data_6615 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 6615 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 'Structure of Bacillus subtilis SSD domain' 'Structure analysis' . 6615 1 stop_ loop_ _Study_keyword.Study_ID _Study_keyword.Keyword _Study_keyword.Entry_ID _Study_keyword.Study_list_ID . 'AAA+ superfamily' 6615 1 . 'solution structure' 6615 1 . 'SSD domain' 6615 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6615 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for SSD domain of Bacillus subtilis Lon protease ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-04-29 _Entry.Accession_date 2005-05-02 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _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 Iren Wang . . . 6615 2 Yuan-Chao Lou . . . 6615 3 Shih-Chi Lo . . . 6615 4 Yueh-Luen Lee . Alan . 6615 5 Shih-Hsiung Wu . . . 6615 6 Chinpan Chen . . . 6615 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6615 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 516 6615 '15N chemical shifts' 120 6615 '1H chemical shifts' 845 6615 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 3 . . 2009-09-08 2005-04-29 update BMRB 'correct entry citation' 6615 2 . . 2008-01-30 2005-04-29 update BMRB 'complete entry citation' 6615 1 . . 2005-12-29 2005-04-29 original author 'original release' 6615 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6615 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19636865 _Citation.Full_citation . _Citation.Title '(1)H, (13)C and (15)N resonance assignments of alpha-domain for Bacillus subtilis Lon protease' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 1 _Citation.Journal_issue 2 _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 201 _Citation.Page_last 203 _Citation.Year 2007 _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 Iren Wang . . . 6615 1 2 Yuan-Chao Lou . . . 6615 1 3 Yu-Ching Lin . . . 6615 1 4 Shih-Chi Lo . . . 6615 1 5 AlanYueh-Luen Lee . . . 6615 1 6 Shih-Hsiung Wu . . . 6615 1 7 Chinpan Chen . . . 6615 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'sensor- and substrate-discrimination domain' 6615 1 'solution structure' 6615 1 'SSD domain' 6615 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6615 _Assembly.ID 1 _Assembly.Name 'BsLonSSD monomer' _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_ _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 'BsLonSSD monomer' 1 $Bacillus_subtilis_SSD_domain_polypeptide . . yes native no no . . . 6615 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Bacillus_subtilis_SSD_domain_polypeptide _Entity.Sf_category entity _Entity.Sf_framecode Bacillus_subtilis_SSD_domain_polypeptide _Entity.Entry_ID 6615 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name BsLonSSD _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 ; MAGYTEIEKLEIVKDHLLPK QIKEHGLKKSNLQLRDQAIL DIIRYYTREAGVRSLERQLA AICRKAAKAIVAEERKRITV TEKNLQDFIGKRIFRYGQAE TEDQVGVVTGLAYTTVLRHH HHHH ; _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 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13965 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1X37 . "Structure Of Bacillus Subtilis Lon Protease Ssd Domain" . . . . . 100.00 124 100.00 100.00 1.18e-82 . . . . 6615 1 2 no PDB 3M6A . "Crystal Structure Of Bacillus Subtilis Lon C-Terminal Domain" . . . . . 93.55 543 99.14 100.00 1.58e-70 . . . . 6615 1 3 no DBJ BAI86310 . "class III heat-shock ATP-dependent Lon protease [Bacillus subtilis subsp. natto BEST195]" . . . . . 93.55 774 99.14 100.00 3.59e-69 . . . . 6615 1 4 no DBJ BAM53256 . "class III heat-shock ATP-dependent LonAprotease [Bacillus subtilis BEST7613]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 5 no DBJ BAM58898 . "class III heat-shock ATP-dependent LonAprotease [Bacillus subtilis BEST7003]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 6 no DBJ GAK80335 . "class III heat-shock ATP-dependent LonA protease [Bacillus subtilis Miyagi-4]" . . . . . 93.55 774 99.14 100.00 3.59e-69 . . . . 6615 1 7 no EMBL CAA53984 . "protease La [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 8 no EMBL CAA99540 . "ATP-dependent Lon protease [Bacillus subtilis]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 9 no EMBL CAB14780 . "class III heat-shock ATP-dependent LonA protease [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 10 no EMBL CCU59313 . "ATP-dependent protease La Type I [Bacillus subtilis E1]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 11 no EMBL CEI58050 . "Lon protease 1 [Bacillus subtilis]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 12 no GB ADM38771 . "class III heat-shock ATP-dependent LonA protease [Bacillus subtilis subsp. spizizenii str. W23]" . . . . . 93.55 774 97.41 99.14 2.74e-68 . . . . 6615 1 13 no GB ADV93612 . "class III heat-shock ATP-dependent LonA protease [Bacillus subtilis BSn5]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 14 no GB AEP87668 . "ATP-dependent protease La [Bacillus subtilis subsp. spizizenii TU-B-10]" . . . . . 93.55 774 97.41 99.14 2.58e-68 . . . . 6615 1 15 no GB AEP91815 . "ATP-dependent protease La [Bacillus subtilis subsp. subtilis str. RO-NN-1]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 16 no GB AFI29338 . "LonA [Bacillus sp. JS]" . . . . . 93.55 774 99.14 100.00 3.93e-69 . . . . 6615 1 17 no REF NP_390698 . "Lon protease 1 [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 18 no REF WP_003222565 . "peptidase [Bacillus subtilis]" . . . . . 93.55 774 97.41 99.14 2.74e-68 . . . . 6615 1 19 no REF WP_003229618 . "peptidase [Bacillus subtilis]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 20 no REF WP_003237606 . "class III heat-shock ATP-dependent LonA protease [Bacillus subtilis]" . . . . . 93.55 774 97.41 100.00 1.10e-68 . . . . 6615 1 21 no REF WP_014114674 . "peptidase [Bacillus subtilis]" . . . . . 93.55 774 97.41 99.14 2.58e-68 . . . . 6615 1 22 no SP P37945 . "RecName: Full=Lon protease 1; AltName: Full=ATP-dependent protease La 1 [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 93.55 774 99.14 100.00 4.54e-69 . . . . 6615 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID protease 6615 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Bacillus subtilis SSD domain' . 6615 1 stop_ loop_ _Entity_keyword.Keyword _Entity_keyword.Entry_ID _Entity_keyword.Entity_ID protease 6615 1 'sensor- and substrate-discrimination domain' 6615 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 -1 MET . 6615 1 2 1 ALA . 6615 1 3 2 GLY . 6615 1 4 3 TYR . 6615 1 5 4 THR . 6615 1 6 5 GLU . 6615 1 7 6 ILE . 6615 1 8 7 GLU . 6615 1 9 8 LYS . 6615 1 10 9 LEU . 6615 1 11 10 GLU . 6615 1 12 11 ILE . 6615 1 13 12 VAL . 6615 1 14 13 LYS . 6615 1 15 14 ASP . 6615 1 16 15 HIS . 6615 1 17 16 LEU . 6615 1 18 17 LEU . 6615 1 19 18 PRO . 6615 1 20 19 LYS . 6615 1 21 20 GLN . 6615 1 22 21 ILE . 6615 1 23 22 LYS . 6615 1 24 23 GLU . 6615 1 25 24 HIS . 6615 1 26 25 GLY . 6615 1 27 26 LEU . 6615 1 28 27 LYS . 6615 1 29 28 LYS . 6615 1 30 29 SER . 6615 1 31 30 ASN . 6615 1 32 31 LEU . 6615 1 33 32 GLN . 6615 1 34 33 LEU . 6615 1 35 34 ARG . 6615 1 36 35 ASP . 6615 1 37 36 GLN . 6615 1 38 37 ALA . 6615 1 39 38 ILE . 6615 1 40 39 LEU . 6615 1 41 40 ASP . 6615 1 42 41 ILE . 6615 1 43 42 ILE . 6615 1 44 43 ARG . 6615 1 45 44 TYR . 6615 1 46 45 TYR . 6615 1 47 46 THR . 6615 1 48 47 ARG . 6615 1 49 48 GLU . 6615 1 50 49 ALA . 6615 1 51 50 GLY . 6615 1 52 51 VAL . 6615 1 53 52 ARG . 6615 1 54 53 SER . 6615 1 55 54 LEU . 6615 1 56 55 GLU . 6615 1 57 56 ARG . 6615 1 58 57 GLN . 6615 1 59 58 LEU . 6615 1 60 59 ALA . 6615 1 61 60 ALA . 6615 1 62 61 ILE . 6615 1 63 62 CYS . 6615 1 64 63 ARG . 6615 1 65 64 LYS . 6615 1 66 65 ALA . 6615 1 67 66 ALA . 6615 1 68 67 LYS . 6615 1 69 68 ALA . 6615 1 70 69 ILE . 6615 1 71 70 VAL . 6615 1 72 71 ALA . 6615 1 73 72 GLU . 6615 1 74 73 GLU . 6615 1 75 74 ARG . 6615 1 76 75 LYS . 6615 1 77 76 ARG . 6615 1 78 77 ILE . 6615 1 79 78 THR . 6615 1 80 79 VAL . 6615 1 81 80 THR . 6615 1 82 81 GLU . 6615 1 83 82 LYS . 6615 1 84 83 ASN . 6615 1 85 84 LEU . 6615 1 86 85 GLN . 6615 1 87 86 ASP . 6615 1 88 87 PHE . 6615 1 89 88 ILE . 6615 1 90 89 GLY . 6615 1 91 90 LYS . 6615 1 92 91 ARG . 6615 1 93 92 ILE . 6615 1 94 93 PHE . 6615 1 95 94 ARG . 6615 1 96 95 TYR . 6615 1 97 96 GLY . 6615 1 98 97 GLN . 6615 1 99 98 ALA . 6615 1 100 99 GLU . 6615 1 101 100 THR . 6615 1 102 101 GLU . 6615 1 103 102 ASP . 6615 1 104 103 GLN . 6615 1 105 104 VAL . 6615 1 106 105 GLY . 6615 1 107 106 VAL . 6615 1 108 107 VAL . 6615 1 109 108 THR . 6615 1 110 109 GLY . 6615 1 111 110 LEU . 6615 1 112 111 ALA . 6615 1 113 112 TYR . 6615 1 114 113 THR . 6615 1 115 114 THR . 6615 1 116 115 VAL . 6615 1 117 116 LEU . 6615 1 118 117 ARG . 6615 1 119 118 HIS . 6615 1 120 119 HIS . 6615 1 121 120 HIS . 6615 1 122 121 HIS . 6615 1 123 122 HIS . 6615 1 124 123 HIS . 6615 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 6615 1 . ALA 2 2 6615 1 . GLY 3 3 6615 1 . TYR 4 4 6615 1 . THR 5 5 6615 1 . GLU 6 6 6615 1 . ILE 7 7 6615 1 . GLU 8 8 6615 1 . LYS 9 9 6615 1 . LEU 10 10 6615 1 . GLU 11 11 6615 1 . ILE 12 12 6615 1 . VAL 13 13 6615 1 . LYS 14 14 6615 1 . ASP 15 15 6615 1 . HIS 16 16 6615 1 . LEU 17 17 6615 1 . LEU 18 18 6615 1 . PRO 19 19 6615 1 . LYS 20 20 6615 1 . GLN 21 21 6615 1 . ILE 22 22 6615 1 . LYS 23 23 6615 1 . GLU 24 24 6615 1 . HIS 25 25 6615 1 . GLY 26 26 6615 1 . LEU 27 27 6615 1 . LYS 28 28 6615 1 . LYS 29 29 6615 1 . SER 30 30 6615 1 . ASN 31 31 6615 1 . LEU 32 32 6615 1 . GLN 33 33 6615 1 . LEU 34 34 6615 1 . ARG 35 35 6615 1 . ASP 36 36 6615 1 . GLN 37 37 6615 1 . ALA 38 38 6615 1 . ILE 39 39 6615 1 . LEU 40 40 6615 1 . ASP 41 41 6615 1 . ILE 42 42 6615 1 . ILE 43 43 6615 1 . ARG 44 44 6615 1 . TYR 45 45 6615 1 . TYR 46 46 6615 1 . THR 47 47 6615 1 . ARG 48 48 6615 1 . GLU 49 49 6615 1 . ALA 50 50 6615 1 . GLY 51 51 6615 1 . VAL 52 52 6615 1 . ARG 53 53 6615 1 . SER 54 54 6615 1 . LEU 55 55 6615 1 . GLU 56 56 6615 1 . ARG 57 57 6615 1 . GLN 58 58 6615 1 . LEU 59 59 6615 1 . ALA 60 60 6615 1 . ALA 61 61 6615 1 . ILE 62 62 6615 1 . CYS 63 63 6615 1 . ARG 64 64 6615 1 . LYS 65 65 6615 1 . ALA 66 66 6615 1 . ALA 67 67 6615 1 . LYS 68 68 6615 1 . ALA 69 69 6615 1 . ILE 70 70 6615 1 . VAL 71 71 6615 1 . ALA 72 72 6615 1 . GLU 73 73 6615 1 . GLU 74 74 6615 1 . ARG 75 75 6615 1 . LYS 76 76 6615 1 . ARG 77 77 6615 1 . ILE 78 78 6615 1 . THR 79 79 6615 1 . VAL 80 80 6615 1 . THR 81 81 6615 1 . GLU 82 82 6615 1 . LYS 83 83 6615 1 . ASN 84 84 6615 1 . LEU 85 85 6615 1 . GLN 86 86 6615 1 . ASP 87 87 6615 1 . PHE 88 88 6615 1 . ILE 89 89 6615 1 . GLY 90 90 6615 1 . LYS 91 91 6615 1 . ARG 92 92 6615 1 . ILE 93 93 6615 1 . PHE 94 94 6615 1 . ARG 95 95 6615 1 . TYR 96 96 6615 1 . GLY 97 97 6615 1 . GLN 98 98 6615 1 . ALA 99 99 6615 1 . GLU 100 100 6615 1 . THR 101 101 6615 1 . GLU 102 102 6615 1 . ASP 103 103 6615 1 . GLN 104 104 6615 1 . VAL 105 105 6615 1 . GLY 106 106 6615 1 . VAL 107 107 6615 1 . VAL 108 108 6615 1 . THR 109 109 6615 1 . GLY 110 110 6615 1 . LEU 111 111 6615 1 . ALA 112 112 6615 1 . TYR 113 113 6615 1 . THR 114 114 6615 1 . THR 115 115 6615 1 . VAL 116 116 6615 1 . LEU 117 117 6615 1 . ARG 118 118 6615 1 . HIS 119 119 6615 1 . HIS 120 120 6615 1 . HIS 121 121 6615 1 . HIS 122 122 6615 1 . HIS 123 123 6615 1 . HIS 124 124 6615 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 6615 _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 $Bacillus_subtilis_SSD_domain_polypeptide . 1423 organism . 'Bacillus subtilis' 'Bacillus subtilis' . . Eubacteria . Bacillus subtilis . . . . . . . . . . . . . . . . . . . . . 6615 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 1 $Bacillus_subtilis_SSD_domain_polypeptide . . . X76424 . . . . 6615 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 6615 _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 $Bacillus_subtilis_SSD_domain_polypeptide . 'obtained from a vendor' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6615 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6615 _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 BsLonSSD '[U-95% 13C; U-95% 15N]' . . 1 $Bacillus_subtilis_SSD_domain_polypeptide . . 1.5 . . mM 0.2 . . . 6615 1 2 D2O . . . . . . . 10 . . % . . . . 6615 1 3 'phosphate buffer' . . . . . . . 50 . . mM . . . . 6615 1 4 'sodium chloride' . . . . . . . 100 . . mM . . . . 6615 1 5 Argnine . . . . . . . 50 . . mM . . . . 6615 1 6 'glutamic acid' . . . . . . . 50 . . mM . . . . 6615 1 7 DTT . . . . . . . 5 . . mM . . . . 6615 1 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6615 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 5.8 0.1 pH 6615 1 temperature 310 0.5 K 6615 1 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 6615 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 6615 _NMR_spectrometer.ID 2 _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 6615 _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 1H15N_HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6615 1 2 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6615 1 3 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6615 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6615 1 5 CCCONH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6615 1 6 '3D 15N-NOESY spectra' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 6615 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6615 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 6615 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 6615 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 6615 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6615 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.2 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 isotropic 6615 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 ALA HA H 1 4.168 0.2 . 1 . . . . 1 ALA HA . 6615 1 2 . 1 1 2 2 ALA HB1 H 1 1.219 0.2 . 1 . . . . 1 ALA HB . 6615 1 3 . 1 1 2 2 ALA HB2 H 1 1.219 0.2 . 1 . . . . 1 ALA HB . 6615 1 4 . 1 1 2 2 ALA HB3 H 1 1.219 0.2 . 1 . . . . 1 ALA HB . 6615 1 5 . 1 1 2 2 ALA C C 13 177.041 0.2 . 1 . . . . 1 ALA C . 6615 1 6 . 1 1 2 2 ALA CA C 13 52.084 0.2 . 1 . . . . 1 ALA CA . 6615 1 7 . 1 1 2 2 ALA CB C 13 19.230 0.2 . 1 . . . . 1 ALA CB . 6615 1 8 . 1 1 2 2 ALA N N 15 126.648 0.2 . 1 . . . . 1 ALA N . 6615 1 9 . 1 1 3 3 GLY H H 1 6.740 0.2 . 1 . . . . 2 GLY H . 6615 1 10 . 1 1 3 3 GLY HA2 H 1 3.451 0.2 . 2 . . . . 2 GLY HA2 . 6615 1 11 . 1 1 3 3 GLY HA3 H 1 3.868 0.2 . 2 . . . . 2 GLY HA3 . 6615 1 12 . 1 1 3 3 GLY C C 13 173.179 0.2 . 1 . . . . 2 GLY C . 6615 1 13 . 1 1 3 3 GLY CA C 13 44.550 0.2 . 1 . . . . 2 GLY CA . 6615 1 14 . 1 1 3 3 GLY N N 15 105.378 0.2 . 1 . . . . 2 GLY N . 6615 1 15 . 1 1 4 4 TYR H H 1 7.868 0.2 . 1 . . . . 3 TYR H . 6615 1 16 . 1 1 4 4 TYR HA H 1 5.018 0.2 . 1 . . . . 3 TYR HA . 6615 1 17 . 1 1 4 4 TYR HB2 H 1 2.434 0.2 . 2 . . . . 3 TYR HB2 . 6615 1 18 . 1 1 4 4 TYR HB3 H 1 3.209 0.2 . 2 . . . . 3 TYR HB3 . 6615 1 19 . 1 1 4 4 TYR HD1 H 1 7.120 0.2 . 1 . . . . 3 TYR HD1 . 6615 1 20 . 1 1 4 4 TYR HD2 H 1 7.120 0.2 . 1 . . . . 3 TYR HD2 . 6615 1 21 . 1 1 4 4 TYR HE1 H 1 6.790 0.2 . 1 . . . . 3 TYR HE1 . 6615 1 22 . 1 1 4 4 TYR HE2 H 1 6.790 0.2 . 1 . . . . 3 TYR HE2 . 6615 1 23 . 1 1 4 4 TYR C C 13 177.440 0.2 . 1 . . . . 3 TYR C . 6615 1 24 . 1 1 4 4 TYR CA C 13 56.599 0.2 . 1 . . . . 3 TYR CA . 6615 1 25 . 1 1 4 4 TYR CB C 13 41.594 0.2 . 1 . . . . 3 TYR CB . 6615 1 26 . 1 1 4 4 TYR CD1 C 13 132.060 0.2 . 1 . . . . 3 TYR CD1 . 6615 1 27 . 1 1 4 4 TYR CD2 C 13 132.060 0.2 . 1 . . . . 3 TYR CD2 . 6615 1 28 . 1 1 4 4 TYR CE1 C 13 118.100 0.2 . 1 . . . . 3 TYR CE1 . 6615 1 29 . 1 1 4 4 TYR CE2 C 13 118.100 0.2 . 1 . . . . 3 TYR CE2 . 6615 1 30 . 1 1 4 4 TYR N N 15 119.161 0.2 . 1 . . . . 3 TYR N . 6615 1 31 . 1 1 5 5 THR H H 1 9.233 0.2 . 1 . . . . 4 THR H . 6615 1 32 . 1 1 5 5 THR HA H 1 4.714 0.2 . 1 . . . . 4 THR HA . 6615 1 33 . 1 1 5 5 THR HB H 1 4.473 0.2 . 1 . . . . 4 THR HB . 6615 1 34 . 1 1 5 5 THR HG21 H 1 1.340 0.2 . 1 . . . . 4 THR HG2 . 6615 1 35 . 1 1 5 5 THR HG22 H 1 1.340 0.2 . 1 . . . . 4 THR HG2 . 6615 1 36 . 1 1 5 5 THR HG23 H 1 1.340 0.2 . 1 . . . . 4 THR HG2 . 6615 1 37 . 1 1 5 5 THR C C 13 175.645 0.2 . 1 . . . . 4 THR C . 6615 1 38 . 1 1 5 5 THR CA C 13 60.860 0.2 . 1 . . . . 4 THR CA . 6615 1 39 . 1 1 5 5 THR CB C 13 70.760 0.2 . 1 . . . . 4 THR CB . 6615 1 40 . 1 1 5 5 THR CG2 C 13 21.660 0.2 . 1 . . . . 4 THR CG2 . 6615 1 41 . 1 1 5 5 THR N N 15 113.939 0.2 . 1 . . . . 4 THR N . 6615 1 42 . 1 1 6 6 GLU H H 1 8.868 0.2 . 1 . . . . 5 GLU H . 6615 1 43 . 1 1 6 6 GLU HA H 1 3.801 0.2 . 1 . . . . 5 GLU HA . 6615 1 44 . 1 1 6 6 GLU HB2 H 1 1.968 0.2 . 2 . . . . 5 GLU HB2 . 6615 1 45 . 1 1 6 6 GLU HB3 H 1 2.094 0.2 . 2 . . . . 5 GLU HB3 . 6615 1 46 . 1 1 6 6 GLU HG2 H 1 2.290 0.2 . 1 . . . . 5 GLU HG2 . 6615 1 47 . 1 1 6 6 GLU HG3 H 1 2.290 0.2 . 1 . . . . 5 GLU HG3 . 6615 1 48 . 1 1 6 6 GLU C C 13 177.728 0.2 . 1 . . . . 5 GLU C . 6615 1 49 . 1 1 6 6 GLU CA C 13 60.770 0.2 . 1 . . . . 5 GLU CA . 6615 1 50 . 1 1 6 6 GLU CB C 13 29.633 0.2 . 1 . . . . 5 GLU CB . 6615 1 51 . 1 1 6 6 GLU CG C 13 37.180 0.2 . 1 . . . . 5 GLU CG . 6615 1 52 . 1 1 6 6 GLU N N 15 120.487 0.2 . 1 . . . . 5 GLU N . 6615 1 53 . 1 1 7 7 ILE H H 1 7.637 0.2 . 1 . . . . 6 ILE H . 6615 1 54 . 1 1 7 7 ILE HA H 1 3.846 0.2 . 1 . . . . 6 ILE HA . 6615 1 55 . 1 1 7 7 ILE HB H 1 1.812 0.2 . 1 . . . . 6 ILE HB . 6615 1 56 . 1 1 7 7 ILE HG12 H 1 1.500 0.2 . 1 . . . . 6 ILE HG12 . 6615 1 57 . 1 1 7 7 ILE HG13 H 1 1.350 0.2 . 1 . . . . 6 ILE HG13 . 6615 1 58 . 1 1 7 7 ILE HG21 H 1 0.910 0.2 . 1 . . . . 6 ILE HG2 . 6615 1 59 . 1 1 7 7 ILE HG22 H 1 0.910 0.2 . 1 . . . . 6 ILE HG2 . 6615 1 60 . 1 1 7 7 ILE HG23 H 1 0.910 0.2 . 1 . . . . 6 ILE HG2 . 6615 1 61 . 1 1 7 7 ILE HD11 H 1 0.850 0.2 . 1 . . . . 6 ILE HD1 . 6615 1 62 . 1 1 7 7 ILE HD12 H 1 0.850 0.2 . 1 . . . . 6 ILE HD1 . 6615 1 63 . 1 1 7 7 ILE HD13 H 1 0.850 0.2 . 1 . . . . 6 ILE HD1 . 6615 1 64 . 1 1 7 7 ILE C C 13 178.362 0.2 . 1 . . . . 6 ILE C . 6615 1 65 . 1 1 7 7 ILE CA C 13 63.152 0.2 . 1 . . . . 6 ILE CA . 6615 1 66 . 1 1 7 7 ILE CB C 13 37.141 0.2 . 1 . . . . 6 ILE CB . 6615 1 67 . 1 1 7 7 ILE CG1 C 13 28.410 0.2 . 1 . . . . 6 ILE CG1 . 6615 1 68 . 1 1 7 7 ILE CG2 C 13 17.550 0.2 . 1 . . . . 6 ILE CG2 . 6615 1 69 . 1 1 7 7 ILE CD1 C 13 12.020 0.2 . 1 . . . . 6 ILE CD1 . 6615 1 70 . 1 1 7 7 ILE N N 15 116.045 0.2 . 1 . . . . 6 ILE N . 6615 1 71 . 1 1 8 8 GLU H H 1 7.448 0.2 . 1 . . . . 7 GLU H . 6615 1 72 . 1 1 8 8 GLU HA H 1 3.985 0.2 . 1 . . . . 7 GLU HA . 6615 1 73 . 1 1 8 8 GLU HB2 H 1 1.845 0.2 . 2 . . . . 7 GLU HB2 . 6615 1 74 . 1 1 8 8 GLU HB3 H 1 2.453 0.2 . 2 . . . . 7 GLU HB3 . 6615 1 75 . 1 1 8 8 GLU HG2 H 1 2.280 0.2 . 2 . . . . 7 GLU HG2 . 6615 1 76 . 1 1 8 8 GLU HG3 H 1 2.390 0.2 . 2 . . . . 7 GLU HG3 . 6615 1 77 . 1 1 8 8 GLU C C 13 179.927 0.2 . 1 . . . . 7 GLU C . 6615 1 78 . 1 1 8 8 GLU CA C 13 59.023 0.2 . 1 . . . . 7 GLU CA . 6615 1 79 . 1 1 8 8 GLU CB C 13 29.868 0.2 . 1 . . . . 7 GLU CB . 6615 1 80 . 1 1 8 8 GLU CG C 13 37.490 0.2 . 1 . . . . 7 GLU CG . 6615 1 81 . 1 1 8 8 GLU N N 15 121.346 0.2 . 1 . . . . 7 GLU N . 6615 1 82 . 1 1 9 9 LYS H H 1 8.334 0.2 . 1 . . . . 8 LYS H . 6615 1 83 . 1 1 9 9 LYS HA H 1 3.551 0.2 . 1 . . . . 8 LYS HA . 6615 1 84 . 1 1 9 9 LYS HB2 H 1 1.314 0.2 . 1 . . . . 8 LYS HB2 . 6615 1 85 . 1 1 9 9 LYS HB3 H 1 1.314 0.2 . 1 . . . . 8 LYS HB3 . 6615 1 86 . 1 1 9 9 LYS HG2 H 1 0.700 0.2 . 2 . . . . 8 LYS HG2 . 6615 1 87 . 1 1 9 9 LYS HG3 H 1 0.810 0.2 . 2 . . . . 8 LYS HG3 . 6615 1 88 . 1 1 9 9 LYS HD2 H 1 2.040 0.2 . 1 . . . . 8 LYS HD2 . 6615 1 89 . 1 1 9 9 LYS HD3 H 1 2.040 0.2 . 1 . . . . 8 LYS HD3 . 6615 1 90 . 1 1 9 9 LYS C C 13 177.615 0.2 . 1 . . . . 8 LYS C . 6615 1 91 . 1 1 9 9 LYS CA C 13 60.557 0.2 . 1 . . . . 8 LYS CA . 6615 1 92 . 1 1 9 9 LYS CB C 13 33.768 0.2 . 1 . . . . 8 LYS CB . 6615 1 93 . 1 1 9 9 LYS N N 15 117.950 0.2 . 1 . . . . 8 LYS N . 6615 1 94 . 1 1 10 10 LEU H H 1 8.059 0.2 . 1 . . . . 9 LEU H . 6615 1 95 . 1 1 10 10 LEU HA H 1 3.730 0.2 . 1 . . . . 9 LEU HA . 6615 1 96 . 1 1 10 10 LEU HB2 H 1 1.426 0.2 . 2 . . . . 9 LEU HB2 . 6615 1 97 . 1 1 10 10 LEU HB3 H 1 2.064 0.2 . 2 . . . . 9 LEU HB3 . 6615 1 98 . 1 1 10 10 LEU HG H 1 1.500 0.2 . 1 . . . . 9 LEU HG . 6615 1 99 . 1 1 10 10 LEU HD11 H 1 0.840 0.2 . 1 . . . . 9 LEU HD1 . 6615 1 100 . 1 1 10 10 LEU HD12 H 1 0.840 0.2 . 1 . . . . 9 LEU HD1 . 6615 1 101 . 1 1 10 10 LEU HD13 H 1 0.840 0.2 . 1 . . . . 9 LEU HD1 . 6615 1 102 . 1 1 10 10 LEU HD21 H 1 0.840 0.2 . 1 . . . . 9 LEU HD2 . 6615 1 103 . 1 1 10 10 LEU HD22 H 1 0.840 0.2 . 1 . . . . 9 LEU HD2 . 6615 1 104 . 1 1 10 10 LEU HD23 H 1 0.840 0.2 . 1 . . . . 9 LEU HD2 . 6615 1 105 . 1 1 10 10 LEU C C 13 177.788 0.2 . 1 . . . . 9 LEU C . 6615 1 106 . 1 1 10 10 LEU CA C 13 59.017 0.2 . 1 . . . . 9 LEU CA . 6615 1 107 . 1 1 10 10 LEU CB C 13 41.600 0.2 . 1 . . . . 9 LEU CB . 6615 1 108 . 1 1 10 10 LEU CG C 13 26.840 0.2 . 1 . . . . 9 LEU CG . 6615 1 109 . 1 1 10 10 LEU CD1 C 13 25.190 0.2 . 1 . . . . 9 LEU CD1 . 6615 1 110 . 1 1 10 10 LEU CD2 C 13 25.190 0.2 . 1 . . . . 9 LEU CD2 . 6615 1 111 . 1 1 10 10 LEU N N 15 120.332 0.2 . 1 . . . . 9 LEU N . 6615 1 112 . 1 1 11 11 GLU H H 1 7.479 0.2 . 1 . . . . 10 GLU H . 6615 1 113 . 1 1 11 11 GLU HA H 1 3.909 0.2 . 1 . . . . 10 GLU HA . 6615 1 114 . 1 1 11 11 GLU HB2 H 1 2.083 0.2 . 1 . . . . 10 GLU HB2 . 6615 1 115 . 1 1 11 11 GLU HB3 H 1 2.083 0.2 . 1 . . . . 10 GLU HB3 . 6615 1 116 . 1 1 11 11 GLU HG2 H 1 2.250 0.2 . 2 . . . . 10 GLU HG2 . 6615 1 117 . 1 1 11 11 GLU HG3 H 1 2.420 0.2 . 2 . . . . 10 GLU HG3 . 6615 1 118 . 1 1 11 11 GLU C C 13 178.332 0.2 . 1 . . . . 10 GLU C . 6615 1 119 . 1 1 11 11 GLU CA C 13 59.378 0.2 . 1 . . . . 10 GLU CA . 6615 1 120 . 1 1 11 11 GLU CB C 13 28.707 0.2 . 1 . . . . 10 GLU CB . 6615 1 121 . 1 1 11 11 GLU CG C 13 35.350 0.2 . 1 . . . . 10 GLU CG . 6615 1 122 . 1 1 11 11 GLU N N 15 117.505 0.2 . 1 . . . . 10 GLU N . 6615 1 123 . 1 1 12 12 ILE H H 1 8.083 0.2 . 1 . . . . 11 ILE H . 6615 1 124 . 1 1 12 12 ILE HA H 1 3.739 0.2 . 1 . . . . 11 ILE HA . 6615 1 125 . 1 1 12 12 ILE HB H 1 1.759 0.2 . 1 . . . . 11 ILE HB . 6615 1 126 . 1 1 12 12 ILE HG12 H 1 0.880 0.2 . 1 . . . . 11 ILE HG12 . 6615 1 127 . 1 1 12 12 ILE HG13 H 1 1.630 0.2 . 1 . . . . 11 ILE HG13 . 6615 1 128 . 1 1 12 12 ILE HG21 H 1 0.850 0.2 . 1 . . . . 11 ILE HG2 . 6615 1 129 . 1 1 12 12 ILE HG22 H 1 0.850 0.2 . 1 . . . . 11 ILE HG2 . 6615 1 130 . 1 1 12 12 ILE HG23 H 1 0.850 0.2 . 1 . . . . 11 ILE HG2 . 6615 1 131 . 1 1 12 12 ILE HD11 H 1 0.160 0.2 . 1 . . . . 11 ILE HD1 . 6615 1 132 . 1 1 12 12 ILE HD12 H 1 0.160 0.2 . 1 . . . . 11 ILE HD1 . 6615 1 133 . 1 1 12 12 ILE HD13 H 1 0.160 0.2 . 1 . . . . 11 ILE HD1 . 6615 1 134 . 1 1 12 12 ILE C C 13 180.368 0.2 . 1 . . . . 11 ILE C . 6615 1 135 . 1 1 12 12 ILE CA C 13 65.226 0.2 . 1 . . . . 11 ILE CA . 6615 1 136 . 1 1 12 12 ILE CB C 13 37.987 0.2 . 1 . . . . 11 ILE CB . 6615 1 137 . 1 1 12 12 ILE CG1 C 13 29.680 0.2 . 1 . . . . 11 ILE CG1 . 6615 1 138 . 1 1 12 12 ILE CG2 C 13 17.260 0.2 . 1 . . . . 11 ILE CG2 . 6615 1 139 . 1 1 12 12 ILE CD1 C 13 12.860 0.2 . 1 . . . . 11 ILE CD1 . 6615 1 140 . 1 1 12 12 ILE N N 15 120.239 0.2 . 1 . . . . 11 ILE N . 6615 1 141 . 1 1 13 13 VAL H H 1 8.725 0.2 . 1 . . . . 12 VAL H . 6615 1 142 . 1 1 13 13 VAL HA H 1 3.446 0.2 . 1 . . . . 12 VAL HA . 6615 1 143 . 1 1 13 13 VAL HB H 1 2.459 0.2 . 1 . . . . 12 VAL HB . 6615 1 144 . 1 1 13 13 VAL HG11 H 1 0.860 0.2 . 1 . . . . 12 VAL HG1 . 6615 1 145 . 1 1 13 13 VAL HG12 H 1 0.860 0.2 . 1 . . . . 12 VAL HG1 . 6615 1 146 . 1 1 13 13 VAL HG13 H 1 0.860 0.2 . 1 . . . . 12 VAL HG1 . 6615 1 147 . 1 1 13 13 VAL HG21 H 1 1.060 0.2 . 1 . . . . 12 VAL HG2 . 6615 1 148 . 1 1 13 13 VAL HG22 H 1 1.060 0.2 . 1 . . . . 12 VAL HG2 . 6615 1 149 . 1 1 13 13 VAL HG23 H 1 1.060 0.2 . 1 . . . . 12 VAL HG2 . 6615 1 150 . 1 1 13 13 VAL C C 13 176.576 0.2 . 1 . . . . 12 VAL C . 6615 1 151 . 1 1 13 13 VAL CA C 13 67.707 0.2 . 1 . . . . 12 VAL CA . 6615 1 152 . 1 1 13 13 VAL CB C 13 31.027 0.2 . 1 . . . . 12 VAL CB . 6615 1 153 . 1 1 13 13 VAL CG1 C 13 22.730 0.2 . 1 . . . . 12 VAL CG1 . 6615 1 154 . 1 1 13 13 VAL CG2 C 13 25.000 0.2 . 1 . . . . 12 VAL CG2 . 6615 1 155 . 1 1 13 13 VAL N N 15 122.063 0.2 . 1 . . . . 12 VAL N . 6615 1 156 . 1 1 14 14 LYS H H 1 8.011 0.2 . 1 . . . . 13 LYS H . 6615 1 157 . 1 1 14 14 LYS HA H 1 3.769 0.2 . 1 . . . . 13 LYS HA . 6615 1 158 . 1 1 14 14 LYS HB2 H 1 1.660 0.2 . 2 . . . . 13 LYS HB2 . 6615 1 159 . 1 1 14 14 LYS HB3 H 1 1.810 0.2 . 2 . . . . 13 LYS HB3 . 6615 1 160 . 1 1 14 14 LYS HG2 H 1 1.300 0.2 . 1 . . . . 13 LYS HG2 . 6615 1 161 . 1 1 14 14 LYS HG3 H 1 1.300 0.2 . 1 . . . . 13 LYS HG3 . 6615 1 162 . 1 1 14 14 LYS HD2 H 1 1.600 0.2 . 1 . . . . 13 LYS HD2 . 6615 1 163 . 1 1 14 14 LYS HD3 H 1 1.600 0.2 . 1 . . . . 13 LYS HD3 . 6615 1 164 . 1 1 14 14 LYS C C 13 178.291 0.2 . 1 . . . . 13 LYS C . 6615 1 165 . 1 1 14 14 LYS CA C 13 60.189 0.2 . 1 . . . . 13 LYS CA . 6615 1 166 . 1 1 14 14 LYS CB C 13 32.055 0.2 . 1 . . . . 13 LYS CB . 6615 1 167 . 1 1 14 14 LYS CG C 13 26.030 0.2 . 1 . . . . 13 LYS CG . 6615 1 168 . 1 1 14 14 LYS CD C 13 29.030 0.2 . 1 . . . . 13 LYS CD . 6615 1 169 . 1 1 14 14 LYS CE C 13 41.430 0.2 . 1 . . . . 13 LYS CE . 6615 1 170 . 1 1 14 14 LYS N N 15 116.606 0.2 . 1 . . . . 13 LYS N . 6615 1 171 . 1 1 15 15 ASP H H 1 8.494 0.2 . 1 . . . . 14 ASP H . 6615 1 172 . 1 1 15 15 ASP HA H 1 4.549 0.2 . 1 . . . . 14 ASP HA . 6615 1 173 . 1 1 15 15 ASP HB2 H 1 2.257 0.2 . 2 . . . . 14 ASP HB2 . 6615 1 174 . 1 1 15 15 ASP HB3 H 1 2.548 0.2 . 2 . . . . 14 ASP HB3 . 6615 1 175 . 1 1 15 15 ASP C C 13 176.831 0.2 . 1 . . . . 14 ASP C . 6615 1 176 . 1 1 15 15 ASP CA C 13 55.564 0.2 . 1 . . . . 14 ASP CA . 6615 1 177 . 1 1 15 15 ASP CB C 13 41.100 0.2 . 1 . . . . 14 ASP CB . 6615 1 178 . 1 1 15 15 ASP N N 15 113.792 0.2 . 1 . . . . 14 ASP N . 6615 1 179 . 1 1 16 16 HIS H H 1 7.670 0.2 . 1 . . . . 15 HIS H . 6615 1 180 . 1 1 16 16 HIS HA H 1 4.956 0.2 . 1 . . . . 15 HIS HA . 6615 1 181 . 1 1 16 16 HIS HB2 H 1 3.216 0.2 . 1 . . . . 15 HIS HB2 . 6615 1 182 . 1 1 16 16 HIS HB3 H 1 3.216 0.2 . 1 . . . . 15 HIS HB3 . 6615 1 183 . 1 1 16 16 HIS HD2 H 1 6.820 0.2 . 1 . . . . 15 HIS HD2 . 6615 1 184 . 1 1 16 16 HIS HE1 H 1 7.830 0.2 . 1 . . . . 15 HIS HE1 . 6615 1 185 . 1 1 16 16 HIS C C 13 175.967 0.2 . 1 . . . . 15 HIS C . 6615 1 186 . 1 1 16 16 HIS CA C 13 57.363 0.2 . 1 . . . . 15 HIS CA . 6615 1 187 . 1 1 16 16 HIS CB C 13 32.311 0.2 . 1 . . . . 15 HIS CB . 6615 1 188 . 1 1 16 16 HIS CD2 C 13 132.960 0.2 . 1 . . . . 15 HIS CD2 . 6615 1 189 . 1 1 16 16 HIS CE1 C 13 138.230 0.2 . 1 . . . . 15 HIS CE1 . 6615 1 190 . 1 1 16 16 HIS N N 15 113.639 0.2 . 1 . . . . 15 HIS N . 6615 1 191 . 1 1 17 17 LEU H H 1 8.640 0.2 . 1 . . . . 16 LEU H . 6615 1 192 . 1 1 17 17 LEU HA H 1 4.028 0.2 . 1 . . . . 16 LEU HA . 6615 1 193 . 1 1 17 17 LEU HB2 H 1 1.403 0.2 . 2 . . . . 16 LEU HB2 . 6615 1 194 . 1 1 17 17 LEU HB3 H 1 1.691 0.2 . 2 . . . . 16 LEU HB3 . 6615 1 195 . 1 1 17 17 LEU HG H 1 1.690 0.2 . 1 . . . . 16 LEU HG . 6615 1 196 . 1 1 17 17 LEU HD11 H 1 0.790 0.2 . 1 . . . . 16 LEU HD1 . 6615 1 197 . 1 1 17 17 LEU HD12 H 1 0.790 0.2 . 1 . . . . 16 LEU HD1 . 6615 1 198 . 1 1 17 17 LEU HD13 H 1 0.790 0.2 . 1 . . . . 16 LEU HD1 . 6615 1 199 . 1 1 17 17 LEU HD21 H 1 0.790 0.2 . 1 . . . . 16 LEU HD2 . 6615 1 200 . 1 1 17 17 LEU HD22 H 1 0.790 0.2 . 1 . . . . 16 LEU HD2 . 6615 1 201 . 1 1 17 17 LEU HD23 H 1 0.790 0.2 . 1 . . . . 16 LEU HD2 . 6615 1 202 . 1 1 17 17 LEU C C 13 177.999 0.2 . 1 . . . . 16 LEU C . 6615 1 203 . 1 1 17 17 LEU CA C 13 58.430 0.2 . 1 . . . . 16 LEU CA . 6615 1 204 . 1 1 17 17 LEU CB C 13 43.892 0.2 . 1 . . . . 16 LEU CB . 6615 1 205 . 1 1 17 17 LEU CG C 13 26.250 0.2 . 1 . . . . 16 LEU CG . 6615 1 206 . 1 1 17 17 LEU CD1 C 13 25.070 0.2 . 1 . . . . 16 LEU CD1 . 6615 1 207 . 1 1 17 17 LEU CD2 C 13 25.070 0.2 . 1 . . . . 16 LEU CD2 . 6615 1 208 . 1 1 17 17 LEU N N 15 119.523 0.2 . 1 . . . . 16 LEU N . 6615 1 209 . 1 1 18 18 LEU H H 1 9.684 0.2 . 1 . . . . 17 LEU H . 6615 1 210 . 1 1 18 18 LEU HA H 1 4.250 0.2 . 1 . . . . 17 LEU HA . 6615 1 211 . 1 1 18 18 LEU HB2 H 1 2.150 0.2 . 1 . . . . 17 LEU HB2 . 6615 1 212 . 1 1 18 18 LEU HB3 H 1 2.150 0.2 . 1 . . . . 17 LEU HB3 . 6615 1 213 . 1 1 18 18 LEU HG H 1 1.150 0.2 . 1 . . . . 17 LEU HG . 6615 1 214 . 1 1 18 18 LEU HD11 H 1 0.860 0.2 . 1 . . . . 17 LEU HD1 . 6615 1 215 . 1 1 18 18 LEU HD12 H 1 0.860 0.2 . 1 . . . . 17 LEU HD1 . 6615 1 216 . 1 1 18 18 LEU HD13 H 1 0.860 0.2 . 1 . . . . 17 LEU HD1 . 6615 1 217 . 1 1 18 18 LEU HD21 H 1 0.690 0.2 . 1 . . . . 17 LEU HD2 . 6615 1 218 . 1 1 18 18 LEU HD22 H 1 0.690 0.2 . 1 . . . . 17 LEU HD2 . 6615 1 219 . 1 1 18 18 LEU HD23 H 1 0.690 0.2 . 1 . . . . 17 LEU HD2 . 6615 1 220 . 1 1 18 18 LEU CA C 13 59.040 0.2 . 1 . . . . 17 LEU CA . 6615 1 221 . 1 1 18 18 LEU CB C 13 39.330 0.2 . 1 . . . . 17 LEU CB . 6615 1 222 . 1 1 18 18 LEU N N 15 118.388 0.2 . 1 . . . . 17 LEU N . 6615 1 223 . 1 1 19 19 PRO HA H 1 4.053 0.2 . 1 . . . . 18 PRO HA . 6615 1 224 . 1 1 19 19 PRO HB2 H 1 1.745 0.2 . 2 . . . . 18 PRO HB2 . 6615 1 225 . 1 1 19 19 PRO HB3 H 1 2.260 0.2 . 2 . . . . 18 PRO HB3 . 6615 1 226 . 1 1 19 19 PRO HG2 H 1 1.840 0.2 . 2 . . . . 18 PRO HG2 . 6615 1 227 . 1 1 19 19 PRO HG3 H 1 1.910 0.2 . 2 . . . . 18 PRO HG3 . 6615 1 228 . 1 1 19 19 PRO HD2 H 1 3.230 0.2 . 2 . . . . 18 PRO HD2 . 6615 1 229 . 1 1 19 19 PRO HD3 H 1 3.650 0.2 . 2 . . . . 18 PRO HD3 . 6615 1 230 . 1 1 19 19 PRO C C 13 178.934 0.2 . 1 . . . . 18 PRO C . 6615 1 231 . 1 1 19 19 PRO CA C 13 66.311 0.2 . 1 . . . . 18 PRO CA . 6615 1 232 . 1 1 19 19 PRO CB C 13 30.502 0.2 . 1 . . . . 18 PRO CB . 6615 1 233 . 1 1 19 19 PRO CG C 13 28.210 0.2 . 1 . . . . 18 PRO CG . 6615 1 234 . 1 1 19 19 PRO CD C 13 49.260 0.2 . 1 . . . . 18 PRO CD . 6615 1 235 . 1 1 20 20 LYS H H 1 7.170 0.2 . 1 . . . . 19 LYS H . 6615 1 236 . 1 1 20 20 LYS HA H 1 4.030 0.2 . 1 . . . . 19 LYS HA . 6615 1 237 . 1 1 20 20 LYS HB2 H 1 1.910 0.2 . 1 . . . . 19 LYS HB2 . 6615 1 238 . 1 1 20 20 LYS HB3 H 1 1.910 0.2 . 1 . . . . 19 LYS HB3 . 6615 1 239 . 1 1 20 20 LYS HG2 H 1 1.160 0.2 . 2 . . . . 19 LYS HG2 . 6615 1 240 . 1 1 20 20 LYS HG3 H 1 1.450 0.2 . 2 . . . . 19 LYS HG3 . 6615 1 241 . 1 1 20 20 LYS HD2 H 1 0.760 0.2 . 1 . . . . 19 LYS HD2 . 6615 1 242 . 1 1 20 20 LYS HD3 H 1 0.760 0.2 . 1 . . . . 19 LYS HD3 . 6615 1 243 . 1 1 20 20 LYS HE2 H 1 3.240 0.2 . 1 . . . . 19 LYS HE2 . 6615 1 244 . 1 1 20 20 LYS HE3 H 1 3.240 0.2 . 1 . . . . 19 LYS HE3 . 6615 1 245 . 1 1 20 20 LYS C C 13 178.434 0.2 . 1 . . . . 19 LYS C . 6615 1 246 . 1 1 20 20 LYS CA C 13 59.521 0.2 . 1 . . . . 19 LYS CA . 6615 1 247 . 1 1 20 20 LYS CB C 13 32.680 0.2 . 1 . . . . 19 LYS CB . 6615 1 248 . 1 1 20 20 LYS CG C 13 24.620 0.2 . 1 . . . . 19 LYS CG . 6615 1 249 . 1 1 20 20 LYS CD C 13 30.010 0.2 . 1 . . . . 19 LYS CD . 6615 1 250 . 1 1 20 20 LYS CE C 13 42.120 0.2 . 1 . . . . 19 LYS CE . 6615 1 251 . 1 1 20 20 LYS N N 15 116.605 0.2 . 1 . . . . 19 LYS N . 6615 1 252 . 1 1 21 21 GLN H H 1 8.122 0.2 . 1 . . . . 20 GLN H . 6615 1 253 . 1 1 21 21 GLN HA H 1 4.094 0.2 . 1 . . . . 20 GLN HA . 6615 1 254 . 1 1 21 21 GLN HB2 H 1 1.828 0.2 . 2 . . . . 20 GLN HB2 . 6615 1 255 . 1 1 21 21 GLN HB3 H 1 2.465 0.2 . 2 . . . . 20 GLN HB3 . 6615 1 256 . 1 1 21 21 GLN HG2 H 1 2.620 0.2 . 1 . . . . 20 GLN HG2 . 6615 1 257 . 1 1 21 21 GLN HG3 H 1 2.620 0.2 . 1 . . . . 20 GLN HG3 . 6615 1 258 . 1 1 21 21 GLN HE21 H 1 6.710 0.2 . 2 . . . . 20 GLN HE21 . 6615 1 259 . 1 1 21 21 GLN HE22 H 1 6.750 0.2 . 2 . . . . 20 GLN HE22 . 6615 1 260 . 1 1 21 21 GLN C C 13 179.730 0.2 . 1 . . . . 20 GLN C . 6615 1 261 . 1 1 21 21 GLN CA C 13 58.024 0.2 . 1 . . . . 20 GLN CA . 6615 1 262 . 1 1 21 21 GLN CB C 13 28.131 0.2 . 1 . . . . 20 GLN CB . 6615 1 263 . 1 1 21 21 GLN CG C 13 33.090 0.2 . 1 . . . . 20 GLN CG . 6615 1 264 . 1 1 21 21 GLN N N 15 118.190 0.2 . 1 . . . . 20 GLN N . 6615 1 265 . 1 1 21 21 GLN NE2 N 15 107.100 0.2 . 1 . . . . 20 GLN NE2 . 6615 1 266 . 1 1 22 22 ILE H H 1 8.900 0.2 . 1 . . . . 21 ILE H . 6615 1 267 . 1 1 22 22 ILE HA H 1 3.546 0.2 . 1 . . . . 21 ILE HA . 6615 1 268 . 1 1 22 22 ILE HB H 1 1.902 0.2 . 1 . . . . 21 ILE HB . 6615 1 269 . 1 1 22 22 ILE HG12 H 1 1.660 0.2 . 1 . . . . 21 ILE HG12 . 6615 1 270 . 1 1 22 22 ILE HG13 H 1 1.660 0.2 . 1 . . . . 21 ILE HG13 . 6615 1 271 . 1 1 22 22 ILE HG21 H 1 0.600 0.2 . 1 . . . . 21 ILE HG2 . 6615 1 272 . 1 1 22 22 ILE HG22 H 1 0.600 0.2 . 1 . . . . 21 ILE HG2 . 6615 1 273 . 1 1 22 22 ILE HG23 H 1 0.600 0.2 . 1 . . . . 21 ILE HG2 . 6615 1 274 . 1 1 22 22 ILE HD11 H 1 0.740 0.2 . 1 . . . . 21 ILE HD1 . 6615 1 275 . 1 1 22 22 ILE HD12 H 1 0.740 0.2 . 1 . . . . 21 ILE HD1 . 6615 1 276 . 1 1 22 22 ILE HD13 H 1 0.740 0.2 . 1 . . . . 21 ILE HD1 . 6615 1 277 . 1 1 22 22 ILE C C 13 177.460 0.2 . 1 . . . . 21 ILE C . 6615 1 278 . 1 1 22 22 ILE CA C 13 66.543 0.2 . 1 . . . . 21 ILE CA . 6615 1 279 . 1 1 22 22 ILE CB C 13 37.573 0.2 . 1 . . . . 21 ILE CB . 6615 1 280 . 1 1 22 22 ILE CG1 C 13 31.060 0.2 . 1 . . . . 21 ILE CG1 . 6615 1 281 . 1 1 22 22 ILE CG2 C 13 17.000 0.2 . 1 . . . . 21 ILE CG2 . 6615 1 282 . 1 1 22 22 ILE CD1 C 13 13.830 0.2 . 1 . . . . 21 ILE CD1 . 6615 1 283 . 1 1 22 22 ILE N N 15 123.541 0.2 . 1 . . . . 21 ILE N . 6615 1 284 . 1 1 23 23 LYS H H 1 7.489 0.2 . 1 . . . . 22 LYS H . 6615 1 285 . 1 1 23 23 LYS HA H 1 4.134 0.2 . 1 . . . . 22 LYS HA . 6615 1 286 . 1 1 23 23 LYS HB2 H 1 1.962 0.2 . 1 . . . . 22 LYS HB2 . 6615 1 287 . 1 1 23 23 LYS HB3 H 1 1.962 0.2 . 1 . . . . 22 LYS HB3 . 6615 1 288 . 1 1 23 23 LYS HG2 H 1 1.440 0.2 . 2 . . . . 22 LYS HG2 . 6615 1 289 . 1 1 23 23 LYS HG3 H 1 1.500 0.2 . 2 . . . . 22 LYS HG3 . 6615 1 290 . 1 1 23 23 LYS HD2 H 1 1.200 0.2 . 1 . . . . 22 LYS HD2 . 6615 1 291 . 1 1 23 23 LYS HD3 H 1 1.200 0.2 . 1 . . . . 22 LYS HD3 . 6615 1 292 . 1 1 23 23 LYS C C 13 181.115 0.2 . 1 . . . . 22 LYS C . 6615 1 293 . 1 1 23 23 LYS CA C 13 59.420 0.2 . 1 . . . . 22 LYS CA . 6615 1 294 . 1 1 23 23 LYS CB C 13 32.061 0.2 . 1 . . . . 22 LYS CB . 6615 1 295 . 1 1 23 23 LYS CG C 13 24.600 0.2 . 1 . . . . 22 LYS CG . 6615 1 296 . 1 1 23 23 LYS CD C 13 29.140 0.2 . 1 . . . . 22 LYS CD . 6615 1 297 . 1 1 23 23 LYS CE C 13 41.900 0.2 . 1 . . . . 22 LYS CE . 6615 1 298 . 1 1 23 23 LYS N N 15 120.255 0.2 . 1 . . . . 22 LYS N . 6615 1 299 . 1 1 24 24 GLU H H 1 8.510 0.2 . 1 . . . . 23 GLU H . 6615 1 300 . 1 1 24 24 GLU HA H 1 3.968 0.2 . 1 . . . . 23 GLU HA . 6615 1 301 . 1 1 24 24 GLU HB2 H 1 1.840 0.2 . 2 . . . . 23 GLU HB2 . 6615 1 302 . 1 1 24 24 GLU HB3 H 1 1.890 0.2 . 2 . . . . 23 GLU HB3 . 6615 1 303 . 1 1 24 24 GLU HG2 H 1 2.100 0.2 . 2 . . . . 23 GLU HG2 . 6615 1 304 . 1 1 24 24 GLU HG3 H 1 2.210 0.2 . 2 . . . . 23 GLU HG3 . 6615 1 305 . 1 1 24 24 GLU C C 13 177.245 0.2 . 1 . . . . 23 GLU C . 6615 1 306 . 1 1 24 24 GLU CA C 13 58.483 0.2 . 1 . . . . 23 GLU CA . 6615 1 307 . 1 1 24 24 GLU CB C 13 29.360 0.2 . 1 . . . . 23 GLU CB . 6615 1 308 . 1 1 24 24 GLU CG C 13 36.120 0.2 . 1 . . . . 23 GLU CG . 6615 1 309 . 1 1 24 24 GLU N N 15 119.198 0.2 . 1 . . . . 23 GLU N . 6615 1 310 . 1 1 25 25 HIS H H 1 7.322 0.2 . 1 . . . . 24 HIS H . 6615 1 311 . 1 1 25 25 HIS HA H 1 4.495 0.2 . 1 . . . . 24 HIS HA . 6615 1 312 . 1 1 25 25 HIS HB2 H 1 2.541 0.2 . 2 . . . . 24 HIS HB2 . 6615 1 313 . 1 1 25 25 HIS HB3 H 1 3.464 0.2 . 2 . . . . 24 HIS HB3 . 6615 1 314 . 1 1 25 25 HIS HD2 H 1 7.170 0.2 . 1 . . . . 24 HIS HD2 . 6615 1 315 . 1 1 25 25 HIS HE1 H 1 8.130 0.2 . 1 . . . . 24 HIS HE1 . 6615 1 316 . 1 1 25 25 HIS C C 13 174.117 0.2 . 1 . . . . 24 HIS C . 6615 1 317 . 1 1 25 25 HIS CA C 13 57.547 0.2 . 1 . . . . 24 HIS CA . 6615 1 318 . 1 1 25 25 HIS CB C 13 28.625 0.2 . 1 . . . . 24 HIS CB . 6615 1 319 . 1 1 25 25 HIS CD2 C 13 131.340 0.2 . 1 . . . . 24 HIS CD2 . 6615 1 320 . 1 1 25 25 HIS CE1 C 13 137.020 0.2 . 1 . . . . 24 HIS CE1 . 6615 1 321 . 1 1 25 25 HIS N N 15 112.937 0.2 . 1 . . . . 24 HIS N . 6615 1 322 . 1 1 26 26 GLY H H 1 7.794 0.2 . 1 . . . . 25 GLY H . 6615 1 323 . 1 1 26 26 GLY HA2 H 1 3.870 0.2 . 2 . . . . 25 GLY HA2 . 6615 1 324 . 1 1 26 26 GLY HA3 H 1 3.950 0.2 . 2 . . . . 25 GLY HA3 . 6615 1 325 . 1 1 26 26 GLY C C 13 174.278 0.2 . 1 . . . . 25 GLY C . 6615 1 326 . 1 1 26 26 GLY CA C 13 46.521 0.2 . 1 . . . . 25 GLY CA . 6615 1 327 . 1 1 26 26 GLY N N 15 107.598 0.2 . 1 . . . . 25 GLY N . 6615 1 328 . 1 1 27 27 LEU H H 1 7.731 0.2 . 1 . . . . 26 LEU H . 6615 1 329 . 1 1 27 27 LEU HA H 1 4.562 0.2 . 1 . . . . 26 LEU HA . 6615 1 330 . 1 1 27 27 LEU HB2 H 1 1.474 0.2 . 2 . . . . 26 LEU HB2 . 6615 1 331 . 1 1 27 27 LEU HB3 H 1 1.870 0.2 . 2 . . . . 26 LEU HB3 . 6615 1 332 . 1 1 27 27 LEU HG H 1 1.440 0.2 . 1 . . . . 26 LEU HG . 6615 1 333 . 1 1 27 27 LEU HD11 H 1 0.860 0.2 . 1 . . . . 26 LEU HD1 . 6615 1 334 . 1 1 27 27 LEU HD12 H 1 0.860 0.2 . 1 . . . . 26 LEU HD1 . 6615 1 335 . 1 1 27 27 LEU HD13 H 1 0.860 0.2 . 1 . . . . 26 LEU HD1 . 6615 1 336 . 1 1 27 27 LEU HD21 H 1 0.780 0.2 . 1 . . . . 26 LEU HD2 . 6615 1 337 . 1 1 27 27 LEU HD22 H 1 0.780 0.2 . 1 . . . . 26 LEU HD2 . 6615 1 338 . 1 1 27 27 LEU HD23 H 1 0.780 0.2 . 1 . . . . 26 LEU HD2 . 6615 1 339 . 1 1 27 27 LEU C C 13 175.154 0.2 . 1 . . . . 26 LEU C . 6615 1 340 . 1 1 27 27 LEU CA C 13 52.852 0.2 . 1 . . . . 26 LEU CA . 6615 1 341 . 1 1 27 27 LEU CB C 13 44.815 0.2 . 1 . . . . 26 LEU CB . 6615 1 342 . 1 1 27 27 LEU CG C 13 26.320 0.2 . 1 . . . . 26 LEU CG . 6615 1 343 . 1 1 27 27 LEU CD1 C 13 23.010 0.2 . 1 . . . . 26 LEU CD1 . 6615 1 344 . 1 1 27 27 LEU CD2 C 13 23.010 0.2 . 1 . . . . 26 LEU CD2 . 6615 1 345 . 1 1 27 27 LEU N N 15 118.378 0.2 . 1 . . . . 26 LEU N . 6615 1 346 . 1 1 28 28 LYS H H 1 8.255 0.2 . 1 . . . . 27 LYS H . 6615 1 347 . 1 1 28 28 LYS HA H 1 4.558 0.2 . 1 . . . . 27 LYS HA . 6615 1 348 . 1 1 28 28 LYS HB2 H 1 1.513 0.2 . 2 . . . . 27 LYS HB2 . 6615 1 349 . 1 1 28 28 LYS HB3 H 1 1.960 0.2 . 2 . . . . 27 LYS HB3 . 6615 1 350 . 1 1 28 28 LYS HG2 H 1 1.400 0.2 . 1 . . . . 27 LYS HG2 . 6615 1 351 . 1 1 28 28 LYS HG3 H 1 1.400 0.2 . 1 . . . . 27 LYS HG3 . 6615 1 352 . 1 1 28 28 LYS HD2 H 1 1.600 0.2 . 1 . . . . 27 LYS HD2 . 6615 1 353 . 1 1 28 28 LYS HD3 H 1 1.600 0.2 . 1 . . . . 27 LYS HD3 . 6615 1 354 . 1 1 28 28 LYS HE2 H 1 2.950 0.2 . 1 . . . . 27 LYS HE2 . 6615 1 355 . 1 1 28 28 LYS HE3 H 1 2.950 0.2 . 1 . . . . 27 LYS HE3 . 6615 1 356 . 1 1 28 28 LYS C C 13 178.035 0.2 . 1 . . . . 27 LYS C . 6615 1 357 . 1 1 28 28 LYS CA C 13 54.096 0.2 . 1 . . . . 27 LYS CA . 6615 1 358 . 1 1 28 28 LYS CB C 13 34.594 0.2 . 1 . . . . 27 LYS CB . 6615 1 359 . 1 1 28 28 LYS CG C 13 25.950 0.2 . 1 . . . . 27 LYS CG . 6615 1 360 . 1 1 28 28 LYS CD C 13 29.270 0.2 . 1 . . . . 27 LYS CD . 6615 1 361 . 1 1 28 28 LYS CE C 13 42.130 0.2 . 1 . . . . 27 LYS CE . 6615 1 362 . 1 1 28 28 LYS N N 15 117.789 0.2 . 1 . . . . 27 LYS N . 6615 1 363 . 1 1 29 29 LYS H H 1 8.844 0.2 . 1 . . . . 28 LYS H . 6615 1 364 . 1 1 29 29 LYS HA H 1 3.954 0.2 . 1 . . . . 28 LYS HA . 6615 1 365 . 1 1 29 29 LYS HB2 H 1 1.820 0.2 . 2 . . . . 28 LYS HB2 . 6615 1 366 . 1 1 29 29 LYS HB3 H 1 1.860 0.2 . 2 . . . . 28 LYS HB3 . 6615 1 367 . 1 1 29 29 LYS HG2 H 1 1.410 0.2 . 2 . . . . 28 LYS HG2 . 6615 1 368 . 1 1 29 29 LYS HG3 H 1 1.510 0.2 . 2 . . . . 28 LYS HG3 . 6615 1 369 . 1 1 29 29 LYS HD2 H 1 1.700 0.2 . 1 . . . . 28 LYS HD2 . 6615 1 370 . 1 1 29 29 LYS HD3 H 1 1.700 0.2 . 1 . . . . 28 LYS HD3 . 6615 1 371 . 1 1 29 29 LYS HE2 H 1 2.980 0.2 . 1 . . . . 28 LYS HE2 . 6615 1 372 . 1 1 29 29 LYS HE3 H 1 2.980 0.2 . 1 . . . . 28 LYS HE3 . 6615 1 373 . 1 1 29 29 LYS C C 13 177.426 0.2 . 1 . . . . 28 LYS C . 6615 1 374 . 1 1 29 29 LYS CA C 13 59.718 0.2 . 1 . . . . 28 LYS CA . 6615 1 375 . 1 1 29 29 LYS CB C 13 31.858 0.2 . 1 . . . . 28 LYS CB . 6615 1 376 . 1 1 29 29 LYS CG C 13 24.880 0.2 . 1 . . . . 28 LYS CG . 6615 1 377 . 1 1 29 29 LYS CD C 13 29.410 0.2 . 1 . . . . 28 LYS CD . 6615 1 378 . 1 1 29 29 LYS CE C 13 41.870 0.2 . 1 . . . . 28 LYS CE . 6615 1 379 . 1 1 29 29 LYS N N 15 122.442 0.2 . 1 . . . . 28 LYS N . 6615 1 380 . 1 1 30 30 SER H H 1 7.574 0.2 . 1 . . . . 29 SER H . 6615 1 381 . 1 1 30 30 SER HA H 1 4.109 0.2 . 1 . . . . 29 SER HA . 6615 1 382 . 1 1 30 30 SER HB2 H 1 3.769 0.2 . 2 . . . . 29 SER HB2 . 6615 1 383 . 1 1 30 30 SER HB3 H 1 3.906 0.2 . 2 . . . . 29 SER HB3 . 6615 1 384 . 1 1 30 30 SER C C 13 175.560 0.2 . 1 . . . . 29 SER C . 6615 1 385 . 1 1 30 30 SER CA C 13 59.000 0.2 . 1 . . . . 29 SER CA . 6615 1 386 . 1 1 30 30 SER CB C 13 62.688 0.2 . 1 . . . . 29 SER CB . 6615 1 387 . 1 1 30 30 SER N N 15 107.962 0.2 . 1 . . . . 29 SER N . 6615 1 388 . 1 1 31 31 ASN H H 1 7.923 0.2 . 1 . . . . 30 ASN H . 6615 1 389 . 1 1 31 31 ASN HA H 1 5.021 0.2 . 1 . . . . 30 ASN HA . 6615 1 390 . 1 1 31 31 ASN HB2 H 1 2.876 0.2 . 1 . . . . 30 ASN HB2 . 6615 1 391 . 1 1 31 31 ASN HB3 H 1 2.876 0.2 . 1 . . . . 30 ASN HB3 . 6615 1 392 . 1 1 31 31 ASN HD21 H 1 7.130 0.2 . 2 . . . . 30 ASN HD21 . 6615 1 393 . 1 1 31 31 ASN HD22 H 1 7.740 0.2 . 2 . . . . 30 ASN HD22 . 6615 1 394 . 1 1 31 31 ASN C C 13 173.777 0.2 . 1 . . . . 30 ASN C . 6615 1 395 . 1 1 31 31 ASN CA C 13 55.012 0.2 . 1 . . . . 30 ASN CA . 6615 1 396 . 1 1 31 31 ASN CB C 13 41.630 0.2 . 1 . . . . 30 ASN CB . 6615 1 397 . 1 1 31 31 ASN N N 15 116.158 0.2 . 1 . . . . 30 ASN N . 6615 1 398 . 1 1 31 31 ASN ND2 N 15 107.930 0.2 . 1 . . . . 30 ASN ND2 . 6615 1 399 . 1 1 32 32 LEU H H 1 7.081 0.2 . 1 . . . . 31 LEU H . 6615 1 400 . 1 1 32 32 LEU HA H 1 5.202 0.2 . 1 . . . . 31 LEU HA . 6615 1 401 . 1 1 32 32 LEU HB2 H 1 0.919 0.2 . 2 . . . . 31 LEU HB2 . 6615 1 402 . 1 1 32 32 LEU HB3 H 1 1.541 0.2 . 2 . . . . 31 LEU HB3 . 6615 1 403 . 1 1 32 32 LEU HG H 1 1.100 0.2 . 1 . . . . 31 LEU HG . 6615 1 404 . 1 1 32 32 LEU HD11 H 1 0.570 0.2 . 1 . . . . 31 LEU HD1 . 6615 1 405 . 1 1 32 32 LEU HD12 H 1 0.570 0.2 . 1 . . . . 31 LEU HD1 . 6615 1 406 . 1 1 32 32 LEU HD13 H 1 0.570 0.2 . 1 . . . . 31 LEU HD1 . 6615 1 407 . 1 1 32 32 LEU HD21 H 1 0.760 0.2 . 1 . . . . 31 LEU HD2 . 6615 1 408 . 1 1 32 32 LEU HD22 H 1 0.760 0.2 . 1 . . . . 31 LEU HD2 . 6615 1 409 . 1 1 32 32 LEU HD23 H 1 0.760 0.2 . 1 . . . . 31 LEU HD2 . 6615 1 410 . 1 1 32 32 LEU C C 13 172.847 0.2 . 1 . . . . 31 LEU C . 6615 1 411 . 1 1 32 32 LEU CA C 13 53.714 0.2 . 1 . . . . 31 LEU CA . 6615 1 412 . 1 1 32 32 LEU CB C 13 44.950 0.2 . 1 . . . . 31 LEU CB . 6615 1 413 . 1 1 32 32 LEU CG C 13 27.550 0.2 . 1 . . . . 31 LEU CG . 6615 1 414 . 1 1 32 32 LEU CD1 C 13 23.680 0.2 . 1 . . . . 31 LEU CD1 . 6615 1 415 . 1 1 32 32 LEU CD2 C 13 23.680 0.2 . 1 . . . . 31 LEU CD2 . 6615 1 416 . 1 1 32 32 LEU N N 15 119.397 0.2 . 1 . . . . 31 LEU N . 6615 1 417 . 1 1 33 33 GLN H H 1 8.453 0.2 . 1 . . . . 32 GLN H . 6615 1 418 . 1 1 33 33 GLN HA H 1 4.572 0.2 . 1 . . . . 32 GLN HA . 6615 1 419 . 1 1 33 33 GLN HB2 H 1 1.827 0.2 . 2 . . . . 32 GLN HB2 . 6615 1 420 . 1 1 33 33 GLN HB3 H 1 1.943 0.2 . 2 . . . . 32 GLN HB3 . 6615 1 421 . 1 1 33 33 GLN HG2 H 1 2.150 0.2 . 1 . . . . 32 GLN HG2 . 6615 1 422 . 1 1 33 33 GLN HG3 H 1 2.150 0.2 . 1 . . . . 32 GLN HG3 . 6615 1 423 . 1 1 33 33 GLN HE21 H 1 6.650 0.2 . 2 . . . . 32 GLN HE21 . 6615 1 424 . 1 1 33 33 GLN HE22 H 1 7.300 0.2 . 2 . . . . 32 GLN HE22 . 6615 1 425 . 1 1 33 33 GLN C C 13 173.349 0.2 . 1 . . . . 32 GLN C . 6615 1 426 . 1 1 33 33 GLN CA C 13 53.774 0.2 . 1 . . . . 32 GLN CA . 6615 1 427 . 1 1 33 33 GLN CB C 13 31.599 0.2 . 1 . . . . 32 GLN CB . 6615 1 428 . 1 1 33 33 GLN CG C 13 33.660 0.2 . 1 . . . . 32 GLN CG . 6615 1 429 . 1 1 33 33 GLN N N 15 123.735 0.2 . 1 . . . . 32 GLN N . 6615 1 430 . 1 1 33 33 GLN NE2 N 15 111.570 0.2 . 1 . . . . 32 GLN NE2 . 6615 1 431 . 1 1 34 34 LEU H H 1 8.806 0.2 . 1 . . . . 33 LEU H . 6615 1 432 . 1 1 34 34 LEU HA H 1 4.874 0.2 . 1 . . . . 33 LEU HA . 6615 1 433 . 1 1 34 34 LEU HB2 H 1 1.129 0.2 . 2 . . . . 33 LEU HB2 . 6615 1 434 . 1 1 34 34 LEU HB3 H 1 1.526 0.2 . 2 . . . . 33 LEU HB3 . 6615 1 435 . 1 1 34 34 LEU HG H 1 1.420 0.2 . 1 . . . . 33 LEU HG . 6615 1 436 . 1 1 34 34 LEU HD11 H 1 0.580 0.2 . 1 . . . . 33 LEU HD1 . 6615 1 437 . 1 1 34 34 LEU HD12 H 1 0.580 0.2 . 1 . . . . 33 LEU HD1 . 6615 1 438 . 1 1 34 34 LEU HD13 H 1 0.580 0.2 . 1 . . . . 33 LEU HD1 . 6615 1 439 . 1 1 34 34 LEU HD21 H 1 0.530 0.2 . 1 . . . . 33 LEU HD2 . 6615 1 440 . 1 1 34 34 LEU HD22 H 1 0.530 0.2 . 1 . . . . 33 LEU HD2 . 6615 1 441 . 1 1 34 34 LEU HD23 H 1 0.530 0.2 . 1 . . . . 33 LEU HD2 . 6615 1 442 . 1 1 34 34 LEU C C 13 175.883 0.2 . 1 . . . . 33 LEU C . 6615 1 443 . 1 1 34 34 LEU CA C 13 53.440 0.2 . 1 . . . . 33 LEU CA . 6615 1 444 . 1 1 34 34 LEU CB C 13 43.030 0.2 . 1 . . . . 33 LEU CB . 6615 1 445 . 1 1 34 34 LEU CG C 13 29.060 0.2 . 1 . . . . 33 LEU CG . 6615 1 446 . 1 1 34 34 LEU CD1 C 13 24.310 0.2 . 1 . . . . 33 LEU CD1 . 6615 1 447 . 1 1 34 34 LEU CD2 C 13 26.350 0.2 . 1 . . . . 33 LEU CD2 . 6615 1 448 . 1 1 34 34 LEU N N 15 126.445 0.2 . 1 . . . . 33 LEU N . 6615 1 449 . 1 1 35 35 ARG H H 1 7.996 0.2 . 1 . . . . 34 ARG H . 6615 1 450 . 1 1 35 35 ARG HA H 1 4.337 0.2 . 1 . . . . 34 ARG HA . 6615 1 451 . 1 1 35 35 ARG HB2 H 1 1.748 0.2 . 2 . . . . 34 ARG HB2 . 6615 1 452 . 1 1 35 35 ARG HB3 H 1 2.256 0.2 . 2 . . . . 34 ARG HB3 . 6615 1 453 . 1 1 35 35 ARG HG2 H 1 1.650 0.2 . 1 . . . . 34 ARG HG2 . 6615 1 454 . 1 1 35 35 ARG HG3 H 1 1.650 0.2 . 1 . . . . 34 ARG HG3 . 6615 1 455 . 1 1 35 35 ARG HD2 H 1 3.230 0.2 . 1 . . . . 34 ARG HD2 . 6615 1 456 . 1 1 35 35 ARG HD3 H 1 3.230 0.2 . 1 . . . . 34 ARG HD3 . 6615 1 457 . 1 1 35 35 ARG C C 13 177.737 0.2 . 1 . . . . 34 ARG C . 6615 1 458 . 1 1 35 35 ARG CA C 13 55.126 0.2 . 1 . . . . 34 ARG CA . 6615 1 459 . 1 1 35 35 ARG CB C 13 30.571 0.2 . 1 . . . . 34 ARG CB . 6615 1 460 . 1 1 35 35 ARG CG C 13 27.560 0.2 . 1 . . . . 34 ARG CG . 6615 1 461 . 1 1 35 35 ARG CD C 13 42.650 0.2 . 1 . . . . 34 ARG CD . 6615 1 462 . 1 1 35 35 ARG N N 15 121.267 0.2 . 1 . . . . 34 ARG N . 6615 1 463 . 1 1 36 36 ASP H H 1 9.101 0.2 . 1 . . . . 35 ASP H . 6615 1 464 . 1 1 36 36 ASP HA H 1 4.141 0.2 . 1 . . . . 35 ASP HA . 6615 1 465 . 1 1 36 36 ASP HB2 H 1 2.444 0.2 . 2 . . . . 35 ASP HB2 . 6615 1 466 . 1 1 36 36 ASP HB3 H 1 2.652 0.2 . 2 . . . . 35 ASP HB3 . 6615 1 467 . 1 1 36 36 ASP C C 13 178.409 0.2 . 1 . . . . 35 ASP C . 6615 1 468 . 1 1 36 36 ASP CA C 13 58.054 0.2 . 1 . . . . 35 ASP CA . 6615 1 469 . 1 1 36 36 ASP CB C 13 39.220 0.2 . 1 . . . . 35 ASP CB . 6615 1 470 . 1 1 36 36 ASP N N 15 124.900 0.2 . 1 . . . . 35 ASP N . 6615 1 471 . 1 1 37 37 GLN H H 1 8.972 0.2 . 1 . . . . 36 GLN H . 6615 1 472 . 1 1 37 37 GLN HA H 1 3.761 0.2 . 1 . . . . 36 GLN HA . 6615 1 473 . 1 1 37 37 GLN HB2 H 1 1.894 0.2 . 2 . . . . 36 GLN HB2 . 6615 1 474 . 1 1 37 37 GLN HB3 H 1 2.186 0.2 . 2 . . . . 36 GLN HB3 . 6615 1 475 . 1 1 37 37 GLN HG2 H 1 2.370 0.2 . 1 . . . . 36 GLN HG2 . 6615 1 476 . 1 1 37 37 GLN HG3 H 1 2.370 0.2 . 1 . . . . 36 GLN HG3 . 6615 1 477 . 1 1 37 37 GLN HE21 H 1 6.260 0.2 . 2 . . . . 36 GLN HE21 . 6615 1 478 . 1 1 37 37 GLN HE22 H 1 7.980 0.2 . 2 . . . . 36 GLN HE22 . 6615 1 479 . 1 1 37 37 GLN C C 13 178.108 0.2 . 1 . . . . 36 GLN C . 6615 1 480 . 1 1 37 37 GLN CA C 13 57.965 0.2 . 1 . . . . 36 GLN CA . 6615 1 481 . 1 1 37 37 GLN CB C 13 28.205 0.2 . 1 . . . . 36 GLN CB . 6615 1 482 . 1 1 37 37 GLN CG C 13 33.750 0.2 . 1 . . . . 36 GLN CG . 6615 1 483 . 1 1 37 37 GLN N N 15 115.832 0.2 . 1 . . . . 36 GLN N . 6615 1 484 . 1 1 37 37 GLN NE2 N 15 115.780 0.2 . 1 . . . . 36 GLN NE2 . 6615 1 485 . 1 1 38 38 ALA H H 1 6.991 0.2 . 1 . . . . 37 ALA H . 6615 1 486 . 1 1 38 38 ALA HA H 1 3.926 0.2 . 1 . . . . 37 ALA HA . 6615 1 487 . 1 1 38 38 ALA HB1 H 1 1.230 0.2 . 1 . . . . 37 ALA HB . 6615 1 488 . 1 1 38 38 ALA HB2 H 1 1.230 0.2 . 1 . . . . 37 ALA HB . 6615 1 489 . 1 1 38 38 ALA HB3 H 1 1.230 0.2 . 1 . . . . 37 ALA HB . 6615 1 490 . 1 1 38 38 ALA C C 13 178.090 0.2 . 1 . . . . 37 ALA C . 6615 1 491 . 1 1 38 38 ALA CA C 13 54.732 0.2 . 1 . . . . 37 ALA CA . 6615 1 492 . 1 1 38 38 ALA CB C 13 17.731 0.2 . 1 . . . . 37 ALA CB . 6615 1 493 . 1 1 38 38 ALA N N 15 117.221 0.2 . 1 . . . . 37 ALA N . 6615 1 494 . 1 1 39 39 ILE H H 1 7.368 0.2 . 1 . . . . 38 ILE H . 6615 1 495 . 1 1 39 39 ILE HA H 1 3.314 0.2 . 1 . . . . 38 ILE HA . 6615 1 496 . 1 1 39 39 ILE HB H 1 1.981 0.2 . 1 . . . . 38 ILE HB . 6615 1 497 . 1 1 39 39 ILE HG12 H 1 1.740 0.2 . 1 . . . . 38 ILE HG12 . 6615 1 498 . 1 1 39 39 ILE HG13 H 1 1.740 0.2 . 1 . . . . 38 ILE HG13 . 6615 1 499 . 1 1 39 39 ILE HG21 H 1 0.850 0.2 . 1 . . . . 38 ILE HG2 . 6615 1 500 . 1 1 39 39 ILE HG22 H 1 0.850 0.2 . 1 . . . . 38 ILE HG2 . 6615 1 501 . 1 1 39 39 ILE HG23 H 1 0.850 0.2 . 1 . . . . 38 ILE HG2 . 6615 1 502 . 1 1 39 39 ILE HD11 H 1 0.780 0.2 . 1 . . . . 38 ILE HD1 . 6615 1 503 . 1 1 39 39 ILE HD12 H 1 0.780 0.2 . 1 . . . . 38 ILE HD1 . 6615 1 504 . 1 1 39 39 ILE HD13 H 1 0.780 0.2 . 1 . . . . 38 ILE HD1 . 6615 1 505 . 1 1 39 39 ILE C C 13 177.800 0.2 . 1 . . . . 38 ILE C . 6615 1 506 . 1 1 39 39 ILE CA C 13 65.756 0.2 . 1 . . . . 38 ILE CA . 6615 1 507 . 1 1 39 39 ILE CB C 13 36.986 0.2 . 1 . . . . 38 ILE CB . 6615 1 508 . 1 1 39 39 ILE CG1 C 13 29.670 0.2 . 1 . . . . 38 ILE CG1 . 6615 1 509 . 1 1 39 39 ILE CG2 C 13 18.940 0.2 . 1 . . . . 38 ILE CG2 . 6615 1 510 . 1 1 39 39 ILE CD1 C 13 13.480 0.2 . 1 . . . . 38 ILE CD1 . 6615 1 511 . 1 1 39 39 ILE N N 15 116.031 0.2 . 1 . . . . 38 ILE N . 6615 1 512 . 1 1 40 40 LEU H H 1 8.065 0.2 . 1 . . . . 39 LEU H . 6615 1 513 . 1 1 40 40 LEU HA H 1 3.891 0.2 . 1 . . . . 39 LEU HA . 6615 1 514 . 1 1 40 40 LEU HB2 H 1 1.107 0.2 . 2 . . . . 39 LEU HB2 . 6615 1 515 . 1 1 40 40 LEU HB3 H 1 1.828 0.2 . 2 . . . . 39 LEU HB3 . 6615 1 516 . 1 1 40 40 LEU HG H 1 1.600 0.2 . 1 . . . . 39 LEU HG . 6615 1 517 . 1 1 40 40 LEU HD11 H 1 1.060 0.2 . 1 . . . . 39 LEU HD1 . 6615 1 518 . 1 1 40 40 LEU HD12 H 1 1.060 0.2 . 1 . . . . 39 LEU HD1 . 6615 1 519 . 1 1 40 40 LEU HD13 H 1 1.060 0.2 . 1 . . . . 39 LEU HD1 . 6615 1 520 . 1 1 40 40 LEU HD21 H 1 0.760 0.2 . 1 . . . . 39 LEU HD2 . 6615 1 521 . 1 1 40 40 LEU HD22 H 1 0.760 0.2 . 1 . . . . 39 LEU HD2 . 6615 1 522 . 1 1 40 40 LEU HD23 H 1 0.760 0.2 . 1 . . . . 39 LEU HD2 . 6615 1 523 . 1 1 40 40 LEU C C 13 178.344 0.2 . 1 . . . . 39 LEU C . 6615 1 524 . 1 1 40 40 LEU CA C 13 54.225 0.2 . 1 . . . . 39 LEU CA . 6615 1 525 . 1 1 40 40 LEU CB C 13 41.046 0.2 . 1 . . . . 39 LEU CB . 6615 1 526 . 1 1 40 40 LEU CG C 13 26.280 0.2 . 1 . . . . 39 LEU CG . 6615 1 527 . 1 1 40 40 LEU CD1 C 13 22.650 0.2 . 1 . . . . 39 LEU CD1 . 6615 1 528 . 1 1 40 40 LEU CD2 C 13 24.850 0.2 . 1 . . . . 39 LEU CD2 . 6615 1 529 . 1 1 40 40 LEU N N 15 118.028 0.2 . 1 . . . . 39 LEU N . 6615 1 530 . 1 1 41 41 ASP H H 1 8.131 0.2 . 1 . . . . 40 ASP H . 6615 1 531 . 1 1 41 41 ASP HA H 1 4.445 0.2 . 1 . . . . 40 ASP HA . 6615 1 532 . 1 1 41 41 ASP HB2 H 1 2.715 0.2 . 2 . . . . 40 ASP HB2 . 6615 1 533 . 1 1 41 41 ASP HB3 H 1 2.995 0.2 . 2 . . . . 40 ASP HB3 . 6615 1 534 . 1 1 41 41 ASP C C 13 179.618 0.2 . 1 . . . . 40 ASP C . 6615 1 535 . 1 1 41 41 ASP CA C 13 57.416 0.2 . 1 . . . . 40 ASP CA . 6615 1 536 . 1 1 41 41 ASP CB C 13 39.620 0.2 . 1 . . . . 40 ASP CB . 6615 1 537 . 1 1 41 41 ASP N N 15 120.775 0.2 . 1 . . . . 40 ASP N . 6615 1 538 . 1 1 42 42 ILE H H 1 8.182 0.2 . 1 . . . . 41 ILE H . 6615 1 539 . 1 1 42 42 ILE HA H 1 3.806 0.2 . 1 . . . . 41 ILE HA . 6615 1 540 . 1 1 42 42 ILE HB H 1 1.966 0.2 . 1 . . . . 41 ILE HB . 6615 1 541 . 1 1 42 42 ILE HG12 H 1 0.730 0.2 . 1 . . . . 41 ILE HG12 . 6615 1 542 . 1 1 42 42 ILE HG13 H 1 0.730 0.2 . 1 . . . . 41 ILE HG13 . 6615 1 543 . 1 1 42 42 ILE HG21 H 1 0.610 0.2 . 1 . . . . 41 ILE HG2 . 6615 1 544 . 1 1 42 42 ILE HG22 H 1 0.610 0.2 . 1 . . . . 41 ILE HG2 . 6615 1 545 . 1 1 42 42 ILE HG23 H 1 0.610 0.2 . 1 . . . . 41 ILE HG2 . 6615 1 546 . 1 1 42 42 ILE HD11 H 1 0.930 0.2 . 1 . . . . 41 ILE HD1 . 6615 1 547 . 1 1 42 42 ILE HD12 H 1 0.930 0.2 . 1 . . . . 41 ILE HD1 . 6615 1 548 . 1 1 42 42 ILE HD13 H 1 0.930 0.2 . 1 . . . . 41 ILE HD1 . 6615 1 549 . 1 1 42 42 ILE C C 13 178.469 0.2 . 1 . . . . 41 ILE C . 6615 1 550 . 1 1 42 42 ILE CA C 13 65.778 0.2 . 1 . . . . 41 ILE CA . 6615 1 551 . 1 1 42 42 ILE CB C 13 37.853 0.2 . 1 . . . . 41 ILE CB . 6615 1 552 . 1 1 42 42 ILE CG1 C 13 28.680 0.2 . 1 . . . . 41 ILE CG1 . 6615 1 553 . 1 1 42 42 ILE CG2 C 13 18.710 0.2 . 1 . . . . 41 ILE CG2 . 6615 1 554 . 1 1 42 42 ILE CD1 C 13 13.940 0.2 . 1 . . . . 41 ILE CD1 . 6615 1 555 . 1 1 42 42 ILE N N 15 121.426 0.2 . 1 . . . . 41 ILE N . 6615 1 556 . 1 1 43 43 ILE H H 1 7.863 0.2 . 1 . . . . 42 ILE H . 6615 1 557 . 1 1 43 43 ILE HA H 1 3.418 0.2 . 1 . . . . 42 ILE HA . 6615 1 558 . 1 1 43 43 ILE HB H 1 1.986 0.2 . 1 . . . . 42 ILE HB . 6615 1 559 . 1 1 43 43 ILE HG12 H 1 1.800 0.2 . 1 . . . . 42 ILE HG12 . 6615 1 560 . 1 1 43 43 ILE HG13 H 1 1.840 0.2 . 1 . . . . 42 ILE HG13 . 6615 1 561 . 1 1 43 43 ILE HG21 H 1 0.830 0.2 . 1 . . . . 42 ILE HG2 . 6615 1 562 . 1 1 43 43 ILE HG22 H 1 0.830 0.2 . 1 . . . . 42 ILE HG2 . 6615 1 563 . 1 1 43 43 ILE HG23 H 1 0.830 0.2 . 1 . . . . 42 ILE HG2 . 6615 1 564 . 1 1 43 43 ILE HD11 H 1 0.780 0.2 . 1 . . . . 42 ILE HD1 . 6615 1 565 . 1 1 43 43 ILE HD12 H 1 0.780 0.2 . 1 . . . . 42 ILE HD1 . 6615 1 566 . 1 1 43 43 ILE HD13 H 1 0.780 0.2 . 1 . . . . 42 ILE HD1 . 6615 1 567 . 1 1 43 43 ILE C C 13 179.091 0.2 . 1 . . . . 42 ILE C . 6615 1 568 . 1 1 43 43 ILE CA C 13 65.083 0.2 . 1 . . . . 42 ILE CA . 6615 1 569 . 1 1 43 43 ILE CB C 13 38.470 0.2 . 1 . . . . 42 ILE CB . 6615 1 570 . 1 1 43 43 ILE CG1 C 13 30.050 0.2 . 1 . . . . 42 ILE CG1 . 6615 1 571 . 1 1 43 43 ILE CG2 C 13 17.970 0.2 . 1 . . . . 42 ILE CG2 . 6615 1 572 . 1 1 43 43 ILE CD1 C 13 15.400 0.2 . 1 . . . . 42 ILE CD1 . 6615 1 573 . 1 1 43 43 ILE N N 15 117.913 0.2 . 1 . . . . 42 ILE N . 6615 1 574 . 1 1 44 44 ARG H H 1 8.573 0.2 . 1 . . . . 43 ARG H . 6615 1 575 . 1 1 44 44 ARG HA H 1 3.660 0.2 . 1 . . . . 43 ARG HA . 6615 1 576 . 1 1 44 44 ARG HB2 H 1 1.960 0.2 . 2 . . . . 43 ARG HB2 . 6615 1 577 . 1 1 44 44 ARG HB3 H 1 2.048 0.2 . 2 . . . . 43 ARG HB3 . 6615 1 578 . 1 1 44 44 ARG HG2 H 1 0.890 0.2 . 2 . . . . 43 ARG HG2 . 6615 1 579 . 1 1 44 44 ARG HG3 H 1 1.500 0.2 . 2 . . . . 43 ARG HG3 . 6615 1 580 . 1 1 44 44 ARG C C 13 177.895 0.2 . 1 . . . . 43 ARG C . 6615 1 581 . 1 1 44 44 ARG CA C 13 59.325 0.2 . 1 . . . . 43 ARG CA . 6615 1 582 . 1 1 44 44 ARG CB C 13 30.859 0.2 . 1 . . . . 43 ARG CB . 6615 1 583 . 1 1 44 44 ARG CG C 13 27.200 0.2 . 1 . . . . 43 ARG CG . 6615 1 584 . 1 1 44 44 ARG CD C 13 43.370 0.2 . 1 . . . . 43 ARG CD . 6615 1 585 . 1 1 44 44 ARG N N 15 115.443 0.2 . 1 . . . . 43 ARG N . 6615 1 586 . 1 1 45 45 TYR H H 1 8.309 0.2 . 1 . . . . 44 TYR H . 6615 1 587 . 1 1 45 45 TYR HA H 1 5.258 0.2 . 1 . . . . 44 TYR HA . 6615 1 588 . 1 1 45 45 TYR HB2 H 1 2.919 0.2 . 2 . . . . 44 TYR HB2 . 6615 1 589 . 1 1 45 45 TYR HB3 H 1 3.032 0.2 . 2 . . . . 44 TYR HB3 . 6615 1 590 . 1 1 45 45 TYR HD1 H 1 7.380 0.2 . 1 . . . . 44 TYR HD1 . 6615 1 591 . 1 1 45 45 TYR HD2 H 1 7.380 0.2 . 1 . . . . 44 TYR HD2 . 6615 1 592 . 1 1 45 45 TYR HE1 H 1 6.880 0.2 . 1 . . . . 44 TYR HE1 . 6615 1 593 . 1 1 45 45 TYR HE2 H 1 6.880 0.2 . 1 . . . . 44 TYR HE2 . 6615 1 594 . 1 1 45 45 TYR C C 13 177.518 0.2 . 1 . . . . 44 TYR C . 6615 1 595 . 1 1 45 45 TYR CA C 13 57.209 0.2 . 1 . . . . 44 TYR CA . 6615 1 596 . 1 1 45 45 TYR CB C 13 39.019 0.2 . 1 . . . . 44 TYR CB . 6615 1 597 . 1 1 45 45 TYR CD1 C 13 133.210 0.2 . 1 . . . . 44 TYR CD1 . 6615 1 598 . 1 1 45 45 TYR CD2 C 13 133.210 0.2 . 1 . . . . 44 TYR CD2 . 6615 1 599 . 1 1 45 45 TYR CE1 C 13 120.040 0.2 . 1 . . . . 44 TYR CE1 . 6615 1 600 . 1 1 45 45 TYR CE2 C 13 120.040 0.2 . 1 . . . . 44 TYR CE2 . 6615 1 601 . 1 1 45 45 TYR N N 15 110.375 0.2 . 1 . . . . 44 TYR N . 6615 1 602 . 1 1 46 46 TYR H H 1 8.349 0.2 . 1 . . . . 45 TYR H . 6615 1 603 . 1 1 46 46 TYR HA H 1 4.907 0.2 . 1 . . . . 45 TYR HA . 6615 1 604 . 1 1 46 46 TYR HB2 H 1 3.273 0.2 . 2 . . . . 45 TYR HB2 . 6615 1 605 . 1 1 46 46 TYR HB3 H 1 3.428 0.2 . 2 . . . . 45 TYR HB3 . 6615 1 606 . 1 1 46 46 TYR HD1 H 1 7.440 0.2 . 1 . . . . 45 TYR HD1 . 6615 1 607 . 1 1 46 46 TYR HD2 H 1 7.440 0.2 . 1 . . . . 45 TYR HD2 . 6615 1 608 . 1 1 46 46 TYR HE1 H 1 6.510 0.2 . 1 . . . . 45 TYR HE1 . 6615 1 609 . 1 1 46 46 TYR HE2 H 1 6.510 0.2 . 1 . . . . 45 TYR HE2 . 6615 1 610 . 1 1 46 46 TYR C C 13 174.234 0.2 . 1 . . . . 45 TYR C . 6615 1 611 . 1 1 46 46 TYR CA C 13 57.859 0.2 . 1 . . . . 45 TYR CA . 6615 1 612 . 1 1 46 46 TYR CB C 13 37.928 0.2 . 1 . . . . 45 TYR CB . 6615 1 613 . 1 1 46 46 TYR CD1 C 13 133.180 0.2 . 1 . . . . 45 TYR CD1 . 6615 1 614 . 1 1 46 46 TYR CD2 C 13 133.180 0.2 . 1 . . . . 45 TYR CD2 . 6615 1 615 . 1 1 46 46 TYR CE1 C 13 118.220 0.2 . 1 . . . . 45 TYR CE1 . 6615 1 616 . 1 1 46 46 TYR CE2 C 13 118.220 0.2 . 1 . . . . 45 TYR CE2 . 6615 1 617 . 1 1 46 46 TYR N N 15 116.142 0.2 . 1 . . . . 45 TYR N . 6615 1 618 . 1 1 47 47 THR H H 1 7.450 0.2 . 1 . . . . 46 THR H . 6615 1 619 . 1 1 47 47 THR HA H 1 4.862 0.2 . 1 . . . . 46 THR HA . 6615 1 620 . 1 1 47 47 THR HB H 1 4.025 0.2 . 1 . . . . 46 THR HB . 6615 1 621 . 1 1 47 47 THR HG21 H 1 1.030 0.2 . 1 . . . . 46 THR HG2 . 6615 1 622 . 1 1 47 47 THR HG22 H 1 1.030 0.2 . 1 . . . . 46 THR HG2 . 6615 1 623 . 1 1 47 47 THR HG23 H 1 1.030 0.2 . 1 . . . . 46 THR HG2 . 6615 1 624 . 1 1 47 47 THR C C 13 170.898 0.2 . 1 . . . . 46 THR C . 6615 1 625 . 1 1 47 47 THR CA C 13 59.296 0.2 . 1 . . . . 46 THR CA . 6615 1 626 . 1 1 47 47 THR CB C 13 73.379 0.2 . 1 . . . . 46 THR CB . 6615 1 627 . 1 1 47 47 THR CG2 C 13 21.340 0.2 . 1 . . . . 46 THR CG2 . 6615 1 628 . 1 1 47 47 THR N N 15 108.533 0.2 . 1 . . . . 46 THR N . 6615 1 629 . 1 1 48 48 ARG H H 1 8.626 0.2 . 1 . . . . 47 ARG H . 6615 1 630 . 1 1 48 48 ARG HA H 1 4.130 0.2 . 1 . . . . 47 ARG HA . 6615 1 631 . 1 1 48 48 ARG HB2 H 1 0.490 0.2 . 2 . . . . 47 ARG HB2 . 6615 1 632 . 1 1 48 48 ARG HB3 H 1 1.200 0.2 . 2 . . . . 47 ARG HB3 . 6615 1 633 . 1 1 48 48 ARG HG2 H 1 0.990 0.2 . 1 . . . . 47 ARG HG2 . 6615 1 634 . 1 1 48 48 ARG HG3 H 1 0.990 0.2 . 1 . . . . 47 ARG HG3 . 6615 1 635 . 1 1 48 48 ARG HD2 H 1 3.420 0.2 . 1 . . . . 47 ARG HD2 . 6615 1 636 . 1 1 48 48 ARG HD3 H 1 3.420 0.2 . 1 . . . . 47 ARG HD3 . 6615 1 637 . 1 1 48 48 ARG C C 13 173.470 0.2 . 1 . . . . 47 ARG C . 6615 1 638 . 1 1 48 48 ARG CA C 13 55.690 0.2 . 1 . . . . 47 ARG CA . 6615 1 639 . 1 1 48 48 ARG CB C 13 29.270 0.2 . 1 . . . . 47 ARG CB . 6615 1 640 . 1 1 48 48 ARG CG C 13 26.040 0.2 . 1 . . . . 47 ARG CG . 6615 1 641 . 1 1 48 48 ARG CD C 13 43.280 0.2 . 1 . . . . 47 ARG CD . 6615 1 642 . 1 1 48 48 ARG N N 15 122.473 0.2 . 1 . . . . 47 ARG N . 6615 1 643 . 1 1 49 49 GLU H H 1 8.740 0.2 . 1 . . . . 48 GLU H . 6615 1 644 . 1 1 49 49 GLU HA H 1 4.800 0.2 . 1 . . . . 48 GLU HA . 6615 1 645 . 1 1 49 49 GLU HB2 H 1 1.950 0.2 . 1 . . . . 48 GLU HB2 . 6615 1 646 . 1 1 49 49 GLU HB3 H 1 1.950 0.2 . 1 . . . . 48 GLU HB3 . 6615 1 647 . 1 1 49 49 GLU HG2 H 1 2.150 0.2 . 2 . . . . 48 GLU HG2 . 6615 1 648 . 1 1 49 49 GLU HG3 H 1 2.430 0.2 . 2 . . . . 48 GLU HG3 . 6615 1 649 . 1 1 49 49 GLU CA C 13 54.220 0.2 . 1 . . . . 48 GLU CA . 6615 1 650 . 1 1 49 49 GLU CB C 13 30.480 0.2 . 1 . . . . 48 GLU CB . 6615 1 651 . 1 1 49 49 GLU N N 15 120.890 0.2 . 1 . . . . 48 GLU N . 6615 1 652 . 1 1 50 50 ALA HA H 1 4.456 0.2 . 1 . . . . 49 ALA HA . 6615 1 653 . 1 1 50 50 ALA HB1 H 1 1.365 0.2 . 1 . . . . 49 ALA HB . 6615 1 654 . 1 1 50 50 ALA HB2 H 1 1.365 0.2 . 1 . . . . 49 ALA HB . 6615 1 655 . 1 1 50 50 ALA HB3 H 1 1.365 0.2 . 1 . . . . 49 ALA HB . 6615 1 656 . 1 1 50 50 ALA C C 13 178.381 0.2 . 1 . . . . 49 ALA C . 6615 1 657 . 1 1 50 50 ALA CA C 13 53.481 0.2 . 1 . . . . 49 ALA CA . 6615 1 658 . 1 1 50 50 ALA CB C 13 19.133 0.2 . 1 . . . . 49 ALA CB . 6615 1 659 . 1 1 51 51 GLY H H 1 7.524 0.2 . 1 . . . . 50 GLY H . 6615 1 660 . 1 1 51 51 GLY HA2 H 1 3.862 0.2 . 2 . . . . 50 GLY HA2 . 6615 1 661 . 1 1 51 51 GLY HA3 H 1 4.515 0.2 . 2 . . . . 50 GLY HA3 . 6615 1 662 . 1 1 51 51 GLY C C 13 172.428 0.2 . 1 . . . . 50 GLY C . 6615 1 663 . 1 1 51 51 GLY CA C 13 44.032 0.2 . 1 . . . . 50 GLY CA . 6615 1 664 . 1 1 51 51 GLY N N 15 104.812 0.2 . 1 . . . . 50 GLY N . 6615 1 665 . 1 1 52 52 VAL H H 1 8.351 0.2 . 1 . . . . 51 VAL H . 6615 1 666 . 1 1 52 52 VAL HA H 1 4.871 0.2 . 1 . . . . 51 VAL HA . 6615 1 667 . 1 1 52 52 VAL HB H 1 2.519 0.2 . 1 . . . . 51 VAL HB . 6615 1 668 . 1 1 52 52 VAL HG11 H 1 0.690 0.2 . 1 . . . . 51 VAL HG1 . 6615 1 669 . 1 1 52 52 VAL HG12 H 1 0.690 0.2 . 1 . . . . 51 VAL HG1 . 6615 1 670 . 1 1 52 52 VAL HG13 H 1 0.690 0.2 . 1 . . . . 51 VAL HG1 . 6615 1 671 . 1 1 52 52 VAL HG21 H 1 0.790 0.2 . 1 . . . . 51 VAL HG2 . 6615 1 672 . 1 1 52 52 VAL HG22 H 1 0.790 0.2 . 1 . . . . 51 VAL HG2 . 6615 1 673 . 1 1 52 52 VAL HG23 H 1 0.790 0.2 . 1 . . . . 51 VAL HG2 . 6615 1 674 . 1 1 52 52 VAL C C 13 176.404 0.2 . 1 . . . . 51 VAL C . 6615 1 675 . 1 1 52 52 VAL CA C 13 59.694 0.2 . 1 . . . . 51 VAL CA . 6615 1 676 . 1 1 52 52 VAL CB C 13 31.831 0.2 . 1 . . . . 51 VAL CB . 6615 1 677 . 1 1 52 52 VAL CG1 C 13 22.060 0.2 . 1 . . . . 51 VAL CG1 . 6615 1 678 . 1 1 52 52 VAL CG2 C 13 17.930 0.2 . 1 . . . . 51 VAL CG2 . 6615 1 679 . 1 1 52 52 VAL N N 15 108.356 0.2 . 1 . . . . 51 VAL N . 6615 1 680 . 1 1 53 53 ARG H H 1 7.772 0.2 . 1 . . . . 52 ARG H . 6615 1 681 . 1 1 53 53 ARG HA H 1 4.191 0.2 . 1 . . . . 52 ARG HA . 6615 1 682 . 1 1 53 53 ARG HB2 H 1 1.881 0.2 . 2 . . . . 52 ARG HB2 . 6615 1 683 . 1 1 53 53 ARG HB3 H 1 1.985 0.2 . 2 . . . . 52 ARG HB3 . 6615 1 684 . 1 1 53 53 ARG HG2 H 1 1.670 0.2 . 2 . . . . 52 ARG HG2 . 6615 1 685 . 1 1 53 53 ARG HG3 H 1 1.800 0.2 . 2 . . . . 52 ARG HG3 . 6615 1 686 . 1 1 53 53 ARG HD2 H 1 3.260 0.2 . 1 . . . . 52 ARG HD2 . 6615 1 687 . 1 1 53 53 ARG HD3 H 1 3.260 0.2 . 1 . . . . 52 ARG HD3 . 6615 1 688 . 1 1 53 53 ARG C C 13 179.724 0.2 . 1 . . . . 52 ARG C . 6615 1 689 . 1 1 53 53 ARG CA C 13 59.981 0.2 . 1 . . . . 52 ARG CA . 6615 1 690 . 1 1 53 53 ARG CB C 13 30.742 0.2 . 1 . . . . 52 ARG CB . 6615 1 691 . 1 1 53 53 ARG CG C 13 27.070 0.2 . 1 . . . . 52 ARG CG . 6615 1 692 . 1 1 53 53 ARG CD C 13 43.220 0.2 . 1 . . . . 52 ARG CD . 6615 1 693 . 1 1 53 53 ARG N N 15 124.453 0.2 . 1 . . . . 52 ARG N . 6615 1 694 . 1 1 54 54 SER H H 1 11.560 0.2 . 1 . . . . 53 SER H . 6615 1 695 . 1 1 54 54 SER HA H 1 3.892 0.2 . 1 . . . . 53 SER HA . 6615 1 696 . 1 1 54 54 SER HB2 H 1 4.270 0.2 . 1 . . . . 53 SER HB2 . 6615 1 697 . 1 1 54 54 SER HB3 H 1 4.270 0.2 . 1 . . . . 53 SER HB3 . 6615 1 698 . 1 1 54 54 SER C C 13 177.820 0.2 . 1 . . . . 53 SER C . 6615 1 699 . 1 1 54 54 SER CA C 13 61.964 0.2 . 1 . . . . 53 SER CA . 6615 1 700 . 1 1 54 54 SER N N 15 121.867 0.2 . 1 . . . . 53 SER N . 6615 1 701 . 1 1 55 55 LEU H H 1 8.872 0.2 . 1 . . . . 54 LEU H . 6615 1 702 . 1 1 55 55 LEU HA H 1 3.643 0.2 . 1 . . . . 54 LEU HA . 6615 1 703 . 1 1 55 55 LEU HB2 H 1 1.810 0.2 . 2 . . . . 54 LEU HB2 . 6615 1 704 . 1 1 55 55 LEU HB3 H 1 1.860 0.2 . 2 . . . . 54 LEU HB3 . 6615 1 705 . 1 1 55 55 LEU HG H 1 1.320 0.2 . 1 . . . . 54 LEU HG . 6615 1 706 . 1 1 55 55 LEU HD11 H 1 0.780 0.2 . 1 . . . . 54 LEU HD1 . 6615 1 707 . 1 1 55 55 LEU HD12 H 1 0.780 0.2 . 1 . . . . 54 LEU HD1 . 6615 1 708 . 1 1 55 55 LEU HD13 H 1 0.780 0.2 . 1 . . . . 54 LEU HD1 . 6615 1 709 . 1 1 55 55 LEU HD21 H 1 0.780 0.2 . 1 . . . . 54 LEU HD2 . 6615 1 710 . 1 1 55 55 LEU HD22 H 1 0.780 0.2 . 1 . . . . 54 LEU HD2 . 6615 1 711 . 1 1 55 55 LEU HD23 H 1 0.780 0.2 . 1 . . . . 54 LEU HD2 . 6615 1 712 . 1 1 55 55 LEU C C 13 178.177 0.2 . 1 . . . . 54 LEU C . 6615 1 713 . 1 1 55 55 LEU CA C 13 58.150 0.2 . 1 . . . . 54 LEU CA . 6615 1 714 . 1 1 55 55 LEU CB C 13 41.104 0.2 . 1 . . . . 54 LEU CB . 6615 1 715 . 1 1 55 55 LEU CG C 13 27.380 0.2 . 1 . . . . 54 LEU CG . 6615 1 716 . 1 1 55 55 LEU CD1 C 13 25.770 0.2 . 1 . . . . 54 LEU CD1 . 6615 1 717 . 1 1 55 55 LEU CD2 C 13 23.740 0.2 . 1 . . . . 54 LEU CD2 . 6615 1 718 . 1 1 55 55 LEU N N 15 125.956 0.2 . 1 . . . . 54 LEU N . 6615 1 719 . 1 1 56 56 GLU H H 1 8.480 0.2 . 1 . . . . 55 GLU H . 6615 1 720 . 1 1 56 56 GLU HA H 1 3.633 0.2 . 1 . . . . 55 GLU HA . 6615 1 721 . 1 1 56 56 GLU HB2 H 1 2.095 0.2 . 2 . . . . 55 GLU HB2 . 6615 1 722 . 1 1 56 56 GLU HB3 H 1 2.216 0.2 . 2 . . . . 55 GLU HB3 . 6615 1 723 . 1 1 56 56 GLU HG2 H 1 2.060 0.2 . 2 . . . . 55 GLU HG2 . 6615 1 724 . 1 1 56 56 GLU HG3 H 1 2.400 0.2 . 2 . . . . 55 GLU HG3 . 6615 1 725 . 1 1 56 56 GLU C C 13 177.703 0.2 . 1 . . . . 55 GLU C . 6615 1 726 . 1 1 56 56 GLU CA C 13 60.511 0.2 . 1 . . . . 55 GLU CA . 6615 1 727 . 1 1 56 56 GLU CB C 13 28.870 0.2 . 1 . . . . 55 GLU CB . 6615 1 728 . 1 1 56 56 GLU CG C 13 37.170 0.2 . 1 . . . . 55 GLU CG . 6615 1 729 . 1 1 56 56 GLU N N 15 118.245 0.2 . 1 . . . . 55 GLU N . 6615 1 730 . 1 1 57 57 ARG H H 1 7.516 0.2 . 1 . . . . 56 ARG H . 6615 1 731 . 1 1 57 57 ARG HA H 1 4.056 0.2 . 1 . . . . 56 ARG HA . 6615 1 732 . 1 1 57 57 ARG HB2 H 1 2.012 0.2 . 2 . . . . 56 ARG HB2 . 6615 1 733 . 1 1 57 57 ARG HB3 H 1 2.121 0.2 . 2 . . . . 56 ARG HB3 . 6615 1 734 . 1 1 57 57 ARG HG2 H 1 1.700 0.2 . 1 . . . . 56 ARG HG2 . 6615 1 735 . 1 1 57 57 ARG HG3 H 1 1.700 0.2 . 1 . . . . 56 ARG HG3 . 6615 1 736 . 1 1 57 57 ARG C C 13 180.128 0.2 . 1 . . . . 56 ARG C . 6615 1 737 . 1 1 57 57 ARG CA C 13 59.288 0.2 . 1 . . . . 56 ARG CA . 6615 1 738 . 1 1 57 57 ARG CB C 13 29.689 0.2 . 1 . . . . 56 ARG CB . 6615 1 739 . 1 1 57 57 ARG CG C 13 27.420 0.2 . 1 . . . . 56 ARG CG . 6615 1 740 . 1 1 57 57 ARG CD C 13 43.250 0.2 . 1 . . . . 56 ARG CD . 6615 1 741 . 1 1 57 57 ARG N N 15 117.944 0.2 . 1 . . . . 56 ARG N . 6615 1 742 . 1 1 58 58 GLN H H 1 8.059 0.2 . 1 . . . . 57 GLN H . 6615 1 743 . 1 1 58 58 GLN HA H 1 4.458 0.2 . 1 . . . . 57 GLN HA . 6615 1 744 . 1 1 58 58 GLN HB2 H 1 1.921 0.2 . 1 . . . . 57 GLN HB2 . 6615 1 745 . 1 1 58 58 GLN HB3 H 1 1.921 0.2 . 1 . . . . 57 GLN HB3 . 6615 1 746 . 1 1 58 58 GLN HG2 H 1 2.470 0.2 . 2 . . . . 57 GLN HG2 . 6615 1 747 . 1 1 58 58 GLN HG3 H 1 2.550 0.2 . 2 . . . . 57 GLN HG3 . 6615 1 748 . 1 1 58 58 GLN HE21 H 1 6.660 0.2 . 2 . . . . 57 GLN HE21 . 6615 1 749 . 1 1 58 58 GLN HE22 H 1 8.020 0.2 . 2 . . . . 57 GLN HE22 . 6615 1 750 . 1 1 58 58 GLN C C 13 178.605 0.2 . 1 . . . . 57 GLN C . 6615 1 751 . 1 1 58 58 GLN CA C 13 57.534 0.2 . 1 . . . . 57 GLN CA . 6615 1 752 . 1 1 58 58 GLN CB C 13 27.639 0.2 . 1 . . . . 57 GLN CB . 6615 1 753 . 1 1 58 58 GLN CG C 13 31.200 0.2 . 1 . . . . 57 GLN CG . 6615 1 754 . 1 1 58 58 GLN N N 15 118.842 0.2 . 1 . . . . 57 GLN N . 6615 1 755 . 1 1 58 58 GLN NE2 N 15 112.240 0.2 . 1 . . . . 57 GLN NE2 . 6615 1 756 . 1 1 59 59 LEU H H 1 7.903 0.2 . 1 . . . . 58 LEU H . 6615 1 757 . 1 1 59 59 LEU HA H 1 3.799 0.2 . 1 . . . . 58 LEU HA . 6615 1 758 . 1 1 59 59 LEU HB2 H 1 1.051 0.2 . 2 . . . . 58 LEU HB2 . 6615 1 759 . 1 1 59 59 LEU HB3 H 1 2.022 0.2 . 2 . . . . 58 LEU HB3 . 6615 1 760 . 1 1 59 59 LEU HG H 1 1.910 0.2 . 1 . . . . 58 LEU HG . 6615 1 761 . 1 1 59 59 LEU HD11 H 1 0.720 0.2 . 1 . . . . 58 LEU HD1 . 6615 1 762 . 1 1 59 59 LEU HD12 H 1 0.720 0.2 . 1 . . . . 58 LEU HD1 . 6615 1 763 . 1 1 59 59 LEU HD13 H 1 0.720 0.2 . 1 . . . . 58 LEU HD1 . 6615 1 764 . 1 1 59 59 LEU HD21 H 1 0.570 0.2 . 1 . . . . 58 LEU HD2 . 6615 1 765 . 1 1 59 59 LEU HD22 H 1 0.570 0.2 . 1 . . . . 58 LEU HD2 . 6615 1 766 . 1 1 59 59 LEU HD23 H 1 0.570 0.2 . 1 . . . . 58 LEU HD2 . 6615 1 767 . 1 1 59 59 LEU C C 13 179.213 0.2 . 1 . . . . 58 LEU C . 6615 1 768 . 1 1 59 59 LEU CA C 13 57.489 0.2 . 1 . . . . 58 LEU CA . 6615 1 769 . 1 1 59 59 LEU CB C 13 41.254 0.2 . 1 . . . . 58 LEU CB . 6615 1 770 . 1 1 59 59 LEU CG C 13 27.790 0.2 . 1 . . . . 58 LEU CG . 6615 1 771 . 1 1 59 59 LEU CD1 C 13 25.970 0.2 . 1 . . . . 58 LEU CD1 . 6615 1 772 . 1 1 59 59 LEU CD2 C 13 22.320 0.2 . 1 . . . . 58 LEU CD2 . 6615 1 773 . 1 1 59 59 LEU N N 15 117.230 0.2 . 1 . . . . 58 LEU N . 6615 1 774 . 1 1 60 60 ALA H H 1 8.561 0.2 . 1 . . . . 59 ALA H . 6615 1 775 . 1 1 60 60 ALA HA H 1 3.728 0.2 . 1 . . . . 59 ALA HA . 6615 1 776 . 1 1 60 60 ALA HB1 H 1 1.503 0.2 . 1 . . . . 59 ALA HB . 6615 1 777 . 1 1 60 60 ALA HB2 H 1 1.503 0.2 . 1 . . . . 59 ALA HB . 6615 1 778 . 1 1 60 60 ALA HB3 H 1 1.503 0.2 . 1 . . . . 59 ALA HB . 6615 1 779 . 1 1 60 60 ALA C C 13 178.515 0.2 . 1 . . . . 59 ALA C . 6615 1 780 . 1 1 60 60 ALA CA C 13 55.726 0.2 . 1 . . . . 59 ALA CA . 6615 1 781 . 1 1 60 60 ALA CB C 13 17.940 0.2 . 1 . . . . 59 ALA CB . 6615 1 782 . 1 1 60 60 ALA N N 15 122.618 0.2 . 1 . . . . 59 ALA N . 6615 1 783 . 1 1 61 61 ALA H H 1 7.436 0.2 . 1 . . . . 60 ALA H . 6615 1 784 . 1 1 61 61 ALA HA H 1 3.975 0.2 . 1 . . . . 60 ALA HA . 6615 1 785 . 1 1 61 61 ALA HB1 H 1 1.547 0.2 . 1 . . . . 60 ALA HB . 6615 1 786 . 1 1 61 61 ALA HB2 H 1 1.547 0.2 . 1 . . . . 60 ALA HB . 6615 1 787 . 1 1 61 61 ALA HB3 H 1 1.547 0.2 . 1 . . . . 60 ALA HB . 6615 1 788 . 1 1 61 61 ALA C C 13 181.050 0.2 . 1 . . . . 60 ALA C . 6615 1 789 . 1 1 61 61 ALA CA C 13 55.076 0.2 . 1 . . . . 60 ALA CA . 6615 1 790 . 1 1 61 61 ALA CB C 13 17.688 0.2 . 1 . . . . 60 ALA CB . 6615 1 791 . 1 1 61 61 ALA N N 15 119.674 0.2 . 1 . . . . 60 ALA N . 6615 1 792 . 1 1 62 62 ILE H H 1 7.658 0.2 . 1 . . . . 61 ILE H . 6615 1 793 . 1 1 62 62 ILE HA H 1 3.478 0.2 . 1 . . . . 61 ILE HA . 6615 1 794 . 1 1 62 62 ILE HB H 1 1.837 0.2 . 1 . . . . 61 ILE HB . 6615 1 795 . 1 1 62 62 ILE HG12 H 1 1.880 0.2 . 1 . . . . 61 ILE HG12 . 6615 1 796 . 1 1 62 62 ILE HG13 H 1 1.920 0.2 . 1 . . . . 61 ILE HG13 . 6615 1 797 . 1 1 62 62 ILE HG21 H 1 0.460 0.2 . 1 . . . . 61 ILE HG2 . 6615 1 798 . 1 1 62 62 ILE HG22 H 1 0.460 0.2 . 1 . . . . 61 ILE HG2 . 6615 1 799 . 1 1 62 62 ILE HG23 H 1 0.460 0.2 . 1 . . . . 61 ILE HG2 . 6615 1 800 . 1 1 62 62 ILE HD11 H 1 0.570 0.2 . 1 . . . . 61 ILE HD1 . 6615 1 801 . 1 1 62 62 ILE HD12 H 1 0.570 0.2 . 1 . . . . 61 ILE HD1 . 6615 1 802 . 1 1 62 62 ILE HD13 H 1 0.570 0.2 . 1 . . . . 61 ILE HD1 . 6615 1 803 . 1 1 62 62 ILE C C 13 177.314 0.2 . 1 . . . . 61 ILE C . 6615 1 804 . 1 1 62 62 ILE CA C 13 65.695 0.2 . 1 . . . . 61 ILE CA . 6615 1 805 . 1 1 62 62 ILE CB C 13 37.779 0.2 . 1 . . . . 61 ILE CB . 6615 1 806 . 1 1 62 62 ILE CG1 C 13 30.090 0.2 . 1 . . . . 61 ILE CG1 . 6615 1 807 . 1 1 62 62 ILE CG2 C 13 16.980 0.2 . 1 . . . . 61 ILE CG2 . 6615 1 808 . 1 1 62 62 ILE CD1 C 13 14.600 0.2 . 1 . . . . 61 ILE CD1 . 6615 1 809 . 1 1 62 62 ILE N N 15 118.424 0.2 . 1 . . . . 61 ILE N . 6615 1 810 . 1 1 63 63 CYS H H 1 7.966 0.2 . 1 . . . . 62 CYS H . 6615 1 811 . 1 1 63 63 CYS HA H 1 3.641 0.2 . 1 . . . . 62 CYS HA . 6615 1 812 . 1 1 63 63 CYS HB2 H 1 1.850 0.2 . 2 . . . . 62 CYS HB2 . 6615 1 813 . 1 1 63 63 CYS HB3 H 1 2.284 0.2 . 2 . . . . 62 CYS HB3 . 6615 1 814 . 1 1 63 63 CYS C C 13 175.758 0.2 . 1 . . . . 62 CYS C . 6615 1 815 . 1 1 63 63 CYS CA C 13 64.346 0.2 . 1 . . . . 62 CYS CA . 6615 1 816 . 1 1 63 63 CYS CB C 13 26.330 0.2 . 1 . . . . 62 CYS CB . 6615 1 817 . 1 1 63 63 CYS N N 15 116.870 0.2 . 1 . . . . 62 CYS N . 6615 1 818 . 1 1 64 64 ARG H H 1 8.269 0.2 . 1 . . . . 63 ARG H . 6615 1 819 . 1 1 64 64 ARG HA H 1 3.890 0.2 . 1 . . . . 63 ARG HA . 6615 1 820 . 1 1 64 64 ARG HB2 H 1 1.823 0.2 . 2 . . . . 63 ARG HB2 . 6615 1 821 . 1 1 64 64 ARG HB3 H 1 1.925 0.2 . 2 . . . . 63 ARG HB3 . 6615 1 822 . 1 1 64 64 ARG HG2 H 1 1.590 0.2 . 2 . . . . 63 ARG HG2 . 6615 1 823 . 1 1 64 64 ARG HG3 H 1 1.790 0.2 . 2 . . . . 63 ARG HG3 . 6615 1 824 . 1 1 64 64 ARG HD2 H 1 3.340 0.2 . 1 . . . . 63 ARG HD2 . 6615 1 825 . 1 1 64 64 ARG HD3 H 1 3.340 0.2 . 1 . . . . 63 ARG HD3 . 6615 1 826 . 1 1 64 64 ARG C C 13 179.084 0.2 . 1 . . . . 63 ARG C . 6615 1 827 . 1 1 64 64 ARG CA C 13 59.643 0.2 . 1 . . . . 63 ARG CA . 6615 1 828 . 1 1 64 64 ARG CB C 13 30.181 0.2 . 1 . . . . 63 ARG CB . 6615 1 829 . 1 1 64 64 ARG CG C 13 27.560 0.2 . 1 . . . . 63 ARG CG . 6615 1 830 . 1 1 64 64 ARG CD C 13 43.490 0.2 . 1 . . . . 63 ARG CD . 6615 1 831 . 1 1 64 64 ARG N N 15 119.551 0.2 . 1 . . . . 63 ARG N . 6615 1 832 . 1 1 65 65 LYS H H 1 7.583 0.2 . 1 . . . . 64 LYS H . 6615 1 833 . 1 1 65 65 LYS HA H 1 4.066 0.2 . 1 . . . . 64 LYS HA . 6615 1 834 . 1 1 65 65 LYS HB2 H 1 1.983 0.2 . 2 . . . . 64 LYS HB2 . 6615 1 835 . 1 1 65 65 LYS HB3 H 1 2.095 0.2 . 2 . . . . 64 LYS HB3 . 6615 1 836 . 1 1 65 65 LYS HG2 H 1 1.440 0.2 . 2 . . . . 64 LYS HG2 . 6615 1 837 . 1 1 65 65 LYS HG3 H 1 1.630 0.2 . 2 . . . . 64 LYS HG3 . 6615 1 838 . 1 1 65 65 LYS HD2 H 1 2.010 0.2 . 2 . . . . 64 LYS HD2 . 6615 1 839 . 1 1 65 65 LYS HD3 H 1 2.110 0.2 . 2 . . . . 64 LYS HD3 . 6615 1 840 . 1 1 65 65 LYS HE2 H 1 3.240 0.2 . 1 . . . . 64 LYS HE2 . 6615 1 841 . 1 1 65 65 LYS HE3 H 1 3.240 0.2 . 1 . . . . 64 LYS HE3 . 6615 1 842 . 1 1 65 65 LYS C C 13 179.703 0.2 . 1 . . . . 64 LYS C . 6615 1 843 . 1 1 65 65 LYS CA C 13 59.351 0.2 . 1 . . . . 64 LYS CA . 6615 1 844 . 1 1 65 65 LYS CB C 13 32.493 0.2 . 1 . . . . 64 LYS CB . 6615 1 845 . 1 1 65 65 LYS CG C 13 25.960 0.2 . 1 . . . . 64 LYS CG . 6615 1 846 . 1 1 65 65 LYS CD C 13 29.250 0.2 . 1 . . . . 64 LYS CD . 6615 1 847 . 1 1 65 65 LYS CE C 13 42.090 0.2 . 1 . . . . 64 LYS CE . 6615 1 848 . 1 1 65 65 LYS N N 15 119.175 0.2 . 1 . . . . 64 LYS N . 6615 1 849 . 1 1 66 66 ALA H H 1 8.853 0.2 . 1 . . . . 65 ALA H . 6615 1 850 . 1 1 66 66 ALA HA H 1 4.057 0.2 . 1 . . . . 65 ALA HA . 6615 1 851 . 1 1 66 66 ALA HB1 H 1 1.341 0.2 . 1 . . . . 65 ALA HB . 6615 1 852 . 1 1 66 66 ALA HB2 H 1 1.341 0.2 . 1 . . . . 65 ALA HB . 6615 1 853 . 1 1 66 66 ALA HB3 H 1 1.341 0.2 . 1 . . . . 65 ALA HB . 6615 1 854 . 1 1 66 66 ALA C C 13 178.219 0.2 . 1 . . . . 65 ALA C . 6615 1 855 . 1 1 66 66 ALA CA C 13 54.938 0.2 . 1 . . . . 65 ALA CA . 6615 1 856 . 1 1 66 66 ALA CB C 13 18.696 0.2 . 1 . . . . 65 ALA CB . 6615 1 857 . 1 1 66 66 ALA N N 15 122.176 0.2 . 1 . . . . 65 ALA N . 6615 1 858 . 1 1 67 67 ALA H H 1 8.456 0.2 . 1 . . . . 66 ALA H . 6615 1 859 . 1 1 67 67 ALA HA H 1 4.002 0.2 . 1 . . . . 66 ALA HA . 6615 1 860 . 1 1 67 67 ALA HB1 H 1 1.600 0.2 . 1 . . . . 66 ALA HB . 6615 1 861 . 1 1 67 67 ALA HB2 H 1 1.600 0.2 . 1 . . . . 66 ALA HB . 6615 1 862 . 1 1 67 67 ALA HB3 H 1 1.600 0.2 . 1 . . . . 66 ALA HB . 6615 1 863 . 1 1 67 67 ALA C C 13 179.643 0.2 . 1 . . . . 66 ALA C . 6615 1 864 . 1 1 67 67 ALA CA C 13 55.263 0.2 . 1 . . . . 66 ALA CA . 6615 1 865 . 1 1 67 67 ALA CB C 13 17.707 0.2 . 1 . . . . 66 ALA CB . 6615 1 866 . 1 1 67 67 ALA N N 15 118.053 0.2 . 1 . . . . 66 ALA N . 6615 1 867 . 1 1 68 68 LYS H H 1 7.292 0.2 . 1 . . . . 67 LYS H . 6615 1 868 . 1 1 68 68 LYS HA H 1 4.101 0.2 . 1 . . . . 67 LYS HA . 6615 1 869 . 1 1 68 68 LYS HB2 H 1 1.931 0.2 . 1 . . . . 67 LYS HB2 . 6615 1 870 . 1 1 68 68 LYS HB3 H 1 1.931 0.2 . 1 . . . . 67 LYS HB3 . 6615 1 871 . 1 1 68 68 LYS HG2 H 1 1.420 0.2 . 2 . . . . 67 LYS HG2 . 6615 1 872 . 1 1 68 68 LYS HG3 H 1 1.620 0.2 . 2 . . . . 67 LYS HG3 . 6615 1 873 . 1 1 68 68 LYS HD2 H 1 2.050 0.2 . 1 . . . . 67 LYS HD2 . 6615 1 874 . 1 1 68 68 LYS HD3 H 1 2.050 0.2 . 1 . . . . 67 LYS HD3 . 6615 1 875 . 1 1 68 68 LYS HE2 H 1 2.920 0.2 . 1 . . . . 67 LYS HE2 . 6615 1 876 . 1 1 68 68 LYS HE3 H 1 2.920 0.2 . 1 . . . . 67 LYS HE3 . 6615 1 877 . 1 1 68 68 LYS C C 13 178.364 0.2 . 1 . . . . 67 LYS C . 6615 1 878 . 1 1 68 68 LYS CA C 13 58.415 0.2 . 1 . . . . 67 LYS CA . 6615 1 879 . 1 1 68 68 LYS CB C 13 32.214 0.2 . 1 . . . . 67 LYS CB . 6615 1 880 . 1 1 68 68 LYS CG C 13 24.780 0.2 . 1 . . . . 67 LYS CG . 6615 1 881 . 1 1 68 68 LYS CD C 13 29.020 0.2 . 1 . . . . 67 LYS CD . 6615 1 882 . 1 1 68 68 LYS CE C 13 41.920 0.2 . 1 . . . . 67 LYS CE . 6615 1 883 . 1 1 68 68 LYS N N 15 115.957 0.2 . 1 . . . . 67 LYS N . 6615 1 884 . 1 1 69 69 ALA H H 1 7.632 0.2 . 1 . . . . 68 ALA H . 6615 1 885 . 1 1 69 69 ALA HA H 1 4.166 0.2 . 1 . . . . 68 ALA HA . 6615 1 886 . 1 1 69 69 ALA HB1 H 1 1.478 0.2 . 1 . . . . 68 ALA HB . 6615 1 887 . 1 1 69 69 ALA HB2 H 1 1.478 0.2 . 1 . . . . 68 ALA HB . 6615 1 888 . 1 1 69 69 ALA HB3 H 1 1.478 0.2 . 1 . . . . 68 ALA HB . 6615 1 889 . 1 1 69 69 ALA C C 13 179.642 0.2 . 1 . . . . 68 ALA C . 6615 1 890 . 1 1 69 69 ALA CA C 13 54.275 0.2 . 1 . . . . 68 ALA CA . 6615 1 891 . 1 1 69 69 ALA CB C 13 18.681 0.2 . 1 . . . . 68 ALA CB . 6615 1 892 . 1 1 69 69 ALA N N 15 121.337 0.2 . 1 . . . . 68 ALA N . 6615 1 893 . 1 1 70 70 ILE H H 1 8.054 0.2 . 1 . . . . 69 ILE H . 6615 1 894 . 1 1 70 70 ILE HA H 1 3.980 0.2 . 1 . . . . 69 ILE HA . 6615 1 895 . 1 1 70 70 ILE HB H 1 1.920 0.2 . 1 . . . . 69 ILE HB . 6615 1 896 . 1 1 70 70 ILE HG12 H 1 1.310 0.2 . 1 . . . . 69 ILE HG12 . 6615 1 897 . 1 1 70 70 ILE HG13 H 1 1.310 0.2 . 1 . . . . 69 ILE HG13 . 6615 1 898 . 1 1 70 70 ILE HG21 H 1 0.740 0.2 . 1 . . . . 69 ILE HG2 . 6615 1 899 . 1 1 70 70 ILE HG22 H 1 0.740 0.2 . 1 . . . . 69 ILE HG2 . 6615 1 900 . 1 1 70 70 ILE HG23 H 1 0.740 0.2 . 1 . . . . 69 ILE HG2 . 6615 1 901 . 1 1 70 70 ILE HD11 H 1 0.900 0.2 . 1 . . . . 69 ILE HD1 . 6615 1 902 . 1 1 70 70 ILE HD12 H 1 0.900 0.2 . 1 . . . . 69 ILE HD1 . 6615 1 903 . 1 1 70 70 ILE HD13 H 1 0.900 0.2 . 1 . . . . 69 ILE HD1 . 6615 1 904 . 1 1 70 70 ILE C C 13 178.080 0.2 . 1 . . . . 69 ILE C . 6615 1 905 . 1 1 70 70 ILE CA C 13 62.830 0.2 . 1 . . . . 69 ILE CA . 6615 1 906 . 1 1 70 70 ILE CB C 13 37.840 0.2 . 1 . . . . 69 ILE CB . 6615 1 907 . 1 1 70 70 ILE N N 15 116.970 0.2 . 1 . . . . 69 ILE N . 6615 1 908 . 1 1 71 71 VAL H H 1 7.600 0.2 . 1 . . . . 70 VAL H . 6615 1 909 . 1 1 71 71 VAL HA H 1 3.844 0.2 . 1 . . . . 70 VAL HA . 6615 1 910 . 1 1 71 71 VAL HB H 1 2.120 0.2 . 1 . . . . 70 VAL HB . 6615 1 911 . 1 1 71 71 VAL HG11 H 1 0.970 0.2 . 1 . . . . 70 VAL HG1 . 6615 1 912 . 1 1 71 71 VAL HG12 H 1 0.970 0.2 . 1 . . . . 70 VAL HG1 . 6615 1 913 . 1 1 71 71 VAL HG13 H 1 0.970 0.2 . 1 . . . . 70 VAL HG1 . 6615 1 914 . 1 1 71 71 VAL HG21 H 1 1.070 0.2 . 1 . . . . 70 VAL HG2 . 6615 1 915 . 1 1 71 71 VAL HG22 H 1 1.070 0.2 . 1 . . . . 70 VAL HG2 . 6615 1 916 . 1 1 71 71 VAL HG23 H 1 1.070 0.2 . 1 . . . . 70 VAL HG2 . 6615 1 917 . 1 1 71 71 VAL C C 13 177.419 0.2 . 1 . . . . 70 VAL C . 6615 1 918 . 1 1 71 71 VAL CA C 13 64.861 0.2 . 1 . . . . 70 VAL CA . 6615 1 919 . 1 1 71 71 VAL CB C 13 31.779 0.2 . 1 . . . . 70 VAL CB . 6615 1 920 . 1 1 71 71 VAL CG1 C 13 20.870 0.2 . 1 . . . . 70 VAL CG1 . 6615 1 921 . 1 1 71 71 VAL CG2 C 13 21.660 0.2 . 1 . . . . 70 VAL CG2 . 6615 1 922 . 1 1 71 71 VAL N N 15 119.000 0.2 . 1 . . . . 70 VAL N . 6615 1 923 . 1 1 72 72 ALA H H 1 7.803 0.2 . 1 . . . . 71 ALA H . 6615 1 924 . 1 1 72 72 ALA HA H 1 4.301 0.2 . 1 . . . . 71 ALA HA . 6615 1 925 . 1 1 72 72 ALA HB1 H 1 1.480 0.2 . 1 . . . . 71 ALA HB . 6615 1 926 . 1 1 72 72 ALA HB2 H 1 1.480 0.2 . 1 . . . . 71 ALA HB . 6615 1 927 . 1 1 72 72 ALA HB3 H 1 1.480 0.2 . 1 . . . . 71 ALA HB . 6615 1 928 . 1 1 72 72 ALA C C 13 177.980 0.2 . 1 . . . . 71 ALA C . 6615 1 929 . 1 1 72 72 ALA CA C 13 53.198 0.2 . 1 . . . . 71 ALA CA . 6615 1 930 . 1 1 72 72 ALA CB C 13 19.245 0.2 . 1 . . . . 71 ALA CB . 6615 1 931 . 1 1 72 72 ALA N N 15 121.017 0.2 . 1 . . . . 71 ALA N . 6615 1 932 . 1 1 73 73 GLU H H 1 7.833 0.2 . 1 . . . . 72 GLU H . 6615 1 933 . 1 1 73 73 GLU HA H 1 4.310 0.2 . 1 . . . . 72 GLU HA . 6615 1 934 . 1 1 73 73 GLU HB2 H 1 2.030 0.2 . 1 . . . . 72 GLU HB2 . 6615 1 935 . 1 1 73 73 GLU HB3 H 1 2.030 0.2 . 1 . . . . 72 GLU HB3 . 6615 1 936 . 1 1 73 73 GLU HG2 H 1 2.200 0.2 . 1 . . . . 72 GLU HG2 . 6615 1 937 . 1 1 73 73 GLU HG3 H 1 2.200 0.2 . 1 . . . . 72 GLU HG3 . 6615 1 938 . 1 1 73 73 GLU CA C 13 55.677 0.2 . 1 . . . . 72 GLU CA . 6615 1 939 . 1 1 73 73 GLU CB C 13 29.677 0.2 . 1 . . . . 72 GLU CB . 6615 1 940 . 1 1 73 73 GLU N N 15 115.749 0.2 . 1 . . . . 72 GLU N . 6615 1 941 . 1 1 74 74 GLU HA H 1 4.090 0.2 . 1 . . . . 73 GLU HA . 6615 1 942 . 1 1 74 74 GLU HB2 H 1 2.040 0.2 . 1 . . . . 73 GLU HB2 . 6615 1 943 . 1 1 74 74 GLU HB3 H 1 2.040 0.2 . 1 . . . . 73 GLU HB3 . 6615 1 944 . 1 1 74 74 GLU HG2 H 1 2.210 0.2 . 1 . . . . 73 GLU HG2 . 6615 1 945 . 1 1 74 74 GLU HG3 H 1 2.210 0.2 . 1 . . . . 73 GLU HG3 . 6615 1 946 . 1 1 74 74 GLU C C 13 176.750 0.2 . 1 . . . . 73 GLU C . 6615 1 947 . 1 1 74 74 GLU CA C 13 57.860 0.2 . 1 . . . . 73 GLU CA . 6615 1 948 . 1 1 74 74 GLU CB C 13 28.930 0.2 . 1 . . . . 73 GLU CB . 6615 1 949 . 1 1 74 74 GLU CG C 13 36.270 0.2 . 1 . . . . 73 GLU CG . 6615 1 950 . 1 1 75 75 ARG H H 1 7.790 0.2 . 1 . . . . 74 ARG H . 6615 1 951 . 1 1 75 75 ARG HA H 1 4.400 0.2 . 1 . . . . 74 ARG HA . 6615 1 952 . 1 1 75 75 ARG HB2 H 1 1.590 0.2 . 2 . . . . 74 ARG HB2 . 6615 1 953 . 1 1 75 75 ARG HB3 H 1 1.870 0.2 . 2 . . . . 74 ARG HB3 . 6615 1 954 . 1 1 75 75 ARG HD2 H 1 3.180 0.2 . 1 . . . . 74 ARG HD2 . 6615 1 955 . 1 1 75 75 ARG HD3 H 1 3.180 0.2 . 1 . . . . 74 ARG HD3 . 6615 1 956 . 1 1 75 75 ARG CA C 13 54.900 0.2 . 1 . . . . 74 ARG CA . 6615 1 957 . 1 1 75 75 ARG CB C 13 31.170 0.2 . 1 . . . . 74 ARG CB . 6615 1 958 . 1 1 75 75 ARG CD C 13 42.830 0.2 . 1 . . . . 74 ARG CD . 6615 1 959 . 1 1 75 75 ARG N N 15 116.550 0.2 . 1 . . . . 74 ARG N . 6615 1 960 . 1 1 76 76 LYS HA H 1 4.203 0.2 . 1 . . . . 75 LYS HA . 6615 1 961 . 1 1 76 76 LYS HB2 H 1 1.772 0.2 . 1 . . . . 75 LYS HB2 . 6615 1 962 . 1 1 76 76 LYS HB3 H 1 1.772 0.2 . 1 . . . . 75 LYS HB3 . 6615 1 963 . 1 1 76 76 LYS HG2 H 1 1.340 0.2 . 2 . . . . 75 LYS HG2 . 6615 1 964 . 1 1 76 76 LYS HG3 H 1 1.420 0.2 . 2 . . . . 75 LYS HG3 . 6615 1 965 . 1 1 76 76 LYS HD2 H 1 1.620 0.2 . 1 . . . . 75 LYS HD2 . 6615 1 966 . 1 1 76 76 LYS HD3 H 1 1.620 0.2 . 1 . . . . 75 LYS HD3 . 6615 1 967 . 1 1 76 76 LYS HE2 H 1 3.260 0.2 . 1 . . . . 75 LYS HE2 . 6615 1 968 . 1 1 76 76 LYS HE3 H 1 3.260 0.2 . 1 . . . . 75 LYS HE3 . 6615 1 969 . 1 1 76 76 LYS C C 13 175.494 0.2 . 1 . . . . 75 LYS C . 6615 1 970 . 1 1 76 76 LYS CA C 13 56.536 0.2 . 1 . . . . 75 LYS CA . 6615 1 971 . 1 1 76 76 LYS CB C 13 32.996 0.2 . 1 . . . . 75 LYS CB . 6615 1 972 . 1 1 76 76 LYS CG C 13 24.780 0.2 . 1 . . . . 75 LYS CG . 6615 1 973 . 1 1 76 76 LYS CD C 13 28.770 0.2 . 1 . . . . 75 LYS CD . 6615 1 974 . 1 1 76 76 LYS CE C 13 42.180 0.2 . 1 . . . . 75 LYS CE . 6615 1 975 . 1 1 77 77 ARG H H 1 7.716 0.2 . 1 . . . . 76 ARG H . 6615 1 976 . 1 1 77 77 ARG HA H 1 4.740 0.2 . 1 . . . . 76 ARG HA . 6615 1 977 . 1 1 77 77 ARG HB2 H 1 1.697 0.2 . 1 . . . . 76 ARG HB2 . 6615 1 978 . 1 1 77 77 ARG HB3 H 1 1.697 0.2 . 1 . . . . 76 ARG HB3 . 6615 1 979 . 1 1 77 77 ARG HG2 H 1 1.320 0.2 . 2 . . . . 76 ARG HG2 . 6615 1 980 . 1 1 77 77 ARG HG3 H 1 1.390 0.2 . 2 . . . . 76 ARG HG3 . 6615 1 981 . 1 1 77 77 ARG HD2 H 1 3.030 0.2 . 1 . . . . 76 ARG HD2 . 6615 1 982 . 1 1 77 77 ARG HD3 H 1 3.030 0.2 . 1 . . . . 76 ARG HD3 . 6615 1 983 . 1 1 77 77 ARG C C 13 174.526 0.2 . 1 . . . . 76 ARG C . 6615 1 984 . 1 1 77 77 ARG CA C 13 55.048 0.2 . 1 . . . . 76 ARG CA . 6615 1 985 . 1 1 77 77 ARG CB C 13 32.388 0.2 . 1 . . . . 76 ARG CB . 6615 1 986 . 1 1 77 77 ARG CG C 13 26.280 0.2 . 1 . . . . 76 ARG CG . 6615 1 987 . 1 1 77 77 ARG CD C 13 43.520 0.2 . 1 . . . . 76 ARG CD . 6615 1 988 . 1 1 77 77 ARG N N 15 119.423 0.2 . 1 . . . . 76 ARG N . 6615 1 989 . 1 1 78 78 ILE H H 1 8.421 0.2 . 1 . . . . 77 ILE H . 6615 1 990 . 1 1 78 78 ILE HA H 1 4.301 0.2 . 1 . . . . 77 ILE HA . 6615 1 991 . 1 1 78 78 ILE HB H 1 1.866 0.2 . 1 . . . . 77 ILE HB . 6615 1 992 . 1 1 78 78 ILE HG12 H 1 1.310 0.2 . 1 . . . . 77 ILE HG12 . 6615 1 993 . 1 1 78 78 ILE HG13 H 1 1.430 0.2 . 1 . . . . 77 ILE HG13 . 6615 1 994 . 1 1 78 78 ILE HG21 H 1 0.760 0.2 . 1 . . . . 77 ILE HG2 . 6615 1 995 . 1 1 78 78 ILE HG22 H 1 0.760 0.2 . 1 . . . . 77 ILE HG2 . 6615 1 996 . 1 1 78 78 ILE HG23 H 1 0.760 0.2 . 1 . . . . 77 ILE HG2 . 6615 1 997 . 1 1 78 78 ILE HD11 H 1 0.830 0.2 . 1 . . . . 77 ILE HD1 . 6615 1 998 . 1 1 78 78 ILE HD12 H 1 0.830 0.2 . 1 . . . . 77 ILE HD1 . 6615 1 999 . 1 1 78 78 ILE HD13 H 1 0.830 0.2 . 1 . . . . 77 ILE HD1 . 6615 1 1000 . 1 1 78 78 ILE C C 13 174.435 0.2 . 1 . . . . 77 ILE C . 6615 1 1001 . 1 1 78 78 ILE CA C 13 59.514 0.2 . 1 . . . . 77 ILE CA . 6615 1 1002 . 1 1 78 78 ILE CB C 13 39.261 0.2 . 1 . . . . 77 ILE CB . 6615 1 1003 . 1 1 78 78 ILE CG1 C 13 27.630 0.2 . 1 . . . . 77 ILE CG1 . 6615 1 1004 . 1 1 78 78 ILE CG2 C 13 17.430 0.2 . 1 . . . . 77 ILE CG2 . 6615 1 1005 . 1 1 78 78 ILE CD1 C 13 12.600 0.2 . 1 . . . . 77 ILE CD1 . 6615 1 1006 . 1 1 78 78 ILE N N 15 126.983 0.2 . 1 . . . . 77 ILE N . 6615 1 1007 . 1 1 79 79 THR H H 1 8.387 0.2 . 1 . . . . 78 THR H . 6615 1 1008 . 1 1 79 79 THR HA H 1 4.932 0.2 . 1 . . . . 78 THR HA . 6615 1 1009 . 1 1 79 79 THR HB H 1 3.865 0.2 . 1 . . . . 78 THR HB . 6615 1 1010 . 1 1 79 79 THR HG21 H 1 0.970 0.2 . 1 . . . . 78 THR HG2 . 6615 1 1011 . 1 1 79 79 THR HG22 H 1 0.970 0.2 . 1 . . . . 78 THR HG2 . 6615 1 1012 . 1 1 79 79 THR HG23 H 1 0.970 0.2 . 1 . . . . 78 THR HG2 . 6615 1 1013 . 1 1 79 79 THR C C 13 173.634 0.2 . 1 . . . . 78 THR C . 6615 1 1014 . 1 1 79 79 THR CA C 13 61.250 0.2 . 1 . . . . 78 THR CA . 6615 1 1015 . 1 1 79 79 THR CB C 13 69.340 0.2 . 1 . . . . 78 THR CB . 6615 1 1016 . 1 1 79 79 THR CG2 C 13 21.070 0.2 . 1 . . . . 78 THR CG2 . 6615 1 1017 . 1 1 79 79 THR N N 15 123.752 0.2 . 1 . . . . 78 THR N . 6615 1 1018 . 1 1 80 80 VAL H H 1 9.035 0.2 . 1 . . . . 79 VAL H . 6615 1 1019 . 1 1 80 80 VAL HA H 1 4.358 0.2 . 1 . . . . 79 VAL HA . 6615 1 1020 . 1 1 80 80 VAL HB H 1 1.755 0.2 . 1 . . . . 79 VAL HB . 6615 1 1021 . 1 1 80 80 VAL HG11 H 1 -0.040 0.2 . 1 . . . . 79 VAL HG1 . 6615 1 1022 . 1 1 80 80 VAL HG12 H 1 -0.040 0.2 . 1 . . . . 79 VAL HG1 . 6615 1 1023 . 1 1 80 80 VAL HG13 H 1 -0.040 0.2 . 1 . . . . 79 VAL HG1 . 6615 1 1024 . 1 1 80 80 VAL HG21 H 1 0.560 0.2 . 1 . . . . 79 VAL HG2 . 6615 1 1025 . 1 1 80 80 VAL HG22 H 1 0.560 0.2 . 1 . . . . 79 VAL HG2 . 6615 1 1026 . 1 1 80 80 VAL HG23 H 1 0.560 0.2 . 1 . . . . 79 VAL HG2 . 6615 1 1027 . 1 1 80 80 VAL C C 13 174.601 0.2 . 1 . . . . 79 VAL C . 6615 1 1028 . 1 1 80 80 VAL CA C 13 61.497 0.2 . 1 . . . . 79 VAL CA . 6615 1 1029 . 1 1 80 80 VAL CB C 13 31.596 0.2 . 1 . . . . 79 VAL CB . 6615 1 1030 . 1 1 80 80 VAL CG1 C 13 20.000 0.2 . 1 . . . . 79 VAL CG1 . 6615 1 1031 . 1 1 80 80 VAL CG2 C 13 21.250 0.2 . 1 . . . . 79 VAL CG2 . 6615 1 1032 . 1 1 80 80 VAL N N 15 129.691 0.2 . 1 . . . . 79 VAL N . 6615 1 1033 . 1 1 81 81 THR H H 1 9.670 0.2 . 1 . . . . 80 THR H . 6615 1 1034 . 1 1 81 81 THR HA H 1 4.510 0.2 . 1 . . . . 80 THR HA . 6615 1 1035 . 1 1 81 81 THR HB H 1 4.560 0.2 . 1 . . . . 80 THR HB . 6615 1 1036 . 1 1 81 81 THR HG21 H 1 1.090 0.2 . 1 . . . . 80 THR HG2 . 6615 1 1037 . 1 1 81 81 THR HG22 H 1 1.090 0.2 . 1 . . . . 80 THR HG2 . 6615 1 1038 . 1 1 81 81 THR HG23 H 1 1.090 0.2 . 1 . . . . 80 THR HG2 . 6615 1 1039 . 1 1 81 81 THR C C 13 173.571 0.2 . 1 . . . . 80 THR C . 6615 1 1040 . 1 1 81 81 THR CA C 13 58.948 0.2 . 1 . . . . 80 THR CA . 6615 1 1041 . 1 1 81 81 THR CB C 13 71.741 0.2 . 1 . . . . 80 THR CB . 6615 1 1042 . 1 1 81 81 THR CG2 C 13 20.970 0.2 . 1 . . . . 80 THR CG2 . 6615 1 1043 . 1 1 81 81 THR N N 15 118.516 0.2 . 1 . . . . 80 THR N . 6615 1 1044 . 1 1 82 82 GLU H H 1 10.811 0.2 . 1 . . . . 81 GLU H . 6615 1 1045 . 1 1 82 82 GLU HA H 1 4.150 0.2 . 1 . . . . 81 GLU HA . 6615 1 1046 . 1 1 82 82 GLU HB2 H 1 1.760 0.2 . 2 . . . . 81 GLU HB2 . 6615 1 1047 . 1 1 82 82 GLU HB3 H 1 2.280 0.2 . 2 . . . . 81 GLU HB3 . 6615 1 1048 . 1 1 82 82 GLU C C 13 175.730 0.2 . 1 . . . . 81 GLU C . 6615 1 1049 . 1 1 82 82 GLU CA C 13 58.850 0.2 . 1 . . . . 81 GLU CA . 6615 1 1050 . 1 1 82 82 GLU CB C 13 27.660 0.2 . 1 . . . . 81 GLU CB . 6615 1 1051 . 1 1 82 82 GLU N N 15 119.870 0.2 . 1 . . . . 81 GLU N . 6615 1 1052 . 1 1 83 83 LYS H H 1 8.030 0.2 . 1 . . . . 82 LYS H . 6615 1 1053 . 1 1 83 83 LYS HA H 1 4.328 0.2 . 1 . . . . 82 LYS HA . 6615 1 1054 . 1 1 83 83 LYS HB2 H 1 1.652 0.2 . 2 . . . . 82 LYS HB2 . 6615 1 1055 . 1 1 83 83 LYS HB3 H 1 1.845 0.2 . 2 . . . . 82 LYS HB3 . 6615 1 1056 . 1 1 83 83 LYS HG2 H 1 1.410 0.2 . 1 . . . . 82 LYS HG2 . 6615 1 1057 . 1 1 83 83 LYS HG3 H 1 1.410 0.2 . 1 . . . . 82 LYS HG3 . 6615 1 1058 . 1 1 83 83 LYS C C 13 177.240 0.2 . 1 . . . . 82 LYS C . 6615 1 1059 . 1 1 83 83 LYS CA C 13 57.173 0.2 . 1 . . . . 82 LYS CA . 6615 1 1060 . 1 1 83 83 LYS CB C 13 32.671 0.2 . 1 . . . . 82 LYS CB . 6615 1 1061 . 1 1 83 83 LYS CG C 13 25.170 0.2 . 1 . . . . 82 LYS CG . 6615 1 1062 . 1 1 83 83 LYS CD C 13 28.550 0.2 . 1 . . . . 82 LYS CD . 6615 1 1063 . 1 1 83 83 LYS CE C 13 42.120 0.2 . 1 . . . . 82 LYS CE . 6615 1 1064 . 1 1 83 83 LYS N N 15 118.840 0.2 . 1 . . . . 82 LYS N . 6615 1 1065 . 1 1 84 84 ASN H H 1 7.490 0.2 . 1 . . . . 83 ASN H . 6615 1 1066 . 1 1 84 84 ASN HA H 1 4.907 0.2 . 1 . . . . 83 ASN HA . 6615 1 1067 . 1 1 84 84 ASN HB2 H 1 2.670 0.2 . 2 . . . . 83 ASN HB2 . 6615 1 1068 . 1 1 84 84 ASN HB3 H 1 3.543 0.2 . 2 . . . . 83 ASN HB3 . 6615 1 1069 . 1 1 84 84 ASN HD21 H 1 7.170 0.2 . 2 . . . . 83 ASN HD21 . 6615 1 1070 . 1 1 84 84 ASN HD22 H 1 7.630 0.2 . 2 . . . . 83 ASN HD22 . 6615 1 1071 . 1 1 84 84 ASN C C 13 177.572 0.2 . 1 . . . . 83 ASN C . 6615 1 1072 . 1 1 84 84 ASN CA C 13 51.975 0.2 . 1 . . . . 83 ASN CA . 6615 1 1073 . 1 1 84 84 ASN CB C 13 38.560 0.2 . 1 . . . . 83 ASN CB . 6615 1 1074 . 1 1 84 84 ASN N N 15 115.310 0.2 . 1 . . . . 83 ASN N . 6615 1 1075 . 1 1 84 84 ASN ND2 N 15 106.230 0.2 . 1 . . . . 83 ASN ND2 . 6615 1 1076 . 1 1 85 85 LEU H H 1 7.301 0.2 . 1 . . . . 84 LEU H . 6615 1 1077 . 1 1 85 85 LEU HA H 1 4.001 0.2 . 1 . . . . 84 LEU HA . 6615 1 1078 . 1 1 85 85 LEU HB2 H 1 1.728 0.2 . 2 . . . . 84 LEU HB2 . 6615 1 1079 . 1 1 85 85 LEU HB3 H 1 1.866 0.2 . 2 . . . . 84 LEU HB3 . 6615 1 1080 . 1 1 85 85 LEU HG H 1 1.410 0.2 . 1 . . . . 84 LEU HG . 6615 1 1081 . 1 1 85 85 LEU HD11 H 1 0.780 0.2 . 1 . . . . 84 LEU HD1 . 6615 1 1082 . 1 1 85 85 LEU HD12 H 1 0.780 0.2 . 1 . . . . 84 LEU HD1 . 6615 1 1083 . 1 1 85 85 LEU HD13 H 1 0.780 0.2 . 1 . . . . 84 LEU HD1 . 6615 1 1084 . 1 1 85 85 LEU HD21 H 1 0.780 0.2 . 1 . . . . 84 LEU HD2 . 6615 1 1085 . 1 1 85 85 LEU HD22 H 1 0.780 0.2 . 1 . . . . 84 LEU HD2 . 6615 1 1086 . 1 1 85 85 LEU HD23 H 1 0.780 0.2 . 1 . . . . 84 LEU HD2 . 6615 1 1087 . 1 1 85 85 LEU C C 13 179.384 0.2 . 1 . . . . 84 LEU C . 6615 1 1088 . 1 1 85 85 LEU CA C 13 58.695 0.2 . 1 . . . . 84 LEU CA . 6615 1 1089 . 1 1 85 85 LEU CB C 13 42.831 0.2 . 1 . . . . 84 LEU CB . 6615 1 1090 . 1 1 85 85 LEU CG C 13 24.610 0.2 . 1 . . . . 84 LEU CG . 6615 1 1091 . 1 1 85 85 LEU CD1 C 13 24.530 0.2 . 1 . . . . 84 LEU CD1 . 6615 1 1092 . 1 1 85 85 LEU CD2 C 13 21.950 0.2 . 1 . . . . 84 LEU CD2 . 6615 1 1093 . 1 1 85 85 LEU N N 15 121.847 0.2 . 1 . . . . 84 LEU N . 6615 1 1094 . 1 1 86 86 GLN H H 1 8.748 0.2 . 1 . . . . 85 GLN H . 6615 1 1095 . 1 1 86 86 GLN HA H 1 4.354 0.2 . 1 . . . . 85 GLN HA . 6615 1 1096 . 1 1 86 86 GLN HB2 H 1 1.946 0.2 . 1 . . . . 85 GLN HB2 . 6615 1 1097 . 1 1 86 86 GLN HB3 H 1 1.946 0.2 . 1 . . . . 85 GLN HB3 . 6615 1 1098 . 1 1 86 86 GLN HG2 H 1 2.310 0.2 . 1 . . . . 85 GLN HG2 . 6615 1 1099 . 1 1 86 86 GLN HG3 H 1 2.310 0.2 . 1 . . . . 85 GLN HG3 . 6615 1 1100 . 1 1 86 86 GLN HE21 H 1 6.790 0.2 . 2 . . . . 85 GLN HE21 . 6615 1 1101 . 1 1 86 86 GLN HE22 H 1 7.450 0.2 . 2 . . . . 85 GLN HE22 . 6615 1 1102 . 1 1 86 86 GLN C C 13 177.876 0.2 . 1 . . . . 85 GLN C . 6615 1 1103 . 1 1 86 86 GLN CA C 13 57.667 0.2 . 1 . . . . 85 GLN CA . 6615 1 1104 . 1 1 86 86 GLN CB C 13 27.512 0.2 . 1 . . . . 85 GLN CB . 6615 1 1105 . 1 1 86 86 GLN CG C 13 33.280 0.2 . 1 . . . . 85 GLN CG . 6615 1 1106 . 1 1 86 86 GLN N N 15 115.515 0.2 . 1 . . . . 85 GLN N . 6615 1 1107 . 1 1 86 86 GLN NE2 N 15 111.330 0.2 . 1 . . . . 85 GLN NE2 . 6615 1 1108 . 1 1 87 87 ASP H H 1 7.953 0.2 . 1 . . . . 86 ASP H . 6615 1 1109 . 1 1 87 87 ASP HA H 1 4.222 0.2 . 1 . . . . 86 ASP HA . 6615 1 1110 . 1 1 87 87 ASP HB2 H 1 2.326 0.2 . 2 . . . . 86 ASP HB2 . 6615 1 1111 . 1 1 87 87 ASP HB3 H 1 2.707 0.2 . 2 . . . . 86 ASP HB3 . 6615 1 1112 . 1 1 87 87 ASP C C 13 176.401 0.2 . 1 . . . . 86 ASP C . 6615 1 1113 . 1 1 87 87 ASP CA C 13 56.099 0.2 . 1 . . . . 86 ASP CA . 6615 1 1114 . 1 1 87 87 ASP CB C 13 39.393 0.2 . 1 . . . . 86 ASP CB . 6615 1 1115 . 1 1 87 87 ASP N N 15 121.167 0.2 . 1 . . . . 86 ASP N . 6615 1 1116 . 1 1 88 88 PHE H H 1 7.899 0.2 . 1 . . . . 87 PHE H . 6615 1 1117 . 1 1 88 88 PHE HA H 1 4.217 0.2 . 1 . . . . 87 PHE HA . 6615 1 1118 . 1 1 88 88 PHE HB2 H 1 2.816 0.2 . 2 . . . . 87 PHE HB2 . 6615 1 1119 . 1 1 88 88 PHE HB3 H 1 3.063 0.2 . 2 . . . . 87 PHE HB3 . 6615 1 1120 . 1 1 88 88 PHE HD1 H 1 7.290 0.2 . 1 . . . . 87 PHE HD1 . 6615 1 1121 . 1 1 88 88 PHE HD2 H 1 7.290 0.2 . 1 . . . . 87 PHE HD2 . 6615 1 1122 . 1 1 88 88 PHE HE1 H 1 7.090 0.2 . 1 . . . . 87 PHE HE1 . 6615 1 1123 . 1 1 88 88 PHE HE2 H 1 7.090 0.2 . 1 . . . . 87 PHE HE2 . 6615 1 1124 . 1 1 88 88 PHE HZ H 1 7.130 0.2 . 1 . . . . 87 PHE HZ . 6615 1 1125 . 1 1 88 88 PHE C C 13 176.544 0.2 . 1 . . . . 87 PHE C . 6615 1 1126 . 1 1 88 88 PHE CA C 13 60.121 0.2 . 1 . . . . 87 PHE CA . 6615 1 1127 . 1 1 88 88 PHE CB C 13 41.706 0.2 . 1 . . . . 87 PHE CB . 6615 1 1128 . 1 1 88 88 PHE CD1 C 13 131.720 0.2 . 1 . . . . 87 PHE CD1 . 6615 1 1129 . 1 1 88 88 PHE CD2 C 13 131.720 0.2 . 1 . . . . 87 PHE CD2 . 6615 1 1130 . 1 1 88 88 PHE CE1 C 13 131.340 0.2 . 1 . . . . 87 PHE CE1 . 6615 1 1131 . 1 1 88 88 PHE CE2 C 13 131.340 0.2 . 1 . . . . 87 PHE CE2 . 6615 1 1132 . 1 1 88 88 PHE CZ C 13 123.510 0.2 . 1 . . . . 87 PHE CZ . 6615 1 1133 . 1 1 88 88 PHE N N 15 115.186 0.2 . 1 . . . . 87 PHE N . 6615 1 1134 . 1 1 89 89 ILE H H 1 7.387 0.2 . 1 . . . . 88 ILE H . 6615 1 1135 . 1 1 89 89 ILE HA H 1 4.665 0.2 . 1 . . . . 88 ILE HA . 6615 1 1136 . 1 1 89 89 ILE HB H 1 2.146 0.2 . 1 . . . . 88 ILE HB . 6615 1 1137 . 1 1 89 89 ILE HG12 H 1 0.620 0.2 . 1 . . . . 88 ILE HG12 . 6615 1 1138 . 1 1 89 89 ILE HG13 H 1 0.620 0.2 . 1 . . . . 88 ILE HG13 . 6615 1 1139 . 1 1 89 89 ILE HG21 H 1 0.750 0.2 . 1 . . . . 88 ILE HG2 . 6615 1 1140 . 1 1 89 89 ILE HG22 H 1 0.750 0.2 . 1 . . . . 88 ILE HG2 . 6615 1 1141 . 1 1 89 89 ILE HG23 H 1 0.750 0.2 . 1 . . . . 88 ILE HG2 . 6615 1 1142 . 1 1 89 89 ILE HD11 H 1 -0.220 0.2 . 1 . . . . 88 ILE HD1 . 6615 1 1143 . 1 1 89 89 ILE HD12 H 1 -0.220 0.2 . 1 . . . . 88 ILE HD1 . 6615 1 1144 . 1 1 89 89 ILE HD13 H 1 -0.220 0.2 . 1 . . . . 88 ILE HD1 . 6615 1 1145 . 1 1 89 89 ILE C C 13 175.615 0.2 . 1 . . . . 88 ILE C . 6615 1 1146 . 1 1 89 89 ILE CA C 13 60.610 0.2 . 1 . . . . 88 ILE CA . 6615 1 1147 . 1 1 89 89 ILE CB C 13 38.946 0.2 . 1 . . . . 88 ILE CB . 6615 1 1148 . 1 1 89 89 ILE CG1 C 13 25.190 0.2 . 1 . . . . 88 ILE CG1 . 6615 1 1149 . 1 1 89 89 ILE CG2 C 13 19.090 0.2 . 1 . . . . 88 ILE CG2 . 6615 1 1150 . 1 1 89 89 ILE CD1 C 13 13.040 0.2 . 1 . . . . 88 ILE CD1 . 6615 1 1151 . 1 1 89 89 ILE N N 15 106.891 0.2 . 1 . . . . 88 ILE N . 6615 1 1152 . 1 1 90 90 GLY H H 1 7.685 0.2 . 1 . . . . 89 GLY H . 6615 1 1153 . 1 1 90 90 GLY HA2 H 1 3.915 0.2 . 2 . . . . 89 GLY HA2 . 6615 1 1154 . 1 1 90 90 GLY HA3 H 1 4.328 0.2 . 2 . . . . 89 GLY HA3 . 6615 1 1155 . 1 1 90 90 GLY C C 13 173.308 0.2 . 1 . . . . 89 GLY C . 6615 1 1156 . 1 1 90 90 GLY CA C 13 44.817 0.2 . 1 . . . . 89 GLY CA . 6615 1 1157 . 1 1 90 90 GLY N N 15 109.789 0.2 . 1 . . . . 89 GLY N . 6615 1 1158 . 1 1 91 91 LYS H H 1 8.288 0.2 . 1 . . . . 90 LYS H . 6615 1 1159 . 1 1 91 91 LYS HA H 1 4.093 0.2 . 1 . . . . 90 LYS HA . 6615 1 1160 . 1 1 91 91 LYS HB2 H 1 1.705 0.2 . 1 . . . . 90 LYS HB2 . 6615 1 1161 . 1 1 91 91 LYS HB3 H 1 1.705 0.2 . 1 . . . . 90 LYS HB3 . 6615 1 1162 . 1 1 91 91 LYS HG2 H 1 1.420 0.2 . 1 . . . . 90 LYS HG2 . 6615 1 1163 . 1 1 91 91 LYS HG3 H 1 1.420 0.2 . 1 . . . . 90 LYS HG3 . 6615 1 1164 . 1 1 91 91 LYS HD2 H 1 0.860 0.2 . 1 . . . . 90 LYS HD2 . 6615 1 1165 . 1 1 91 91 LYS HD3 H 1 0.860 0.2 . 1 . . . . 90 LYS HD3 . 6615 1 1166 . 1 1 91 91 LYS C C 13 176.127 0.2 . 1 . . . . 90 LYS C . 6615 1 1167 . 1 1 91 91 LYS CA C 13 55.970 0.2 . 1 . . . . 90 LYS CA . 6615 1 1168 . 1 1 91 91 LYS CB C 13 32.866 0.2 . 1 . . . . 90 LYS CB . 6615 1 1169 . 1 1 91 91 LYS CG C 13 24.490 0.2 . 1 . . . . 90 LYS CG . 6615 1 1170 . 1 1 91 91 LYS CD C 13 29.000 0.2 . 1 . . . . 90 LYS CD . 6615 1 1171 . 1 1 91 91 LYS N N 15 119.990 0.2 . 1 . . . . 90 LYS N . 6615 1 1172 . 1 1 92 92 ARG H H 1 8.054 0.2 . 1 . . . . 91 ARG H . 6615 1 1173 . 1 1 92 92 ARG HA H 1 2.710 0.2 . 1 . . . . 91 ARG HA . 6615 1 1174 . 1 1 92 92 ARG HB2 H 1 2.050 0.2 . 2 . . . . 91 ARG HB2 . 6615 1 1175 . 1 1 92 92 ARG HB3 H 1 2.190 0.2 . 2 . . . . 91 ARG HB3 . 6615 1 1176 . 1 1 92 92 ARG HG2 H 1 1.410 0.2 . 1 . . . . 91 ARG HG2 . 6615 1 1177 . 1 1 92 92 ARG HG3 H 1 1.410 0.2 . 1 . . . . 91 ARG HG3 . 6615 1 1178 . 1 1 92 92 ARG C C 13 175.872 0.2 . 1 . . . . 91 ARG C . 6615 1 1179 . 1 1 92 92 ARG CA C 13 57.733 0.2 . 1 . . . . 91 ARG CA . 6615 1 1180 . 1 1 92 92 ARG CB C 13 30.694 0.2 . 1 . . . . 91 ARG CB . 6615 1 1181 . 1 1 92 92 ARG CG C 13 27.070 0.2 . 1 . . . . 91 ARG CG . 6615 1 1182 . 1 1 92 92 ARG CD C 13 43.510 0.2 . 1 . . . . 91 ARG CD . 6615 1 1183 . 1 1 92 92 ARG N N 15 119.370 0.2 . 1 . . . . 91 ARG N . 6615 1 1184 . 1 1 93 93 ILE H H 1 6.541 0.2 . 1 . . . . 92 ILE H . 6615 1 1185 . 1 1 93 93 ILE HA H 1 3.652 0.2 . 1 . . . . 92 ILE HA . 6615 1 1186 . 1 1 93 93 ILE HB H 1 1.227 0.2 . 1 . . . . 92 ILE HB . 6615 1 1187 . 1 1 93 93 ILE HG12 H 1 1.510 0.2 . 1 . . . . 92 ILE HG12 . 6615 1 1188 . 1 1 93 93 ILE HG13 H 1 1.510 0.2 . 1 . . . . 92 ILE HG13 . 6615 1 1189 . 1 1 93 93 ILE HG21 H 1 0.000 0.2 . 1 . . . . 92 ILE HG2 . 6615 1 1190 . 1 1 93 93 ILE HG22 H 1 0.000 0.2 . 1 . . . . 92 ILE HG2 . 6615 1 1191 . 1 1 93 93 ILE HG23 H 1 0.000 0.2 . 1 . . . . 92 ILE HG2 . 6615 1 1192 . 1 1 93 93 ILE HD11 H 1 0.870 0.2 . 1 . . . . 92 ILE HD1 . 6615 1 1193 . 1 1 93 93 ILE HD12 H 1 0.870 0.2 . 1 . . . . 92 ILE HD1 . 6615 1 1194 . 1 1 93 93 ILE HD13 H 1 0.870 0.2 . 1 . . . . 92 ILE HD1 . 6615 1 1195 . 1 1 93 93 ILE C C 13 175.703 0.2 . 1 . . . . 92 ILE C . 6615 1 1196 . 1 1 93 93 ILE CA C 13 62.461 0.2 . 1 . . . . 92 ILE CA . 6615 1 1197 . 1 1 93 93 ILE CB C 13 40.092 0.2 . 1 . . . . 92 ILE CB . 6615 1 1198 . 1 1 93 93 ILE CG1 C 13 27.120 0.2 . 1 . . . . 92 ILE CG1 . 6615 1 1199 . 1 1 93 93 ILE CG2 C 13 16.710 0.2 . 1 . . . . 92 ILE CG2 . 6615 1 1200 . 1 1 93 93 ILE CD1 C 13 12.850 0.2 . 1 . . . . 92 ILE CD1 . 6615 1 1201 . 1 1 93 93 ILE N N 15 120.820 0.2 . 1 . . . . 92 ILE N . 6615 1 1202 . 1 1 94 94 PHE H H 1 8.095 0.2 . 1 . . . . 93 PHE H . 6615 1 1203 . 1 1 94 94 PHE HA H 1 4.753 0.2 . 1 . . . . 93 PHE HA . 6615 1 1204 . 1 1 94 94 PHE HB2 H 1 2.545 0.2 . 2 . . . . 93 PHE HB2 . 6615 1 1205 . 1 1 94 94 PHE HB3 H 1 3.269 0.2 . 2 . . . . 93 PHE HB3 . 6615 1 1206 . 1 1 94 94 PHE HD1 H 1 6.890 0.2 . 1 . . . . 93 PHE HD1 . 6615 1 1207 . 1 1 94 94 PHE HD2 H 1 6.890 0.2 . 1 . . . . 93 PHE HD2 . 6615 1 1208 . 1 1 94 94 PHE HE1 H 1 6.980 0.2 . 1 . . . . 93 PHE HE1 . 6615 1 1209 . 1 1 94 94 PHE HE2 H 1 6.980 0.2 . 1 . . . . 93 PHE HE2 . 6615 1 1210 . 1 1 94 94 PHE HZ H 1 7.200 0.2 . 1 . . . . 93 PHE HZ . 6615 1 1211 . 1 1 94 94 PHE C C 13 175.492 0.2 . 1 . . . . 93 PHE C . 6615 1 1212 . 1 1 94 94 PHE CA C 13 56.357 0.2 . 1 . . . . 93 PHE CA . 6615 1 1213 . 1 1 94 94 PHE CB C 13 41.433 0.2 . 1 . . . . 93 PHE CB . 6615 1 1214 . 1 1 94 94 PHE CD1 C 13 131.980 0.2 . 1 . . . . 93 PHE CD1 . 6615 1 1215 . 1 1 94 94 PHE CD2 C 13 131.980 0.2 . 1 . . . . 93 PHE CD2 . 6615 1 1216 . 1 1 94 94 PHE CE1 C 13 129.760 0.2 . 1 . . . . 93 PHE CE1 . 6615 1 1217 . 1 1 94 94 PHE CE2 C 13 129.760 0.2 . 1 . . . . 93 PHE CE2 . 6615 1 1218 . 1 1 94 94 PHE CZ C 13 123.510 0.2 . 1 . . . . 93 PHE CZ . 6615 1 1219 . 1 1 94 94 PHE N N 15 118.907 0.2 . 1 . . . . 93 PHE N . 6615 1 1220 . 1 1 95 95 ARG H H 1 8.471 0.2 . 1 . . . . 94 ARG H . 6615 1 1221 . 1 1 95 95 ARG HA H 1 4.423 0.2 . 1 . . . . 94 ARG HA . 6615 1 1222 . 1 1 95 95 ARG HB2 H 1 1.700 0.2 . 2 . . . . 94 ARG HB2 . 6615 1 1223 . 1 1 95 95 ARG HB3 H 1 1.750 0.2 . 2 . . . . 94 ARG HB3 . 6615 1 1224 . 1 1 95 95 ARG HG2 H 1 1.530 0.2 . 1 . . . . 94 ARG HG2 . 6615 1 1225 . 1 1 95 95 ARG HG3 H 1 1.530 0.2 . 1 . . . . 94 ARG HG3 . 6615 1 1226 . 1 1 95 95 ARG HD2 H 1 3.120 0.2 . 1 . . . . 94 ARG HD2 . 6615 1 1227 . 1 1 95 95 ARG HD3 H 1 3.120 0.2 . 1 . . . . 94 ARG HD3 . 6615 1 1228 . 1 1 95 95 ARG C C 13 175.735 0.2 . 1 . . . . 94 ARG C . 6615 1 1229 . 1 1 95 95 ARG CA C 13 55.809 0.2 . 1 . . . . 94 ARG CA . 6615 1 1230 . 1 1 95 95 ARG CB C 13 30.792 0.2 . 1 . . . . 94 ARG CB . 6615 1 1231 . 1 1 95 95 ARG CG C 13 27.130 0.2 . 1 . . . . 94 ARG CG . 6615 1 1232 . 1 1 95 95 ARG CD C 13 43.230 0.2 . 1 . . . . 94 ARG CD . 6615 1 1233 . 1 1 95 95 ARG N N 15 119.926 0.2 . 1 . . . . 94 ARG N . 6615 1 1234 . 1 1 96 96 TYR H H 1 8.297 0.2 . 1 . . . . 95 TYR H . 6615 1 1235 . 1 1 96 96 TYR HA H 1 4.562 0.2 . 1 . . . . 95 TYR HA . 6615 1 1236 . 1 1 96 96 TYR HB2 H 1 2.794 0.2 . 2 . . . . 95 TYR HB2 . 6615 1 1237 . 1 1 96 96 TYR HB3 H 1 2.862 0.2 . 2 . . . . 95 TYR HB3 . 6615 1 1238 . 1 1 96 96 TYR HD1 H 1 7.040 0.2 . 1 . . . . 95 TYR HD1 . 6615 1 1239 . 1 1 96 96 TYR HD2 H 1 7.040 0.2 . 1 . . . . 95 TYR HD2 . 6615 1 1240 . 1 1 96 96 TYR HE1 H 1 6.880 0.2 . 1 . . . . 95 TYR HE1 . 6615 1 1241 . 1 1 96 96 TYR HE2 H 1 6.880 0.2 . 1 . . . . 95 TYR HE2 . 6615 1 1242 . 1 1 96 96 TYR C C 13 175.693 0.2 . 1 . . . . 95 TYR C . 6615 1 1243 . 1 1 96 96 TYR CA C 13 57.832 0.2 . 1 . . . . 95 TYR CA . 6615 1 1244 . 1 1 96 96 TYR CB C 13 39.964 0.2 . 1 . . . . 95 TYR CB . 6615 1 1245 . 1 1 96 96 TYR CD1 C 13 132.960 0.2 . 1 . . . . 95 TYR CD1 . 6615 1 1246 . 1 1 96 96 TYR CD2 C 13 132.960 0.2 . 1 . . . . 95 TYR CD2 . 6615 1 1247 . 1 1 96 96 TYR CE1 C 13 117.820 0.2 . 1 . . . . 95 TYR CE1 . 6615 1 1248 . 1 1 96 96 TYR CE2 C 13 117.820 0.2 . 1 . . . . 95 TYR CE2 . 6615 1 1249 . 1 1 96 96 TYR N N 15 121.784 0.2 . 1 . . . . 95 TYR N . 6615 1 1250 . 1 1 97 97 GLY H H 1 8.182 0.2 . 1 . . . . 96 GLY H . 6615 1 1251 . 1 1 97 97 GLY HA2 H 1 3.662 0.2 . 2 . . . . 96 GLY HA2 . 6615 1 1252 . 1 1 97 97 GLY HA3 H 1 3.834 0.2 . 2 . . . . 96 GLY HA3 . 6615 1 1253 . 1 1 97 97 GLY C C 13 173.747 0.2 . 1 . . . . 96 GLY C . 6615 1 1254 . 1 1 97 97 GLY CA C 13 45.021 0.2 . 1 . . . . 96 GLY CA . 6615 1 1255 . 1 1 97 97 GLY N N 15 113.208 0.2 . 1 . . . . 96 GLY N . 6615 1 1256 . 1 1 98 98 GLN H H 1 8.004 0.2 . 1 . . . . 97 GLN H . 6615 1 1257 . 1 1 98 98 GLN HA H 1 4.268 0.2 . 1 . . . . 97 GLN HA . 6615 1 1258 . 1 1 98 98 GLN HB2 H 1 1.911 0.2 . 2 . . . . 97 GLN HB2 . 6615 1 1259 . 1 1 98 98 GLN HB3 H 1 2.067 0.2 . 2 . . . . 97 GLN HB3 . 6615 1 1260 . 1 1 98 98 GLN HG2 H 1 2.290 0.2 . 1 . . . . 97 GLN HG2 . 6615 1 1261 . 1 1 98 98 GLN HG3 H 1 2.290 0.2 . 1 . . . . 97 GLN HG3 . 6615 1 1262 . 1 1 98 98 GLN HE21 H 1 6.740 0.2 . 2 . . . . 97 GLN HE21 . 6615 1 1263 . 1 1 98 98 GLN HE22 H 1 7.410 0.2 . 2 . . . . 97 GLN HE22 . 6615 1 1264 . 1 1 98 98 GLN C C 13 175.579 0.2 . 1 . . . . 97 GLN C . 6615 1 1265 . 1 1 98 98 GLN CA C 13 55.670 0.2 . 1 . . . . 97 GLN CA . 6615 1 1266 . 1 1 98 98 GLN CB C 13 29.563 0.2 . 1 . . . . 97 GLN CB . 6615 1 1267 . 1 1 98 98 GLN CG C 13 33.650 0.2 . 1 . . . . 97 GLN CG . 6615 1 1268 . 1 1 98 98 GLN N N 15 119.768 0.2 . 1 . . . . 97 GLN N . 6615 1 1269 . 1 1 98 98 GLN NE2 N 15 111.940 0.2 . 1 . . . . 97 GLN NE2 . 6615 1 1270 . 1 1 99 99 ALA H H 1 8.274 0.2 . 1 . . . . 98 ALA H . 6615 1 1271 . 1 1 99 99 ALA HA H 1 4.276 0.2 . 1 . . . . 98 ALA HA . 6615 1 1272 . 1 1 99 99 ALA HB1 H 1 1.363 0.2 . 1 . . . . 98 ALA HB . 6615 1 1273 . 1 1 99 99 ALA HB2 H 1 1.363 0.2 . 1 . . . . 98 ALA HB . 6615 1 1274 . 1 1 99 99 ALA HB3 H 1 1.363 0.2 . 1 . . . . 98 ALA HB . 6615 1 1275 . 1 1 99 99 ALA C C 13 177.668 0.2 . 1 . . . . 98 ALA C . 6615 1 1276 . 1 1 99 99 ALA CA C 13 52.384 0.2 . 1 . . . . 98 ALA CA . 6615 1 1277 . 1 1 99 99 ALA CB C 13 19.153 0.2 . 1 . . . . 98 ALA CB . 6615 1 1278 . 1 1 99 99 ALA N N 15 124.632 0.2 . 1 . . . . 98 ALA N . 6615 1 1279 . 1 1 100 100 GLU H H 1 8.350 0.2 . 1 . . . . 99 GLU H . 6615 1 1280 . 1 1 100 100 GLU HA H 1 4.290 0.2 . 1 . . . . 99 GLU HA . 6615 1 1281 . 1 1 100 100 GLU HB2 H 1 1.921 0.2 . 2 . . . . 99 GLU HB2 . 6615 1 1282 . 1 1 100 100 GLU HB3 H 1 2.046 0.2 . 2 . . . . 99 GLU HB3 . 6615 1 1283 . 1 1 100 100 GLU HG2 H 1 2.230 0.2 . 1 . . . . 99 GLU HG2 . 6615 1 1284 . 1 1 100 100 GLU HG3 H 1 2.230 0.2 . 1 . . . . 99 GLU HG3 . 6615 1 1285 . 1 1 100 100 GLU C C 13 176.664 0.2 . 1 . . . . 99 GLU C . 6615 1 1286 . 1 1 100 100 GLU CA C 13 56.650 0.2 . 1 . . . . 99 GLU CA . 6615 1 1287 . 1 1 100 100 GLU CB C 13 30.040 0.2 . 1 . . . . 99 GLU CB . 6615 1 1288 . 1 1 100 100 GLU CG C 13 36.100 0.2 . 1 . . . . 99 GLU CG . 6615 1 1289 . 1 1 100 100 GLU N N 15 119.666 0.2 . 1 . . . . 99 GLU N . 6615 1 1290 . 1 1 101 101 THR H H 1 7.920 0.2 . 1 . . . . 100 THR H . 6615 1 1291 . 1 1 101 101 THR HA H 1 4.313 0.2 . 1 . . . . 100 THR HA . 6615 1 1292 . 1 1 101 101 THR HB H 1 4.217 0.2 . 1 . . . . 100 THR HB . 6615 1 1293 . 1 1 101 101 THR HG21 H 1 1.150 0.2 . 1 . . . . 100 THR HG2 . 6615 1 1294 . 1 1 101 101 THR HG22 H 1 1.150 0.2 . 1 . . . . 100 THR HG2 . 6615 1 1295 . 1 1 101 101 THR HG23 H 1 1.150 0.2 . 1 . . . . 100 THR HG2 . 6615 1 1296 . 1 1 101 101 THR C C 13 174.641 0.2 . 1 . . . . 100 THR C . 6615 1 1297 . 1 1 101 101 THR CA C 13 61.482 0.2 . 1 . . . . 100 THR CA . 6615 1 1298 . 1 1 101 101 THR CB C 13 69.586 0.2 . 1 . . . . 100 THR CB . 6615 1 1299 . 1 1 101 101 THR CG2 C 13 21.550 0.2 . 1 . . . . 100 THR CG2 . 6615 1 1300 . 1 1 101 101 THR N N 15 113.121 0.2 . 1 . . . . 100 THR N . 6615 1 1301 . 1 1 102 102 GLU H H 1 8.307 0.2 . 1 . . . . 101 GLU H . 6615 1 1302 . 1 1 102 102 GLU HA H 1 4.250 0.2 . 1 . . . . 101 GLU HA . 6615 1 1303 . 1 1 102 102 GLU HB2 H 1 1.906 0.2 . 2 . . . . 101 GLU HB2 . 6615 1 1304 . 1 1 102 102 GLU HB3 H 1 2.029 0.2 . 2 . . . . 101 GLU HB3 . 6615 1 1305 . 1 1 102 102 GLU HG2 H 1 2.210 0.2 . 1 . . . . 101 GLU HG2 . 6615 1 1306 . 1 1 102 102 GLU HG3 H 1 2.210 0.2 . 1 . . . . 101 GLU HG3 . 6615 1 1307 . 1 1 102 102 GLU C C 13 176.182 0.2 . 1 . . . . 101 GLU C . 6615 1 1308 . 1 1 102 102 GLU CA C 13 56.556 0.2 . 1 . . . . 101 GLU CA . 6615 1 1309 . 1 1 102 102 GLU CB C 13 30.088 0.2 . 1 . . . . 101 GLU CB . 6615 1 1310 . 1 1 102 102 GLU CG C 13 36.020 0.2 . 1 . . . . 101 GLU CG . 6615 1 1311 . 1 1 102 102 GLU N N 15 122.330 0.2 . 1 . . . . 101 GLU N . 6615 1 1312 . 1 1 103 103 ASP H H 1 8.228 0.2 . 1 . . . . 102 ASP H . 6615 1 1313 . 1 1 103 103 ASP HA H 1 4.531 0.2 . 1 . . . . 102 ASP HA . 6615 1 1314 . 1 1 103 103 ASP HB2 H 1 2.580 0.2 . 2 . . . . 102 ASP HB2 . 6615 1 1315 . 1 1 103 103 ASP HB3 H 1 2.610 0.2 . 2 . . . . 102 ASP HB3 . 6615 1 1316 . 1 1 103 103 ASP C C 13 176.114 0.2 . 1 . . . . 102 ASP C . 6615 1 1317 . 1 1 103 103 ASP CA C 13 54.259 0.2 . 1 . . . . 102 ASP CA . 6615 1 1318 . 1 1 103 103 ASP CB C 13 40.985 0.2 . 1 . . . . 102 ASP CB . 6615 1 1319 . 1 1 103 103 ASP N N 15 120.572 0.2 . 1 . . . . 102 ASP N . 6615 1 1320 . 1 1 104 104 GLN H H 1 8.140 0.2 . 1 . . . . 103 GLN H . 6615 1 1321 . 1 1 104 104 GLN HA H 1 4.281 0.2 . 1 . . . . 103 GLN HA . 6615 1 1322 . 1 1 104 104 GLN HB2 H 1 1.932 0.2 . 2 . . . . 103 GLN HB2 . 6615 1 1323 . 1 1 104 104 GLN HB3 H 1 2.055 0.2 . 2 . . . . 103 GLN HB3 . 6615 1 1324 . 1 1 104 104 GLN HG2 H 1 2.310 0.2 . 1 . . . . 103 GLN HG2 . 6615 1 1325 . 1 1 104 104 GLN HG3 H 1 2.310 0.2 . 1 . . . . 103 GLN HG3 . 6615 1 1326 . 1 1 104 104 GLN HE21 H 1 6.750 0.2 . 2 . . . . 103 GLN HE21 . 6615 1 1327 . 1 1 104 104 GLN HE22 H 1 7.470 0.2 . 2 . . . . 103 GLN HE22 . 6615 1 1328 . 1 1 104 104 GLN C C 13 175.905 0.2 . 1 . . . . 103 GLN C . 6615 1 1329 . 1 1 104 104 GLN CA C 13 55.840 0.2 . 1 . . . . 103 GLN CA . 6615 1 1330 . 1 1 104 104 GLN CB C 13 29.060 0.2 . 1 . . . . 103 GLN CB . 6615 1 1331 . 1 1 104 104 GLN CG C 13 33.660 0.2 . 1 . . . . 103 GLN CG . 6615 1 1332 . 1 1 104 104 GLN N N 15 119.921 0.2 . 1 . . . . 103 GLN N . 6615 1 1333 . 1 1 104 104 GLN NE2 N 15 111.910 0.2 . 1 . . . . 103 GLN NE2 . 6615 1 1334 . 1 1 105 105 VAL H H 1 8.000 0.2 . 1 . . . . 104 VAL H . 6615 1 1335 . 1 1 105 105 VAL HA H 1 4.040 0.2 . 1 . . . . 104 VAL HA . 6615 1 1336 . 1 1 105 105 VAL HB H 1 2.050 0.2 . 1 . . . . 104 VAL HB . 6615 1 1337 . 1 1 105 105 VAL HG11 H 1 0.900 0.2 . 1 . . . . 104 VAL HG1 . 6615 1 1338 . 1 1 105 105 VAL HG12 H 1 0.900 0.2 . 1 . . . . 104 VAL HG1 . 6615 1 1339 . 1 1 105 105 VAL HG13 H 1 0.900 0.2 . 1 . . . . 104 VAL HG1 . 6615 1 1340 . 1 1 105 105 VAL HG21 H 1 0.900 0.2 . 1 . . . . 104 VAL HG2 . 6615 1 1341 . 1 1 105 105 VAL HG22 H 1 0.900 0.2 . 1 . . . . 104 VAL HG2 . 6615 1 1342 . 1 1 105 105 VAL HG23 H 1 0.900 0.2 . 1 . . . . 104 VAL HG2 . 6615 1 1343 . 1 1 105 105 VAL C C 13 176.660 0.2 . 1 . . . . 104 VAL C . 6615 1 1344 . 1 1 105 105 VAL CA C 13 62.630 0.2 . 1 . . . . 104 VAL CA . 6615 1 1345 . 1 1 105 105 VAL CB C 13 32.230 0.2 . 1 . . . . 104 VAL CB . 6615 1 1346 . 1 1 105 105 VAL CG1 C 13 20.790 0.2 . 1 . . . . 104 VAL CG1 . 6615 1 1347 . 1 1 105 105 VAL CG2 C 13 20.790 0.2 . 1 . . . . 104 VAL CG2 . 6615 1 1348 . 1 1 105 105 VAL N N 15 120.550 0.2 . 1 . . . . 104 VAL N . 6615 1 1349 . 1 1 106 106 GLY H H 1 8.360 0.2 . 1 . . . . 105 GLY H . 6615 1 1350 . 1 1 106 106 GLY HA2 H 1 3.909 0.2 . 1 . . . . 105 GLY HA2 . 6615 1 1351 . 1 1 106 106 GLY HA3 H 1 3.909 0.2 . 1 . . . . 105 GLY HA3 . 6615 1 1352 . 1 1 106 106 GLY C C 13 173.865 0.2 . 1 . . . . 105 GLY C . 6615 1 1353 . 1 1 106 106 GLY CA C 13 45.121 0.2 . 1 . . . . 105 GLY CA . 6615 1 1354 . 1 1 106 106 GLY N N 15 111.900 0.2 . 1 . . . . 105 GLY N . 6615 1 1355 . 1 1 107 107 VAL H H 1 7.799 0.2 . 1 . . . . 106 VAL H . 6615 1 1356 . 1 1 107 107 VAL HA H 1 4.084 0.2 . 1 . . . . 106 VAL HA . 6615 1 1357 . 1 1 107 107 VAL HB H 1 2.009 0.2 . 1 . . . . 106 VAL HB . 6615 1 1358 . 1 1 107 107 VAL HG11 H 1 0.870 0.2 . 1 . . . . 106 VAL HG1 . 6615 1 1359 . 1 1 107 107 VAL HG12 H 1 0.870 0.2 . 1 . . . . 106 VAL HG1 . 6615 1 1360 . 1 1 107 107 VAL HG13 H 1 0.870 0.2 . 1 . . . . 106 VAL HG1 . 6615 1 1361 . 1 1 107 107 VAL HG21 H 1 0.870 0.2 . 1 . . . . 106 VAL HG2 . 6615 1 1362 . 1 1 107 107 VAL HG22 H 1 0.870 0.2 . 1 . . . . 106 VAL HG2 . 6615 1 1363 . 1 1 107 107 VAL HG23 H 1 0.870 0.2 . 1 . . . . 106 VAL HG2 . 6615 1 1364 . 1 1 107 107 VAL C C 13 176.230 0.2 . 1 . . . . 106 VAL C . 6615 1 1365 . 1 1 107 107 VAL CA C 13 62.075 0.2 . 1 . . . . 106 VAL CA . 6615 1 1366 . 1 1 107 107 VAL CB C 13 32.471 0.2 . 1 . . . . 106 VAL CB . 6615 1 1367 . 1 1 107 107 VAL CG1 C 13 20.770 0.2 . 1 . . . . 106 VAL CG1 . 6615 1 1368 . 1 1 107 107 VAL CG2 C 13 20.770 0.2 . 1 . . . . 106 VAL CG2 . 6615 1 1369 . 1 1 107 107 VAL N N 15 119.396 0.2 . 1 . . . . 106 VAL N . 6615 1 1370 . 1 1 108 108 VAL H H 1 8.139 0.2 . 1 . . . . 107 VAL H . 6615 1 1371 . 1 1 108 108 VAL HA H 1 4.153 0.2 . 1 . . . . 107 VAL HA . 6615 1 1372 . 1 1 108 108 VAL HB H 1 2.040 0.2 . 1 . . . . 107 VAL HB . 6615 1 1373 . 1 1 108 108 VAL HG11 H 1 0.890 0.2 . 1 . . . . 107 VAL HG1 . 6615 1 1374 . 1 1 108 108 VAL HG12 H 1 0.890 0.2 . 1 . . . . 107 VAL HG1 . 6615 1 1375 . 1 1 108 108 VAL HG13 H 1 0.890 0.2 . 1 . . . . 107 VAL HG1 . 6615 1 1376 . 1 1 108 108 VAL HG21 H 1 0.890 0.2 . 1 . . . . 107 VAL HG2 . 6615 1 1377 . 1 1 108 108 VAL HG22 H 1 0.890 0.2 . 1 . . . . 107 VAL HG2 . 6615 1 1378 . 1 1 108 108 VAL HG23 H 1 0.890 0.2 . 1 . . . . 107 VAL HG2 . 6615 1 1379 . 1 1 108 108 VAL C C 13 176.248 0.2 . 1 . . . . 107 VAL C . 6615 1 1380 . 1 1 108 108 VAL CA C 13 62.010 0.2 . 1 . . . . 107 VAL CA . 6615 1 1381 . 1 1 108 108 VAL CB C 13 32.276 0.2 . 1 . . . . 107 VAL CB . 6615 1 1382 . 1 1 108 108 VAL CG1 C 13 18.660 0.2 . 1 . . . . 107 VAL CG1 . 6615 1 1383 . 1 1 108 108 VAL CG2 C 13 20.850 0.2 . 1 . . . . 107 VAL CG2 . 6615 1 1384 . 1 1 108 108 VAL N N 15 123.486 0.2 . 1 . . . . 107 VAL N . 6615 1 1385 . 1 1 109 109 THR H H 1 8.066 0.2 . 1 . . . . 108 THR H . 6615 1 1386 . 1 1 109 109 THR HA H 1 4.301 0.2 . 1 . . . . 108 THR HA . 6615 1 1387 . 1 1 109 109 THR HB H 1 4.172 0.2 . 1 . . . . 108 THR HB . 6615 1 1388 . 1 1 109 109 THR HG21 H 1 1.160 0.2 . 1 . . . . 108 THR HG2 . 6615 1 1389 . 1 1 109 109 THR HG22 H 1 1.160 0.2 . 1 . . . . 108 THR HG2 . 6615 1 1390 . 1 1 109 109 THR HG23 H 1 1.160 0.2 . 1 . . . . 108 THR HG2 . 6615 1 1391 . 1 1 109 109 THR C C 13 174.913 0.2 . 1 . . . . 108 THR C . 6615 1 1392 . 1 1 109 109 THR CA C 13 61.642 0.2 . 1 . . . . 108 THR CA . 6615 1 1393 . 1 1 109 109 THR CB C 13 69.572 0.2 . 1 . . . . 108 THR CB . 6615 1 1394 . 1 1 109 109 THR CG2 C 13 21.410 0.2 . 1 . . . . 108 THR CG2 . 6615 1 1395 . 1 1 109 109 THR N N 15 117.270 0.2 . 1 . . . . 108 THR N . 6615 1 1396 . 1 1 110 110 GLY H H 1 8.245 0.2 . 1 . . . . 109 GLY H . 6615 1 1397 . 1 1 110 110 GLY HA2 H 1 3.926 0.2 . 1 . . . . 109 GLY HA2 . 6615 1 1398 . 1 1 110 110 GLY HA3 H 1 3.926 0.2 . 1 . . . . 109 GLY HA3 . 6615 1 1399 . 1 1 110 110 GLY C C 13 174.007 0.2 . 1 . . . . 109 GLY C . 6615 1 1400 . 1 1 110 110 GLY CA C 13 45.184 0.2 . 1 . . . . 109 GLY CA . 6615 1 1401 . 1 1 110 110 GLY N N 15 110.548 0.2 . 1 . . . . 109 GLY N . 6615 1 1402 . 1 1 111 111 LEU H H 1 7.913 0.2 . 1 . . . . 110 LEU H . 6615 1 1403 . 1 1 111 111 LEU HA H 1 4.269 0.2 . 1 . . . . 110 LEU HA . 6615 1 1404 . 1 1 111 111 LEU HB2 H 1 1.451 0.2 . 2 . . . . 110 LEU HB2 . 6615 1 1405 . 1 1 111 111 LEU HB3 H 1 1.520 0.2 . 2 . . . . 110 LEU HB3 . 6615 1 1406 . 1 1 111 111 LEU HG H 1 0.790 0.2 . 1 . . . . 110 LEU HG . 6615 1 1407 . 1 1 111 111 LEU HD11 H 1 0.830 0.2 . 1 . . . . 110 LEU HD1 . 6615 1 1408 . 1 1 111 111 LEU HD12 H 1 0.830 0.2 . 1 . . . . 110 LEU HD1 . 6615 1 1409 . 1 1 111 111 LEU HD13 H 1 0.830 0.2 . 1 . . . . 110 LEU HD1 . 6615 1 1410 . 1 1 111 111 LEU HD21 H 1 0.830 0.2 . 1 . . . . 110 LEU HD2 . 6615 1 1411 . 1 1 111 111 LEU HD22 H 1 0.830 0.2 . 1 . . . . 110 LEU HD2 . 6615 1 1412 . 1 1 111 111 LEU HD23 H 1 0.830 0.2 . 1 . . . . 110 LEU HD2 . 6615 1 1413 . 1 1 111 111 LEU C C 13 177.039 0.2 . 1 . . . . 110 LEU C . 6615 1 1414 . 1 1 111 111 LEU CA C 13 54.875 0.2 . 1 . . . . 110 LEU CA . 6615 1 1415 . 1 1 111 111 LEU CB C 13 42.306 0.2 . 1 . . . . 110 LEU CB . 6615 1 1416 . 1 1 111 111 LEU CG C 13 26.840 0.2 . 1 . . . . 110 LEU CG . 6615 1 1417 . 1 1 111 111 LEU CD1 C 13 24.720 0.2 . 1 . . . . 110 LEU CD1 . 6615 1 1418 . 1 1 111 111 LEU CD2 C 13 23.510 0.2 . 1 . . . . 110 LEU CD2 . 6615 1 1419 . 1 1 111 111 LEU N N 15 121.438 0.2 . 1 . . . . 110 LEU N . 6615 1 1420 . 1 1 112 112 ALA H H 1 8.112 0.2 . 1 . . . . 111 ALA H . 6615 1 1421 . 1 1 112 112 ALA HA H 1 4.232 0.2 . 1 . . . . 111 ALA HA . 6615 1 1422 . 1 1 112 112 ALA HB1 H 1 1.258 0.2 . 1 . . . . 111 ALA HB . 6615 1 1423 . 1 1 112 112 ALA HB2 H 1 1.258 0.2 . 1 . . . . 111 ALA HB . 6615 1 1424 . 1 1 112 112 ALA HB3 H 1 1.258 0.2 . 1 . . . . 111 ALA HB . 6615 1 1425 . 1 1 112 112 ALA C C 13 177.299 0.2 . 1 . . . . 111 ALA C . 6615 1 1426 . 1 1 112 112 ALA CA C 13 52.297 0.2 . 1 . . . . 111 ALA CA . 6615 1 1427 . 1 1 112 112 ALA CB C 13 19.030 0.2 . 1 . . . . 111 ALA CB . 6615 1 1428 . 1 1 112 112 ALA N N 15 123.848 0.2 . 1 . . . . 111 ALA N . 6615 1 1429 . 1 1 113 113 TYR H H 1 7.901 0.2 . 1 . . . . 112 TYR H . 6615 1 1430 . 1 1 113 113 TYR HA H 1 4.547 0.2 . 1 . . . . 112 TYR HA . 6615 1 1431 . 1 1 113 113 TYR HB2 H 1 2.919 0.2 . 2 . . . . 112 TYR HB2 . 6615 1 1432 . 1 1 113 113 TYR HB3 H 1 3.026 0.2 . 2 . . . . 112 TYR HB3 . 6615 1 1433 . 1 1 113 113 TYR HD1 H 1 7.040 0.2 . 1 . . . . 112 TYR HD1 . 6615 1 1434 . 1 1 113 113 TYR HD2 H 1 7.040 0.2 . 1 . . . . 112 TYR HD2 . 6615 1 1435 . 1 1 113 113 TYR HE1 H 1 6.880 0.2 . 1 . . . . 112 TYR HE1 . 6615 1 1436 . 1 1 113 113 TYR HE2 H 1 6.880 0.2 . 1 . . . . 112 TYR HE2 . 6615 1 1437 . 1 1 113 113 TYR C C 13 175.840 0.2 . 1 . . . . 112 TYR C . 6615 1 1438 . 1 1 113 113 TYR CA C 13 57.731 0.2 . 1 . . . . 112 TYR CA . 6615 1 1439 . 1 1 113 113 TYR CB C 13 38.476 0.2 . 1 . . . . 112 TYR CB . 6615 1 1440 . 1 1 113 113 TYR CD1 C 13 132.960 0.2 . 1 . . . . 112 TYR CD1 . 6615 1 1441 . 1 1 113 113 TYR CD2 C 13 132.960 0.2 . 1 . . . . 112 TYR CD2 . 6615 1 1442 . 1 1 113 113 TYR CE1 C 13 117.820 0.2 . 1 . . . . 112 TYR CE1 . 6615 1 1443 . 1 1 113 113 TYR CE2 C 13 117.820 0.2 . 1 . . . . 112 TYR CE2 . 6615 1 1444 . 1 1 113 113 TYR N N 15 118.589 0.2 . 1 . . . . 112 TYR N . 6615 1 1445 . 1 1 114 114 THR H H 1 7.871 0.2 . 1 . . . . 113 THR H . 6615 1 1446 . 1 1 114 114 THR HA H 1 4.295 0.2 . 1 . . . . 113 THR HA . 6615 1 1447 . 1 1 114 114 THR HB H 1 4.152 0.2 . 1 . . . . 113 THR HB . 6615 1 1448 . 1 1 114 114 THR HG21 H 1 1.140 0.2 . 1 . . . . 113 THR HG2 . 6615 1 1449 . 1 1 114 114 THR HG22 H 1 1.140 0.2 . 1 . . . . 113 THR HG2 . 6615 1 1450 . 1 1 114 114 THR HG23 H 1 1.140 0.2 . 1 . . . . 113 THR HG2 . 6615 1 1451 . 1 1 114 114 THR C C 13 174.389 0.2 . 1 . . . . 113 THR C . 6615 1 1452 . 1 1 114 114 THR CA C 13 61.620 0.2 . 1 . . . . 113 THR CA . 6615 1 1453 . 1 1 114 114 THR CB C 13 69.480 0.2 . 1 . . . . 113 THR CB . 6615 1 1454 . 1 1 114 114 THR CG2 C 13 21.380 0.2 . 1 . . . . 113 THR CG2 . 6615 1 1455 . 1 1 114 114 THR N N 15 114.608 0.2 . 1 . . . . 113 THR N . 6615 1 1456 . 1 1 115 115 THR H H 1 7.965 0.2 . 1 . . . . 114 THR H . 6615 1 1457 . 1 1 115 115 THR HA H 1 4.288 0.2 . 1 . . . . 114 THR HA . 6615 1 1458 . 1 1 115 115 THR HB H 1 4.158 0.2 . 1 . . . . 114 THR HB . 6615 1 1459 . 1 1 115 115 THR HG21 H 1 1.150 0.2 . 1 . . . . 114 THR HG2 . 6615 1 1460 . 1 1 115 115 THR HG22 H 1 1.150 0.2 . 1 . . . . 114 THR HG2 . 6615 1 1461 . 1 1 115 115 THR HG23 H 1 1.150 0.2 . 1 . . . . 114 THR HG2 . 6615 1 1462 . 1 1 115 115 THR C C 13 174.404 0.2 . 1 . . . . 114 THR C . 6615 1 1463 . 1 1 115 115 THR CA C 13 61.838 0.2 . 1 . . . . 114 THR CA . 6615 1 1464 . 1 1 115 115 THR CB C 13 69.403 0.2 . 1 . . . . 114 THR CB . 6615 1 1465 . 1 1 115 115 THR CG2 C 13 21.500 0.2 . 1 . . . . 114 THR CG2 . 6615 1 1466 . 1 1 115 115 THR N N 15 116.349 0.2 . 1 . . . . 114 THR N . 6615 1 1467 . 1 1 116 116 VAL H H 1 7.945 0.2 . 1 . . . . 115 VAL H . 6615 1 1468 . 1 1 116 116 VAL HA H 1 4.030 0.2 . 1 . . . . 115 VAL HA . 6615 1 1469 . 1 1 116 116 VAL HB H 1 2.020 0.2 . 1 . . . . 115 VAL HB . 6615 1 1470 . 1 1 116 116 VAL HG11 H 1 0.860 0.2 . 1 . . . . 115 VAL HG1 . 6615 1 1471 . 1 1 116 116 VAL HG12 H 1 0.860 0.2 . 1 . . . . 115 VAL HG1 . 6615 1 1472 . 1 1 116 116 VAL HG13 H 1 0.860 0.2 . 1 . . . . 115 VAL HG1 . 6615 1 1473 . 1 1 116 116 VAL HG21 H 1 0.860 0.2 . 1 . . . . 115 VAL HG2 . 6615 1 1474 . 1 1 116 116 VAL HG22 H 1 0.860 0.2 . 1 . . . . 115 VAL HG2 . 6615 1 1475 . 1 1 116 116 VAL HG23 H 1 0.860 0.2 . 1 . . . . 115 VAL HG2 . 6615 1 1476 . 1 1 116 116 VAL C C 13 175.910 0.2 . 1 . . . . 115 VAL C . 6615 1 1477 . 1 1 116 116 VAL CA C 13 62.370 0.2 . 1 . . . . 115 VAL CA . 6615 1 1478 . 1 1 116 116 VAL CB C 13 32.220 0.2 . 1 . . . . 115 VAL CB . 6615 1 1479 . 1 1 116 116 VAL CG1 C 13 20.760 0.2 . 1 . . . . 115 VAL CG1 . 6615 1 1480 . 1 1 116 116 VAL CG2 C 13 20.760 0.2 . 1 . . . . 115 VAL CG2 . 6615 1 1481 . 1 1 116 116 VAL N N 15 122.235 0.2 . 1 . . . . 115 VAL N . 6615 1 stop_ save_