data_10011 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10011 _Entry.Title ; SOLUTION STRUCTURE OF THE SWIRM DOMAIN OF HUMAN LSD1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-11-07 _Entry.Accession_date 2005-11-07 _Entry.Last_release_date 2006-11-14 _Entry.Original_release_date 2006-11-14 _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 . _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 N. Tochio . . . 10011 2 T. Umehara . . . 10011 3 S. Koshiba . . . 10011 4 M. Inoue . . . 10011 5 A. TANAKA . . . 10011 6 T. Kigawa . . . 10011 7 S. Yokoyama . . . 10011 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10011 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 525 10011 '15N chemical shifts' 119 10011 '1H chemical shifts' 828 10011 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2006-11-14 2005-11-07 original author . 10011 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2COM 'BMRB Entry Tracking System' 10011 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10011 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16531230 _Citation.Full_citation . _Citation.Title 'Solution structure of the SWIRM domain of human histone demethylase LSD1' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full . _Citation.Journal_volume 14 _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 457 _Citation.Page_last 468 _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 N. Tochio . . . 10011 1 2 T. Umehara . . . 10011 1 3 S. Koshiba . . . 10011 1 4 M. Inoue . . . 10011 1 5 T. Yabuki . . . 10011 1 6 M. Aoki . . . 10011 1 7 E. Seki . . . 10011 1 8 S. Watanabe . . . 10011 1 9 Y. Tomo . . . 10011 1 10 M. Hanada . . . 10011 1 11 M. Ikari . . . 10011 1 12 M. Sato . . . 10011 1 13 T. Terada . . . 10011 1 14 T. Nagase . . . 10011 1 15 O. Ohara . . . 10011 1 16 M. Shirouzu . . . 10011 1 17 A. Tanaka . . . 10011 1 18 T. Kigawa . . . 10011 1 19 S. Yokoyama . . . 10011 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID AOF2 10011 1 'HISTONE MODULATION' 10011 1 KIAA0601 10011 1 LSD1 10011 1 'NATIONAL PROJECT ON PROTEIN STRUCTURAL AND FUNCTIONAL ANALYSES' 10011 1 NPPSFA 10011 1 'RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE' 10011 1 RSGI 10011 1 'structural genomics' 10011 1 'SWIRM DOMAIN' 10011 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10011 _Assembly.ID 1 _Assembly.Name 'the SWIRM domain of human LSD1' _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 . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID 'protein monomer' 10011 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 'SWIRM domain' 1 $SWIRM_domain . . yes native no no . . . 10011 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2COM . . . . . . 10011 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_SWIRM_domain _Entity.Sf_category entity _Entity.Sf_framecode SWIRM_domain _Entity.Entry_ID 10011 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'SWIRM domain' _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 ; GSSGSSGEEPSGVEGAAFQS RLPHDRMTSQEAACFPDIIS GPQQTQKVFLFIRNRTLQLW LDNPKIQLTFEATLQQLEAP YNSDTVLVHRVHSYLERHGL INFGIYKRIKPLPTKKTGSG PSSG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 124 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13710.63 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 17171 . SWIRM . . . . . 81.45 102 99.01 99.01 1.22e-67 . . . . 10011 1 2 no PDB 2COM . "The Solution Structure Of The Swirm Domain Of Human Lsd1" . . . . . 100.00 124 100.00 100.00 2.54e-85 . . . . 10011 1 3 no PDB 2DW4 . "Crystal Structure Of Human Lsd1 At 2.3 A Resolution" . . . . . 87.10 660 100.00 100.00 1.65e-68 . . . . 10011 1 4 no PDB 2EJR . "Lsd1-Tranylcypromine Complex" . . . . . 87.10 662 100.00 100.00 1.65e-68 . . . . 10011 1 5 no PDB 2H94 . "Crystal Structure And Mechanism Of Human Lysine-Specific Demethylase-1" . . . . . 87.10 664 100.00 100.00 1.64e-68 . . . . 10011 1 6 no PDB 2HKO . "Crystal Structure Of Lsd1" . . . . . 87.10 664 100.00 100.00 1.62e-68 . . . . 10011 1 7 no PDB 2IW5 . "Structural Basis For Corest-dependent Demethylation Of Nucleosomes By The Human Lsd1 Histone Demethylase" . . . . . 87.90 666 100.00 100.00 1.63e-69 . . . . 10011 1 8 no PDB 2L3D . "The Solution Structure Of The Short Form Swirm Domain Of Lsd1" . . . . . 81.45 102 99.01 99.01 1.22e-67 . . . . 10011 1 9 no PDB 2UXN . "Structural Basis Of Histone Demethylation By Lsd1 Revealed By Suicide Inactivation" . . . . . 87.90 666 100.00 100.00 1.63e-69 . . . . 10011 1 10 no PDB 2UXX . "Human Lsd1 Histone Demethylase-corest In Complex With An Fad-tranylcypromine Adduct" . . . . . 87.90 666 100.00 100.00 1.63e-69 . . . . 10011 1 11 no PDB 2V1D . "Structural Basis Of Lsd1-Corest Selectivity In Histone H3 Recognition" . . . . . 91.94 730 98.25 98.25 1.25e-70 . . . . 10011 1 12 no PDB 2X0L . "Crystal Structure Of A Neuro-Specific Splicing Variant Of Human Histone Lysine Demethylase Lsd1" . . . . . 91.94 734 98.25 98.25 1.39e-70 . . . . 10011 1 13 no PDB 2XAF . "Crystal Structure Of Lsd1-Corest In Complex With Para-Bromo- (+)-Cis-2-Phenylcyclopropyl-1-Amine" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 14 no PDB 2XAG . "Crystal Structure Of Lsd1-Corest In Complex With Para-Bromo- (-)-Trans-2-Phenylcyclopropyl-1-Amine" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 15 no PDB 2XAH . "Crystal Structure Of Lsd1-Corest In Complex With (+)- Trans-2-Phenylcyclopropyl-1-Amine" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 16 no PDB 2XAJ . "Crystal Structure Of Lsd1-Corest In Complex With (-)-Trans- 2-Phenylcyclopropyl-1-Amine" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 17 no PDB 2XAQ . "Crystal Structure Of Lsd1-Corest In Complex With A Tranylcypromine Derivative (Mc2584, 13b)" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 18 no PDB 2XAS . "Crystal Structure Of Lsd1-Corest In Complex With A Tranylcypromine Derivative (Mc2580, 14e)" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 19 no PDB 2Y48 . "Crystal Structure Of Lsd1-Corest In Complex With A N- Terminal Snail Peptide" . . . . . 91.94 730 98.25 98.25 1.25e-70 . . . . 10011 1 20 no PDB 2Z3Y . "Crystal Structure Of Lysine-Specific Demethylase1" . . . . . 87.10 662 100.00 100.00 1.65e-68 . . . . 10011 1 21 no PDB 2Z5U . "Crystal Structure Of Lysine-specific Histone Demethylase 1" . . . . . 87.10 662 100.00 100.00 1.65e-68 . . . . 10011 1 22 no PDB 3ABT . "Crystal Structure Of Lsd1 In Complex With Trans-2- Pentafluorophenylcyclopropylamine" . . . . . 87.10 662 100.00 100.00 1.65e-68 . . . . 10011 1 23 no PDB 3ABU . "Crystal Structure Of Lsd1 In Complex With A 2-Pcpa Derivative, S1201" . . . . . 87.10 662 100.00 100.00 1.65e-68 . . . . 10011 1 24 no PDB 4BAY . "Phosphomimetic Mutant Of Lsd1-8a Splicing Variant In Complex With Corest" . . . . . 87.90 686 100.00 100.00 2.84e-69 . . . . 10011 1 25 no PDB 4KUM . "Structure Of Lsd1-corest-tetrahydrofolate Complex" . . . . . 87.90 666 100.00 100.00 1.63e-69 . . . . 10011 1 26 no PDB 4UXN . "Lsd1(kdm1a)-corest In Complex With Z-pro Derivative Of Mc2580" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 27 no DBJ BAA25527 . "KIAA0601 protein [Homo sapiens]" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 28 no DBJ BAC97980 . "mKIAA0601 protein [Mus musculus]" . . . . . 91.94 879 97.37 97.37 1.68e-69 . . . . 10011 1 29 no DBJ BAF83017 . "unnamed protein product [Homo sapiens]" . . . . . 91.94 730 98.25 98.25 1.63e-70 . . . . 10011 1 30 no DBJ BAG09773 . "amine oxidase (flavin containing) domain 2 [synthetic construct]" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 31 no EMBL CAH90077 . "hypothetical protein [Pongo abelii]" . . . . . 91.94 688 98.25 98.25 1.03e-70 . . . . 10011 1 32 no GB AAH16639 . "AOF2 protein, partial [Homo sapiens]" . . . . . 60.48 648 100.00 100.00 4.03e-43 . . . . 10011 1 33 no GB AAH48134 . "Amine oxidase (flavin containing) domain 2 [Homo sapiens]" . . . . . 91.94 852 98.25 98.25 2.61e-70 . . . . 10011 1 34 no GB AAI51757 . "AOF2 protein [Bos taurus]" . . . . . 91.94 363 98.25 98.25 7.04e-76 . . . . 10011 1 35 no GB ABX10191 . "amine oxidase (flavin containing) domain 2 isoform b [Sus scrofa]" . . . . . 91.94 853 97.37 98.25 7.97e-70 . . . . 10011 1 36 no GB AIC62107 . "KDM1A, partial [synthetic construct]" . . . . . 91.94 730 98.25 98.25 1.25e-70 . . . . 10011 1 37 no REF NP_055828 . "lysine-specific histone demethylase 1A isoform b [Homo sapiens]" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 38 no REF NP_598633 . "lysine-specific histone demethylase 1A [Mus musculus]" . . . . . 91.94 853 97.37 97.37 1.24e-69 . . . . 10011 1 39 no REF XP_002685763 . "PREDICTED: lysine-specific histone demethylase 1A isoform X2 [Bos taurus]" . . . . . 91.94 853 98.25 98.25 2.63e-70 . . . . 10011 1 40 no REF XP_003271633 . "PREDICTED: lysine-specific histone demethylase 1A [Nomascus leucogenys]" . . . . . 91.94 730 98.25 98.25 1.29e-70 . . . . 10011 1 41 no REF XP_003415419 . "PREDICTED: lysine-specific histone demethylase 1A isoform X3 [Loxodonta africana]" . . . . . 86.29 855 97.20 97.20 1.22e-64 . . . . 10011 1 42 no SP O60341 . "RecName: Full=Lysine-specific histone demethylase 1A; AltName: Full=BRAF35-HDAC complex protein BHC110; AltName: Full=Flavin-co" . . . . . 91.94 852 98.25 98.25 2.51e-70 . . . . 10011 1 43 no SP Q6ZQ88 . "RecName: Full=Lysine-specific histone demethylase 1A; AltName: Full=BRAF35-HDAC complex protein BHC110; AltName: Full=Flavin-co" . . . . . 91.94 853 97.37 97.37 1.24e-69 . . . . 10011 1 44 no TPG DAA32188 . "TPA: lysine (K)-specific demethylase 1A isoform 2 [Bos taurus]" . . . . . 91.94 853 98.25 98.25 2.63e-70 . . . . 10011 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 10011 1 2 . SER . 10011 1 3 . SER . 10011 1 4 . GLY . 10011 1 5 . SER . 10011 1 6 . SER . 10011 1 7 . GLY . 10011 1 8 . GLU . 10011 1 9 . GLU . 10011 1 10 . PRO . 10011 1 11 . SER . 10011 1 12 . GLY . 10011 1 13 . VAL . 10011 1 14 . GLU . 10011 1 15 . GLY . 10011 1 16 . ALA . 10011 1 17 . ALA . 10011 1 18 . PHE . 10011 1 19 . GLN . 10011 1 20 . SER . 10011 1 21 . ARG . 10011 1 22 . LEU . 10011 1 23 . PRO . 10011 1 24 . HIS . 10011 1 25 . ASP . 10011 1 26 . ARG . 10011 1 27 . MET . 10011 1 28 . THR . 10011 1 29 . SER . 10011 1 30 . GLN . 10011 1 31 . GLU . 10011 1 32 . ALA . 10011 1 33 . ALA . 10011 1 34 . CYS . 10011 1 35 . PHE . 10011 1 36 . PRO . 10011 1 37 . ASP . 10011 1 38 . ILE . 10011 1 39 . ILE . 10011 1 40 . SER . 10011 1 41 . GLY . 10011 1 42 . PRO . 10011 1 43 . GLN . 10011 1 44 . GLN . 10011 1 45 . THR . 10011 1 46 . GLN . 10011 1 47 . LYS . 10011 1 48 . VAL . 10011 1 49 . PHE . 10011 1 50 . LEU . 10011 1 51 . PHE . 10011 1 52 . ILE . 10011 1 53 . ARG . 10011 1 54 . ASN . 10011 1 55 . ARG . 10011 1 56 . THR . 10011 1 57 . LEU . 10011 1 58 . GLN . 10011 1 59 . LEU . 10011 1 60 . TRP . 10011 1 61 . LEU . 10011 1 62 . ASP . 10011 1 63 . ASN . 10011 1 64 . PRO . 10011 1 65 . LYS . 10011 1 66 . ILE . 10011 1 67 . GLN . 10011 1 68 . LEU . 10011 1 69 . THR . 10011 1 70 . PHE . 10011 1 71 . GLU . 10011 1 72 . ALA . 10011 1 73 . THR . 10011 1 74 . LEU . 10011 1 75 . GLN . 10011 1 76 . GLN . 10011 1 77 . LEU . 10011 1 78 . GLU . 10011 1 79 . ALA . 10011 1 80 . PRO . 10011 1 81 . TYR . 10011 1 82 . ASN . 10011 1 83 . SER . 10011 1 84 . ASP . 10011 1 85 . THR . 10011 1 86 . VAL . 10011 1 87 . LEU . 10011 1 88 . VAL . 10011 1 89 . HIS . 10011 1 90 . ARG . 10011 1 91 . VAL . 10011 1 92 . HIS . 10011 1 93 . SER . 10011 1 94 . TYR . 10011 1 95 . LEU . 10011 1 96 . GLU . 10011 1 97 . ARG . 10011 1 98 . HIS . 10011 1 99 . GLY . 10011 1 100 . LEU . 10011 1 101 . ILE . 10011 1 102 . ASN . 10011 1 103 . PHE . 10011 1 104 . GLY . 10011 1 105 . ILE . 10011 1 106 . TYR . 10011 1 107 . LYS . 10011 1 108 . ARG . 10011 1 109 . ILE . 10011 1 110 . LYS . 10011 1 111 . PRO . 10011 1 112 . LEU . 10011 1 113 . PRO . 10011 1 114 . THR . 10011 1 115 . LYS . 10011 1 116 . LYS . 10011 1 117 . THR . 10011 1 118 . GLY . 10011 1 119 . SER . 10011 1 120 . GLY . 10011 1 121 . PRO . 10011 1 122 . SER . 10011 1 123 . SER . 10011 1 124 . GLY . 10011 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 10011 1 . SER 2 2 10011 1 . SER 3 3 10011 1 . GLY 4 4 10011 1 . SER 5 5 10011 1 . SER 6 6 10011 1 . GLY 7 7 10011 1 . GLU 8 8 10011 1 . GLU 9 9 10011 1 . PRO 10 10 10011 1 . SER 11 11 10011 1 . GLY 12 12 10011 1 . VAL 13 13 10011 1 . GLU 14 14 10011 1 . GLY 15 15 10011 1 . ALA 16 16 10011 1 . ALA 17 17 10011 1 . PHE 18 18 10011 1 . GLN 19 19 10011 1 . SER 20 20 10011 1 . ARG 21 21 10011 1 . LEU 22 22 10011 1 . PRO 23 23 10011 1 . HIS 24 24 10011 1 . ASP 25 25 10011 1 . ARG 26 26 10011 1 . MET 27 27 10011 1 . THR 28 28 10011 1 . SER 29 29 10011 1 . GLN 30 30 10011 1 . GLU 31 31 10011 1 . ALA 32 32 10011 1 . ALA 33 33 10011 1 . CYS 34 34 10011 1 . PHE 35 35 10011 1 . PRO 36 36 10011 1 . ASP 37 37 10011 1 . ILE 38 38 10011 1 . ILE 39 39 10011 1 . SER 40 40 10011 1 . GLY 41 41 10011 1 . PRO 42 42 10011 1 . GLN 43 43 10011 1 . GLN 44 44 10011 1 . THR 45 45 10011 1 . GLN 46 46 10011 1 . LYS 47 47 10011 1 . VAL 48 48 10011 1 . PHE 49 49 10011 1 . LEU 50 50 10011 1 . PHE 51 51 10011 1 . ILE 52 52 10011 1 . ARG 53 53 10011 1 . ASN 54 54 10011 1 . ARG 55 55 10011 1 . THR 56 56 10011 1 . LEU 57 57 10011 1 . GLN 58 58 10011 1 . LEU 59 59 10011 1 . TRP 60 60 10011 1 . LEU 61 61 10011 1 . ASP 62 62 10011 1 . ASN 63 63 10011 1 . PRO 64 64 10011 1 . LYS 65 65 10011 1 . ILE 66 66 10011 1 . GLN 67 67 10011 1 . LEU 68 68 10011 1 . THR 69 69 10011 1 . PHE 70 70 10011 1 . GLU 71 71 10011 1 . ALA 72 72 10011 1 . THR 73 73 10011 1 . LEU 74 74 10011 1 . GLN 75 75 10011 1 . GLN 76 76 10011 1 . LEU 77 77 10011 1 . GLU 78 78 10011 1 . ALA 79 79 10011 1 . PRO 80 80 10011 1 . TYR 81 81 10011 1 . ASN 82 82 10011 1 . SER 83 83 10011 1 . ASP 84 84 10011 1 . THR 85 85 10011 1 . VAL 86 86 10011 1 . LEU 87 87 10011 1 . VAL 88 88 10011 1 . HIS 89 89 10011 1 . ARG 90 90 10011 1 . VAL 91 91 10011 1 . HIS 92 92 10011 1 . SER 93 93 10011 1 . TYR 94 94 10011 1 . LEU 95 95 10011 1 . GLU 96 96 10011 1 . ARG 97 97 10011 1 . HIS 98 98 10011 1 . GLY 99 99 10011 1 . LEU 100 100 10011 1 . ILE 101 101 10011 1 . ASN 102 102 10011 1 . PHE 103 103 10011 1 . GLY 104 104 10011 1 . ILE 105 105 10011 1 . TYR 106 106 10011 1 . LYS 107 107 10011 1 . ARG 108 108 10011 1 . ILE 109 109 10011 1 . LYS 110 110 10011 1 . PRO 111 111 10011 1 . LEU 112 112 10011 1 . PRO 113 113 10011 1 . THR 114 114 10011 1 . LYS 115 115 10011 1 . LYS 116 116 10011 1 . THR 117 117 10011 1 . GLY 118 118 10011 1 . SER 119 119 10011 1 . GLY 120 120 10011 1 . PRO 121 121 10011 1 . SER 122 122 10011 1 . SER 123 123 10011 1 . GLY 124 124 10011 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 10011 _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 $SWIRM_domain . 9606 . no . human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . no . . . . . . . . 10011 1 stop_ loop_ _Natural_source_db.Entity_natural_src_ID _Natural_source_db.Entity_ID _Natural_source_db.Entity_label _Natural_source_db.Entity_chimera_segment_ID _Natural_source_db.Database_code _Natural_source_db.Database_type _Natural_source_db.Entry_code _Natural_source_db.Entry_type _Natural_source_db.ORF_code _Natural_source_db.Gene_locus_code _Natural_source_db.Gene_cDNA_code _Natural_source_db.Entry_ID _Natural_source_db.Entity_natural_src_list_ID . 1 $SWIRM_domain . SWS . O60341 . . . . 10011 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 10011 _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 $SWIRM_domain . 'cell free synthesis' . . . . . . . . . . . . . . . . . . . plasmid . . P040401-21 . . . . . . 10011 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10011 _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 'SWIRM domain' '[U-13C, U-15N]' . . 1 $SWIRM_domain . protein 1.2 . . mM . . . . 10011 1 2 D-Tris . . . . . . buffer 20 . . mM . . . . 10011 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10011 1 4 d-DTT . . . . . . salt 1 . . mM . . . . 10011 1 5 NaN3 . . . . . . salt 0.02 . . % . . . . 10011 1 6 D2O . . . . . . solvent 10 . . % . . . . 10011 1 7 H2O . . . . . . solvent 90 . . % . . . . 10011 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 10011 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.12 0.001 M 10011 1 pH 7.0 0.05 pH 10011 1 pressure 1 0.03 atm 10011 1 temperature 296 0.1 K 10011 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10011 _Software.ID 1 _Software.Name xwinnmr _Software.Version 2.6 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 10011 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10011 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10011 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20031121 _Software.Details 'Delaglio, F.' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10011 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10011 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details 'Johnson, B.A.' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10011 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10011 _Software.ID 4 _Software.Name Kujira _Software.Version 0.8994 _Software.Details 'Kobayashi, N.' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10011 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10011 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details 'Guntert, P.' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10011 5 'structure solution' 10011 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 10011 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 10011 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 3D_13C-separated_NOESY no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10011 1 2 3D_15N-separated_NOESY no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10011 1 stop_ save_ save_3D_13C-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_13C-separated_NOESY _NMR_spec_expt.Entry_ID 10011 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D 13C-separated 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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_15N-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_15N-separated_NOESY _NMR_spec_expt.Entry_ID 10011 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D 15N-separated 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 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _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_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10011 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784 ppm at 296 K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 10011 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 10011 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10011 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10011 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 3D_13C-separated_NOESY 1 $sample_1 isotropic 10011 1 2 3D_15N-separated_NOESY 1 $sample_1 isotropic 10011 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 4 4 GLY HA2 H 1 4.029 0.030 . 1 . . . . 4 GLY HA2 . 10011 1 2 . 1 1 4 4 GLY HA3 H 1 4.029 0.030 . 1 . . . . 4 GLY HA3 . 10011 1 3 . 1 1 4 4 GLY C C 13 174.317 0.300 . 1 . . . . 4 GLY C . 10011 1 4 . 1 1 4 4 GLY CA C 13 45.334 0.300 . 1 . . . . 4 GLY CA . 10011 1 5 . 1 1 5 5 SER H H 1 8.271 0.030 . 1 . . . . 5 SER H . 10011 1 6 . 1 1 5 5 SER HA H 1 4.514 0.030 . 1 . . . . 5 SER HA . 10011 1 7 . 1 1 5 5 SER HB2 H 1 3.889 0.030 . 1 . . . . 5 SER HB2 . 10011 1 8 . 1 1 5 5 SER HB3 H 1 3.889 0.030 . 1 . . . . 5 SER HB3 . 10011 1 9 . 1 1 5 5 SER C C 13 174.852 0.300 . 1 . . . . 5 SER C . 10011 1 10 . 1 1 5 5 SER CA C 13 58.280 0.300 . 1 . . . . 5 SER CA . 10011 1 11 . 1 1 5 5 SER CB C 13 64.094 0.300 . 1 . . . . 5 SER CB . 10011 1 12 . 1 1 5 5 SER N N 15 115.800 0.300 . 1 . . . . 5 SER N . 10011 1 13 . 1 1 6 6 SER H H 1 8.526 0.030 . 1 . . . . 6 SER H . 10011 1 14 . 1 1 6 6 SER HA H 1 4.496 0.030 . 1 . . . . 6 SER HA . 10011 1 15 . 1 1 6 6 SER HB2 H 1 3.889 0.030 . 1 . . . . 6 SER HB2 . 10011 1 16 . 1 1 6 6 SER HB3 H 1 3.889 0.030 . 1 . . . . 6 SER HB3 . 10011 1 17 . 1 1 6 6 SER C C 13 175.045 0.300 . 1 . . . . 6 SER C . 10011 1 18 . 1 1 6 6 SER CA C 13 58.647 0.300 . 1 . . . . 6 SER CA . 10011 1 19 . 1 1 6 6 SER CB C 13 64.041 0.300 . 1 . . . . 6 SER CB . 10011 1 20 . 1 1 6 6 SER N N 15 118.100 0.300 . 1 . . . . 6 SER N . 10011 1 21 . 1 1 7 7 GLY H H 1 8.410 0.030 . 1 . . . . 7 GLY H . 10011 1 22 . 1 1 7 7 GLY HA2 H 1 3.994 0.030 . 1 . . . . 7 GLY HA2 . 10011 1 23 . 1 1 7 7 GLY HA3 H 1 3.994 0.030 . 1 . . . . 7 GLY HA3 . 10011 1 24 . 1 1 7 7 GLY C C 13 173.944 0.300 . 1 . . . . 7 GLY C . 10011 1 25 . 1 1 7 7 GLY CA C 13 45.291 0.300 . 1 . . . . 7 GLY CA . 10011 1 26 . 1 1 7 7 GLY N N 15 110.810 0.300 . 1 . . . . 7 GLY N . 10011 1 27 . 1 1 8 8 GLU H H 1 8.212 0.030 . 1 . . . . 8 GLU H . 10011 1 28 . 1 1 8 8 GLU HA H 1 4.294 0.030 . 1 . . . . 8 GLU HA . 10011 1 29 . 1 1 8 8 GLU HB2 H 1 2.016 0.030 . 2 . . . . 8 GLU HB2 . 10011 1 30 . 1 1 8 8 GLU HB3 H 1 1.859 0.030 . 2 . . . . 8 GLU HB3 . 10011 1 31 . 1 1 8 8 GLU HG2 H 1 2.208 0.030 . 1 . . . . 8 GLU HG2 . 10011 1 32 . 1 1 8 8 GLU HG3 H 1 2.208 0.030 . 1 . . . . 8 GLU HG3 . 10011 1 33 . 1 1 8 8 GLU C C 13 176.298 0.300 . 1 . . . . 8 GLU C . 10011 1 34 . 1 1 8 8 GLU CA C 13 56.123 0.300 . 1 . . . . 8 GLU CA . 10011 1 35 . 1 1 8 8 GLU CB C 13 30.564 0.300 . 1 . . . . 8 GLU CB . 10011 1 36 . 1 1 8 8 GLU CG C 13 36.284 0.300 . 1 . . . . 8 GLU CG . 10011 1 37 . 1 1 8 8 GLU N N 15 120.287 0.300 . 1 . . . . 8 GLU N . 10011 1 38 . 1 1 9 9 GLU H H 1 8.467 0.030 . 1 . . . . 9 GLU H . 10011 1 39 . 1 1 9 9 GLU HA H 1 4.502 0.030 . 1 . . . . 9 GLU HA . 10011 1 40 . 1 1 9 9 GLU HB2 H 1 1.984 0.030 . 2 . . . . 9 GLU HB2 . 10011 1 41 . 1 1 9 9 GLU HB3 H 1 1.857 0.030 . 2 . . . . 9 GLU HB3 . 10011 1 42 . 1 1 9 9 GLU HG2 H 1 2.257 0.030 . 1 . . . . 9 GLU HG2 . 10011 1 43 . 1 1 9 9 GLU HG3 H 1 2.257 0.030 . 1 . . . . 9 GLU HG3 . 10011 1 44 . 1 1 9 9 GLU C C 13 174.652 0.300 . 1 . . . . 9 GLU C . 10011 1 45 . 1 1 9 9 GLU CA C 13 54.376 0.300 . 1 . . . . 9 GLU CA . 10011 1 46 . 1 1 9 9 GLU CB C 13 29.630 0.300 . 1 . . . . 9 GLU CB . 10011 1 47 . 1 1 9 9 GLU CG C 13 35.944 0.300 . 1 . . . . 9 GLU CG . 10011 1 48 . 1 1 9 9 GLU N N 15 123.546 0.300 . 1 . . . . 9 GLU N . 10011 1 49 . 1 1 10 10 PRO HA H 1 4.423 0.030 . 1 . . . . 10 PRO HA . 10011 1 50 . 1 1 10 10 PRO HB2 H 1 2.242 0.030 . 2 . . . . 10 PRO HB2 . 10011 1 51 . 1 1 10 10 PRO HB3 H 1 1.866 0.030 . 2 . . . . 10 PRO HB3 . 10011 1 52 . 1 1 10 10 PRO HG2 H 1 1.939 0.030 . 1 . . . . 10 PRO HG2 . 10011 1 53 . 1 1 10 10 PRO HG3 H 1 1.939 0.030 . 1 . . . . 10 PRO HG3 . 10011 1 54 . 1 1 10 10 PRO HD2 H 1 3.762 0.030 . 2 . . . . 10 PRO HD2 . 10011 1 55 . 1 1 10 10 PRO HD3 H 1 3.591 0.030 . 2 . . . . 10 PRO HD3 . 10011 1 56 . 1 1 10 10 PRO C C 13 176.835 0.300 . 1 . . . . 10 PRO C . 10011 1 57 . 1 1 10 10 PRO CA C 13 63.189 0.300 . 1 . . . . 10 PRO CA . 10011 1 58 . 1 1 10 10 PRO CB C 13 32.011 0.300 . 1 . . . . 10 PRO CB . 10011 1 59 . 1 1 10 10 PRO CG C 13 27.290 0.300 . 1 . . . . 10 PRO CG . 10011 1 60 . 1 1 10 10 PRO CD C 13 50.620 0.300 . 1 . . . . 10 PRO CD . 10011 1 61 . 1 1 11 11 SER H H 1 8.518 0.030 . 1 . . . . 11 SER H . 10011 1 62 . 1 1 11 11 SER HA H 1 4.464 0.030 . 1 . . . . 11 SER HA . 10011 1 63 . 1 1 11 11 SER HB2 H 1 3.905 0.030 . 2 . . . . 11 SER HB2 . 10011 1 64 . 1 1 11 11 SER HB3 H 1 3.849 0.030 . 2 . . . . 11 SER HB3 . 10011 1 65 . 1 1 11 11 SER C C 13 175.297 0.300 . 1 . . . . 11 SER C . 10011 1 66 . 1 1 11 11 SER CA C 13 58.295 0.300 . 1 . . . . 11 SER CA . 10011 1 67 . 1 1 11 11 SER CB C 13 64.153 0.300 . 1 . . . . 11 SER CB . 10011 1 68 . 1 1 11 11 SER N N 15 116.375 0.300 . 1 . . . . 11 SER N . 10011 1 69 . 1 1 12 12 GLY H H 1 8.479 0.030 . 1 . . . . 12 GLY H . 10011 1 70 . 1 1 12 12 GLY HA2 H 1 3.982 0.030 . 1 . . . . 12 GLY HA2 . 10011 1 71 . 1 1 12 12 GLY HA3 H 1 3.982 0.030 . 1 . . . . 12 GLY HA3 . 10011 1 72 . 1 1 12 12 GLY C C 13 174.621 0.300 . 1 . . . . 12 GLY C . 10011 1 73 . 1 1 12 12 GLY CA C 13 45.511 0.300 . 1 . . . . 12 GLY CA . 10011 1 74 . 1 1 12 12 GLY N N 15 110.767 0.300 . 1 . . . . 12 GLY N . 10011 1 75 . 1 1 13 13 VAL H H 1 8.069 0.030 . 1 . . . . 13 VAL H . 10011 1 76 . 1 1 13 13 VAL HA H 1 4.015 0.030 . 1 . . . . 13 VAL HA . 10011 1 77 . 1 1 13 13 VAL HB H 1 2.024 0.030 . 1 . . . . 13 VAL HB . 10011 1 78 . 1 1 13 13 VAL HG11 H 1 0.871 0.030 . 1 . . . . 13 VAL HG1 . 10011 1 79 . 1 1 13 13 VAL HG12 H 1 0.871 0.030 . 1 . . . . 13 VAL HG1 . 10011 1 80 . 1 1 13 13 VAL HG13 H 1 0.871 0.030 . 1 . . . . 13 VAL HG1 . 10011 1 81 . 1 1 13 13 VAL HG21 H 1 0.856 0.030 . 1 . . . . 13 VAL HG2 . 10011 1 82 . 1 1 13 13 VAL HG22 H 1 0.856 0.030 . 1 . . . . 13 VAL HG2 . 10011 1 83 . 1 1 13 13 VAL HG23 H 1 0.856 0.030 . 1 . . . . 13 VAL HG2 . 10011 1 84 . 1 1 13 13 VAL C C 13 176.561 0.300 . 1 . . . . 13 VAL C . 10011 1 85 . 1 1 13 13 VAL CA C 13 62.842 0.300 . 1 . . . . 13 VAL CA . 10011 1 86 . 1 1 13 13 VAL CB C 13 32.352 0.300 . 1 . . . . 13 VAL CB . 10011 1 87 . 1 1 13 13 VAL CG1 C 13 20.353 0.300 . 1 . . . . 13 VAL CG1 . 10011 1 88 . 1 1 13 13 VAL CG2 C 13 21.232 0.300 . 1 . . . . 13 VAL CG2 . 10011 1 89 . 1 1 13 13 VAL N N 15 119.033 0.300 . 1 . . . . 13 VAL N . 10011 1 90 . 1 1 14 14 GLU H H 1 8.563 0.030 . 1 . . . . 14 GLU H . 10011 1 91 . 1 1 14 14 GLU HA H 1 4.130 0.030 . 1 . . . . 14 GLU HA . 10011 1 92 . 1 1 14 14 GLU HB2 H 1 1.935 0.030 . 1 . . . . 14 GLU HB2 . 10011 1 93 . 1 1 14 14 GLU HB3 H 1 1.935 0.030 . 1 . . . . 14 GLU HB3 . 10011 1 94 . 1 1 14 14 GLU HG2 H 1 2.205 0.030 . 1 . . . . 14 GLU HG2 . 10011 1 95 . 1 1 14 14 GLU HG3 H 1 2.205 0.030 . 1 . . . . 14 GLU HG3 . 10011 1 96 . 1 1 14 14 GLU C C 13 177.531 0.300 . 1 . . . . 14 GLU C . 10011 1 97 . 1 1 14 14 GLU CA C 13 57.635 0.300 . 1 . . . . 14 GLU CA . 10011 1 98 . 1 1 14 14 GLU CB C 13 29.738 0.300 . 1 . . . . 14 GLU CB . 10011 1 99 . 1 1 14 14 GLU CG C 13 36.392 0.300 . 1 . . . . 14 GLU CG . 10011 1 100 . 1 1 14 14 GLU N N 15 123.564 0.300 . 1 . . . . 14 GLU N . 10011 1 101 . 1 1 15 15 GLY H H 1 8.285 0.030 . 1 . . . . 15 GLY H . 10011 1 102 . 1 1 15 15 GLY HA2 H 1 3.889 0.030 . 1 . . . . 15 GLY HA2 . 10011 1 103 . 1 1 15 15 GLY HA3 H 1 3.889 0.030 . 1 . . . . 15 GLY HA3 . 10011 1 104 . 1 1 15 15 GLY C C 13 174.357 0.300 . 1 . . . . 15 GLY C . 10011 1 105 . 1 1 15 15 GLY CA C 13 45.701 0.300 . 1 . . . . 15 GLY CA . 10011 1 106 . 1 1 15 15 GLY N N 15 109.581 0.300 . 1 . . . . 15 GLY N . 10011 1 107 . 1 1 16 16 ALA H H 1 7.965 0.030 . 1 . . . . 16 ALA H . 10011 1 108 . 1 1 16 16 ALA HA H 1 4.201 0.030 . 1 . . . . 16 ALA HA . 10011 1 109 . 1 1 16 16 ALA HB1 H 1 1.345 0.030 . 1 . . . . 16 ALA HB . 10011 1 110 . 1 1 16 16 ALA HB2 H 1 1.345 0.030 . 1 . . . . 16 ALA HB . 10011 1 111 . 1 1 16 16 ALA HB3 H 1 1.345 0.030 . 1 . . . . 16 ALA HB . 10011 1 112 . 1 1 16 16 ALA C C 13 178.219 0.300 . 1 . . . . 16 ALA C . 10011 1 113 . 1 1 16 16 ALA CA C 13 53.129 0.300 . 1 . . . . 16 ALA CA . 10011 1 114 . 1 1 16 16 ALA CB C 13 19.101 0.300 . 1 . . . . 16 ALA CB . 10011 1 115 . 1 1 16 16 ALA N N 15 123.852 0.300 . 1 . . . . 16 ALA N . 10011 1 116 . 1 1 17 17 ALA H H 1 8.004 0.030 . 1 . . . . 17 ALA H . 10011 1 117 . 1 1 17 17 ALA HA H 1 4.136 0.030 . 1 . . . . 17 ALA HA . 10011 1 118 . 1 1 17 17 ALA HB1 H 1 1.299 0.030 . 1 . . . . 17 ALA HB . 10011 1 119 . 1 1 17 17 ALA HB2 H 1 1.299 0.030 . 1 . . . . 17 ALA HB . 10011 1 120 . 1 1 17 17 ALA HB3 H 1 1.299 0.030 . 1 . . . . 17 ALA HB . 10011 1 121 . 1 1 17 17 ALA C C 13 178.138 0.300 . 1 . . . . 17 ALA C . 10011 1 122 . 1 1 17 17 ALA CA C 13 53.319 0.300 . 1 . . . . 17 ALA CA . 10011 1 123 . 1 1 17 17 ALA CB C 13 18.410 0.300 . 1 . . . . 17 ALA CB . 10011 1 124 . 1 1 17 17 ALA N N 15 122.122 0.300 . 1 . . . . 17 ALA N . 10011 1 125 . 1 1 18 18 PHE H H 1 8.007 0.030 . 1 . . . . 18 PHE H . 10011 1 126 . 1 1 18 18 PHE HA H 1 4.500 0.030 . 1 . . . . 18 PHE HA . 10011 1 127 . 1 1 18 18 PHE HB2 H 1 3.149 0.030 . 2 . . . . 18 PHE HB2 . 10011 1 128 . 1 1 18 18 PHE HB3 H 1 3.097 0.030 . 2 . . . . 18 PHE HB3 . 10011 1 129 . 1 1 18 18 PHE HD1 H 1 7.228 0.030 . 1 . . . . 18 PHE HD1 . 10011 1 130 . 1 1 18 18 PHE HD2 H 1 7.228 0.030 . 1 . . . . 18 PHE HD2 . 10011 1 131 . 1 1 18 18 PHE HE1 H 1 7.314 0.030 . 1 . . . . 18 PHE HE1 . 10011 1 132 . 1 1 18 18 PHE HE2 H 1 7.314 0.030 . 1 . . . . 18 PHE HE2 . 10011 1 133 . 1 1 18 18 PHE C C 13 176.733 0.300 . 1 . . . . 18 PHE C . 10011 1 134 . 1 1 18 18 PHE CA C 13 58.690 0.300 . 1 . . . . 18 PHE CA . 10011 1 135 . 1 1 18 18 PHE CB C 13 39.299 0.300 . 1 . . . . 18 PHE CB . 10011 1 136 . 1 1 18 18 PHE CD1 C 13 131.765 0.300 . 1 . . . . 18 PHE CD1 . 10011 1 137 . 1 1 18 18 PHE CD2 C 13 131.765 0.300 . 1 . . . . 18 PHE CD2 . 10011 1 138 . 1 1 18 18 PHE CE1 C 13 131.641 0.300 . 1 . . . . 18 PHE CE1 . 10011 1 139 . 1 1 18 18 PHE CE2 C 13 131.641 0.300 . 1 . . . . 18 PHE CE2 . 10011 1 140 . 1 1 18 18 PHE N N 15 118.776 0.300 . 1 . . . . 18 PHE N . 10011 1 141 . 1 1 19 19 GLN H H 1 8.292 0.030 . 1 . . . . 19 GLN H . 10011 1 142 . 1 1 19 19 GLN HA H 1 4.229 0.030 . 1 . . . . 19 GLN HA . 10011 1 143 . 1 1 19 19 GLN HB2 H 1 2.095 0.030 . 2 . . . . 19 GLN HB2 . 10011 1 144 . 1 1 19 19 GLN HB3 H 1 2.002 0.030 . 2 . . . . 19 GLN HB3 . 10011 1 145 . 1 1 19 19 GLN HG2 H 1 2.354 0.030 . 1 . . . . 19 GLN HG2 . 10011 1 146 . 1 1 19 19 GLN HG3 H 1 2.354 0.030 . 1 . . . . 19 GLN HG3 . 10011 1 147 . 1 1 19 19 GLN HE21 H 1 7.515 0.030 . 2 . . . . 19 GLN HE21 . 10011 1 148 . 1 1 19 19 GLN HE22 H 1 6.887 0.030 . 2 . . . . 19 GLN HE22 . 10011 1 149 . 1 1 19 19 GLN C C 13 175.925 0.300 . 1 . . . . 19 GLN C . 10011 1 150 . 1 1 19 19 GLN CA C 13 56.430 0.300 . 1 . . . . 19 GLN CA . 10011 1 151 . 1 1 19 19 GLN CB C 13 29.431 0.300 . 1 . . . . 19 GLN CB . 10011 1 152 . 1 1 19 19 GLN CG C 13 33.964 0.300 . 1 . . . . 19 GLN CG . 10011 1 153 . 1 1 19 19 GLN N N 15 120.888 0.300 . 1 . . . . 19 GLN N . 10011 1 154 . 1 1 19 19 GLN NE2 N 15 112.157 0.300 . 1 . . . . 19 GLN NE2 . 10011 1 155 . 1 1 20 20 SER H H 1 8.062 0.030 . 1 . . . . 20 SER H . 10011 1 156 . 1 1 20 20 SER HA H 1 4.420 0.030 . 1 . . . . 20 SER HA . 10011 1 157 . 1 1 20 20 SER HB2 H 1 3.900 0.030 . 1 . . . . 20 SER HB2 . 10011 1 158 . 1 1 20 20 SER HB3 H 1 3.900 0.030 . 1 . . . . 20 SER HB3 . 10011 1 159 . 1 1 20 20 SER C C 13 173.723 0.300 . 1 . . . . 20 SER C . 10011 1 160 . 1 1 20 20 SER CA C 13 58.482 0.300 . 1 . . . . 20 SER CA . 10011 1 161 . 1 1 20 20 SER CB C 13 63.763 0.300 . 1 . . . . 20 SER CB . 10011 1 162 . 1 1 20 20 SER N N 15 116.021 0.300 . 1 . . . . 20 SER N . 10011 1 163 . 1 1 21 21 ARG H H 1 8.163 0.030 . 1 . . . . 21 ARG H . 10011 1 164 . 1 1 21 21 ARG HA H 1 4.258 0.030 . 1 . . . . 21 ARG HA . 10011 1 165 . 1 1 21 21 ARG HB2 H 1 1.846 0.030 . 1 . . . . 21 ARG HB2 . 10011 1 166 . 1 1 21 21 ARG HB3 H 1 1.846 0.030 . 1 . . . . 21 ARG HB3 . 10011 1 167 . 1 1 21 21 ARG HG2 H 1 1.601 0.030 . 1 . . . . 21 ARG HG2 . 10011 1 168 . 1 1 21 21 ARG HG3 H 1 1.601 0.030 . 1 . . . . 21 ARG HG3 . 10011 1 169 . 1 1 21 21 ARG HD2 H 1 3.164 0.030 . 1 . . . . 21 ARG HD2 . 10011 1 170 . 1 1 21 21 ARG HD3 H 1 3.164 0.030 . 1 . . . . 21 ARG HD3 . 10011 1 171 . 1 1 21 21 ARG C C 13 175.753 0.300 . 1 . . . . 21 ARG C . 10011 1 172 . 1 1 21 21 ARG CA C 13 56.294 0.300 . 1 . . . . 21 ARG CA . 10011 1 173 . 1 1 21 21 ARG CB C 13 30.061 0.300 . 1 . . . . 21 ARG CB . 10011 1 174 . 1 1 21 21 ARG CG C 13 27.222 0.300 . 1 . . . . 21 ARG CG . 10011 1 175 . 1 1 21 21 ARG CD C 13 43.273 0.300 . 1 . . . . 21 ARG CD . 10011 1 176 . 1 1 21 21 ARG N N 15 120.623 0.300 . 1 . . . . 21 ARG N . 10011 1 177 . 1 1 22 22 LEU H H 1 8.196 0.030 . 1 . . . . 22 LEU H . 10011 1 178 . 1 1 22 22 LEU HA H 1 4.656 0.030 . 1 . . . . 22 LEU HA . 10011 1 179 . 1 1 22 22 LEU HB2 H 1 1.435 0.030 . 2 . . . . 22 LEU HB2 . 10011 1 180 . 1 1 22 22 LEU HB3 H 1 1.314 0.030 . 2 . . . . 22 LEU HB3 . 10011 1 181 . 1 1 22 22 LEU HG H 1 1.632 0.030 . 1 . . . . 22 LEU HG . 10011 1 182 . 1 1 22 22 LEU HD11 H 1 0.902 0.030 . 1 . . . . 22 LEU HD1 . 10011 1 183 . 1 1 22 22 LEU HD12 H 1 0.902 0.030 . 1 . . . . 22 LEU HD1 . 10011 1 184 . 1 1 22 22 LEU HD13 H 1 0.902 0.030 . 1 . . . . 22 LEU HD1 . 10011 1 185 . 1 1 22 22 LEU HD21 H 1 0.873 0.030 . 1 . . . . 22 LEU HD2 . 10011 1 186 . 1 1 22 22 LEU HD22 H 1 0.873 0.030 . 1 . . . . 22 LEU HD2 . 10011 1 187 . 1 1 22 22 LEU HD23 H 1 0.873 0.030 . 1 . . . . 22 LEU HD2 . 10011 1 188 . 1 1 22 22 LEU C C 13 174.502 0.300 . 1 . . . . 22 LEU C . 10011 1 189 . 1 1 22 22 LEU CA C 13 52.555 0.300 . 1 . . . . 22 LEU CA . 10011 1 190 . 1 1 22 22 LEU CB C 13 41.855 0.300 . 1 . . . . 22 LEU CB . 10011 1 191 . 1 1 22 22 LEU CG C 13 27.225 0.300 . 1 . . . . 22 LEU CG . 10011 1 192 . 1 1 22 22 LEU CD1 C 13 24.114 0.300 . 1 . . . . 22 LEU CD1 . 10011 1 193 . 1 1 22 22 LEU CD2 C 13 25.972 0.300 . 1 . . . . 22 LEU CD2 . 10011 1 194 . 1 1 22 22 LEU N N 15 122.862 0.300 . 1 . . . . 22 LEU N . 10011 1 195 . 1 1 23 23 PRO HA H 1 4.546 0.030 . 1 . . . . 23 PRO HA . 10011 1 196 . 1 1 23 23 PRO HB2 H 1 2.241 0.030 . 2 . . . . 23 PRO HB2 . 10011 1 197 . 1 1 23 23 PRO HB3 H 1 2.047 0.030 . 2 . . . . 23 PRO HB3 . 10011 1 198 . 1 1 23 23 PRO HG2 H 1 2.344 0.030 . 2 . . . . 23 PRO HG2 . 10011 1 199 . 1 1 23 23 PRO HG3 H 1 1.911 0.030 . 2 . . . . 23 PRO HG3 . 10011 1 200 . 1 1 23 23 PRO HD2 H 1 3.775 0.030 . 2 . . . . 23 PRO HD2 . 10011 1 201 . 1 1 23 23 PRO HD3 H 1 3.467 0.030 . 2 . . . . 23 PRO HD3 . 10011 1 202 . 1 1 23 23 PRO C C 13 178.396 0.300 . 1 . . . . 23 PRO C . 10011 1 203 . 1 1 23 23 PRO CA C 13 62.431 0.300 . 1 . . . . 23 PRO CA . 10011 1 204 . 1 1 23 23 PRO CB C 13 31.721 0.300 . 1 . . . . 23 PRO CB . 10011 1 205 . 1 1 23 23 PRO CG C 13 27.047 0.300 . 1 . . . . 23 PRO CG . 10011 1 206 . 1 1 23 23 PRO CD C 13 50.371 0.300 . 1 . . . . 23 PRO CD . 10011 1 207 . 1 1 24 24 HIS H H 1 8.760 0.030 . 1 . . . . 24 HIS H . 10011 1 208 . 1 1 24 24 HIS HA H 1 4.149 0.030 . 1 . . . . 24 HIS HA . 10011 1 209 . 1 1 24 24 HIS HB2 H 1 3.136 0.030 . 2 . . . . 24 HIS HB2 . 10011 1 210 . 1 1 24 24 HIS HB3 H 1 3.057 0.030 . 2 . . . . 24 HIS HB3 . 10011 1 211 . 1 1 24 24 HIS HD2 H 1 7.005 0.030 . 1 . . . . 24 HIS HD2 . 10011 1 212 . 1 1 24 24 HIS C C 13 175.864 0.300 . 1 . . . . 24 HIS C . 10011 1 213 . 1 1 24 24 HIS CA C 13 58.977 0.300 . 1 . . . . 24 HIS CA . 10011 1 214 . 1 1 24 24 HIS CB C 13 30.835 0.300 . 1 . . . . 24 HIS CB . 10011 1 215 . 1 1 24 24 HIS CD2 C 13 119.734 0.300 . 1 . . . . 24 HIS CD2 . 10011 1 216 . 1 1 24 24 HIS N N 15 122.711 0.300 . 1 . . . . 24 HIS N . 10011 1 217 . 1 1 25 25 ASP H H 1 8.256 0.030 . 1 . . . . 25 ASP H . 10011 1 218 . 1 1 25 25 ASP HA H 1 4.478 0.030 . 1 . . . . 25 ASP HA . 10011 1 219 . 1 1 25 25 ASP HB2 H 1 2.738 0.030 . 2 . . . . 25 ASP HB2 . 10011 1 220 . 1 1 25 25 ASP HB3 H 1 2.098 0.030 . 2 . . . . 25 ASP HB3 . 10011 1 221 . 1 1 25 25 ASP C C 13 175.065 0.300 . 1 . . . . 25 ASP C . 10011 1 222 . 1 1 25 25 ASP CA C 13 52.750 0.300 . 1 . . . . 25 ASP CA . 10011 1 223 . 1 1 25 25 ASP CB C 13 40.860 0.300 . 1 . . . . 25 ASP CB . 10011 1 224 . 1 1 25 25 ASP N N 15 114.074 0.300 . 1 . . . . 25 ASP N . 10011 1 225 . 1 1 26 26 ARG H H 1 7.156 0.030 . 1 . . . . 26 ARG H . 10011 1 226 . 1 1 26 26 ARG HA H 1 4.505 0.030 . 1 . . . . 26 ARG HA . 10011 1 227 . 1 1 26 26 ARG HB2 H 1 1.733 0.030 . 2 . . . . 26 ARG HB2 . 10011 1 228 . 1 1 26 26 ARG HB3 H 1 1.577 0.030 . 2 . . . . 26 ARG HB3 . 10011 1 229 . 1 1 26 26 ARG HG2 H 1 1.502 0.030 . 2 . . . . 26 ARG HG2 . 10011 1 230 . 1 1 26 26 ARG HG3 H 1 1.386 0.030 . 2 . . . . 26 ARG HG3 . 10011 1 231 . 1 1 26 26 ARG HD2 H 1 3.121 0.030 . 1 . . . . 26 ARG HD2 . 10011 1 232 . 1 1 26 26 ARG HD3 H 1 3.121 0.030 . 1 . . . . 26 ARG HD3 . 10011 1 233 . 1 1 26 26 ARG C C 13 173.690 0.300 . 1 . . . . 26 ARG C . 10011 1 234 . 1 1 26 26 ARG CA C 13 54.770 0.300 . 1 . . . . 26 ARG CA . 10011 1 235 . 1 1 26 26 ARG CB C 13 33.172 0.300 . 1 . . . . 26 ARG CB . 10011 1 236 . 1 1 26 26 ARG CG C 13 26.052 0.300 . 1 . . . . 26 ARG CG . 10011 1 237 . 1 1 26 26 ARG CD C 13 43.333 0.300 . 1 . . . . 26 ARG CD . 10011 1 238 . 1 1 26 26 ARG N N 15 116.806 0.300 . 1 . . . . 26 ARG N . 10011 1 239 . 1 1 27 27 MET H H 1 8.466 0.030 . 1 . . . . 27 MET H . 10011 1 240 . 1 1 27 27 MET HA H 1 4.539 0.030 . 1 . . . . 27 MET HA . 10011 1 241 . 1 1 27 27 MET HB2 H 1 2.020 0.030 . 2 . . . . 27 MET HB2 . 10011 1 242 . 1 1 27 27 MET HB3 H 1 1.602 0.030 . 2 . . . . 27 MET HB3 . 10011 1 243 . 1 1 27 27 MET HG2 H 1 2.413 0.030 . 2 . . . . 27 MET HG2 . 10011 1 244 . 1 1 27 27 MET HG3 H 1 2.257 0.030 . 2 . . . . 27 MET HG3 . 10011 1 245 . 1 1 27 27 MET HE1 H 1 0.869 0.030 . 1 . . . . 27 MET HE . 10011 1 246 . 1 1 27 27 MET HE2 H 1 0.869 0.030 . 1 . . . . 27 MET HE . 10011 1 247 . 1 1 27 27 MET HE3 H 1 0.869 0.030 . 1 . . . . 27 MET HE . 10011 1 248 . 1 1 27 27 MET C C 13 177.744 0.300 . 1 . . . . 27 MET C . 10011 1 249 . 1 1 27 27 MET CA C 13 55.795 0.300 . 1 . . . . 27 MET CA . 10011 1 250 . 1 1 27 27 MET CB C 13 34.030 0.300 . 1 . . . . 27 MET CB . 10011 1 251 . 1 1 27 27 MET CG C 13 32.407 0.300 . 1 . . . . 27 MET CG . 10011 1 252 . 1 1 27 27 MET CE C 13 14.899 0.300 . 1 . . . . 27 MET CE . 10011 1 253 . 1 1 27 27 MET N N 15 119.491 0.300 . 1 . . . . 27 MET N . 10011 1 254 . 1 1 28 28 THR H H 1 9.335 0.030 . 1 . . . . 28 THR H . 10011 1 255 . 1 1 28 28 THR HA H 1 4.424 0.030 . 1 . . . . 28 THR HA . 10011 1 256 . 1 1 28 28 THR HB H 1 4.838 0.030 . 1 . . . . 28 THR HB . 10011 1 257 . 1 1 28 28 THR HG1 H 1 5.708 0.030 . 1 . . . . 28 THR HG1 . 10011 1 258 . 1 1 28 28 THR HG21 H 1 1.341 0.030 . 1 . . . . 28 THR HG2 . 10011 1 259 . 1 1 28 28 THR HG22 H 1 1.341 0.030 . 1 . . . . 28 THR HG2 . 10011 1 260 . 1 1 28 28 THR HG23 H 1 1.341 0.030 . 1 . . . . 28 THR HG2 . 10011 1 261 . 1 1 28 28 THR C C 13 175.621 0.300 . 1 . . . . 28 THR C . 10011 1 262 . 1 1 28 28 THR CA C 13 60.549 0.300 . 1 . . . . 28 THR CA . 10011 1 263 . 1 1 28 28 THR CB C 13 71.345 0.300 . 1 . . . . 28 THR CB . 10011 1 264 . 1 1 28 28 THR CG2 C 13 22.677 0.300 . 1 . . . . 28 THR CG2 . 10011 1 265 . 1 1 28 28 THR N N 15 114.793 0.300 . 1 . . . . 28 THR N . 10011 1 266 . 1 1 29 29 SER HA H 1 4.161 0.030 . 1 . . . . 29 SER HA . 10011 1 267 . 1 1 29 29 SER HB2 H 1 3.917 0.030 . 1 . . . . 29 SER HB2 . 10011 1 268 . 1 1 29 29 SER HB3 H 1 3.917 0.030 . 1 . . . . 29 SER HB3 . 10011 1 269 . 1 1 29 29 SER C C 13 177.613 0.300 . 1 . . . . 29 SER C . 10011 1 270 . 1 1 29 29 SER CA C 13 61.788 0.300 . 1 . . . . 29 SER CA . 10011 1 271 . 1 1 29 29 SER CB C 13 62.086 0.300 . 1 . . . . 29 SER CB . 10011 1 272 . 1 1 30 30 GLN H H 1 8.356 0.030 . 1 . . . . 30 GLN H . 10011 1 273 . 1 1 30 30 GLN HA H 1 4.175 0.030 . 1 . . . . 30 GLN HA . 10011 1 274 . 1 1 30 30 GLN HB2 H 1 2.139 0.030 . 2 . . . . 30 GLN HB2 . 10011 1 275 . 1 1 30 30 GLN HB3 H 1 2.033 0.030 . 2 . . . . 30 GLN HB3 . 10011 1 276 . 1 1 30 30 GLN HG2 H 1 2.417 0.030 . 2 . . . . 30 GLN HG2 . 10011 1 277 . 1 1 30 30 GLN HG3 H 1 2.349 0.030 . 2 . . . . 30 GLN HG3 . 10011 1 278 . 1 1 30 30 GLN HE21 H 1 7.424 0.030 . 2 . . . . 30 GLN HE21 . 10011 1 279 . 1 1 30 30 GLN HE22 H 1 6.889 0.030 . 2 . . . . 30 GLN HE22 . 10011 1 280 . 1 1 30 30 GLN C C 13 178.798 0.300 . 1 . . . . 30 GLN C . 10011 1 281 . 1 1 30 30 GLN CA C 13 59.161 0.300 . 1 . . . . 30 GLN CA . 10011 1 282 . 1 1 30 30 GLN CB C 13 28.849 0.300 . 1 . . . . 30 GLN CB . 10011 1 283 . 1 1 30 30 GLN CG C 13 34.514 0.300 . 1 . . . . 30 GLN CG . 10011 1 284 . 1 1 30 30 GLN N N 15 122.982 0.300 . 1 . . . . 30 GLN N . 10011 1 285 . 1 1 30 30 GLN NE2 N 15 112.001 0.300 . 1 . . . . 30 GLN NE2 . 10011 1 286 . 1 1 31 31 GLU H H 1 7.744 0.030 . 1 . . . . 31 GLU H . 10011 1 287 . 1 1 31 31 GLU HA H 1 3.493 0.030 . 1 . . . . 31 GLU HA . 10011 1 288 . 1 1 31 31 GLU HB2 H 1 2.293 0.030 . 2 . . . . 31 GLU HB2 . 10011 1 289 . 1 1 31 31 GLU HB3 H 1 1.402 0.030 . 2 . . . . 31 GLU HB3 . 10011 1 290 . 1 1 31 31 GLU HG2 H 1 1.877 0.030 . 2 . . . . 31 GLU HG2 . 10011 1 291 . 1 1 31 31 GLU HG3 H 1 2.490 0.030 . 2 . . . . 31 GLU HG3 . 10011 1 292 . 1 1 31 31 GLU C C 13 178.643 0.300 . 1 . . . . 31 GLU C . 10011 1 293 . 1 1 31 31 GLU CA C 13 59.411 0.300 . 1 . . . . 31 GLU CA . 10011 1 294 . 1 1 31 31 GLU CB C 13 29.237 0.300 . 1 . . . . 31 GLU CB . 10011 1 295 . 1 1 31 31 GLU CG C 13 37.562 0.300 . 1 . . . . 31 GLU CG . 10011 1 296 . 1 1 31 31 GLU N N 15 120.782 0.300 . 1 . . . . 31 GLU N . 10011 1 297 . 1 1 32 32 ALA H H 1 8.572 0.030 . 1 . . . . 32 ALA H . 10011 1 298 . 1 1 32 32 ALA HA H 1 3.593 0.030 . 1 . . . . 32 ALA HA . 10011 1 299 . 1 1 32 32 ALA HB1 H 1 1.386 0.030 . 1 . . . . 32 ALA HB . 10011 1 300 . 1 1 32 32 ALA HB2 H 1 1.386 0.030 . 1 . . . . 32 ALA HB . 10011 1 301 . 1 1 32 32 ALA HB3 H 1 1.386 0.030 . 1 . . . . 32 ALA HB . 10011 1 302 . 1 1 32 32 ALA C C 13 179.159 0.300 . 1 . . . . 32 ALA C . 10011 1 303 . 1 1 32 32 ALA CA C 13 55.169 0.300 . 1 . . . . 32 ALA CA . 10011 1 304 . 1 1 32 32 ALA CB C 13 17.969 0.300 . 1 . . . . 32 ALA CB . 10011 1 305 . 1 1 32 32 ALA N N 15 120.976 0.300 . 1 . . . . 32 ALA N . 10011 1 306 . 1 1 33 33 ALA H H 1 7.384 0.030 . 1 . . . . 33 ALA H . 10011 1 307 . 1 1 33 33 ALA HA H 1 4.063 0.030 . 1 . . . . 33 ALA HA . 10011 1 308 . 1 1 33 33 ALA HB1 H 1 1.512 0.030 . 1 . . . . 33 ALA HB . 10011 1 309 . 1 1 33 33 ALA HB2 H 1 1.512 0.030 . 1 . . . . 33 ALA HB . 10011 1 310 . 1 1 33 33 ALA HB3 H 1 1.512 0.030 . 1 . . . . 33 ALA HB . 10011 1 311 . 1 1 33 33 ALA C C 13 179.816 0.300 . 1 . . . . 33 ALA C . 10011 1 312 . 1 1 33 33 ALA CA C 13 54.200 0.300 . 1 . . . . 33 ALA CA . 10011 1 313 . 1 1 33 33 ALA CB C 13 18.459 0.300 . 1 . . . . 33 ALA CB . 10011 1 314 . 1 1 33 33 ALA N N 15 117.321 0.300 . 1 . . . . 33 ALA N . 10011 1 315 . 1 1 34 34 CYS H H 1 7.540 0.030 . 1 . . . . 34 CYS H . 10011 1 316 . 1 1 34 34 CYS HA H 1 4.208 0.030 . 1 . . . . 34 CYS HA . 10011 1 317 . 1 1 34 34 CYS HB2 H 1 2.625 0.030 . 1 . . . . 34 CYS HB2 . 10011 1 318 . 1 1 34 34 CYS HB3 H 1 2.625 0.030 . 1 . . . . 34 CYS HB3 . 10011 1 319 . 1 1 34 34 CYS C C 13 173.689 0.300 . 1 . . . . 34 CYS C . 10011 1 320 . 1 1 34 34 CYS CA C 13 61.135 0.300 . 1 . . . . 34 CYS CA . 10011 1 321 . 1 1 34 34 CYS CB C 13 28.641 0.300 . 1 . . . . 34 CYS CB . 10011 1 322 . 1 1 34 34 CYS N N 15 114.470 0.300 . 1 . . . . 34 CYS N . 10011 1 323 . 1 1 35 35 PHE H H 1 8.037 0.030 . 1 . . . . 35 PHE H . 10011 1 324 . 1 1 35 35 PHE HA H 1 4.595 0.030 . 1 . . . . 35 PHE HA . 10011 1 325 . 1 1 35 35 PHE HB2 H 1 2.592 0.030 . 2 . . . . 35 PHE HB2 . 10011 1 326 . 1 1 35 35 PHE HB3 H 1 2.420 0.030 . 2 . . . . 35 PHE HB3 . 10011 1 327 . 1 1 35 35 PHE HD1 H 1 7.185 0.030 . 1 . . . . 35 PHE HD1 . 10011 1 328 . 1 1 35 35 PHE HD2 H 1 7.185 0.030 . 1 . . . . 35 PHE HD2 . 10011 1 329 . 1 1 35 35 PHE HE1 H 1 6.838 0.030 . 1 . . . . 35 PHE HE1 . 10011 1 330 . 1 1 35 35 PHE HE2 H 1 6.838 0.030 . 1 . . . . 35 PHE HE2 . 10011 1 331 . 1 1 35 35 PHE HZ H 1 7.168 0.030 . 1 . . . . 35 PHE HZ . 10011 1 332 . 1 1 35 35 PHE C C 13 173.339 0.300 . 1 . . . . 35 PHE C . 10011 1 333 . 1 1 35 35 PHE CA C 13 55.384 0.300 . 1 . . . . 35 PHE CA . 10011 1 334 . 1 1 35 35 PHE CB C 13 37.599 0.300 . 1 . . . . 35 PHE CB . 10011 1 335 . 1 1 35 35 PHE CD1 C 13 132.978 0.300 . 1 . . . . 35 PHE CD1 . 10011 1 336 . 1 1 35 35 PHE CD2 C 13 132.978 0.300 . 1 . . . . 35 PHE CD2 . 10011 1 337 . 1 1 35 35 PHE CE1 C 13 130.365 0.300 . 1 . . . . 35 PHE CE1 . 10011 1 338 . 1 1 35 35 PHE CE2 C 13 130.365 0.300 . 1 . . . . 35 PHE CE2 . 10011 1 339 . 1 1 35 35 PHE CZ C 13 128.576 0.300 . 1 . . . . 35 PHE CZ . 10011 1 340 . 1 1 35 35 PHE N N 15 117.181 0.300 . 1 . . . . 35 PHE N . 10011 1 341 . 1 1 36 36 PRO HA H 1 4.382 0.030 . 1 . . . . 36 PRO HA . 10011 1 342 . 1 1 36 36 PRO HB2 H 1 2.216 0.030 . 2 . . . . 36 PRO HB2 . 10011 1 343 . 1 1 36 36 PRO HB3 H 1 2.006 0.030 . 2 . . . . 36 PRO HB3 . 10011 1 344 . 1 1 36 36 PRO HG2 H 1 2.012 0.030 . 1 . . . . 36 PRO HG2 . 10011 1 345 . 1 1 36 36 PRO HG3 H 1 2.012 0.030 . 1 . . . . 36 PRO HG3 . 10011 1 346 . 1 1 36 36 PRO HD2 H 1 3.388 0.030 . 2 . . . . 36 PRO HD2 . 10011 1 347 . 1 1 36 36 PRO HD3 H 1 3.263 0.030 . 2 . . . . 36 PRO HD3 . 10011 1 348 . 1 1 36 36 PRO C C 13 178.130 0.300 . 1 . . . . 36 PRO C . 10011 1 349 . 1 1 36 36 PRO CA C 13 65.214 0.300 . 1 . . . . 36 PRO CA . 10011 1 350 . 1 1 36 36 PRO CB C 13 30.974 0.300 . 1 . . . . 36 PRO CB . 10011 1 351 . 1 1 36 36 PRO CG C 13 27.260 0.300 . 1 . . . . 36 PRO CG . 10011 1 352 . 1 1 36 36 PRO CD C 13 50.474 0.300 . 1 . . . . 36 PRO CD . 10011 1 353 . 1 1 37 37 ASP H H 1 9.773 0.030 . 1 . . . . 37 ASP H . 10011 1 354 . 1 1 37 37 ASP HA H 1 4.187 0.030 . 1 . . . . 37 ASP HA . 10011 1 355 . 1 1 37 37 ASP HB2 H 1 2.718 0.030 . 2 . . . . 37 ASP HB2 . 10011 1 356 . 1 1 37 37 ASP HB3 H 1 2.518 0.030 . 2 . . . . 37 ASP HB3 . 10011 1 357 . 1 1 37 37 ASP C C 13 176.754 0.300 . 1 . . . . 37 ASP C . 10011 1 358 . 1 1 37 37 ASP CA C 13 54.743 0.300 . 1 . . . . 37 ASP CA . 10011 1 359 . 1 1 37 37 ASP CB C 13 38.613 0.300 . 1 . . . . 37 ASP CB . 10011 1 360 . 1 1 37 37 ASP N N 15 115.556 0.300 . 1 . . . . 37 ASP N . 10011 1 361 . 1 1 38 38 ILE H H 1 7.276 0.030 . 1 . . . . 38 ILE H . 10011 1 362 . 1 1 38 38 ILE HA H 1 3.930 0.030 . 1 . . . . 38 ILE HA . 10011 1 363 . 1 1 38 38 ILE HB H 1 1.865 0.030 . 1 . . . . 38 ILE HB . 10011 1 364 . 1 1 38 38 ILE HG12 H 1 1.530 0.030 . 2 . . . . 38 ILE HG12 . 10011 1 365 . 1 1 38 38 ILE HG13 H 1 1.268 0.030 . 2 . . . . 38 ILE HG13 . 10011 1 366 . 1 1 38 38 ILE HG21 H 1 0.539 0.030 . 1 . . . . 38 ILE HG2 . 10011 1 367 . 1 1 38 38 ILE HG22 H 1 0.539 0.030 . 1 . . . . 38 ILE HG2 . 10011 1 368 . 1 1 38 38 ILE HG23 H 1 0.539 0.030 . 1 . . . . 38 ILE HG2 . 10011 1 369 . 1 1 38 38 ILE HD11 H 1 0.723 0.030 . 1 . . . . 38 ILE HD1 . 10011 1 370 . 1 1 38 38 ILE HD12 H 1 0.723 0.030 . 1 . . . . 38 ILE HD1 . 10011 1 371 . 1 1 38 38 ILE HD13 H 1 0.723 0.030 . 1 . . . . 38 ILE HD1 . 10011 1 372 . 1 1 38 38 ILE C C 13 178.997 0.300 . 1 . . . . 38 ILE C . 10011 1 373 . 1 1 38 38 ILE CA C 13 60.772 0.300 . 1 . . . . 38 ILE CA . 10011 1 374 . 1 1 38 38 ILE CB C 13 36.347 0.300 . 1 . . . . 38 ILE CB . 10011 1 375 . 1 1 38 38 ILE CG1 C 13 27.457 0.300 . 1 . . . . 38 ILE CG1 . 10011 1 376 . 1 1 38 38 ILE CG2 C 13 17.760 0.300 . 1 . . . . 38 ILE CG2 . 10011 1 377 . 1 1 38 38 ILE CD1 C 13 10.408 0.300 . 1 . . . . 38 ILE CD1 . 10011 1 378 . 1 1 38 38 ILE N N 15 119.418 0.300 . 1 . . . . 38 ILE N . 10011 1 379 . 1 1 39 39 ILE H H 1 7.367 0.030 . 1 . . . . 39 ILE H . 10011 1 380 . 1 1 39 39 ILE HA H 1 3.969 0.030 . 1 . . . . 39 ILE HA . 10011 1 381 . 1 1 39 39 ILE HB H 1 1.687 0.030 . 1 . . . . 39 ILE HB . 10011 1 382 . 1 1 39 39 ILE HG12 H 1 1.386 0.030 . 1 . . . . 39 ILE HG12 . 10011 1 383 . 1 1 39 39 ILE HG13 H 1 1.386 0.030 . 1 . . . . 39 ILE HG13 . 10011 1 384 . 1 1 39 39 ILE HG21 H 1 1.007 0.030 . 1 . . . . 39 ILE HG2 . 10011 1 385 . 1 1 39 39 ILE HG22 H 1 1.007 0.030 . 1 . . . . 39 ILE HG2 . 10011 1 386 . 1 1 39 39 ILE HG23 H 1 1.007 0.030 . 1 . . . . 39 ILE HG2 . 10011 1 387 . 1 1 39 39 ILE HD11 H 1 0.829 0.030 . 1 . . . . 39 ILE HD1 . 10011 1 388 . 1 1 39 39 ILE HD12 H 1 0.829 0.030 . 1 . . . . 39 ILE HD1 . 10011 1 389 . 1 1 39 39 ILE HD13 H 1 0.829 0.030 . 1 . . . . 39 ILE HD1 . 10011 1 390 . 1 1 39 39 ILE C C 13 175.318 0.300 . 1 . . . . 39 ILE C . 10011 1 391 . 1 1 39 39 ILE CA C 13 61.621 0.300 . 1 . . . . 39 ILE CA . 10011 1 392 . 1 1 39 39 ILE CB C 13 37.908 0.300 . 1 . . . . 39 ILE CB . 10011 1 393 . 1 1 39 39 ILE CG1 C 13 28.735 0.300 . 1 . . . . 39 ILE CG1 . 10011 1 394 . 1 1 39 39 ILE CG2 C 13 18.428 0.300 . 1 . . . . 39 ILE CG2 . 10011 1 395 . 1 1 39 39 ILE CD1 C 13 13.531 0.300 . 1 . . . . 39 ILE CD1 . 10011 1 396 . 1 1 39 39 ILE N N 15 118.769 0.300 . 1 . . . . 39 ILE N . 10011 1 397 . 1 1 40 40 SER H H 1 7.129 0.030 . 1 . . . . 40 SER H . 10011 1 398 . 1 1 40 40 SER HA H 1 4.503 0.030 . 1 . . . . 40 SER HA . 10011 1 399 . 1 1 40 40 SER HB2 H 1 3.987 0.030 . 2 . . . . 40 SER HB2 . 10011 1 400 . 1 1 40 40 SER HB3 H 1 3.883 0.030 . 2 . . . . 40 SER HB3 . 10011 1 401 . 1 1 40 40 SER C C 13 174.529 0.300 . 1 . . . . 40 SER C . 10011 1 402 . 1 1 40 40 SER CA C 13 58.428 0.300 . 1 . . . . 40 SER CA . 10011 1 403 . 1 1 40 40 SER CB C 13 64.011 0.300 . 1 . . . . 40 SER CB . 10011 1 404 . 1 1 40 40 SER N N 15 112.170 0.300 . 1 . . . . 40 SER N . 10011 1 405 . 1 1 41 41 GLY H H 1 7.183 0.030 . 1 . . . . 41 GLY H . 10011 1 406 . 1 1 41 41 GLY HA2 H 1 4.481 0.030 . 2 . . . . 41 GLY HA2 . 10011 1 407 . 1 1 41 41 GLY HA3 H 1 3.858 0.030 . 2 . . . . 41 GLY HA3 . 10011 1 408 . 1 1 41 41 GLY C C 13 171.117 0.300 . 1 . . . . 41 GLY C . 10011 1 409 . 1 1 41 41 GLY CA C 13 44.483 0.300 . 1 . . . . 41 GLY CA . 10011 1 410 . 1 1 41 41 GLY N N 15 110.767 0.300 . 1 . . . . 41 GLY N . 10011 1 411 . 1 1 42 42 PRO HA H 1 4.540 0.030 . 1 . . . . 42 PRO HA . 10011 1 412 . 1 1 42 42 PRO HB2 H 1 2.529 0.030 . 2 . . . . 42 PRO HB2 . 10011 1 413 . 1 1 42 42 PRO HB3 H 1 2.079 0.030 . 2 . . . . 42 PRO HB3 . 10011 1 414 . 1 1 42 42 PRO HG2 H 1 2.111 0.030 . 1 . . . . 42 PRO HG2 . 10011 1 415 . 1 1 42 42 PRO HG3 H 1 2.111 0.030 . 1 . . . . 42 PRO HG3 . 10011 1 416 . 1 1 42 42 PRO HD2 H 1 3.722 0.030 . 2 . . . . 42 PRO HD2 . 10011 1 417 . 1 1 42 42 PRO HD3 H 1 3.652 0.030 . 2 . . . . 42 PRO HD3 . 10011 1 418 . 1 1 42 42 PRO CA C 13 62.723 0.300 . 1 . . . . 42 PRO CA . 10011 1 419 . 1 1 42 42 PRO CB C 13 32.739 0.300 . 1 . . . . 42 PRO CB . 10011 1 420 . 1 1 42 42 PRO CG C 13 27.624 0.300 . 1 . . . . 42 PRO CG . 10011 1 421 . 1 1 42 42 PRO CD C 13 49.707 0.300 . 1 . . . . 42 PRO CD . 10011 1 422 . 1 1 43 43 GLN HA H 1 3.907 0.030 . 1 . . . . 43 GLN HA . 10011 1 423 . 1 1 43 43 GLN HB2 H 1 2.153 0.030 . 1 . . . . 43 GLN HB2 . 10011 1 424 . 1 1 43 43 GLN HB3 H 1 2.153 0.030 . 1 . . . . 43 GLN HB3 . 10011 1 425 . 1 1 43 43 GLN HG2 H 1 2.500 0.030 . 2 . . . . 43 GLN HG2 . 10011 1 426 . 1 1 43 43 GLN HG3 H 1 2.439 0.030 . 2 . . . . 43 GLN HG3 . 10011 1 427 . 1 1 43 43 GLN HE21 H 1 7.612 0.030 . 2 . . . . 43 GLN HE21 . 10011 1 428 . 1 1 43 43 GLN HE22 H 1 6.849 0.030 . 2 . . . . 43 GLN HE22 . 10011 1 429 . 1 1 43 43 GLN C C 13 178.555 0.300 . 1 . . . . 43 GLN C . 10011 1 430 . 1 1 43 43 GLN CA C 13 59.543 0.300 . 1 . . . . 43 GLN CA . 10011 1 431 . 1 1 43 43 GLN CB C 13 28.299 0.300 . 1 . . . . 43 GLN CB . 10011 1 432 . 1 1 43 43 GLN CG C 13 34.106 0.300 . 1 . . . . 43 GLN CG . 10011 1 433 . 1 1 43 43 GLN NE2 N 15 112.213 0.300 . 1 . . . . 43 GLN NE2 . 10011 1 434 . 1 1 44 44 GLN H H 1 9.184 0.030 . 1 . . . . 44 GLN H . 10011 1 435 . 1 1 44 44 GLN HA H 1 4.082 0.030 . 1 . . . . 44 GLN HA . 10011 1 436 . 1 1 44 44 GLN HB2 H 1 2.185 0.030 . 2 . . . . 44 GLN HB2 . 10011 1 437 . 1 1 44 44 GLN HB3 H 1 2.011 0.030 . 2 . . . . 44 GLN HB3 . 10011 1 438 . 1 1 44 44 GLN HG2 H 1 2.482 0.030 . 1 . . . . 44 GLN HG2 . 10011 1 439 . 1 1 44 44 GLN HG3 H 1 2.482 0.030 . 1 . . . . 44 GLN HG3 . 10011 1 440 . 1 1 44 44 GLN HE21 H 1 7.464 0.030 . 2 . . . . 44 GLN HE21 . 10011 1 441 . 1 1 44 44 GLN HE22 H 1 6.903 0.030 . 2 . . . . 44 GLN HE22 . 10011 1 442 . 1 1 44 44 GLN C C 13 178.007 0.300 . 1 . . . . 44 GLN C . 10011 1 443 . 1 1 44 44 GLN CA C 13 59.484 0.300 . 1 . . . . 44 GLN CA . 10011 1 444 . 1 1 44 44 GLN CB C 13 27.730 0.300 . 1 . . . . 44 GLN CB . 10011 1 445 . 1 1 44 44 GLN CG C 13 33.277 0.300 . 1 . . . . 44 GLN CG . 10011 1 446 . 1 1 44 44 GLN N N 15 117.813 0.300 . 1 . . . . 44 GLN N . 10011 1 447 . 1 1 44 44 GLN NE2 N 15 111.525 0.300 . 1 . . . . 44 GLN NE2 . 10011 1 448 . 1 1 45 45 THR H H 1 7.234 0.030 . 1 . . . . 45 THR H . 10011 1 449 . 1 1 45 45 THR HA H 1 4.105 0.030 . 1 . . . . 45 THR HA . 10011 1 450 . 1 1 45 45 THR HB H 1 4.310 0.030 . 1 . . . . 45 THR HB . 10011 1 451 . 1 1 45 45 THR HG21 H 1 1.381 0.030 . 1 . . . . 45 THR HG2 . 10011 1 452 . 1 1 45 45 THR HG22 H 1 1.381 0.030 . 1 . . . . 45 THR HG2 . 10011 1 453 . 1 1 45 45 THR HG23 H 1 1.381 0.030 . 1 . . . . 45 THR HG2 . 10011 1 454 . 1 1 45 45 THR C C 13 176.410 0.300 . 1 . . . . 45 THR C . 10011 1 455 . 1 1 45 45 THR CA C 13 65.709 0.300 . 1 . . . . 45 THR CA . 10011 1 456 . 1 1 45 45 THR CB C 13 68.260 0.300 . 1 . . . . 45 THR CB . 10011 1 457 . 1 1 45 45 THR CG2 C 13 23.046 0.300 . 1 . . . . 45 THR CG2 . 10011 1 458 . 1 1 45 45 THR N N 15 114.758 0.300 . 1 . . . . 45 THR N . 10011 1 459 . 1 1 46 46 GLN H H 1 7.433 0.030 . 1 . . . . 46 GLN H . 10011 1 460 . 1 1 46 46 GLN HA H 1 3.822 0.030 . 1 . . . . 46 GLN HA . 10011 1 461 . 1 1 46 46 GLN HB2 H 1 2.187 0.030 . 2 . . . . 46 GLN HB2 . 10011 1 462 . 1 1 46 46 GLN HB3 H 1 2.087 0.030 . 2 . . . . 46 GLN HB3 . 10011 1 463 . 1 1 46 46 GLN HG2 H 1 2.305 0.030 . 2 . . . . 46 GLN HG2 . 10011 1 464 . 1 1 46 46 GLN HG3 H 1 2.190 0.030 . 2 . . . . 46 GLN HG3 . 10011 1 465 . 1 1 46 46 GLN HE21 H 1 6.855 0.030 . 2 . . . . 46 GLN HE21 . 10011 1 466 . 1 1 46 46 GLN HE22 H 1 6.638 0.030 . 2 . . . . 46 GLN HE22 . 10011 1 467 . 1 1 46 46 GLN C C 13 177.815 0.300 . 1 . . . . 46 GLN C . 10011 1 468 . 1 1 46 46 GLN CA C 13 59.909 0.300 . 1 . . . . 46 GLN CA . 10011 1 469 . 1 1 46 46 GLN CB C 13 27.440 0.300 . 1 . . . . 46 GLN CB . 10011 1 470 . 1 1 46 46 GLN CG C 13 34.827 0.300 . 1 . . . . 46 GLN CG . 10011 1 471 . 1 1 46 46 GLN N N 15 122.032 0.300 . 1 . . . . 46 GLN N . 10011 1 472 . 1 1 46 46 GLN NE2 N 15 111.546 0.300 . 1 . . . . 46 GLN NE2 . 10011 1 473 . 1 1 47 47 LYS H H 1 8.040 0.030 . 1 . . . . 47 LYS H . 10011 1 474 . 1 1 47 47 LYS HA H 1 4.045 0.030 . 1 . . . . 47 LYS HA . 10011 1 475 . 1 1 47 47 LYS HB2 H 1 2.080 0.030 . 2 . . . . 47 LYS HB2 . 10011 1 476 . 1 1 47 47 LYS HB3 H 1 2.020 0.030 . 2 . . . . 47 LYS HB3 . 10011 1 477 . 1 1 47 47 LYS HG2 H 1 1.674 0.030 . 2 . . . . 47 LYS HG2 . 10011 1 478 . 1 1 47 47 LYS HG3 H 1 1.496 0.030 . 2 . . . . 47 LYS HG3 . 10011 1 479 . 1 1 47 47 LYS HD2 H 1 1.717 0.030 . 1 . . . . 47 LYS HD2 . 10011 1 480 . 1 1 47 47 LYS HD3 H 1 1.717 0.030 . 1 . . . . 47 LYS HD3 . 10011 1 481 . 1 1 47 47 LYS HE2 H 1 3.001 0.030 . 1 . . . . 47 LYS HE2 . 10011 1 482 . 1 1 47 47 LYS HE3 H 1 3.001 0.030 . 1 . . . . 47 LYS HE3 . 10011 1 483 . 1 1 47 47 LYS C C 13 179.938 0.300 . 1 . . . . 47 LYS C . 10011 1 484 . 1 1 47 47 LYS CA C 13 59.845 0.300 . 1 . . . . 47 LYS CA . 10011 1 485 . 1 1 47 47 LYS CB C 13 31.990 0.300 . 1 . . . . 47 LYS CB . 10011 1 486 . 1 1 47 47 LYS CG C 13 25.560 0.300 . 1 . . . . 47 LYS CG . 10011 1 487 . 1 1 47 47 LYS CD C 13 29.246 0.300 . 1 . . . . 47 LYS CD . 10011 1 488 . 1 1 47 47 LYS CE C 13 42.173 0.300 . 1 . . . . 47 LYS CE . 10011 1 489 . 1 1 47 47 LYS N N 15 117.633 0.300 . 1 . . . . 47 LYS N . 10011 1 490 . 1 1 48 48 VAL H H 1 7.778 0.030 . 1 . . . . 48 VAL H . 10011 1 491 . 1 1 48 48 VAL HA H 1 3.894 0.030 . 1 . . . . 48 VAL HA . 10011 1 492 . 1 1 48 48 VAL HB H 1 2.406 0.030 . 1 . . . . 48 VAL HB . 10011 1 493 . 1 1 48 48 VAL HG11 H 1 1.242 0.030 . 1 . . . . 48 VAL HG1 . 10011 1 494 . 1 1 48 48 VAL HG12 H 1 1.242 0.030 . 1 . . . . 48 VAL HG1 . 10011 1 495 . 1 1 48 48 VAL HG13 H 1 1.242 0.030 . 1 . . . . 48 VAL HG1 . 10011 1 496 . 1 1 48 48 VAL HG21 H 1 1.190 0.030 . 1 . . . . 48 VAL HG2 . 10011 1 497 . 1 1 48 48 VAL HG22 H 1 1.190 0.030 . 1 . . . . 48 VAL HG2 . 10011 1 498 . 1 1 48 48 VAL HG23 H 1 1.190 0.030 . 1 . . . . 48 VAL HG2 . 10011 1 499 . 1 1 48 48 VAL C C 13 177.035 0.300 . 1 . . . . 48 VAL C . 10011 1 500 . 1 1 48 48 VAL CA C 13 67.440 0.300 . 1 . . . . 48 VAL CA . 10011 1 501 . 1 1 48 48 VAL CB C 13 31.797 0.300 . 1 . . . . 48 VAL CB . 10011 1 502 . 1 1 48 48 VAL CG1 C 13 21.993 0.300 . 1 . . . . 48 VAL CG1 . 10011 1 503 . 1 1 48 48 VAL CG2 C 13 22.761 0.300 . 1 . . . . 48 VAL CG2 . 10011 1 504 . 1 1 48 48 VAL N N 15 121.839 0.300 . 1 . . . . 48 VAL N . 10011 1 505 . 1 1 49 49 PHE H H 1 8.202 0.030 . 1 . . . . 49 PHE H . 10011 1 506 . 1 1 49 49 PHE HA H 1 3.669 0.030 . 1 . . . . 49 PHE HA . 10011 1 507 . 1 1 49 49 PHE HB2 H 1 3.397 0.030 . 2 . . . . 49 PHE HB2 . 10011 1 508 . 1 1 49 49 PHE HB3 H 1 2.840 0.030 . 2 . . . . 49 PHE HB3 . 10011 1 509 . 1 1 49 49 PHE HD1 H 1 6.551 0.030 . 1 . . . . 49 PHE HD1 . 10011 1 510 . 1 1 49 49 PHE HD2 H 1 6.551 0.030 . 1 . . . . 49 PHE HD2 . 10011 1 511 . 1 1 49 49 PHE HE1 H 1 5.996 0.030 . 1 . . . . 49 PHE HE1 . 10011 1 512 . 1 1 49 49 PHE HE2 H 1 5.996 0.030 . 1 . . . . 49 PHE HE2 . 10011 1 513 . 1 1 49 49 PHE HZ H 1 6.408 0.030 . 1 . . . . 49 PHE HZ . 10011 1 514 . 1 1 49 49 PHE C C 13 176.006 0.300 . 1 . . . . 49 PHE C . 10011 1 515 . 1 1 49 49 PHE CA C 13 62.743 0.300 . 1 . . . . 49 PHE CA . 10011 1 516 . 1 1 49 49 PHE CB C 13 39.496 0.300 . 1 . . . . 49 PHE CB . 10011 1 517 . 1 1 49 49 PHE CD1 C 13 131.184 0.300 . 1 . . . . 49 PHE CD1 . 10011 1 518 . 1 1 49 49 PHE CD2 C 13 131.184 0.300 . 1 . . . . 49 PHE CD2 . 10011 1 519 . 1 1 49 49 PHE CE1 C 13 131.121 0.300 . 1 . . . . 49 PHE CE1 . 10011 1 520 . 1 1 49 49 PHE CE2 C 13 131.121 0.300 . 1 . . . . 49 PHE CE2 . 10011 1 521 . 1 1 49 49 PHE CZ C 13 128.112 0.300 . 1 . . . . 49 PHE CZ . 10011 1 522 . 1 1 49 49 PHE N N 15 119.350 0.300 . 1 . . . . 49 PHE N . 10011 1 523 . 1 1 50 50 LEU H H 1 8.482 0.030 . 1 . . . . 50 LEU H . 10011 1 524 . 1 1 50 50 LEU HA H 1 3.624 0.030 . 1 . . . . 50 LEU HA . 10011 1 525 . 1 1 50 50 LEU HB2 H 1 1.874 0.030 . 2 . . . . 50 LEU HB2 . 10011 1 526 . 1 1 50 50 LEU HB3 H 1 1.276 0.030 . 2 . . . . 50 LEU HB3 . 10011 1 527 . 1 1 50 50 LEU HG H 1 1.871 0.030 . 1 . . . . 50 LEU HG . 10011 1 528 . 1 1 50 50 LEU HD11 H 1 0.669 0.030 . 1 . . . . 50 LEU HD1 . 10011 1 529 . 1 1 50 50 LEU HD12 H 1 0.669 0.030 . 1 . . . . 50 LEU HD1 . 10011 1 530 . 1 1 50 50 LEU HD13 H 1 0.669 0.030 . 1 . . . . 50 LEU HD1 . 10011 1 531 . 1 1 50 50 LEU HD21 H 1 0.686 0.030 . 1 . . . . 50 LEU HD2 . 10011 1 532 . 1 1 50 50 LEU HD22 H 1 0.686 0.030 . 1 . . . . 50 LEU HD2 . 10011 1 533 . 1 1 50 50 LEU HD23 H 1 0.686 0.030 . 1 . . . . 50 LEU HD2 . 10011 1 534 . 1 1 50 50 LEU C C 13 177.572 0.300 . 1 . . . . 50 LEU C . 10011 1 535 . 1 1 50 50 LEU CA C 13 57.766 0.300 . 1 . . . . 50 LEU CA . 10011 1 536 . 1 1 50 50 LEU CB C 13 41.718 0.300 . 1 . . . . 50 LEU CB . 10011 1 537 . 1 1 50 50 LEU CG C 13 26.970 0.300 . 1 . . . . 50 LEU CG . 10011 1 538 . 1 1 50 50 LEU CD1 C 13 25.702 0.300 . 1 . . . . 50 LEU CD1 . 10011 1 539 . 1 1 50 50 LEU CD2 C 13 22.130 0.300 . 1 . . . . 50 LEU CD2 . 10011 1 540 . 1 1 50 50 LEU N N 15 118.532 0.300 . 1 . . . . 50 LEU N . 10011 1 541 . 1 1 51 51 PHE H H 1 8.112 0.030 . 1 . . . . 51 PHE H . 10011 1 542 . 1 1 51 51 PHE HA H 1 3.872 0.030 . 1 . . . . 51 PHE HA . 10011 1 543 . 1 1 51 51 PHE HB2 H 1 2.825 0.030 . 1 . . . . 51 PHE HB2 . 10011 1 544 . 1 1 51 51 PHE HB3 H 1 2.825 0.030 . 1 . . . . 51 PHE HB3 . 10011 1 545 . 1 1 51 51 PHE HD1 H 1 6.517 0.030 . 1 . . . . 51 PHE HD1 . 10011 1 546 . 1 1 51 51 PHE HD2 H 1 6.517 0.030 . 1 . . . . 51 PHE HD2 . 10011 1 547 . 1 1 51 51 PHE HE1 H 1 7.064 0.030 . 1 . . . . 51 PHE HE1 . 10011 1 548 . 1 1 51 51 PHE HE2 H 1 7.064 0.030 . 1 . . . . 51 PHE HE2 . 10011 1 549 . 1 1 51 51 PHE HZ H 1 7.181 0.030 . 1 . . . . 51 PHE HZ . 10011 1 550 . 1 1 51 51 PHE C C 13 178.370 0.300 . 1 . . . . 51 PHE C . 10011 1 551 . 1 1 51 51 PHE CA C 13 62.170 0.300 . 1 . . . . 51 PHE CA . 10011 1 552 . 1 1 51 51 PHE CB C 13 39.559 0.300 . 1 . . . . 51 PHE CB . 10011 1 553 . 1 1 51 51 PHE CD1 C 13 131.493 0.300 . 1 . . . . 51 PHE CD1 . 10011 1 554 . 1 1 51 51 PHE CD2 C 13 131.493 0.300 . 1 . . . . 51 PHE CD2 . 10011 1 555 . 1 1 51 51 PHE CE1 C 13 130.594 0.300 . 1 . . . . 51 PHE CE1 . 10011 1 556 . 1 1 51 51 PHE CE2 C 13 130.594 0.300 . 1 . . . . 51 PHE CE2 . 10011 1 557 . 1 1 51 51 PHE CZ C 13 129.202 0.300 . 1 . . . . 51 PHE CZ . 10011 1 558 . 1 1 51 51 PHE N N 15 119.842 0.300 . 1 . . . . 51 PHE N . 10011 1 559 . 1 1 52 52 ILE H H 1 8.349 0.030 . 1 . . . . 52 ILE H . 10011 1 560 . 1 1 52 52 ILE HA H 1 3.338 0.030 . 1 . . . . 52 ILE HA . 10011 1 561 . 1 1 52 52 ILE HB H 1 1.709 0.030 . 1 . . . . 52 ILE HB . 10011 1 562 . 1 1 52 52 ILE HG12 H 1 2.262 0.030 . 2 . . . . 52 ILE HG12 . 10011 1 563 . 1 1 52 52 ILE HG13 H 1 1.044 0.030 . 2 . . . . 52 ILE HG13 . 10011 1 564 . 1 1 52 52 ILE HG21 H 1 0.840 0.030 . 1 . . . . 52 ILE HG2 . 10011 1 565 . 1 1 52 52 ILE HG22 H 1 0.840 0.030 . 1 . . . . 52 ILE HG2 . 10011 1 566 . 1 1 52 52 ILE HG23 H 1 0.840 0.030 . 1 . . . . 52 ILE HG2 . 10011 1 567 . 1 1 52 52 ILE HD11 H 1 1.007 0.030 . 1 . . . . 52 ILE HD1 . 10011 1 568 . 1 1 52 52 ILE HD12 H 1 1.007 0.030 . 1 . . . . 52 ILE HD1 . 10011 1 569 . 1 1 52 52 ILE HD13 H 1 1.007 0.030 . 1 . . . . 52 ILE HD1 . 10011 1 570 . 1 1 52 52 ILE C C 13 178.998 0.300 . 1 . . . . 52 ILE C . 10011 1 571 . 1 1 52 52 ILE CA C 13 65.994 0.300 . 1 . . . . 52 ILE CA . 10011 1 572 . 1 1 52 52 ILE CB C 13 38.706 0.300 . 1 . . . . 52 ILE CB . 10011 1 573 . 1 1 52 52 ILE CG1 C 13 29.327 0.300 . 1 . . . . 52 ILE CG1 . 10011 1 574 . 1 1 52 52 ILE CG2 C 13 18.044 0.300 . 1 . . . . 52 ILE CG2 . 10011 1 575 . 1 1 52 52 ILE CD1 C 13 15.676 0.300 . 1 . . . . 52 ILE CD1 . 10011 1 576 . 1 1 52 52 ILE N N 15 118.124 0.300 . 1 . . . . 52 ILE N . 10011 1 577 . 1 1 53 53 ARG H H 1 8.856 0.030 . 1 . . . . 53 ARG H . 10011 1 578 . 1 1 53 53 ARG HA H 1 3.424 0.030 . 1 . . . . 53 ARG HA . 10011 1 579 . 1 1 53 53 ARG HB2 H 1 1.347 0.030 . 2 . . . . 53 ARG HB2 . 10011 1 580 . 1 1 53 53 ARG HB3 H 1 1.198 0.030 . 2 . . . . 53 ARG HB3 . 10011 1 581 . 1 1 53 53 ARG HG2 H 1 1.666 0.030 . 2 . . . . 53 ARG HG2 . 10011 1 582 . 1 1 53 53 ARG HG3 H 1 1.491 0.030 . 2 . . . . 53 ARG HG3 . 10011 1 583 . 1 1 53 53 ARG HD2 H 1 2.740 0.030 . 2 . . . . 53 ARG HD2 . 10011 1 584 . 1 1 53 53 ARG HD3 H 1 3.000 0.030 . 2 . . . . 53 ARG HD3 . 10011 1 585 . 1 1 53 53 ARG HE H 1 9.568 0.030 . 1 . . . . 53 ARG HE . 10011 1 586 . 1 1 53 53 ARG HH11 H 1 7.455 0.030 . 1 . . . . 53 ARG HH11 . 10011 1 587 . 1 1 53 53 ARG HH12 H 1 7.455 0.030 . 1 . . . . 53 ARG HH12 . 10011 1 588 . 1 1 53 53 ARG HH21 H 1 7.257 0.030 . 1 . . . . 53 ARG HH21 . 10011 1 589 . 1 1 53 53 ARG HH22 H 1 7.257 0.030 . 1 . . . . 53 ARG HH22 . 10011 1 590 . 1 1 53 53 ARG C C 13 176.642 0.300 . 1 . . . . 53 ARG C . 10011 1 591 . 1 1 53 53 ARG CA C 13 61.003 0.300 . 1 . . . . 53 ARG CA . 10011 1 592 . 1 1 53 53 ARG CB C 13 30.198 0.300 . 1 . . . . 53 ARG CB . 10011 1 593 . 1 1 53 53 ARG CG C 13 24.205 0.300 . 1 . . . . 53 ARG CG . 10011 1 594 . 1 1 53 53 ARG CD C 13 45.852 0.300 . 1 . . . . 53 ARG CD . 10011 1 595 . 1 1 53 53 ARG N N 15 123.564 0.300 . 1 . . . . 53 ARG N . 10011 1 596 . 1 1 53 53 ARG NE N 15 84.181 0.300 . 1 . . . . 53 ARG NE . 10011 1 597 . 1 1 54 54 ASN H H 1 8.859 0.030 . 1 . . . . 54 ASN H . 10011 1 598 . 1 1 54 54 ASN HA H 1 4.292 0.030 . 1 . . . . 54 ASN HA . 10011 1 599 . 1 1 54 54 ASN HB2 H 1 2.595 0.030 . 2 . . . . 54 ASN HB2 . 10011 1 600 . 1 1 54 54 ASN HB3 H 1 2.546 0.030 . 2 . . . . 54 ASN HB3 . 10011 1 601 . 1 1 54 54 ASN HD21 H 1 7.294 0.030 . 1 . . . . 54 ASN HD21 . 10011 1 602 . 1 1 54 54 ASN HD22 H 1 7.294 0.030 . 1 . . . . 54 ASN HD22 . 10011 1 603 . 1 1 54 54 ASN C C 13 178.088 0.300 . 1 . . . . 54 ASN C . 10011 1 604 . 1 1 54 54 ASN CA C 13 55.814 0.300 . 1 . . . . 54 ASN CA . 10011 1 605 . 1 1 54 54 ASN CB C 13 37.275 0.300 . 1 . . . . 54 ASN CB . 10011 1 606 . 1 1 54 54 ASN N N 15 117.736 0.300 . 1 . . . . 54 ASN N . 10011 1 607 . 1 1 54 54 ASN ND2 N 15 112.644 0.300 . 1 . . . . 54 ASN ND2 . 10011 1 608 . 1 1 55 55 ARG H H 1 8.565 0.030 . 1 . . . . 55 ARG H . 10011 1 609 . 1 1 55 55 ARG HA H 1 3.915 0.030 . 1 . . . . 55 ARG HA . 10011 1 610 . 1 1 55 55 ARG HB2 H 1 1.612 0.030 . 2 . . . . 55 ARG HB2 . 10011 1 611 . 1 1 55 55 ARG HB3 H 1 1.315 0.030 . 2 . . . . 55 ARG HB3 . 10011 1 612 . 1 1 55 55 ARG HG2 H 1 1.590 0.030 . 2 . . . . 55 ARG HG2 . 10011 1 613 . 1 1 55 55 ARG HG3 H 1 1.315 0.030 . 2 . . . . 55 ARG HG3 . 10011 1 614 . 1 1 55 55 ARG HD2 H 1 3.338 0.030 . 2 . . . . 55 ARG HD2 . 10011 1 615 . 1 1 55 55 ARG HD3 H 1 2.960 0.030 . 2 . . . . 55 ARG HD3 . 10011 1 616 . 1 1 55 55 ARG HE H 1 7.464 0.030 . 1 . . . . 55 ARG HE . 10011 1 617 . 1 1 55 55 ARG C C 13 177.492 0.300 . 1 . . . . 55 ARG C . 10011 1 618 . 1 1 55 55 ARG CA C 13 57.503 0.300 . 1 . . . . 55 ARG CA . 10011 1 619 . 1 1 55 55 ARG CB C 13 29.103 0.300 . 1 . . . . 55 ARG CB . 10011 1 620 . 1 1 55 55 ARG CG C 13 26.638 0.300 . 1 . . . . 55 ARG CG . 10011 1 621 . 1 1 55 55 ARG CD C 13 42.019 0.300 . 1 . . . . 55 ARG CD . 10011 1 622 . 1 1 55 55 ARG N N 15 121.226 0.300 . 1 . . . . 55 ARG N . 10011 1 623 . 1 1 55 55 ARG NE N 15 84.996 0.300 . 1 . . . . 55 ARG NE . 10011 1 624 . 1 1 56 56 THR H H 1 8.178 0.030 . 1 . . . . 56 THR H . 10011 1 625 . 1 1 56 56 THR HA H 1 3.717 0.030 . 1 . . . . 56 THR HA . 10011 1 626 . 1 1 56 56 THR HB H 1 3.925 0.030 . 1 . . . . 56 THR HB . 10011 1 627 . 1 1 56 56 THR HG1 H 1 4.467 0.030 . 1 . . . . 56 THR HG1 . 10011 1 628 . 1 1 56 56 THR HG21 H 1 1.217 0.030 . 1 . . . . 56 THR HG2 . 10011 1 629 . 1 1 56 56 THR HG22 H 1 1.217 0.030 . 1 . . . . 56 THR HG2 . 10011 1 630 . 1 1 56 56 THR HG23 H 1 1.217 0.030 . 1 . . . . 56 THR HG2 . 10011 1 631 . 1 1 56 56 THR C C 13 175.854 0.300 . 1 . . . . 56 THR C . 10011 1 632 . 1 1 56 56 THR CA C 13 68.526 0.300 . 1 . . . . 56 THR CA . 10011 1 633 . 1 1 56 56 THR CB C 13 67.855 0.300 . 1 . . . . 56 THR CB . 10011 1 634 . 1 1 56 56 THR CG2 C 13 22.804 0.300 . 1 . . . . 56 THR CG2 . 10011 1 635 . 1 1 56 56 THR N N 15 116.770 0.300 . 1 . . . . 56 THR N . 10011 1 636 . 1 1 57 57 LEU H H 1 7.695 0.030 . 1 . . . . 57 LEU H . 10011 1 637 . 1 1 57 57 LEU HA H 1 3.988 0.030 . 1 . . . . 57 LEU HA . 10011 1 638 . 1 1 57 57 LEU HB2 H 1 1.834 0.030 . 2 . . . . 57 LEU HB2 . 10011 1 639 . 1 1 57 57 LEU HB3 H 1 1.517 0.030 . 2 . . . . 57 LEU HB3 . 10011 1 640 . 1 1 57 57 LEU HG H 1 1.764 0.030 . 1 . . . . 57 LEU HG . 10011 1 641 . 1 1 57 57 LEU HD11 H 1 0.921 0.030 . 1 . . . . 57 LEU HD1 . 10011 1 642 . 1 1 57 57 LEU HD12 H 1 0.921 0.030 . 1 . . . . 57 LEU HD1 . 10011 1 643 . 1 1 57 57 LEU HD13 H 1 0.921 0.030 . 1 . . . . 57 LEU HD1 . 10011 1 644 . 1 1 57 57 LEU HD21 H 1 0.903 0.030 . 1 . . . . 57 LEU HD2 . 10011 1 645 . 1 1 57 57 LEU HD22 H 1 0.903 0.030 . 1 . . . . 57 LEU HD2 . 10011 1 646 . 1 1 57 57 LEU HD23 H 1 0.903 0.030 . 1 . . . . 57 LEU HD2 . 10011 1 647 . 1 1 57 57 LEU C C 13 178.231 0.300 . 1 . . . . 57 LEU C . 10011 1 648 . 1 1 57 57 LEU CA C 13 58.310 0.300 . 1 . . . . 57 LEU CA . 10011 1 649 . 1 1 57 57 LEU CB C 13 42.125 0.300 . 1 . . . . 57 LEU CB . 10011 1 650 . 1 1 57 57 LEU CG C 13 27.088 0.300 . 1 . . . . 57 LEU CG . 10011 1 651 . 1 1 57 57 LEU CD1 C 13 26.258 0.300 . 1 . . . . 57 LEU CD1 . 10011 1 652 . 1 1 57 57 LEU CD2 C 13 24.819 0.300 . 1 . . . . 57 LEU CD2 . 10011 1 653 . 1 1 57 57 LEU N N 15 118.679 0.300 . 1 . . . . 57 LEU N . 10011 1 654 . 1 1 58 58 GLN H H 1 7.928 0.030 . 1 . . . . 58 GLN H . 10011 1 655 . 1 1 58 58 GLN HA H 1 3.807 0.030 . 1 . . . . 58 GLN HA . 10011 1 656 . 1 1 58 58 GLN HB2 H 1 2.273 0.030 . 2 . . . . 58 GLN HB2 . 10011 1 657 . 1 1 58 58 GLN HB3 H 1 2.085 0.030 . 2 . . . . 58 GLN HB3 . 10011 1 658 . 1 1 58 58 GLN HG2 H 1 2.399 0.030 . 2 . . . . 58 GLN HG2 . 10011 1 659 . 1 1 58 58 GLN HG3 H 1 2.260 0.030 . 2 . . . . 58 GLN HG3 . 10011 1 660 . 1 1 58 58 GLN HE21 H 1 7.775 0.030 . 2 . . . . 58 GLN HE21 . 10011 1 661 . 1 1 58 58 GLN HE22 H 1 6.713 0.030 . 2 . . . . 58 GLN HE22 . 10011 1 662 . 1 1 58 58 GLN C C 13 177.583 0.300 . 1 . . . . 58 GLN C . 10011 1 663 . 1 1 58 58 GLN CA C 13 59.087 0.300 . 1 . . . . 58 GLN CA . 10011 1 664 . 1 1 58 58 GLN CB C 13 28.504 0.300 . 1 . . . . 58 GLN CB . 10011 1 665 . 1 1 58 58 GLN CG C 13 33.391 0.300 . 1 . . . . 58 GLN CG . 10011 1 666 . 1 1 58 58 GLN N N 15 118.676 0.300 . 1 . . . . 58 GLN N . 10011 1 667 . 1 1 58 58 GLN NE2 N 15 113.979 0.300 . 1 . . . . 58 GLN NE2 . 10011 1 668 . 1 1 59 59 LEU H H 1 8.203 0.030 . 1 . . . . 59 LEU H . 10011 1 669 . 1 1 59 59 LEU HA H 1 4.014 0.030 . 1 . . . . 59 LEU HA . 10011 1 670 . 1 1 59 59 LEU HB2 H 1 2.245 0.030 . 2 . . . . 59 LEU HB2 . 10011 1 671 . 1 1 59 59 LEU HB3 H 1 1.392 0.030 . 2 . . . . 59 LEU HB3 . 10011 1 672 . 1 1 59 59 LEU HG H 1 1.968 0.030 . 1 . . . . 59 LEU HG . 10011 1 673 . 1 1 59 59 LEU HD11 H 1 0.910 0.030 . 1 . . . . 59 LEU HD1 . 10011 1 674 . 1 1 59 59 LEU HD12 H 1 0.910 0.030 . 1 . . . . 59 LEU HD1 . 10011 1 675 . 1 1 59 59 LEU HD13 H 1 0.910 0.030 . 1 . . . . 59 LEU HD1 . 10011 1 676 . 1 1 59 59 LEU HD21 H 1 0.846 0.030 . 1 . . . . 59 LEU HD2 . 10011 1 677 . 1 1 59 59 LEU HD22 H 1 0.846 0.030 . 1 . . . . 59 LEU HD2 . 10011 1 678 . 1 1 59 59 LEU HD23 H 1 0.846 0.030 . 1 . . . . 59 LEU HD2 . 10011 1 679 . 1 1 59 59 LEU C C 13 180.099 0.300 . 1 . . . . 59 LEU C . 10011 1 680 . 1 1 59 59 LEU CA C 13 57.825 0.300 . 1 . . . . 59 LEU CA . 10011 1 681 . 1 1 59 59 LEU CB C 13 42.781 0.300 . 1 . . . . 59 LEU CB . 10011 1 682 . 1 1 59 59 LEU CG C 13 26.762 0.300 . 1 . . . . 59 LEU CG . 10011 1 683 . 1 1 59 59 LEU CD1 C 13 27.015 0.300 . 1 . . . . 59 LEU CD1 . 10011 1 684 . 1 1 59 59 LEU CD2 C 13 22.556 0.300 . 1 . . . . 59 LEU CD2 . 10011 1 685 . 1 1 59 59 LEU N N 15 118.796 0.300 . 1 . . . . 59 LEU N . 10011 1 686 . 1 1 60 60 TRP H H 1 7.659 0.030 . 1 . . . . 60 TRP H . 10011 1 687 . 1 1 60 60 TRP HA H 1 4.690 0.030 . 1 . . . . 60 TRP HA . 10011 1 688 . 1 1 60 60 TRP HB2 H 1 3.450 0.030 . 2 . . . . 60 TRP HB2 . 10011 1 689 . 1 1 60 60 TRP HB3 H 1 3.214 0.030 . 2 . . . . 60 TRP HB3 . 10011 1 690 . 1 1 60 60 TRP HD1 H 1 7.152 0.030 . 1 . . . . 60 TRP HD1 . 10011 1 691 . 1 1 60 60 TRP HE1 H 1 9.413 0.030 . 1 . . . . 60 TRP HE1 . 10011 1 692 . 1 1 60 60 TRP HE3 H 1 7.838 0.030 . 1 . . . . 60 TRP HE3 . 10011 1 693 . 1 1 60 60 TRP HZ2 H 1 6.660 0.030 . 1 . . . . 60 TRP HZ2 . 10011 1 694 . 1 1 60 60 TRP HZ3 H 1 7.220 0.030 . 1 . . . . 60 TRP HZ3 . 10011 1 695 . 1 1 60 60 TRP HH2 H 1 6.880 0.030 . 1 . . . . 60 TRP HH2 . 10011 1 696 . 1 1 60 60 TRP C C 13 176.410 0.300 . 1 . . . . 60 TRP C . 10011 1 697 . 1 1 60 60 TRP CA C 13 58.911 0.300 . 1 . . . . 60 TRP CA . 10011 1 698 . 1 1 60 60 TRP CB C 13 30.226 0.300 . 1 . . . . 60 TRP CB . 10011 1 699 . 1 1 60 60 TRP CD1 C 13 128.796 0.300 . 1 . . . . 60 TRP CD1 . 10011 1 700 . 1 1 60 60 TRP CE3 C 13 122.232 0.300 . 1 . . . . 60 TRP CE3 . 10011 1 701 . 1 1 60 60 TRP CZ2 C 13 114.156 0.300 . 1 . . . . 60 TRP CZ2 . 10011 1 702 . 1 1 60 60 TRP CZ3 C 13 123.862 0.300 . 1 . . . . 60 TRP CZ3 . 10011 1 703 . 1 1 60 60 TRP CH2 C 13 125.532 0.300 . 1 . . . . 60 TRP CH2 . 10011 1 704 . 1 1 60 60 TRP N N 15 120.464 0.300 . 1 . . . . 60 TRP N . 10011 1 705 . 1 1 60 60 TRP NE1 N 15 128.267 0.300 . 1 . . . . 60 TRP NE1 . 10011 1 706 . 1 1 61 61 LEU H H 1 8.542 0.030 . 1 . . . . 61 LEU H . 10011 1 707 . 1 1 61 61 LEU HA H 1 3.487 0.030 . 1 . . . . 61 LEU HA . 10011 1 708 . 1 1 61 61 LEU HB2 H 1 1.865 0.030 . 2 . . . . 61 LEU HB2 . 10011 1 709 . 1 1 61 61 LEU HB3 H 1 1.359 0.030 . 2 . . . . 61 LEU HB3 . 10011 1 710 . 1 1 61 61 LEU HG H 1 2.037 0.030 . 1 . . . . 61 LEU HG . 10011 1 711 . 1 1 61 61 LEU HD11 H 1 0.897 0.030 . 1 . . . . 61 LEU HD1 . 10011 1 712 . 1 1 61 61 LEU HD12 H 1 0.897 0.030 . 1 . . . . 61 LEU HD1 . 10011 1 713 . 1 1 61 61 LEU HD13 H 1 0.897 0.030 . 1 . . . . 61 LEU HD1 . 10011 1 714 . 1 1 61 61 LEU HD21 H 1 0.968 0.030 . 1 . . . . 61 LEU HD2 . 10011 1 715 . 1 1 61 61 LEU HD22 H 1 0.968 0.030 . 1 . . . . 61 LEU HD2 . 10011 1 716 . 1 1 61 61 LEU HD23 H 1 0.968 0.030 . 1 . . . . 61 LEU HD2 . 10011 1 717 . 1 1 61 61 LEU C C 13 180.028 0.300 . 1 . . . . 61 LEU C . 10011 1 718 . 1 1 61 61 LEU CA C 13 57.107 0.300 . 1 . . . . 61 LEU CA . 10011 1 719 . 1 1 61 61 LEU CB C 13 41.502 0.300 . 1 . . . . 61 LEU CB . 10011 1 720 . 1 1 61 61 LEU CG C 13 26.844 0.300 . 1 . . . . 61 LEU CG . 10011 1 721 . 1 1 61 61 LEU CD1 C 13 25.830 0.300 . 1 . . . . 61 LEU CD1 . 10011 1 722 . 1 1 61 61 LEU CD2 C 13 22.696 0.300 . 1 . . . . 61 LEU CD2 . 10011 1 723 . 1 1 61 61 LEU N N 15 116.806 0.300 . 1 . . . . 61 LEU N . 10011 1 724 . 1 1 62 62 ASP H H 1 8.138 0.030 . 1 . . . . 62 ASP H . 10011 1 725 . 1 1 62 62 ASP HA H 1 4.355 0.030 . 1 . . . . 62 ASP HA . 10011 1 726 . 1 1 62 62 ASP HB2 H 1 2.759 0.030 . 2 . . . . 62 ASP HB2 . 10011 1 727 . 1 1 62 62 ASP HB3 H 1 2.553 0.030 . 2 . . . . 62 ASP HB3 . 10011 1 728 . 1 1 62 62 ASP C C 13 177.492 0.300 . 1 . . . . 62 ASP C . 10011 1 729 . 1 1 62 62 ASP CA C 13 56.079 0.300 . 1 . . . . 62 ASP CA . 10011 1 730 . 1 1 62 62 ASP CB C 13 41.122 0.300 . 1 . . . . 62 ASP CB . 10011 1 731 . 1 1 62 62 ASP N N 15 117.686 0.300 . 1 . . . . 62 ASP N . 10011 1 732 . 1 1 63 63 ASN H H 1 7.222 0.030 . 1 . . . . 63 ASN H . 10011 1 733 . 1 1 63 63 ASN HA H 1 4.700 0.030 . 1 . . . . 63 ASN HA . 10011 1 734 . 1 1 63 63 ASN HB2 H 1 2.914 0.030 . 2 . . . . 63 ASN HB2 . 10011 1 735 . 1 1 63 63 ASN HB3 H 1 2.649 0.030 . 2 . . . . 63 ASN HB3 . 10011 1 736 . 1 1 63 63 ASN HD21 H 1 7.814 0.030 . 2 . . . . 63 ASN HD21 . 10011 1 737 . 1 1 63 63 ASN HD22 H 1 6.683 0.030 . 2 . . . . 63 ASN HD22 . 10011 1 738 . 1 1 63 63 ASN C C 13 171.420 0.300 . 1 . . . . 63 ASN C . 10011 1 739 . 1 1 63 63 ASN CA C 13 51.713 0.300 . 1 . . . . 63 ASN CA . 10011 1 740 . 1 1 63 63 ASN CB C 13 38.302 0.300 . 1 . . . . 63 ASN CB . 10011 1 741 . 1 1 63 63 ASN N N 15 113.126 0.300 . 1 . . . . 63 ASN N . 10011 1 742 . 1 1 63 63 ASN ND2 N 15 111.479 0.300 . 1 . . . . 63 ASN ND2 . 10011 1 743 . 1 1 64 64 PRO HA H 1 2.856 0.030 . 1 . . . . 64 PRO HA . 10011 1 744 . 1 1 64 64 PRO HB2 H 1 1.424 0.030 . 2 . . . . 64 PRO HB2 . 10011 1 745 . 1 1 64 64 PRO HB3 H 1 0.764 0.030 . 2 . . . . 64 PRO HB3 . 10011 1 746 . 1 1 64 64 PRO HG2 H 1 1.642 0.030 . 2 . . . . 64 PRO HG2 . 10011 1 747 . 1 1 64 64 PRO HG3 H 1 1.393 0.030 . 2 . . . . 64 PRO HG3 . 10011 1 748 . 1 1 64 64 PRO HD2 H 1 3.320 0.030 . 2 . . . . 64 PRO HD2 . 10011 1 749 . 1 1 64 64 PRO HD3 H 1 3.267 0.030 . 2 . . . . 64 PRO HD3 . 10011 1 750 . 1 1 64 64 PRO C C 13 175.389 0.300 . 1 . . . . 64 PRO C . 10011 1 751 . 1 1 64 64 PRO CA C 13 63.224 0.300 . 1 . . . . 64 PRO CA . 10011 1 752 . 1 1 64 64 PRO CB C 13 30.123 0.300 . 1 . . . . 64 PRO CB . 10011 1 753 . 1 1 64 64 PRO CG C 13 26.444 0.300 . 1 . . . . 64 PRO CG . 10011 1 754 . 1 1 64 64 PRO CD C 13 48.581 0.300 . 1 . . . . 64 PRO CD . 10011 1 755 . 1 1 65 65 LYS H H 1 7.077 0.030 . 1 . . . . 65 LYS H . 10011 1 756 . 1 1 65 65 LYS HA H 1 4.356 0.030 . 1 . . . . 65 LYS HA . 10011 1 757 . 1 1 65 65 LYS HB2 H 1 1.959 0.030 . 2 . . . . 65 LYS HB2 . 10011 1 758 . 1 1 65 65 LYS HB3 H 1 1.732 0.030 . 2 . . . . 65 LYS HB3 . 10011 1 759 . 1 1 65 65 LYS HG2 H 1 1.339 0.030 . 2 . . . . 65 LYS HG2 . 10011 1 760 . 1 1 65 65 LYS HG3 H 1 1.270 0.030 . 2 . . . . 65 LYS HG3 . 10011 1 761 . 1 1 65 65 LYS HD2 H 1 1.624 0.030 . 1 . . . . 65 LYS HD2 . 10011 1 762 . 1 1 65 65 LYS HD3 H 1 1.624 0.030 . 1 . . . . 65 LYS HD3 . 10011 1 763 . 1 1 65 65 LYS HE2 H 1 2.955 0.030 . 1 . . . . 65 LYS HE2 . 10011 1 764 . 1 1 65 65 LYS HE3 H 1 2.955 0.030 . 1 . . . . 65 LYS HE3 . 10011 1 765 . 1 1 65 65 LYS C C 13 176.460 0.300 . 1 . . . . 65 LYS C . 10011 1 766 . 1 1 65 65 LYS CA C 13 55.724 0.300 . 1 . . . . 65 LYS CA . 10011 1 767 . 1 1 65 65 LYS CB C 13 32.533 0.300 . 1 . . . . 65 LYS CB . 10011 1 768 . 1 1 65 65 LYS CG C 13 25.097 0.300 . 1 . . . . 65 LYS CG . 10011 1 769 . 1 1 65 65 LYS CD C 13 28.611 0.300 . 1 . . . . 65 LYS CD . 10011 1 770 . 1 1 65 65 LYS CE C 13 42.094 0.300 . 1 . . . . 65 LYS CE . 10011 1 771 . 1 1 65 65 LYS N N 15 114.557 0.300 . 1 . . . . 65 LYS N . 10011 1 772 . 1 1 66 66 ILE H H 1 7.315 0.030 . 1 . . . . 66 ILE H . 10011 1 773 . 1 1 66 66 ILE HA H 1 4.653 0.030 . 1 . . . . 66 ILE HA . 10011 1 774 . 1 1 66 66 ILE HB H 1 1.808 0.030 . 1 . . . . 66 ILE HB . 10011 1 775 . 1 1 66 66 ILE HG12 H 1 1.424 0.030 . 2 . . . . 66 ILE HG12 . 10011 1 776 . 1 1 66 66 ILE HG13 H 1 1.100 0.030 . 2 . . . . 66 ILE HG13 . 10011 1 777 . 1 1 66 66 ILE HG21 H 1 0.909 0.030 . 1 . . . . 66 ILE HG2 . 10011 1 778 . 1 1 66 66 ILE HG22 H 1 0.909 0.030 . 1 . . . . 66 ILE HG2 . 10011 1 779 . 1 1 66 66 ILE HG23 H 1 0.909 0.030 . 1 . . . . 66 ILE HG2 . 10011 1 780 . 1 1 66 66 ILE HD11 H 1 0.855 0.030 . 1 . . . . 66 ILE HD1 . 10011 1 781 . 1 1 66 66 ILE HD12 H 1 0.855 0.030 . 1 . . . . 66 ILE HD1 . 10011 1 782 . 1 1 66 66 ILE HD13 H 1 0.855 0.030 . 1 . . . . 66 ILE HD1 . 10011 1 783 . 1 1 66 66 ILE C C 13 173.311 0.300 . 1 . . . . 66 ILE C . 10011 1 784 . 1 1 66 66 ILE CA C 13 58.856 0.300 . 1 . . . . 66 ILE CA . 10011 1 785 . 1 1 66 66 ILE CB C 13 41.837 0.300 . 1 . . . . 66 ILE CB . 10011 1 786 . 1 1 66 66 ILE CG1 C 13 26.526 0.300 . 1 . . . . 66 ILE CG1 . 10011 1 787 . 1 1 66 66 ILE CG2 C 13 17.246 0.300 . 1 . . . . 66 ILE CG2 . 10011 1 788 . 1 1 66 66 ILE CD1 C 13 13.235 0.300 . 1 . . . . 66 ILE CD1 . 10011 1 789 . 1 1 66 66 ILE N N 15 117.320 0.300 . 1 . . . . 66 ILE N . 10011 1 790 . 1 1 67 67 GLN H H 1 8.381 0.030 . 1 . . . . 67 GLN H . 10011 1 791 . 1 1 67 67 GLN HA H 1 3.877 0.030 . 1 . . . . 67 GLN HA . 10011 1 792 . 1 1 67 67 GLN HB2 H 1 2.108 0.030 . 2 . . . . 67 GLN HB2 . 10011 1 793 . 1 1 67 67 GLN HB3 H 1 2.042 0.030 . 2 . . . . 67 GLN HB3 . 10011 1 794 . 1 1 67 67 GLN HG2 H 1 2.158 0.030 . 2 . . . . 67 GLN HG2 . 10011 1 795 . 1 1 67 67 GLN HG3 H 1 1.966 0.030 . 2 . . . . 67 GLN HG3 . 10011 1 796 . 1 1 67 67 GLN HE21 H 1 7.902 0.030 . 2 . . . . 67 GLN HE21 . 10011 1 797 . 1 1 67 67 GLN HE22 H 1 6.871 0.030 . 2 . . . . 67 GLN HE22 . 10011 1 798 . 1 1 67 67 GLN C C 13 175.257 0.300 . 1 . . . . 67 GLN C . 10011 1 799 . 1 1 67 67 GLN CA C 13 56.671 0.300 . 1 . . . . 67 GLN CA . 10011 1 800 . 1 1 67 67 GLN CB C 13 29.399 0.300 . 1 . . . . 67 GLN CB . 10011 1 801 . 1 1 67 67 GLN CG C 13 32.838 0.300 . 1 . . . . 67 GLN CG . 10011 1 802 . 1 1 67 67 GLN N N 15 123.285 0.300 . 1 . . . . 67 GLN N . 10011 1 803 . 1 1 67 67 GLN NE2 N 15 111.848 0.300 . 1 . . . . 67 GLN NE2 . 10011 1 804 . 1 1 68 68 LEU H H 1 10.349 0.030 . 1 . . . . 68 LEU H . 10011 1 805 . 1 1 68 68 LEU HA H 1 4.822 0.030 . 1 . . . . 68 LEU HA . 10011 1 806 . 1 1 68 68 LEU HB2 H 1 2.142 0.030 . 2 . . . . 68 LEU HB2 . 10011 1 807 . 1 1 68 68 LEU HB3 H 1 2.055 0.030 . 2 . . . . 68 LEU HB3 . 10011 1 808 . 1 1 68 68 LEU HG H 1 1.401 0.030 . 1 . . . . 68 LEU HG . 10011 1 809 . 1 1 68 68 LEU HD11 H 1 0.991 0.030 . 1 . . . . 68 LEU HD1 . 10011 1 810 . 1 1 68 68 LEU HD12 H 1 0.991 0.030 . 1 . . . . 68 LEU HD1 . 10011 1 811 . 1 1 68 68 LEU HD13 H 1 0.991 0.030 . 1 . . . . 68 LEU HD1 . 10011 1 812 . 1 1 68 68 LEU HD21 H 1 1.162 0.030 . 1 . . . . 68 LEU HD2 . 10011 1 813 . 1 1 68 68 LEU HD22 H 1 1.162 0.030 . 1 . . . . 68 LEU HD2 . 10011 1 814 . 1 1 68 68 LEU HD23 H 1 1.162 0.030 . 1 . . . . 68 LEU HD2 . 10011 1 815 . 1 1 68 68 LEU C C 13 177.896 0.300 . 1 . . . . 68 LEU C . 10011 1 816 . 1 1 68 68 LEU CA C 13 53.891 0.300 . 1 . . . . 68 LEU CA . 10011 1 817 . 1 1 68 68 LEU CB C 13 41.457 0.300 . 1 . . . . 68 LEU CB . 10011 1 818 . 1 1 68 68 LEU CG C 13 28.131 0.300 . 1 . . . . 68 LEU CG . 10011 1 819 . 1 1 68 68 LEU CD1 C 13 23.059 0.300 . 1 . . . . 68 LEU CD1 . 10011 1 820 . 1 1 68 68 LEU CD2 C 13 29.524 0.300 . 1 . . . . 68 LEU CD2 . 10011 1 821 . 1 1 68 68 LEU N N 15 132.001 0.300 . 1 . . . . 68 LEU N . 10011 1 822 . 1 1 69 69 THR H H 1 8.418 0.030 . 1 . . . . 69 THR H . 10011 1 823 . 1 1 69 69 THR HA H 1 4.654 0.030 . 1 . . . . 69 THR HA . 10011 1 824 . 1 1 69 69 THR HB H 1 4.779 0.030 . 1 . . . . 69 THR HB . 10011 1 825 . 1 1 69 69 THR HG1 H 1 5.730 0.030 . 1 . . . . 69 THR HG1 . 10011 1 826 . 1 1 69 69 THR HG21 H 1 1.281 0.030 . 1 . . . . 69 THR HG2 . 10011 1 827 . 1 1 69 69 THR HG22 H 1 1.281 0.030 . 1 . . . . 69 THR HG2 . 10011 1 828 . 1 1 69 69 THR HG23 H 1 1.281 0.030 . 1 . . . . 69 THR HG2 . 10011 1 829 . 1 1 69 69 THR C C 13 176.117 0.300 . 1 . . . . 69 THR C . 10011 1 830 . 1 1 69 69 THR CA C 13 60.922 0.300 . 1 . . . . 69 THR CA . 10011 1 831 . 1 1 69 69 THR CB C 13 71.302 0.300 . 1 . . . . 69 THR CB . 10011 1 832 . 1 1 69 69 THR CG2 C 13 22.060 0.300 . 1 . . . . 69 THR CG2 . 10011 1 833 . 1 1 69 69 THR N N 15 121.163 0.300 . 1 . . . . 69 THR N . 10011 1 834 . 1 1 70 70 PHE H H 1 9.211 0.030 . 1 . . . . 70 PHE H . 10011 1 835 . 1 1 70 70 PHE HA H 1 3.411 0.030 . 1 . . . . 70 PHE HA . 10011 1 836 . 1 1 70 70 PHE HB2 H 1 2.779 0.030 . 2 . . . . 70 PHE HB2 . 10011 1 837 . 1 1 70 70 PHE HB3 H 1 2.570 0.030 . 2 . . . . 70 PHE HB3 . 10011 1 838 . 1 1 70 70 PHE HD1 H 1 6.872 0.030 . 1 . . . . 70 PHE HD1 . 10011 1 839 . 1 1 70 70 PHE HD2 H 1 6.872 0.030 . 1 . . . . 70 PHE HD2 . 10011 1 840 . 1 1 70 70 PHE HE1 H 1 7.245 0.030 . 1 . . . . 70 PHE HE1 . 10011 1 841 . 1 1 70 70 PHE HE2 H 1 7.245 0.030 . 1 . . . . 70 PHE HE2 . 10011 1 842 . 1 1 70 70 PHE C C 13 175.985 0.300 . 1 . . . . 70 PHE C . 10011 1 843 . 1 1 70 70 PHE CA C 13 60.071 0.300 . 1 . . . . 70 PHE CA . 10011 1 844 . 1 1 70 70 PHE CB C 13 38.514 0.300 . 1 . . . . 70 PHE CB . 10011 1 845 . 1 1 70 70 PHE CD1 C 13 131.350 0.300 . 1 . . . . 70 PHE CD1 . 10011 1 846 . 1 1 70 70 PHE CD2 C 13 131.350 0.300 . 1 . . . . 70 PHE CD2 . 10011 1 847 . 1 1 70 70 PHE CE1 C 13 130.785 0.300 . 1 . . . . 70 PHE CE1 . 10011 1 848 . 1 1 70 70 PHE CE2 C 13 130.785 0.300 . 1 . . . . 70 PHE CE2 . 10011 1 849 . 1 1 70 70 PHE N N 15 125.865 0.300 . 1 . . . . 70 PHE N . 10011 1 850 . 1 1 71 71 GLU H H 1 9.208 0.030 . 1 . . . . 71 GLU H . 10011 1 851 . 1 1 71 71 GLU HA H 1 3.189 0.030 . 1 . . . . 71 GLU HA . 10011 1 852 . 1 1 71 71 GLU HB2 H 1 1.938 0.030 . 2 . . . . 71 GLU HB2 . 10011 1 853 . 1 1 71 71 GLU HB3 H 1 1.752 0.030 . 2 . . . . 71 GLU HB3 . 10011 1 854 . 1 1 71 71 GLU HG2 H 1 2.439 0.030 . 2 . . . . 71 GLU HG2 . 10011 1 855 . 1 1 71 71 GLU HG3 H 1 2.119 0.030 . 2 . . . . 71 GLU HG3 . 10011 1 856 . 1 1 71 71 GLU C C 13 178.866 0.300 . 1 . . . . 71 GLU C . 10011 1 857 . 1 1 71 71 GLU CA C 13 61.098 0.300 . 1 . . . . 71 GLU CA . 10011 1 858 . 1 1 71 71 GLU CB C 13 28.348 0.300 . 1 . . . . 71 GLU CB . 10011 1 859 . 1 1 71 71 GLU CG C 13 37.541 0.300 . 1 . . . . 71 GLU CG . 10011 1 860 . 1 1 71 71 GLU N N 15 119.181 0.300 . 1 . . . . 71 GLU N . 10011 1 861 . 1 1 72 72 ALA H H 1 7.898 0.030 . 1 . . . . 72 ALA H . 10011 1 862 . 1 1 72 72 ALA HA H 1 4.006 0.030 . 1 . . . . 72 ALA HA . 10011 1 863 . 1 1 72 72 ALA HB1 H 1 1.411 0.030 . 1 . . . . 72 ALA HB . 10011 1 864 . 1 1 72 72 ALA HB2 H 1 1.411 0.030 . 1 . . . . 72 ALA HB . 10011 1 865 . 1 1 72 72 ALA HB3 H 1 1.411 0.030 . 1 . . . . 72 ALA HB . 10011 1 866 . 1 1 72 72 ALA C C 13 180.382 0.300 . 1 . . . . 72 ALA C . 10011 1 867 . 1 1 72 72 ALA CA C 13 54.640 0.300 . 1 . . . . 72 ALA CA . 10011 1 868 . 1 1 72 72 ALA CB C 13 18.998 0.300 . 1 . . . . 72 ALA CB . 10011 1 869 . 1 1 72 72 ALA N N 15 121.264 0.300 . 1 . . . . 72 ALA N . 10011 1 870 . 1 1 73 73 THR H H 1 7.558 0.030 . 1 . . . . 73 THR H . 10011 1 871 . 1 1 73 73 THR HA H 1 3.553 0.030 . 1 . . . . 73 THR HA . 10011 1 872 . 1 1 73 73 THR HB H 1 4.193 0.030 . 1 . . . . 73 THR HB . 10011 1 873 . 1 1 73 73 THR HG1 H 1 3.768 0.030 . 1 . . . . 73 THR HG1 . 10011 1 874 . 1 1 73 73 THR HG21 H 1 1.110 0.030 . 1 . . . . 73 THR HG2 . 10011 1 875 . 1 1 73 73 THR HG22 H 1 1.110 0.030 . 1 . . . . 73 THR HG2 . 10011 1 876 . 1 1 73 73 THR HG23 H 1 1.110 0.030 . 1 . . . . 73 THR HG2 . 10011 1 877 . 1 1 73 73 THR C C 13 178.167 0.300 . 1 . . . . 73 THR C . 10011 1 878 . 1 1 73 73 THR CA C 13 67.762 0.300 . 1 . . . . 73 THR CA . 10011 1 879 . 1 1 73 73 THR CB C 13 68.230 0.300 . 1 . . . . 73 THR CB . 10011 1 880 . 1 1 73 73 THR CG2 C 13 21.335 0.300 . 1 . . . . 73 THR CG2 . 10011 1 881 . 1 1 73 73 THR N N 15 116.877 0.300 . 1 . . . . 73 THR N . 10011 1 882 . 1 1 74 74 LEU H H 1 7.912 0.030 . 1 . . . . 74 LEU H . 10011 1 883 . 1 1 74 74 LEU HA H 1 3.744 0.030 . 1 . . . . 74 LEU HA . 10011 1 884 . 1 1 74 74 LEU HB2 H 1 1.430 0.030 . 2 . . . . 74 LEU HB2 . 10011 1 885 . 1 1 74 74 LEU HB3 H 1 1.001 0.030 . 2 . . . . 74 LEU HB3 . 10011 1 886 . 1 1 74 74 LEU HG H 1 1.412 0.030 . 1 . . . . 74 LEU HG . 10011 1 887 . 1 1 74 74 LEU HD11 H 1 0.830 0.030 . 1 . . . . 74 LEU HD1 . 10011 1 888 . 1 1 74 74 LEU HD12 H 1 0.830 0.030 . 1 . . . . 74 LEU HD1 . 10011 1 889 . 1 1 74 74 LEU HD13 H 1 0.830 0.030 . 1 . . . . 74 LEU HD1 . 10011 1 890 . 1 1 74 74 LEU HD21 H 1 0.829 0.030 . 1 . . . . 74 LEU HD2 . 10011 1 891 . 1 1 74 74 LEU HD22 H 1 0.829 0.030 . 1 . . . . 74 LEU HD2 . 10011 1 892 . 1 1 74 74 LEU HD23 H 1 0.829 0.030 . 1 . . . . 74 LEU HD2 . 10011 1 893 . 1 1 74 74 LEU C C 13 179.290 0.300 . 1 . . . . 74 LEU C . 10011 1 894 . 1 1 74 74 LEU CA C 13 57.928 0.300 . 1 . . . . 74 LEU CA . 10011 1 895 . 1 1 74 74 LEU CB C 13 41.846 0.300 . 1 . . . . 74 LEU CB . 10011 1 896 . 1 1 74 74 LEU CG C 13 26.463 0.300 . 1 . . . . 74 LEU CG . 10011 1 897 . 1 1 74 74 LEU CD1 C 13 24.445 0.300 . 1 . . . . 74 LEU CD1 . 10011 1 898 . 1 1 74 74 LEU CD2 C 13 25.108 0.300 . 1 . . . . 74 LEU CD2 . 10011 1 899 . 1 1 74 74 LEU N N 15 119.371 0.300 . 1 . . . . 74 LEU N . 10011 1 900 . 1 1 75 75 GLN H H 1 7.435 0.030 . 1 . . . . 75 GLN H . 10011 1 901 . 1 1 75 75 GLN HA H 1 3.985 0.030 . 1 . . . . 75 GLN HA . 10011 1 902 . 1 1 75 75 GLN HB2 H 1 2.088 0.030 . 1 . . . . 75 GLN HB2 . 10011 1 903 . 1 1 75 75 GLN HB3 H 1 2.088 0.030 . 1 . . . . 75 GLN HB3 . 10011 1 904 . 1 1 75 75 GLN HG2 H 1 2.458 0.030 . 2 . . . . 75 GLN HG2 . 10011 1 905 . 1 1 75 75 GLN HG3 H 1 2.396 0.030 . 2 . . . . 75 GLN HG3 . 10011 1 906 . 1 1 75 75 GLN HE21 H 1 7.381 0.030 . 2 . . . . 75 GLN HE21 . 10011 1 907 . 1 1 75 75 GLN HE22 H 1 6.733 0.030 . 2 . . . . 75 GLN HE22 . 10011 1 908 . 1 1 75 75 GLN C C 13 176.986 0.300 . 1 . . . . 75 GLN C . 10011 1 909 . 1 1 75 75 GLN CA C 13 57.714 0.300 . 1 . . . . 75 GLN CA . 10011 1 910 . 1 1 75 75 GLN CB C 13 28.882 0.300 . 1 . . . . 75 GLN CB . 10011 1 911 . 1 1 75 75 GLN CG C 13 33.893 0.300 . 1 . . . . 75 GLN CG . 10011 1 912 . 1 1 75 75 GLN N N 15 113.811 0.300 . 1 . . . . 75 GLN N . 10011 1 913 . 1 1 75 75 GLN NE2 N 15 111.477 0.300 . 1 . . . . 75 GLN NE2 . 10011 1 914 . 1 1 76 76 GLN H H 1 7.330 0.030 . 1 . . . . 76 GLN H . 10011 1 915 . 1 1 76 76 GLN HA H 1 4.363 0.030 . 1 . . . . 76 GLN HA . 10011 1 916 . 1 1 76 76 GLN HB2 H 1 2.405 0.030 . 2 . . . . 76 GLN HB2 . 10011 1 917 . 1 1 76 76 GLN HB3 H 1 1.899 0.030 . 2 . . . . 76 GLN HB3 . 10011 1 918 . 1 1 76 76 GLN HG2 H 1 2.500 0.030 . 2 . . . . 76 GLN HG2 . 10011 1 919 . 1 1 76 76 GLN HG3 H 1 2.234 0.030 . 2 . . . . 76 GLN HG3 . 10011 1 920 . 1 1 76 76 GLN HE21 H 1 7.262 0.030 . 2 . . . . 76 GLN HE21 . 10011 1 921 . 1 1 76 76 GLN HE22 H 1 7.009 0.030 . 2 . . . . 76 GLN HE22 . 10011 1 922 . 1 1 76 76 GLN C C 13 175.014 0.300 . 1 . . . . 76 GLN C . 10011 1 923 . 1 1 76 76 GLN CA C 13 55.609 0.300 . 1 . . . . 76 GLN CA . 10011 1 924 . 1 1 76 76 GLN CB C 13 30.806 0.300 . 1 . . . . 76 GLN CB . 10011 1 925 . 1 1 76 76 GLN CG C 13 35.011 0.300 . 1 . . . . 76 GLN CG . 10011 1 926 . 1 1 76 76 GLN N N 15 115.600 0.300 . 1 . . . . 76 GLN N . 10011 1 927 . 1 1 76 76 GLN NE2 N 15 111.355 0.300 . 1 . . . . 76 GLN NE2 . 10011 1 928 . 1 1 77 77 LEU H H 1 7.324 0.030 . 1 . . . . 77 LEU H . 10011 1 929 . 1 1 77 77 LEU HA H 1 4.528 0.030 . 1 . . . . 77 LEU HA . 10011 1 930 . 1 1 77 77 LEU HB2 H 1 1.811 0.030 . 2 . . . . 77 LEU HB2 . 10011 1 931 . 1 1 77 77 LEU HB3 H 1 1.350 0.030 . 2 . . . . 77 LEU HB3 . 10011 1 932 . 1 1 77 77 LEU HG H 1 1.932 0.030 . 1 . . . . 77 LEU HG . 10011 1 933 . 1 1 77 77 LEU HD11 H 1 0.922 0.030 . 1 . . . . 77 LEU HD1 . 10011 1 934 . 1 1 77 77 LEU HD12 H 1 0.922 0.030 . 1 . . . . 77 LEU HD1 . 10011 1 935 . 1 1 77 77 LEU HD13 H 1 0.922 0.030 . 1 . . . . 77 LEU HD1 . 10011 1 936 . 1 1 77 77 LEU HD21 H 1 0.913 0.030 . 1 . . . . 77 LEU HD2 . 10011 1 937 . 1 1 77 77 LEU HD22 H 1 0.913 0.030 . 1 . . . . 77 LEU HD2 . 10011 1 938 . 1 1 77 77 LEU HD23 H 1 0.913 0.030 . 1 . . . . 77 LEU HD2 . 10011 1 939 . 1 1 77 77 LEU C C 13 175.125 0.300 . 1 . . . . 77 LEU C . 10011 1 940 . 1 1 77 77 LEU CA C 13 54.332 0.300 . 1 . . . . 77 LEU CA . 10011 1 941 . 1 1 77 77 LEU CB C 13 44.412 0.300 . 1 . . . . 77 LEU CB . 10011 1 942 . 1 1 77 77 LEU CG C 13 26.366 0.300 . 1 . . . . 77 LEU CG . 10011 1 943 . 1 1 77 77 LEU CD1 C 13 27.862 0.300 . 1 . . . . 77 LEU CD1 . 10011 1 944 . 1 1 77 77 LEU CD2 C 13 25.147 0.300 . 1 . . . . 77 LEU CD2 . 10011 1 945 . 1 1 77 77 LEU N N 15 122.126 0.300 . 1 . . . . 77 LEU N . 10011 1 946 . 1 1 78 78 GLU H H 1 9.126 0.030 . 1 . . . . 78 GLU H . 10011 1 947 . 1 1 78 78 GLU HA H 1 4.319 0.030 . 1 . . . . 78 GLU HA . 10011 1 948 . 1 1 78 78 GLU HB2 H 1 2.178 0.030 . 2 . . . . 78 GLU HB2 . 10011 1 949 . 1 1 78 78 GLU HB3 H 1 2.125 0.030 . 2 . . . . 78 GLU HB3 . 10011 1 950 . 1 1 78 78 GLU HG2 H 1 2.456 0.030 . 2 . . . . 78 GLU HG2 . 10011 1 951 . 1 1 78 78 GLU HG3 H 1 2.381 0.030 . 2 . . . . 78 GLU HG3 . 10011 1 952 . 1 1 78 78 GLU C C 13 176.035 0.300 . 1 . . . . 78 GLU C . 10011 1 953 . 1 1 78 78 GLU CA C 13 55.419 0.300 . 1 . . . . 78 GLU CA . 10011 1 954 . 1 1 78 78 GLU CB C 13 31.216 0.300 . 1 . . . . 78 GLU CB . 10011 1 955 . 1 1 78 78 GLU CG C 13 36.653 0.300 . 1 . . . . 78 GLU CG . 10011 1 956 . 1 1 78 78 GLU N N 15 122.965 0.300 . 1 . . . . 78 GLU N . 10011 1 957 . 1 1 79 79 ALA H H 1 8.481 0.030 . 1 . . . . 79 ALA H . 10011 1 958 . 1 1 79 79 ALA HA H 1 4.213 0.030 . 1 . . . . 79 ALA HA . 10011 1 959 . 1 1 79 79 ALA HB1 H 1 1.307 0.030 . 1 . . . . 79 ALA HB . 10011 1 960 . 1 1 79 79 ALA HB2 H 1 1.307 0.030 . 1 . . . . 79 ALA HB . 10011 1 961 . 1 1 79 79 ALA HB3 H 1 1.307 0.030 . 1 . . . . 79 ALA HB . 10011 1 962 . 1 1 79 79 ALA C C 13 176.894 0.300 . 1 . . . . 79 ALA C . 10011 1 963 . 1 1 79 79 ALA CA C 13 51.587 0.300 . 1 . . . . 79 ALA CA . 10011 1 964 . 1 1 79 79 ALA CB C 13 17.298 0.300 . 1 . . . . 79 ALA CB . 10011 1 965 . 1 1 79 79 ALA N N 15 124.312 0.300 . 1 . . . . 79 ALA N . 10011 1 966 . 1 1 80 80 PRO HA H 1 4.534 0.030 . 1 . . . . 80 PRO HA . 10011 1 967 . 1 1 80 80 PRO HB2 H 1 2.131 0.030 . 2 . . . . 80 PRO HB2 . 10011 1 968 . 1 1 80 80 PRO HB3 H 1 2.005 0.030 . 2 . . . . 80 PRO HB3 . 10011 1 969 . 1 1 80 80 PRO HG2 H 1 1.601 0.030 . 2 . . . . 80 PRO HG2 . 10011 1 970 . 1 1 80 80 PRO HG3 H 1 0.574 0.030 . 2 . . . . 80 PRO HG3 . 10011 1 971 . 1 1 80 80 PRO HD2 H 1 3.130 0.030 . 2 . . . . 80 PRO HD2 . 10011 1 972 . 1 1 80 80 PRO HD3 H 1 2.657 0.030 . 2 . . . . 80 PRO HD3 . 10011 1 973 . 1 1 80 80 PRO C C 13 176.673 0.300 . 1 . . . . 80 PRO C . 10011 1 974 . 1 1 80 80 PRO CA C 13 63.711 0.300 . 1 . . . . 80 PRO CA . 10011 1 975 . 1 1 80 80 PRO CB C 13 33.660 0.300 . 1 . . . . 80 PRO CB . 10011 1 976 . 1 1 80 80 PRO CG C 13 23.441 0.300 . 1 . . . . 80 PRO CG . 10011 1 977 . 1 1 80 80 PRO CD C 13 49.532 0.300 . 1 . . . . 80 PRO CD . 10011 1 978 . 1 1 81 81 TYR H H 1 8.037 0.030 . 1 . . . . 81 TYR H . 10011 1 979 . 1 1 81 81 TYR HA H 1 4.086 0.030 . 1 . . . . 81 TYR HA . 10011 1 980 . 1 1 81 81 TYR HB2 H 1 3.156 0.030 . 2 . . . . 81 TYR HB2 . 10011 1 981 . 1 1 81 81 TYR HB3 H 1 3.007 0.030 . 2 . . . . 81 TYR HB3 . 10011 1 982 . 1 1 81 81 TYR HD1 H 1 6.846 0.030 . 1 . . . . 81 TYR HD1 . 10011 1 983 . 1 1 81 81 TYR HD2 H 1 6.846 0.030 . 1 . . . . 81 TYR HD2 . 10011 1 984 . 1 1 81 81 TYR HE1 H 1 6.345 0.030 . 1 . . . . 81 TYR HE1 . 10011 1 985 . 1 1 81 81 TYR HE2 H 1 6.345 0.030 . 1 . . . . 81 TYR HE2 . 10011 1 986 . 1 1 81 81 TYR C C 13 174.408 0.300 . 1 . . . . 81 TYR C . 10011 1 987 . 1 1 81 81 TYR CA C 13 60.736 0.300 . 1 . . . . 81 TYR CA . 10011 1 988 . 1 1 81 81 TYR CB C 13 37.430 0.300 . 1 . . . . 81 TYR CB . 10011 1 989 . 1 1 81 81 TYR CD1 C 13 132.382 0.300 . 1 . . . . 81 TYR CD1 . 10011 1 990 . 1 1 81 81 TYR CD2 C 13 132.382 0.300 . 1 . . . . 81 TYR CD2 . 10011 1 991 . 1 1 81 81 TYR CE1 C 13 118.147 0.300 . 1 . . . . 81 TYR CE1 . 10011 1 992 . 1 1 81 81 TYR CE2 C 13 118.147 0.300 . 1 . . . . 81 TYR CE2 . 10011 1 993 . 1 1 81 81 TYR N N 15 127.096 0.300 . 1 . . . . 81 TYR N . 10011 1 994 . 1 1 82 82 ASN H H 1 7.646 0.030 . 1 . . . . 82 ASN H . 10011 1 995 . 1 1 82 82 ASN HA H 1 4.220 0.030 . 1 . . . . 82 ASN HA . 10011 1 996 . 1 1 82 82 ASN HB2 H 1 3.072 0.030 . 2 . . . . 82 ASN HB2 . 10011 1 997 . 1 1 82 82 ASN HB3 H 1 2.627 0.030 . 2 . . . . 82 ASN HB3 . 10011 1 998 . 1 1 82 82 ASN HD21 H 1 7.673 0.030 . 2 . . . . 82 ASN HD21 . 10011 1 999 . 1 1 82 82 ASN HD22 H 1 6.726 0.030 . 2 . . . . 82 ASN HD22 . 10011 1 1000 . 1 1 82 82 ASN C C 13 175.803 0.300 . 1 . . . . 82 ASN C . 10011 1 1001 . 1 1 82 82 ASN CA C 13 51.939 0.300 . 1 . . . . 82 ASN CA . 10011 1 1002 . 1 1 82 82 ASN CB C 13 37.308 0.300 . 1 . . . . 82 ASN CB . 10011 1 1003 . 1 1 82 82 ASN N N 15 112.924 0.300 . 1 . . . . 82 ASN N . 10011 1 1004 . 1 1 82 82 ASN ND2 N 15 110.764 0.300 . 1 . . . . 82 ASN ND2 . 10011 1 1005 . 1 1 83 83 SER H H 1 7.472 0.030 . 1 . . . . 83 SER H . 10011 1 1006 . 1 1 83 83 SER HA H 1 4.087 0.030 . 1 . . . . 83 SER HA . 10011 1 1007 . 1 1 83 83 SER HB2 H 1 3.917 0.030 . 1 . . . . 83 SER HB2 . 10011 1 1008 . 1 1 83 83 SER HB3 H 1 3.917 0.030 . 1 . . . . 83 SER HB3 . 10011 1 1009 . 1 1 83 83 SER C C 13 174.519 0.300 . 1 . . . . 83 SER C . 10011 1 1010 . 1 1 83 83 SER CA C 13 61.165 0.300 . 1 . . . . 83 SER CA . 10011 1 1011 . 1 1 83 83 SER CB C 13 63.760 0.300 . 1 . . . . 83 SER CB . 10011 1 1012 . 1 1 83 83 SER N N 15 113.570 0.300 . 1 . . . . 83 SER N . 10011 1 1013 . 1 1 84 84 ASP H H 1 8.126 0.030 . 1 . . . . 84 ASP H . 10011 1 1014 . 1 1 84 84 ASP HA H 1 5.026 0.030 . 1 . . . . 84 ASP HA . 10011 1 1015 . 1 1 84 84 ASP HB2 H 1 3.106 0.030 . 2 . . . . 84 ASP HB2 . 10011 1 1016 . 1 1 84 84 ASP HB3 H 1 2.477 0.030 . 2 . . . . 84 ASP HB3 . 10011 1 1017 . 1 1 84 84 ASP C C 13 176.864 0.300 . 1 . . . . 84 ASP C . 10011 1 1018 . 1 1 84 84 ASP CA C 13 51.950 0.300 . 1 . . . . 84 ASP CA . 10011 1 1019 . 1 1 84 84 ASP CB C 13 40.105 0.300 . 1 . . . . 84 ASP CB . 10011 1 1020 . 1 1 84 84 ASP N N 15 121.551 0.300 . 1 . . . . 84 ASP N . 10011 1 1021 . 1 1 85 85 THR H H 1 8.378 0.030 . 1 . . . . 85 THR H . 10011 1 1022 . 1 1 85 85 THR HA H 1 3.816 0.030 . 1 . . . . 85 THR HA . 10011 1 1023 . 1 1 85 85 THR HB H 1 4.453 0.030 . 1 . . . . 85 THR HB . 10011 1 1024 . 1 1 85 85 THR HG21 H 1 1.448 0.030 . 1 . . . . 85 THR HG2 . 10011 1 1025 . 1 1 85 85 THR HG22 H 1 1.448 0.030 . 1 . . . . 85 THR HG2 . 10011 1 1026 . 1 1 85 85 THR HG23 H 1 1.448 0.030 . 1 . . . . 85 THR HG2 . 10011 1 1027 . 1 1 85 85 THR C C 13 176.682 0.300 . 1 . . . . 85 THR C . 10011 1 1028 . 1 1 85 85 THR CA C 13 65.981 0.300 . 1 . . . . 85 THR CA . 10011 1 1029 . 1 1 85 85 THR CB C 13 68.224 0.300 . 1 . . . . 85 THR CB . 10011 1 1030 . 1 1 85 85 THR CG2 C 13 22.888 0.300 . 1 . . . . 85 THR CG2 . 10011 1 1031 . 1 1 85 85 THR N N 15 116.087 0.300 . 1 . . . . 85 THR N . 10011 1 1032 . 1 1 86 86 VAL H H 1 7.955 0.030 . 1 . . . . 86 VAL H . 10011 1 1033 . 1 1 86 86 VAL HA H 1 3.774 0.030 . 1 . . . . 86 VAL HA . 10011 1 1034 . 1 1 86 86 VAL HB H 1 2.265 0.030 . 1 . . . . 86 VAL HB . 10011 1 1035 . 1 1 86 86 VAL HG11 H 1 1.052 0.030 . 1 . . . . 86 VAL HG1 . 10011 1 1036 . 1 1 86 86 VAL HG12 H 1 1.052 0.030 . 1 . . . . 86 VAL HG1 . 10011 1 1037 . 1 1 86 86 VAL HG13 H 1 1.052 0.030 . 1 . . . . 86 VAL HG1 . 10011 1 1038 . 1 1 86 86 VAL HG21 H 1 0.962 0.030 . 1 . . . . 86 VAL HG2 . 10011 1 1039 . 1 1 86 86 VAL HG22 H 1 0.962 0.030 . 1 . . . . 86 VAL HG2 . 10011 1 1040 . 1 1 86 86 VAL HG23 H 1 0.962 0.030 . 1 . . . . 86 VAL HG2 . 10011 1 1041 . 1 1 86 86 VAL C C 13 178.462 0.300 . 1 . . . . 86 VAL C . 10011 1 1042 . 1 1 86 86 VAL CA C 13 66.259 0.300 . 1 . . . . 86 VAL CA . 10011 1 1043 . 1 1 86 86 VAL CB C 13 31.238 0.300 . 1 . . . . 86 VAL CB . 10011 1 1044 . 1 1 86 86 VAL CG1 C 13 22.692 0.300 . 2 . . . . 86 VAL CG1 . 10011 1 1045 . 1 1 86 86 VAL CG2 C 13 21.081 0.300 . 2 . . . . 86 VAL CG2 . 10011 1 1046 . 1 1 86 86 VAL N N 15 124.024 0.300 . 1 . . . . 86 VAL N . 10011 1 1047 . 1 1 87 87 LEU H H 1 7.770 0.030 . 1 . . . . 87 LEU H . 10011 1 1048 . 1 1 87 87 LEU HA H 1 4.232 0.030 . 1 . . . . 87 LEU HA . 10011 1 1049 . 1 1 87 87 LEU HB2 H 1 1.890 0.030 . 2 . . . . 87 LEU HB2 . 10011 1 1050 . 1 1 87 87 LEU HB3 H 1 1.653 0.030 . 2 . . . . 87 LEU HB3 . 10011 1 1051 . 1 1 87 87 LEU HG H 1 1.568 0.030 . 1 . . . . 87 LEU HG . 10011 1 1052 . 1 1 87 87 LEU HD11 H 1 1.147 0.030 . 1 . . . . 87 LEU HD1 . 10011 1 1053 . 1 1 87 87 LEU HD12 H 1 1.147 0.030 . 1 . . . . 87 LEU HD1 . 10011 1 1054 . 1 1 87 87 LEU HD13 H 1 1.147 0.030 . 1 . . . . 87 LEU HD1 . 10011 1 1055 . 1 1 87 87 LEU HD21 H 1 1.024 0.030 . 1 . . . . 87 LEU HD2 . 10011 1 1056 . 1 1 87 87 LEU HD22 H 1 1.024 0.030 . 1 . . . . 87 LEU HD2 . 10011 1 1057 . 1 1 87 87 LEU HD23 H 1 1.024 0.030 . 1 . . . . 87 LEU HD2 . 10011 1 1058 . 1 1 87 87 LEU C C 13 178.947 0.300 . 1 . . . . 87 LEU C . 10011 1 1059 . 1 1 87 87 LEU CA C 13 58.324 0.300 . 1 . . . . 87 LEU CA . 10011 1 1060 . 1 1 87 87 LEU CB C 13 40.810 0.300 . 1 . . . . 87 LEU CB . 10011 1 1061 . 1 1 87 87 LEU CG C 13 27.469 0.300 . 1 . . . . 87 LEU CG . 10011 1 1062 . 1 1 87 87 LEU CD1 C 13 22.984 0.300 . 1 . . . . 87 LEU CD1 . 10011 1 1063 . 1 1 87 87 LEU CD2 C 13 26.415 0.300 . 1 . . . . 87 LEU CD2 . 10011 1 1064 . 1 1 87 87 LEU N N 15 122.270 0.300 . 1 . . . . 87 LEU N . 10011 1 1065 . 1 1 88 88 VAL H H 1 7.880 0.030 . 1 . . . . 88 VAL H . 10011 1 1066 . 1 1 88 88 VAL HA H 1 3.564 0.030 . 1 . . . . 88 VAL HA . 10011 1 1067 . 1 1 88 88 VAL HB H 1 2.369 0.030 . 1 . . . . 88 VAL HB . 10011 1 1068 . 1 1 88 88 VAL HG11 H 1 0.982 0.030 . 1 . . . . 88 VAL HG1 . 10011 1 1069 . 1 1 88 88 VAL HG12 H 1 0.982 0.030 . 1 . . . . 88 VAL HG1 . 10011 1 1070 . 1 1 88 88 VAL HG13 H 1 0.982 0.030 . 1 . . . . 88 VAL HG1 . 10011 1 1071 . 1 1 88 88 VAL HG21 H 1 1.134 0.030 . 1 . . . . 88 VAL HG2 . 10011 1 1072 . 1 1 88 88 VAL HG22 H 1 1.134 0.030 . 1 . . . . 88 VAL HG2 . 10011 1 1073 . 1 1 88 88 VAL HG23 H 1 1.134 0.030 . 1 . . . . 88 VAL HG2 . 10011 1 1074 . 1 1 88 88 VAL C C 13 177.380 0.300 . 1 . . . . 88 VAL C . 10011 1 1075 . 1 1 88 88 VAL CA C 13 67.528 0.300 . 1 . . . . 88 VAL CA . 10011 1 1076 . 1 1 88 88 VAL CB C 13 31.395 0.300 . 1 . . . . 88 VAL CB . 10011 1 1077 . 1 1 88 88 VAL CG1 C 13 21.745 0.300 . 1 . . . . 88 VAL CG1 . 10011 1 1078 . 1 1 88 88 VAL CG2 C 13 22.896 0.300 . 1 . . . . 88 VAL CG2 . 10011 1 1079 . 1 1 88 88 VAL N N 15 115.800 0.300 . 1 . . . . 88 VAL N . 10011 1 1080 . 1 1 89 89 HIS H H 1 8.413 0.030 . 1 . . . . 89 HIS H . 10011 1 1081 . 1 1 89 89 HIS HA H 1 3.932 0.030 . 1 . . . . 89 HIS HA . 10011 1 1082 . 1 1 89 89 HIS HB2 H 1 3.214 0.030 . 2 . . . . 89 HIS HB2 . 10011 1 1083 . 1 1 89 89 HIS HB3 H 1 2.725 0.030 . 2 . . . . 89 HIS HB3 . 10011 1 1084 . 1 1 89 89 HIS HD2 H 1 6.079 0.030 . 1 . . . . 89 HIS HD2 . 10011 1 1085 . 1 1 89 89 HIS C C 13 178.562 0.300 . 1 . . . . 89 HIS C . 10011 1 1086 . 1 1 89 89 HIS CA C 13 60.452 0.300 . 1 . . . . 89 HIS CA . 10011 1 1087 . 1 1 89 89 HIS CB C 13 29.950 0.300 . 1 . . . . 89 HIS CB . 10011 1 1088 . 1 1 89 89 HIS CD2 C 13 118.478 0.300 . 1 . . . . 89 HIS CD2 . 10011 1 1089 . 1 1 89 89 HIS N N 15 120.437 0.300 . 1 . . . . 89 HIS N . 10011 1 1090 . 1 1 90 90 ARG H H 1 9.009 0.030 . 1 . . . . 90 ARG H . 10011 1 1091 . 1 1 90 90 ARG HA H 1 4.175 0.030 . 1 . . . . 90 ARG HA . 10011 1 1092 . 1 1 90 90 ARG HB2 H 1 2.445 0.030 . 2 . . . . 90 ARG HB2 . 10011 1 1093 . 1 1 90 90 ARG HB3 H 1 2.296 0.030 . 2 . . . . 90 ARG HB3 . 10011 1 1094 . 1 1 90 90 ARG HG2 H 1 2.345 0.030 . 2 . . . . 90 ARG HG2 . 10011 1 1095 . 1 1 90 90 ARG HG3 H 1 1.772 0.030 . 2 . . . . 90 ARG HG3 . 10011 1 1096 . 1 1 90 90 ARG HD2 H 1 3.380 0.030 . 2 . . . . 90 ARG HD2 . 10011 1 1097 . 1 1 90 90 ARG HD3 H 1 3.132 0.030 . 2 . . . . 90 ARG HD3 . 10011 1 1098 . 1 1 90 90 ARG C C 13 180.898 0.300 . 1 . . . . 90 ARG C . 10011 1 1099 . 1 1 90 90 ARG CA C 13 60.010 0.300 . 1 . . . . 90 ARG CA . 10011 1 1100 . 1 1 90 90 ARG CB C 13 32.933 0.300 . 1 . . . . 90 ARG CB . 10011 1 1101 . 1 1 90 90 ARG CG C 13 27.061 0.300 . 1 . . . . 90 ARG CG . 10011 1 1102 . 1 1 90 90 ARG CD C 13 45.104 0.300 . 1 . . . . 90 ARG CD . 10011 1 1103 . 1 1 90 90 ARG N N 15 119.919 0.300 . 1 . . . . 90 ARG N . 10011 1 1104 . 1 1 91 91 VAL H H 1 8.822 0.030 . 1 . . . . 91 VAL H . 10011 1 1105 . 1 1 91 91 VAL HA H 1 3.847 0.030 . 1 . . . . 91 VAL HA . 10011 1 1106 . 1 1 91 91 VAL HB H 1 2.135 0.030 . 1 . . . . 91 VAL HB . 10011 1 1107 . 1 1 91 91 VAL HG11 H 1 0.588 0.030 . 1 . . . . 91 VAL HG1 . 10011 1 1108 . 1 1 91 91 VAL HG12 H 1 0.588 0.030 . 1 . . . . 91 VAL HG1 . 10011 1 1109 . 1 1 91 91 VAL HG13 H 1 0.588 0.030 . 1 . . . . 91 VAL HG1 . 10011 1 1110 . 1 1 91 91 VAL HG21 H 1 0.785 0.030 . 1 . . . . 91 VAL HG2 . 10011 1 1111 . 1 1 91 91 VAL HG22 H 1 0.785 0.030 . 1 . . . . 91 VAL HG2 . 10011 1 1112 . 1 1 91 91 VAL HG23 H 1 0.785 0.030 . 1 . . . . 91 VAL HG2 . 10011 1 1113 . 1 1 91 91 VAL C C 13 176.662 0.300 . 1 . . . . 91 VAL C . 10011 1 1114 . 1 1 91 91 VAL CA C 13 67.930 0.300 . 1 . . . . 91 VAL CA . 10011 1 1115 . 1 1 91 91 VAL CB C 13 31.648 0.300 . 1 . . . . 91 VAL CB . 10011 1 1116 . 1 1 91 91 VAL CG1 C 13 21.098 0.300 . 1 . . . . 91 VAL CG1 . 10011 1 1117 . 1 1 91 91 VAL CG2 C 13 23.276 0.300 . 1 . . . . 91 VAL CG2 . 10011 1 1118 . 1 1 91 91 VAL N N 15 122.082 0.300 . 1 . . . . 91 VAL N . 10011 1 1119 . 1 1 92 92 HIS H H 1 8.863 0.030 . 1 . . . . 92 HIS H . 10011 1 1120 . 1 1 92 92 HIS HA H 1 3.779 0.030 . 1 . . . . 92 HIS HA . 10011 1 1121 . 1 1 92 92 HIS HB2 H 1 3.278 0.030 . 1 . . . . 92 HIS HB2 . 10011 1 1122 . 1 1 92 92 HIS HB3 H 1 3.278 0.030 . 1 . . . . 92 HIS HB3 . 10011 1 1123 . 1 1 92 92 HIS HD2 H 1 6.837 0.030 . 1 . . . . 92 HIS HD2 . 10011 1 1124 . 1 1 92 92 HIS HE1 H 1 7.602 0.030 . 1 . . . . 92 HIS HE1 . 10011 1 1125 . 1 1 92 92 HIS C C 13 176.733 0.300 . 1 . . . . 92 HIS C . 10011 1 1126 . 1 1 92 92 HIS CA C 13 63.207 0.300 . 1 . . . . 92 HIS CA . 10011 1 1127 . 1 1 92 92 HIS CB C 13 31.717 0.300 . 1 . . . . 92 HIS CB . 10011 1 1128 . 1 1 92 92 HIS CD2 C 13 116.203 0.300 . 1 . . . . 92 HIS CD2 . 10011 1 1129 . 1 1 92 92 HIS CE1 C 13 138.635 0.300 . 1 . . . . 92 HIS CE1 . 10011 1 1130 . 1 1 92 92 HIS N N 15 121.514 0.300 . 1 . . . . 92 HIS N . 10011 1 1131 . 1 1 93 93 SER H H 1 8.770 0.030 . 1 . . . . 93 SER H . 10011 1 1132 . 1 1 93 93 SER HA H 1 4.269 0.030 . 1 . . . . 93 SER HA . 10011 1 1133 . 1 1 93 93 SER HB2 H 1 3.996 0.030 . 2 . . . . 93 SER HB2 . 10011 1 1134 . 1 1 93 93 SER HB3 H 1 3.923 0.030 . 2 . . . . 93 SER HB3 . 10011 1 1135 . 1 1 93 93 SER C C 13 176.946 0.300 . 1 . . . . 93 SER C . 10011 1 1136 . 1 1 93 93 SER CA C 13 61.671 0.300 . 1 . . . . 93 SER CA . 10011 1 1137 . 1 1 93 93 SER CB C 13 63.361 0.300 . 1 . . . . 93 SER CB . 10011 1 1138 . 1 1 93 93 SER N N 15 111.582 0.300 . 1 . . . . 93 SER N . 10011 1 1139 . 1 1 94 94 TYR H H 1 8.151 0.030 . 1 . . . . 94 TYR H . 10011 1 1140 . 1 1 94 94 TYR HA H 1 4.433 0.030 . 1 . . . . 94 TYR HA . 10011 1 1141 . 1 1 94 94 TYR HB2 H 1 3.644 0.030 . 1 . . . . 94 TYR HB2 . 10011 1 1142 . 1 1 94 94 TYR HB3 H 1 3.644 0.030 . 1 . . . . 94 TYR HB3 . 10011 1 1143 . 1 1 94 94 TYR HD1 H 1 7.190 0.030 . 1 . . . . 94 TYR HD1 . 10011 1 1144 . 1 1 94 94 TYR HD2 H 1 7.190 0.030 . 1 . . . . 94 TYR HD2 . 10011 1 1145 . 1 1 94 94 TYR HE1 H 1 6.553 0.030 . 1 . . . . 94 TYR HE1 . 10011 1 1146 . 1 1 94 94 TYR HE2 H 1 6.553 0.030 . 1 . . . . 94 TYR HE2 . 10011 1 1147 . 1 1 94 94 TYR C C 13 177.532 0.300 . 1 . . . . 94 TYR C . 10011 1 1148 . 1 1 94 94 TYR CA C 13 61.470 0.300 . 1 . . . . 94 TYR CA . 10011 1 1149 . 1 1 94 94 TYR CB C 13 38.314 0.300 . 1 . . . . 94 TYR CB . 10011 1 1150 . 1 1 94 94 TYR CD1 C 13 133.523 0.300 . 1 . . . . 94 TYR CD1 . 10011 1 1151 . 1 1 94 94 TYR CD2 C 13 133.523 0.300 . 1 . . . . 94 TYR CD2 . 10011 1 1152 . 1 1 94 94 TYR CE1 C 13 118.543 0.300 . 1 . . . . 94 TYR CE1 . 10011 1 1153 . 1 1 94 94 TYR CE2 C 13 118.543 0.300 . 1 . . . . 94 TYR CE2 . 10011 1 1154 . 1 1 94 94 TYR N N 15 123.509 0.300 . 1 . . . . 94 TYR N . 10011 1 1155 . 1 1 95 95 LEU H H 1 8.432 0.030 . 1 . . . . 95 LEU H . 10011 1 1156 . 1 1 95 95 LEU HA H 1 3.577 0.030 . 1 . . . . 95 LEU HA . 10011 1 1157 . 1 1 95 95 LEU HB2 H 1 1.811 0.030 . 2 . . . . 95 LEU HB2 . 10011 1 1158 . 1 1 95 95 LEU HB3 H 1 1.019 0.030 . 2 . . . . 95 LEU HB3 . 10011 1 1159 . 1 1 95 95 LEU HG H 1 2.103 0.030 . 1 . . . . 95 LEU HG . 10011 1 1160 . 1 1 95 95 LEU HD11 H 1 0.819 0.030 . 1 . . . . 95 LEU HD1 . 10011 1 1161 . 1 1 95 95 LEU HD12 H 1 0.819 0.030 . 1 . . . . 95 LEU HD1 . 10011 1 1162 . 1 1 95 95 LEU HD13 H 1 0.819 0.030 . 1 . . . . 95 LEU HD1 . 10011 1 1163 . 1 1 95 95 LEU HD21 H 1 0.810 0.030 . 1 . . . . 95 LEU HD2 . 10011 1 1164 . 1 1 95 95 LEU HD22 H 1 0.810 0.030 . 1 . . . . 95 LEU HD2 . 10011 1 1165 . 1 1 95 95 LEU HD23 H 1 0.810 0.030 . 1 . . . . 95 LEU HD2 . 10011 1 1166 . 1 1 95 95 LEU C C 13 179.136 0.300 . 1 . . . . 95 LEU C . 10011 1 1167 . 1 1 95 95 LEU CA C 13 57.781 0.300 . 1 . . . . 95 LEU CA . 10011 1 1168 . 1 1 95 95 LEU CB C 13 41.683 0.300 . 1 . . . . 95 LEU CB . 10011 1 1169 . 1 1 95 95 LEU CG C 13 26.655 0.300 . 1 . . . . 95 LEU CG . 10011 1 1170 . 1 1 95 95 LEU CD1 C 13 27.259 0.300 . 1 . . . . 95 LEU CD1 . 10011 1 1171 . 1 1 95 95 LEU CD2 C 13 23.823 0.300 . 1 . . . . 95 LEU CD2 . 10011 1 1172 . 1 1 95 95 LEU N N 15 121.264 0.300 . 1 . . . . 95 LEU N . 10011 1 1173 . 1 1 96 96 GLU H H 1 8.198 0.030 . 1 . . . . 96 GLU H . 10011 1 1174 . 1 1 96 96 GLU HA H 1 3.819 0.030 . 1 . . . . 96 GLU HA . 10011 1 1175 . 1 1 96 96 GLU HB2 H 1 1.918 0.030 . 2 . . . . 96 GLU HB2 . 10011 1 1176 . 1 1 96 96 GLU HB3 H 1 1.778 0.030 . 2 . . . . 96 GLU HB3 . 10011 1 1177 . 1 1 96 96 GLU HG2 H 1 2.027 0.030 . 1 . . . . 96 GLU HG2 . 10011 1 1178 . 1 1 96 96 GLU HG3 H 1 2.027 0.030 . 1 . . . . 96 GLU HG3 . 10011 1 1179 . 1 1 96 96 GLU C C 13 180.376 0.300 . 1 . . . . 96 GLU C . 10011 1 1180 . 1 1 96 96 GLU CA C 13 59.669 0.300 . 1 . . . . 96 GLU CA . 10011 1 1181 . 1 1 96 96 GLU CB C 13 30.224 0.300 . 1 . . . . 96 GLU CB . 10011 1 1182 . 1 1 96 96 GLU CG C 13 37.730 0.300 . 1 . . . . 96 GLU CG . 10011 1 1183 . 1 1 96 96 GLU N N 15 119.299 0.300 . 1 . . . . 96 GLU N . 10011 1 1184 . 1 1 97 97 ARG H H 1 8.791 0.030 . 1 . . . . 97 ARG H . 10011 1 1185 . 1 1 97 97 ARG HA H 1 4.003 0.030 . 1 . . . . 97 ARG HA . 10011 1 1186 . 1 1 97 97 ARG HB2 H 1 1.919 0.030 . 2 . . . . 97 ARG HB2 . 10011 1 1187 . 1 1 97 97 ARG HB3 H 1 1.712 0.030 . 2 . . . . 97 ARG HB3 . 10011 1 1188 . 1 1 97 97 ARG HG2 H 1 1.563 0.030 . 2 . . . . 97 ARG HG2 . 10011 1 1189 . 1 1 97 97 ARG HG3 H 1 1.407 0.030 . 2 . . . . 97 ARG HG3 . 10011 1 1190 . 1 1 97 97 ARG HD2 H 1 3.130 0.030 . 1 . . . . 97 ARG HD2 . 10011 1 1191 . 1 1 97 97 ARG HD3 H 1 3.130 0.030 . 1 . . . . 97 ARG HD3 . 10011 1 1192 . 1 1 97 97 ARG C C 13 177.926 0.300 . 1 . . . . 97 ARG C . 10011 1 1193 . 1 1 97 97 ARG CA C 13 58.911 0.300 . 1 . . . . 97 ARG CA . 10011 1 1194 . 1 1 97 97 ARG CB C 13 29.754 0.300 . 1 . . . . 97 ARG CB . 10011 1 1195 . 1 1 97 97 ARG CG C 13 27.578 0.300 . 1 . . . . 97 ARG CG . 10011 1 1196 . 1 1 97 97 ARG CD C 13 43.369 0.300 . 1 . . . . 97 ARG CD . 10011 1 1197 . 1 1 97 97 ARG N N 15 121.744 0.300 . 1 . . . . 97 ARG N . 10011 1 1198 . 1 1 98 98 HIS H H 1 7.533 0.030 . 1 . . . . 98 HIS H . 10011 1 1199 . 1 1 98 98 HIS HA H 1 4.380 0.030 . 1 . . . . 98 HIS HA . 10011 1 1200 . 1 1 98 98 HIS HB2 H 1 3.309 0.030 . 2 . . . . 98 HIS HB2 . 10011 1 1201 . 1 1 98 98 HIS HB3 H 1 2.362 0.030 . 2 . . . . 98 HIS HB3 . 10011 1 1202 . 1 1 98 98 HIS HD2 H 1 6.808 0.030 . 1 . . . . 98 HIS HD2 . 10011 1 1203 . 1 1 98 98 HIS HE1 H 1 7.806 0.030 . 1 . . . . 98 HIS HE1 . 10011 1 1204 . 1 1 98 98 HIS C C 13 174.610 0.300 . 1 . . . . 98 HIS C . 10011 1 1205 . 1 1 98 98 HIS CA C 13 57.209 0.300 . 1 . . . . 98 HIS CA . 10011 1 1206 . 1 1 98 98 HIS CB C 13 28.427 0.300 . 1 . . . . 98 HIS CB . 10011 1 1207 . 1 1 98 98 HIS CD2 C 13 123.126 0.300 . 1 . . . . 98 HIS CD2 . 10011 1 1208 . 1 1 98 98 HIS CE1 C 13 137.716 0.300 . 1 . . . . 98 HIS CE1 . 10011 1 1209 . 1 1 98 98 HIS N N 15 113.955 0.300 . 1 . . . . 98 HIS N . 10011 1 1210 . 1 1 99 99 GLY H H 1 7.598 0.030 . 1 . . . . 99 GLY H . 10011 1 1211 . 1 1 99 99 GLY HA2 H 1 3.881 0.030 . 2 . . . . 99 GLY HA2 . 10011 1 1212 . 1 1 99 99 GLY HA3 H 1 3.736 0.030 . 2 . . . . 99 GLY HA3 . 10011 1 1213 . 1 1 99 99 GLY C C 13 173.549 0.300 . 1 . . . . 99 GLY C . 10011 1 1214 . 1 1 99 99 GLY CA C 13 46.553 0.300 . 1 . . . . 99 GLY CA . 10011 1 1215 . 1 1 99 99 GLY N N 15 107.447 0.300 . 1 . . . . 99 GLY N . 10011 1 1216 . 1 1 100 100 LEU H H 1 8.129 0.030 . 1 . . . . 100 LEU H . 10011 1 1217 . 1 1 100 100 LEU HA H 1 4.162 0.030 . 1 . . . . 100 LEU HA . 10011 1 1218 . 1 1 100 100 LEU HB2 H 1 1.578 0.030 . 2 . . . . 100 LEU HB2 . 10011 1 1219 . 1 1 100 100 LEU HB3 H 1 1.446 0.030 . 2 . . . . 100 LEU HB3 . 10011 1 1220 . 1 1 100 100 LEU HG H 1 1.446 0.030 . 1 . . . . 100 LEU HG . 10011 1 1221 . 1 1 100 100 LEU HD11 H 1 0.866 0.030 . 1 . . . . 100 LEU HD1 . 10011 1 1222 . 1 1 100 100 LEU HD12 H 1 0.866 0.030 . 1 . . . . 100 LEU HD1 . 10011 1 1223 . 1 1 100 100 LEU HD13 H 1 0.866 0.030 . 1 . . . . 100 LEU HD1 . 10011 1 1224 . 1 1 100 100 LEU HD21 H 1 0.852 0.030 . 1 . . . . 100 LEU HD2 . 10011 1 1225 . 1 1 100 100 LEU HD22 H 1 0.852 0.030 . 1 . . . . 100 LEU HD2 . 10011 1 1226 . 1 1 100 100 LEU HD23 H 1 0.852 0.030 . 1 . . . . 100 LEU HD2 . 10011 1 1227 . 1 1 100 100 LEU C C 13 175.975 0.300 . 1 . . . . 100 LEU C . 10011 1 1228 . 1 1 100 100 LEU CA C 13 56.035 0.300 . 1 . . . . 100 LEU CA . 10011 1 1229 . 1 1 100 100 LEU CB C 13 43.466 0.300 . 1 . . . . 100 LEU CB . 10011 1 1230 . 1 1 100 100 LEU CG C 13 28.116 0.300 . 1 . . . . 100 LEU CG . 10011 1 1231 . 1 1 100 100 LEU CD1 C 13 26.024 0.300 . 1 . . . . 100 LEU CD1 . 10011 1 1232 . 1 1 100 100 LEU CD2 C 13 23.684 0.300 . 1 . . . . 100 LEU CD2 . 10011 1 1233 . 1 1 100 100 LEU N N 15 117.796 0.300 . 1 . . . . 100 LEU N . 10011 1 1234 . 1 1 101 101 ILE H H 1 6.561 0.030 . 1 . . . . 101 ILE H . 10011 1 1235 . 1 1 101 101 ILE HA H 1 2.416 0.030 . 1 . . . . 101 ILE HA . 10011 1 1236 . 1 1 101 101 ILE HB H 1 0.772 0.030 . 1 . . . . 101 ILE HB . 10011 1 1237 . 1 1 101 101 ILE HG12 H 1 0.447 0.030 . 2 . . . . 101 ILE HG12 . 10011 1 1238 . 1 1 101 101 ILE HG13 H 1 0.120 0.030 . 2 . . . . 101 ILE HG13 . 10011 1 1239 . 1 1 101 101 ILE HG21 H 1 0.628 0.030 . 1 . . . . 101 ILE HG2 . 10011 1 1240 . 1 1 101 101 ILE HG22 H 1 0.628 0.030 . 1 . . . . 101 ILE HG2 . 10011 1 1241 . 1 1 101 101 ILE HG23 H 1 0.628 0.030 . 1 . . . . 101 ILE HG2 . 10011 1 1242 . 1 1 101 101 ILE HD11 H 1 0.204 0.030 . 1 . . . . 101 ILE HD1 . 10011 1 1243 . 1 1 101 101 ILE HD12 H 1 0.204 0.030 . 1 . . . . 101 ILE HD1 . 10011 1 1244 . 1 1 101 101 ILE HD13 H 1 0.204 0.030 . 1 . . . . 101 ILE HD1 . 10011 1 1245 . 1 1 101 101 ILE C C 13 173.114 0.300 . 1 . . . . 101 ILE C . 10011 1 1246 . 1 1 101 101 ILE CA C 13 57.855 0.300 . 1 . . . . 101 ILE CA . 10011 1 1247 . 1 1 101 101 ILE CB C 13 41.992 0.300 . 1 . . . . 101 ILE CB . 10011 1 1248 . 1 1 101 101 ILE CG1 C 13 24.121 0.300 . 1 . . . . 101 ILE CG1 . 10011 1 1249 . 1 1 101 101 ILE CG2 C 13 17.727 0.300 . 1 . . . . 101 ILE CG2 . 10011 1 1250 . 1 1 101 101 ILE CD1 C 13 13.334 0.300 . 1 . . . . 101 ILE CD1 . 10011 1 1251 . 1 1 101 101 ILE N N 15 104.448 0.300 . 1 . . . . 101 ILE N . 10011 1 1252 . 1 1 102 102 ASN H H 1 3.636 0.030 . 1 . . . . 102 ASN H . 10011 1 1253 . 1 1 102 102 ASN HA H 1 3.318 0.030 . 1 . . . . 102 ASN HA . 10011 1 1254 . 1 1 102 102 ASN HB2 H 1 2.601 0.030 . 2 . . . . 102 ASN HB2 . 10011 1 1255 . 1 1 102 102 ASN HB3 H 1 2.544 0.030 . 2 . . . . 102 ASN HB3 . 10011 1 1256 . 1 1 102 102 ASN HD21 H 1 8.169 0.030 . 2 . . . . 102 ASN HD21 . 10011 1 1257 . 1 1 102 102 ASN HD22 H 1 7.473 0.030 . 2 . . . . 102 ASN HD22 . 10011 1 1258 . 1 1 102 102 ASN C C 13 172.295 0.300 . 1 . . . . 102 ASN C . 10011 1 1259 . 1 1 102 102 ASN CA C 13 54.244 0.300 . 1 . . . . 102 ASN CA . 10011 1 1260 . 1 1 102 102 ASN CB C 13 35.802 0.300 . 1 . . . . 102 ASN CB . 10011 1 1261 . 1 1 102 102 ASN N N 15 111.982 0.300 . 1 . . . . 102 ASN N . 10011 1 1262 . 1 1 102 102 ASN ND2 N 15 110.639 0.300 . 1 . . . . 102 ASN ND2 . 10011 1 1263 . 1 1 103 103 PHE H H 1 6.328 0.030 . 1 . . . . 103 PHE H . 10011 1 1264 . 1 1 103 103 PHE HA H 1 4.924 0.030 . 1 . . . . 103 PHE HA . 10011 1 1265 . 1 1 103 103 PHE HB2 H 1 3.071 0.030 . 2 . . . . 103 PHE HB2 . 10011 1 1266 . 1 1 103 103 PHE HB3 H 1 2.639 0.030 . 2 . . . . 103 PHE HB3 . 10011 1 1267 . 1 1 103 103 PHE HD1 H 1 6.792 0.030 . 1 . . . . 103 PHE HD1 . 10011 1 1268 . 1 1 103 103 PHE HD2 H 1 6.792 0.030 . 1 . . . . 103 PHE HD2 . 10011 1 1269 . 1 1 103 103 PHE HE1 H 1 7.323 0.030 . 1 . . . . 103 PHE HE1 . 10011 1 1270 . 1 1 103 103 PHE HE2 H 1 7.323 0.030 . 1 . . . . 103 PHE HE2 . 10011 1 1271 . 1 1 103 103 PHE HZ H 1 7.485 0.030 . 1 . . . . 103 PHE HZ . 10011 1 1272 . 1 1 103 103 PHE C C 13 175.066 0.300 . 1 . . . . 103 PHE C . 10011 1 1273 . 1 1 103 103 PHE CA C 13 55.786 0.300 . 1 . . . . 103 PHE CA . 10011 1 1274 . 1 1 103 103 PHE CB C 13 41.405 0.300 . 1 . . . . 103 PHE CB . 10011 1 1275 . 1 1 103 103 PHE CD1 C 13 132.328 0.300 . 1 . . . . 103 PHE CD1 . 10011 1 1276 . 1 1 103 103 PHE CD2 C 13 132.328 0.300 . 1 . . . . 103 PHE CD2 . 10011 1 1277 . 1 1 103 103 PHE CE1 C 13 131.457 0.300 . 1 . . . . 103 PHE CE1 . 10011 1 1278 . 1 1 103 103 PHE CE2 C 13 131.457 0.300 . 1 . . . . 103 PHE CE2 . 10011 1 1279 . 1 1 103 103 PHE CZ C 13 129.882 0.300 . 1 . . . . 103 PHE CZ . 10011 1 1280 . 1 1 103 103 PHE N N 15 115.512 0.300 . 1 . . . . 103 PHE N . 10011 1 1281 . 1 1 104 104 GLY H H 1 8.743 0.030 . 1 . . . . 104 GLY H . 10011 1 1282 . 1 1 104 104 GLY HA2 H 1 4.058 0.030 . 2 . . . . 104 GLY HA2 . 10011 1 1283 . 1 1 104 104 GLY HA3 H 1 3.744 0.030 . 2 . . . . 104 GLY HA3 . 10011 1 1284 . 1 1 104 104 GLY C C 13 173.963 0.300 . 1 . . . . 104 GLY C . 10011 1 1285 . 1 1 104 104 GLY CA C 13 45.510 0.300 . 1 . . . . 104 GLY CA . 10011 1 1286 . 1 1 104 104 GLY N N 15 110.732 0.300 . 1 . . . . 104 GLY N . 10011 1 1287 . 1 1 105 105 ILE H H 1 7.988 0.030 . 1 . . . . 105 ILE H . 10011 1 1288 . 1 1 105 105 ILE HA H 1 4.122 0.030 . 1 . . . . 105 ILE HA . 10011 1 1289 . 1 1 105 105 ILE HB H 1 1.770 0.030 . 1 . . . . 105 ILE HB . 10011 1 1290 . 1 1 105 105 ILE HG12 H 1 1.292 0.030 . 2 . . . . 105 ILE HG12 . 10011 1 1291 . 1 1 105 105 ILE HG13 H 1 0.998 0.030 . 2 . . . . 105 ILE HG13 . 10011 1 1292 . 1 1 105 105 ILE HG21 H 1 0.763 0.030 . 1 . . . . 105 ILE HG2 . 10011 1 1293 . 1 1 105 105 ILE HG22 H 1 0.763 0.030 . 1 . . . . 105 ILE HG2 . 10011 1 1294 . 1 1 105 105 ILE HG23 H 1 0.763 0.030 . 1 . . . . 105 ILE HG2 . 10011 1 1295 . 1 1 105 105 ILE HD11 H 1 0.731 0.030 . 1 . . . . 105 ILE HD1 . 10011 1 1296 . 1 1 105 105 ILE HD12 H 1 0.731 0.030 . 1 . . . . 105 ILE HD1 . 10011 1 1297 . 1 1 105 105 ILE HD13 H 1 0.731 0.030 . 1 . . . . 105 ILE HD1 . 10011 1 1298 . 1 1 105 105 ILE C C 13 175.217 0.300 . 1 . . . . 105 ILE C . 10011 1 1299 . 1 1 105 105 ILE CA C 13 60.721 0.300 . 1 . . . . 105 ILE CA . 10011 1 1300 . 1 1 105 105 ILE CB C 13 38.051 0.300 . 1 . . . . 105 ILE CB . 10011 1 1301 . 1 1 105 105 ILE CG1 C 13 26.777 0.300 . 1 . . . . 105 ILE CG1 . 10011 1 1302 . 1 1 105 105 ILE CG2 C 13 17.603 0.300 . 1 . . . . 105 ILE CG2 . 10011 1 1303 . 1 1 105 105 ILE CD1 C 13 12.372 0.300 . 1 . . . . 105 ILE CD1 . 10011 1 1304 . 1 1 105 105 ILE N N 15 120.333 0.300 . 1 . . . . 105 ILE N . 10011 1 1305 . 1 1 106 106 TYR H H 1 7.806 0.030 . 1 . . . . 106 TYR H . 10011 1 1306 . 1 1 106 106 TYR HA H 1 4.609 0.030 . 1 . . . . 106 TYR HA . 10011 1 1307 . 1 1 106 106 TYR HB2 H 1 3.078 0.030 . 2 . . . . 106 TYR HB2 . 10011 1 1308 . 1 1 106 106 TYR HB3 H 1 2.629 0.030 . 2 . . . . 106 TYR HB3 . 10011 1 1309 . 1 1 106 106 TYR HD1 H 1 6.861 0.030 . 1 . . . . 106 TYR HD1 . 10011 1 1310 . 1 1 106 106 TYR HD2 H 1 6.861 0.030 . 1 . . . . 106 TYR HD2 . 10011 1 1311 . 1 1 106 106 TYR HE1 H 1 6.535 0.030 . 1 . . . . 106 TYR HE1 . 10011 1 1312 . 1 1 106 106 TYR HE2 H 1 6.535 0.030 . 1 . . . . 106 TYR HE2 . 10011 1 1313 . 1 1 106 106 TYR C C 13 174.560 0.300 . 1 . . . . 106 TYR C . 10011 1 1314 . 1 1 106 106 TYR CA C 13 56.617 0.300 . 1 . . . . 106 TYR CA . 10011 1 1315 . 1 1 106 106 TYR CB C 13 39.178 0.300 . 1 . . . . 106 TYR CB . 10011 1 1316 . 1 1 106 106 TYR CD1 C 13 133.439 0.300 . 1 . . . . 106 TYR CD1 . 10011 1 1317 . 1 1 106 106 TYR CD2 C 13 133.439 0.300 . 1 . . . . 106 TYR CD2 . 10011 1 1318 . 1 1 106 106 TYR CE1 C 13 117.483 0.300 . 1 . . . . 106 TYR CE1 . 10011 1 1319 . 1 1 106 106 TYR CE2 C 13 117.483 0.300 . 1 . . . . 106 TYR CE2 . 10011 1 1320 . 1 1 106 106 TYR N N 15 122.724 0.300 . 1 . . . . 106 TYR N . 10011 1 1321 . 1 1 107 107 LYS H H 1 8.225 0.030 . 1 . . . . 107 LYS H . 10011 1 1322 . 1 1 107 107 LYS HA H 1 4.232 0.030 . 1 . . . . 107 LYS HA . 10011 1 1323 . 1 1 107 107 LYS HB2 H 1 1.815 0.030 . 2 . . . . 107 LYS HB2 . 10011 1 1324 . 1 1 107 107 LYS HB3 H 1 1.734 0.030 . 2 . . . . 107 LYS HB3 . 10011 1 1325 . 1 1 107 107 LYS HG2 H 1 1.326 0.030 . 1 . . . . 107 LYS HG2 . 10011 1 1326 . 1 1 107 107 LYS HG3 H 1 1.326 0.030 . 1 . . . . 107 LYS HG3 . 10011 1 1327 . 1 1 107 107 LYS HD2 H 1 1.647 0.030 . 1 . . . . 107 LYS HD2 . 10011 1 1328 . 1 1 107 107 LYS HD3 H 1 1.647 0.030 . 1 . . . . 107 LYS HD3 . 10011 1 1329 . 1 1 107 107 LYS HE2 H 1 2.951 0.030 . 1 . . . . 107 LYS HE2 . 10011 1 1330 . 1 1 107 107 LYS HE3 H 1 2.951 0.030 . 1 . . . . 107 LYS HE3 . 10011 1 1331 . 1 1 107 107 LYS C C 13 175.732 0.300 . 1 . . . . 107 LYS C . 10011 1 1332 . 1 1 107 107 LYS CA C 13 56.034 0.300 . 1 . . . . 107 LYS CA . 10011 1 1333 . 1 1 107 107 LYS CB C 13 33.322 0.300 . 1 . . . . 107 LYS CB . 10011 1 1334 . 1 1 107 107 LYS CG C 13 24.676 0.300 . 1 . . . . 107 LYS CG . 10011 1 1335 . 1 1 107 107 LYS CD C 13 29.190 0.300 . 1 . . . . 107 LYS CD . 10011 1 1336 . 1 1 107 107 LYS CE C 13 42.082 0.300 . 1 . . . . 107 LYS CE . 10011 1 1337 . 1 1 107 107 LYS N N 15 123.133 0.300 . 1 . . . . 107 LYS N . 10011 1 1338 . 1 1 108 108 ARG H H 1 8.439 0.030 . 1 . . . . 108 ARG H . 10011 1 1339 . 1 1 108 108 ARG HA H 1 4.373 0.030 . 1 . . . . 108 ARG HA . 10011 1 1340 . 1 1 108 108 ARG HB2 H 1 1.836 0.030 . 2 . . . . 108 ARG HB2 . 10011 1 1341 . 1 1 108 108 ARG HB3 H 1 1.710 0.030 . 2 . . . . 108 ARG HB3 . 10011 1 1342 . 1 1 108 108 ARG HG2 H 1 1.607 0.030 . 1 . . . . 108 ARG HG2 . 10011 1 1343 . 1 1 108 108 ARG HG3 H 1 1.607 0.030 . 1 . . . . 108 ARG HG3 . 10011 1 1344 . 1 1 108 108 ARG HD2 H 1 3.150 0.030 . 1 . . . . 108 ARG HD2 . 10011 1 1345 . 1 1 108 108 ARG HD3 H 1 3.150 0.030 . 1 . . . . 108 ARG HD3 . 10011 1 1346 . 1 1 108 108 ARG C C 13 176.268 0.300 . 1 . . . . 108 ARG C . 10011 1 1347 . 1 1 108 108 ARG CA C 13 56.138 0.300 . 1 . . . . 108 ARG CA . 10011 1 1348 . 1 1 108 108 ARG CB C 13 30.770 0.300 . 1 . . . . 108 ARG CB . 10011 1 1349 . 1 1 108 108 ARG CG C 13 27.637 0.300 . 1 . . . . 108 ARG CG . 10011 1 1350 . 1 1 108 108 ARG CD C 13 43.270 0.300 . 1 . . . . 108 ARG CD . 10011 1 1351 . 1 1 108 108 ARG N N 15 124.715 0.300 . 1 . . . . 108 ARG N . 10011 1 1352 . 1 1 109 109 ILE H H 1 8.287 0.030 . 1 . . . . 109 ILE H . 10011 1 1353 . 1 1 109 109 ILE HA H 1 4.185 0.030 . 1 . . . . 109 ILE HA . 10011 1 1354 . 1 1 109 109 ILE HB H 1 1.807 0.030 . 1 . . . . 109 ILE HB . 10011 1 1355 . 1 1 109 109 ILE HG12 H 1 1.478 0.030 . 2 . . . . 109 ILE HG12 . 10011 1 1356 . 1 1 109 109 ILE HG13 H 1 1.252 0.030 . 2 . . . . 109 ILE HG13 . 10011 1 1357 . 1 1 109 109 ILE HG21 H 1 0.896 0.030 . 1 . . . . 109 ILE HG2 . 10011 1 1358 . 1 1 109 109 ILE HG22 H 1 0.896 0.030 . 1 . . . . 109 ILE HG2 . 10011 1 1359 . 1 1 109 109 ILE HG23 H 1 0.896 0.030 . 1 . . . . 109 ILE HG2 . 10011 1 1360 . 1 1 109 109 ILE HD11 H 1 0.875 0.030 . 1 . . . . 109 ILE HD1 . 10011 1 1361 . 1 1 109 109 ILE HD12 H 1 0.875 0.030 . 1 . . . . 109 ILE HD1 . 10011 1 1362 . 1 1 109 109 ILE HD13 H 1 0.875 0.030 . 1 . . . . 109 ILE HD1 . 10011 1 1363 . 1 1 109 109 ILE C C 13 175.915 0.300 . 1 . . . . 109 ILE C . 10011 1 1364 . 1 1 109 109 ILE CA C 13 60.819 0.300 . 1 . . . . 109 ILE CA . 10011 1 1365 . 1 1 109 109 ILE CB C 13 38.758 0.300 . 1 . . . . 109 ILE CB . 10011 1 1366 . 1 1 109 109 ILE CG1 C 13 27.294 0.300 . 1 . . . . 109 ILE CG1 . 10011 1 1367 . 1 1 109 109 ILE CG2 C 13 17.558 0.300 . 1 . . . . 109 ILE CG2 . 10011 1 1368 . 1 1 109 109 ILE CD1 C 13 12.541 0.300 . 1 . . . . 109 ILE CD1 . 10011 1 1369 . 1 1 109 109 ILE N N 15 122.702 0.300 . 1 . . . . 109 ILE N . 10011 1 1370 . 1 1 110 110 LYS H H 1 8.337 0.030 . 1 . . . . 110 LYS H . 10011 1 1371 . 1 1 110 110 LYS HA H 1 4.639 0.030 . 1 . . . . 110 LYS HA . 10011 1 1372 . 1 1 110 110 LYS HB2 H 1 1.827 0.030 . 2 . . . . 110 LYS HB2 . 10011 1 1373 . 1 1 110 110 LYS HB3 H 1 1.718 0.030 . 2 . . . . 110 LYS HB3 . 10011 1 1374 . 1 1 110 110 LYS HG2 H 1 1.484 0.030 . 2 . . . . 110 LYS HG2 . 10011 1 1375 . 1 1 110 110 LYS HG3 H 1 1.440 0.030 . 2 . . . . 110 LYS HG3 . 10011 1 1376 . 1 1 110 110 LYS HD2 H 1 1.708 0.030 . 1 . . . . 110 LYS HD2 . 10011 1 1377 . 1 1 110 110 LYS HD3 H 1 1.708 0.030 . 1 . . . . 110 LYS HD3 . 10011 1 1378 . 1 1 110 110 LYS HE2 H 1 3.012 0.030 . 1 . . . . 110 LYS HE2 . 10011 1 1379 . 1 1 110 110 LYS HE3 H 1 3.012 0.030 . 1 . . . . 110 LYS HE3 . 10011 1 1380 . 1 1 110 110 LYS C C 13 174.127 0.300 . 1 . . . . 110 LYS C . 10011 1 1381 . 1 1 110 110 LYS CA C 13 53.949 0.300 . 1 . . . . 110 LYS CA . 10011 1 1382 . 1 1 110 110 LYS CB C 13 32.924 0.300 . 1 . . . . 110 LYS CB . 10011 1 1383 . 1 1 110 110 LYS CG C 13 24.716 0.300 . 1 . . . . 110 LYS CG . 10011 1 1384 . 1 1 110 110 LYS CD C 13 29.391 0.300 . 1 . . . . 110 LYS CD . 10011 1 1385 . 1 1 110 110 LYS CE C 13 42.140 0.300 . 1 . . . . 110 LYS CE . 10011 1 1386 . 1 1 110 110 LYS N N 15 126.296 0.300 . 1 . . . . 110 LYS N . 10011 1 1387 . 1 1 111 111 PRO HA H 1 4.416 0.030 . 1 . . . . 111 PRO HA . 10011 1 1388 . 1 1 111 111 PRO HB2 H 1 2.271 0.030 . 2 . . . . 111 PRO HB2 . 10011 1 1389 . 1 1 111 111 PRO HB3 H 1 1.862 0.030 . 2 . . . . 111 PRO HB3 . 10011 1 1390 . 1 1 111 111 PRO HD2 H 1 3.841 0.030 . 2 . . . . 111 PRO HD2 . 10011 1 1391 . 1 1 111 111 PRO HD3 H 1 3.641 0.030 . 2 . . . . 111 PRO HD3 . 10011 1 1392 . 1 1 111 111 PRO C C 13 176.683 0.300 . 1 . . . . 111 PRO C . 10011 1 1393 . 1 1 111 111 PRO CA C 13 62.712 0.300 . 1 . . . . 111 PRO CA . 10011 1 1394 . 1 1 111 111 PRO CB C 13 32.186 0.300 . 1 . . . . 111 PRO CB . 10011 1 1395 . 1 1 111 111 PRO CG C 13 27.290 0.300 . 1 . . . . 111 PRO CG . 10011 1 1396 . 1 1 111 111 PRO CD C 13 50.767 0.300 . 1 . . . . 111 PRO CD . 10011 1 1397 . 1 1 112 112 LEU H H 1 8.385 0.030 . 1 . . . . 112 LEU H . 10011 1 1398 . 1 1 112 112 LEU HA H 1 4.554 0.030 . 1 . . . . 112 LEU HA . 10011 1 1399 . 1 1 112 112 LEU HB2 H 1 1.581 0.030 . 2 . . . . 112 LEU HB2 . 10011 1 1400 . 1 1 112 112 LEU HB3 H 1 1.551 0.030 . 2 . . . . 112 LEU HB3 . 10011 1 1401 . 1 1 112 112 LEU HG H 1 1.720 0.030 . 1 . . . . 112 LEU HG . 10011 1 1402 . 1 1 112 112 LEU HD11 H 1 0.942 0.030 . 1 . . . . 112 LEU HD1 . 10011 1 1403 . 1 1 112 112 LEU HD12 H 1 0.942 0.030 . 1 . . . . 112 LEU HD1 . 10011 1 1404 . 1 1 112 112 LEU HD13 H 1 0.942 0.030 . 1 . . . . 112 LEU HD1 . 10011 1 1405 . 1 1 112 112 LEU HD21 H 1 0.928 0.030 . 1 . . . . 112 LEU HD2 . 10011 1 1406 . 1 1 112 112 LEU HD22 H 1 0.928 0.030 . 1 . . . . 112 LEU HD2 . 10011 1 1407 . 1 1 112 112 LEU HD23 H 1 0.928 0.030 . 1 . . . . 112 LEU HD2 . 10011 1 1408 . 1 1 112 112 LEU C C 13 175.571 0.300 . 1 . . . . 112 LEU C . 10011 1 1409 . 1 1 112 112 LEU CA C 13 53.154 0.300 . 1 . . . . 112 LEU CA . 10011 1 1410 . 1 1 112 112 LEU CB C 13 41.641 0.300 . 1 . . . . 112 LEU CB . 10011 1 1411 . 1 1 112 112 LEU CG C 13 27.165 0.300 . 1 . . . . 112 LEU CG . 10011 1 1412 . 1 1 112 112 LEU CD1 C 13 25.216 0.300 . 2 . . . . 112 LEU CD1 . 10011 1 1413 . 1 1 112 112 LEU CD2 C 13 23.354 0.300 . 2 . . . . 112 LEU CD2 . 10011 1 1414 . 1 1 112 112 LEU N N 15 123.983 0.300 . 1 . . . . 112 LEU N . 10011 1 1415 . 1 1 113 113 PRO HA H 1 4.480 0.030 . 1 . . . . 113 PRO HA . 10011 1 1416 . 1 1 113 113 PRO HB2 H 1 2.293 0.030 . 2 . . . . 113 PRO HB2 . 10011 1 1417 . 1 1 113 113 PRO HB3 H 1 1.902 0.030 . 2 . . . . 113 PRO HB3 . 10011 1 1418 . 1 1 113 113 PRO HG2 H 1 2.026 0.030 . 1 . . . . 113 PRO HG2 . 10011 1 1419 . 1 1 113 113 PRO HG3 H 1 2.026 0.030 . 1 . . . . 113 PRO HG3 . 10011 1 1420 . 1 1 113 113 PRO HD2 H 1 3.850 0.030 . 2 . . . . 113 PRO HD2 . 10011 1 1421 . 1 1 113 113 PRO HD3 H 1 3.646 0.030 . 2 . . . . 113 PRO HD3 . 10011 1 1422 . 1 1 113 113 PRO C C 13 176.977 0.300 . 1 . . . . 113 PRO C . 10011 1 1423 . 1 1 113 113 PRO CA C 13 63.065 0.300 . 1 . . . . 113 PRO CA . 10011 1 1424 . 1 1 113 113 PRO CB C 13 32.068 0.300 . 1 . . . . 113 PRO CB . 10011 1 1425 . 1 1 113 113 PRO CG C 13 27.428 0.300 . 1 . . . . 113 PRO CG . 10011 1 1426 . 1 1 113 113 PRO CD C 13 50.576 0.300 . 1 . . . . 113 PRO CD . 10011 1 1427 . 1 1 114 114 THR H H 1 8.212 0.030 . 1 . . . . 114 THR H . 10011 1 1428 . 1 1 114 114 THR HA H 1 4.276 0.030 . 1 . . . . 114 THR HA . 10011 1 1429 . 1 1 114 114 THR HB H 1 4.167 0.030 . 1 . . . . 114 THR HB . 10011 1 1430 . 1 1 114 114 THR HG21 H 1 1.208 0.030 . 1 . . . . 114 THR HG2 . 10011 1 1431 . 1 1 114 114 THR HG22 H 1 1.208 0.030 . 1 . . . . 114 THR HG2 . 10011 1 1432 . 1 1 114 114 THR HG23 H 1 1.208 0.030 . 1 . . . . 114 THR HG2 . 10011 1 1433 . 1 1 114 114 THR C C 13 174.469 0.300 . 1 . . . . 114 THR C . 10011 1 1434 . 1 1 114 114 THR CA C 13 61.803 0.300 . 1 . . . . 114 THR CA . 10011 1 1435 . 1 1 114 114 THR CB C 13 69.995 0.300 . 1 . . . . 114 THR CB . 10011 1 1436 . 1 1 114 114 THR CG2 C 13 21.676 0.300 . 1 . . . . 114 THR CG2 . 10011 1 1437 . 1 1 114 114 THR N N 15 115.081 0.300 . 1 . . . . 114 THR N . 10011 1 1438 . 1 1 115 115 LYS H H 1 8.330 0.030 . 1 . . . . 115 LYS H . 10011 1 1439 . 1 1 115 115 LYS C C 13 176.369 0.300 . 1 . . . . 115 LYS C . 10011 1 1440 . 1 1 115 115 LYS CA C 13 56.255 0.300 . 1 . . . . 115 LYS CA . 10011 1 1441 . 1 1 115 115 LYS CB C 13 33.233 0.300 . 1 . . . . 115 LYS CB . 10011 1 1442 . 1 1 115 115 LYS N N 15 124.255 0.300 . 1 . . . . 115 LYS N . 10011 1 1443 . 1 1 116 116 LYS HA H 1 4.373 0.030 . 1 . . . . 116 LYS HA . 10011 1 1444 . 1 1 116 116 LYS HB2 H 1 1.794 0.030 . 1 . . . . 116 LYS HB2 . 10011 1 1445 . 1 1 116 116 LYS HB3 H 1 1.794 0.030 . 1 . . . . 116 LYS HB3 . 10011 1 1446 . 1 1 116 116 LYS HG2 H 1 1.419 0.030 . 1 . . . . 116 LYS HG2 . 10011 1 1447 . 1 1 116 116 LYS HG3 H 1 1.419 0.030 . 1 . . . . 116 LYS HG3 . 10011 1 1448 . 1 1 116 116 LYS HD2 H 1 1.662 0.030 . 1 . . . . 116 LYS HD2 . 10011 1 1449 . 1 1 116 116 LYS HD3 H 1 1.662 0.030 . 1 . . . . 116 LYS HD3 . 10011 1 1450 . 1 1 116 116 LYS HE2 H 1 2.980 0.030 . 1 . . . . 116 LYS HE2 . 10011 1 1451 . 1 1 116 116 LYS HE3 H 1 2.980 0.030 . 1 . . . . 116 LYS HE3 . 10011 1 1452 . 1 1 116 116 LYS C C 13 176.775 0.300 . 1 . . . . 116 LYS C . 10011 1 1453 . 1 1 116 116 LYS CA C 13 56.314 0.300 . 1 . . . . 116 LYS CA . 10011 1 1454 . 1 1 116 116 LYS CB C 13 33.110 0.300 . 1 . . . . 116 LYS CB . 10011 1 1455 . 1 1 116 116 LYS CG C 13 24.676 0.300 . 1 . . . . 116 LYS CG . 10011 1 1456 . 1 1 116 116 LYS CD C 13 29.148 0.300 . 1 . . . . 116 LYS CD . 10011 1 1457 . 1 1 116 116 LYS CE C 13 42.151 0.300 . 1 . . . . 116 LYS CE . 10011 1 1458 . 1 1 117 117 THR H H 1 8.253 0.030 . 1 . . . . 117 THR H . 10011 1 1459 . 1 1 117 117 THR HA H 1 4.349 0.030 . 1 . . . . 117 THR HA . 10011 1 1460 . 1 1 117 117 THR HB H 1 4.223 0.030 . 1 . . . . 117 THR HB . 10011 1 1461 . 1 1 117 117 THR HG21 H 1 1.204 0.030 . 1 . . . . 117 THR HG2 . 10011 1 1462 . 1 1 117 117 THR HG22 H 1 1.204 0.030 . 1 . . . . 117 THR HG2 . 10011 1 1463 . 1 1 117 117 THR HG23 H 1 1.204 0.030 . 1 . . . . 117 THR HG2 . 10011 1 1464 . 1 1 117 117 THR C C 13 175.015 0.300 . 1 . . . . 117 THR C . 10011 1 1465 . 1 1 117 117 THR CA C 13 61.905 0.300 . 1 . . . . 117 THR CA . 10011 1 1466 . 1 1 117 117 THR CB C 13 69.888 0.300 . 1 . . . . 117 THR CB . 10011 1 1467 . 1 1 117 117 THR CG2 C 13 21.580 0.300 . 1 . . . . 117 THR CG2 . 10011 1 1468 . 1 1 117 117 THR N N 15 115.944 0.300 . 1 . . . . 117 THR N . 10011 1 1469 . 1 1 118 118 GLY H H 1 8.465 0.030 . 1 . . . . 118 GLY H . 10011 1 1470 . 1 1 118 118 GLY C C 13 174.127 0.300 . 1 . . . . 118 GLY C . 10011 1 1471 . 1 1 118 118 GLY CA C 13 45.305 0.300 . 1 . . . . 118 GLY CA . 10011 1 1472 . 1 1 118 118 GLY N N 15 111.486 0.300 . 1 . . . . 118 GLY N . 10011 1 stop_ save_