82 82 VAL HG23 H 1 0.91 0.01 . 1 . . . . 114 VAL HG2 . 6902 1 688 . 1 1 82 82 VAL N N 15 128.3 0.1 . 1 . . . . 114 VAL N . 6902 1 689 . 1 1 83 83 THR H H 1 9.29 0.01 . 1 . . . . 115 THR H . 6902 1 690 . 1 1 83 83 THR HA H 1 5.13 0.01 . 1 . . . . 115 THR HA . 6902 1 691 . 1 1 83 83 THR HB H 1 4.12 0.01 . 1 . . . . 115 THR HB . 6902 1 692 . 1 1 83 83 THR HG21 H 1 1.12 0.01 . 1 . . . . 115 THR HG2 . 6902 1 693 . 1 1 83 83 THR HG22 H 1 1.12 0.01 . 1 . . . . 115 THR HG2 . 6902 1 694 . 1 1 83 83 THR HG23 H 1 1.12 0.01 . 1 . . . . 115 THR HG2 . 6902 1 695 . 1 1 83 83 THR N N 15 119.6 0.1 . 1 . . . . 115 THR N . 6902 1 696 . 1 1 84 84 ALA H H 1 8.64 0.01 . 1 . . . . 116 ALA H . 6902 1 697 . 1 1 84 84 ALA HA H 1 5.37 0.01 . 1 . . . . 116 ALA HA . 6902 1 698 . 1 1 84 84 ALA HB1 H 1 1.11 0.01 . 1 . . . . 116 ALA HB . 6902 1 699 . 1 1 84 84 ALA HB2 H 1 1.11 0.01 . 1 . . . . 116 ALA HB . 6902 1 700 . 1 1 84 84 ALA HB3 H 1 1.11 0.01 . 1 . . . . 116 ALA HB . 6902 1 701 . 1 1 84 84 ALA N N 15 126.7 0.1 . 1 . . . . 116 ALA N . 6902 1 702 . 1 1 85 85 ASP H H 1 8.16 0.01 . 1 . . . . 117 ASP H . 6902 1 703 . 1 1 85 85 ASP HA H 1 4.48 0.01 . 1 . . . . 117 ASP HA . 6902 1 704 . 1 1 85 85 ASP HB2 H 1 2.98 0.01 . 1 . . . . 117 ASP HB2 . 6902 1 705 . 1 1 85 85 ASP HB3 H 1 2.49 0.01 . 1 . . . . 117 ASP HB3 . 6902 1 706 . 1 1 85 85 ASP N N 15 120.7 0.1 . 1 . . . . 117 ASP N . 6902 1 707 . 1 1 86 86 SER H H 1 8.66 0.01 . 1 . . . . 118 SER H . 6902 1 708 . 1 1 86 86 SER HA H 1 3.94 0.01 . 1 . . . . 118 SER HA . 6902 1 709 . 1 1 86 86 SER HB2 H 1 3.60 0.01 . 1 . . . . 118 SER HB2 . 6902 1 710 . 1 1 86 86 SER HB3 H 1 3.51 0.01 . 1 . . . . 118 SER HB3 . 6902 1 711 . 1 1 86 86 SER N N 15 121.0 0.1 . 1 . . . . 118 SER N . 6902 1 712 . 1 1 87 87 LYS H H 1 9.12 0.01 . 1 . . . . 119 LYS H . 6902 1 713 . 1 1 87 87 LYS HA H 1 3.99 0.01 . 1 . . . . 119 LYS HA . 6902 1 714 . 1 1 87 87 LYS HB2 H 1 1.65 0.01 . 1 . . . . 119 LYS HB2 . 6902 1 715 . 1 1 87 87 LYS HB3 H 1 1.28 0.01 . 1 . . . . 119 LYS HB3 . 6902 1 716 . 1 1 87 87 LYS HG2 H 1 0.55 0.01 . 1 . . . . 119 LYS HG2 . 6902 1 717 . 1 1 87 87 LYS HG3 H 1 0.93 0.01 . 1 . . . . 119 LYS HG3 . 6902 1 718 . 1 1 87 87 LYS HD2 H 1 1.39 0.01 . 2 . . . . 119 LYS HD2 . 6902 1 719 . 1 1 87 87 LYS HD3 H 1 1.37 0.01 . 2 . . . . 119 LYS HD3 . 6902 1 720 . 1 1 87 87 LYS HE2 H 1 2.75 0.01 . 1 . . . . 119 LYS HE2 . 6902 1 721 . 1 1 87 87 LYS HE3 H 1 2.75 0.01 . 1 . . . . 119 LYS HE3 . 6902 1 722 . 1 1 87 87 LYS N N 15 125.6 0.1 . 1 . . . . 119 LYS N . 6902 1 723 . 1 1 88 88 TYR H H 1 7.62 0.01 . 1 . . . . 120 TYR H . 6902 1 724 . 1 1 88 88 TYR HA H 1 4.73 0.01 . 1 . . . . 120 TYR HA . 6902 1 725 . 1 1 88 88 TYR HB2 H 1 2.58 0.01 . 1 . . . . 120 TYR HB2 . 6902 1 726 . 1 1 88 88 TYR HB3 H 1 3.26 0.01 . 1 . . . . 120 TYR HB3 . 6902 1 727 . 1 1 88 88 TYR HD1 H 1 6.92 0.01 . 1 . . . . 120 TYR HD1 . 6902 1 728 . 1 1 88 88 TYR HD2 H 1 6.92 0.01 . 1 . . . . 120 TYR HD2 . 6902 1 729 . 1 1 88 88 TYR HE1 H 1 6.69 0.01 . 1 . . . . 120 TYR HE1 . 6902 1 730 . 1 1 88 88 TYR HE2 H 1 6.69 0.01 . 1 . . . . 120 TYR HE2 . 6902 1 731 . 1 1 88 88 TYR N N 15 115.9 0.1 . 1 . . . . 120 TYR N . 6902 1 732 . 1 1 89 89 CYS H H 1 7.71 0.01 . 1 . . . . 121 CYS H . 6902 1 733 . 1 1 89 89 CYS HA H 1 4.43 0.01 . 1 . . . . 121 CYS HA . 6902 1 734 . 1 1 89 89 CYS HB2 H 1 3.22 0.01 . 1 . . . . 121 CYS HB2 . 6902 1 735 . 1 1 89 89 CYS HB3 H 1 2.33 0.01 . 1 . . . . 121 CYS HB3 . 6902 1 736 . 1 1 89 89 CYS HG H 1 2.60 0.01 . 1 . . . . 121 CYS HG . 6902 1 737 . 1 1 89 89 CYS N N 15 119.9 0.1 . 1 . . . . 121 CYS N . 6902 1 738 . 1 1 90 90 TYR H H 1 9.37 0.01 . 1 . . . . 122 TYR H . 6902 1 739 . 1 1 90 90 TYR HA H 1 4.59 0.01 . 1 . . . . 122 TYR HA . 6902 1 740 . 1 1 90 90 TYR HB2 H 1 2.64 0.01 . 1 . . . . 122 TYR HB2 . 6902 1 741 . 1 1 90 90 TYR HB3 H 1 3.16 0.01 . 1 . . . . 122 TYR HB3 . 6902 1 742 . 1 1 90 90 TYR HD1 H 1 7.17 0.01 . 1 . . . . 122 TYR HD1 . 6902 1 743 . 1 1 90 90 TYR HD2 H 1 7.17 0.01 . 1 . . . . 122 TYR HD2 . 6902 1 744 . 1 1 90 90 TYR HE1 H 1 6.67 0.01 . 1 . . . . 122 TYR HE1 . 6902 1 745 . 1 1 90 90 TYR HE2 H 1 6.67 0.01 . 1 . . . . 122 TYR HE2 . 6902 1 746 . 1 1 90 90 TYR N N 15 122.6 0.1 . 1 . . . . 122 TYR N . 6902 1 747 . 1 1 91 91 GLY H H 1 8.01 0.01 . 1 . . . . 123 GLY H . 6902 1 748 . 1 1 91 91 GLY HA2 H 1 4.16 0.01 . 1 . . . . 123 GLY HA2 . 6902 1 749 . 1 1 91 91 GLY HA3 H 1 3.61 0.01 . 1 . . . . 123 GLY HA3 . 6902 1 750 . 1 1 91 91 GLY N N 15 107.2 0.1 . 1 . . . . 123 GLY N . 6902 1 751 . 1 1 92 92 PRO HA H 1 3.32 0.01 . 1 . . . . 124 PRO HA . 6902 1 752 . 1 1 92 92 PRO HB2 H 1 2.30 0.01 . 1 . . . . 124 PRO HB2 . 6902 1 753 . 1 1 92 92 PRO HB3 H 1 1.92 0.01 . 1 . . . . 124 PRO HB3 . 6902 1 754 . 1 1 92 92 PRO HG2 H 1 2.08 0.01 . 1 . . . . 124 PRO HG2 . 6902 1 755 . 1 1 92 92 PRO HG3 H 1 1.99 0.01 . 1 . . . . 124 PRO HG3 . 6902 1 756 . 1 1 92 92 PRO HD2 H 1 3.60 0.01 . 1 . . . . 124 PRO HD2 . 6902 1 757 . 1 1 92 92 PRO HD3 H 1 3.96 0.01 . 1 . . . . 124 PRO HD3 . 6902 1 758 . 1 1 93 93 GLN H H 1 7.98 0.01 . 1 . . . . 125 GLN H . 6902 1 759 . 1 1 93 93 GLN HA H 1 4.14 0.01 . 1 . . . . 125 GLN HA . 6902 1 760 . 1 1 93 93 GLN HB2 H 1 2.16 0.01 . 1 . . . . 125 GLN HB2 . 6902 1 761 . 1 1 93 93 GLN HB3 H 1 2.31 0.01 . 1 . . . . 125 GLN HB3 . 6902 1 762 . 1 1 93 93 GLN HG2 H 1 2.57 0.01 . 1 . . . . 125 GLN HG2 . 6902 1 763 . 1 1 93 93 GLN HG3 H 1 2.44 0.01 . 1 . . . . 125 GLN HG3 . 6902 1 764 . 1 1 93 93 GLN HE21 H 1 7.55 0.01 . 2 . . . . 125 GLN HE21 . 6902 1 765 . 1 1 93 93 GLN HE22 H 1 6.89 0.01 . 2 . . . . 125 GLN HE22 . 6902 1 766 . 1 1 93 93 GLN N N 15 114.4 0.1 . 1 . . . . 125 GLN N . 6902 1 767 . 1 1 93 93 GLN NE2 N 15 111.8 0.1 . 1 . . . . 125 GLN NE2 . 6902 1 768 . 1 1 94 94 GLY H H 1 6.98 0.01 . 1 . . . . 126 GLY H . 6902 1 769 . 1 1 94 94 GLY HA2 H 1 3.69 0.01 . 2 . . . . 126 GLY HA2 . 6902 1 770 . 1 1 94 94 GLY HA3 H 1 3.59 0.01 . 2 . . . . 126 GLY HA3 . 6902 1 771 . 1 1 94 94 GLY N N 15 103.9 0.1 . 1 . . . . 126 GLY N . 6902 1 772 . 1 1 95 95 ARG H H 1 8.63 0.01 . 1 . . . . 127 ARG H . 6902 1 773 . 1 1 95 95 ARG HA H 1 4.24 0.01 . 1 . . . . 127 ARG HA . 6902 1 774 . 1 1 95 95 ARG HB2 H 1 0.57 0.01 . 1 . . . . 127 ARG HB2 . 6902 1 775 . 1 1 95 95 ARG HB3 H 1 0.57 0.01 . 1 . . . . 127 ARG HB3 . 6902 1 776 . 1 1 95 95 ARG HG2 H 1 1.13 0.01 . 1 . . . . 127 ARG HG2 . 6902 1 777 . 1 1 95 95 ARG HG3 H 1 1.28 0.01 . 1 . . . . 127 ARG HG3 . 6902 1 778 . 1 1 95 95 ARG HD2 H 1 2.72 0.01 . 1 . . . . 127 ARG HD2 . 6902 1 779 . 1 1 95 95 ARG HD3 H 1 2.82 0.01 . 1 . . . . 127 ARG HD3 . 6902 1 780 . 1 1 95 95 ARG HE H 1 7.04 0.01 . 1 . . . . 127 ARG HE . 6902 1 781 . 1 1 95 95 ARG N N 15 120.2 0.1 . 1 . . . . 127 ARG N . 6902 1 782 . 1 1 96 96 SER H H 1 8.01 0.01 . 1 . . . . 128 SER H . 6902 1 783 . 1 1 96 96 SER HA H 1 4.34 0.01 . 1 . . . . 128 SER HA . 6902 1 784 . 1 1 96 96 SER HB2 H 1 3.83 0.01 . 2 . . . . 128 SER HB2 . 6902 1 785 . 1 1 96 96 SER HB3 H 1 3.73 0.01 . 2 . . . . 128 SER HB3 . 6902 1 786 . 1 1 96 96 SER N N 15 114.0 0.1 . 9 . . . . 128 SER N . 6902 1 787 . 1 1 97 97 PRO HA H 1 4.73 0.01 . 1 . . . . 129 PRO HA . 6902 1 788 . 1 1 97 97 PRO HB2 H 1 1.99 0.01 . 2 . . . . 129 PRO HB2 . 6902 1 789 . 1 1 97 97 PRO HB3 H 1 1.65 0.01 . 2 . . . . 129 PRO HB3 . 6902 1 790 . 1 1 97 97 PRO HG2 H 1 0.54 0.01 . 1 . . . . 129 PRO HG2 . 6902 1 791 . 1 1 97 97 PRO HG3 H 1 1.58 0.01 . 1 . . . . 129 PRO HG3 . 6902 1 792 . 1 1 97 97 PRO HD2 H 1 3.16 0.01 . 1 . . . . 129 PRO HD2 . 6902 1 793 . 1 1 97 97 PRO HD3 H 1 3.40 0.01 . 1 . . . . 129 PRO HD3 . 6902 1 794 . 1 1 98 98 TYR H H 1 7.73 0.01 . 1 . . . . 130 TYR H . 6902 1 795 . 1 1 98 98 TYR HA H 1 4.70 0.01 . 1 . . . . 130 TYR HA . 6902 1 796 . 1 1 98 98 TYR HB2 H 1 2.95 0.01 . 1 . . . . 130 TYR HB2 . 6902 1 797 . 1 1 98 98 TYR HB3 H 1 3.27 0.01 . 1 . . . . 130 TYR HB3 . 6902 1 798 . 1 1 98 98 TYR HD1 H 1 7.15 0.01 . 1 . . . . 130 TYR HD1 . 6902 1 799 . 1 1 98 98 TYR HD2 H 1 7.15 0.01 . 1 . . . . 130 TYR HD2 . 6902 1 800 . 1 1 98 98 TYR HE1 H 1 6.88 0.01 . 1 . . . . 130 TYR HE1 . 6902 1 801 . 1 1 98 98 TYR HE2 H 1 6.88 0.01 . 1 . . . . 130 TYR HE2 . 6902 1 802 . 1 1 98 98 TYR N N 15 119.9 0.1 . 1 . . . . 130 TYR N . 6902 1 803 . 1 1 99 99 ILE H H 1 7.84 0.01 . 1 . . . . 131 ILE H . 6902 1 804 . 1 1 99 99 ILE HA H 1 4.74 0.01 . 1 . . . . 131 ILE HA . 6902 1 805 . 1 1 99 99 ILE HB H 1 1.72 0.01 . 1 . . . . 131 ILE HB . 6902 1 806 . 1 1 99 99 ILE HG12 H 1 0.91 0.01 . 1 . . . . 131 ILE HG12 . 6902 1 807 . 1 1 99 99 ILE HG13 H 1 0.91 0.01 . 1 . . . . 131 ILE HG13 . 6902 1 808 . 1 1 99 99 ILE HG21 H 1 1.02 0.01 . 1 . . . . 131 ILE HG2 . 6902 1 809 . 1 1 99 99 ILE HG22 H 1 1.02 0.01 . 1 . . . . 131 ILE HG2 . 6902 1 810 . 1 1 99 99 ILE HG23 H 1 1.02 0.01 . 1 . . . . 131 ILE HG2 . 6902 1 811 . 1 1 99 99 ILE HD11 H 1 0.78 0.01 . 1 . . . . 131 ILE HD1 . 6902 1 812 . 1 1 99 99 ILE HD12 H 1 0.78 0.01 . 1 . . . . 131 ILE HD1 . 6902 1 813 . 1 1 99 99 ILE HD13 H 1 0.78 0.01 . 1 . . . . 131 ILE HD1 . 6902 1 814 . 1 1 99 99 ILE N N 15 118.1 0.1 . 1 . . . . 131 ILE N . 6902 1 815 . 1 1 100 100 PRO HA H 1 3.72 0.01 . 9 . . . . 132 PRO HA . 6902 1 816 . 1 1 100 100 PRO HB2 H 1 1.97 0.01 . 9 . . . . 132 PRO HB2 . 6902 1 817 . 1 1 100 100 PRO HB3 H 1 1.97 0.01 . 9 . . . . 132 PRO HB3 . 6902 1 818 . 1 1 100 100 PRO HG2 H 1 2.05 0.01 . 9 . . . . 132 PRO HG2 . 6902 1 819 . 1 1 100 100 PRO HG3 H 1 2.05 0.01 . 9 . . . . 132 PRO HG3 . 6902 1 820 . 1 1 100 100 PRO HD2 H 1 3.68 0.01 . 9 . . . . 132 PRO HD2 . 6902 1 821 . 1 1 100 100 PRO HD3 H 1 3.53 0.01 . 9 . . . . 132 PRO HD3 . 6902 1 822 . 1 1 101 101 PRO HA H 1 4.33 0.01 . 1 . . . . 133 PRO HA . 6902 1 823 . 1 1 101 101 PRO HB2 H 1 2.03 0.01 . 2 . . . . 133 PRO HB2 . 6902 1 824 . 1 1 101 101 PRO HB3 H 1 1.93 0.01 . 2 . . . . 133 PRO HB3 . 6902 1 825 . 1 1 101 101 PRO HG2 H 1 1.57 0.01 . 1 . . . . 133 PRO HG2 . 6902 1 826 . 1 1 101 101 PRO HG3 H 1 2.25 0.01 . 1 . . . . 133 PRO HG3 . 6902 1 827 . 1 1 101 101 PRO HD2 H 1 3.60 0.01 . 1 . . . . 133 PRO HD2 . 6902 1 828 . 1 1 101 101 PRO HD3 H 1 3.60 0.01 . 1 . . . . 133 PRO HD3 . 6902 1 829 . 1 1 102 102 HIS H H 1 7.82 0.01 . 1 . . . . 134 HIS H . 6902 1 830 . 1 1 102 102 HIS HA H 1 3.86 0.01 . 1 . . . . 134 HIS HA . 6902 1 831 . 1 1 102 102 HIS HB2 H 1 3.25 0.01 . 2 . . . . 134 HIS HB2 . 6902 1 832 . 1 1 102 102 HIS HB3 H 1 3.19 0.01 . 2 . . . . 134 HIS HB3 . 6902 1 833 . 1 1 102 102 HIS HD2 H 1 6.91 0.01 . 1 . . . . 134 HIS HD2 . 6902 1 834 . 1 1 102 102 HIS HE1 H 1 7.80 0.01 . 1 . . . . 134 HIS HE1 . 6902 1 835 . 1 1 102 102 HIS N N 15 115.9 0.1 . 1 . . . . 134 HIS N . 6902 1 836 . 1 1 103 103 ALA H H 1 7.49 0.01 . 1 . . . . 135 ALA H . 6902 1 837 . 1 1 103 103 ALA HA H 1 4.48 0.01 . 1 . . . . 135 ALA HA . 6902 1 838 . 1 1 103 103 ALA HB1 H 1 1.35 0.01 . 1 . . . . 135 ALA HB . 6902 1 839 . 1 1 103 103 ALA HB2 H 1 1.35 0.01 . 1 . . . . 135 ALA HB . 6902 1 840 . 1 1 103 103 ALA HB3 H 1 1.35 0.01 . 1 . . . . 135 ALA HB . 6902 1 841 . 1 1 103 103 ALA N N 15 122.2 0.1 . 1 . . . . 135 ALA N . 6902 1 842 . 1 1 104 104 ALA H H 1 8.49 0.01 . 1 . . . . 136 ALA H . 6902 1 843 . 1 1 104 104 ALA HA H 1 4.62 0.01 . 1 . . . . 136 ALA HA . 6902 1 844 . 1 1 104 104 ALA HB1 H 1 1.46 0.01 . 1 . . . . 136 ALA HB . 6902 1 845 . 1 1 104 104 ALA HB2 H 1 1.46 0.01 . 1 . . . . 136 ALA HB . 6902 1 846 . 1 1 104 104 ALA HB3 H 1 1.46 0.01 . 1 . . . . 136 ALA HB . 6902 1 847 . 1 1 104 104 ALA N N 15 129.1 0.1 . 1 . . . . 136 ALA N . 6902 1 848 . 1 1 105 105 LEU H H 1 8.24 0.01 . 1 . . . . 137 LEU H . 6902 1 849 . 1 1 105 105 LEU HA H 1 5.25 0.01 . 1 . . . . 137 LEU HA . 6902 1 850 . 1 1 105 105 LEU HB2 H 1 1.90 0.01 . 1 . . . . 137 LEU HB2 . 6902 1 851 . 1 1 105 105 LEU HB3 H 1 1.90 0.01 . 1 . . . . 137 LEU HB3 . 6902 1 852 . 1 1 105 105 LEU HG H 1 1.41 0.01 . 1 . . . . 137 LEU HG . 6902 1 853 . 1 1 105 105 LEU HD11 H 1 1.05 0.01 . 1 . . . . 137 LEU HD1 . 6902 1 854 . 1 1 105 105 LEU HD12 H 1 1.05 0.01 . 1 . . . . 137 LEU HD1 . 6902 1 855 . 1 1 105 105 LEU HD13 H 1 1.05 0.01 . 1 . . . . 137 LEU HD1 . 6902 1 856 . 1 1 105 105 LEU HD21 H 1 0.89 0.01 . 1 . . . . 137 LEU HD2 . 6902 1 857 . 1 1 105 105 LEU HD22 H 1 0.89 0.01 . 1 . . . . 137 LEU HD2 . 6902 1 858 . 1 1 105 105 LEU HD23 H 1 0.89 0.01 . 1 . . . . 137 LEU HD2 . 6902 1 859 . 1 1 105 105 LEU N N 15 117.2 0.1 . 1 . . . . 137 LEU N . 6902 1 860 . 1 1 106 106 CYS H H 1 8.84 0.01 . 1 . . . . 138 CYS H . 6902 1 861 . 1 1 106 106 CYS HA H 1 5.06 0.01 . 1 . . . . 138 CYS HA . 6902 1 862 . 1 1 106 106 CYS HB2 H 1 2.70 0.01 . 1 . . . . 138 CYS HB2 . 6902 1 863 . 1 1 106 106 CYS HB3 H 1 2.90 0.01 . 1 . . . . 138 CYS HB3 . 6902 1 864 . 1 1 106 106 CYS N N 15 120.9 0.1 . 1 . . . . 138 CYS N . 6902 1 865 . 1 1 107 107 LEU H H 1 9.92 0.01 . 1 . . . . 139 LEU H . 6902 1 866 . 1 1 107 107 LEU HA H 1 5.23 0.01 . 1 . . . . 139 LEU HA . 6902 1 867 . 1 1 107 107 LEU HB2 H 1 1.89 0.01 . 1 . . . . 139 LEU HB2 . 6902 1 868 . 1 1 107 107 LEU HB3 H 1 1.66 0.01 . 1 . . . . 139 LEU HB3 . 6902 1 869 . 1 1 107 107 LEU HG H 1 1.27 0.01 . 1 . . . . 139 LEU HG . 6902 1 870 . 1 1 107 107 LEU HD11 H 1 0.94 0.01 . 1 . . . . 139 LEU HD1 . 6902 1 871 . 1 1 107 107 LEU HD12 H 1 0.94 0.01 . 1 . . . . 139 LEU HD1 . 6902 1 872 . 1 1 107 107 LEU HD13 H 1 0.94 0.01 . 1 . . . . 139 LEU HD1 . 6902 1 873 . 1 1 107 107 LEU HD21 H 1 0.69 0.01 . 1 . . . . 139 LEU HD2 . 6902 1 874 . 1 1 107 107 LEU HD22 H 1 0.69 0.01 . 1 . . . . 139 LEU HD2 . 6902 1 875 . 1 1 107 107 LEU HD23 H 1 0.69 0.01 . 1 . . . . 139 LEU HD2 . 6902 1 876 . 1 1 107 107 LEU N N 15 127.9 0.1 . 1 . . . . 139 LEU N . 6902 1 877 . 1 1 108 108 GLU H H 1 9.21 0.01 . 1 . . . . 140 GLU H . 6902 1 878 . 1 1 108 108 GLU HA H 1 5.20 0.01 . 1 . . . . 140 GLU HA . 6902 1 879 . 1 1 108 108 GLU HB2 H 1 2.03 0.01 . 1 . . . . 140 GLU HB2 . 6902 1 880 . 1 1 108 108 GLU HB3 H 1 2.03 0.01 . 1 . . . . 140 GLU HB3 . 6902 1 881 . 1 1 108 108 GLU HG2 H 1 1.94 0.01 . 1 . . . . 140 GLU HG2 . 6902 1 882 . 1 1 108 108 GLU HG3 H 1 1.94 0.01 . 1 . . . . 140 GLU HG3 . 6902 1 883 . 1 1 108 108 GLU N N 15 125.3 0.1 . 1 . . . . 140 GLU N . 6902 1 884 . 1 1 109 109 VAL H H 1 9.42 0.01 . 1 . . . . 141 VAL H . 6902 1 885 . 1 1 109 109 VAL HA H 1 4.96 0.01 . 1 . . . . 141 VAL HA . 6902 1 886 . 1 1 109 109 VAL HB H 1 1.96 0.01 . 1 . . . . 141 VAL HB . 6902 1 887 . 1 1 109 109 VAL HG11 H 1 0.84 0.01 . 1 . . . . 141 VAL HG1 . 6902 1 888 . 1 1 109 109 VAL HG12 H 1 0.84 0.01 . 1 . . . . 141 VAL HG1 . 6902 1 889 . 1 1 109 109 VAL HG13 H 1 0.84 0.01 . 1 . . . . 141 VAL HG1 . 6902 1 890 . 1 1 109 109 VAL HG21 H 1 0.82 0.01 . 1 . . . . 141 VAL HG2 . 6902 1 891 . 1 1 109 109 VAL HG22 H 1 0.82 0.01 . 1 . . . . 141 VAL HG2 . 6902 1 892 . 1 1 109 109 VAL HG23 H 1 0.82 0.01 . 1 . . . . 141 VAL HG2 . 6902 1 893 . 1 1 109 109 VAL N N 15 128.0 0.1 . 1 . . . . 141 VAL N . 6902 1 894 . 1 1 110 110 THR H H 1 9.22 0.01 . 1 . . . . 142 THR H . 6902 1 895 . 1 1 110 110 THR HA H 1 5.58 0.01 . 1 . . . . 142 THR HA . 6902 1 896 . 1 1 110 110 THR HB H 1 4.07 0.01 . 1 . . . . 142 THR HB . 6902 1 897 . 1 1 110 110 THR HG21 H 1 1.03 0.01 . 1 . . . . 142 THR HG2 . 6902 1 898 . 1 1 110 110 THR HG22 H 1 1.03 0.01 . 1 . . . . 142 THR HG2 . 6902 1 899 . 1 1 110 110 THR HG23 H 1 1.03 0.01 . 1 . . . . 142 THR HG2 . 6902 1 900 . 1 1 110 110 THR N N 15 124.1 0.1 . 1 . . . . 142 THR N . 6902 1 901 . 1 1 111 111 LEU H H 1 8.44 0.01 . 1 . . . . 143 LEU H . 6902 1 902 . 1 1 111 111 LEU HA H 1 4.66 0.01 . 1 . . . . 143 LEU HA . 6902 1 903 . 1 1 111 111 LEU HB2 H 1 1.92 0.01 . 1 . . . . 143 LEU HB2 . 6902 1 904 . 1 1 111 111 LEU HB3 H 1 1.92 0.01 . 1 . . . . 143 LEU HB3 . 6902 1 905 . 1 1 111 111 LEU HG H 1 1.44 0.01 . 1 . . . . 143 LEU HG . 6902 1 906 . 1 1 111 111 LEU HD11 H 1 0.88 0.01 . 1 . . . . 143 LEU HD1 . 6902 1 907 . 1 1 111 111 LEU HD12 H 1 0.88 0.01 . 1 . . . . 143 LEU HD1 . 6902 1 908 . 1 1 111 111 LEU HD13 H 1 0.88 0.01 . 1 . . . . 143 LEU HD1 . 6902 1 909 . 1 1 111 111 LEU HD21 H 1 0.76 0.01 . 1 . . . . 143 LEU HD2 . 6902 1 910 . 1 1 111 111 LEU HD22 H 1 0.76 0.01 . 1 . . . . 143 LEU HD2 . 6902 1 911 . 1 1 111 111 LEU HD23 H 1 0.76 0.01 . 1 . . . . 143 LEU HD2 . 6902 1 912 . 1 1 111 111 LEU N N 15 129.4 0.1 . 1 . . . . 143 LEU N . 6902 1 913 . 1 1 112 112 LYS H H 1 8.98 0.01 . 1 . . . . 144 LYS H . 6902 1 914 . 1 1 112 112 LYS HA H 1 4.30 0.01 . 1 . . . . 144 LYS HA . 6902 1 915 . 1 1 112 112 LYS HB2 H 1 1.67 0.01 . 1 . . . . 144 LYS HB2 . 6902 1 916 . 1 1 112 112 LYS HB3 H 1 1.85 0.01 . 1 . . . . 144 LYS HB3 . 6902 1 917 . 1 1 112 112 LYS HG2 H 1 1.38 0.01 . 1 . . . . 144 LYS HG2 . 6902 1 918 . 1 1 112 112 LYS HG3 H 1 1.53 0.01 . 1 . . . . 144 LYS HG3 . 6902 1 919 . 1 1 112 112 LYS HD2 H 1 1.73 0.01 . 2 . . . . 144 LYS HD2 . 6902 1 920 . 1 1 112 112 LYS HD3 H 1 1.63 0.01 . 2 . . . . 144 LYS HD3 . 6902 1 921 . 1 1 112 112 LYS HE2 H 1 2.95 0.01 . 1 . . . . 144 LYS HE2 . 6902 1 922 . 1 1 112 112 LYS HE3 H 1 2.95 0.01 . 1 . . . . 144 LYS HE3 . 6902 1 923 . 1 1 112 112 LYS N N 15 128.5 0.1 . 1 . . . . 144 LYS N . 6902 1 924 . 1 1 113 113 THR H H 1 7.36 0.01 . 1 . . . . 145 THR H . 6902 1 925 . 1 1 113 113 THR HA H 1 4.52 0.01 . 1 . . . . 145 THR HA . 6902 1 926 . 1 1 113 113 THR HB H 1 4.06 0.01 . 1 . . . . 145 THR HB . 6902 1 927 . 1 1 113 113 THR HG1 H 1 5.53 0.01 . 1 . . . . 145 THR HG1 . 6902 1 928 . 1 1 113 113 THR HG21 H 1 1.10 0.01 . 1 . . . . 145 THR HG2 . 6902 1 929 . 1 1 113 113 THR HG22 H 1 1.10 0.01 . 1 . . . . 145 THR HG2 . 6902 1 930 . 1 1 113 113 THR HG23 H 1 1.10 0.01 . 1 . . . . 145 THR HG2 . 6902 1 931 . 1 1 113 113 THR N N 15 106.1 0.1 . 1 . . . . 145 THR N . 6902 1 932 . 1 1 114 114 ALA H H 1 8.33 0.01 . 1 . . . . 146 ALA H . 6902 1 933 . 1 1 114 114 ALA HA H 1 5.02 0.01 . 1 . . . . 146 ALA HA . 6902 1 934 . 1 1 114 114 ALA HB1 H 1 1.11 0.01 . 1 . . . . 146 ALA HB . 6902 1 935 . 1 1 114 114 ALA HB2 H 1 1.11 0.01 . 1 . . . . 146 ALA HB . 6902 1 936 . 1 1 114 114 ALA HB3 H 1 1.11 0.01 . 1 . . . . 146 ALA HB . 6902 1 937 . 1 1 114 114 ALA N N 15 123.0 0.1 . 1 . . . . 146 ALA N . 6902 1 938 . 1 1 115 115 VAL H H 1 8.68 0.01 . 1 . . . . 147 VAL H . 6902 1 939 . 1 1 115 115 VAL HA H 1 4.66 0.01 . 1 . . . . 147 VAL HA . 6902 1 940 . 1 1 115 115 VAL HB H 1 2.19 0.01 . 1 . . . . 147 VAL HB . 6902 1 941 . 1 1 115 115 VAL HG11 H 1 0.91 0.01 . 1 . . . . 147 VAL HG1 . 6902 1 942 . 1 1 115 115 VAL HG12 H 1 0.91 0.01 . 1 . . . . 147 VAL HG1 . 6902 1 943 . 1 1 115 115 VAL HG13 H 1 0.91 0.01 . 1 . . . . 147 VAL HG1 . 6902 1 944 . 1 1 115 115 VAL HG21 H 1 0.82 0.01 . 1 . . . . 147 VAL HG2 . 6902 1 945 . 1 1 115 115 VAL HG22 H 1 0.82 0.01 . 1 . . . . 147 VAL HG2 . 6902 1 946 . 1 1 115 115 VAL HG23 H 1 0.82 0.01 . 1 . . . . 147 VAL HG2 . 6902 1 947 . 1 1 115 115 VAL N N 15 117.7 0.1 . 1 . . . . 147 VAL N . 6902 1 948 . 1 1 116 116 ASP H H 1 8.55 0.01 . 1 . . . . 148 ASP H . 6902 1 949 . 1 1 116 116 ASP HA H 1 4.66 0.01 . 1 . . . . 148 ASP HA . 6902 1 950 . 1 1 116 116 ASP HB2 H 1 2.77 0.01 . 1 . . . . 148 ASP HB2 . 6902 1 951 . 1 1 116 116 ASP HB3 H 1 2.57 0.01 . 1 . . . . 148 ASP HB3 . 6902 1 952 . 1 1 116 116 ASP N N 15 122.5 0.1 . 1 . . . . 148 ASP N . 6902 1 953 . 1 1 117 117 GLY H H 1 8.45 0.01 . 1 . . . . 149 GLY H . 6902 1 954 . 1 1 117 117 GLY HA2 H 1 4.22 0.01 . 1 . . . . 149 GLY HA2 . 6902 1 955 . 1 1 117 117 GLY HA3 H 1 3.98 0.01 . 1 . . . . 149 GLY HA3 . 6902 1 956 . 1 1 117 117 GLY N N 15 109.0 0.1 . 1 . . . . 149 GLY N . 6902 1 957 . 1 1 118 118 PRO HA H 1 4.41 0.01 . 1 . . . . 150 PRO HA . 6902 1 958 . 1 1 118 118 PRO HB2 H 1 1.92 0.01 . 1 . . . . 150 PRO HB2 . 6902 1 959 . 1 1 118 118 PRO HB3 H 1 2.25 0.01 . 1 . . . . 150 PRO HB3 . 6902 1 960 . 1 1 118 118 PRO HG2 H 1 1.97 0.01 . 1 . . . . 150 PRO HG2 . 6902 1 961 . 1 1 118 118 PRO HG3 H 1 2.00 0.01 . 1 . . . . 150 PRO HG3 . 6902 1 962 . 1 1 118 118 PRO HD2 H 1 3.63 0.01 . 2 . . . . 150 PRO HD2 . 6902 1 963 . 1 1 118 118 PRO HD3 H 1 3.56 0.01 . 2 . . . . 150 PRO HD3 . 6902 1 964 . 1 1 119 119 ASP H H 1 8.43 0.01 . 1 . . . . 151 ASP H . 6902 1 965 . 1 1 119 119 ASP HA H 1 4.60 0.01 . 1 . . . . 151 ASP HA . 6902 1 966 . 1 1 119 119 ASP HB2 H 1 2.58 0.01 . 1 . . . . 151 ASP HB2 . 6902 1 967 . 1 1 119 119 ASP HB3 H 1 2.74 0.01 . 1 . . . . 151 ASP HB3 . 6902 1 968 . 1 1 119 119 ASP N N 15 120.0 0.1 . 1 . . . . 151 ASP N . 6902 1 969 . 1 1 120 120 LEU H H 1 8.16 0.01 . 1 . . . . 152 LEU H . 6902 1 970 . 1 1 120 120 LEU HA H 1 4.36 0.01 . 1 . . . . 152 LEU HA . 6902 1 971 . 1 1 120 120 LEU HB2 H 1 1.63 0.01 . 1 . . . . 152 LEU HB2 . 6902 1 972 . 1 1 120 120 LEU HB3 H 1 1.63 0.01 . 1 . . . . 152 LEU HB3 . 6902 1 973 . 1 1 120 120 LEU HG H 1 1.63 0.01 . 1 . . . . 152 LEU HG . 6902 1 974 . 1 1 120 120 LEU HD11 H 1 0.91 0.01 . 2 . . . . 152 LEU HD1 . 6902 1 975 . 1 1 120 120 LEU HD12 H 1 0.91 0.01 . 2 . . . . 152 LEU HD1 . 6902 1 976 . 1 1 120 120 LEU HD13 H 1 0.91 0.01 . 2 . . . . 152 LEU HD1 . 6902 1 977 . 1 1 120 120 LEU HD21 H 1 0.86 0.01 . 2 . . . . 152 LEU HD2 . 6902 1 978 . 1 1 120 120 LEU HD22 H 1 0.86 0.01 . 2 . . . . 152 LEU HD2 . 6902 1 979 . 1 1 120 120 LEU HD23 H 1 0.86 0.01 . 2 . . . . 152 LEU HD2 . 6902 1 980 . 1 1 120 120 LEU N N 15 123.0 0.1 . 1 . . . . 152 LEU N . 6902 1 981 . 1 1 121 121 GLU H H 1 7.86 0.01 . 1 . . . . 153 GLU H . 6902 1 982 . 1 1 121 121 GLU HA H 1 4.09 0.01 . 1 . . . . 153 GLU HA . 6902 1 983 . 1 1 121 121 GLU HB2 H 1 1.90 0.01 . 1 . . . . 153 GLU HB2 . 6902 1 984 . 1 1 121 121 GLU HB3 H 1 2.03 0.01 . 1 . . . . 153 GLU HB3 . 6902 1 985 . 1 1 121 121 GLU HG2 H 1 2.20 0.01 . 1 . . . . 153 GLU HG2 . 6902 1 986 . 1 1 121 121 GLU HG3 H 1 2.20 0.01 . 1 . . . . 153 GLU HG3 . 6902 1 987 . 1 1 121 121 GLU N N 15 126.5 0.1 . 1 . . . . 153 GLU N . 6902 1 stop_ save_