data_c16368_2kko ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID c16368_2kko _Entry.Title ; Solution NMR structure of the homodimeric winged helix-turn-helix DNA-binding domain (fragment 1-100) Mb0332 from Mycobacterium bovis, a possible ArsR-family transcriptional regulator. Northeast Structural Genomics Consortium Target MbR242E. ; _Entry.Version_type new _Entry.Submission_date 2009-06-26 _Entry.Accession_date 2009-06-26 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.0.8.125 _Entry.Original_NMR_STAR_version 3.0.8.125 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Theresa Ramelot . A. . c16368_2kko 2 John Ramelot . R. . c16368_2kko 3 D. Wang . . . c16368_2kko 4 Colleen Ciccosanti . . . c16368_2kko 5 Mei Jiang . . . c16368_2kko 6 R. Nair . . . c16368_2kko 7 Burkhard Rost . . . c16368_2kko 8 G.V.T. Swapna . . . c16368_2kko 9 Thomas Acton . B. . c16368_2kko 10 Rong Xiao . . . c16368_2kko 11 John Everett . K. . c16368_2kko 12 Gaetano Montelione . T. . c16368_2kko 13 Michael Kennedy . A. . c16368_2kko stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'PSI, Protein Structure Initiative' 'Northeast Structural Genomics Consortium' . c16368_2kko stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID NESG . c16368_2kko DNA-BINDING . c16368_2kko 'TRANSCRIPTION REGULATION' . c16368_2kko 'TRANSCRIPTIONAL REGULATOR' . c16368_2kko wHTH . c16368_2kko HOMODIMER . c16368_2kko 'winged helix-turn-helix' . c16368_2kko stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 c16368_2kko stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 431 c16368_2kko '1H chemical shifts' 720 c16368_2kko '15N chemical shifts' 116 c16368_2kko stop_ loop_ _Release.Release_number _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 2010-05-28 2009-06-26 update BMRB 'edit entity/assembly name' c16368_2kko 1 2009-08-06 2009-06-26 original author 'original release' c16368_2kko stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID c16368_2kko _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Solution NMR structure of the homodimeric winged helix-turn-helix DNA-binding domain (fragment 1-100) Mb0332 from Mycobacterium bovis, a possible ArsR-family transcriptional regulator. Northeast Structural Genomics Consortium Target MbR242E.' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Theresa Ramelot . A. . c16368_2kko 1 2 John Cort . R. . c16368_2kko 1 3 D. Wang . . . c16368_2kko 1 4 Colleen Ciccosanti . . . c16368_2kko 1 5 Mei Jiang . . . c16368_2kko 1 6 R. Nair . . . c16368_2kko 1 7 Burkhard Rost . . . c16368_2kko 1 8 G.V.T. Swapna . . . c16368_2kko 1 9 Thomas Acton . B. . c16368_2kko 1 10 Rong Xiao . . . c16368_2kko 1 11 John Everett . K. . c16368_2kko 1 12 Gaetano Montelione . T. . c16368_2kko 1 13 Michael Kennedy . A. . c16368_2kko 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID c16368_2kko _Assembly.ID 1 _Assembly.Name Mb0332 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 23400 _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 Mb0332 1 $entity A . yes native no no . . . c16368_2kko 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID c16368_2kko _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Mb0332 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; XAGQSDRKAALLDQVARVGK ALANGRRLQILDLLAQGERA VEAIATATGMNLTTASANLQ ALKSGGLVEARREGTRQYYR IAGEDVARLFALVQVVADEH LEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details '8 non-native residues at C-terminus (LEHHHHHH)' _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 108 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'HTH arsR-type DNA binding domain' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 11700 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2013-05-13 loop_ _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 no PDB 2KKO . 'Solution Nmr Structure Of The Homodimeric Winged Helix-Turn- Helix Dna-Binding Domain (Fragment 1-100) Mb0332 From Mycobacteriu' . . . . . 99.07 108 100.00 100.00 2.71e-67 . . . . c16368_2kko 1 no PDB 3GW2 . 'Crystal Structure Of Possible Transcriptional Regulatory Protein (Fragment 1-100) From Mycobacterium Bovis. Northeast Structura' . . . . . 99.07 108 99.07 99.07 4.24e-66 . . . . c16368_2kko 1 no DBJ BAH24631 . 'putative transcriptional regulatory protein [Mycobacterium bovis BCG str. Tokyo 172]' . . . . . 92.59 226 100.00 100.00 3.06e-59 . . . . c16368_2kko 1 no DBJ BAL64175 . 'ArsR family transcriptional regulator [Mycobacterium tuberculosis str. Erdman = ATCC 35801]' . . . . . 92.59 226 100.00 100.00 3.06e-59 . . . . c16368_2kko 1 no DBJ GAA44115 . 'ArsR family transcriptional regulator [Mycobacterium tuberculosis NCGM2209]' . . . . . 77.78 209 98.81 100.00 1.33e-47 . . . . c16368_2kko 1 no EMBL CAD93196 . 'POSSIBLE TRANSCRIPTIONAL REGULATORY PROTEIN (POSSIBLY ARSR-FAMILY) [Mycobacterium bovis AF2122/97]' . . . . . 92.59 226 100.00 100.00 3.06e-59 . . . . c16368_2kko 1 no EMBL CAL70349 . 'Possible transcriptional regulatory protein (possibly arsR-family) [Mycobacterium bovis BCG str. Pasteur 1173P2]' . . . . . 92.59 226 100.00 100.00 3.06e-59 . . . . c16368_2kko 1 no EMBL CCC25398 . 'putative transcriptional regulatory protein (possibly ARSR-family) [Mycobacterium africanum GM041182]' . . . . . 92.59 226 100.00 100.00 3.06e-59 . . . . c16368_2kko 1 no EMBL CCC42666 . 'putative transcriptional regulatory protein (possibly ARSR-family) [Mycobacterium canettii CIPT 140010059]' . . . . . 92.59 226 99.00 100.00 1.05e-58 . . . . c16368_2kko 1 no EMBL CCC62925 . 'possible transcriptional regulatory protein (possibly arsR-family) [Mycobacterium bovis BCG str. Moreau RDJ]' . . . . . 92.59 226 100.00 100.00 3.06e-59 . . . . c16368_2kko 1 no GB AAK44562 . 'transcriptional regulator, ArsR family [Mycobacterium tuberculosis CDC1551]' . . . . . 92.59 226 100.00 100.00 3.06e-59 . . . . c16368_2kko 1 no GB ABQ72051 . 'ArsR family transcriptional regulator [Mycobacterium tuberculosis H37Ra]' . . . . . 92.59 226 100.00 100.00 2.63e-59 . . . . c16368_2kko 1 no GB ABR04672 . 'hypothetical transcriptional regulatory protein, arsR-family [Mycobacterium tuberculosis F11]' . . . . . 92.59 226 100.00 100.00 2.63e-59 . . . . c16368_2kko 1 no GB ACT23356 . 'transcriptional regulator, arsR-family [Mycobacterium tuberculosis KZN 1435]' . . . . . 92.59 226 100.00 100.00 2.63e-59 . . . . c16368_2kko 1 no GB AEB02460 . 'transcriptional regulator, arsR-family [Mycobacterium tuberculosis KZN 4207]' . . . . . 92.59 226 100.00 100.00 2.63e-59 . . . . c16368_2kko 1 no REF NP_214838 . 'Possible transcriptional regulatory protein (possibly ArsR-family) [Mycobacterium tuberculosis H37Rv]' . . . . . 92.59 226 100.00 100.00 2.63e-59 . . . . c16368_2kko 1 no REF NP_334748 . 'ArsR family transcriptional regulator [Mycobacterium tuberculosis CDC1551]' . . . . . 92.59 226 100.00 100.00 3.06e-59 . . . . c16368_2kko 1 no REF NP_853996 . 'ArsR family transcriptional regulator [Mycobacterium bovis AF2122/97]' . . . . . 92.59 226 100.00 100.00 3.06e-59 . . . . c16368_2kko 1 no REF WP_003401648 . 'ArsR family transcriptional regulator [Mycobacterium orygis]' . . . . . 92.59 226 100.00 100.00 3.06e-59 . . . . c16368_2kko 1 no REF WP_003906339 . 'ArsR family transcriptional regulator [Mycobacterium tuberculosis]' . . . . . 92.59 226 100.00 100.00 2.63e-59 . . . . c16368_2kko 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'HTH arsR' c16368_2kko 1 'DNA binding' c16368_2kko 1 'transcriptional regulator' c16368_2kko 1 'winged helix' c16368_2kko 1 wHTH c16368_2kko 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 . MET_AC . c16368_2kko 1 2 . ALA . c16368_2kko 1 3 . GLY . c16368_2kko 1 4 . GLN . c16368_2kko 1 5 . SER . c16368_2kko 1 6 . ASP . c16368_2kko 1 7 . ARG . c16368_2kko 1 8 . LYS . c16368_2kko 1 9 . ALA . c16368_2kko 1 10 . ALA . c16368_2kko 1 11 . LEU . c16368_2kko 1 12 . LEU . c16368_2kko 1 13 . ASP . c16368_2kko 1 14 . GLN . c16368_2kko 1 15 . VAL . c16368_2kko 1 16 . ALA . c16368_2kko 1 17 . ARG . c16368_2kko 1 18 . VAL . c16368_2kko 1 19 . GLY . c16368_2kko 1 20 . LYS . c16368_2kko 1 21 . ALA . c16368_2kko 1 22 . LEU . c16368_2kko 1 23 . ALA . c16368_2kko 1 24 . ASN . c16368_2kko 1 25 . GLY . c16368_2kko 1 26 . ARG . c16368_2kko 1 27 . ARG . c16368_2kko 1 28 . LEU . c16368_2kko 1 29 . GLN . c16368_2kko 1 30 . ILE . c16368_2kko 1 31 . LEU . c16368_2kko 1 32 . ASP . c16368_2kko 1 33 . LEU . c16368_2kko 1 34 . LEU . c16368_2kko 1 35 . ALA . c16368_2kko 1 36 . GLN . c16368_2kko 1 37 . GLY . c16368_2kko 1 38 . GLU . c16368_2kko 1 39 . ARG . c16368_2kko 1 40 . ALA . c16368_2kko 1 41 . VAL . c16368_2kko 1 42 . GLU . c16368_2kko 1 43 . ALA . c16368_2kko 1 44 . ILE . c16368_2kko 1 45 . ALA . c16368_2kko 1 46 . THR . c16368_2kko 1 47 . ALA . c16368_2kko 1 48 . THR . c16368_2kko 1 49 . GLY . c16368_2kko 1 50 . MET . c16368_2kko 1 51 . ASN . c16368_2kko 1 52 . LEU . c16368_2kko 1 53 . THR . c16368_2kko 1 54 . THR . c16368_2kko 1 55 . ALA . c16368_2kko 1 56 . SER . c16368_2kko 1 57 . ALA . c16368_2kko 1 58 . ASN . c16368_2kko 1 59 . LEU . c16368_2kko 1 60 . GLN . c16368_2kko 1 61 . ALA . c16368_2kko 1 62 . LEU . c16368_2kko 1 63 . LYS . c16368_2kko 1 64 . SER . c16368_2kko 1 65 . GLY . c16368_2kko 1 66 . GLY . c16368_2kko 1 67 . LEU . c16368_2kko 1 68 . VAL . c16368_2kko 1 69 . GLU . c16368_2kko 1 70 . ALA . c16368_2kko 1 71 . ARG . c16368_2kko 1 72 . ARG . c16368_2kko 1 73 . GLU . c16368_2kko 1 74 . GLY . c16368_2kko 1 75 . THR . c16368_2kko 1 76 . ARG . c16368_2kko 1 77 . GLN . c16368_2kko 1 78 . TYR . c16368_2kko 1 79 . TYR . c16368_2kko 1 80 . ARG . c16368_2kko 1 81 . ILE . c16368_2kko 1 82 . ALA . c16368_2kko 1 83 . GLY . c16368_2kko 1 84 . GLU . c16368_2kko 1 85 . ASP . c16368_2kko 1 86 . VAL . c16368_2kko 1 87 . ALA . c16368_2kko 1 88 . ARG . c16368_2kko 1 89 . LEU . c16368_2kko 1 90 . PHE . c16368_2kko 1 91 . ALA . c16368_2kko 1 92 . LEU . c16368_2kko 1 93 . VAL . c16368_2kko 1 94 . GLN . c16368_2kko 1 95 . VAL . c16368_2kko 1 96 . VAL . c16368_2kko 1 97 . ALA . c16368_2kko 1 98 . ASP . c16368_2kko 1 99 . GLU . c16368_2kko 1 100 . HIS . c16368_2kko 1 101 . LEU . c16368_2kko 1 102 . GLU . c16368_2kko 1 103 . HIS . c16368_2kko 1 104 . HIS . c16368_2kko 1 105 . HIS . c16368_2kko 1 106 . HIS . c16368_2kko 1 107 . HIS . c16368_2kko 1 108 . HIS . c16368_2kko 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_AC 1 1 c16368_2kko 1 . ALA 2 2 c16368_2kko 1 . GLY 3 3 c16368_2kko 1 . GLN 4 4 c16368_2kko 1 . SER 5 5 c16368_2kko 1 . ASP 6 6 c16368_2kko 1 . ARG 7 7 c16368_2kko 1 . LYS 8 8 c16368_2kko 1 . ALA 9 9 c16368_2kko 1 . ALA 10 10 c16368_2kko 1 . LEU 11 11 c16368_2kko 1 . LEU 12 12 c16368_2kko 1 . ASP 13 13 c16368_2kko 1 . GLN 14 14 c16368_2kko 1 . VAL 15 15 c16368_2kko 1 . ALA 16 16 c16368_2kko 1 . ARG 17 17 c16368_2kko 1 . VAL 18 18 c16368_2kko 1 . GLY 19 19 c16368_2kko 1 . LYS 20 20 c16368_2kko 1 . ALA 21 21 c16368_2kko 1 . LEU 22 22 c16368_2kko 1 . ALA 23 23 c16368_2kko 1 . ASN 24 24 c16368_2kko 1 . GLY 25 25 c16368_2kko 1 . ARG 26 26 c16368_2kko 1 . ARG 27 27 c16368_2kko 1 . LEU 28 28 c16368_2kko 1 . GLN 29 29 c16368_2kko 1 . ILE 30 30 c16368_2kko 1 . LEU 31 31 c16368_2kko 1 . ASP 32 32 c16368_2kko 1 . LEU 33 33 c16368_2kko 1 . LEU 34 34 c16368_2kko 1 . ALA 35 35 c16368_2kko 1 . GLN 36 36 c16368_2kko 1 . GLY 37 37 c16368_2kko 1 . GLU 38 38 c16368_2kko 1 . ARG 39 39 c16368_2kko 1 . ALA 40 40 c16368_2kko 1 . VAL 41 41 c16368_2kko 1 . GLU 42 42 c16368_2kko 1 . ALA 43 43 c16368_2kko 1 . ILE 44 44 c16368_2kko 1 . ALA 45 45 c16368_2kko 1 . THR 46 46 c16368_2kko 1 . ALA 47 47 c16368_2kko 1 . THR 48 48 c16368_2kko 1 . GLY 49 49 c16368_2kko 1 . MET 50 50 c16368_2kko 1 . ASN 51 51 c16368_2kko 1 . LEU 52 52 c16368_2kko 1 . THR 53 53 c16368_2kko 1 . THR 54 54 c16368_2kko 1 . ALA 55 55 c16368_2kko 1 . SER 56 56 c16368_2kko 1 . ALA 57 57 c16368_2kko 1 . ASN 58 58 c16368_2kko 1 . LEU 59 59 c16368_2kko 1 . GLN 60 60 c16368_2kko 1 . ALA 61 61 c16368_2kko 1 . LEU 62 62 c16368_2kko 1 . LYS 63 63 c16368_2kko 1 . SER 64 64 c16368_2kko 1 . GLY 65 65 c16368_2kko 1 . GLY 66 66 c16368_2kko 1 . LEU 67 67 c16368_2kko 1 . VAL 68 68 c16368_2kko 1 . GLU 69 69 c16368_2kko 1 . ALA 70 70 c16368_2kko 1 . ARG 71 71 c16368_2kko 1 . ARG 72 72 c16368_2kko 1 . GLU 73 73 c16368_2kko 1 . GLY 74 74 c16368_2kko 1 . THR 75 75 c16368_2kko 1 . ARG 76 76 c16368_2kko 1 . GLN 77 77 c16368_2kko 1 . TYR 78 78 c16368_2kko 1 . TYR 79 79 c16368_2kko 1 . ARG 80 80 c16368_2kko 1 . ILE 81 81 c16368_2kko 1 . ALA 82 82 c16368_2kko 1 . GLY 83 83 c16368_2kko 1 . GLU 84 84 c16368_2kko 1 . ASP 85 85 c16368_2kko 1 . VAL 86 86 c16368_2kko 1 . ALA 87 87 c16368_2kko 1 . ARG 88 88 c16368_2kko 1 . LEU 89 89 c16368_2kko 1 . PHE 90 90 c16368_2kko 1 . ALA 91 91 c16368_2kko 1 . LEU 92 92 c16368_2kko 1 . VAL 93 93 c16368_2kko 1 . GLN 94 94 c16368_2kko 1 . VAL 95 95 c16368_2kko 1 . VAL 96 96 c16368_2kko 1 . ALA 97 97 c16368_2kko 1 . ASP 98 98 c16368_2kko 1 . GLU 99 99 c16368_2kko 1 . HIS 100 100 c16368_2kko 1 . LEU 101 101 c16368_2kko 1 . GLU 102 102 c16368_2kko 1 . HIS 103 103 c16368_2kko 1 . HIS 104 104 c16368_2kko 1 . HIS 105 105 c16368_2kko 1 . HIS 106 106 c16368_2kko 1 . HIS 107 107 c16368_2kko 1 . HIS 108 108 c16368_2kko 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 c16368_2kko _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . 1765 organism . 'Mycobacterium bovis' 'Mycobacterium bovis' . . Bacteria . Mycobacterium bovis . . . . . . . . . . . . . . . . Mb0332 . . . . c16368_2kko 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 c16368_2kko _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21(DE3) pMGK' . . . . . . . . . . . . . . . pET21-23C . . . . . . c16368_2kko 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_MET_AC _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode MET_AC _Chem_comp.Entry_ID c16368_2kko _Chem_comp.ID MET_AC _Chem_comp.Provenance . _Chem_comp.Name 'N-ACETYL L-METHIONINE' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code MET_AC _Chem_comp.PDB_code . _Chem_comp.Ambiguous_flag . _Chem_comp.Initial_date . _Chem_comp.Modified_date . _Chem_comp.Release_status . _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code . _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InCHi_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code MET _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge . _Chem_comp.Paramagnetic no _Chem_comp.Aromatic . _Chem_comp.Formula 'C7 H12 N1 O2 S1' _Chem_comp.Formula_weight . _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag . _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag . _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site . _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_common_name.Name _Chem_comp_common_name.Type _Chem_comp_common_name.Entry_ID _Chem_comp_common_name.Comp_ID 'N-ACETYL L-METHIONINE' common c16368_2kko MET_AC Ac-MET abbreviation c16368_2kko MET_AC stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID N . N . . N . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC CA . CA . . C . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC CB . CB . . C . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC CG . CG . . C . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC SD . SD . . S . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC CE . CE . . C . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC C . C . . C . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC O . O . . O . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC H . H . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC HA . HA . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC HB2 . 1HB . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC HB3 . 2HB . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC HG2 . 1HG . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC HG3 . 2HG . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC HE1 . 1HE . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC HE2 . 2HE . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC HE3 . 3HE . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC C1 . . . . C . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC C2 . . . . C . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC O1 . . . . O . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC H21 . . . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC H22 . . . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC H23 . . . . H . . . 0 . . . . . . . . . . . . . . . . . . . . . c16368_2kko MET_AC stop_ loop_ _Atom_nomenclature.Atom_ID _Atom_nomenclature.Atom_name _Atom_nomenclature.Naming_system _Atom_nomenclature.Entry_ID _Atom_nomenclature.Comp_ID . N . c16368_2kko MET_AC . CA . c16368_2kko MET_AC . CB . c16368_2kko MET_AC . CG . c16368_2kko MET_AC . SD . c16368_2kko MET_AC . CE . c16368_2kko MET_AC . C . c16368_2kko MET_AC . O . c16368_2kko MET_AC . H . c16368_2kko MET_AC . HA . c16368_2kko MET_AC . HB2 . c16368_2kko MET_AC . HB3 . c16368_2kko MET_AC . HG2 . c16368_2kko MET_AC . HG3 . c16368_2kko MET_AC . HE1 . c16368_2kko MET_AC . HE2 . c16368_2kko MET_AC . HE3 . c16368_2kko MET_AC . C1 . c16368_2kko MET_AC . C2 . c16368_2kko MET_AC . O1 . c16368_2kko MET_AC . H21 . c16368_2kko MET_AC . H22 . c16368_2kko MET_AC . H23 . c16368_2kko MET_AC stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N CA . . . . c16368_2kko MET_AC 2 . SING N C1 . . . . c16368_2kko MET_AC 3 . SING N H . . . . c16368_2kko MET_AC 4 . SING CA CB . . . . c16368_2kko MET_AC 5 . SING CA C . . . . c16368_2kko MET_AC 6 . SING CA HA . . . . c16368_2kko MET_AC 7 . SING CB CG . . . . c16368_2kko MET_AC 8 . SING CB HB2 . . . . c16368_2kko MET_AC 9 . SING CB HB3 . . . . c16368_2kko MET_AC 10 . SING CG SD . . . . c16368_2kko MET_AC 11 . SING CG HG2 . . . . c16368_2kko MET_AC 12 . SING CG HG3 . . . . c16368_2kko MET_AC 13 . SING SD CE . . . . c16368_2kko MET_AC 14 . SING CE HE1 . . . . c16368_2kko MET_AC 15 . SING CE HE2 . . . . c16368_2kko MET_AC 16 . SING CE HE3 . . . . c16368_2kko MET_AC 17 . DOUB C O . . . . c16368_2kko MET_AC 18 . DOUB C1 O1 . . . . c16368_2kko MET_AC 19 . SING C1 C2 . . . . c16368_2kko MET_AC 20 . SING C2 H21 . . . . c16368_2kko MET_AC 21 . SING C2 H22 . . . . c16368_2kko MET_AC 22 . SING C2 H23 . . . . c16368_2kko MET_AC stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_NC_sample _Sample.Sf_category sample _Sample.Sf_framecode NC_sample _Sample.Entry_ID c16368_2kko _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 MES 'natural abundance' . . . . . . 20 . . mM 2.5 . . . c16368_2kko 1 2 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM 10 . . . c16368_2kko 1 3 DTT 'natural abundance' . . . . . . 10 . . mM 0.5 . . . c16368_2kko 1 4 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % 0.001 . . . c16368_2kko 1 5 protein '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 1.1 . . mM 0.05 . . . c16368_2kko 1 6 DSS 'natural abundance' . . . . . . 50 . . uM 2.5 . . . c16368_2kko 1 7 H2O 'natural abundance' . . . . . . 95 . . % . . . . c16368_2kko 1 8 D2O 'natural abundance' . . . . . . 5 . . % . . . . c16368_2kko 1 stop_ save_ save_NC5_sample _Sample.Sf_category sample _Sample.Sf_framecode NC5_sample _Sample.Entry_ID c16368_2kko _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 MES 'natural abundance' . . . . . . 20 . . mM 2.5 . . . c16368_2kko 2 2 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM 2.5 . . . c16368_2kko 2 3 DTT 'natural abundance' . . . . . . 10 . . mM 0.5 . . . c16368_2kko 2 4 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % 0.001 . . . c16368_2kko 2 5 protein '[U-5% 13C; U-100% 15N]' . . 1 $entity . . 0.8 . . mM 0.1 . . . c16368_2kko 2 6 DSS 'natural abundance' . . . . . . 50 . . uM 2.5 . . . c16368_2kko 2 7 H2O 'natural abundance' . . . . . . 95 . . % . . . . c16368_2kko 2 8 D2O 'natural abundance' . . . . . . 5 . . % . . . . c16368_2kko 2 stop_ save_ save_NC50_sample _Sample.Sf_category sample _Sample.Sf_framecode NC50_sample _Sample.Entry_ID c16368_2kko _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 MES 'natural abundance' . . . . . . 20 . . mM 2.5 . . . c16368_2kko 3 2 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM 2.5 . . . c16368_2kko 3 3 DTT 'natural abundance' . . . . . . 10 . . mM 0.5 . . . c16368_2kko 3 4 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % 0.001 . . . c16368_2kko 3 5 protein '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 0.5 . . mM 0.05 . . . c16368_2kko 3 6 DSS 'natural abundance' . . . . . . 50 . . uM 2.5 . . . c16368_2kko 3 7 protein 'natural abundance' . . 1 $entity . . .5 . . mM 0.05 . . . c16368_2kko 3 8 H2O 'natural abundance' . . . . . . 95 . . % . . . . c16368_2kko 3 9 D2O 'natural abundance' . . . . . . 5 . . % . . . . c16368_2kko 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID c16368_2kko _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 temperature 293 0.5 K c16368_2kko 1 pH 6.0 0.1 pH c16368_2kko 1 pressure 1 . atm c16368_2kko 1 'ionic strength' 200 5 mM c16368_2kko 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID c16368_2kko _Software.ID 1 _Software.Name NMRPipe _Software.Version 2008 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . c16368_2kko 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing c16368_2kko 1 stop_ save_ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID c16368_2kko _Software.ID 2 _Software.Name VNMR _Software.Version 6.1C _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . c16368_2kko 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection c16368_2kko 2 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID c16368_2kko _Software.ID 3 _Software.Name TOPSPIN _Software.Version 2.1.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . c16368_2kko 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection c16368_2kko 3 stop_ save_ save_AutoStructure _Software.Sf_category software _Software.Sf_framecode AutoStructure _Software.Entry_ID c16368_2kko _Software.ID 4 _Software.Name AutoStructure _Software.Version 2.2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Huang, Tejero, Powers and Montelione' . . c16368_2kko 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c16368_2kko 4 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID c16368_2kko _Software.ID 5 _Software.Name X-PLOR_NIH _Software.Version 2.20 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . c16368_2kko 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' c16368_2kko 5 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID c16368_2kko _Software.ID 6 _Software.Name SPARKY _Software.Version 3.113 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . c16368_2kko 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c16368_2kko 6 stop_ save_ save_PSVS _Software.Sf_category software _Software.Sf_framecode PSVS _Software.Entry_ID c16368_2kko _Software.ID 7 _Software.Name PSVS _Software.Version 1.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . c16368_2kko 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure validation' c16368_2kko 7 stop_ save_ save_AutoAssign _Software.Sf_category software _Software.Sf_framecode AutoAssign _Software.Entry_ID c16368_2kko _Software.ID 8 _Software.Name AutoAssign _Software.Version 2.3.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Zimmerman, Moseley, Kulikowski and Montelione' . . c16368_2kko 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' c16368_2kko 8 stop_ save_ save_PDBStat _Software.Sf_category software _Software.Sf_framecode PDBStat _Software.Entry_ID c16368_2kko _Software.ID 9 _Software.Name PDBStat _Software.Version 5.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID '(PDBStat) R. Tejero, G.T. Montelione' . . c16368_2kko 9 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' c16368_2kko 9 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID c16368_2kko _Software.ID 10 _Software.Name CNS _Software.Version 1.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . c16368_2kko 10 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement c16368_2kko 10 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 c16368_2kko _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 c16368_2kko _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID c16368_2kko _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID c16368_2kko _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 600 . . . c16368_2kko 1 2 spectrometer_2 Bruker AvanceIII . 850 . . . c16368_2kko 1 3 spectrometer_3 Varian INOVA . 750 . . . c16368_2kko 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID c16368_2kko _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.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.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . c16368_2kko 1 2 '2D 1H-13C HSQC' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . c16368_2kko 1 3 '3D 1H-15N NOESY' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . c16368_2kko 1 4 '3D 1H-13C NOESY aliph' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . c16368_2kko 1 5 '3D HNCO' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 6 '3D HNCA' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 7 '3D CBCA(CO)NH' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 8 '3D HNCACB' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 9 '3D C(CO)NH' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 10 '3D HBHA(CO)NH' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 11 '3D HCCH-TOCSY' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 12 '3D HCCH-COSY' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 13 '2D 1H-13C HSQC arom' yes . . 2 $NC5_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 14 '3D 1H-13C NOESY arom' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 15 '3D CN filt 1H-13C NOESY' yes . . 3 $NC50_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 16 '2D 1H-13C HSQC' yes . . 3 $NC50_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 17 '3D HNCOCA' yes . . 1 $NC_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 18 '2D 1H-13C HSQC aliph' yes . . 2 $NC5_sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . c16368_2kko 1 19 '2D 1H-15N HSQC' yes . . 2 $NC5_sample isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . c16368_2kko 1 stop_ save_ save_NMR_spectrometer_expt_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_1 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '2D 1H-15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 3 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_3 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_Nhsqc_750MHz_4_23_09.fid/ . . . . . . . c16368_2kko 1 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_Nhsqc_750MHz_4_23_09.fid/ . . . . . . . c16368_2kko 1 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_Nhsqc_750MHz_4_23_09.fid/ . . . . . . . c16368_2kko 1 stop_ save_ save_NMR_spectrometer_expt_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_2 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '2D 1H-13C HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqu 'acquisition parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/10_mbr242e.012_Chsqc_5_8_09.850mhz/ . . . . . . . c16368_2kko 2 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/10_mbr242e.012_Chsqc_5_8_09.850mhz/ . . . . . . . c16368_2kko 2 ser 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/10_mbr242e.012_Chsqc_5_8_09.850mhz/ . . . . . . . c16368_2kko 2 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/10_mbr242e.012_Chsqc_5_8_09.850mhz/ . . . . . . . c16368_2kko 2 stop_ save_ save_NMR_spectrometer_expt_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_3 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '3D 1H-15N NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 3 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_3 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_Nnoesy_750Mhz_4_24_09.fid/ . . . . . . . c16368_2kko 3 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_Nnoesy_750Mhz_4_24_09.fid/ . . . . . . . c16368_2kko 3 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_Nnoesy_750Mhz_4_24_09.fid/ . . . . . . . c16368_2kko 3 stop_ save_ save_NMR_spectrometer_expt_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_4 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 4 _NMR_spec_expt.Name '3D 1H-13C NOESY aliph' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 2 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_2 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID acqu 'acquisition parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/52_Cnoesy_aliph_5_12_09.850mhz/ . . . . . . . c16368_2kko 4 pulseprogram 'pulse program' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/52_Cnoesy_aliph_5_12_09.850mhz/ . . . . . . . c16368_2kko 4 ser 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/52_Cnoesy_aliph_5_12_09.850mhz/ . . . . . . . c16368_2kko 4 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/52_Cnoesy_aliph_5_12_09.850mhz/ . . . . . . . c16368_2kko 4 stop_ save_ save_NMR_spectrometer_expt_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_5 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 5 _NMR_spec_expt.Name '3D HNCO' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hnco_3_25_09.fid/ . . . . . . . c16368_2kko 5 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hnco_3_25_09.fid/ . . . . . . . c16368_2kko 5 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hnco_3_25_09.fid/ . . . . . . . c16368_2kko 5 stop_ save_ save_NMR_spectrometer_expt_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_6 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 6 _NMR_spec_expt.Name '3D HNCA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hnca_4_9_09.fid/ . . . . . . . c16368_2kko 6 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hnca_4_9_09.fid/ . . . . . . . c16368_2kko 6 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hnca_4_9_09.fid/ . . . . . . . c16368_2kko 6 stop_ save_ save_NMR_spectrometer_expt_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_7 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 7 _NMR_spec_expt.Name '3D CBCA(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_cbcaconh_4_6_09.fid/ . . . . . . . c16368_2kko 7 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_cbcaconh_4_6_09.fid/ . . . . . . . c16368_2kko 7 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_cbcaconh_4_6_09.fid/ . . . . . . . c16368_2kko 7 stop_ save_ save_NMR_spectrometer_expt_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_8 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 8 _NMR_spec_expt.Name '3D HNCACB' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hncacb_3_30_09.fid/ . . . . . . . c16368_2kko 8 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hncacb_3_30_09.fid/ . . . . . . . c16368_2kko 8 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hncacb_3_30_09.fid/ . . . . . . . c16368_2kko 8 stop_ save_ save_NMR_spectrometer_expt_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_9 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 9 _NMR_spec_expt.Name '3D C(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_ccc_toc_conh_4_13_09.fid/ . . . . . . . c16368_2kko 9 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_ccc_toc_conh_4_13_09.fid/ . . . . . . . c16368_2kko 9 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_ccc_toc_conh_4_13_09.fid/ . . . . . . . c16368_2kko 9 stop_ save_ save_NMR_spectrometer_expt_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_10 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '3D HBHA(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hbha_co_nh_4_2_09.fid/ . . . . . . . c16368_2kko 10 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hbha_co_nh_4_2_09.fid/ . . . . . . . c16368_2kko 10 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hbha_co_nh_4_2_09.fid/ . . . . . . . c16368_2kko 10 stop_ save_ save_NMR_spectrometer_expt_11 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_11 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 11 _NMR_spec_expt.Name '3D HCCH-TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hcch_tocsy_4_8_09.fid/ . . . . . . . c16368_2kko 11 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hcch_tocsy_4_8_09.fid/ . . . . . . . c16368_2kko 11 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hcch_tocsy_4_8_09.fid/ . . . . . . . c16368_2kko 11 stop_ save_ save_NMR_spectrometer_expt_12 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_12 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 12 _NMR_spec_expt.Name '3D HCCH-COSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hcch_cosy_5_12_09.fid/ . . . . . . . c16368_2kko 12 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hcch_cosy_5_12_09.fid/ . . . . . . . c16368_2kko 12 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hcch_cosy_5_12_09.fid/ . . . . . . . c16368_2kko 12 stop_ save_ save_NMR_spectrometer_expt_13 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_13 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 13 _NMR_spec_expt.Name '2D 1H-13C HSQC arom' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_chsqc_arom_noct_3_25_09.fid/ . . . . . . . c16368_2kko 13 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_chsqc_arom_noct_3_25_09.fid/ . . . . . . . c16368_2kko 13 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_chsqc_arom_noct_3_25_09.fid/ . . . . . . . c16368_2kko 13 stop_ save_ save_NMR_spectrometer_expt_14 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_14 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 14 _NMR_spec_expt.Name '3D 1H-13C NOESY arom' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_Cnoesy_arom_600mhz_5_10_09.fid/ . . . . . . . c16368_2kko 14 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_Cnoesy_arom_600mhz_5_10_09.fid/ . . . . . . . c16368_2kko 14 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_Cnoesy_arom_600mhz_5_10_09.fid/ . . . . . . . c16368_2kko 14 stop_ save_ save_NMR_spectrometer_expt_15 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_15 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 15 _NMR_spec_expt.Name '3D CN filt 1H-13C NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc50_CNfilt_Cnoesy_5_22_09.fid/ . . . . . . . c16368_2kko 15 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc50_CNfilt_Cnoesy_5_22_09.fid/ . . . . . . . c16368_2kko 15 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc50_CNfilt_Cnoesy_5_22_09.fid/ . . . . . . . c16368_2kko 15 stop_ save_ save_NMR_spectrometer_expt_16 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_16 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 16 _NMR_spec_expt.Name '2D 1H-13C HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc50_Chsqc_5_22_09.fid/ . . . . . . . c16368_2kko 16 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc50_Chsqc_5_22_09.fid/ . . . . . . . c16368_2kko 16 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc50_Chsqc_5_22_09.fid/ . . . . . . . c16368_2kko 16 stop_ save_ save_NMR_spectrometer_expt_17 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_17 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 17 _NMR_spec_expt.Name '3D HNCOCA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hncoca_4_10_09.fid/ . . . . . . . c16368_2kko 17 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hncoca_4_10_09.fid/ . . . . . . . c16368_2kko 17 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_hncoca_4_10_09.fid/ . . . . . . . c16368_2kko 17 stop_ save_ save_NMR_spectrometer_expt_18 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_18 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 18 _NMR_spec_expt.Name '2D 1H-13C HSQC aliph' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc5_chsqc_aliph_600mhz_4_17_09.fid/ . . . . . . . c16368_2kko 18 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc5_chsqc_aliph_600mhz_4_17_09.fid/ . . . . . . . c16368_2kko 18 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc5_chsqc_aliph_600mhz_4_17_09.fid/ . . . . . . . c16368_2kko 18 stop_ save_ save_NMR_spectrometer_expt_19 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_19 _NMR_spec_expt.Entry_ID c16368_2kko _NMR_spec_expt.ID 19 _NMR_spec_expt.Name '2D 1H-15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc5_nhsqc_600mhz_4_16_09.fid/ . . . . . . . c16368_2kko 19 procpar 'processing parameters' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc5_nhsqc_600mhz_4_16_09.fid/ . . . . . . . c16368_2kko 19 . 'NMR Experiment Directory' http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr16368/timedomain_data/nesgMbR242E_bmrb16368_pdb2KKO/mbr242e_nc5_nhsqc_600mhz_4_16_09.fid/ . . . . . . . c16368_2kko 19 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID c16368_2kko _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . c16368_2kko 1 C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . c16368_2kko 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . c16368_2kko 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID c16368_2kko _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . c16368_2kko 1 3 '3D 1H-15N NOESY' . . . c16368_2kko 1 4 '3D 1H-13C NOESY' . . . c16368_2kko 1 5 '3D HNCO' . . . c16368_2kko 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 6 $SPARKY . . c16368_2kko 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_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET_AC C C 13 177.4 0.2 . 1 . . . 1 MET C . c16368_2kko 1 2 . 1 1 1 1 MET_AC CA C 13 73.5 0.2 . 1 . . . 1 MET CA . c16368_2kko 1 3 . 1 1 1 1 MET_AC CB C 13 76.0 0.2 . 1 . . . 1 MET CB . c16368_2kko 1 4 . 1 1 2 2 ALA H H 1 8.45 0.02 . 1 . . . 2 ALA H . c16368_2kko 1 5 . 1 1 2 2 ALA HA H 1 4.39 0.02 . 1 . . . 2 ALA HA . c16368_2kko 1 6 . 1 1 2 2 ALA HB1 H 1 1.41 0.02 . 1 . . . 2 ALA HB . c16368_2kko 1 7 . 1 1 2 2 ALA HB2 H 1 1.41 0.02 . 1 . . . 2 ALA HB . c16368_2kko 1 8 . 1 1 2 2 ALA HB3 H 1 1.41 0.02 . 1 . . . 2 ALA HB . c16368_2kko 1 9 . 1 1 2 2 ALA C C 13 178.3 0.2 . 1 . . . 2 ALA C . c16368_2kko 1 10 . 1 1 2 2 ALA CA C 13 52.5 0.2 . 1 . . . 2 ALA CA . c16368_2kko 1 11 . 1 1 2 2 ALA CB C 13 19.2 0.2 . 1 . . . 2 ALA CB . c16368_2kko 1 12 . 1 1 2 2 ALA N N 15 125.1 0.2 . 1 . . . 2 ALA N . c16368_2kko 1 13 . 1 1 3 3 GLY H H 1 8.45 0.02 . 1 . . . 3 GLY H . c16368_2kko 1 14 . 1 1 3 3 GLY HA2 H 1 4.03 0.02 . 2 . . . 3 GLY HA2 . c16368_2kko 1 15 . 1 1 3 3 GLY HA3 H 1 4.03 0.02 . 2 . . . 3 GLY HA3 . c16368_2kko 1 16 . 1 1 3 3 GLY C C 13 174.1 0.2 . 1 . . . 3 GLY C . c16368_2kko 1 17 . 1 1 3 3 GLY CA C 13 45.2 0.2 . 1 . . . 3 GLY CA . c16368_2kko 1 18 . 1 1 3 3 GLY N N 15 108.0 0.2 . 1 . . . 3 GLY N . c16368_2kko 1 19 . 1 1 4 4 GLN H H 1 8.55 0.02 . 1 . . . 4 GLN H . c16368_2kko 1 20 . 1 1 4 4 GLN HA H 1 4.34 0.02 . 1 . . . 4 GLN HA . c16368_2kko 1 21 . 1 1 4 4 GLN HB2 H 1 2.01 0.02 . 2 . . . 4 GLN HB2 . c16368_2kko 1 22 . 1 1 4 4 GLN HB3 H 1 2.11 0.02 . 2 . . . 4 GLN HB3 . c16368_2kko 1 23 . 1 1 4 4 GLN HE21 H 1 6.89 0.02 . 2 . . . 4 GLN HE21 . c16368_2kko 1 24 . 1 1 4 4 GLN HE22 H 1 7.60 0.02 . 2 . . . 4 GLN HE22 . c16368_2kko 1 25 . 1 1 4 4 GLN HG2 H 1 2.39 0.02 . 2 . . . 4 GLN HG2 . c16368_2kko 1 26 . 1 1 4 4 GLN HG3 H 1 2.39 0.02 . 2 . . . 4 GLN HG3 . c16368_2kko 1 27 . 1 1 4 4 GLN C C 13 176.7 0.2 . 1 . . . 4 GLN C . c16368_2kko 1 28 . 1 1 4 4 GLN CA C 13 56.6 0.2 . 1 . . . 4 GLN CA . c16368_2kko 1 29 . 1 1 4 4 GLN CB C 13 29.3 0.2 . 1 . . . 4 GLN CB . c16368_2kko 1 30 . 1 1 4 4 GLN CG C 13 33.7 0.2 . 1 . . . 4 GLN CG . c16368_2kko 1 31 . 1 1 4 4 GLN N N 15 120.5 0.2 . 1 . . . 4 GLN N . c16368_2kko 1 32 . 1 1 4 4 GLN NE2 N 15 112.3 0.2 . 1 . . . 4 GLN NE2 . c16368_2kko 1 33 . 1 1 5 5 SER H H 1 8.54 0.02 . 1 . . . 5 SER H . c16368_2kko 1 34 . 1 1 5 5 SER HA H 1 4.39 0.02 . 1 . . . 5 SER HA . c16368_2kko 1 35 . 1 1 5 5 SER HB2 H 1 3.88 0.02 . 2 . . . 5 SER HB2 . c16368_2kko 1 36 . 1 1 5 5 SER HB3 H 1 3.94 0.02 . 2 . . . 5 SER HB3 . c16368_2kko 1 37 . 1 1 5 5 SER HG H 1 5.67 0.02 . 1 . . . 5 SER HG . c16368_2kko 1 38 . 1 1 5 5 SER C C 13 174.8 0.2 . 1 . . . 5 SER C . c16368_2kko 1 39 . 1 1 5 5 SER CA C 13 59.1 0.2 . 1 . . . 5 SER CA . c16368_2kko 1 40 . 1 1 5 5 SER CB C 13 63.5 0.2 . 1 . . . 5 SER CB . c16368_2kko 1 41 . 1 1 5 5 SER N N 15 117.1 0.2 . 1 . . . 5 SER N . c16368_2kko 1 42 . 1 1 6 6 ASP H H 1 8.30 0.02 . 1 . . . 6 ASP H . c16368_2kko 1 43 . 1 1 6 6 ASP HA H 1 4.54 0.02 . 1 . . . 6 ASP HA . c16368_2kko 1 44 . 1 1 6 6 ASP HB2 H 1 2.71 0.02 . 2 . . . 6 ASP HB2 . c16368_2kko 1 45 . 1 1 6 6 ASP HB3 H 1 2.71 0.02 . 2 . . . 6 ASP HB3 . c16368_2kko 1 46 . 1 1 6 6 ASP C C 13 177.3 0.2 . 1 . . . 6 ASP C . c16368_2kko 1 47 . 1 1 6 6 ASP CA C 13 55.1 0.2 . 1 . . . 6 ASP CA . c16368_2kko 1 48 . 1 1 6 6 ASP CB C 13 40.8 0.2 . 1 . . . 6 ASP CB . c16368_2kko 1 49 . 1 1 6 6 ASP N N 15 122.7 0.2 . 1 . . . 6 ASP N . c16368_2kko 1 50 . 1 1 7 7 ARG H H 1 8.27 0.02 . 1 . . . 7 ARG H . c16368_2kko 1 51 . 1 1 7 7 ARG HA H 1 4.15 0.02 . 1 . . . 7 ARG HA . c16368_2kko 1 52 . 1 1 7 7 ARG HB2 H 1 1.85 0.02 . 2 . . . 7 ARG HB2 . c16368_2kko 1 53 . 1 1 7 7 ARG HB3 H 1 1.97 0.02 . 2 . . . 7 ARG HB3 . c16368_2kko 1 54 . 1 1 7 7 ARG HD2 H 1 3.17 0.02 . 2 . . . 7 ARG HD2 . c16368_2kko 1 55 . 1 1 7 7 ARG HD3 H 1 3.17 0.02 . 2 . . . 7 ARG HD3 . c16368_2kko 1 56 . 1 1 7 7 ARG HG2 H 1 1.66 0.02 . 2 . . . 7 ARG HG2 . c16368_2kko 1 57 . 1 1 7 7 ARG HG3 H 1 1.75 0.02 . 2 . . . 7 ARG HG3 . c16368_2kko 1 58 . 1 1 7 7 ARG C C 13 177.6 0.2 . 1 . . . 7 ARG C . c16368_2kko 1 59 . 1 1 7 7 ARG CA C 13 58.0 0.2 . 1 . . . 7 ARG CA . c16368_2kko 1 60 . 1 1 7 7 ARG CB C 13 30.1 0.2 . 1 . . . 7 ARG CB . c16368_2kko 1 61 . 1 1 7 7 ARG CD C 13 43.0 0.2 . 1 . . . 7 ARG CD . c16368_2kko 1 62 . 1 1 7 7 ARG CG C 13 27.2 0.2 . 1 . . . 7 ARG CG . c16368_2kko 1 63 . 1 1 7 7 ARG N N 15 122.1 0.2 . 1 . . . 7 ARG N . c16368_2kko 1 64 . 1 1 8 8 LYS H H 1 8.13 0.02 . 1 . . . 8 LYS H . c16368_2kko 1 65 . 1 1 8 8 LYS HA H 1 4.09 0.02 . 1 . . . 8 LYS HA . c16368_2kko 1 66 . 1 1 8 8 LYS HB2 H 1 1.87 0.02 . 2 . . . 8 LYS HB2 . c16368_2kko 1 67 . 1 1 8 8 LYS HB3 H 1 1.87 0.02 . 2 . . . 8 LYS HB3 . c16368_2kko 1 68 . 1 1 8 8 LYS HD2 H 1 1.70 0.02 . 2 . . . 8 LYS HD2 . c16368_2kko 1 69 . 1 1 8 8 LYS HD3 H 1 1.70 0.02 . 2 . . . 8 LYS HD3 . c16368_2kko 1 70 . 1 1 8 8 LYS HE2 H 1 2.92 0.02 . 2 . . . 8 LYS HE2 . c16368_2kko 1 71 . 1 1 8 8 LYS HE3 H 1 2.92 0.02 . 2 . . . 8 LYS HE3 . c16368_2kko 1 72 . 1 1 8 8 LYS HG2 H 1 1.45 0.02 . 2 . . . 8 LYS HG2 . c16368_2kko 1 73 . 1 1 8 8 LYS HG3 H 1 1.45 0.02 . 2 . . . 8 LYS HG3 . c16368_2kko 1 74 . 1 1 8 8 LYS C C 13 177.6 0.2 . 1 . . . 8 LYS C . c16368_2kko 1 75 . 1 1 8 8 LYS CA C 13 58.4 0.2 . 1 . . . 8 LYS CA . c16368_2kko 1 76 . 1 1 8 8 LYS CB C 13 31.7 0.2 . 1 . . . 8 LYS CB . c16368_2kko 1 77 . 1 1 8 8 LYS CD C 13 28.8 0.2 . 1 . . . 8 LYS CD . c16368_2kko 1 78 . 1 1 8 8 LYS CE C 13 41.8 0.2 . 1 . . . 8 LYS CE . c16368_2kko 1 79 . 1 1 8 8 LYS CG C 13 24.7 0.2 . 1 . . . 8 LYS CG . c16368_2kko 1 80 . 1 1 8 8 LYS N N 15 120.9 0.2 . 1 . . . 8 LYS N . c16368_2kko 1 81 . 1 1 9 9 ALA H H 1 8.05 0.02 . 1 . . . 9 ALA H . c16368_2kko 1 82 . 1 1 9 9 ALA HA H 1 3.95 0.02 . 1 . . . 9 ALA HA . c16368_2kko 1 83 . 1 1 9 9 ALA HB1 H 1 1.45 0.02 . 1 . . . 9 ALA HB . c16368_2kko 1 84 . 1 1 9 9 ALA HB2 H 1 1.45 0.02 . 1 . . . 9 ALA HB . c16368_2kko 1 85 . 1 1 9 9 ALA HB3 H 1 1.45 0.02 . 1 . . . 9 ALA HB . c16368_2kko 1 86 . 1 1 9 9 ALA C C 13 179.8 0.2 . 1 . . . 9 ALA C . c16368_2kko 1 87 . 1 1 9 9 ALA CA C 13 55.1 0.2 . 1 . . . 9 ALA CA . c16368_2kko 1 88 . 1 1 9 9 ALA CB C 13 18.1 0.2 . 1 . . . 9 ALA CB . c16368_2kko 1 89 . 1 1 9 9 ALA N N 15 121.6 0.2 . 1 . . . 9 ALA N . c16368_2kko 1 90 . 1 1 10 10 ALA H H 1 7.91 0.02 . 1 . . . 10 ALA H . c16368_2kko 1 91 . 1 1 10 10 ALA HA H 1 4.20 0.02 . 1 . . . 10 ALA HA . c16368_2kko 1 92 . 1 1 10 10 ALA HB1 H 1 1.46 0.02 . 1 . . . 10 ALA HB . c16368_2kko 1 93 . 1 1 10 10 ALA HB2 H 1 1.46 0.02 . 1 . . . 10 ALA HB . c16368_2kko 1 94 . 1 1 10 10 ALA HB3 H 1 1.46 0.02 . 1 . . . 10 ALA HB . c16368_2kko 1 95 . 1 1 10 10 ALA C C 13 180.5 0.2 . 1 . . . 10 ALA C . c16368_2kko 1 96 . 1 1 10 10 ALA CA C 13 54.6 0.2 . 1 . . . 10 ALA CA . c16368_2kko 1 97 . 1 1 10 10 ALA CB C 13 18.1 0.2 . 1 . . . 10 ALA CB . c16368_2kko 1 98 . 1 1 10 10 ALA N N 15 120.2 0.2 . 1 . . . 10 ALA N . c16368_2kko 1 99 . 1 1 11 11 LEU H H 1 8.08 0.02 . 1 . . . 11 LEU H . c16368_2kko 1 100 . 1 1 11 11 LEU HA H 1 4.12 0.02 . 1 . . . 11 LEU HA . c16368_2kko 1 101 . 1 1 11 11 LEU HB2 H 1 1.70 0.02 . 2 . . . 11 LEU HB2 . c16368_2kko 1 102 . 1 1 11 11 LEU HB3 H 1 1.88 0.02 . 2 . . . 11 LEU HB3 . c16368_2kko 1 103 . 1 1 11 11 LEU HD11 H 1 0.89 0.02 . 2 . . . 11 LEU HD1 . c16368_2kko 1 104 . 1 1 11 11 LEU HD12 H 1 0.89 0.02 . 2 . . . 11 LEU HD1 . c16368_2kko 1 105 . 1 1 11 11 LEU HD13 H 1 0.89 0.02 . 2 . . . 11 LEU HD1 . c16368_2kko 1 106 . 1 1 11 11 LEU HD21 H 1 0.93 0.02 . 2 . . . 11 LEU HD2 . c16368_2kko 1 107 . 1 1 11 11 LEU HD22 H 1 0.93 0.02 . 2 . . . 11 LEU HD2 . c16368_2kko 1 108 . 1 1 11 11 LEU HD23 H 1 0.93 0.02 . 2 . . . 11 LEU HD2 . c16368_2kko 1 109 . 1 1 11 11 LEU HG H 1 1.56 0.02 . 1 . . . 11 LEU HG . c16368_2kko 1 110 . 1 1 11 11 LEU C C 13 179.6 0.2 . 1 . . . 11 LEU C . c16368_2kko 1 111 . 1 1 11 11 LEU CA C 13 57.8 0.2 . 1 . . . 11 LEU CA . c16368_2kko 1 112 . 1 1 11 11 LEU CB C 13 41.7 0.2 . 1 . . . 11 LEU CB . c16368_2kko 1 113 . 1 1 11 11 LEU CD1 C 13 25.1 0.2 . 2 . . . 11 LEU CD1 . c16368_2kko 1 114 . 1 1 11 11 LEU CD2 C 13 24.1 0.2 . 2 . . . 11 LEU CD2 . c16368_2kko 1 115 . 1 1 11 11 LEU N N 15 120.9 0.2 . 1 . . . 11 LEU N . c16368_2kko 1 116 . 1 1 12 12 LEU H H 1 8.48 0.02 . 1 . . . 12 LEU H . c16368_2kko 1 117 . 1 1 12 12 LEU HA H 1 4.04 0.02 . 1 . . . 12 LEU HA . c16368_2kko 1 118 . 1 1 12 12 LEU HB2 H 1 1.53 0.02 . 2 . . . 12 LEU HB2 . c16368_2kko 1 119 . 1 1 12 12 LEU HB3 H 1 1.97 0.02 . 2 . . . 12 LEU HB3 . c16368_2kko 1 120 . 1 1 12 12 LEU HD11 H 1 0.86 0.02 . 1 . . . 12 LEU HD1 . c16368_2kko 1 121 . 1 1 12 12 LEU HD12 H 1 0.86 0.02 . 1 . . . 12 LEU HD1 . c16368_2kko 1 122 . 1 1 12 12 LEU HD13 H 1 0.86 0.02 . 1 . . . 12 LEU HD1 . c16368_2kko 1 123 . 1 1 12 12 LEU HD21 H 1 0.82 0.02 . 1 . . . 12 LEU HD2 . c16368_2kko 1 124 . 1 1 12 12 LEU HD22 H 1 0.82 0.02 . 1 . . . 12 LEU HD2 . c16368_2kko 1 125 . 1 1 12 12 LEU HD23 H 1 0.82 0.02 . 1 . . . 12 LEU HD2 . c16368_2kko 1 126 . 1 1 12 12 LEU HG H 1 1.92 0.02 . 1 . . . 12 LEU HG . c16368_2kko 1 127 . 1 1 12 12 LEU C C 13 178.9 0.2 . 1 . . . 12 LEU C . c16368_2kko 1 128 . 1 1 12 12 LEU CA C 13 58.1 0.2 . 1 . . . 12 LEU CA . c16368_2kko 1 129 . 1 1 12 12 LEU CB C 13 40.1 0.2 . 1 . . . 12 LEU CB . c16368_2kko 1 130 . 1 1 12 12 LEU CD1 C 13 25.2 0.2 . 1 . . . 12 LEU CD1 . c16368_2kko 1 131 . 1 1 12 12 LEU CD2 C 13 21.6 0.2 . 1 . . . 12 LEU CD2 . c16368_2kko 1 132 . 1 1 12 12 LEU CG C 13 26.9 0.2 . 1 . . . 12 LEU CG . c16368_2kko 1 133 . 1 1 12 12 LEU N N 15 118.7 0.2 . 1 . . . 12 LEU N . c16368_2kko 1 134 . 1 1 13 13 ASP H H 1 7.99 0.02 . 1 . . . 13 ASP H . c16368_2kko 1 135 . 1 1 13 13 ASP HA H 1 4.42 0.02 . 1 . . . 13 ASP HA . c16368_2kko 1 136 . 1 1 13 13 ASP HB2 H 1 2.64 0.02 . 2 . . . 13 ASP HB2 . c16368_2kko 1 137 . 1 1 13 13 ASP HB3 H 1 2.84 0.02 . 2 . . . 13 ASP HB3 . c16368_2kko 1 138 . 1 1 13 13 ASP C C 13 178.9 0.2 . 1 . . . 13 ASP C . c16368_2kko 1 139 . 1 1 13 13 ASP CA C 13 57.5 0.2 . 1 . . . 13 ASP CA . c16368_2kko 1 140 . 1 1 13 13 ASP CB C 13 40.5 0.2 . 1 . . . 13 ASP CB . c16368_2kko 1 141 . 1 1 13 13 ASP N N 15 119.5 0.2 . 1 . . . 13 ASP N . c16368_2kko 1 142 . 1 1 14 14 GLN H H 1 7.62 0.02 . 1 . . . 14 GLN H . c16368_2kko 1 143 . 1 1 14 14 GLN HA H 1 4.23 0.02 . 1 . . . 14 GLN HA . c16368_2kko 1 144 . 1 1 14 14 GLN HB2 H 1 2.37 0.02 . 2 . . . 14 GLN HB2 . c16368_2kko 1 145 . 1 1 14 14 GLN HB3 H 1 2.37 0.02 . 2 . . . 14 GLN HB3 . c16368_2kko 1 146 . 1 1 14 14 GLN HE21 H 1 7.39 0.02 . 1 . . . 14 GLN HE21 . c16368_2kko 1 147 . 1 1 14 14 GLN HE22 H 1 6.79 0.02 . 1 . . . 14 GLN HE22 . c16368_2kko 1 148 . 1 1 14 14 GLN HG2 H 1 2.34 0.02 . 2 . . . 14 GLN HG2 . c16368_2kko 1 149 . 1 1 14 14 GLN HG3 H 1 2.56 0.02 . 2 . . . 14 GLN HG3 . c16368_2kko 1 150 . 1 1 14 14 GLN C C 13 178.4 0.2 . 1 . . . 14 GLN C . c16368_2kko 1 151 . 1 1 14 14 GLN CA C 13 58.1 0.2 . 1 . . . 14 GLN CA . c16368_2kko 1 152 . 1 1 14 14 GLN CB C 13 27.8 0.2 . 1 . . . 14 GLN CB . c16368_2kko 1 153 . 1 1 14 14 GLN CG C 13 33.0 0.2 . 1 . . . 14 GLN CG . c16368_2kko 1 154 . 1 1 14 14 GLN N N 15 118.9 0.2 . 1 . . . 14 GLN N . c16368_2kko 1 155 . 1 1 14 14 GLN NE2 N 15 111.6 0.2 . 1 . . . 14 GLN NE2 . c16368_2kko 1 156 . 1 1 15 15 VAL H H 1 8.48 0.02 . 1 . . . 15 VAL H . c16368_2kko 1 157 . 1 1 15 15 VAL HA H 1 3.38 0.02 . 1 . . . 15 VAL HA . c16368_2kko 1 158 . 1 1 15 15 VAL HB H 1 2.32 0.02 . 1 . . . 15 VAL HB . c16368_2kko 1 159 . 1 1 15 15 VAL HG11 H 1 0.93 0.02 . 1 . . . 15 VAL HG1 . c16368_2kko 1 160 . 1 1 15 15 VAL HG12 H 1 0.93 0.02 . 1 . . . 15 VAL HG1 . c16368_2kko 1 161 . 1 1 15 15 VAL HG13 H 1 0.93 0.02 . 1 . . . 15 VAL HG1 . c16368_2kko 1 162 . 1 1 15 15 VAL HG21 H 1 1.01 0.02 . 1 . . . 15 VAL HG2 . c16368_2kko 1 163 . 1 1 15 15 VAL HG22 H 1 1.01 0.02 . 1 . . . 15 VAL HG2 . c16368_2kko 1 164 . 1 1 15 15 VAL HG23 H 1 1.01 0.02 . 1 . . . 15 VAL HG2 . c16368_2kko 1 165 . 1 1 15 15 VAL C C 13 177.6 0.2 . 1 . . . 15 VAL C . c16368_2kko 1 166 . 1 1 15 15 VAL CA C 13 66.6 0.2 . 1 . . . 15 VAL CA . c16368_2kko 1 167 . 1 1 15 15 VAL CB C 13 30.5 0.2 . 1 . . . 15 VAL CB . c16368_2kko 1 168 . 1 1 15 15 VAL CG1 C 13 24.0 0.2 . 1 . . . 15 VAL CG1 . c16368_2kko 1 169 . 1 1 15 15 VAL CG2 C 13 23.9 0.2 . 1 . . . 15 VAL CG2 . c16368_2kko 1 170 . 1 1 15 15 VAL N N 15 121.3 0.2 . 1 . . . 15 VAL N . c16368_2kko 1 171 . 1 1 16 16 ALA H H 1 8.08 0.02 . 1 . . . 16 ALA H . c16368_2kko 1 172 . 1 1 16 16 ALA HA H 1 4.45 0.02 . 1 . . . 16 ALA HA . c16368_2kko 1 173 . 1 1 16 16 ALA HB1 H 1 1.33 0.02 . 1 . . . 16 ALA HB . c16368_2kko 1 174 . 1 1 16 16 ALA HB2 H 1 1.33 0.02 . 1 . . . 16 ALA HB . c16368_2kko 1 175 . 1 1 16 16 ALA HB3 H 1 1.33 0.02 . 1 . . . 16 ALA HB . c16368_2kko 1 176 . 1 1 16 16 ALA C C 13 179.1 0.2 . 1 . . . 16 ALA C . c16368_2kko 1 177 . 1 1 16 16 ALA CA C 13 54.6 0.2 . 1 . . . 16 ALA CA . c16368_2kko 1 178 . 1 1 16 16 ALA CB C 13 17.7 0.2 . 1 . . . 16 ALA CB . c16368_2kko 1 179 . 1 1 16 16 ALA N N 15 121.4 0.2 . 1 . . . 16 ALA N . c16368_2kko 1 180 . 1 1 17 17 ARG H H 1 7.48 0.02 . 1 . . . 17 ARG H . c16368_2kko 1 181 . 1 1 17 17 ARG HA H 1 3.91 0.02 . 1 . . . 17 ARG HA . c16368_2kko 1 182 . 1 1 17 17 ARG HB2 H 1 2.12 0.02 . 2 . . . 17 ARG HB2 . c16368_2kko 1 183 . 1 1 17 17 ARG HB3 H 1 2.12 0.02 . 2 . . . 17 ARG HB3 . c16368_2kko 1 184 . 1 1 17 17 ARG HD2 H 1 3.27 0.02 . 2 . . . 17 ARG HD2 . c16368_2kko 1 185 . 1 1 17 17 ARG HD3 H 1 3.27 0.02 . 2 . . . 17 ARG HD3 . c16368_2kko 1 186 . 1 1 17 17 ARG HG2 H 1 1.63 0.02 . 2 . . . 17 ARG HG2 . c16368_2kko 1 187 . 1 1 17 17 ARG C C 13 179.7 0.2 . 1 . . . 17 ARG C . c16368_2kko 1 188 . 1 1 17 17 ARG CA C 13 59.7 0.2 . 1 . . . 17 ARG CA . c16368_2kko 1 189 . 1 1 17 17 ARG CB C 13 30.4 0.2 . 1 . . . 17 ARG CB . c16368_2kko 1 190 . 1 1 17 17 ARG CD C 13 44.0 0.2 . 1 . . . 17 ARG CD . c16368_2kko 1 191 . 1 1 17 17 ARG N N 15 116.9 0.2 . 1 . . . 17 ARG N . c16368_2kko 1 192 . 1 1 18 18 VAL H H 1 7.96 0.02 . 1 . . . 18 VAL H . c16368_2kko 1 193 . 1 1 18 18 VAL HA H 1 3.69 0.02 . 1 . . . 18 VAL HA . c16368_2kko 1 194 . 1 1 18 18 VAL HB H 1 2.39 0.02 . 1 . . . 18 VAL HB . c16368_2kko 1 195 . 1 1 18 18 VAL HG11 H 1 0.87 0.02 . 1 . . . 18 VAL HG1 . c16368_2kko 1 196 . 1 1 18 18 VAL HG12 H 1 0.87 0.02 . 1 . . . 18 VAL HG1 . c16368_2kko 1 197 . 1 1 18 18 VAL HG13 H 1 0.87 0.02 . 1 . . . 18 VAL HG1 . c16368_2kko 1 198 . 1 1 18 18 VAL HG21 H 1 1.17 0.02 . 1 . . . 18 VAL HG2 . c16368_2kko 1 199 . 1 1 18 18 VAL HG22 H 1 1.17 0.02 . 1 . . . 18 VAL HG2 . c16368_2kko 1 200 . 1 1 18 18 VAL HG23 H 1 1.17 0.02 . 1 . . . 18 VAL HG2 . c16368_2kko 1 201 . 1 1 18 18 VAL C C 13 177.9 0.2 . 1 . . . 18 VAL C . c16368_2kko 1 202 . 1 1 18 18 VAL CA C 13 66.6 0.2 . 1 . . . 18 VAL CA . c16368_2kko 1 203 . 1 1 18 18 VAL CB C 13 31.3 0.2 . 1 . . . 18 VAL CB . c16368_2kko 1 204 . 1 1 18 18 VAL CG1 C 13 22.1 0.2 . 1 . . . 18 VAL CG1 . c16368_2kko 1 205 . 1 1 18 18 VAL CG2 C 13 21.6 0.2 . 1 . . . 18 VAL CG2 . c16368_2kko 1 206 . 1 1 18 18 VAL N N 15 123.0 0.2 . 1 . . . 18 VAL N . c16368_2kko 1 207 . 1 1 19 19 GLY H H 1 8.27 0.02 . 1 . . . 19 GLY H . c16368_2kko 1 208 . 1 1 19 19 GLY HA2 H 1 3.43 0.02 . 2 . . . 19 GLY HA2 . c16368_2kko 1 209 . 1 1 19 19 GLY HA3 H 1 3.43 0.02 . 2 . . . 19 GLY HA3 . c16368_2kko 1 210 . 1 1 19 19 GLY C C 13 174.4 0.2 . 1 . . . 19 GLY C . c16368_2kko 1 211 . 1 1 19 19 GLY CA C 13 48.5 0.2 . 1 . . . 19 GLY CA . c16368_2kko 1 212 . 1 1 19 19 GLY N N 15 105.4 0.2 . 1 . . . 19 GLY N . c16368_2kko 1 213 . 1 1 20 20 LYS H H 1 8.25 0.02 . 1 . . . 20 LYS H . c16368_2kko 1 214 . 1 1 20 20 LYS HA H 1 3.71 0.02 . 1 . . . 20 LYS HA . c16368_2kko 1 215 . 1 1 20 20 LYS HB2 H 1 1.85 0.02 . 2 . . . 20 LYS HB2 . c16368_2kko 1 216 . 1 1 20 20 LYS HB3 H 1 1.85 0.02 . 2 . . . 20 LYS HB3 . c16368_2kko 1 217 . 1 1 20 20 LYS HD2 H 1 1.68 0.02 . 2 . . . 20 LYS HD2 . c16368_2kko 1 218 . 1 1 20 20 LYS HD3 H 1 1.68 0.02 . 2 . . . 20 LYS HD3 . c16368_2kko 1 219 . 1 1 20 20 LYS HE2 H 1 2.97 0.02 . 2 . . . 20 LYS HE2 . c16368_2kko 1 220 . 1 1 20 20 LYS HE3 H 1 2.97 0.02 . 2 . . . 20 LYS HE3 . c16368_2kko 1 221 . 1 1 20 20 LYS HG2 H 1 1.37 0.02 . 2 . . . 20 LYS HG2 . c16368_2kko 1 222 . 1 1 20 20 LYS HG3 H 1 1.55 0.02 . 2 . . . 20 LYS HG3 . c16368_2kko 1 223 . 1 1 20 20 LYS C C 13 179.4 0.2 . 1 . . . 20 LYS C . c16368_2kko 1 224 . 1 1 20 20 LYS CA C 13 59.3 0.2 . 1 . . . 20 LYS CA . c16368_2kko 1 225 . 1 1 20 20 LYS CB C 13 32.6 0.2 . 1 . . . 20 LYS CB . c16368_2kko 1 226 . 1 1 20 20 LYS CD C 13 29.4 0.2 . 1 . . . 20 LYS CD . c16368_2kko 1 227 . 1 1 20 20 LYS CE C 13 42.4 0.2 . 1 . . . 20 LYS CE . c16368_2kko 1 228 . 1 1 20 20 LYS CG C 13 25.7 0.2 . 1 . . . 20 LYS CG . c16368_2kko 1 229 . 1 1 20 20 LYS N N 15 118.7 0.2 . 1 . . . 20 LYS N . c16368_2kko 1 230 . 1 1 21 21 ALA H H 1 7.64 0.02 . 1 . . . 21 ALA H . c16368_2kko 1 231 . 1 1 21 21 ALA HA H 1 3.79 0.02 . 1 . . . 21 ALA HA . c16368_2kko 1 232 . 1 1 21 21 ALA HB1 H 1 1.57 0.02 . 1 . . . 21 ALA HB . c16368_2kko 1 233 . 1 1 21 21 ALA HB2 H 1 1.57 0.02 . 1 . . . 21 ALA HB . c16368_2kko 1 234 . 1 1 21 21 ALA HB3 H 1 1.57 0.02 . 1 . . . 21 ALA HB . c16368_2kko 1 235 . 1 1 21 21 ALA C C 13 177.9 0.2 . 1 . . . 21 ALA C . c16368_2kko 1 236 . 1 1 21 21 ALA CA C 13 55.2 0.2 . 1 . . . 21 ALA CA . c16368_2kko 1 237 . 1 1 21 21 ALA CB C 13 19.2 0.2 . 1 . . . 21 ALA CB . c16368_2kko 1 238 . 1 1 21 21 ALA N N 15 121.7 0.2 . 1 . . . 21 ALA N . c16368_2kko 1 239 . 1 1 22 22 LEU H H 1 7.33 0.02 . 1 . . . 22 LEU H . c16368_2kko 1 240 . 1 1 22 22 LEU HA H 1 4.14 0.02 . 1 . . . 22 LEU HA . c16368_2kko 1 241 . 1 1 22 22 LEU HB2 H 1 1.61 0.02 . 2 . . . 22 LEU HB2 . c16368_2kko 1 242 . 1 1 22 22 LEU HB3 H 1 1.93 0.02 . 2 . . . 22 LEU HB3 . c16368_2kko 1 243 . 1 1 22 22 LEU HD11 H 1 0.69 0.02 . 1 . . . 22 LEU HD1 . c16368_2kko 1 244 . 1 1 22 22 LEU HD12 H 1 0.69 0.02 . 1 . . . 22 LEU HD1 . c16368_2kko 1 245 . 1 1 22 22 LEU HD13 H 1 0.69 0.02 . 1 . . . 22 LEU HD1 . c16368_2kko 1 246 . 1 1 22 22 LEU HD21 H 1 0.63 0.02 . 1 . . . 22 LEU HD2 . c16368_2kko 1 247 . 1 1 22 22 LEU HD22 H 1 0.63 0.02 . 1 . . . 22 LEU HD2 . c16368_2kko 1 248 . 1 1 22 22 LEU HD23 H 1 0.63 0.02 . 1 . . . 22 LEU HD2 . c16368_2kko 1 249 . 1 1 22 22 LEU HG H 1 1.94 0.02 . 1 . . . 22 LEU HG . c16368_2kko 1 250 . 1 1 22 22 LEU C C 13 176.8 0.2 . 1 . . . 22 LEU C . c16368_2kko 1 251 . 1 1 22 22 LEU CA C 13 54.6 0.2 . 1 . . . 22 LEU CA . c16368_2kko 1 252 . 1 1 22 22 LEU CB C 13 42.9 0.2 . 1 . . . 22 LEU CB . c16368_2kko 1 253 . 1 1 22 22 LEU CD1 C 13 25.7 0.2 . 1 . . . 22 LEU CD1 . c16368_2kko 1 254 . 1 1 22 22 LEU CD2 C 13 22.7 0.2 . 1 . . . 22 LEU CD2 . c16368_2kko 1 255 . 1 1 22 22 LEU CG C 13 26.0 0.2 . 1 . . . 22 LEU CG . c16368_2kko 1 256 . 1 1 22 22 LEU N N 15 114.2 0.2 . 1 . . . 22 LEU N . c16368_2kko 1 257 . 1 1 23 23 ALA H H 1 7.16 0.02 . 1 . . . 23 ALA H . c16368_2kko 1 258 . 1 1 23 23 ALA HA H 1 4.72 0.02 . 1 . . . 23 ALA HA . c16368_2kko 1 259 . 1 1 23 23 ALA HB1 H 1 1.34 0.02 . 1 . . . 23 ALA HB . c16368_2kko 1 260 . 1 1 23 23 ALA HB2 H 1 1.34 0.02 . 1 . . . 23 ALA HB . c16368_2kko 1 261 . 1 1 23 23 ALA HB3 H 1 1.34 0.02 . 1 . . . 23 ALA HB . c16368_2kko 1 262 . 1 1 23 23 ALA C C 13 176.7 0.2 . 1 . . . 23 ALA C . c16368_2kko 1 263 . 1 1 23 23 ALA CA C 13 53.0 0.2 . 1 . . . 23 ALA CA . c16368_2kko 1 264 . 1 1 23 23 ALA CB C 13 18.2 0.2 . 1 . . . 23 ALA CB . c16368_2kko 1 265 . 1 1 23 23 ALA N N 15 118.2 0.2 . 1 . . . 23 ALA N . c16368_2kko 1 266 . 1 1 24 24 ASN H H 1 7.44 0.02 . 1 . . . 24 ASN H . c16368_2kko 1 267 . 1 1 24 24 ASN HA H 1 4.73 0.02 . 1 . . . 24 ASN HA . c16368_2kko 1 268 . 1 1 24 24 ASN HB2 H 1 2.32 0.02 . 2 . . . 24 ASN HB2 . c16368_2kko 1 269 . 1 1 24 24 ASN HB3 H 1 2.94 0.02 . 2 . . . 24 ASN HB3 . c16368_2kko 1 270 . 1 1 24 24 ASN HD21 H 1 7.85 0.02 . 1 . . . 24 ASN HD21 . c16368_2kko 1 271 . 1 1 24 24 ASN HD22 H 1 7.10 0.02 . 1 . . . 24 ASN HD22 . c16368_2kko 1 272 . 1 1 24 24 ASN C C 13 174.8 0.2 . 1 . . . 24 ASN C . c16368_2kko 1 273 . 1 1 24 24 ASN CA C 13 53.5 0.2 . 1 . . . 24 ASN CA . c16368_2kko 1 274 . 1 1 24 24 ASN CB C 13 41.7 0.2 . 1 . . . 24 ASN CB . c16368_2kko 1 275 . 1 1 24 24 ASN N N 15 116.8 0.2 . 1 . . . 24 ASN N . c16368_2kko 1 276 . 1 1 24 24 ASN ND2 N 15 113.6 0.2 . 1 . . . 24 ASN ND2 . c16368_2kko 1 277 . 1 1 25 25 GLY H H 1 9.37 0.02 . 1 . . . 25 GLY H . c16368_2kko 1 278 . 1 1 25 25 GLY HA2 H 1 3.65 0.02 . 2 . . . 25 GLY HA2 . c16368_2kko 1 279 . 1 1 25 25 GLY HA3 H 1 4.11 0.02 . 2 . . . 25 GLY HA3 . c16368_2kko 1 280 . 1 1 25 25 GLY C C 13 175.3 0.2 . 1 . . . 25 GLY C . c16368_2kko 1 281 . 1 1 25 25 GLY CA C 13 47.6 0.2 . 1 . . . 25 GLY CA . c16368_2kko 1 282 . 1 1 25 25 GLY N N 15 114.8 0.2 . 1 . . . 25 GLY N . c16368_2kko 1 283 . 1 1 26 26 ARG H H 1 8.05 0.02 . 1 . . . 26 ARG H . c16368_2kko 1 284 . 1 1 26 26 ARG HA H 1 4.15 0.02 . 1 . . . 26 ARG HA . c16368_2kko 1 285 . 1 1 26 26 ARG HB2 H 1 1.93 0.02 . 2 . . . 26 ARG HB2 . c16368_2kko 1 286 . 1 1 26 26 ARG HB3 H 1 1.93 0.02 . 2 . . . 26 ARG HB3 . c16368_2kko 1 287 . 1 1 26 26 ARG HG2 H 1 1.74 0.02 . 2 . . . 26 ARG HG2 . c16368_2kko 1 288 . 1 1 26 26 ARG HG3 H 1 1.74 0.02 . 2 . . . 26 ARG HG3 . c16368_2kko 1 289 . 1 1 26 26 ARG C C 13 179.3 0.2 . 1 . . . 26 ARG C . c16368_2kko 1 290 . 1 1 26 26 ARG CA C 13 57.0 0.2 . 1 . . . 26 ARG CA . c16368_2kko 1 291 . 1 1 26 26 ARG CB C 13 29.9 0.2 . 1 . . . 26 ARG CB . c16368_2kko 1 292 . 1 1 26 26 ARG CD C 13 43.1 0.2 . 1 . . . 26 ARG CD . c16368_2kko 1 293 . 1 1 26 26 ARG CG C 13 26.8 0.2 . 1 . . . 26 ARG CG . c16368_2kko 1 294 . 1 1 26 26 ARG N N 15 120.5 0.2 . 1 . . . 26 ARG N . c16368_2kko 1 295 . 1 1 27 27 ARG H H 1 7.93 0.02 . 1 . . . 27 ARG H . c16368_2kko 1 296 . 1 1 27 27 ARG HA H 1 3.71 0.02 . 1 . . . 27 ARG HA . c16368_2kko 1 297 . 1 1 27 27 ARG HB2 H 1 1.84 0.02 . 2 . . . 27 ARG HB2 . c16368_2kko 1 298 . 1 1 27 27 ARG HB3 H 1 2.08 0.02 . 2 . . . 27 ARG HB3 . c16368_2kko 1 299 . 1 1 27 27 ARG HD2 H 1 3.02 0.02 . 2 . . . 27 ARG HD2 . c16368_2kko 1 300 . 1 1 27 27 ARG HD3 H 1 3.53 0.02 . 2 . . . 27 ARG HD3 . c16368_2kko 1 301 . 1 1 27 27 ARG C C 13 178.3 0.2 . 1 . . . 27 ARG C . c16368_2kko 1 302 . 1 1 27 27 ARG CA C 13 61.0 0.2 . 1 . . . 27 ARG CA . c16368_2kko 1 303 . 1 1 27 27 ARG CB C 13 30.4 0.2 . 1 . . . 27 ARG CB . c16368_2kko 1 304 . 1 1 27 27 ARG CD C 13 45.2 0.2 . 1 . . . 27 ARG CD . c16368_2kko 1 305 . 1 1 27 27 ARG N N 15 117.9 0.2 . 1 . . . 27 ARG N . c16368_2kko 1 306 . 1 1 28 28 LEU H H 1 7.64 0.02 . 1 . . . 28 LEU H . c16368_2kko 1 307 . 1 1 28 28 LEU HA H 1 3.95 0.02 . 1 . . . 28 LEU HA . c16368_2kko 1 308 . 1 1 28 28 LEU HB2 H 1 1.51 0.02 . 2 . . . 28 LEU HB2 . c16368_2kko 1 309 . 1 1 28 28 LEU HB3 H 1 2.24 0.02 . 2 . . . 28 LEU HB3 . c16368_2kko 1 310 . 1 1 28 28 LEU HD11 H 1 1.07 0.02 . 1 . . . 28 LEU HD1 . c16368_2kko 1 311 . 1 1 28 28 LEU HD12 H 1 1.07 0.02 . 1 . . . 28 LEU HD1 . c16368_2kko 1 312 . 1 1 28 28 LEU HD13 H 1 1.07 0.02 . 1 . . . 28 LEU HD1 . c16368_2kko 1 313 . 1 1 28 28 LEU HD21 H 1 0.99 0.02 . 1 . . . 28 LEU HD2 . c16368_2kko 1 314 . 1 1 28 28 LEU HD22 H 1 0.99 0.02 . 1 . . . 28 LEU HD2 . c16368_2kko 1 315 . 1 1 28 28 LEU HD23 H 1 0.99 0.02 . 1 . . . 28 LEU HD2 . c16368_2kko 1 316 . 1 1 28 28 LEU HG H 1 2.07 0.02 . 1 . . . 28 LEU HG . c16368_2kko 1 317 . 1 1 28 28 LEU C C 13 178.2 0.2 . 1 . . . 28 LEU C . c16368_2kko 1 318 . 1 1 28 28 LEU CA C 13 57.6 0.2 . 1 . . . 28 LEU CA . c16368_2kko 1 319 . 1 1 28 28 LEU CB C 13 41.9 0.2 . 1 . . . 28 LEU CB . c16368_2kko 1 320 . 1 1 28 28 LEU CD1 C 13 27.6 0.2 . 1 . . . 28 LEU CD1 . c16368_2kko 1 321 . 1 1 28 28 LEU CD2 C 13 23.6 0.2 . 1 . . . 28 LEU CD2 . c16368_2kko 1 322 . 1 1 28 28 LEU CG C 13 26.5 0.2 . 1 . . . 28 LEU CG . c16368_2kko 1 323 . 1 1 28 28 LEU N N 15 117.6 0.2 . 1 . . . 28 LEU N . c16368_2kko 1 324 . 1 1 29 29 GLN H H 1 8.11 0.02 . 1 . . . 29 GLN H . c16368_2kko 1 325 . 1 1 29 29 GLN HA H 1 3.88 0.02 . 1 . . . 29 GLN HA . c16368_2kko 1 326 . 1 1 29 29 GLN HB2 H 1 2.14 0.02 . 2 . . . 29 GLN HB2 . c16368_2kko 1 327 . 1 1 29 29 GLN HB3 H 1 2.26 0.02 . 2 . . . 29 GLN HB3 . c16368_2kko 1 328 . 1 1 29 29 GLN HE21 H 1 7.68 0.02 . 1 . . . 29 GLN HE21 . c16368_2kko 1 329 . 1 1 29 29 GLN HE22 H 1 6.86 0.02 . 1 . . . 29 GLN HE22 . c16368_2kko 1 330 . 1 1 29 29 GLN HG2 H 1 2.58 0.02 . 2 . . . 29 GLN HG2 . c16368_2kko 1 331 . 1 1 29 29 GLN HG3 H 1 2.25 0.02 . 2 . . . 29 GLN HG3 . c16368_2kko 1 332 . 1 1 29 29 GLN C C 13 179.4 0.2 . 1 . . . 29 GLN C . c16368_2kko 1 333 . 1 1 29 29 GLN CA C 13 59.1 0.2 . 1 . . . 29 GLN CA . c16368_2kko 1 334 . 1 1 29 29 GLN CB C 13 28.8 0.2 . 1 . . . 29 GLN CB . c16368_2kko 1 335 . 1 1 29 29 GLN CG C 13 34.4 0.2 . 1 . . . 29 GLN CG . c16368_2kko 1 336 . 1 1 29 29 GLN N N 15 119.3 0.2 . 1 . . . 29 GLN N . c16368_2kko 1 337 . 1 1 29 29 GLN NE2 N 15 110.7 0.2 . 1 . . . 29 GLN NE2 . c16368_2kko 1 338 . 1 1 30 30 ILE H H 1 7.53 0.02 . 1 . . . 30 ILE H . c16368_2kko 1 339 . 1 1 30 30 ILE HA H 1 3.34 0.02 . 1 . . . 30 ILE HA . c16368_2kko 1 340 . 1 1 30 30 ILE HB H 1 1.89 0.02 . 1 . . . 30 ILE HB . c16368_2kko 1 341 . 1 1 30 30 ILE HD11 H 1 0.66 0.02 . 1 . . . 30 ILE HD1 . c16368_2kko 1 342 . 1 1 30 30 ILE HD12 H 1 0.66 0.02 . 1 . . . 30 ILE HD1 . c16368_2kko 1 343 . 1 1 30 30 ILE HD13 H 1 0.66 0.02 . 1 . . . 30 ILE HD1 . c16368_2kko 1 344 . 1 1 30 30 ILE HG12 H 1 0.60 0.02 . 2 . . . 30 ILE HG12 . c16368_2kko 1 345 . 1 1 30 30 ILE HG13 H 1 1.93 0.02 . 2 . . . 30 ILE HG13 . c16368_2kko 1 346 . 1 1 30 30 ILE HG21 H 1 0.58 0.02 . 1 . . . 30 ILE HG2 . c16368_2kko 1 347 . 1 1 30 30 ILE HG22 H 1 0.58 0.02 . 1 . . . 30 ILE HG2 . c16368_2kko 1 348 . 1 1 30 30 ILE HG23 H 1 0.58 0.02 . 1 . . . 30 ILE HG2 . c16368_2kko 1 349 . 1 1 30 30 ILE C C 13 176.7 0.2 . 1 . . . 30 ILE C . c16368_2kko 1 350 . 1 1 30 30 ILE CA C 13 65.9 0.2 . 1 . . . 30 ILE CA . c16368_2kko 1 351 . 1 1 30 30 ILE CB C 13 37.4 0.2 . 1 . . . 30 ILE CB . c16368_2kko 1 352 . 1 1 30 30 ILE CD1 C 13 14.4 0.2 . 1 . . . 30 ILE CD1 . c16368_2kko 1 353 . 1 1 30 30 ILE CG1 C 13 29.3 0.2 . 1 . . . 30 ILE CG1 . c16368_2kko 1 354 . 1 1 30 30 ILE CG2 C 13 18.0 0.2 . 1 . . . 30 ILE CG2 . c16368_2kko 1 355 . 1 1 30 30 ILE N N 15 118.6 0.2 . 1 . . . 30 ILE N . c16368_2kko 1 356 . 1 1 31 31 LEU H H 1 7.50 0.02 . 1 . . . 31 LEU H . c16368_2kko 1 357 . 1 1 31 31 LEU HA H 1 3.52 0.02 . 1 . . . 31 LEU HA . c16368_2kko 1 358 . 1 1 31 31 LEU HB2 H 1 0.62 0.02 . 2 . . . 31 LEU HB2 . c16368_2kko 1 359 . 1 1 31 31 LEU HB3 H 1 1.23 0.02 . 2 . . . 31 LEU HB3 . c16368_2kko 1 360 . 1 1 31 31 LEU HD11 H 1 0.49 0.02 . 2 . . . 31 LEU HD1 . c16368_2kko 1 361 . 1 1 31 31 LEU HD12 H 1 0.49 0.02 . 2 . . . 31 LEU HD1 . c16368_2kko 1 362 . 1 1 31 31 LEU HD13 H 1 0.49 0.02 . 2 . . . 31 LEU HD1 . c16368_2kko 1 363 . 1 1 31 31 LEU HD21 H 1 0.36 0.02 . 2 . . . 31 LEU HD2 . c16368_2kko 1 364 . 1 1 31 31 LEU HD22 H 1 0.36 0.02 . 2 . . . 31 LEU HD2 . c16368_2kko 1 365 . 1 1 31 31 LEU HD23 H 1 0.36 0.02 . 2 . . . 31 LEU HD2 . c16368_2kko 1 366 . 1 1 31 31 LEU HG H 1 1.26 0.02 . 1 . . . 31 LEU HG . c16368_2kko 1 367 . 1 1 31 31 LEU C C 13 177.3 0.2 . 1 . . . 31 LEU C . c16368_2kko 1 368 . 1 1 31 31 LEU CA C 13 58.1 0.2 . 1 . . . 31 LEU CA . c16368_2kko 1 369 . 1 1 31 31 LEU CB C 13 41.1 0.2 . 1 . . . 31 LEU CB . c16368_2kko 1 370 . 1 1 31 31 LEU CD1 C 13 25.3 0.2 . 1 . . . 31 LEU CD1 . c16368_2kko 1 371 . 1 1 31 31 LEU CD2 C 13 23.9 0.2 . 1 . . . 31 LEU CD2 . c16368_2kko 1 372 . 1 1 31 31 LEU CG C 13 26.2 0.2 . 1 . . . 31 LEU CG . c16368_2kko 1 373 . 1 1 31 31 LEU N N 15 119.9 0.2 . 1 . . . 31 LEU N . c16368_2kko 1 374 . 1 1 32 32 ASP H H 1 7.95 0.02 . 1 . . . 32 ASP H . c16368_2kko 1 375 . 1 1 32 32 ASP HA H 1 4.30 0.02 . 1 . . . 32 ASP HA . c16368_2kko 1 376 . 1 1 32 32 ASP HB2 H 1 2.73 0.02 . 1 . . . 32 ASP HB2 . c16368_2kko 1 377 . 1 1 32 32 ASP HB3 H 1 2.73 0.02 . 1 . . . 32 ASP HB3 . c16368_2kko 1 378 . 1 1 32 32 ASP C C 13 178.3 0.2 . 1 . . . 32 ASP C . c16368_2kko 1 379 . 1 1 32 32 ASP CA C 13 57.4 0.2 . 1 . . . 32 ASP CA . c16368_2kko 1 380 . 1 1 32 32 ASP CB C 13 42.4 0.2 . 1 . . . 32 ASP CB . c16368_2kko 1 381 . 1 1 32 32 ASP N N 15 116.9 0.2 . 1 . . . 32 ASP N . c16368_2kko 1 382 . 1 1 33 33 LEU H H 1 7.35 0.02 . 1 . . . 33 LEU H . c16368_2kko 1 383 . 1 1 33 33 LEU HA H 1 4.13 0.02 . 1 . . . 33 LEU HA . c16368_2kko 1 384 . 1 1 33 33 LEU HB2 H 1 1.69 0.02 . 2 . . . 33 LEU HB2 . c16368_2kko 1 385 . 1 1 33 33 LEU HB3 H 1 1.74 0.02 . 2 . . . 33 LEU HB3 . c16368_2kko 1 386 . 1 1 33 33 LEU HD11 H 1 0.83 0.02 . 2 . . . 33 LEU HD1 . c16368_2kko 1 387 . 1 1 33 33 LEU HD12 H 1 0.83 0.02 . 2 . . . 33 LEU HD1 . c16368_2kko 1 388 . 1 1 33 33 LEU HD13 H 1 0.83 0.02 . 2 . . . 33 LEU HD1 . c16368_2kko 1 389 . 1 1 33 33 LEU HD21 H 1 0.85 0.02 . 2 . . . 33 LEU HD2 . c16368_2kko 1 390 . 1 1 33 33 LEU HD22 H 1 0.85 0.02 . 2 . . . 33 LEU HD2 . c16368_2kko 1 391 . 1 1 33 33 LEU HD23 H 1 0.85 0.02 . 2 . . . 33 LEU HD2 . c16368_2kko 1 392 . 1 1 33 33 LEU HG H 1 1.59 0.02 . 1 . . . 33 LEU HG . c16368_2kko 1 393 . 1 1 33 33 LEU C C 13 180.0 0.2 . 1 . . . 33 LEU C . c16368_2kko 1 394 . 1 1 33 33 LEU CA C 13 57.6 0.2 . 1 . . . 33 LEU CA . c16368_2kko 1 395 . 1 1 33 33 LEU CB C 13 42.3 0.2 . 1 . . . 33 LEU CB . c16368_2kko 1 396 . 1 1 33 33 LEU CD1 C 13 27.0 0.2 . 2 . . . 33 LEU CD1 . c16368_2kko 1 397 . 1 1 33 33 LEU CD2 C 13 24.6 0.2 . 2 . . . 33 LEU CD2 . c16368_2kko 1 398 . 1 1 33 33 LEU CG C 13 27.0 0.2 . 1 . . . 33 LEU CG . c16368_2kko 1 399 . 1 1 33 33 LEU N N 15 118.6 0.2 . 1 . . . 33 LEU N . c16368_2kko 1 400 . 1 1 34 34 LEU H H 1 8.30 0.02 . 1 . . . 34 LEU H . c16368_2kko 1 401 . 1 1 34 34 LEU HA H 1 4.49 0.02 . 1 . . . 34 LEU HA . c16368_2kko 1 402 . 1 1 34 34 LEU HB2 H 1 1.34 0.02 . 2 . . . 34 LEU HB2 . c16368_2kko 1 403 . 1 1 34 34 LEU HB3 H 1 1.69 0.02 . 2 . . . 34 LEU HB3 . c16368_2kko 1 404 . 1 1 34 34 LEU HD11 H 1 0.53 0.02 . 1 . . . 34 LEU HD1 . c16368_2kko 1 405 . 1 1 34 34 LEU HD12 H 1 0.53 0.02 . 1 . . . 34 LEU HD1 . c16368_2kko 1 406 . 1 1 34 34 LEU HD13 H 1 0.53 0.02 . 1 . . . 34 LEU HD1 . c16368_2kko 1 407 . 1 1 34 34 LEU HD21 H 1 0.86 0.02 . 1 . . . 34 LEU HD2 . c16368_2kko 1 408 . 1 1 34 34 LEU HD22 H 1 0.86 0.02 . 1 . . . 34 LEU HD2 . c16368_2kko 1 409 . 1 1 34 34 LEU HD23 H 1 0.86 0.02 . 1 . . . 34 LEU HD2 . c16368_2kko 1 410 . 1 1 34 34 LEU HG H 1 1.84 0.02 . 1 . . . 34 LEU HG . c16368_2kko 1 411 . 1 1 34 34 LEU C C 13 178.9 0.2 . 1 . . . 34 LEU C . c16368_2kko 1 412 . 1 1 34 34 LEU CA C 13 55.8 0.2 . 1 . . . 34 LEU CA . c16368_2kko 1 413 . 1 1 34 34 LEU CB C 13 41.3 0.2 . 1 . . . 34 LEU CB . c16368_2kko 1 414 . 1 1 34 34 LEU CD1 C 13 26.8 0.2 . 1 . . . 34 LEU CD1 . c16368_2kko 1 415 . 1 1 34 34 LEU CD2 C 13 22.4 0.2 . 1 . . . 34 LEU CD2 . c16368_2kko 1 416 . 1 1 34 34 LEU CG C 13 26.3 0.2 . 1 . . . 34 LEU CG . c16368_2kko 1 417 . 1 1 34 34 LEU N N 15 117.8 0.2 . 1 . . . 34 LEU N . c16368_2kko 1 418 . 1 1 35 35 ALA H H 1 8.16 0.02 . 1 . . . 35 ALA H . c16368_2kko 1 419 . 1 1 35 35 ALA HA H 1 4.05 0.02 . 1 . . . 35 ALA HA . c16368_2kko 1 420 . 1 1 35 35 ALA HB1 H 1 1.56 0.02 . 1 . . . 35 ALA HB . c16368_2kko 1 421 . 1 1 35 35 ALA HB2 H 1 1.56 0.02 . 1 . . . 35 ALA HB . c16368_2kko 1 422 . 1 1 35 35 ALA HB3 H 1 1.56 0.02 . 1 . . . 35 ALA HB . c16368_2kko 1 423 . 1 1 35 35 ALA C C 13 179.0 0.2 . 1 . . . 35 ALA C . c16368_2kko 1 424 . 1 1 35 35 ALA CA C 13 54.9 0.2 . 1 . . . 35 ALA CA . c16368_2kko 1 425 . 1 1 35 35 ALA CB C 13 17.5 0.2 . 1 . . . 35 ALA CB . c16368_2kko 1 426 . 1 1 35 35 ALA N N 15 123.9 0.2 . 1 . . . 35 ALA N . c16368_2kko 1 427 . 1 1 36 36 GLN H H 1 7.60 0.02 . 1 . . . 36 GLN H . c16368_2kko 1 428 . 1 1 36 36 GLN HA H 1 4.34 0.02 . 1 . . . 36 GLN HA . c16368_2kko 1 429 . 1 1 36 36 GLN HB2 H 1 2.13 0.02 . 2 . . . 36 GLN HB2 . c16368_2kko 1 430 . 1 1 36 36 GLN HB3 H 1 2.38 0.02 . 2 . . . 36 GLN HB3 . c16368_2kko 1 431 . 1 1 36 36 GLN HE21 H 1 7.52 0.02 . 1 . . . 36 GLN HE21 . c16368_2kko 1 432 . 1 1 36 36 GLN HE22 H 1 6.88 0.02 . 1 . . . 36 GLN HE22 . c16368_2kko 1 433 . 1 1 36 36 GLN HG2 H 1 2.41 0.02 . 2 . . . 36 GLN HG2 . c16368_2kko 1 434 . 1 1 36 36 GLN HG3 H 1 2.50 0.02 . 2 . . . 36 GLN HG3 . c16368_2kko 1 435 . 1 1 36 36 GLN C C 13 176.1 0.2 . 1 . . . 36 GLN C . c16368_2kko 1 436 . 1 1 36 36 GLN CA C 13 55.8 0.2 . 1 . . . 36 GLN CA . c16368_2kko 1 437 . 1 1 36 36 GLN CB C 13 29.0 0.2 . 1 . . . 36 GLN CB . c16368_2kko 1 438 . 1 1 36 36 GLN CG C 13 34.0 0.2 . 1 . . . 36 GLN CG . c16368_2kko 1 439 . 1 1 36 36 GLN N N 15 113.3 0.2 . 1 . . . 36 GLN N . c16368_2kko 1 440 . 1 1 36 36 GLN NE2 N 15 112.8 0.2 . 1 . . . 36 GLN NE2 . c16368_2kko 1 441 . 1 1 37 37 GLY H H 1 7.55 0.02 . 1 . . . 37 GLY H . c16368_2kko 1 442 . 1 1 37 37 GLY HA2 H 1 3.73 0.02 . 2 . . . 37 GLY HA2 . c16368_2kko 1 443 . 1 1 37 37 GLY HA3 H 1 4.49 0.02 . 2 . . . 37 GLY HA3 . c16368_2kko 1 444 . 1 1 37 37 GLY C C 13 171.5 0.2 . 1 . . . 37 GLY C . c16368_2kko 1 445 . 1 1 37 37 GLY CA C 13 44.5 0.2 . 1 . . . 37 GLY CA . c16368_2kko 1 446 . 1 1 37 37 GLY N N 15 108.4 0.2 . 1 . . . 37 GLY N . c16368_2kko 1 447 . 1 1 38 38 GLU H H 1 8.12 0.02 . 1 . . . 38 GLU H . c16368_2kko 1 448 . 1 1 38 38 GLU HA H 1 4.82 0.02 . 1 . . . 38 GLU HA . c16368_2kko 1 449 . 1 1 38 38 GLU HB2 H 1 1.91 0.02 . 2 . . . 38 GLU HB2 . c16368_2kko 1 450 . 1 1 38 38 GLU HB3 H 1 1.91 0.02 . 2 . . . 38 GLU HB3 . c16368_2kko 1 451 . 1 1 38 38 GLU HG2 H 1 2.12 0.02 . 2 . . . 38 GLU HG2 . c16368_2kko 1 452 . 1 1 38 38 GLU HG3 H 1 2.12 0.02 . 2 . . . 38 GLU HG3 . c16368_2kko 1 453 . 1 1 38 38 GLU C C 13 177.0 0.2 . 1 . . . 38 GLU C . c16368_2kko 1 454 . 1 1 38 38 GLU CA C 13 56.4 0.2 . 1 . . . 38 GLU CA . c16368_2kko 1 455 . 1 1 38 38 GLU CB C 13 31.2 0.2 . 1 . . . 38 GLU CB . c16368_2kko 1 456 . 1 1 38 38 GLU CG C 13 36.8 0.2 . 1 . . . 38 GLU CG . c16368_2kko 1 457 . 1 1 38 38 GLU N N 15 119.6 0.2 . 1 . . . 38 GLU N . c16368_2kko 1 458 . 1 1 39 39 ARG H H 1 8.58 0.02 . 1 . . . 39 ARG H . c16368_2kko 1 459 . 1 1 39 39 ARG HA H 1 4.97 0.02 . 1 . . . 39 ARG HA . c16368_2kko 1 460 . 1 1 39 39 ARG HB2 H 1 1.61 0.02 . 2 . . . 39 ARG HB2 . c16368_2kko 1 461 . 1 1 39 39 ARG HB3 H 1 1.86 0.02 . 2 . . . 39 ARG HB3 . c16368_2kko 1 462 . 1 1 39 39 ARG HD2 H 1 3.27 0.02 . 2 . . . 39 ARG HD2 . c16368_2kko 1 463 . 1 1 39 39 ARG HD3 H 1 2.99 0.02 . 2 . . . 39 ARG HD3 . c16368_2kko 1 464 . 1 1 39 39 ARG HE H 1 7.26 0.02 . 1 . . . 39 ARG HE . c16368_2kko 1 465 . 1 1 39 39 ARG HG2 H 1 1.52 0.02 . 2 . . . 39 ARG HG2 . c16368_2kko 1 466 . 1 1 39 39 ARG HG3 H 1 1.88 0.02 . 2 . . . 39 ARG HG3 . c16368_2kko 1 467 . 1 1 39 39 ARG C C 13 174.8 0.2 . 1 . . . 39 ARG C . c16368_2kko 1 468 . 1 1 39 39 ARG CA C 13 53.9 0.2 . 1 . . . 39 ARG CA . c16368_2kko 1 469 . 1 1 39 39 ARG CB C 13 36.4 0.2 . 1 . . . 39 ARG CB . c16368_2kko 1 470 . 1 1 39 39 ARG CD C 13 43.2 0.2 . 1 . . . 39 ARG CD . c16368_2kko 1 471 . 1 1 39 39 ARG CG C 13 27.2 0.2 . 1 . . . 39 ARG CG . c16368_2kko 1 472 . 1 1 39 39 ARG N N 15 121.5 0.2 . 1 . . . 39 ARG N . c16368_2kko 1 473 . 1 1 39 39 ARG NE N 15 84.4 0.2 . 1 . . . 39 ARG NE . c16368_2kko 1 474 . 1 1 40 40 ALA H H 1 8.91 0.02 . 1 . . . 40 ALA H . c16368_2kko 1 475 . 1 1 40 40 ALA HA H 1 4.92 0.02 . 1 . . . 40 ALA HA . c16368_2kko 1 476 . 1 1 40 40 ALA HB1 H 1 1.28 0.02 . 1 . . . 40 ALA HB . c16368_2kko 1 477 . 1 1 40 40 ALA HB2 H 1 1.28 0.02 . 1 . . . 40 ALA HB . c16368_2kko 1 478 . 1 1 40 40 ALA HB3 H 1 1.28 0.02 . 1 . . . 40 ALA HB . c16368_2kko 1 479 . 1 1 40 40 ALA C C 13 179.2 0.2 . 1 . . . 40 ALA C . c16368_2kko 1 480 . 1 1 40 40 ALA CA C 13 51.1 0.2 . 1 . . . 40 ALA CA . c16368_2kko 1 481 . 1 1 40 40 ALA CB C 13 19.2 0.2 . 1 . . . 40 ALA CB . c16368_2kko 1 482 . 1 1 40 40 ALA N N 15 125.1 0.2 . 1 . . . 40 ALA N . c16368_2kko 1 483 . 1 1 41 41 VAL H H 1 8.42 0.02 . 1 . . . 41 VAL H . c16368_2kko 1 484 . 1 1 41 41 VAL HA H 1 3.43 0.02 . 1 . . . 41 VAL HA . c16368_2kko 1 485 . 1 1 41 41 VAL HB H 1 2.11 0.02 . 1 . . . 41 VAL HB . c16368_2kko 1 486 . 1 1 41 41 VAL HG11 H 1 0.91 0.02 . 1 . . . 41 VAL HG1 . c16368_2kko 1 487 . 1 1 41 41 VAL HG12 H 1 0.91 0.02 . 1 . . . 41 VAL HG1 . c16368_2kko 1 488 . 1 1 41 41 VAL HG13 H 1 0.91 0.02 . 1 . . . 41 VAL HG1 . c16368_2kko 1 489 . 1 1 41 41 VAL HG21 H 1 1.09 0.02 . 1 . . . 41 VAL HG2 . c16368_2kko 1 490 . 1 1 41 41 VAL HG22 H 1 1.09 0.02 . 1 . . . 41 VAL HG2 . c16368_2kko 1 491 . 1 1 41 41 VAL HG23 H 1 1.09 0.02 . 1 . . . 41 VAL HG2 . c16368_2kko 1 492 . 1 1 41 41 VAL C C 13 176.8 0.2 . 1 . . . 41 VAL C . c16368_2kko 1 493 . 1 1 41 41 VAL CA C 13 67.6 0.2 . 1 . . . 41 VAL CA . c16368_2kko 1 494 . 1 1 41 41 VAL CB C 13 31.6 0.2 . 1 . . . 41 VAL CB . c16368_2kko 1 495 . 1 1 41 41 VAL CG1 C 13 20.6 0.2 . 1 . . . 41 VAL CG1 . c16368_2kko 1 496 . 1 1 41 41 VAL CG2 C 13 23.1 0.2 . 1 . . . 41 VAL CG2 . c16368_2kko 1 497 . 1 1 41 41 VAL N N 15 120.9 0.2 . 1 . . . 41 VAL N . c16368_2kko 1 498 . 1 1 42 42 GLU H H 1 9.64 0.02 . 1 . . . 42 GLU H . c16368_2kko 1 499 . 1 1 42 42 GLU HA H 1 3.88 0.02 . 1 . . . 42 GLU HA . c16368_2kko 1 500 . 1 1 42 42 GLU HB2 H 1 2.01 0.02 . 2 . . . 42 GLU HB2 . c16368_2kko 1 501 . 1 1 42 42 GLU HB3 H 1 2.01 0.02 . 2 . . . 42 GLU HB3 . c16368_2kko 1 502 . 1 1 42 42 GLU HG2 H 1 2.27 0.02 . 2 . . . 42 GLU HG2 . c16368_2kko 1 503 . 1 1 42 42 GLU HG3 H 1 2.48 0.02 . 2 . . . 42 GLU HG3 . c16368_2kko 1 504 . 1 1 42 42 GLU C C 13 178.3 0.2 . 1 . . . 42 GLU C . c16368_2kko 1 505 . 1 1 42 42 GLU CA C 13 60.6 0.2 . 1 . . . 42 GLU CA . c16368_2kko 1 506 . 1 1 42 42 GLU CB C 13 28.3 0.2 . 1 . . . 42 GLU CB . c16368_2kko 1 507 . 1 1 42 42 GLU CG C 13 37.0 0.2 . 1 . . . 42 GLU CG . c16368_2kko 1 508 . 1 1 42 42 GLU N N 15 119.0 0.2 . 1 . . . 42 GLU N . c16368_2kko 1 509 . 1 1 43 43 ALA H H 1 6.87 0.02 . 1 . . . 43 ALA H . c16368_2kko 1 510 . 1 1 43 43 ALA HA H 1 4.29 0.02 . 1 . . . 43 ALA HA . c16368_2kko 1 511 . 1 1 43 43 ALA HB1 H 1 1.65 0.02 . 1 . . . 43 ALA HB . c16368_2kko 1 512 . 1 1 43 43 ALA HB2 H 1 1.65 0.02 . 1 . . . 43 ALA HB . c16368_2kko 1 513 . 1 1 43 43 ALA HB3 H 1 1.65 0.02 . 1 . . . 43 ALA HB . c16368_2kko 1 514 . 1 1 43 43 ALA C C 13 180.7 0.2 . 1 . . . 43 ALA C . c16368_2kko 1 515 . 1 1 43 43 ALA CA C 13 54.1 0.2 . 1 . . . 43 ALA CA . c16368_2kko 1 516 . 1 1 43 43 ALA CB C 13 19.1 0.2 . 1 . . . 43 ALA CB . c16368_2kko 1 517 . 1 1 43 43 ALA N N 15 120.5 0.2 . 1 . . . 43 ALA N . c16368_2kko 1 518 . 1 1 44 44 ILE H H 1 7.97 0.02 . 1 . . . 44 ILE H . c16368_2kko 1 519 . 1 1 44 44 ILE HA H 1 3.47 0.02 . 1 . . . 44 ILE HA . c16368_2kko 1 520 . 1 1 44 44 ILE HB H 1 2.05 0.02 . 1 . . . 44 ILE HB . c16368_2kko 1 521 . 1 1 44 44 ILE HD11 H 1 0.80 0.02 . 1 . . . 44 ILE HD1 . c16368_2kko 1 522 . 1 1 44 44 ILE HD12 H 1 0.80 0.02 . 1 . . . 44 ILE HD1 . c16368_2kko 1 523 . 1 1 44 44 ILE HD13 H 1 0.80 0.02 . 1 . . . 44 ILE HD1 . c16368_2kko 1 524 . 1 1 44 44 ILE HG12 H 1 0.76 0.02 . 2 . . . 44 ILE HG12 . c16368_2kko 1 525 . 1 1 44 44 ILE HG13 H 1 1.78 0.02 . 2 . . . 44 ILE HG13 . c16368_2kko 1 526 . 1 1 44 44 ILE HG21 H 1 0.71 0.02 . 1 . . . 44 ILE HG2 . c16368_2kko 1 527 . 1 1 44 44 ILE HG22 H 1 0.71 0.02 . 1 . . . 44 ILE HG2 . c16368_2kko 1 528 . 1 1 44 44 ILE HG23 H 1 0.71 0.02 . 1 . . . 44 ILE HG2 . c16368_2kko 1 529 . 1 1 44 44 ILE C C 13 178.3 0.2 . 1 . . . 44 ILE C . c16368_2kko 1 530 . 1 1 44 44 ILE CA C 13 64.7 0.2 . 1 . . . 44 ILE CA . c16368_2kko 1 531 . 1 1 44 44 ILE CB C 13 38.1 0.2 . 1 . . . 44 ILE CB . c16368_2kko 1 532 . 1 1 44 44 ILE CD1 C 13 14.7 0.2 . 1 . . . 44 ILE CD1 . c16368_2kko 1 533 . 1 1 44 44 ILE CG1 C 13 29.1 0.2 . 1 . . . 44 ILE CG1 . c16368_2kko 1 534 . 1 1 44 44 ILE CG2 C 13 17.7 0.2 . 1 . . . 44 ILE CG2 . c16368_2kko 1 535 . 1 1 44 44 ILE N N 15 120.5 0.2 . 1 . . . 44 ILE N . c16368_2kko 1 536 . 1 1 45 45 ALA H H 1 8.46 0.02 . 1 . . . 45 ALA H . c16368_2kko 1 537 . 1 1 45 45 ALA HA H 1 3.72 0.02 . 1 . . . 45 ALA HA . c16368_2kko 1 538 . 1 1 45 45 ALA HB1 H 1 1.40 0.02 . 1 . . . 45 ALA HB . c16368_2kko 1 539 . 1 1 45 45 ALA HB2 H 1 1.40 0.02 . 1 . . . 45 ALA HB . c16368_2kko 1 540 . 1 1 45 45 ALA HB3 H 1 1.40 0.02 . 1 . . . 45 ALA HB . c16368_2kko 1 541 . 1 1 45 45 ALA C C 13 178.5 0.2 . 1 . . . 45 ALA C . c16368_2kko 1 542 . 1 1 45 45 ALA CA C 13 56.2 0.2 . 1 . . . 45 ALA CA . c16368_2kko 1 543 . 1 1 45 45 ALA CB C 13 17.4 0.2 . 1 . . . 45 ALA CB . c16368_2kko 1 544 . 1 1 45 45 ALA N N 15 124.5 0.2 . 1 . . . 45 ALA N . c16368_2kko 1 545 . 1 1 46 46 THR H H 1 8.08 0.02 . 1 . . . 46 THR H . c16368_2kko 1 546 . 1 1 46 46 THR HA H 1 3.90 0.02 . 1 . . . 46 THR HA . c16368_2kko 1 547 . 1 1 46 46 THR HB H 1 4.13 0.02 . 1 . . . 46 THR HB . c16368_2kko 1 548 . 1 1 46 46 THR HG21 H 1 1.25 0.02 . 1 . . . 46 THR HG2 . c16368_2kko 1 549 . 1 1 46 46 THR HG22 H 1 1.25 0.02 . 1 . . . 46 THR HG2 . c16368_2kko 1 550 . 1 1 46 46 THR HG23 H 1 1.25 0.02 . 1 . . . 46 THR HG2 . c16368_2kko 1 551 . 1 1 46 46 THR C C 13 177.2 0.2 . 1 . . . 46 THR C . c16368_2kko 1 552 . 1 1 46 46 THR CA C 13 66.4 0.2 . 1 . . . 46 THR CA . c16368_2kko 1 553 . 1 1 46 46 THR CB C 13 68.8 0.2 . 1 . . . 46 THR CB . c16368_2kko 1 554 . 1 1 46 46 THR CG2 C 13 21.7 0.2 . 1 . . . 46 THR CG2 . c16368_2kko 1 555 . 1 1 46 46 THR N N 15 112.4 0.2 . 1 . . . 46 THR N . c16368_2kko 1 556 . 1 1 47 47 ALA H H 1 7.93 0.02 . 1 . . . 47 ALA H . c16368_2kko 1 557 . 1 1 47 47 ALA HA H 1 4.20 0.02 . 1 . . . 47 ALA HA . c16368_2kko 1 558 . 1 1 47 47 ALA HB1 H 1 1.52 0.02 . 1 . . . 47 ALA HB . c16368_2kko 1 559 . 1 1 47 47 ALA HB2 H 1 1.52 0.02 . 1 . . . 47 ALA HB . c16368_2kko 1 560 . 1 1 47 47 ALA HB3 H 1 1.52 0.02 . 1 . . . 47 ALA HB . c16368_2kko 1 561 . 1 1 47 47 ALA C C 13 179.2 0.2 . 1 . . . 47 ALA C . c16368_2kko 1 562 . 1 1 47 47 ALA CA C 13 54.8 0.2 . 1 . . . 47 ALA CA . c16368_2kko 1 563 . 1 1 47 47 ALA CB C 13 19.8 0.2 . 1 . . . 47 ALA CB . c16368_2kko 1 564 . 1 1 47 47 ALA N N 15 121.4 0.2 . 1 . . . 47 ALA N . c16368_2kko 1 565 . 1 1 48 48 THR H H 1 7.56 0.02 . 1 . . . 48 THR H . c16368_2kko 1 566 . 1 1 48 48 THR HA H 1 4.39 0.02 . 1 . . . 48 THR HA . c16368_2kko 1 567 . 1 1 48 48 THR HB H 1 4.21 0.02 . 1 . . . 48 THR HB . c16368_2kko 1 568 . 1 1 48 48 THR HG21 H 1 1.11 0.02 . 1 . . . 48 THR HG2 . c16368_2kko 1 569 . 1 1 48 48 THR HG22 H 1 1.11 0.02 . 1 . . . 48 THR HG2 . c16368_2kko 1 570 . 1 1 48 48 THR HG23 H 1 1.11 0.02 . 1 . . . 48 THR HG2 . c16368_2kko 1 571 . 1 1 48 48 THR C C 13 175.7 0.2 . 1 . . . 48 THR C . c16368_2kko 1 572 . 1 1 48 48 THR CA C 13 61.8 0.2 . 1 . . . 48 THR CA . c16368_2kko 1 573 . 1 1 48 48 THR CB C 13 71.0 0.2 . 1 . . . 48 THR CB . c16368_2kko 1 574 . 1 1 48 48 THR CG2 C 13 21.7 0.2 . 1 . . . 48 THR CG2 . c16368_2kko 1 575 . 1 1 48 48 THR N N 15 103.5 0.2 . 1 . . . 48 THR N . c16368_2kko 1 576 . 1 1 49 49 GLY H H 1 7.82 0.02 . 1 . . . 49 GLY H . c16368_2kko 1 577 . 1 1 49 49 GLY HA2 H 1 3.87 0.02 . 2 . . . 49 GLY HA2 . c16368_2kko 1 578 . 1 1 49 49 GLY HA3 H 1 4.10 0.02 . 2 . . . 49 GLY HA3 . c16368_2kko 1 579 . 1 1 49 49 GLY C C 13 174.4 0.2 . 1 . . . 49 GLY C . c16368_2kko 1 580 . 1 1 49 49 GLY CA C 13 46.3 0.2 . 1 . . . 49 GLY CA . c16368_2kko 1 581 . 1 1 49 49 GLY N N 15 111.1 0.2 . 1 . . . 49 GLY N . c16368_2kko 1 582 . 1 1 50 50 MET H H 1 7.93 0.02 . 1 . . . 50 MET H . c16368_2kko 1 583 . 1 1 50 50 MET HA H 1 4.54 0.02 . 1 . . . 50 MET HA . c16368_2kko 1 584 . 1 1 50 50 MET HB2 H 1 1.73 0.02 . 2 . . . 50 MET HB2 . c16368_2kko 1 585 . 1 1 50 50 MET HB3 H 1 1.94 0.02 . 2 . . . 50 MET HB3 . c16368_2kko 1 586 . 1 1 50 50 MET HE1 H 1 1.98 0.02 . 1 . . . 50 MET HE . c16368_2kko 1 587 . 1 1 50 50 MET HE2 H 1 1.98 0.02 . 1 . . . 50 MET HE . c16368_2kko 1 588 . 1 1 50 50 MET HE3 H 1 1.98 0.02 . 1 . . . 50 MET HE . c16368_2kko 1 589 . 1 1 50 50 MET HG2 H 1 2.39 0.02 . 2 . . . 50 MET HG2 . c16368_2kko 1 590 . 1 1 50 50 MET HG3 H 1 2.58 0.02 . 2 . . . 50 MET HG3 . c16368_2kko 1 591 . 1 1 50 50 MET C C 13 174.8 0.2 . 1 . . . 50 MET C . c16368_2kko 1 592 . 1 1 50 50 MET CA C 13 55.1 0.2 . 1 . . . 50 MET CA . c16368_2kko 1 593 . 1 1 50 50 MET CB C 13 37.2 0.2 . 1 . . . 50 MET CB . c16368_2kko 1 594 . 1 1 50 50 MET CE C 13 17.6 0.2 . 1 . . . 50 MET CE . c16368_2kko 1 595 . 1 1 50 50 MET CG C 13 32.7 0.2 . 1 . . . 50 MET CG . c16368_2kko 1 596 . 1 1 50 50 MET N N 15 119.3 0.2 . 1 . . . 50 MET N . c16368_2kko 1 597 . 1 1 51 51 ASN H H 1 8.04 0.02 . 1 . . . 51 ASN H . c16368_2kko 1 598 . 1 1 51 51 ASN HA H 1 4.58 0.02 . 1 . . . 51 ASN HA . c16368_2kko 1 599 . 1 1 51 51 ASN HB2 H 1 2.69 0.02 . 2 . . . 51 ASN HB2 . c16368_2kko 1 600 . 1 1 51 51 ASN HB3 H 1 3.06 0.02 . 2 . . . 51 ASN HB3 . c16368_2kko 1 601 . 1 1 51 51 ASN C C 13 176.1 0.2 . 1 . . . 51 ASN C . c16368_2kko 1 602 . 1 1 51 51 ASN CA C 13 52.8 0.2 . 1 . . . 51 ASN CA . c16368_2kko 1 603 . 1 1 51 51 ASN CB C 13 41.1 0.2 . 1 . . . 51 ASN CB . c16368_2kko 1 604 . 1 1 51 51 ASN N N 15 118.0 0.2 . 1 . . . 51 ASN N . c16368_2kko 1 605 . 1 1 52 52 LEU H H 1 8.56 0.02 . 1 . . . 52 LEU H . c16368_2kko 1 606 . 1 1 52 52 LEU HA H 1 3.76 0.02 . 1 . . . 52 LEU HA . c16368_2kko 1 607 . 1 1 52 52 LEU HB2 H 1 1.67 0.02 . 2 . . . 52 LEU HB2 . c16368_2kko 1 608 . 1 1 52 52 LEU HB3 H 1 1.67 0.02 . 2 . . . 52 LEU HB3 . c16368_2kko 1 609 . 1 1 52 52 LEU HD11 H 1 0.86 0.02 . 2 . . . 52 LEU HD1 . c16368_2kko 1 610 . 1 1 52 52 LEU HD12 H 1 0.86 0.02 . 2 . . . 52 LEU HD1 . c16368_2kko 1 611 . 1 1 52 52 LEU HD13 H 1 0.86 0.02 . 2 . . . 52 LEU HD1 . c16368_2kko 1 612 . 1 1 52 52 LEU HD21 H 1 0.92 0.02 . 2 . . . 52 LEU HD2 . c16368_2kko 1 613 . 1 1 52 52 LEU HD22 H 1 0.92 0.02 . 2 . . . 52 LEU HD2 . c16368_2kko 1 614 . 1 1 52 52 LEU HD23 H 1 0.92 0.02 . 2 . . . 52 LEU HD2 . c16368_2kko 1 615 . 1 1 52 52 LEU HG H 1 1.68 0.02 . 1 . . . 52 LEU HG . c16368_2kko 1 616 . 1 1 52 52 LEU C C 13 179.6 0.2 . 1 . . . 52 LEU C . c16368_2kko 1 617 . 1 1 52 52 LEU CA C 13 59.0 0.2 . 1 . . . 52 LEU CA . c16368_2kko 1 618 . 1 1 52 52 LEU CB C 13 41.8 0.2 . 1 . . . 52 LEU CB . c16368_2kko 1 619 . 1 1 52 52 LEU CD1 C 13 24.5 0.2 . 2 . . . 52 LEU CD1 . c16368_2kko 1 620 . 1 1 52 52 LEU CD2 C 13 24.9 0.2 . 2 . . . 52 LEU CD2 . c16368_2kko 1 621 . 1 1 52 52 LEU CG C 13 27.4 0.2 . 1 . . . 52 LEU CG . c16368_2kko 1 622 . 1 1 52 52 LEU N N 15 120.6 0.2 . 1 . . . 52 LEU N . c16368_2kko 1 623 . 1 1 53 53 THR H H 1 8.23 0.02 . 1 . . . 53 THR H . c16368_2kko 1 624 . 1 1 53 53 THR HA H 1 3.88 0.02 . 1 . . . 53 THR HA . c16368_2kko 1 625 . 1 1 53 53 THR HB H 1 4.16 0.02 . 1 . . . 53 THR HB . c16368_2kko 1 626 . 1 1 53 53 THR HG21 H 1 1.21 0.02 . 1 . . . 53 THR HG2 . c16368_2kko 1 627 . 1 1 53 53 THR HG22 H 1 1.21 0.02 . 1 . . . 53 THR HG2 . c16368_2kko 1 628 . 1 1 53 53 THR HG23 H 1 1.21 0.02 . 1 . . . 53 THR HG2 . c16368_2kko 1 629 . 1 1 53 53 THR C C 13 176.9 0.2 . 1 . . . 53 THR C . c16368_2kko 1 630 . 1 1 53 53 THR CA C 13 66.5 0.2 . 1 . . . 53 THR CA . c16368_2kko 1 631 . 1 1 53 53 THR CB C 13 68.4 0.2 . 1 . . . 53 THR CB . c16368_2kko 1 632 . 1 1 53 53 THR CG2 C 13 21.7 0.2 . 1 . . . 53 THR CG2 . c16368_2kko 1 633 . 1 1 53 53 THR N N 15 115.8 0.2 . 1 . . . 53 THR N . c16368_2kko 1 634 . 1 1 54 54 THR H H 1 8.42 0.02 . 1 . . . 54 THR H . c16368_2kko 1 635 . 1 1 54 54 THR HA H 1 3.88 0.02 . 1 . . . 54 THR HA . c16368_2kko 1 636 . 1 1 54 54 THR HB H 1 3.89 0.02 . 1 . . . 54 THR HB . c16368_2kko 1 637 . 1 1 54 54 THR HG21 H 1 1.21 0.02 . 1 . . . 54 THR HG2 . c16368_2kko 1 638 . 1 1 54 54 THR HG22 H 1 1.21 0.02 . 1 . . . 54 THR HG2 . c16368_2kko 1 639 . 1 1 54 54 THR HG23 H 1 1.21 0.02 . 1 . . . 54 THR HG2 . c16368_2kko 1 640 . 1 1 54 54 THR C C 13 177.3 0.2 . 1 . . . 54 THR C . c16368_2kko 1 641 . 1 1 54 54 THR CA C 13 66.6 0.2 . 1 . . . 54 THR CA . c16368_2kko 1 642 . 1 1 54 54 THR CB C 13 66.6 0.2 . 1 . . . 54 THR CB . c16368_2kko 1 643 . 1 1 54 54 THR CG2 C 13 21.7 0.2 . 1 . . . 54 THR CG2 . c16368_2kko 1 644 . 1 1 54 54 THR N N 15 122.3 0.2 . 1 . . . 54 THR N . c16368_2kko 1 645 . 1 1 55 55 ALA H H 1 8.86 0.02 . 1 . . . 55 ALA H . c16368_2kko 1 646 . 1 1 55 55 ALA HA H 1 4.02 0.02 . 1 . . . 55 ALA HA . c16368_2kko 1 647 . 1 1 55 55 ALA HB1 H 1 1.17 0.02 . 1 . . . 55 ALA HB . c16368_2kko 1 648 . 1 1 55 55 ALA HB2 H 1 1.17 0.02 . 1 . . . 55 ALA HB . c16368_2kko 1 649 . 1 1 55 55 ALA HB3 H 1 1.17 0.02 . 1 . . . 55 ALA HB . c16368_2kko 1 650 . 1 1 55 55 ALA C C 13 179.0 0.2 . 1 . . . 55 ALA C . c16368_2kko 1 651 . 1 1 55 55 ALA CA C 13 56.1 0.2 . 1 . . . 55 ALA CA . c16368_2kko 1 652 . 1 1 55 55 ALA CB C 13 17.0 0.2 . 1 . . . 55 ALA CB . c16368_2kko 1 653 . 1 1 55 55 ALA N N 15 125.6 0.2 . 1 . . . 55 ALA N . c16368_2kko 1 654 . 1 1 56 56 SER H H 1 8.44 0.02 . 1 . . . 56 SER H . c16368_2kko 1 655 . 1 1 56 56 SER HA H 1 3.92 0.02 . 1 . . . 56 SER HA . c16368_2kko 1 656 . 1 1 56 56 SER HB2 H 1 4.01 0.02 . 2 . . . 56 SER HB2 . c16368_2kko 1 657 . 1 1 56 56 SER HB3 H 1 4.01 0.02 . 2 . . . 56 SER HB3 . c16368_2kko 1 658 . 1 1 56 56 SER C C 13 176.4 0.2 . 1 . . . 56 SER C . c16368_2kko 1 659 . 1 1 56 56 SER CA C 13 62.6 0.2 . 1 . . . 56 SER CA . c16368_2kko 1 660 . 1 1 56 56 SER CB C 13 62.7 0.2 . 1 . . . 56 SER CB . c16368_2kko 1 661 . 1 1 56 56 SER N N 15 112.7 0.2 . 1 . . . 56 SER N . c16368_2kko 1 662 . 1 1 57 57 ALA H H 1 8.09 0.02 . 1 . . . 57 ALA H . c16368_2kko 1 663 . 1 1 57 57 ALA HA H 1 4.13 0.02 . 1 . . . 57 ALA HA . c16368_2kko 1 664 . 1 1 57 57 ALA HB1 H 1 1.47 0.02 . 1 . . . 57 ALA HB . c16368_2kko 1 665 . 1 1 57 57 ALA HB2 H 1 1.47 0.02 . 1 . . . 57 ALA HB . c16368_2kko 1 666 . 1 1 57 57 ALA HB3 H 1 1.47 0.02 . 1 . . . 57 ALA HB . c16368_2kko 1 667 . 1 1 57 57 ALA C C 13 181.2 0.2 . 1 . . . 57 ALA C . c16368_2kko 1 668 . 1 1 57 57 ALA CA C 13 55.2 0.2 . 1 . . . 57 ALA CA . c16368_2kko 1 669 . 1 1 57 57 ALA CB C 13 17.9 0.2 . 1 . . . 57 ALA CB . c16368_2kko 1 670 . 1 1 57 57 ALA N N 15 124.0 0.2 . 1 . . . 57 ALA N . c16368_2kko 1 671 . 1 1 58 58 ASN H H 1 7.97 0.02 . 1 . . . 58 ASN H . c16368_2kko 1 672 . 1 1 58 58 ASN HA H 1 4.48 0.02 . 1 . . . 58 ASN HA . c16368_2kko 1 673 . 1 1 58 58 ASN HB2 H 1 2.10 0.02 . 2 . . . 58 ASN HB2 . c16368_2kko 1 674 . 1 1 58 58 ASN HB3 H 1 2.63 0.02 . 2 . . . 58 ASN HB3 . c16368_2kko 1 675 . 1 1 58 58 ASN HD21 H 1 7.72 0.02 . 2 . . . 58 ASN HD21 . c16368_2kko 1 676 . 1 1 58 58 ASN HD22 H 1 6.68 0.02 . 2 . . . 58 ASN HD22 . c16368_2kko 1 677 . 1 1 58 58 ASN C C 13 177.5 0.2 . 1 . . . 58 ASN C . c16368_2kko 1 678 . 1 1 58 58 ASN CA C 13 56.9 0.2 . 1 . . . 58 ASN CA . c16368_2kko 1 679 . 1 1 58 58 ASN CB C 13 39.8 0.2 . 1 . . . 58 ASN CB . c16368_2kko 1 680 . 1 1 58 58 ASN N N 15 117.6 0.2 . 1 . . . 58 ASN N . c16368_2kko 1 681 . 1 1 58 58 ASN ND2 N 15 114.4 0.2 . 1 . . . 58 ASN ND2 . c16368_2kko 1 682 . 1 1 59 59 LEU H H 1 8.53 0.02 . 1 . . . 59 LEU H . c16368_2kko 1 683 . 1 1 59 59 LEU HA H 1 3.71 0.02 . 1 . . . 59 LEU HA . c16368_2kko 1 684 . 1 1 59 59 LEU HB2 H 1 0.57 0.02 . 2 . . . 59 LEU HB2 . c16368_2kko 1 685 . 1 1 59 59 LEU HB3 H 1 1.64 0.02 . 2 . . . 59 LEU HB3 . c16368_2kko 1 686 . 1 1 59 59 LEU HD11 H 1 0.26 0.02 . 1 . . . 59 LEU HD1 . c16368_2kko 1 687 . 1 1 59 59 LEU HD12 H 1 0.26 0.02 . 1 . . . 59 LEU HD1 . c16368_2kko 1 688 . 1 1 59 59 LEU HD13 H 1 0.26 0.02 . 1 . . . 59 LEU HD1 . c16368_2kko 1 689 . 1 1 59 59 LEU HD21 H 1 0.22 0.02 . 1 . . . 59 LEU HD2 . c16368_2kko 1 690 . 1 1 59 59 LEU HD22 H 1 0.22 0.02 . 1 . . . 59 LEU HD2 . c16368_2kko 1 691 . 1 1 59 59 LEU HD23 H 1 0.22 0.02 . 1 . . . 59 LEU HD2 . c16368_2kko 1 692 . 1 1 59 59 LEU HG H 1 1.34 0.02 . 1 . . . 59 LEU HG . c16368_2kko 1 693 . 1 1 59 59 LEU C C 13 178.4 0.2 . 1 . . . 59 LEU C . c16368_2kko 1 694 . 1 1 59 59 LEU CA C 13 58.6 0.2 . 1 . . . 59 LEU CA . c16368_2kko 1 695 . 1 1 59 59 LEU CB C 13 40.5 0.2 . 1 . . . 59 LEU CB . c16368_2kko 1 696 . 1 1 59 59 LEU CD1 C 13 25.7 0.2 . 1 . . . 59 LEU CD1 . c16368_2kko 1 697 . 1 1 59 59 LEU CD2 C 13 23.3 0.2 . 1 . . . 59 LEU CD2 . c16368_2kko 1 698 . 1 1 59 59 LEU CG C 13 27.3 0.2 . 1 . . . 59 LEU CG . c16368_2kko 1 699 . 1 1 59 59 LEU N N 15 122.6 0.2 . 1 . . . 59 LEU N . c16368_2kko 1 700 . 1 1 60 60 GLN H H 1 8.20 0.02 . 1 . . . 60 GLN H . c16368_2kko 1 701 . 1 1 60 60 GLN HA H 1 4.02 0.02 . 1 . . . 60 GLN HA . c16368_2kko 1 702 . 1 1 60 60 GLN HB2 H 1 2.16 0.02 . 2 . . . 60 GLN HB2 . c16368_2kko 1 703 . 1 1 60 60 GLN HB3 H 1 2.16 0.02 . 2 . . . 60 GLN HB3 . c16368_2kko 1 704 . 1 1 60 60 GLN HE21 H 1 7.34 0.02 . 1 . . . 60 GLN HE21 . c16368_2kko 1 705 . 1 1 60 60 GLN HE22 H 1 6.89 0.02 . 1 . . . 60 GLN HE22 . c16368_2kko 1 706 . 1 1 60 60 GLN HG2 H 1 2.46 0.02 . 2 . . . 60 GLN HG2 . c16368_2kko 1 707 . 1 1 60 60 GLN HG3 H 1 2.46 0.02 . 2 . . . 60 GLN HG3 . c16368_2kko 1 708 . 1 1 60 60 GLN C C 13 178.7 0.2 . 1 . . . 60 GLN C . c16368_2kko 1 709 . 1 1 60 60 GLN CA C 13 58.8 0.2 . 1 . . . 60 GLN CA . c16368_2kko 1 710 . 1 1 60 60 GLN CB C 13 27.7 0.2 . 1 . . . 60 GLN CB . c16368_2kko 1 711 . 1 1 60 60 GLN CG C 13 33.8 0.2 . 1 . . . 60 GLN CG . c16368_2kko 1 712 . 1 1 60 60 GLN N N 15 118.9 0.2 . 1 . . . 60 GLN N . c16368_2kko 1 713 . 1 1 60 60 GLN NE2 N 15 112.3 0.2 . 1 . . . 60 GLN NE2 . c16368_2kko 1 714 . 1 1 61 61 ALA H H 1 7.58 0.02 . 1 . . . 61 ALA H . c16368_2kko 1 715 . 1 1 61 61 ALA HA H 1 4.23 0.02 . 1 . . . 61 ALA HA . c16368_2kko 1 716 . 1 1 61 61 ALA HB1 H 1 1.47 0.02 . 1 . . . 61 ALA HB . c16368_2kko 1 717 . 1 1 61 61 ALA HB2 H 1 1.47 0.02 . 1 . . . 61 ALA HB . c16368_2kko 1 718 . 1 1 61 61 ALA HB3 H 1 1.47 0.02 . 1 . . . 61 ALA HB . c16368_2kko 1 719 . 1 1 61 61 ALA C C 13 181.3 0.2 . 1 . . . 61 ALA C . c16368_2kko 1 720 . 1 1 61 61 ALA CA C 13 55.1 0.2 . 1 . . . 61 ALA CA . c16368_2kko 1 721 . 1 1 61 61 ALA CB C 13 17.6 0.2 . 1 . . . 61 ALA CB . c16368_2kko 1 722 . 1 1 61 61 ALA N N 15 122.2 0.2 . 1 . . . 61 ALA N . c16368_2kko 1 723 . 1 1 62 62 LEU H H 1 7.83 0.02 . 1 . . . 62 LEU H . c16368_2kko 1 724 . 1 1 62 62 LEU HA H 1 3.98 0.02 . 1 . . . 62 LEU HA . c16368_2kko 1 725 . 1 1 62 62 LEU HB2 H 1 1.19 0.02 . 2 . . . 62 LEU HB2 . c16368_2kko 1 726 . 1 1 62 62 LEU HB3 H 1 2.12 0.02 . 2 . . . 62 LEU HB3 . c16368_2kko 1 727 . 1 1 62 62 LEU HD11 H 1 0.77 0.02 . 1 . . . 62 LEU HD1 . c16368_2kko 1 728 . 1 1 62 62 LEU HD12 H 1 0.77 0.02 . 1 . . . 62 LEU HD1 . c16368_2kko 1 729 . 1 1 62 62 LEU HD13 H 1 0.77 0.02 . 1 . . . 62 LEU HD1 . c16368_2kko 1 730 . 1 1 62 62 LEU HD21 H 1 0.63 0.02 . 1 . . . 62 LEU HD2 . c16368_2kko 1 731 . 1 1 62 62 LEU HD22 H 1 0.63 0.02 . 1 . . . 62 LEU HD2 . c16368_2kko 1 732 . 1 1 62 62 LEU HD23 H 1 0.63 0.02 . 1 . . . 62 LEU HD2 . c16368_2kko 1 733 . 1 1 62 62 LEU HG H 1 1.72 0.02 . 1 . . . 62 LEU HG . c16368_2kko 1 734 . 1 1 62 62 LEU C C 13 178.5 0.2 . 1 . . . 62 LEU C . c16368_2kko 1 735 . 1 1 62 62 LEU CA C 13 58.1 0.2 . 1 . . . 62 LEU CA . c16368_2kko 1 736 . 1 1 62 62 LEU CB C 13 43.3 0.2 . 1 . . . 62 LEU CB . c16368_2kko 1 737 . 1 1 62 62 LEU CD1 C 13 25.8 0.2 . 1 . . . 62 LEU CD1 . c16368_2kko 1 738 . 1 1 62 62 LEU CD2 C 13 20.0 0.2 . 1 . . . 62 LEU CD2 . c16368_2kko 1 739 . 1 1 62 62 LEU N N 15 119.0 0.2 . 1 . . . 62 LEU N . c16368_2kko 1 740 . 1 1 63 63 LYS H H 1 8.58 0.02 . 1 . . . 63 LYS H . c16368_2kko 1 741 . 1 1 63 63 LYS HA H 1 4.13 0.02 . 1 . . . 63 LYS HA . c16368_2kko 1 742 . 1 1 63 63 LYS HB2 H 1 1.75 0.02 . 2 . . . 63 LYS HB2 . c16368_2kko 1 743 . 1 1 63 63 LYS HB3 H 1 2.16 0.02 . 2 . . . 63 LYS HB3 . c16368_2kko 1 744 . 1 1 63 63 LYS HD2 H 1 1.82 0.02 . 2 . . . 63 LYS HD2 . c16368_2kko 1 745 . 1 1 63 63 LYS HD3 H 1 1.82 0.02 . 2 . . . 63 LYS HD3 . c16368_2kko 1 746 . 1 1 63 63 LYS HE2 H 1 3.09 0.02 . 2 . . . 63 LYS HE2 . c16368_2kko 1 747 . 1 1 63 63 LYS HE3 H 1 3.09 0.02 . 2 . . . 63 LYS HE3 . c16368_2kko 1 748 . 1 1 63 63 LYS HG2 H 1 1.59 0.02 . 2 . . . 63 LYS HG2 . c16368_2kko 1 749 . 1 1 63 63 LYS HG3 H 1 1.59 0.02 . 2 . . . 63 LYS HG3 . c16368_2kko 1 750 . 1 1 63 63 LYS C C 13 180.5 0.2 . 1 . . . 63 LYS C . c16368_2kko 1 751 . 1 1 63 63 LYS CA C 13 59.7 0.2 . 1 . . . 63 LYS CA . c16368_2kko 1 752 . 1 1 63 63 LYS CB C 13 32.6 0.2 . 1 . . . 63 LYS CB . c16368_2kko 1 753 . 1 1 63 63 LYS CD C 13 29.8 0.2 . 1 . . . 63 LYS CD . c16368_2kko 1 754 . 1 1 63 63 LYS CE C 13 42.2 0.2 . 1 . . . 63 LYS CE . c16368_2kko 1 755 . 1 1 63 63 LYS CG C 13 24.8 0.2 . 1 . . . 63 LYS CG . c16368_2kko 1 756 . 1 1 63 63 LYS N N 15 123.4 0.2 . 1 . . . 63 LYS N . c16368_2kko 1 757 . 1 1 64 64 SER H H 1 8.64 0.02 . 1 . . . 64 SER H . c16368_2kko 1 758 . 1 1 64 64 SER HA H 1 4.30 0.02 . 1 . . . 64 SER HA . c16368_2kko 1 759 . 1 1 64 64 SER HB2 H 1 4.01 0.02 . 2 . . . 64 SER HB2 . c16368_2kko 1 760 . 1 1 64 64 SER HB3 H 1 4.01 0.02 . 2 . . . 64 SER HB3 . c16368_2kko 1 761 . 1 1 64 64 SER C C 13 175.0 0.2 . 1 . . . 64 SER C . c16368_2kko 1 762 . 1 1 64 64 SER CA C 13 61.4 0.2 . 1 . . . 64 SER CA . c16368_2kko 1 763 . 1 1 64 64 SER CB C 13 63.0 0.2 . 1 . . . 64 SER CB . c16368_2kko 1 764 . 1 1 64 64 SER N N 15 117.7 0.2 . 1 . . . 64 SER N . c16368_2kko 1 765 . 1 1 65 65 GLY H H 1 7.28 0.02 . 1 . . . 65 GLY H . c16368_2kko 1 766 . 1 1 65 65 GLY HA2 H 1 3.24 0.02 . 2 . . . 65 GLY HA2 . c16368_2kko 1 767 . 1 1 65 65 GLY HA3 H 1 3.98 0.02 . 2 . . . 65 GLY HA3 . c16368_2kko 1 768 . 1 1 65 65 GLY C C 13 171.3 0.2 . 1 . . . 65 GLY C . c16368_2kko 1 769 . 1 1 65 65 GLY CA C 13 45.1 0.2 . 1 . . . 65 GLY CA . c16368_2kko 1 770 . 1 1 65 65 GLY N N 15 104.4 0.2 . 1 . . . 65 GLY N . c16368_2kko 1 771 . 1 1 66 66 GLY H H 1 7.73 0.02 . 1 . . . 66 GLY H . c16368_2kko 1 772 . 1 1 66 66 GLY HA2 H 1 3.65 0.02 . 2 . . . 66 GLY HA2 . c16368_2kko 1 773 . 1 1 66 66 GLY HA3 H 1 3.75 0.02 . 2 . . . 66 GLY HA3 . c16368_2kko 1 774 . 1 1 66 66 GLY C C 13 173.7 0.2 . 1 . . . 66 GLY C . c16368_2kko 1 775 . 1 1 66 66 GLY CA C 13 45.4 0.2 . 1 . . . 66 GLY CA . c16368_2kko 1 776 . 1 1 66 66 GLY N N 15 104.7 0.2 . 1 . . . 66 GLY N . c16368_2kko 1 777 . 1 1 67 67 LEU H H 1 7.52 0.02 . 1 . . . 67 LEU H . c16368_2kko 1 778 . 1 1 67 67 LEU HA H 1 4.31 0.02 . 1 . . . 67 LEU HA . c16368_2kko 1 779 . 1 1 67 67 LEU HB2 H 1 1.60 0.02 . 2 . . . 67 LEU HB2 . c16368_2kko 1 780 . 1 1 67 67 LEU HB3 H 1 1.60 0.02 . 2 . . . 67 LEU HB3 . c16368_2kko 1 781 . 1 1 67 67 LEU HD11 H 1 0.70 0.02 . 1 . . . 67 LEU HD1 . c16368_2kko 1 782 . 1 1 67 67 LEU HD12 H 1 0.70 0.02 . 1 . . . 67 LEU HD1 . c16368_2kko 1 783 . 1 1 67 67 LEU HD13 H 1 0.70 0.02 . 1 . . . 67 LEU HD1 . c16368_2kko 1 784 . 1 1 67 67 LEU HD21 H 1 0.82 0.02 . 1 . . . 67 LEU HD2 . c16368_2kko 1 785 . 1 1 67 67 LEU HD22 H 1 0.82 0.02 . 1 . . . 67 LEU HD2 . c16368_2kko 1 786 . 1 1 67 67 LEU HD23 H 1 0.82 0.02 . 1 . . . 67 LEU HD2 . c16368_2kko 1 787 . 1 1 67 67 LEU HG H 1 1.55 0.02 . 1 . . . 67 LEU HG . c16368_2kko 1 788 . 1 1 67 67 LEU C C 13 177.7 0.2 . 1 . . . 67 LEU C . c16368_2kko 1 789 . 1 1 67 67 LEU CA C 13 55.5 0.2 . 1 . . . 67 LEU CA . c16368_2kko 1 790 . 1 1 67 67 LEU CB C 13 42.4 0.2 . 1 . . . 67 LEU CB . c16368_2kko 1 791 . 1 1 67 67 LEU CD1 C 13 23.4 0.2 . 1 . . . 67 LEU CD1 . c16368_2kko 1 792 . 1 1 67 67 LEU CD2 C 13 27.1 0.2 . 1 . . . 67 LEU CD2 . c16368_2kko 1 793 . 1 1 67 67 LEU CG C 13 27.0 0.2 . 1 . . . 67 LEU CG . c16368_2kko 1 794 . 1 1 67 67 LEU N N 15 110.6 0.2 . 1 . . . 67 LEU N . c16368_2kko 1 795 . 1 1 68 68 VAL H H 1 6.89 0.02 . 1 . . . 68 VAL H . c16368_2kko 1 796 . 1 1 68 68 VAL HA H 1 5.19 0.02 . 1 . . . 68 VAL HA . c16368_2kko 1 797 . 1 1 68 68 VAL HB H 1 2.15 0.02 . 1 . . . 68 VAL HB . c16368_2kko 1 798 . 1 1 68 68 VAL HG11 H 1 0.65 0.02 . 1 . . . 68 VAL HG1 . c16368_2kko 1 799 . 1 1 68 68 VAL HG12 H 1 0.65 0.02 . 1 . . . 68 VAL HG1 . c16368_2kko 1 800 . 1 1 68 68 VAL HG13 H 1 0.65 0.02 . 1 . . . 68 VAL HG1 . c16368_2kko 1 801 . 1 1 68 68 VAL HG21 H 1 0.63 0.02 . 1 . . . 68 VAL HG2 . c16368_2kko 1 802 . 1 1 68 68 VAL HG22 H 1 0.63 0.02 . 1 . . . 68 VAL HG2 . c16368_2kko 1 803 . 1 1 68 68 VAL HG23 H 1 0.63 0.02 . 1 . . . 68 VAL HG2 . c16368_2kko 1 804 . 1 1 68 68 VAL C C 13 173.7 0.2 . 1 . . . 68 VAL C . c16368_2kko 1 805 . 1 1 68 68 VAL CA C 13 57.4 0.2 . 1 . . . 68 VAL CA . c16368_2kko 1 806 . 1 1 68 68 VAL CB C 13 36.4 0.2 . 1 . . . 68 VAL CB . c16368_2kko 1 807 . 1 1 68 68 VAL CG1 C 13 22.7 0.2 . 1 . . . 68 VAL CG1 . c16368_2kko 1 808 . 1 1 68 68 VAL CG2 C 13 20.1 0.2 . 1 . . . 68 VAL CG2 . c16368_2kko 1 809 . 1 1 68 68 VAL N N 15 106.4 0.2 . 1 . . . 68 VAL N . c16368_2kko 1 810 . 1 1 69 69 GLU H H 1 8.88 0.02 . 1 . . . 69 GLU H . c16368_2kko 1 811 . 1 1 69 69 GLU HA H 1 4.66 0.02 . 1 . . . 69 GLU HA . c16368_2kko 1 812 . 1 1 69 69 GLU HB2 H 1 1.59 0.02 . 2 . . . 69 GLU HB2 . c16368_2kko 1 813 . 1 1 69 69 GLU HB3 H 1 1.93 0.02 . 2 . . . 69 GLU HB3 . c16368_2kko 1 814 . 1 1 69 69 GLU HG2 H 1 2.14 0.02 . 2 . . . 69 GLU HG2 . c16368_2kko 1 815 . 1 1 69 69 GLU HG3 H 1 2.21 0.02 . 2 . . . 69 GLU HG3 . c16368_2kko 1 816 . 1 1 69 69 GLU C C 13 173.3 0.2 . 1 . . . 69 GLU C . c16368_2kko 1 817 . 1 1 69 69 GLU CA C 13 54.3 0.2 . 1 . . . 69 GLU CA . c16368_2kko 1 818 . 1 1 69 69 GLU CB C 13 34.1 0.2 . 1 . . . 69 GLU CB . c16368_2kko 1 819 . 1 1 69 69 GLU CG C 13 36.0 0.2 . 1 . . . 69 GLU CG . c16368_2kko 1 820 . 1 1 69 69 GLU N N 15 120.4 0.2 . 1 . . . 69 GLU N . c16368_2kko 1 821 . 1 1 70 70 ALA H H 1 8.73 0.02 . 1 . . . 70 ALA H . c16368_2kko 1 822 . 1 1 70 70 ALA HA H 1 4.99 0.02 . 1 . . . 70 ALA HA . c16368_2kko 1 823 . 1 1 70 70 ALA HB1 H 1 0.65 0.02 . 1 . . . 70 ALA HB . c16368_2kko 1 824 . 1 1 70 70 ALA HB2 H 1 0.65 0.02 . 1 . . . 70 ALA HB . c16368_2kko 1 825 . 1 1 70 70 ALA HB3 H 1 0.65 0.02 . 1 . . . 70 ALA HB . c16368_2kko 1 826 . 1 1 70 70 ALA C C 13 176.5 0.2 . 1 . . . 70 ALA C . c16368_2kko 1 827 . 1 1 70 70 ALA CA C 13 50.0 0.2 . 1 . . . 70 ALA CA . c16368_2kko 1 828 . 1 1 70 70 ALA CB C 13 22.3 0.2 . 1 . . . 70 ALA CB . c16368_2kko 1 829 . 1 1 70 70 ALA N N 15 122.8 0.2 . 1 . . . 70 ALA N . c16368_2kko 1 830 . 1 1 71 71 ARG H H 1 8.67 0.02 . 1 . . . 71 ARG H . c16368_2kko 1 831 . 1 1 71 71 ARG HA H 1 4.63 0.02 . 1 . . . 71 ARG HA . c16368_2kko 1 832 . 1 1 71 71 ARG HB2 H 1 1.65 0.02 . 2 . . . 71 ARG HB2 . c16368_2kko 1 833 . 1 1 71 71 ARG HB3 H 1 1.70 0.02 . 2 . . . 71 ARG HB3 . c16368_2kko 1 834 . 1 1 71 71 ARG HD2 H 1 2.85 0.02 . 2 . . . 71 ARG HD2 . c16368_2kko 1 835 . 1 1 71 71 ARG HD3 H 1 3.16 0.02 . 2 . . . 71 ARG HD3 . c16368_2kko 1 836 . 1 1 71 71 ARG HE H 1 8.31 0.02 . 1 . . . 71 ARG HE . c16368_2kko 1 837 . 1 1 71 71 ARG HG2 H 1 1.32 0.02 . 2 . . . 71 ARG HG2 . c16368_2kko 1 838 . 1 1 71 71 ARG HG3 H 1 1.40 0.02 . 2 . . . 71 ARG HG3 . c16368_2kko 1 839 . 1 1 71 71 ARG HH11 H 1 6.17 0.02 . 2 . . . 71 ARG HH11 . c16368_2kko 1 840 . 1 1 71 71 ARG HH12 H 1 6.17 0.02 . 2 . . . 71 ARG HH12 . c16368_2kko 1 841 . 1 1 71 71 ARG HH21 H 1 6.89 0.02 . 2 . . . 71 ARG HH21 . c16368_2kko 1 842 . 1 1 71 71 ARG HH22 H 1 6.89 0.02 . 2 . . . 71 ARG HH22 . c16368_2kko 1 843 . 1 1 71 71 ARG C C 13 173.5 0.2 . 1 . . . 71 ARG C . c16368_2kko 1 844 . 1 1 71 71 ARG CA C 13 54.6 0.2 . 1 . . . 71 ARG CA . c16368_2kko 1 845 . 1 1 71 71 ARG CB C 13 33.6 0.2 . 1 . . . 71 ARG CB . c16368_2kko 1 846 . 1 1 71 71 ARG CD C 13 42.9 0.2 . 1 . . . 71 ARG CD . c16368_2kko 1 847 . 1 1 71 71 ARG CG C 13 27.7 0.2 . 1 . . . 71 ARG CG . c16368_2kko 1 848 . 1 1 71 71 ARG CZ C 13 159.1 0.2 . 1 . . . 71 ARG CZ . c16368_2kko 1 849 . 1 1 71 71 ARG N N 15 120.1 0.2 . 1 . . . 71 ARG N . c16368_2kko 1 850 . 1 1 71 71 ARG NE N 15 84.1 0.2 . 1 . . . 71 ARG NE . c16368_2kko 1 851 . 1 1 72 72 ARG H H 1 8.78 0.02 . 1 . . . 72 ARG H . c16368_2kko 1 852 . 1 1 72 72 ARG HA H 1 5.10 0.02 . 1 . . . 72 ARG HA . c16368_2kko 1 853 . 1 1 72 72 ARG HB2 H 1 1.65 0.02 . 2 . . . 72 ARG HB2 . c16368_2kko 1 854 . 1 1 72 72 ARG HB3 H 1 1.75 0.02 . 2 . . . 72 ARG HB3 . c16368_2kko 1 855 . 1 1 72 72 ARG HD2 H 1 3.13 0.02 . 2 . . . 72 ARG HD2 . c16368_2kko 1 856 . 1 1 72 72 ARG HD3 H 1 3.13 0.02 . 2 . . . 72 ARG HD3 . c16368_2kko 1 857 . 1 1 72 72 ARG HG2 H 1 1.41 0.02 . 2 . . . 72 ARG HG2 . c16368_2kko 1 858 . 1 1 72 72 ARG HG3 H 1 1.49 0.02 . 2 . . . 72 ARG HG3 . c16368_2kko 1 859 . 1 1 72 72 ARG C C 13 176.0 0.2 . 1 . . . 72 ARG C . c16368_2kko 1 860 . 1 1 72 72 ARG CA C 13 54.9 0.2 . 1 . . . 72 ARG CA . c16368_2kko 1 861 . 1 1 72 72 ARG CB C 13 32.5 0.2 . 1 . . . 72 ARG CB . c16368_2kko 1 862 . 1 1 72 72 ARG CD C 13 43.2 0.2 . 1 . . . 72 ARG CD . c16368_2kko 1 863 . 1 1 72 72 ARG CG C 13 27.8 0.2 . 1 . . . 72 ARG CG . c16368_2kko 1 864 . 1 1 72 72 ARG N N 15 123.6 0.2 . 1 . . . 72 ARG N . c16368_2kko 1 865 . 1 1 73 73 GLU H H 1 8.72 0.02 . 1 . . . 73 GLU H . c16368_2kko 1 866 . 1 1 73 73 GLU HA H 1 4.51 0.02 . 1 . . . 73 GLU HA . c16368_2kko 1 867 . 1 1 73 73 GLU HB2 H 1 1.85 0.02 . 2 . . . 73 GLU HB2 . c16368_2kko 1 868 . 1 1 73 73 GLU HB3 H 1 2.08 0.02 . 2 . . . 73 GLU HB3 . c16368_2kko 1 869 . 1 1 73 73 GLU HG2 H 1 2.16 0.02 . 2 . . . 73 GLU HG2 . c16368_2kko 1 870 . 1 1 73 73 GLU HG3 H 1 2.16 0.02 . 2 . . . 73 GLU HG3 . c16368_2kko 1 871 . 1 1 73 73 GLU C C 13 175.9 0.2 . 1 . . . 73 GLU C . c16368_2kko 1 872 . 1 1 73 73 GLU CA C 13 55.7 0.2 . 1 . . . 73 GLU CA . c16368_2kko 1 873 . 1 1 73 73 GLU CB C 13 31.8 0.2 . 1 . . . 73 GLU CB . c16368_2kko 1 874 . 1 1 73 73 GLU CG C 13 36.2 0.2 . 1 . . . 73 GLU CG . c16368_2kko 1 875 . 1 1 73 73 GLU N N 15 126.8 0.2 . 1 . . . 73 GLU N . c16368_2kko 1 876 . 1 1 74 74 GLY H H 1 9.19 0.02 . 1 . . . 74 GLY H . c16368_2kko 1 877 . 1 1 74 74 GLY HA2 H 1 3.70 0.02 . 2 . . . 74 GLY HA2 . c16368_2kko 1 878 . 1 1 74 74 GLY HA3 H 1 4.17 0.02 . 2 . . . 74 GLY HA3 . c16368_2kko 1 879 . 1 1 74 74 GLY C C 13 175.4 0.2 . 1 . . . 74 GLY C . c16368_2kko 1 880 . 1 1 74 74 GLY CA C 13 47.1 0.2 . 1 . . . 74 GLY CA . c16368_2kko 1 881 . 1 1 74 74 GLY N N 15 118.5 0.2 . 1 . . . 74 GLY N . c16368_2kko 1 882 . 1 1 75 75 THR H H 1 8.78 0.02 . 1 . . . 75 THR H . c16368_2kko 1 883 . 1 1 75 75 THR HA H 1 4.29 0.02 . 1 . . . 75 THR HA . c16368_2kko 1 884 . 1 1 75 75 THR HB H 1 4.52 0.02 . 1 . . . 75 THR HB . c16368_2kko 1 885 . 1 1 75 75 THR HG21 H 1 1.21 0.02 . 1 . . . 75 THR HG2 . c16368_2kko 1 886 . 1 1 75 75 THR HG22 H 1 1.21 0.02 . 1 . . . 75 THR HG2 . c16368_2kko 1 887 . 1 1 75 75 THR HG23 H 1 1.21 0.02 . 1 . . . 75 THR HG2 . c16368_2kko 1 888 . 1 1 75 75 THR C C 13 174.6 0.2 . 1 . . . 75 THR C . c16368_2kko 1 889 . 1 1 75 75 THR CA C 13 62.0 0.2 . 1 . . . 75 THR CA . c16368_2kko 1 890 . 1 1 75 75 THR CB C 13 69.0 0.2 . 1 . . . 75 THR CB . c16368_2kko 1 891 . 1 1 75 75 THR CG2 C 13 21.7 0.2 . 1 . . . 75 THR CG2 . c16368_2kko 1 892 . 1 1 75 75 THR N N 15 118.0 0.2 . 1 . . . 75 THR N . c16368_2kko 1 893 . 1 1 76 76 ARG H H 1 8.03 0.02 . 1 . . . 76 ARG H . c16368_2kko 1 894 . 1 1 76 76 ARG HA H 1 4.61 0.02 . 1 . . . 76 ARG HA . c16368_2kko 1 895 . 1 1 76 76 ARG HB2 H 1 1.53 0.02 . 2 . . . 76 ARG HB2 . c16368_2kko 1 896 . 1 1 76 76 ARG HB3 H 1 1.93 0.02 . 2 . . . 76 ARG HB3 . c16368_2kko 1 897 . 1 1 76 76 ARG HD2 H 1 3.13 0.02 . 2 . . . 76 ARG HD2 . c16368_2kko 1 898 . 1 1 76 76 ARG HD3 H 1 3.13 0.02 . 2 . . . 76 ARG HD3 . c16368_2kko 1 899 . 1 1 76 76 ARG HG2 H 1 1.51 0.02 . 2 . . . 76 ARG HG2 . c16368_2kko 1 900 . 1 1 76 76 ARG HG3 H 1 1.69 0.02 . 2 . . . 76 ARG HG3 . c16368_2kko 1 901 . 1 1 76 76 ARG C C 13 174.8 0.2 . 1 . . . 76 ARG C . c16368_2kko 1 902 . 1 1 76 76 ARG CA C 13 55.5 0.2 . 1 . . . 76 ARG CA . c16368_2kko 1 903 . 1 1 76 76 ARG CB C 13 32.7 0.2 . 1 . . . 76 ARG CB . c16368_2kko 1 904 . 1 1 76 76 ARG CD C 13 43.4 0.2 . 1 . . . 76 ARG CD . c16368_2kko 1 905 . 1 1 76 76 ARG CG C 13 27.5 0.2 . 1 . . . 76 ARG CG . c16368_2kko 1 906 . 1 1 76 76 ARG N N 15 122.6 0.2 . 1 . . . 76 ARG N . c16368_2kko 1 907 . 1 1 77 77 GLN H H 1 8.58 0.02 . 1 . . . 77 GLN H . c16368_2kko 1 908 . 1 1 77 77 GLN HA H 1 4.91 0.02 . 1 . . . 77 GLN HA . c16368_2kko 1 909 . 1 1 77 77 GLN HB2 H 1 1.82 0.02 . 2 . . . 77 GLN HB2 . c16368_2kko 1 910 . 1 1 77 77 GLN HB3 H 1 1.82 0.02 . 2 . . . 77 GLN HB3 . c16368_2kko 1 911 . 1 1 77 77 GLN HE21 H 1 7.21 0.02 . 1 . . . 77 GLN HE21 . c16368_2kko 1 912 . 1 1 77 77 GLN HE22 H 1 6.75 0.02 . 1 . . . 77 GLN HE22 . c16368_2kko 1 913 . 1 1 77 77 GLN HG2 H 1 1.93 0.02 . 2 . . . 77 GLN HG2 . c16368_2kko 1 914 . 1 1 77 77 GLN HG3 H 1 2.11 0.02 . 2 . . . 77 GLN HG3 . c16368_2kko 1 915 . 1 1 77 77 GLN C C 13 173.9 0.2 . 1 . . . 77 GLN C . c16368_2kko 1 916 . 1 1 77 77 GLN CA C 13 54.7 0.2 . 1 . . . 77 GLN CA . c16368_2kko 1 917 . 1 1 77 77 GLN CB C 13 31.8 0.2 . 1 . . . 77 GLN CB . c16368_2kko 1 918 . 1 1 77 77 GLN CG C 13 34.5 0.2 . 1 . . . 77 GLN CG . c16368_2kko 1 919 . 1 1 77 77 GLN N N 15 121.9 0.2 . 1 . . . 77 GLN N . c16368_2kko 1 920 . 1 1 77 77 GLN NE2 N 15 111.2 0.2 . 1 . . . 77 GLN NE2 . c16368_2kko 1 921 . 1 1 78 78 TYR H H 1 8.89 0.02 . 1 . . . 78 TYR H . c16368_2kko 1 922 . 1 1 78 78 TYR HA H 1 4.75 0.02 . 1 . . . 78 TYR HA . c16368_2kko 1 923 . 1 1 78 78 TYR HB2 H 1 2.50 0.02 . 2 . . . 78 TYR HB2 . c16368_2kko 1 924 . 1 1 78 78 TYR HB3 H 1 2.59 0.02 . 2 . . . 78 TYR HB3 . c16368_2kko 1 925 . 1 1 78 78 TYR HD1 H 1 6.71 0.02 . 3 . . . 78 TYR HD1 . c16368_2kko 1 926 . 1 1 78 78 TYR HD2 H 1 6.71 0.02 . 3 . . . 78 TYR HD2 . c16368_2kko 1 927 . 1 1 78 78 TYR HE1 H 1 6.74 0.02 . 3 . . . 78 TYR HE1 . c16368_2kko 1 928 . 1 1 78 78 TYR HE2 H 1 6.74 0.02 . 3 . . . 78 TYR HE2 . c16368_2kko 1 929 . 1 1 78 78 TYR C C 13 175.6 0.2 . 1 . . . 78 TYR C . c16368_2kko 1 930 . 1 1 78 78 TYR CA C 13 57.0 0.2 . 1 . . . 78 TYR CA . c16368_2kko 1 931 . 1 1 78 78 TYR CB C 13 41.4 0.2 . 1 . . . 78 TYR CB . c16368_2kko 1 932 . 1 1 78 78 TYR CD1 C 13 132.5 0.2 . 3 . . . 78 TYR CD1 . c16368_2kko 1 933 . 1 1 78 78 TYR CD2 C 13 132.5 0.2 . 3 . . . 78 TYR CD2 . c16368_2kko 1 934 . 1 1 78 78 TYR CE1 C 13 118.2 0.2 . 3 . . . 78 TYR CE1 . c16368_2kko 1 935 . 1 1 78 78 TYR CE2 C 13 118.2 0.2 . 3 . . . 78 TYR CE2 . c16368_2kko 1 936 . 1 1 78 78 TYR N N 15 121.8 0.2 . 1 . . . 78 TYR N . c16368_2kko 1 937 . 1 1 79 79 TYR H H 1 9.01 0.02 . 1 . . . 79 TYR H . c16368_2kko 1 938 . 1 1 79 79 TYR HA H 1 5.41 0.02 . 1 . . . 79 TYR HA . c16368_2kko 1 939 . 1 1 79 79 TYR HB2 H 1 2.60 0.02 . 2 . . . 79 TYR HB2 . c16368_2kko 1 940 . 1 1 79 79 TYR HB3 H 1 2.60 0.02 . 2 . . . 79 TYR HB3 . c16368_2kko 1 941 . 1 1 79 79 TYR HD1 H 1 6.77 0.02 . 3 . . . 79 TYR HD1 . c16368_2kko 1 942 . 1 1 79 79 TYR HD2 H 1 6.77 0.02 . 3 . . . 79 TYR HD2 . c16368_2kko 1 943 . 1 1 79 79 TYR HE1 H 1 6.46 0.02 . 3 . . . 79 TYR HE1 . c16368_2kko 1 944 . 1 1 79 79 TYR HE2 H 1 6.46 0.02 . 3 . . . 79 TYR HE2 . c16368_2kko 1 945 . 1 1 79 79 TYR C C 13 173.1 0.2 . 1 . . . 79 TYR C . c16368_2kko 1 946 . 1 1 79 79 TYR CA C 13 57.3 0.2 . 1 . . . 79 TYR CA . c16368_2kko 1 947 . 1 1 79 79 TYR CB C 13 43.3 0.2 . 1 . . . 79 TYR CB . c16368_2kko 1 948 . 1 1 79 79 TYR CD1 C 13 132.8 0.2 . 3 . . . 79 TYR CD1 . c16368_2kko 1 949 . 1 1 79 79 TYR CD2 C 13 132.8 0.2 . 3 . . . 79 TYR CD2 . c16368_2kko 1 950 . 1 1 79 79 TYR CE1 C 13 118.5 0.2 . 3 . . . 79 TYR CE1 . c16368_2kko 1 951 . 1 1 79 79 TYR CE2 C 13 118.5 0.2 . 3 . . . 79 TYR CE2 . c16368_2kko 1 952 . 1 1 79 79 TYR N N 15 122.5 0.2 . 1 . . . 79 TYR N . c16368_2kko 1 953 . 1 1 80 80 ARG H H 1 8.72 0.02 . 1 . . . 80 ARG H . c16368_2kko 1 954 . 1 1 80 80 ARG HA H 1 5.12 0.02 . 1 . . . 80 ARG HA . c16368_2kko 1 955 . 1 1 80 80 ARG HB2 H 1 1.60 0.02 . 2 . . . 80 ARG HB2 . c16368_2kko 1 956 . 1 1 80 80 ARG HB3 H 1 1.89 0.02 . 2 . . . 80 ARG HB3 . c16368_2kko 1 957 . 1 1 80 80 ARG HD2 H 1 2.99 0.02 . 2 . . . 80 ARG HD2 . c16368_2kko 1 958 . 1 1 80 80 ARG HD3 H 1 2.99 0.02 . 2 . . . 80 ARG HD3 . c16368_2kko 1 959 . 1 1 80 80 ARG HE H 1 7.35 0.02 . 1 . . . 80 ARG HE . c16368_2kko 1 960 . 1 1 80 80 ARG HG2 H 1 1.19 0.02 . 2 . . . 80 ARG HG2 . c16368_2kko 1 961 . 1 1 80 80 ARG HG3 H 1 1.64 0.02 . 2 . . . 80 ARG HG3 . c16368_2kko 1 962 . 1 1 80 80 ARG C C 13 175.5 0.2 . 1 . . . 80 ARG C . c16368_2kko 1 963 . 1 1 80 80 ARG CA C 13 53.2 0.2 . 1 . . . 80 ARG CA . c16368_2kko 1 964 . 1 1 80 80 ARG CB C 13 33.9 0.2 . 1 . . . 80 ARG CB . c16368_2kko 1 965 . 1 1 80 80 ARG CD C 13 43.7 0.2 . 1 . . . 80 ARG CD . c16368_2kko 1 966 . 1 1 80 80 ARG CG C 13 25.9 0.2 . 1 . . . 80 ARG CG . c16368_2kko 1 967 . 1 1 80 80 ARG N N 15 114.5 0.2 . 1 . . . 80 ARG N . c16368_2kko 1 968 . 1 1 80 80 ARG NE N 15 86.3 0.2 . 1 . . . 80 ARG NE . c16368_2kko 1 969 . 1 1 81 81 ILE H H 1 9.30 0.02 . 1 . . . 81 ILE H . c16368_2kko 1 970 . 1 1 81 81 ILE HA H 1 4.15 0.02 . 1 . . . 81 ILE HA . c16368_2kko 1 971 . 1 1 81 81 ILE HB H 1 1.70 0.02 . 1 . . . 81 ILE HB . c16368_2kko 1 972 . 1 1 81 81 ILE HD11 H 1 0.75 0.02 . 1 . . . 81 ILE HD1 . c16368_2kko 1 973 . 1 1 81 81 ILE HD12 H 1 0.75 0.02 . 1 . . . 81 ILE HD1 . c16368_2kko 1 974 . 1 1 81 81 ILE HD13 H 1 0.75 0.02 . 1 . . . 81 ILE HD1 . c16368_2kko 1 975 . 1 1 81 81 ILE HG12 H 1 1.16 0.02 . 2 . . . 81 ILE HG12 . c16368_2kko 1 976 . 1 1 81 81 ILE HG13 H 1 1.46 0.02 . 2 . . . 81 ILE HG13 . c16368_2kko 1 977 . 1 1 81 81 ILE HG21 H 1 0.90 0.02 . 1 . . . 81 ILE HG2 . c16368_2kko 1 978 . 1 1 81 81 ILE HG22 H 1 0.90 0.02 . 1 . . . 81 ILE HG2 . c16368_2kko 1 979 . 1 1 81 81 ILE HG23 H 1 0.90 0.02 . 1 . . . 81 ILE HG2 . c16368_2kko 1 980 . 1 1 81 81 ILE C C 13 177.8 0.2 . 1 . . . 81 ILE C . c16368_2kko 1 981 . 1 1 81 81 ILE CA C 13 62.3 0.2 . 1 . . . 81 ILE CA . c16368_2kko 1 982 . 1 1 81 81 ILE CB C 13 37.8 0.2 . 1 . . . 81 ILE CB . c16368_2kko 1 983 . 1 1 81 81 ILE CD1 C 13 12.4 0.2 . 1 . . . 81 ILE CD1 . c16368_2kko 1 984 . 1 1 81 81 ILE CG1 C 13 28.9 0.2 . 1 . . . 81 ILE CG1 . c16368_2kko 1 985 . 1 1 81 81 ILE CG2 C 13 17.9 0.2 . 1 . . . 81 ILE CG2 . c16368_2kko 1 986 . 1 1 81 81 ILE N N 15 122.1 0.2 . 1 . . . 81 ILE N . c16368_2kko 1 987 . 1 1 82 82 ALA H H 1 7.93 0.02 . 1 . . . 82 ALA H . c16368_2kko 1 988 . 1 1 82 82 ALA HA H 1 3.93 0.02 . 1 . . . 82 ALA HA . c16368_2kko 1 989 . 1 1 82 82 ALA HB1 H 1 0.97 0.02 . 1 . . . 82 ALA HB . c16368_2kko 1 990 . 1 1 82 82 ALA HB2 H 1 0.97 0.02 . 1 . . . 82 ALA HB . c16368_2kko 1 991 . 1 1 82 82 ALA HB3 H 1 0.97 0.02 . 1 . . . 82 ALA HB . c16368_2kko 1 992 . 1 1 82 82 ALA C C 13 176.3 0.2 . 1 . . . 82 ALA C . c16368_2kko 1 993 . 1 1 82 82 ALA CA C 13 54.2 0.2 . 1 . . . 82 ALA CA . c16368_2kko 1 994 . 1 1 82 82 ALA CB C 13 18.5 0.2 . 1 . . . 82 ALA CB . c16368_2kko 1 995 . 1 1 82 82 ALA N N 15 127.2 0.2 . 1 . . . 82 ALA N . c16368_2kko 1 996 . 1 1 83 83 GLY H H 1 6.98 0.02 . 1 . . . 83 GLY H . c16368_2kko 1 997 . 1 1 83 83 GLY HA2 H 1 4.09 0.02 . 2 . . . 83 GLY HA2 . c16368_2kko 1 998 . 1 1 83 83 GLY HA3 H 1 4.44 0.02 . 2 . . . 83 GLY HA3 . c16368_2kko 1 999 . 1 1 83 83 GLY C C 13 173.6 0.2 . 1 . . . 83 GLY C . c16368_2kko 1 1000 . 1 1 83 83 GLY CA C 13 45.2 0.2 . 1 . . . 83 GLY CA . c16368_2kko 1 1001 . 1 1 83 83 GLY N N 15 101.8 0.2 . 1 . . . 83 GLY N . c16368_2kko 1 1002 . 1 1 84 84 GLU H H 1 8.93 0.02 . 1 . . . 84 GLU H . c16368_2kko 1 1003 . 1 1 84 84 GLU HA H 1 4.12 0.02 . 1 . . . 84 GLU HA . c16368_2kko 1 1004 . 1 1 84 84 GLU HB2 H 1 2.04 0.02 . 2 . . . 84 GLU HB2 . c16368_2kko 1 1005 . 1 1 84 84 GLU HB3 H 1 2.11 0.02 . 2 . . . 84 GLU HB3 . c16368_2kko 1 1006 . 1 1 84 84 GLU HG2 H 1 2.35 0.02 . 2 . . . 84 GLU HG2 . c16368_2kko 1 1007 . 1 1 84 84 GLU HG3 H 1 2.35 0.02 . 2 . . . 84 GLU HG3 . c16368_2kko 1 1008 . 1 1 84 84 GLU C C 13 178.3 0.2 . 1 . . . 84 GLU C . c16368_2kko 1 1009 . 1 1 84 84 GLU CA C 13 58.9 0.2 . 1 . . . 84 GLU CA . c16368_2kko 1 1010 . 1 1 84 84 GLU CB C 13 29.4 0.2 . 1 . . . 84 GLU CB . c16368_2kko 1 1011 . 1 1 84 84 GLU CG C 13 36.0 0.2 . 1 . . . 84 GLU CG . c16368_2kko 1 1012 . 1 1 84 84 GLU N N 15 120.3 0.2 . 1 . . . 84 GLU N . c16368_2kko 1 1013 . 1 1 85 85 ASP H H 1 8.95 0.02 . 1 . . . 85 ASP H . c16368_2kko 1 1014 . 1 1 85 85 ASP HA H 1 4.31 0.02 . 1 . . . 85 ASP HA . c16368_2kko 1 1015 . 1 1 85 85 ASP HB2 H 1 2.61 0.02 . 2 . . . 85 ASP HB2 . c16368_2kko 1 1016 . 1 1 85 85 ASP HB3 H 1 2.61 0.02 . 2 . . . 85 ASP HB3 . c16368_2kko 1 1017 . 1 1 85 85 ASP C C 13 178.0 0.2 . 1 . . . 85 ASP C . c16368_2kko 1 1018 . 1 1 85 85 ASP CA C 13 57.1 0.2 . 1 . . . 85 ASP CA . c16368_2kko 1 1019 . 1 1 85 85 ASP CB C 13 38.9 0.2 . 1 . . . 85 ASP CB . c16368_2kko 1 1020 . 1 1 85 85 ASP N N 15 119.4 0.2 . 1 . . . 85 ASP N . c16368_2kko 1 1021 . 1 1 86 86 VAL H H 1 7.62 0.02 . 1 . . . 86 VAL H . c16368_2kko 1 1022 . 1 1 86 86 VAL HA H 1 3.48 0.02 . 1 . . . 86 VAL HA . c16368_2kko 1 1023 . 1 1 86 86 VAL HB H 1 2.20 0.02 . 1 . . . 86 VAL HB . c16368_2kko 1 1024 . 1 1 86 86 VAL HG11 H 1 1.17 0.02 . 2 . . . 86 VAL HG1 . c16368_2kko 1 1025 . 1 1 86 86 VAL HG12 H 1 1.17 0.02 . 2 . . . 86 VAL HG1 . c16368_2kko 1 1026 . 1 1 86 86 VAL HG13 H 1 1.17 0.02 . 2 . . . 86 VAL HG1 . c16368_2kko 1 1027 . 1 1 86 86 VAL HG21 H 1 1.00 0.02 . 2 . . . 86 VAL HG2 . c16368_2kko 1 1028 . 1 1 86 86 VAL HG22 H 1 1.00 0.02 . 2 . . . 86 VAL HG2 . c16368_2kko 1 1029 . 1 1 86 86 VAL HG23 H 1 1.00 0.02 . 2 . . . 86 VAL HG2 . c16368_2kko 1 1030 . 1 1 86 86 VAL C C 13 177.4 0.2 . 1 . . . 86 VAL C . c16368_2kko 1 1031 . 1 1 86 86 VAL CA C 13 66.8 0.2 . 1 . . . 86 VAL CA . c16368_2kko 1 1032 . 1 1 86 86 VAL CB C 13 31.3 0.2 . 1 . . . 86 VAL CB . c16368_2kko 1 1033 . 1 1 86 86 VAL CG1 C 13 22.0 0.2 . 2 . . . 86 VAL CG1 . c16368_2kko 1 1034 . 1 1 86 86 VAL CG2 C 13 23.6 0.2 . 2 . . . 86 VAL CG2 . c16368_2kko 1 1035 . 1 1 86 86 VAL N N 15 121.6 0.2 . 1 . . . 86 VAL N . c16368_2kko 1 1036 . 1 1 87 87 ALA H H 1 7.52 0.02 . 1 . . . 87 ALA H . c16368_2kko 1 1037 . 1 1 87 87 ALA HA H 1 4.11 0.02 . 1 . . . 87 ALA HA . c16368_2kko 1 1038 . 1 1 87 87 ALA HB1 H 1 1.59 0.02 . 1 . . . 87 ALA HB . c16368_2kko 1 1039 . 1 1 87 87 ALA HB2 H 1 1.59 0.02 . 1 . . . 87 ALA HB . c16368_2kko 1 1040 . 1 1 87 87 ALA HB3 H 1 1.59 0.02 . 1 . . . 87 ALA HB . c16368_2kko 1 1041 . 1 1 87 87 ALA C C 13 181.2 0.2 . 1 . . . 87 ALA C . c16368_2kko 1 1042 . 1 1 87 87 ALA CA C 13 55.8 0.2 . 1 . . . 87 ALA CA . c16368_2kko 1 1043 . 1 1 87 87 ALA CB C 13 17.6 0.2 . 1 . . . 87 ALA CB . c16368_2kko 1 1044 . 1 1 87 87 ALA N N 15 122.7 0.2 . 1 . . . 87 ALA N . c16368_2kko 1 1045 . 1 1 88 88 ARG H H 1 8.38 0.02 . 1 . . . 88 ARG H . c16368_2kko 1 1046 . 1 1 88 88 ARG HA H 1 4.09 0.02 . 1 . . . 88 ARG HA . c16368_2kko 1 1047 . 1 1 88 88 ARG HB2 H 1 1.85 0.02 . 2 . . . 88 ARG HB2 . c16368_2kko 1 1048 . 1 1 88 88 ARG HB3 H 1 2.08 0.02 . 2 . . . 88 ARG HB3 . c16368_2kko 1 1049 . 1 1 88 88 ARG HD2 H 1 3.26 0.02 . 2 . . . 88 ARG HD2 . c16368_2kko 1 1050 . 1 1 88 88 ARG HD3 H 1 3.26 0.02 . 2 . . . 88 ARG HD3 . c16368_2kko 1 1051 . 1 1 88 88 ARG HE H 1 7.56 0.02 . 1 . . . 88 ARG HE . c16368_2kko 1 1052 . 1 1 88 88 ARG HG2 H 1 1.63 0.02 . 2 . . . 88 ARG HG2 . c16368_2kko 1 1053 . 1 1 88 88 ARG HG3 H 1 1.95 0.02 . 2 . . . 88 ARG HG3 . c16368_2kko 1 1054 . 1 1 88 88 ARG C C 13 179.1 0.2 . 1 . . . 88 ARG C . c16368_2kko 1 1055 . 1 1 88 88 ARG CA C 13 59.6 0.2 . 1 . . . 88 ARG CA . c16368_2kko 1 1056 . 1 1 88 88 ARG CB C 13 30.5 0.2 . 1 . . . 88 ARG CB . c16368_2kko 1 1057 . 1 1 88 88 ARG CD C 13 43.6 0.2 . 1 . . . 88 ARG CD . c16368_2kko 1 1058 . 1 1 88 88 ARG CG C 13 28.5 0.2 . 1 . . . 88 ARG CG . c16368_2kko 1 1059 . 1 1 88 88 ARG N N 15 119.2 0.2 . 1 . . . 88 ARG N . c16368_2kko 1 1060 . 1 1 88 88 ARG NE N 15 84.4 0.2 . 1 . . . 88 ARG NE . c16368_2kko 1 1061 . 1 1 89 89 LEU H H 1 8.48 0.02 . 1 . . . 89 LEU H . c16368_2kko 1 1062 . 1 1 89 89 LEU HA H 1 4.04 0.02 . 1 . . . 89 LEU HA . c16368_2kko 1 1063 . 1 1 89 89 LEU HB2 H 1 1.55 0.02 . 2 . . . 89 LEU HB2 . c16368_2kko 1 1064 . 1 1 89 89 LEU HB3 H 1 1.55 0.02 . 2 . . . 89 LEU HB3 . c16368_2kko 1 1065 . 1 1 89 89 LEU HD11 H 1 0.84 0.02 . 1 . . . 89 LEU HD1 . c16368_2kko 1 1066 . 1 1 89 89 LEU HD12 H 1 0.84 0.02 . 1 . . . 89 LEU HD1 . c16368_2kko 1 1067 . 1 1 89 89 LEU HD13 H 1 0.84 0.02 . 1 . . . 89 LEU HD1 . c16368_2kko 1 1068 . 1 1 89 89 LEU HD21 H 1 0.89 0.02 . 1 . . . 89 LEU HD2 . c16368_2kko 1 1069 . 1 1 89 89 LEU HD22 H 1 0.89 0.02 . 1 . . . 89 LEU HD2 . c16368_2kko 1 1070 . 1 1 89 89 LEU HD23 H 1 0.89 0.02 . 1 . . . 89 LEU HD2 . c16368_2kko 1 1071 . 1 1 89 89 LEU C C 13 177.2 0.2 . 1 . . . 89 LEU C . c16368_2kko 1 1072 . 1 1 89 89 LEU CA C 13 58.3 0.2 . 1 . . . 89 LEU CA . c16368_2kko 1 1073 . 1 1 89 89 LEU CB C 13 41.3 0.2 . 1 . . . 89 LEU CB . c16368_2kko 1 1074 . 1 1 89 89 LEU CD1 C 13 24.7 0.2 . 1 . . . 89 LEU CD1 . c16368_2kko 1 1075 . 1 1 89 89 LEU CD2 C 13 27.0 0.2 . 1 . . . 89 LEU CD2 . c16368_2kko 1 1076 . 1 1 89 89 LEU N N 15 123.3 0.2 . 1 . . . 89 LEU N . c16368_2kko 1 1077 . 1 1 90 90 PHE H H 1 8.89 0.02 . 1 . . . 90 PHE H . c16368_2kko 1 1078 . 1 1 90 90 PHE HA H 1 4.38 0.02 . 1 . . . 90 PHE HA . c16368_2kko 1 1079 . 1 1 90 90 PHE HB2 H 1 3.07 0.02 . 2 . . . 90 PHE HB2 . c16368_2kko 1 1080 . 1 1 90 90 PHE HB3 H 1 3.19 0.02 . 2 . . . 90 PHE HB3 . c16368_2kko 1 1081 . 1 1 90 90 PHE HD1 H 1 7.13 0.02 . 3 . . . 90 PHE HD1 . c16368_2kko 1 1082 . 1 1 90 90 PHE HD2 H 1 7.13 0.02 . 3 . . . 90 PHE HD2 . c16368_2kko 1 1083 . 1 1 90 90 PHE HE1 H 1 7.25 0.02 . 3 . . . 90 PHE HE1 . c16368_2kko 1 1084 . 1 1 90 90 PHE HE2 H 1 7.25 0.02 . 3 . . . 90 PHE HE2 . c16368_2kko 1 1085 . 1 1 90 90 PHE HZ H 1 7.11 0.02 . 1 . . . 90 PHE HZ . c16368_2kko 1 1086 . 1 1 90 90 PHE C C 13 177.5 0.2 . 1 . . . 90 PHE C . c16368_2kko 1 1087 . 1 1 90 90 PHE CA C 13 59.4 0.2 . 1 . . . 90 PHE CA . c16368_2kko 1 1088 . 1 1 90 90 PHE CB C 13 38.6 0.2 . 1 . . . 90 PHE CB . c16368_2kko 1 1089 . 1 1 90 90 PHE CD1 C 13 131.0 0.2 . 3 . . . 90 PHE CD1 . c16368_2kko 1 1090 . 1 1 90 90 PHE CD2 C 13 131.0 0.2 . 3 . . . 90 PHE CD2 . c16368_2kko 1 1091 . 1 1 90 90 PHE CE1 C 13 131.1 0.2 . 3 . . . 90 PHE CE1 . c16368_2kko 1 1092 . 1 1 90 90 PHE CE2 C 13 131.1 0.2 . 3 . . . 90 PHE CE2 . c16368_2kko 1 1093 . 1 1 90 90 PHE CZ C 13 130.0 0.2 . 1 . . . 90 PHE CZ . c16368_2kko 1 1094 . 1 1 90 90 PHE N N 15 119.4 0.2 . 1 . . . 90 PHE N . c16368_2kko 1 1095 . 1 1 91 91 ALA H H 1 7.92 0.02 . 1 . . . 91 ALA H . c16368_2kko 1 1096 . 1 1 91 91 ALA HA H 1 3.94 0.02 . 1 . . . 91 ALA HA . c16368_2kko 1 1097 . 1 1 91 91 ALA HB1 H 1 1.46 0.02 . 1 . . . 91 ALA HB . c16368_2kko 1 1098 . 1 1 91 91 ALA HB2 H 1 1.46 0.02 . 1 . . . 91 ALA HB . c16368_2kko 1 1099 . 1 1 91 91 ALA HB3 H 1 1.46 0.02 . 1 . . . 91 ALA HB . c16368_2kko 1 1100 . 1 1 91 91 ALA C C 13 180.2 0.2 . 1 . . . 91 ALA C . c16368_2kko 1 1101 . 1 1 91 91 ALA CA C 13 55.1 0.2 . 1 . . . 91 ALA CA . c16368_2kko 1 1102 . 1 1 91 91 ALA CB C 13 18.0 0.2 . 1 . . . 91 ALA CB . c16368_2kko 1 1103 . 1 1 91 91 ALA N N 15 120.5 0.2 . 1 . . . 91 ALA N . c16368_2kko 1 1104 . 1 1 92 92 LEU H H 1 8.19 0.02 . 1 . . . 92 LEU H . c16368_2kko 1 1105 . 1 1 92 92 LEU HA H 1 4.30 0.02 . 1 . . . 92 LEU HA . c16368_2kko 1 1106 . 1 1 92 92 LEU HB2 H 1 1.67 0.02 . 2 . . . 92 LEU HB2 . c16368_2kko 1 1107 . 1 1 92 92 LEU HB3 H 1 1.82 0.02 . 2 . . . 92 LEU HB3 . c16368_2kko 1 1108 . 1 1 92 92 LEU HD11 H 1 0.97 0.02 . 1 . . . 92 LEU HD1 . c16368_2kko 1 1109 . 1 1 92 92 LEU HD12 H 1 0.97 0.02 . 1 . . . 92 LEU HD1 . c16368_2kko 1 1110 . 1 1 92 92 LEU HD13 H 1 0.97 0.02 . 1 . . . 92 LEU HD1 . c16368_2kko 1 1111 . 1 1 92 92 LEU HD21 H 1 0.89 0.02 . 1 . . . 92 LEU HD2 . c16368_2kko 1 1112 . 1 1 92 92 LEU HD22 H 1 0.89 0.02 . 1 . . . 92 LEU HD2 . c16368_2kko 1 1113 . 1 1 92 92 LEU HD23 H 1 0.89 0.02 . 1 . . . 92 LEU HD2 . c16368_2kko 1 1114 . 1 1 92 92 LEU HG H 1 1.54 0.02 . 1 . . . 92 LEU HG . c16368_2kko 1 1115 . 1 1 92 92 LEU C C 13 178.9 0.2 . 1 . . . 92 LEU C . c16368_2kko 1 1116 . 1 1 92 92 LEU CA C 13 57.5 0.2 . 1 . . . 92 LEU CA . c16368_2kko 1 1117 . 1 1 92 92 LEU CB C 13 42.1 0.2 . 1 . . . 92 LEU CB . c16368_2kko 1 1118 . 1 1 92 92 LEU CD1 C 13 22.8 0.2 . 1 . . . 92 LEU CD1 . c16368_2kko 1 1119 . 1 1 92 92 LEU CD2 C 13 25.8 0.2 . 1 . . . 92 LEU CD2 . c16368_2kko 1 1120 . 1 1 92 92 LEU CG C 13 27.4 0.2 . 1 . . . 92 LEU CG . c16368_2kko 1 1121 . 1 1 92 92 LEU N N 15 120.2 0.2 . 1 . . . 92 LEU N . c16368_2kko 1 1122 . 1 1 93 93 VAL H H 1 8.89 0.02 . 1 . . . 93 VAL H . c16368_2kko 1 1123 . 1 1 93 93 VAL HA H 1 3.81 0.02 . 1 . . . 93 VAL HA . c16368_2kko 1 1124 . 1 1 93 93 VAL HB H 1 2.12 0.02 . 1 . . . 93 VAL HB . c16368_2kko 1 1125 . 1 1 93 93 VAL HG11 H 1 1.09 0.02 . 2 . . . 93 VAL HG1 . c16368_2kko 1 1126 . 1 1 93 93 VAL HG12 H 1 1.09 0.02 . 2 . . . 93 VAL HG1 . c16368_2kko 1 1127 . 1 1 93 93 VAL HG13 H 1 1.09 0.02 . 2 . . . 93 VAL HG1 . c16368_2kko 1 1128 . 1 1 93 93 VAL HG21 H 1 0.98 0.02 . 2 . . . 93 VAL HG2 . c16368_2kko 1 1129 . 1 1 93 93 VAL HG22 H 1 0.98 0.02 . 2 . . . 93 VAL HG2 . c16368_2kko 1 1130 . 1 1 93 93 VAL HG23 H 1 0.98 0.02 . 2 . . . 93 VAL HG2 . c16368_2kko 1 1131 . 1 1 93 93 VAL C C 13 176.9 0.2 . 1 . . . 93 VAL C . c16368_2kko 1 1132 . 1 1 93 93 VAL CA C 13 66.0 0.2 . 1 . . . 93 VAL CA . c16368_2kko 1 1133 . 1 1 93 93 VAL CB C 13 31.2 0.2 . 1 . . . 93 VAL CB . c16368_2kko 1 1134 . 1 1 93 93 VAL CG1 C 13 22.5 0.2 . 2 . . . 93 VAL CG1 . c16368_2kko 1 1135 . 1 1 93 93 VAL CG2 C 13 23.2 0.2 . 2 . . . 93 VAL CG2 . c16368_2kko 1 1136 . 1 1 93 93 VAL N N 15 117.1 0.2 . 1 . . . 93 VAL N . c16368_2kko 1 1137 . 1 1 94 94 GLN H H 1 6.92 0.02 . 1 . . . 94 GLN H . c16368_2kko 1 1138 . 1 1 94 94 GLN HA H 1 3.79 0.02 . 1 . . . 94 GLN HA . c16368_2kko 1 1139 . 1 1 94 94 GLN HB2 H 1 2.00 0.02 . 2 . . . 94 GLN HB2 . c16368_2kko 1 1140 . 1 1 94 94 GLN HB3 H 1 2.10 0.02 . 2 . . . 94 GLN HB3 . c16368_2kko 1 1141 . 1 1 94 94 GLN HE21 H 1 5.37 0.02 . 2 . . . 94 GLN HE21 . c16368_2kko 1 1142 . 1 1 94 94 GLN HE22 H 1 6.38 0.02 . 2 . . . 94 GLN HE22 . c16368_2kko 1 1143 . 1 1 94 94 GLN HG2 H 1 1.63 0.02 . 2 . . . 94 GLN HG2 . c16368_2kko 1 1144 . 1 1 94 94 GLN HG3 H 1 2.12 0.02 . 2 . . . 94 GLN HG3 . c16368_2kko 1 1145 . 1 1 94 94 GLN C C 13 177.4 0.2 . 1 . . . 94 GLN C . c16368_2kko 1 1146 . 1 1 94 94 GLN CA C 13 60.0 0.2 . 1 . . . 94 GLN CA . c16368_2kko 1 1147 . 1 1 94 94 GLN CB C 13 30.3 0.2 . 1 . . . 94 GLN CB . c16368_2kko 1 1148 . 1 1 94 94 GLN CG C 13 35.9 0.2 . 1 . . . 94 GLN CG . c16368_2kko 1 1149 . 1 1 94 94 GLN N N 15 117.8 0.2 . 1 . . . 94 GLN N . c16368_2kko 1 1150 . 1 1 94 94 GLN NE2 N 15 111.3 0.2 . 1 . . . 94 GLN NE2 . c16368_2kko 1 1151 . 1 1 95 95 VAL H H 1 7.42 0.02 . 1 . . . 95 VAL H . c16368_2kko 1 1152 . 1 1 95 95 VAL HA H 1 3.76 0.02 . 1 . . . 95 VAL HA . c16368_2kko 1 1153 . 1 1 95 95 VAL HB H 1 2.37 0.02 . 1 . . . 95 VAL HB . c16368_2kko 1 1154 . 1 1 95 95 VAL HG11 H 1 0.96 0.02 . 1 . . . 95 VAL HG1 . c16368_2kko 1 1155 . 1 1 95 95 VAL HG12 H 1 0.96 0.02 . 1 . . . 95 VAL HG1 . c16368_2kko 1 1156 . 1 1 95 95 VAL HG13 H 1 0.96 0.02 . 1 . . . 95 VAL HG1 . c16368_2kko 1 1157 . 1 1 95 95 VAL HG21 H 1 1.08 0.02 . 1 . . . 95 VAL HG2 . c16368_2kko 1 1158 . 1 1 95 95 VAL HG22 H 1 1.08 0.02 . 1 . . . 95 VAL HG2 . c16368_2kko 1 1159 . 1 1 95 95 VAL HG23 H 1 1.08 0.02 . 1 . . . 95 VAL HG2 . c16368_2kko 1 1160 . 1 1 95 95 VAL C C 13 178.3 0.2 . 1 . . . 95 VAL C . c16368_2kko 1 1161 . 1 1 95 95 VAL CA C 13 66.6 0.2 . 1 . . . 95 VAL CA . c16368_2kko 1 1162 . 1 1 95 95 VAL CB C 13 31.9 0.2 . 1 . . . 95 VAL CB . c16368_2kko 1 1163 . 1 1 95 95 VAL CG1 C 13 21.0 0.2 . 1 . . . 95 VAL CG1 . c16368_2kko 1 1164 . 1 1 95 95 VAL CG2 C 13 22.6 0.2 . 1 . . . 95 VAL CG2 . c16368_2kko 1 1165 . 1 1 95 95 VAL N N 15 121.5 0.2 . 1 . . . 95 VAL N . c16368_2kko 1 1166 . 1 1 96 96 VAL H H 1 8.34 0.02 . 1 . . . 96 VAL H . c16368_2kko 1 1167 . 1 1 96 96 VAL HA H 1 3.81 0.02 . 1 . . . 96 VAL HA . c16368_2kko 1 1168 . 1 1 96 96 VAL HB H 1 2.09 0.02 . 1 . . . 96 VAL HB . c16368_2kko 1 1169 . 1 1 96 96 VAL HG11 H 1 0.84 0.02 . 1 . . . 96 VAL HG1 . c16368_2kko 1 1170 . 1 1 96 96 VAL HG12 H 1 0.84 0.02 . 1 . . . 96 VAL HG1 . c16368_2kko 1 1171 . 1 1 96 96 VAL HG13 H 1 0.84 0.02 . 1 . . . 96 VAL HG1 . c16368_2kko 1 1172 . 1 1 96 96 VAL HG21 H 1 0.99 0.02 . 1 . . . 96 VAL HG2 . c16368_2kko 1 1173 . 1 1 96 96 VAL HG22 H 1 0.99 0.02 . 1 . . . 96 VAL HG2 . c16368_2kko 1 1174 . 1 1 96 96 VAL HG23 H 1 0.99 0.02 . 1 . . . 96 VAL HG2 . c16368_2kko 1 1175 . 1 1 96 96 VAL C C 13 178.4 0.2 . 1 . . . 96 VAL C . c16368_2kko 1 1176 . 1 1 96 96 VAL CA C 13 66.1 0.2 . 1 . . . 96 VAL CA . c16368_2kko 1 1177 . 1 1 96 96 VAL CB C 13 32.2 0.2 . 1 . . . 96 VAL CB . c16368_2kko 1 1178 . 1 1 96 96 VAL CG1 C 13 21.5 0.2 . 1 . . . 96 VAL CG1 . c16368_2kko 1 1179 . 1 1 96 96 VAL CG2 C 13 23.6 0.2 . 1 . . . 96 VAL CG2 . c16368_2kko 1 1180 . 1 1 96 96 VAL N N 15 120.0 0.2 . 1 . . . 96 VAL N . c16368_2kko 1 1181 . 1 1 97 97 ALA H H 1 8.14 0.02 . 1 . . . 97 ALA H . c16368_2kko 1 1182 . 1 1 97 97 ALA HA H 1 4.01 0.02 . 1 . . . 97 ALA HA . c16368_2kko 1 1183 . 1 1 97 97 ALA HB1 H 1 1.46 0.02 . 1 . . . 97 ALA HB . c16368_2kko 1 1184 . 1 1 97 97 ALA HB2 H 1 1.46 0.02 . 1 . . . 97 ALA HB . c16368_2kko 1 1185 . 1 1 97 97 ALA HB3 H 1 1.46 0.02 . 1 . . . 97 ALA HB . c16368_2kko 1 1186 . 1 1 97 97 ALA C C 13 178.8 0.2 . 1 . . . 97 ALA C . c16368_2kko 1 1187 . 1 1 97 97 ALA CA C 13 54.9 0.2 . 1 . . . 97 ALA CA . c16368_2kko 1 1188 . 1 1 97 97 ALA CB C 13 19.9 0.2 . 1 . . . 97 ALA CB . c16368_2kko 1 1189 . 1 1 97 97 ALA N N 15 121.4 0.2 . 1 . . . 97 ALA N . c16368_2kko 1 1190 . 1 1 98 98 ASP H H 1 8.17 0.02 . 1 . . . 98 ASP H . c16368_2kko 1 1191 . 1 1 98 98 ASP HA H 1 4.32 0.02 . 1 . . . 98 ASP HA . c16368_2kko 1 1192 . 1 1 98 98 ASP HB2 H 1 2.73 0.02 . 2 . . . 98 ASP HB2 . c16368_2kko 1 1193 . 1 1 98 98 ASP HB3 H 1 2.82 0.02 . 2 . . . 98 ASP HB3 . c16368_2kko 1 1194 . 1 1 98 98 ASP C C 13 178.1 0.2 . 1 . . . 98 ASP C . c16368_2kko 1 1195 . 1 1 98 98 ASP CA C 13 57.1 0.2 . 1 . . . 98 ASP CA . c16368_2kko 1 1196 . 1 1 98 98 ASP CB C 13 41.8 0.2 . 1 . . . 98 ASP CB . c16368_2kko 1 1197 . 1 1 98 98 ASP N N 15 118.5 0.2 . 1 . . . 98 ASP N . c16368_2kko 1 1198 . 1 1 99 99 GLU H H 1 8.22 0.02 . 1 . . . 99 GLU H . c16368_2kko 1 1199 . 1 1 99 99 GLU HA H 1 4.00 0.02 . 1 . . . 99 GLU HA . c16368_2kko 1 1200 . 1 1 99 99 GLU HB2 H 1 1.77 0.02 . 2 . . . 99 GLU HB2 . c16368_2kko 1 1201 . 1 1 99 99 GLU HB3 H 1 2.00 0.02 . 2 . . . 99 GLU HB3 . c16368_2kko 1 1202 . 1 1 99 99 GLU HG2 H 1 2.00 0.02 . 2 . . . 99 GLU HG2 . c16368_2kko 1 1203 . 1 1 99 99 GLU HG3 H 1 2.23 0.02 . 2 . . . 99 GLU HG3 . c16368_2kko 1 1204 . 1 1 99 99 GLU C C 13 178.3 0.2 . 1 . . . 99 GLU C . c16368_2kko 1 1205 . 1 1 99 99 GLU CA C 13 58.3 0.2 . 1 . . . 99 GLU CA . c16368_2kko 1 1206 . 1 1 99 99 GLU CB C 13 29.8 0.2 . 1 . . . 99 GLU CB . c16368_2kko 1 1207 . 1 1 99 99 GLU CG C 13 35.4 0.2 . 1 . . . 99 GLU CG . c16368_2kko 1 1208 . 1 1 99 99 GLU N N 15 116.6 0.2 . 1 . . . 99 GLU N . c16368_2kko 1 1209 . 1 1 100 100 HIS H H 1 7.98 0.02 . 1 . . . 100 HIS H . c16368_2kko 1 1210 . 1 1 100 100 HIS HA H 1 4.60 0.02 . 1 . . . 100 HIS HA . c16368_2kko 1 1211 . 1 1 100 100 HIS HB2 H 1 3.14 0.02 . 2 . . . 100 HIS HB2 . c16368_2kko 1 1212 . 1 1 100 100 HIS HB3 H 1 3.42 0.02 . 2 . . . 100 HIS HB3 . c16368_2kko 1 1213 . 1 1 100 100 HIS HD2 H 1 7.16 0.02 . 1 . . . 100 HIS HD2 . c16368_2kko 1 1214 . 1 1 100 100 HIS C C 13 175.9 0.2 . 1 . . . 100 HIS C . c16368_2kko 1 1215 . 1 1 100 100 HIS CA C 13 57.5 0.2 . 1 . . . 100 HIS CA . c16368_2kko 1 1216 . 1 1 100 100 HIS CB C 13 30.8 0.2 . 1 . . . 100 HIS CB . c16368_2kko 1 1217 . 1 1 100 100 HIS CD2 C 13 121.1 0.2 . 1 . . . 100 HIS CD2 . c16368_2kko 1 1218 . 1 1 100 100 HIS N N 15 114.0 0.2 . 1 . . . 100 HIS N . c16368_2kko 1 1219 . 1 1 101 101 LEU H H 1 7.92 0.02 . 1 . . . 101 LEU H . c16368_2kko 1 1220 . 1 1 101 101 LEU HA H 1 4.37 0.02 . 1 . . . 101 LEU HA . c16368_2kko 1 1221 . 1 1 101 101 LEU HB2 H 1 1.40 0.02 . 2 . . . 101 LEU HB2 . c16368_2kko 1 1222 . 1 1 101 101 LEU HB3 H 1 1.99 0.02 . 2 . . . 101 LEU HB3 . c16368_2kko 1 1223 . 1 1 101 101 LEU HD11 H 1 0.87 0.02 . 1 . . . 101 LEU HD1 . c16368_2kko 1 1224 . 1 1 101 101 LEU HD12 H 1 0.87 0.02 . 1 . . . 101 LEU HD1 . c16368_2kko 1 1225 . 1 1 101 101 LEU HD13 H 1 0.87 0.02 . 1 . . . 101 LEU HD1 . c16368_2kko 1 1226 . 1 1 101 101 LEU HD21 H 1 0.80 0.02 . 1 . . . 101 LEU HD2 . c16368_2kko 1 1227 . 1 1 101 101 LEU HD22 H 1 0.80 0.02 . 1 . . . 101 LEU HD2 . c16368_2kko 1 1228 . 1 1 101 101 LEU HD23 H 1 0.80 0.02 . 1 . . . 101 LEU HD2 . c16368_2kko 1 1229 . 1 1 101 101 LEU HG H 1 1.67 0.02 . 1 . . . 101 LEU HG . c16368_2kko 1 1230 . 1 1 101 101 LEU C C 13 177.7 0.2 . 1 . . . 101 LEU C . c16368_2kko 1 1231 . 1 1 101 101 LEU CA C 13 55.9 0.2 . 1 . . . 101 LEU CA . c16368_2kko 1 1232 . 1 1 101 101 LEU CB C 13 42.1 0.2 . 1 . . . 101 LEU CB . c16368_2kko 1 1233 . 1 1 101 101 LEU CD1 C 13 26.3 0.2 . 1 . . . 101 LEU CD1 . c16368_2kko 1 1234 . 1 1 101 101 LEU CD2 C 13 22.8 0.2 . 1 . . . 101 LEU CD2 . c16368_2kko 1 1235 . 1 1 101 101 LEU CG C 13 27.3 0.2 . 1 . . . 101 LEU CG . c16368_2kko 1 1236 . 1 1 101 101 LEU N N 15 118.5 0.2 . 1 . . . 101 LEU N . c16368_2kko 1 1237 . 1 1 102 102 GLU H H 1 8.10 0.02 . 1 . . . 102 GLU H . c16368_2kko 1 1238 . 1 1 102 102 GLU HA H 1 4.16 0.02 . 1 . . . 102 GLU HA . c16368_2kko 1 1239 . 1 1 102 102 GLU HB2 H 1 1.94 0.02 . 2 . . . 102 GLU HB2 . c16368_2kko 1 1240 . 1 1 102 102 GLU HB3 H 1 1.94 0.02 . 2 . . . 102 GLU HB3 . c16368_2kko 1 1241 . 1 1 102 102 GLU HG2 H 1 2.14 0.02 . 2 . . . 102 GLU HG2 . c16368_2kko 1 1242 . 1 1 102 102 GLU HG3 H 1 2.14 0.02 . 2 . . . 102 GLU HG3 . c16368_2kko 1 1243 . 1 1 102 102 GLU C C 13 176.7 0.2 . 1 . . . 102 GLU C . c16368_2kko 1 1244 . 1 1 102 102 GLU CA C 13 57.0 0.2 . 1 . . . 102 GLU CA . c16368_2kko 1 1245 . 1 1 102 102 GLU CB C 13 29.9 0.2 . 1 . . . 102 GLU CB . c16368_2kko 1 1246 . 1 1 102 102 GLU CG C 13 35.9 0.2 . 1 . . . 102 GLU CG . c16368_2kko 1 1247 . 1 1 102 102 GLU N N 15 119.1 0.2 . 1 . . . 102 GLU N . c16368_2kko 1 1248 . 1 1 103 103 HIS H H 1 8.01 0.02 . 1 . . . 103 HIS H . c16368_2kko 1 1249 . 1 1 103 103 HIS HA H 1 4.52 0.02 . 1 . . . 103 HIS HA . c16368_2kko 1 1250 . 1 1 103 103 HIS HB2 H 1 3.03 0.02 . 2 . . . 103 HIS HB2 . c16368_2kko 1 1251 . 1 1 103 103 HIS HB3 H 1 3.03 0.02 . 2 . . . 103 HIS HB3 . c16368_2kko 1 1252 . 1 1 103 103 HIS CA C 13 56.1 0.2 . 1 . . . 103 HIS CA . c16368_2kko 1 1253 . 1 1 103 103 HIS CB C 13 29.7 0.2 . 1 . . . 103 HIS CB . c16368_2kko 1 1254 . 1 1 103 103 HIS N N 15 117.3 0.2 . 1 . . . 103 HIS N . c16368_2kko 1 1255 . 1 1 107 107 HIS HA H 1 4.56 0.02 . 1 . . . 107 HIS HA . c16368_2kko 1 1256 . 1 1 107 107 HIS HB2 H 1 3.03 0.02 . 2 . . . 107 HIS HB2 . c16368_2kko 1 1257 . 1 1 107 107 HIS HB3 H 1 3.17 0.02 . 2 . . . 107 HIS HB3 . c16368_2kko 1 1258 . 1 1 107 107 HIS C C 13 173.9 0.2 . 1 . . . 107 HIS C . c16368_2kko 1 1259 . 1 1 107 107 HIS CA C 13 55.9 0.2 . 1 . . . 107 HIS CA . c16368_2kko 1 1260 . 1 1 107 107 HIS CB C 13 30.2 0.2 . 1 . . . 107 HIS CB . c16368_2kko 1 1261 . 1 1 108 108 HIS H H 1 8.10 0.02 . 1 . . . 108 HIS H . c16368_2kko 1 1262 . 1 1 108 108 HIS HA H 1 4.41 0.02 . 1 . . . 108 HIS HA . c16368_2kko 1 1263 . 1 1 108 108 HIS HB2 H 1 3.04 0.02 . 2 . . . 108 HIS HB2 . c16368_2kko 1 1264 . 1 1 108 108 HIS HB3 H 1 3.04 0.02 . 2 . . . 108 HIS HB3 . c16368_2kko 1 1265 . 1 1 108 108 HIS CA C 13 57.3 0.2 . 1 . . . 108 HIS CA . c16368_2kko 1 1266 . 1 1 108 108 HIS CB C 13 30.4 0.2 . 1 . . . 108 HIS CB . c16368_2kko 1 1267 . 1 1 108 108 HIS N N 15 125.4 0.2 . 1 . . . 108 HIS N . c16368_2kko 1 stop_ save_ ######################### # Spectral peak lists # ######################### save_Nnoesy_peak_list _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode Nnoesy_peak_list _Spectral_peak_list.Entry_ID c16368_2kko _Spectral_peak_list.ID 1 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $NC_sample _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 3 _Spectral_peak_list.Experiment_name '3D 1H-15N NOESY' _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Details 750MHz _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 w3 Data Height Note G83N-E84H-G83H 101.756 8.938 6.986 183337 G83N-HA3-H 101.765 4.443 6.981 731559 G83N-V86QG1-G83H 101.768 1.154 6.981 534390 G83N-A82HA-G83H 101.775 3.938 6.985 540148 G83N-H-H 101.793 6.984 6.985 6270762 G83N-A82QB-G83H 101.798 0.944 6.983 1747992 G83N-HA2-H 101.808 4.105 6.985 954567 G83N-V86HB-G83H 101.850 2.182 6.986 578576 G83N-A82H-G83H 101.890 7.933 6.985 238821 T48N-A45HA-T48H 103.497 3.701 7.562 197687 T48N-A47QB-T48H 103.532 1.521 7.561 670485 A1H-H-H 103.533 4.206 7.561 910305 T48N-A47HA-T48H/T48N-T48HB-T48H(QU=0.990) T48N-H-H 103.533 7.561 7.561 2981268 ?-?-? 103.533 4.116 7.564 1191263 T48N-G49H-T48H 103.542 7.816 7.562 1090598 T48N-A47H-T48H 103.543 7.948 7.564 965111 T48N-HA-H 103.548 4.383 7.560 581384 T48N-QG2-H 103.555 1.105 7.563 977146 A1H-H-H 103.563 3.901 7.564 242472 T48N-T46HA-T48H/T48N-G49HA2-T48H(QU=0.642) G65N-L67QD2-G65H 104.433 0.834 7.281 300337 G65N-G66H-G65H 104.454 7.735 7.284 676241 ?-?-? 104.455 1.572 7.285 645557 G65N-H-H 104.462 7.289 7.285 3911651 A1H-H-H 104.462 3.995 7.285 1575779 G65N-S64QB-G65H/G65N-G65HA3-G65H(QU=0.936) G65N-S64HA-G65H 104.469 4.284 7.282 346744 G65N-S64H-G65H 104.473 8.655 7.285 692215 G65N-HA2-H 104.475 3.243 7.282 1027726 G65N-L67H-G65H 104.497 7.540 7.289 272881 G65N-G66HA3-G65H 104.514 3.732 7.299 262849 G66N-L67H-G66H 104.698 7.526 7.733 576622 G66N-G65HA2-G66H 104.704 3.236 7.722 259651 G66N-HA3-H 104.709 3.716 7.735 1123503 G66N-H-H 104.710 7.739 7.736 3280251 G66N-L67QD2-G66H 104.714 0.819 7.736 498631 G66N-L67QB-G66H 104.716 1.590 7.735 401337 G66N-G65H-G66H 104.721 7.289 7.735 696622 G66N-G65HA3-G66H 104.725 3.988 7.735 474322 G66N-S64HA-G66H 104.727 4.313 7.737 285163 ?-?-? 105.397 3.684 8.278 107220 ?-?-? 105.422 4.451 8.266 87429 G19N-V18QG1-G19H 105.441 0.878 8.279 306672 G19N-H-H 105.443 8.278 8.277 1478130 G19N-V18HB-G19H 105.450 2.397 8.270 273191 G19N-V18QG2-G19H 105.452 1.148 8.278 260906 G19N-QA-H 105.453 3.440 8.279 809142 G19N-V18H-G19H 105.456 7.974 8.275 322276 V68N-A82QB-V68H 106.361 0.973 6.897 401604 V68N-L67HA-V68H 106.393 4.297 6.901 189711 V68N-L67H-V68H 106.407 7.524 6.901 987290 V68N-K63HA-V68H 106.429 4.138 6.900 648334 V68N-L67QB-V68H 106.435 1.587 6.899 636526 A1H-H-H 106.438 0.647 6.898 1367350 V68N-V68QG1-V68H/V68N-V68QG2-V68H(QU=0.706) V68N-H-H 106.446 6.897 6.898 4219096 A1H-H-H 106.510 2.147 6.899 281644 V68N-K63HB3-V68H/V68N-V68HB-V68H(QU=0.928) V68N-V86QG1-V68H 106.512 1.146 6.897 205486 V68N-HA-H 106.535 5.182 6.903 249459 G37N-Q36HA-G37H 108.367 4.345 7.543 814624 G37N-E38H-G37H 108.371 8.133 7.554 729259 A1H-H-H 108.381 0.857 7.555 298782 G37N-L33QD2-G37H/G37N-L34QD2-G37H(QU=0.661) G37N-HA2-H 108.388 3.732 7.551 1575686 G37N-Q36HG2-G37H 108.391 2.431 7.553 545887 G37N-HA3-H 108.395 4.495 7.551 2062527 G37N-H-H 108.396 7.558 7.551 12934988 G37N-A35QB-G37H 108.407 1.590 7.552 325738 G37N-A35HA-G37H 108.425 4.074 7.553 297364 G37N-Q36HB2-G37H 108.430 2.112 7.545 551524 L67N-HA-H 110.514 4.335 7.530 162220 ?-?-? 110.521 4.133 7.526 145767 L67N-QB-H 110.541 1.581 7.522 1025358 L67N-H-H 110.549 7.531 7.533 1309175 L67N-QD1-H 110.554 0.705 7.523 593345 L67N-V68H-L67H 110.555 6.892 7.537 740616 L67N-G66H-L67H 110.559 7.721 7.537 561611 ?-?-? 110.564 0.767 7.524 556877 A1H-H-H 110.630 2.257 7.684 424101 Q29NE2-Q29HB3-Q29HE21/Q29NE2-Q29HG3-Q29HE21(QU=0.977) L67N-G66HA2-L67H 110.663 3.663 7.536 183008 Q29NE2-HG2-HE22 110.676 2.584 6.864 343613 Q29NE2-HG2-HE21 110.683 2.584 7.687 386671 A1H-H-H 110.734 2.245 6.859 369436 Q29NE2-Q29HB3-Q29HE22/Q29NE2-Q29HG3-Q29HE22(QU=0.996) Q29NE2-HE22-HE21 110.736 6.859 7.685 6670498 Q29NE2-HE21-HE22 110.737 7.688 6.861 5674114 G49N-HA2-H 111.109 3.868 7.826 1480502 G49N-H-H 111.110 7.834 7.827 4774020 G49N-T48QG2-G49H 111.121 1.139 7.829 282026 G49N-HA3-H 111.127 4.112 7.827 1733853 G49N-T48H-G49H 111.130 7.559 7.826 1271403 G49N-T48HA-G49H 111.138 4.366 7.820 343405 A1H-H-H 111.174 2.124 5.379 169331 Q94NE2-Q94HB3-Q94HE21/Q94NE2-Q94HG3-Q94HE21(QU=0.907) ?-?-? 111.190 1.517 7.829 240183 Q94NE2-A91HA-Q94HE22 111.200 3.917 6.377 176751 Q77NE2-HG3-HE21 111.249 2.115 7.212 846342 Q77NE2-QB-HE22 111.267 1.811 6.752 228389 Q77NE2-HG2-HE21 111.274 1.923 7.211 547806 Q77NE2-HG3-HE22 111.275 2.119 6.751 439877 Q77NE2-A70QB-Q77HE21 111.276 0.655 7.210 341993 Q94NE2-HE21-HE22 111.276 5.370 6.383 1530767 Q77NE2-HE22-HE21 111.282 6.749 7.211 11955068 Q77NE2-HE21-HE22 111.288 7.214 6.750 11375631 A1H-H-H 111.307 2.087 6.386 251815 Q94NE2-Q94HB3-Q94HE22/Q94NE2-Q94HG3-Q94HE22(QU=0.696) Q77NE2-A70QB-Q77HE22 111.340 0.648 6.748 269896 Q77NE2-HG2-HE22 111.422 1.899 6.741 270266 A1H-H-H 111.644 2.336 7.390 240583 Q14NE2-Q14QB-Q14HE21/Q14NE2-Q14HG2-Q14HE21(QU=0.996) A1H-H-H 111.789 2.338 6.791 218468 Q14NE2-Q14QB-Q14HE22/Q14NE2-Q14HG2-Q14HE22(QU=0.849) Q14NE2-HE21-HE22 111.854 7.390 6.792 1704222 Q14NE2-HE22-HE21 111.857 6.787 7.388 1420521 Q4NE2-HG2-HE22 112.237 2.381 7.601 441035 Q60NE2-HA-HE22 112.309 3.987 6.888 180880 Q4NE2-HE21-HE22 112.325 6.881 7.597 13657479 Q60NE2-HA-HE21 112.344 3.989 7.335 292388 Q60NE2-QB-HE21 112.370 2.128 7.332 167847 T46N-A43HA-T46H 112.387 4.274 8.097 492816 T46N-A45QB-T46H 112.387 1.400 8.087 1907616 T46N-A47H-T46H 112.387 7.942 8.090 1567841 T46N-QG2-H 112.388 1.284 8.087 1232120 T46N-HB-H 112.390 4.129 8.086 2210320 T46N-H-H 112.394 8.087 8.087 7797381 T46N-A45HA-T46H 112.396 3.741 8.084 504545 T46N-HA-H 112.397 3.916 8.086 1660788 Q60NE2-QG-HE21 112.398 2.457 7.335 575357 T46N-A45H-T46H 112.407 8.480 8.088 900600 Q60NE2-HE22-HE21 112.415 6.897 7.335 16483689 Q60NE2-HE21-HE22 112.417 7.338 6.897 15012055 Q36NE2-L33HG-Q36HE22 112.608 1.603 6.883 294773 Q36NE2-HG3-HE22 112.692 2.471 6.887 458219 S56N-V41QG1-S56H 112.698 0.902 8.451 341724 ?-?-? 112.715 3.902 8.448 1922778 ?-?-? 112.715 3.769 8.451 465188 S56N-HA-H 112.746 3.955 8.450 2504278 S56N-QB-H 112.747 4.018 8.438 1502704 S56N-A55H-S56H 112.750 8.869 8.452 835012 S56N-H-H 112.755 8.452 8.451 5661604 S56N-A55QB-S56H 112.763 1.174 8.451 1224669 S56N-A57H-S56H 112.779 8.090 8.451 1045807 Q36NE2-HG3-HE21 112.789 2.465 7.515 843972 S56N-A57QB-S56H 112.793 1.462 8.453 360656 S56N-L59HB3-S56H 112.795 1.643 8.452 267809 A1H-H-H 112.801 0.855 7.508 243047 Q36NE2-L33QD1-Q36HE21/Q36NE2-L33QD2-Q36HE21(QU=0.949) Q36NE2-L33HA-Q36HE22 112.806 4.138 6.874 192216 Q36NE2-L33HA-Q36HE21 112.820 4.140 7.518 258292 Q36NE2-L33HG-Q36HE21 112.820 1.568 7.511 247043 Q36NE2-HE22-HE21 112.826 6.877 7.516 16737813 Q36NE2-HE21-HE22 112.832 7.514 6.875 15549297 Q36N-H-H 113.309 7.595 7.600 10045502 Q36N-L33QD2-Q36H 113.315 0.851 7.596 389040 Q36N-L34HA-Q36H 113.317 4.506 7.603 455596 Q36N-HB2-H 113.318 2.107 7.601 1471502 Q36N-HA-H 113.323 4.357 7.599 1196940 Q36N-A35H-Q36H 113.330 8.166 7.599 1100378 Q36N-HG2-H 113.334 2.432 7.601 1930921 Q36N-A35QB-Q36H 113.338 1.565 7.602 1167680 Q36N-A35HA-Q36H 113.348 4.065 7.601 454790 N24ND2-HD21-HD22 113.608 7.853 7.098 956871 N24ND2-HD22-HD21 113.637 7.097 7.849 1023658 R71NE-HG3-HE 113.736 1.389 8.317 244719 A1H-H-H 113.756 1.662 8.310 229066 R71NE-R71HB2-R71HE/R71NE-R71HB3-R71HE(QU=0.517) R71NE-HD2-HE 113.762 2.845 8.317 658300 R71NE-HD3-HE 113.772 3.145 8.314 532455 R71NE-QH2-HE 113.772 6.901 8.318 535117 R71NE-QH1-HE 113.790 6.165 8.312 480173 A1H-H-H 113.980 0.849 7.251 327502 R39NE-L33QD1-R39HE/R39NE-L33QD2-R39HE(QU=0.803) R39NE-HD2-HE 113.994 3.275 7.257 292513 H100N-E99H-H100H 114.026 8.230 7.993 367167 H100N-HB2-H 114.032 3.150 7.993 335102 H100N-E99HB2-H100H 114.033 1.740 8.010 186114 R39NE-HD3-HE 114.034 2.984 7.258 429979 A1H-H-H 114.040 1.572 7.259 507209 R39NE-L33HG-R39HE/R39NE-R39HB2-R39HE(QU=0.606) H100N-E99HA-H100H 114.040 4.020 8.001 225353 H100N-HB3-H 114.056 3.431 7.998 289100 H100N-H-H 114.060 7.993 7.997 1768103 H100N-HA-H 114.102 4.600 7.992 250886 A1H-H-H 114.133 2.009 7.998 264461 H100N-E99HB3-H100H/H100N-E99HG2-H100H(QU=0.332) A1H-H-H 114.171 3.255 7.559 296923 R88NE-R88HD2-R88HE/R88NE-R88HD3-R88HE(QU=0.997) L22N-H-H 114.191 7.339 7.338 1761056 A1H-H-H 114.214 1.928 7.337 1061182 L22N-L22HB3-L22H/L22N-L22HG-L22H(QU=0.517) ?-?-? 114.223 0.812 7.340 319811 A1H-H-H 114.228 1.590 7.338 901061 L22N-A21QB-L22H/L22N-L22HB2-L22H(QU=0.876) A1H-H-H 114.238 3.442 7.337 292500 L22N-G19QA-L22H/L22N-G19QA-L22H(QU=0.432) L22N-HA-H 114.243 4.146 7.338 337615 A1H-H-H 114.247 0.663 7.337 688596 L22N-L22QD1-L22H/L22N-L22QD2-L22H(QU=0.673) L22N-A21H-L22H 114.259 7.641 7.337 564679 L22N-A23H-L22H 114.265 7.176 7.338 639299 N58ND2-T54QG2-N58HD22 114.391 1.209 6.678 202864 ?-?-? 114.400 1.951 6.674 84843 N58ND2-HD21-HD22 114.402 7.712 6.684 483806 N58ND2-HD22-HD21 114.408 6.680 7.717 567894 A1H-H-H 114.419 1.187 7.707 192623 N58ND2-T54QG2-N58HD21/N58ND2-A55QB-N58HD21(QU=0.205) R80N-QD-H 114.463 2.979 8.731 162804 ?-?-? 114.463 2.089 6.648 86281 R80N-V68HA-R80H 114.503 5.160 8.730 295438 A1H-H-H 114.514 2.594 8.730 241569 R80N-Y79HB2-R80H/R80N-Y79HB3-R80H(QU=0.945) A1H-H-H 114.526 2.151 8.734 227587 R80N-V68HB-R80H/R80N-E69HG2-R80H(QU=0.521) R80N-H-H 114.532 8.731 8.730 1687737 R80N-Y79HA-R80H 114.539 5.411 8.731 794299 ?-?-? 114.543 8.885 8.732 317803 A1H-H-H 114.584 1.619 8.728 516256 R80N-R80HB2-R80H/R80N-R80HG3-R80H(QU=0.786) A1H-H-H 114.624 0.640 8.730 276990 R80N-V68QG1-R80H/R80N-V68QG2-R80H(QU=0.674) R80N-HG2-H 114.630 1.178 8.728 267139 ?-?-? 114.678 4.998 8.719 170967 T53N-N51HB3-T53H 115.756 3.068 8.235 188837 T53N-H-H 115.837 8.240 8.236 6302216 T53N-QG2-H 115.844 1.210 8.235 807217 R80NE-HG2-HE 115.844 1.213 7.354 257563 T53N-L52QB-T53H 115.849 1.661 8.235 1516630 T53N-L52HA-T53H 115.850 3.747 8.226 337062 T53N-HA-H 115.856 3.872 8.234 1290956 T53N-HB-H 115.857 4.156 8.235 1832672 T53N-T54H-T53H 115.858 8.427 8.235 1321851 T53N-L52H-T53H 115.868 8.572 8.233 809810 R80NE-QD-HE 115.869 2.986 7.351 1309954 R80NE-HB3-HE 115.873 1.925 7.354 274361 ?-?-? 115.875 6.407 7.353 391351 R80NE-E69HG2-R80HE 115.875 2.154 7.358 176747 A1H-H-H 115.889 1.631 7.356 494100 R80NE-R80HB2-R80HE/R80NE-R80HG3-R80HE(QU=0.949) R80NE-HE-HE 115.890 7.353 7.354 3455162 ?-?-? 115.920 4.585 8.239 159309 T53N-N51HB2-T53H 115.930 2.676 8.241 164641 E99N-V95QG1-E99H 116.515 0.963 8.248 215241 E99N-D98HA-E99H 116.515 4.317 8.242 177655 E99N-D98HB2-E99H 116.568 2.735 8.235 475084 E99N-H-H 116.580 8.236 8.236 3042908 E99N-HG3-H 116.584 2.208 8.228 471856 E99N-HB3-H 116.599 2.003 8.232 1135430 E99N-D98HB3-E99H 116.616 2.816 8.237 464214 E99N-HA-H 116.627 4.023 8.234 492337 E99N-HB2-H 116.699 1.778 8.230 517028 E99N-H100H-E99H 116.700 7.991 8.237 534780 E99N-V95HA-E99H 116.720 3.779 8.244 160654 ?-?-? 116.782 1.023 7.455 416867 N24N-A23H-N24H 116.791 7.162 7.452 717132 A1H-H-H 116.792 4.738 7.452 1493644 N24N-A23HA-N24H/N24N-N24HA-N24H(QU=0.940) A1H-H-H 116.795 7.454 7.453 9473252 R17N-R17H-R17H/N24N-N24H-N24H(QU=0.892) N24N-HB2-H 116.795 2.312 7.452 765348 A1H-H-H 116.800 1.337 7.453 1507391 R17N-A16QB-R17H/N24N-A23QB-N24H(QU=0.712) D32N-Q29HA-D32H 116.818 3.904 7.962 217862 D32N-L31HA-D32H 116.818 3.537 7.962 218820 N24N-HB3-H 116.825 2.949 7.451 570918 D32N-L31HB2-D32H 116.892 0.614 7.957 435590 ?-?-? 116.892 4.232 7.505 166036 D32N-QB-H 116.912 2.737 7.962 1380787 A1H-H-H 116.914 7.509 7.960 526667 D32N-I30H-D32H/D32N-L31H-D32H(QU=0.951) R17N-HA-H 116.926 3.906 7.497 360323 ?-?-? 116.926 1.875 7.497 559542 D32N-L33H-D32H 116.935 7.357 7.961 635228 D32N-L12QD2-D32H 116.944 0.818 7.961 277029 R17N-QB-H 116.955 2.124 7.488 583844 D32N-L31HB3-D32H 116.963 1.232 7.960 411017 R17N-V18H-R17H 116.965 7.967 7.490 432291 R17N-A16H-R17H 116.965 8.071 7.491 404162 R17N-QG-H 116.971 1.644 7.494 511635 D32N-F90HZ-D32H 116.973 7.137 7.970 312852 D32N-HA-H 116.974 4.287 7.957 637056 D32N-H-H 116.976 7.961 7.962 2640416 R17N-QD-H 116.985 3.281 7.490 306276 ?-?-? 117.077 8.268 7.507 112591 V93N-HA-H 117.120 3.807 8.907 511072 V93N-Q94H-V93H 117.139 6.926 8.904 428311 V93N-H-H 117.148 8.905 8.904 3523582 V93N-L92H-V93H 117.150 8.204 8.904 606551 V93N-QG1-H 117.162 1.093 8.903 1385119 A1H-H-H 117.175 0.868 8.903 856966 V93N-L89QD2-V93H/V93N-L92QD2-V93H(QU=0.755) V93N-L92HA-V93H 117.184 4.315 8.902 213853 A1H-H-H 117.185 2.120 8.903 971301 V93N-V93HB-V93H/V93N-Q94HG3-V93H(QU=0.229) V93N-Q94HG2-V93H 117.187 1.617 8.905 383637 V93N-A91QB-V93H 117.188 1.457 8.906 253376 V93N-L92HB3-V93H 117.188 1.818 8.900 375497 H103N-QB-H 117.322 3.025 8.014 333043 ?-?-? 117.465 3.672 7.636 110976 A1H-H-H 117.499 4.480 7.982 670336 N58N-N58HA-N58H/H103N-H103HA-H103H(QU=0.202) N58N-A57QB-N58H 117.545 1.471 7.976 1084663 N58N-HB3-H 117.545 2.625 7.979 502661 L28N-R27H-L28H 117.548 7.950 7.653 344676 L28N-HA-H 117.555 3.953 7.644 278982 N58N-A57H-N58H 117.556 8.108 7.976 718637 ?-?-? 117.556 4.016 7.978 286386 N58N-A57HA-N58H 117.597 4.137 7.972 387321 N58N-L59H-N58H 117.602 8.532 7.975 536254 L28N-QD2-H 117.615 1.020 7.647 575955 L28N-Q29H-L28H 117.615 8.095 7.647 241657 A1H-H-H 117.629 2.075 7.652 836288 L28N-R27HB3-L28H/L28N-L28HG-L28H(QU=0.779) L28N-HB2-H 117.639 1.511 7.648 353537 L28N-H-H 117.640 7.652 7.651 1434027 N58N-H-H 117.666 7.976 7.971 3169229 ?-?-? 117.704 0.654 7.957 280673 ?-?-? 117.707 4.097 7.650 146718 R27N-HA-H 117.717 3.719 7.942 398598 S64N-QB-H 117.724 4.017 8.656 2543246 S64N-H-H 117.729 8.654 8.656 5049734 S64N-HA-H 117.730 4.285 8.655 1118974 S64N-K63HA-S64H 117.731 4.131 8.643 370905 S64N-G65H-S64H 117.736 7.288 8.657 742016 S64N-K63HB3-S64H 117.740 2.163 8.655 684882 S64N-K63QG-S64H 117.741 1.578 8.652 508139 N58N-HB2-H 117.743 2.087 7.961 794867 S64N-K63HB2-S64H 117.748 1.749 8.657 396413 A1H-H-H 117.753 0.850 8.305 726606 L34N-L33QD2-L34H/L34N-L34QD2-L34H(QU=0.969) A1H-H-H 117.755 1.711 8.303 1188792 L34N-L33HB3-L34H/L34N-L34HB3-L34H(QU=0.779) A1H-H-H 117.762 0.549 8.303 511902 L34N-I30QG2-L34H/L34N-L34QD1-L34H(QU=0.763) ?-?-? 117.768 3.519 8.303 156917 L34N-H-H 117.770 8.302 8.306 1763815 L34N-L33H-L34H 117.786 7.351 8.309 437639 L34N-HA-H 117.842 4.480 8.294 259400 Q94N-V95H-Q94H 117.849 7.423 6.920 409257 ?-?-? 117.870 1.399 8.296 243896 A1H-H-H 117.886 1.076 6.923 830987 Q94N-V93QG1-Q94H/Q94N-V95QG2-Q94H(QU=0.531) R27N-L28H-R27H 117.888 7.659 7.942 624092 A1H-H-H 117.888 2.104 6.925 1354488 Q94N-Q94HB3-Q94H/Q94N-Q94HG3-Q94H(QU=0.806) Q94N-H-H 117.895 6.924 6.925 2175972 A1H-H-H 117.895 3.808 6.924 660260 Q94N-V93HA-Q94H/Q94N-Q94HA-Q94H(QU=0.887) Q94N-HG2-H 117.899 1.628 6.923 410318 R27N-HB3-H 117.920 2.045 7.942 837066 Q94N-V93H-Q94H 117.934 8.901 6.922 484742 R27N-HB2-H 117.942 1.812 7.941 859843 ?-?-? 117.960 4.309 8.792 135894 T75N-G74HA3-T75H 117.961 4.205 8.793 278317 N51N-T54H-N51H 117.966 8.423 8.053 187435 T75N-QG2-H 117.968 1.216 8.792 244006 N51N-M50HB2-N51H 117.988 1.739 8.053 547764 T75N-H-H 117.989 8.782 8.791 177590 N51N-HB3-H 118.007 3.071 8.054 501116 N51N-HB2-H 118.008 2.673 8.052 853939 A1H-H-H 118.008 1.201 8.051 545388 N51N-T54QG2-N51H/N51N-A55QB-N51H(QU=0.628) N51N-M50HB3-N51H 118.016 1.948 8.052 601039 N51N-A55HA-N51H 118.023 4.005 8.056 596171 T75N-G74HA2-T75H 118.029 3.705 8.790 246523 A1H-H-H 118.037 4.561 8.054 2925162 N51N-M50HA-N51H/N51N-N51HA-N51H(QU=0.821) R27N-H-H 118.042 7.956 7.947 3088644 N51N-H-H 118.049 8.053 8.054 5569986 A1H-H-H 118.164 3.447 7.169 270563 A23N-G19QA-A23H/A23N-G19QA-A23H(QU=0.798) A23N-L22HB3-A23H 118.171 1.919 7.166 417481 A23N-H-H 118.187 7.171 7.168 5222257 A23N-QB-H 118.188 1.350 7.168 2271471 A1H-H-H 118.190 0.666 7.161 248120 A23N-L22QD1-A23H/A23N-L22QD2-A23H(QU=0.651) A23N-L22H-A23H 118.191 7.354 7.165 909640 A23N-K20HA-A23H 118.193 3.721 7.166 441722 A23N-HA-H 118.195 4.731 7.166 601535 A23N-A21H-A23H 118.200 7.630 7.173 383368 A23N-N24H-A23H 118.205 7.441 7.162 632796 A23N-L22HA-A23H 118.211 4.142 7.167 255464 A1H-H-H 118.224 1.588 7.168 438120 A23N-A21QB-A23H/A23N-L22HB2-A23H(QU=0.783) L101N-HA-H 118.484 4.350 7.933 547791 G74N-E73HA-G74H 118.496 4.493 9.181 223462 L101N-H100HB3-L101H 118.521 3.410 7.936 265758 D98N-HB2-H 118.536 2.739 8.186 1090192 D98N-HB3-H 118.536 2.826 8.188 1088013 D98N-V15QG1-D98H 118.538 0.935 8.191 459051 G74N-HA2-H 118.555 3.692 9.202 197219 L101N-QD2-H 118.559 0.825 7.927 521869 L101N-E102H-L101H 118.560 8.111 7.934 576225 D98N-HA-H 118.563 4.341 8.184 605553 L101N-HB2-H 118.579 1.425 7.935 426729 G74N-HA3-H 118.588 4.172 9.195 280961 A1H-H-H 118.589 3.765 8.186 438217 D98N-Q94HA-D98H/D98N-V95HA-D98H(QU=0.461) L33N-D32HA-L33H 118.591 4.305 7.350 204194 L33N-D32H-L33H 118.598 7.969 7.354 600555 ?-?-? 118.599 3.914 7.541 111345 A1H-H-H 118.604 0.615 7.533 894805 I30N-I30QG2-I30H/I30N-I30HG12-I30H(QU=0.921) L33N-D32QB-L33H 118.606 2.724 7.353 745332 ?-?-? 118.614 3.693 7.542 89734 A1H-H-H 118.616 1.706 7.354 1720839 L33N-L33HB2-L33H/L33N-L33HB3-L33H(QU=0.589) L33N-H-H 118.624 7.357 7.355 3610976 A1H-H-H 118.626 0.845 7.354 780373 L33N-L33QD1-L33H/L33N-L33QD2-L33H(QU=0.994) L33N-L34H-L33H 118.626 8.308 7.356 600244 L33N-HA-H 118.628 4.139 7.357 748224 I30N-Q29H-I30H 118.639 8.128 7.540 243872 A1H-H-H 118.652 1.907 7.539 879554 I30N-I30HB-I30H/I30N-I30HG13-I30H(QU=0.794) ?-?-? 118.656 3.340 7.360 134053 A1H-H-H 118.666 2.243 7.539 377116 I30N-Q29HB3-I30H/I30N-Q29HG3-I30H(QU=0.207) L12N-HA-H 118.677 4.033 8.490 482133 ?-?-? 118.677 7.985 8.492 656288 K20N-A21H-K20H 118.680 7.668 8.256 484155 K20N-G19QA-K20H 118.689 3.432 8.264 435145 A1H-H-H 118.697 1.354 8.256 912506 K20N-K20HG2-K20H/K20N-A23QB-K20H(QU=0.950) L12N-L11H-L12H 118.698 8.076 8.489 776166 L12N-HG-H 118.698 1.930 8.490 1564144 A1H-H-H 118.708 0.853 8.492 917309 L12N-L11QD1-L12H/L12N-L12QD1-L12H/L12N-L12QD2-L12H(QU=0.639) K20N-HA-H 118.714 3.714 8.255 666668 L12N-HB2-H 118.715 1.512 8.490 742596 I30N-H-H 118.715 7.541 7.536 1360790 L12N-H-H 118.717 8.494 8.489 2598825 K20N-QB-H 118.724 1.852 8.261 1398650 K20N-HG3-H 118.738 1.562 8.255 596104 L12N-L11HB2-L12H 118.755 1.678 8.498 370897 L12N-L11HA-L12H 118.771 4.090 8.488 586426 I30N-HA-H 118.777 3.333 7.523 159197 Q60N-A61QB-Q60H 118.814 1.483 8.203 681711 A1H-H-H 118.874 1.441 7.625 249387 Q14N-A10QB-Q14H/Q14N-A97QB-Q14H(QU=0.678) Q60N-HA-H 118.895 4.013 8.205 912183 Q14N-H-H 118.899 7.633 7.630 2712783 Q14N-L101QD1-Q14H 118.900 0.886 7.632 277798 Q60N-L59H-Q60H 118.901 8.541 8.207 725893 Q60N-QB-H 118.924 2.164 8.208 2069414 ?-?-? 118.924 4.129 7.634 410871 Q14N-HA-H 118.933 4.220 7.632 613349 A1H-H-H 118.941 0.259 8.207 268138 Q60N-L59QD1-Q60H/Q60N-L59QD2-Q60H(QU=0.563) Q60N-L59HB2-Q60H 118.942 0.586 8.206 340057 Q14N-D13HB2-Q14H 118.951 2.621 7.631 384096 Q60N-QG-H 118.951 2.461 8.207 913508 Q14N-HG2-H 118.962 2.326 7.631 856906 L62N-HA-H 118.973 3.979 7.832 372738 Q60N-L59HB3-Q60H 118.974 1.640 8.212 528298 Q14N-D13H-Q14H 118.984 8.004 7.631 650813 Q14N-HG3-H 118.988 2.557 7.636 356105 Q29N-L28HA-Q29H 119.004 3.929 8.118 491783 Q14N-V15H-Q14H 119.007 8.488 7.632 613390 L62N-HB3-H 119.024 2.128 7.834 612302 A1H-H-H 119.024 0.645 7.830 359990 L62N-L62QD2-L62H/L62N-V68QG2-L62H(QU=0.268) L62N-HG-H 119.033 1.718 7.832 638717 L62N-A61H-L62H 119.035 7.601 7.830 460104 L62N-QD1-H 119.041 0.782 7.830 732853 L62N-K63H-L62H 119.041 8.597 7.834 463581 L62N-A61QB-L62H 119.042 1.473 7.832 630534 ?-?-? 119.054 4.419 7.629 175369 E42N-HA-H 119.055 3.893 9.641 814259 E42N-V41H-E42H 119.059 8.427 9.639 428661 L62N-H-H 119.060 7.835 7.833 2386187 E42N-V41QG1-E42H 119.065 0.902 9.642 1082716 E42N-QB-H 119.065 2.024 9.641 1841881 E42N-H-H 119.071 9.646 9.642 5699491 E42N-A43H-E42H 119.079 6.868 9.638 760130 E42N-V41HA-E42H 119.080 3.429 9.648 206591 E42N-A43QB-E42H 119.084 1.651 9.642 243388 E42N-HG3-H 119.085 2.482 9.642 367995 E42N-A40QB-E42H 119.093 1.282 9.640 695208 E42N-HG2-H 119.094 2.271 9.645 545969 E102N-L101HB2-E102H 119.094 1.411 8.106 518196 E102N-L101HA-E102H 119.106 4.352 8.103 974442 E102N-HA-H 119.112 4.147 8.112 1085183 ?-?-? 119.138 1.900 8.382 823412 L62N-A61HA-L62H 119.139 4.225 7.825 215887 R88N-D85HA-R88H 119.158 4.309 8.386 246956 R88N-H-H 119.158 8.385 8.382 2987620 R88N-HB3-H 119.160 2.081 8.382 867531 R88N-A87H-R88H 119.172 7.536 8.383 690337 ?-?-? 119.188 3.021 7.818 64883 A1H-H-H 119.190 0.899 8.380 332279 R88N-I81QG2-R88H/R88N-L92QD2-R88H(QU=0.944) A1H-H-H 119.191 1.608 8.382 1298816 R88N-A87QB-R88H/R88N-R88HG2-R88H(QU=0.826) A1H-H-H 119.198 4.102 8.383 959819 R88N-A87HA-R88H/R88N-R88HA-R88H(QU=0.978) Q29N-L12QD1-Q29H 119.215 0.856 8.115 559125 Q29N-HG2-H 119.255 2.574 8.124 564691 Q29N-HA-H 119.303 3.883 8.119 686250 A1H-H-H 119.307 2.132 8.117 1877488 Q29N-Q29HB2-Q29H/E38N-E38QG-E38H(QU=0.254) M50N-A45HA-M50H 119.313 3.736 7.940 911172 M50N-HG3-H 119.328 2.592 7.940 590850 M50N-HG2-H 119.331 2.387 7.940 786948 M50N-G49HA2-M50H 119.337 3.855 7.935 906768 F90N-HA-H 119.338 4.382 8.890 421421 M50N-HA-H 119.346 4.555 7.938 1094513 A1H-H-H 119.352 8.120 8.114 8414031 Q29N-Q29H-Q29H/E38N-E38H-E38H/E102N-E102H-E102H(QU=0.504) F90N-A91H-F90H 119.367 7.922 8.886 355749 Q29N-L28H-Q29H 119.377 7.618 8.112 475297 A1H-H-H 119.377 7.531 8.118 818175 Q29N-I30H-Q29H/E38N-G37H-E38H(QU=0.586) F90N-L89QB-F90H 119.378 1.516 8.888 506135 M50N-G49HA3-M50H 119.379 4.122 7.943 1222885 D85N-HA-H 119.381 4.318 8.961 466781 D85N-V86QG2-D85H 119.382 0.976 8.958 462618 D85N-E84HB3-D85H 119.392 2.097 8.962 345277 F90N-L89H-F90H 119.393 8.493 8.893 226750 A1H-H-H 119.399 4.088 8.889 320992 F90N-A87HA-F90H/F90N-R88HA-F90H(QU=0.742) D85N-E84HA-D85H 119.400 4.116 8.957 368017 E38N-QB-H 119.404 1.939 8.114 2402913 F90N-HB2-H 119.415 3.083 8.891 726027 F90N-HB3-H 119.415 3.190 8.891 511295 M50N-H-H 119.435 7.945 7.943 6451976 M50N-HB2-H 119.442 1.738 7.938 840612 D85N-E84QG-D85H 119.442 2.352 8.963 245857 D85N-QB-H 119.442 2.613 8.959 675849 D85N-V86H-D85H 119.450 7.623 8.955 558327 F90N-L89QD2-F90H 119.458 0.913 8.892 492037 A1H-H-H 119.477 1.148 7.939 431368 M50N-T48QG2-M50H/M50N-A55QB-M50H(QU=0.595) A1H-H-H 119.482 1.962 7.950 910886 M50N-M50HB3-M50H/M50N-M50QE-M50H(QU=0.564) D13N-L12HB2-D13H 119.491 1.547 7.983 351206 D13N-L11HA-D13H 119.499 4.081 7.989 548641 D13N-L12H-D13H 119.521 8.488 7.992 1200242 E38N-HA-H 119.533 4.815 8.116 745196 D13N-A10HA-D13H 119.537 4.206 7.993 634167 D13N-L12HB3-D13H 119.538 1.933 7.990 914943 A1H-H-H 119.538 0.860 7.994 493001 D13N-L11QD1-D13H/D13N-L12QD1-D13H(QU=0.971) D13N-Q14H-D13H 119.542 7.634 7.992 1234834 D13N-H-H 119.544 7.989 7.989 7564724 D13N-HA-H 119.545 4.424 7.990 1122744 D13N-HB2-H 119.545 2.644 7.989 1277682 D13N-HB3-H 119.552 2.841 7.991 1600330 E38N-G37HA2-E38H 119.556 3.732 8.117 2039022 E38N-G37HA3-E38H 119.567 4.498 8.119 1780472 E38N-R39H-E38H 119.595 8.603 8.120 263443 L31N-L62QD1-L31H 119.866 0.794 7.511 306654 A1H-H-H 119.867 1.893 7.508 400507 L31N-I30HB-L31H/L31N-I30HG13-L31H(QU=0.363) L31N-HA-H 119.905 3.527 7.508 210045 L31N-H-H 119.919 7.514 7.505 2441598 A1H-H-H 119.945 1.242 7.510 1032200 L31N-L31HB3-L31H/L31N-L31HG-L31H(QU=0.671) L31N-D32H-L31H 119.973 7.957 7.508 472222 L31N-L28HA-L31H 119.981 3.964 7.508 248039 V96N-V95HB-V96H 119.992 2.369 8.338 291077 A1H-H-H 120.002 0.608 7.509 1033965 L31N-I30QG2-L31H/L31N-L31HB2-L31H(QU=0.895) V96N-V95H-V96H 120.014 7.424 8.332 429151 A1H-H-H 120.024 3.799 8.335 666594 V96N-Q94HA-V96H/V96N-V95HA-V96H/V96N-V96HA-V96H(QU=0.974) A1H-H-H 120.025 0.971 8.336 1408449 V96N-V95QG1-V96H/V96N-V96QG2-V96H(QU=0.918) V96N-HB-H 120.039 2.095 8.336 632018 A1H-H-H 120.042 1.678 8.682 507288 R71N-R71HB2-R71H/R71N-R71HB3-R71H(QU=0.801) R71N-HG3-H 120.051 1.426 8.676 366631 R71N-HG2-H 120.071 1.321 8.678 238802 R71N-HA-H 120.077 4.634 8.681 444452 R71N-H-H 120.085 8.683 8.679 3551371 R71N-Y78H-R71H 120.089 8.896 8.675 497333 R71N-A70QB-R71H 120.094 0.653 8.679 974659 R71N-A70HA-R71H 120.098 4.981 8.678 1512461 R71N-Y79HA-R71H 120.115 5.408 8.681 218170 ?-?-? 120.232 3.916 8.197 164191 ?-?-? 120.240 4.054 8.192 191417 L92N-HB2-H 120.250 1.652 8.196 918215 L92N-H-H 120.255 8.203 8.196 3449150 L92N-HB3-H 120.256 1.829 8.198 719061 L92N-HA-H 120.257 4.307 8.197 655639 A10N-HA-H 120.263 4.169 7.920 2151566 L92N-A91H-L92H 120.266 7.919 8.196 749103 A1H-H-H 120.269 8.900 8.195 754225 L92N-F90H-L92H/L92N-V93H-L92H(QU=0.960) A1H-H-H 120.275 8.077 7.920 2981090 A10N-A9H-A10H/A10N-L11H-A10H(QU=0.757) A1H-H-H 120.278 1.452 7.922 6052918 A10N-A10QB-A10H/A91N-A91QB-A91H(QU=0.654) L92N-HG-H 120.303 1.506 8.199 1003254 L92N-QD2-H 120.322 0.914 8.197 896179 A1H-H-H 120.342 4.098 8.938 482053 E84N-G83HA2-E84H/E84N-E84HA-E84H(QU=0.853) E84N-HB3-H 120.345 2.088 8.942 422924 A1H-H-H 120.349 8.486 7.928 305136 A10N-L12H-A10H/A91N-L89H-A91H(QU=0.709) A1H-H-H 120.397 3.940 7.925 1280401 A10N-A9HA-A10H/A91N-A91HA-A91H(QU=0.962) A1H-H-H 120.403 7.941 7.926 11159790 A10N-A10H-A10H/A91N-A91H-A91H(QU=0.840) E69N-H-H 120.425 8.893 8.892 1688467 ?-?-? 120.430 4.156 8.885 244851 Q4N-HB2-H 120.431 2.045 8.559 197783 A1H-H-H 120.436 0.892 7.922 573901 A10N-L11QD1-A10H/A91N-L92QD2-A91H(QU=0.236) E69N-A82QB-E69H 120.446 0.982 8.903 255323 E69N-R80H-E69H 120.456 8.753 8.890 481300 A91N-F90HA-A91H 120.463 4.356 7.927 327651 E69N-V68HA-E69H 120.474 5.192 8.886 669686 A91N-F90HB3-A91H 120.478 3.192 7.920 555908 A43N-E42H-A43H 120.487 9.649 6.870 828488 A43N-I44H-A43H 120.489 7.979 6.869 1115280 E69N-HB2-H 120.489 1.601 8.894 468545 ?-?-? 120.491 7.096 8.037 149429 A43N-H-H 120.492 6.870 6.869 5206608 Q4N-G3QA-Q4H 120.493 4.027 8.564 416675 A1H-H-H 120.495 0.649 8.888 789712 E69N-V68QG1-E69H/E69N-V68QG2-E69H(QU=0.816) A1H-H-H 120.500 2.148 8.888 780425 E69N-V68HB-E69H/E69N-E69HG2-E69H(QU=0.818) A43N-QB-H 120.503 1.650 6.869 2193678 A43N-A40QB-A43H 120.504 1.279 6.865 771904 ?-?-? 120.504 0.848 7.978 561963 ?-?-? 120.504 1.861 7.981 619244 A43N-HA-H 120.507 4.286 6.868 762006 I44N-A43H-I44H 120.507 6.870 7.978 561640 I44N-HB-H 120.507 2.019 7.970 853142 A43N-E42QB-A43H 120.509 2.016 6.870 985502 A43N-I44QD1-A43H 120.517 0.790 6.870 285672 I44N-A43QB-I44H 120.518 1.652 7.976 945237 A1H-H-H 120.521 8.894 7.923 925120 A91N-F90H-A91H/A91N-V93H-A91H(QU=0.552) E69N-HA-H 120.524 4.660 8.886 238470 A91N-F90HB2-A91H 120.524 3.071 7.919 644269 A1H-H-H 120.525 3.462 7.979 397588 I44N-V41HA-I44H/I44N-I44HA-I44H(QU=0.965) ?-?-? 120.527 7.923 8.893 148388 A1H-H-H 120.535 0.777 7.979 913752 I44N-I44HG12-I44H/I44N-I44QD1-I44H(QU=0.821) ?-?-? 120.585 7.664 8.032 200541 R26N-QG-H 120.593 1.740 8.031 1676795 A1H-H-H 120.612 4.146 8.037 1064172 R26N-G25HA3-R26H/R26N-R26HA-R26H(QU=0.879) A43N-E42HA-A43H 120.617 3.888 6.880 204831 R26N-QB-H 120.651 1.948 8.047 898416 L52N-T53H-L52H 120.659 8.239 8.575 403716 L52N-QB-H 120.660 1.671 8.577 2403240 L52N-N51HA-L52H 120.661 4.579 8.576 1321126 L52N-N51HB3-L52H 120.670 3.068 8.577 736613 ?-?-? 120.670 3.187 8.037 189153 L52N-QD1-H 120.679 0.873 8.575 393814 L52N-HA-H 120.690 3.761 8.577 559334 L52N-N51HB2-L52H 120.695 2.693 8.576 660648 R26N-G25HA2-R26H 120.702 3.681 8.033 392491 V41N-HA-H 120.882 3.436 8.432 480375 V41N-A40QB-V41H 120.887 1.279 8.428 869812 L11N-A10H-L11H 120.896 7.934 8.083 867584 V41N-A40HA-V41H 120.910 4.913 8.431 1086085 V41N-HB-H 120.910 2.097 8.431 899647 V41N-QG2-H 120.924 1.088 8.427 928212 A1H-H-H 120.928 1.865 8.141 4897090 K8N-R7HB2-K8H/K8N-K8QB-K8H(QU=0.884) L11N-HB2-H 120.929 1.699 8.094 1415351 V41N-QG1-H 120.933 0.908 8.431 724452 V41N-E42H-V41H 120.938 9.663 8.421 294882 K8N-HA-H 120.947 4.110 8.139 1975233 L11N-HA-H 120.952 4.132 8.095 1463096 K8N-H-H 120.962 8.134 8.139 10005550 L11N-A10QB-L11H 121.035 1.472 8.093 1459754 A1H-H-H 121.105 8.488 8.089 884524 L11N-L12H-L11H/A16N-V15H-A16H(QU=0.501) ?-?-? 121.230 3.970 7.940 450052 A16N-V15QG1-A16H 121.245 0.944 8.086 939398 A97N-HA-H 121.302 3.994 8.156 502226 A97N-QB-H 121.308 1.463 8.159 1265636 A1H-H-H 121.322 2.333 8.493 458390 V15N-Q14QB-V15H/V15N-Q14HG2-V15H/V15N-V15HB-V15H(QU=0.897) V15N-Q14H-V15H 121.348 7.630 8.487 327606 V15N-QG2-H 121.356 0.996 8.492 649351 A16N-V15HB-A16H 121.369 2.302 8.085 606245 V15N-A16H-V15H 121.370 8.082 8.488 416513 A47N-H-H 121.376 7.937 7.942 5855864 A97N-V96H-A97H 121.382 8.321 8.156 612797 V15N-A97QB-V15H 121.386 1.451 8.487 218103 ?-?-? 121.389 4.185 8.481 148758 A47N-T46QG2-A47H 121.401 1.261 7.947 751324 A47N-T46H-A47H 121.404 8.094 7.949 1183690 R39N-HA-H 121.406 4.994 8.590 226682 A16N-R17H-A16H 121.408 7.489 8.084 647839 A97N-V15QG1-A97H 121.417 0.933 8.155 1030053 A1H-H-H 121.419 4.163 7.944 2335995 A47N-T46HB-A47H/A47N-A47HA-A47H(QU=0.541) A97N-V96HB-A97H 121.419 2.096 8.158 686883 A16N-V15HA-A16H 121.421 3.394 8.087 219481 A1H-H-H 121.421 4.437 8.083 889326 A16N-D13HA-A16H/A16N-A16HA-A16H(QU=0.971) A47N-T48H-A47H 121.421 7.573 7.943 1091328 A1H-H-H 121.429 3.809 8.157 621992 A97N-Q94HA-A97H/A97N-V96HA-A97H(QU=0.882) V15N-H-H 121.431 8.484 8.485 1213362 A47N-QB-H 121.433 1.526 7.945 2837018 A47N-I44HA-A47H 121.436 3.489 7.937 297399 A47N-T46HA-A47H 121.438 3.918 7.943 474473 ?-?-? 121.445 9.019 8.594 302124 A47N-L33QD1-A47H 121.476 0.829 7.944 401222 V95N-QG2-H 121.508 1.053 7.429 1350833 V95N-H-H 121.531 7.427 7.428 2488176 A1H-H-H 121.540 2.086 7.430 584764 V95N-Q94HB3-V95H/V95N-Q94HG3-V95H(QU=0.390) V95N-Q94H-V95H 121.542 6.926 7.428 514367 V95N-HB-H 121.550 2.372 7.427 844079 ?-?-? 121.551 4.305 7.429 246193 V95N-V96H-V95H 121.552 8.335 7.431 475150 A9N-K8HA-A9H 121.557 4.100 8.050 982363 A1H-H-H 121.559 3.779 7.429 756907 V95N-V93HA-V95H/V95N-Q94HA-V95H/V95N-V95HA-V95H(QU=0.871) R39N-L34QD2-R39H 121.579 0.861 8.596 933500 A9N-QB-H 121.603 1.428 8.055 4239897 A1H-H-H 121.612 8.057 8.056 13509575 A9N-A9H-A9H/A16N-A16H-A16H(QU=0.401) A9N-HA-H 121.615 3.958 8.055 1559574 R39N-E38HA-R39H 121.615 4.810 8.596 1328322 A9N-K8QB-A9H 121.643 1.866 8.057 1790688 V86N-E84HA-V86H 121.655 4.109 7.628 259904 ?-?-? 121.656 3.702 7.638 381350 A21N-HA-H 121.659 3.781 7.644 858223 A1H-H-H 121.665 7.639 7.641 6652198 A21N-A21H-A21H/V86N-V86H-V86H(QU=0.676) A21N-K20QB-A21H 121.666 1.863 7.643 982793 A1H-H-H 121.666 1.576 7.643 1969593 A21N-K20HG3-A21H/A21N-A21QB-A21H(QU=0.993) V86N-D85H-V86H 121.666 8.960 7.628 610593 V86N-HA-H 121.675 3.480 7.632 540706 R39N-E38H-R39H 121.678 8.089 8.592 254634 V86N-QG2-H 121.678 0.981 7.632 1496742 A21N-L22H-A21H 121.681 7.346 7.645 691618 A21N-K20H-A21H 121.687 8.266 7.648 635471 Q77N-HG3-H 121.720 2.108 8.593 768988 ?-?-? 121.733 4.318 7.635 153166 Y78N-HB2-H 121.766 2.493 8.901 356417 Y78N-HB3-H 121.766 2.589 8.900 318941 Y78N-H-H 121.773 8.903 8.902 2467950 ?-?-? 121.775 5.078 8.899 347251 Y78N-Q77QB-Y78H 121.782 1.837 8.903 491856 Y78N-R71H-Y78H 121.794 8.668 8.900 477769 Y78N-Q77HA-Y78H 121.797 4.901 8.903 1334487 Q77N-H-H 121.816 8.598 8.598 6587318 ?-?-? 121.822 3.969 7.644 188652 Q77N-QB-H 121.836 1.848 8.596 1859207 V86N-HB-H 121.836 2.176 7.626 538690 Y78N-QD-H 121.837 6.724 8.898 438161 Q77N-R76HG2-Q77H 121.869 1.519 8.597 1273226 Q77N-R76QD-Q77H 121.887 3.124 8.609 261915 Q77N-R76HA-Q77H 121.893 4.611 8.597 3331112 Q77N-HA-H 121.893 4.914 8.597 690417 R7N-K8H-R7H 122.096 8.115 8.280 1005174 I81N-HG13-H 122.097 1.478 9.309 389447 I81N-HB-H 122.104 1.690 9.312 1025895 I81N-HG12-H 122.109 1.165 9.320 440450 I81N-HA-H 122.115 4.139 9.318 249696 R7N-QD-H 122.116 3.159 8.280 230986 I81N-R80HA-I81H 122.117 5.138 9.313 610515 I81N-QG2-H 122.117 0.897 9.311 515023 I81N-H-H 122.118 9.314 9.314 1649242 R7N-H-H 122.123 8.279 8.275 7694390 I81N-QD1-H 122.126 0.743 9.311 283492 R7N-D6HA-R7H 122.127 4.555 8.274 1678740 R7N-HB2-H 122.132 1.850 8.278 2864131 R7N-HA-H 122.141 4.153 8.279 1325445 R7N-HG2-H 122.141 1.657 8.279 1090560 R7N-D6QB-R7H 122.142 2.713 8.274 657280 I81N-R80HB3-I81H 122.145 1.906 9.315 402791 A61N-Q60QG-A61H 122.186 2.463 7.593 276286 A1H-H-H 122.254 3.854 8.418 831819 T54N-T53HA-T54H/T54N-T54HA-T54H/T54N-T54HB-T54H(QU=0.631) ?-?-? 122.268 1.461 8.280 250022 A61N-N58HA-A61H 122.282 4.476 7.596 352384 A61N-Q60H-A61H 122.284 8.209 7.594 798763 A61N-H-H 122.286 7.593 7.594 4700968 A61N-QB-H 122.287 1.471 7.595 2137620 A61N-Q60QB-A61H 122.288 2.148 7.594 1027317 A61N-Q60HA-A61H 122.301 4.021 7.595 557945 A61N-HA-H 122.302 4.226 7.595 981777 A61N-L62H-A61H 122.312 7.842 7.594 784898 T54N-T53HB-T54H 122.324 4.145 8.428 1009020 A1H-H-H 122.329 1.199 8.430 1079169 T54N-T53QG2-T54H/T54N-T54QG2-T54H(QU=0.912) T54N-T53H-T54H 122.340 8.249 8.431 954750 T54N-H-H 122.344 8.429 8.427 2410539 T54N-A55H-T54H 122.346 8.868 8.432 725275 Y79N-Y78HB2-Y79H 122.506 2.495 9.024 390371 L59N-HA-H 122.526 3.699 8.542 280613 ?-?-? 122.532 8.599 9.017 271554 Y79N-H-H 122.544 9.023 9.024 2076822 Y79N-Y78HA-Y79H 122.547 4.760 9.025 1016441 Y79N-QD-H 122.553 6.752 9.029 353493 ?-?-? 122.556 4.918 9.029 414275 L59N-HB2-H 122.557 0.595 8.540 571375 A1H-H-H 122.557 2.623 9.027 652139 Y79N-Y78HB3-Y79H/Y79N-Y79HB2-Y79H/Y79N-Y79HB3-Y79H(QU=0.711) L59N-S56HA-L59H 122.569 3.946 8.545 444787 Y79N-HA-H 122.569 5.415 9.019 224175 L59N-H-H 122.571 8.534 8.541 2065651 L59N-Q60H-L59H 122.575 8.202 8.547 484103 A1H-H-H 122.588 0.249 8.541 698131 L59N-L59QD1-L59H/L59N-L59QD2-L59H(QU=0.306) L59N-N58H-L59H 122.592 7.992 8.542 504323 L59N-HG-H 122.601 1.359 8.542 518822 A1H-H-H 122.606 2.138 8.531 309007 L59N-N58HB2-L59H/L59N-Q60QB-L59H(QU=0.201) R76N-HB2-H 122.619 1.526 8.041 1616846 L59N-HB3-H 122.623 1.636 8.539 503457 R76N-H-H 122.631 8.042 8.035 11655997 ?-?-? 122.646 4.169 8.038 330832 ?-?-? 122.648 1.706 8.045 903036 R76N-T75H-R76H 122.649 8.767 8.042 874139 ?-?-? 122.653 8.948 7.530 137714 R76N-T75HA-R76H 122.655 4.280 8.037 586782 R76N-G74HA2-R76H 122.660 3.702 8.046 212385 R76N-HA-H 122.683 4.602 8.040 1016706 D6N-HA-H 122.701 4.557 8.315 732479 D6N-S5HB2-D6H 122.721 3.886 8.311 489795 D6N-S5HB3-D6H 122.721 3.946 8.311 604567 R76N-Q77H-R76H 122.724 8.592 8.045 377921 R76N-HB3-H 122.725 1.931 8.035 1712087 R76N-QD-H 122.729 3.136 8.040 349376 A87N-H-H 122.742 7.534 7.531 3444992 D6N-QB-H 122.744 2.710 8.311 1692526 D6N-S5HA-D6H 122.746 4.386 8.311 1657961 A87N-V86HB-A87H 122.754 2.199 7.531 465250 A1H-H-H 122.758 4.114 7.528 1152738 A87N-E84HA-A87H/A87N-A87HA-A87H(QU=0.971) A87N-QB-H 122.762 1.599 7.529 1759115 R76N-T75QG2-R76H 122.765 1.220 8.031 382330 ?-?-? 122.768 0.949 7.533 694787 A87N-R88H-A87H 122.783 8.380 7.529 706858 A87N-V86QG1-A87H 122.787 1.162 7.524 406385 A70N-K63QE-A70H 122.799 3.084 8.738 251254 A1H-H-H 122.802 1.595 8.741 882894 A70N-K63QG-A70H/A70N-E69HB2-A70H(QU=0.960) A70N-HA-H 122.806 4.993 8.747 542238 A70N-E69HG2-A70H 122.813 2.162 8.745 599731 A70N-E69HB3-A70H 122.814 1.933 8.744 927307 A70N-H-H 122.815 8.744 8.744 7534208 A70N-QB-H 122.820 0.651 8.744 1792159 A70N-E69HA-A70H 122.823 4.670 8.744 2708468 ?-?-? 122.868 3.911 7.955 157877 A1H-H-H 122.984 3.403 7.971 271714 V18N-V15HA-V18H/V18N-G19QA-V18H(QU=0.562) V18N-H-H 122.992 7.977 7.970 1804877 A1H-H-H 122.999 8.281 7.970 519963 V18N-G19H-V18H/V18N-K20H-V18H(QU=0.216) V18N-QG2-H 123.001 1.164 7.972 801436 V18N-HB-H 123.004 2.394 7.965 550472 V18N-QG1-H 123.013 0.874 7.971 450693 V18N-R17H-V18H 123.025 7.496 7.970 351341 V18N-HA-H 123.055 3.691 7.963 282741 ?-?-? 123.325 2.311 8.489 482754 A1H-H-H 123.341 4.018 8.590 522601 K63N-Q60HA-K63H/K63N-L62HA-K63H(QU=0.551) K63N-L62H-K63H 123.361 7.838 8.593 314851 K63N-HB2-H 123.388 1.733 8.578 566242 L89N-F90H-L89H 123.391 8.902 8.485 340715 K63N-H-H 123.393 8.587 8.580 1857293 A1H-H-H 123.399 4.058 8.487 604969 L89N-R88HA-L89H/L89N-L89HA-L89H(QU=0.866) L89N-L92QD2-L89H 123.412 0.874 8.487 1190507 K63N-QG-H 123.416 1.622 8.580 522942 A1H-H-H 123.423 0.635 8.587 428974 K63N-L62QD2-K63H/K63N-V68QG2-K63H(QU=0.900) K63N-HA-H 123.423 4.119 8.581 461916 ?-?-? 123.427 1.801 8.486 328352 A1H-H-H 123.429 2.147 8.582 880572 K63N-L62HB3-K63H/K63N-K63HB3-K63H(QU=0.961) L89N-H-H 123.431 8.490 8.488 2292093 L89N-QB-H 123.439 1.548 8.489 982666 L89N-V86HA-L89H 123.446 3.478 8.486 249498 K63N-L62QD1-K63H 123.465 0.782 8.582 228709 L89N-R88HB3-L89H 123.469 2.117 8.501 356468 R72N-HA-H 123.651 5.086 8.789 518818 A1H-H-H 123.673 1.435 8.792 713431 R72N-R71HG3-R72H/R72N-R72HG2-R72H(QU=0.730) R72N-H-H 123.687 8.791 8.789 6501735 A1H-H-H 123.693 1.675 8.788 2183184 R72N-R71HB3-R72H/R72N-R72HB2-R72H(QU=0.703) R72N-R71HA-R72H 123.696 4.624 8.788 2504750 A1H-H-H 123.736 3.142 8.786 236761 R72N-R71HD3-R72H/R72N-R72QD-R72H(QU=0.878) ?-?-? 123.887 4.307 8.164 324319 A35N-HA-H 123.892 4.064 8.167 1180616 A35N-Q36H-A35H 123.902 7.593 8.163 1158399 A35N-QB-H 123.910 1.566 8.163 2940812 ?-?-? 123.922 0.791 8.169 537470 A35N-L34HA-A35H 123.962 4.490 8.163 299282 ?-?-? 123.964 7.335 8.160 154111 A57N-H-H 123.998 8.102 8.091 5130518 A57N-HA-H 123.999 4.102 8.090 1443231 A57N-T54QG2-A57H 124.013 1.218 8.089 337674 A57N-S56H-A57H 124.019 8.448 8.088 1121998 A57N-QB-H 124.021 1.478 8.093 2630036 A57N-S56HA-A57H 124.030 3.940 8.090 1678292 A45N-A55QB-A45H 124.435 1.138 8.474 441916 A45N-M50HB2-A45H 124.445 1.716 8.469 304727 A45N-H-H 124.493 8.483 8.470 3508854 A45N-A43QB-A45H 124.539 1.638 8.470 227306 A45N-I44QG2-A45H 124.556 0.723 8.471 642885 A45N-T46HB-A45H 124.560 4.139 8.471 185698 A45N-QB-H 124.575 1.398 8.471 1467697 A45N-HA-H 124.585 3.718 8.474 509137 A45N-I44HB-A45H 124.589 2.038 8.470 795197 A45N-I44H-A45H 124.596 7.990 8.470 810498 A1H-H-H 124.598 3.453 8.471 301834 A45N-V41HA-A45H/A45N-I44HA-A45H(QU=0.839) A45N-E42HA-A45H 124.618 3.911 8.471 411148 A1H-H-H 125.118 1.865 8.925 716747 A40N-R39HB3-A40H/A40N-R39HG3-A40H(QU=0.565) A40N-R39HA-A40H 125.128 4.968 8.924 1946952 A1H-H-H 125.130 6.718 8.915 274168 A40N-Y78QD-A40H/A40N-Y78QE-A40H(QU=0.401) A40N-H-H 125.132 8.930 8.925 3964969 ?-?-? 125.132 3.279 8.925 266874 A40N-QB-H 125.134 1.282 8.924 1400578 A1H-H-H 125.145 1.631 8.923 837044 A40N-R39HB2-A40H/A40N-A43QB-A40H(QU=0.814) ?-?-? 125.357 3.155 8.115 506350 A1H-H-H 125.361 3.057 8.118 924322 H108N-H107HB2-H108H/H108N-H108QB-H108H(QU=0.773) H108N-HA-H 125.368 4.415 8.115 566620 H108N-H-H 125.370 8.120 8.118 16722036 H108N-H107HA-H108H 125.378 4.585 8.118 1839499 A55N-M50HB2-A55H 125.550 1.745 8.867 190374 A55N-M50HB3-A55H 125.572 1.939 8.869 274261 ?-?-? 125.587 3.749 8.865 344625 A1H-H-H 125.604 8.443 8.867 1535444 A55N-T54H-A55H/A55N-S56H-A55H(QU=0.894) A1H-H-H 125.607 1.178 8.868 1906442 A55N-T54QG2-A55H/A55N-A55QB-A55H(QU=0.974) A55N-H-H 125.611 8.867 8.867 4099600 A1H-H-H 125.613 3.886 8.855 679616 A55N-T54HA-A55H/A55N-T54HB-A55H(QU=0.876) A55N-HA-H 125.622 4.004 8.867 1496528 A55N-A57H-A55H 125.750 8.083 8.886 179965 A1H-H-H 126.782 6.723 8.743 239633 E73N-Y78QD-E73H/E73N-Y78QE-E73H(QU=0.250) ?-?-? 126.798 1.804 8.735 758355 E73N-R72HA-E73H 126.800 5.108 8.736 2302580 ?-?-? 126.801 4.908 8.732 485313 E73N-H-H 126.802 8.735 8.735 5455312 E73N-HB3-H 126.811 2.079 8.733 606178 E73N-QG-H 126.811 2.149 8.733 620482 ?-?-? 126.839 8.040 8.735 244278 E73N-HA-H 126.851 4.517 8.740 587777 E73N-R72HB3-E73H 126.859 1.727 8.730 578998 E73N-R72HG3-E73H 126.863 1.478 8.728 473759 A82N-I81HB-A82H 127.118 1.730 7.928 162164 A82N-H-H 127.202 7.932 7.939 1263352 A82N-V68QG1-A82H 127.205 0.659 7.941 318664 A1H-H-H 127.216 0.971 7.938 1055638 A82N-A82QB-A82H/A82N-V86QG2-A82H(QU=0.359) A82N-I81HA-A82H 127.219 4.146 7.939 694543 A82N-HA-H 127.226 3.943 7.941 309008 A82N-V68HA-A82H 127.239 5.189 7.948 313686 A82N-V86QG1-A82H 127.268 1.137 7.937 250424 ; loop_ _Spectral_dim.ID _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Sweep_width _Spectral_dim.Encoding_code _Spectral_dim.Encoded_source_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 N 15 N 1 2249.972 . . c16368_2kko 1 2 H 1 H 2 7866.144 . . c16368_2kko 1 3 H 1 HN 1 14005.6 . . c16368_2kko 1 stop_ save_ save_Cnoesy_peak_list _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode Cnoesy_peak_list _Spectral_peak_list.Entry_ID c16368_2kko _Spectral_peak_list.ID 2 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $NC_sample _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 4 _Spectral_peak_list.Experiment_name '3D 1H-13C NOESY' _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Details 850mhz _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; w1 w2 w3 Data Height 12.362 8.171 0.767 10729340 12.424 1.178 0.762 73604960 12.432 1.596 0.763 74344656 12.438 1.486 0.763 56560992 12.441 0.377 0.763 35371072 12.448 3.525 0.757 11349743 12.449 4.092 0.764 46705912 12.449 8.333 0.756 4059008 12.450 1.702 0.762 40089904 12.455 7.543 0.761 13316130 12.458 0.543 0.763 34717624 12.459 7.943 0.760 7218556 12.469 7.134 0.760 5140775 12.479 9.305 0.760 7331666 12.497 2.178 0.758 9342977 12.589 8.874 0.774 3916622 14.376 1.955 0.666 75567168 14.379 7.542 0.666 26171482 14.379 8.544 0.668 6331534 14.383 4.025 0.667 14701883 14.384 3.722 0.665 25970482 14.390 1.153 0.665 25191164 14.390 1.359 0.664 26731464 14.396 7.972 0.667 11011804 14.400 2.103 0.666 28235854 14.401 0.251 0.665 37314304 14.406 3.364 0.667 12833666 14.410 2.630 0.664 15891441 14.420 6.687 0.660 3056618 14.730 1.406 0.802 9974245 14.748 6.767 0.803 10547691 14.759 7.986 0.801 18008272 14.774 4.942 0.806 4736110 14.778 1.638 0.797 29081250 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10401442 55.769 8.312 4.492 8446890 55.770 1.867 4.503 32780408 55.777 2.157 4.508 41361860 55.804 0.541 4.496 11450592 55.816 0.871 4.492 40369380 55.822 1.375 4.497 13209657 55.825 1.590 4.357 15238615 55.838 1.666 4.494 13681507 55.867 7.583 4.359 42480136 55.867 2.419 4.360 88286400 55.869 7.538 4.123 16572026 55.891 1.438 4.356 15785864 55.894 0.758 4.122 13740558 55.902 7.943 4.371 10987034 55.903 2.118 4.361 37119764 55.907 8.131 4.368 13422196 55.914 8.892 4.124 6761896 55.917 1.608 4.123 64881400 55.924 3.184 4.123 7489608 55.927 0.822 4.366 46005004 55.944 8.347 4.565 10922881 55.947 8.396 4.120 7270618 55.969 6.973 4.559 24673840 55.997 8.115 4.586 31058450 56.002 0.923 4.127 10542677 56.133 8.458 4.026 7795132 56.137 1.979 4.033 11494747 56.154 1.188 4.031 52342576 56.162 8.868 4.029 12149880 56.173 7.977 4.034 4462016 56.204 0.680 4.029 11522476 56.222 8.079 3.730 7302186 56.261 2.622 4.029 6658896 56.268 4.152 3.726 17087630 56.270 8.483 3.725 13662209 56.294 7.948 3.720 10639414 56.309 1.415 3.727 42867720 56.327 1.181 3.726 18963948 56.340 1.977 3.719 7314326 56.347 0.743 3.730 5799272 56.351 7.564 3.725 4052096 56.551 2.387 4.335 37976536 56.591 2.120 4.338 55301592 56.605 8.554 4.336 14186442 56.608 2.028 4.336 52097564 56.909 2.103 4.477 8821676 56.919 1.487 4.480 26671036 56.921 3.552 4.466 4410577 57.009 2.628 4.481 7862471 57.042 0.951 4.320 41298440 57.052 8.532 4.474 4337050 57.057 2.142 4.153 26005910 57.076 1.945 4.154 40444772 57.088 7.615 4.468 7347905 57.110 8.116 4.154 24767708 57.144 7.981 4.471 10332779 57.181 8.375 4.309 6257064 57.190 1.643 5.404 3353218 57.190 8.961 4.344 6027895 57.218 4.794 5.423 4496102 57.238 1.488 4.337 9251034 57.239 6.762 5.416 5483769 57.258 8.039 4.156 13400172 57.306 4.988 5.415 11457342 57.372 8.726 5.413 21620870 57.372 8.191 4.322 34773232 57.374 0.660 5.416 14294666 57.381 2.754 4.318 47445116 57.397 2.657 5.417 7524220 57.401 1.842 4.307 17874218 57.428 0.978 4.309 71852384 57.432 7.233 4.308 20148222 57.439 7.964 4.308 23130514 57.456 8.887 5.202 15124374 57.463 1.595 4.307 30029016 57.480 7.938 5.196 10955346 57.481 0.657 5.201 27079022 57.486 2.150 5.203 12841901 57.490 2.374 4.308 20582368 57.504 7.412 4.308 10368026 57.507 2.847 4.422 25553354 57.538 1.599 5.182 5869706 57.541 4.158 5.199 12629206 57.546 0.981 5.200 12809699 57.554 1.340 4.430 23363200 57.556 2.652 4.428 32843278 57.566 8.011 4.427 22584132 57.568 6.904 5.200 4356297 57.589 7.633 4.426 7252998 57.607 7.648 3.960 7582491 57.616 1.010 3.958 36529316 57.623 7.530 3.961 7355980 57.634 2.245 3.966 8929624 57.636 1.247 3.959 12873794 57.670 7.360 4.142 17293592 57.699 0.627 3.962 10303188 57.758 8.094 4.421 16179847 57.760 7.517 4.144 4745856 57.763 0.867 4.141 73346560 57.773 1.547 3.957 12799810 57.773 0.819 3.961 15157033 57.923 1.676 4.149 53737768 57.941 7.637 4.046 5732962 57.959 2.542 4.120 5489648 58.011 7.934 4.157 10734274 58.032 7.631 4.125 5362373 58.041 1.480 4.155 39045760 58.045 1.857 4.156 67963856 58.045 1.857 4.156 67963856 58.060 2.729 4.168 4036295 58.068 8.280 4.159 21093964 58.068 8.280 4.159 21093964 58.098 8.115 4.154 29709042 58.133 7.958 3.534 2926350 58.148 2.312 4.049 17105570 58.153 8.490 4.049 17146496 58.159 7.826 3.982 8195378 58.160 7.513 4.223 5613622 58.165 2.173 4.223 11954639 58.177 2.553 4.215 5666658 58.185 0.376 3.524 25388174 58.185 1.261 3.523 13562418 58.189 1.689 3.523 6139848 58.189 3.274 4.223 10776504 58.190 2.353 4.224 16870034 58.194 0.602 3.523 21855840 58.196 7.637 4.226 11441047 58.217 7.525 3.523 9339108 58.228 3.190 4.164 14424990 58.248 0.769 3.525 9660767 58.271 8.316 3.508 3495406 58.308 1.968 4.046 29262318 58.342 1.655 3.710 8616046 58.356 0.875 4.040 61447568 58.356 0.875 4.040 61447568 58.408 1.557 4.041 27413892 58.417 2.126 3.715 6993408 58.454 8.114 4.082 33763976 58.454 8.114 4.082 33763976 58.463 0.608 3.709 18612978 58.469 0.245 3.705 28226098 58.469 0.786 3.711 19060054 58.471 1.880 4.081 69755704 58.471 1.880 4.081 69755704 58.494 1.472 4.080 40165708 58.507 1.708 4.078 36800468 58.507 1.708 4.078 36800468 58.510 7.857 3.696 4175642 58.530 8.905 4.041 4645327 58.532 1.360 3.710 12018412 58.559 8.549 3.714 9281009 58.606 8.205 4.027 26027334 58.666 8.573 4.029 9233941 58.869 2.467 4.020 18901438 58.869 2.168 4.026 51740708 58.943 7.588 4.025 8075070 58.962 1.610 4.124 37299004 58.986 1.188 3.763 35799700 58.994 2.076 4.126 34956676 58.997 0.893 3.765 57014756 59.005 7.539 4.126 11544605 59.017 1.681 3.763 52875804 59.022 8.579 3.762 16284543 59.030 8.945 4.128 8109580 59.041 8.461 3.767 7081992 59.139 2.144 3.896 21503190 59.140 8.312 4.394 39469444 59.157 3.934 4.393 118507776 59.157 1.878 4.393 16381264 59.161 8.124 3.896 14770342 59.185 0.862 3.897 29428588 59.191 8.144 4.394 7129744 59.208 2.257 3.895 33517010 59.219 2.594 3.894 14691294 59.230 7.965 3.899 7838744 59.234 2.744 3.894 15013015 59.274 7.347 3.889 4497365 59.291 1.461 4.392 9743880 59.374 7.660 3.922 3889324 59.386 1.367 3.719 73858752 59.396 2.123 4.394 6105254 59.424 8.271 3.717 20676288 59.438 7.651 3.718 3817906 59.457 7.936 4.380 5415709 59.510 3.090 4.393 16588275 59.510 1.110 4.389 39814836 59.515 8.899 4.389 15559357 59.551 7.128 4.389 25714398 59.613 2.129 3.918 15092337 59.641 0.905 4.106 8516399 59.669 7.932 4.101 7298108 59.673 1.491 4.101 29363868 59.677 8.387 4.098 16849802 59.690 1.625 4.106 35308072 59.692 7.545 4.150 5574628 59.698 1.857 4.102 26340536 59.720 3.270 4.095 5831548 59.730 3.277 3.920 8757069 59.731 7.500 3.910 12893146 59.766 1.361 3.918 10116114 59.784 1.862 3.916 34758856 59.816 1.657 3.914 20783132 59.829 6.897 4.145 12756999 59.838 0.651 4.145 22114174 59.852 8.608 4.146 11020607 59.865 8.267 3.915 7497659 59.999 8.167 3.800 7526125 60.029 7.420 3.811 6388535 60.031 2.108 3.812 26777560 60.035 1.478 3.806 19039462 60.040 1.644 3.813 16906752 60.072 0.987 3.809 27677670 60.110 5.373 3.806 3878916 60.120 6.928 3.809 9692141 60.715 2.490 3.899 14082414 60.728 6.877 3.893 6957867 60.730 1.415 3.898 22286572 60.730 1.415 3.898 22286572 60.731 0.896 3.898 39867020 60.736 2.285 3.901 21157386 60.738 8.477 3.897 7984926 60.741 2.015 3.898 42568520 60.744 8.076 3.886 5005548 60.787 9.637 3.898 20356450 61.066 1.886 3.715 14808068 61.104 0.792 3.715 12544879 61.111 0.670 3.708 13846235 61.121 7.536 3.712 6378724 61.147 2.081 3.716 9594013 61.151 7.943 3.712 5824858 61.460 7.744 4.307 4581678 61.479 7.285 4.317 5843780 61.504 4.019 4.308 48949936 61.542 8.661 4.308 21704070 61.542 8.661 4.308 21704070 61.543 1.596 4.314 6232376 61.543 1.596 4.314 6232376 61.917 4.211 4.391 35837648 61.920 4.392 4.394 137386256 61.944 1.117 4.392 46294244 62.032 4.302 4.299 278467840 62.060 8.041 4.297 14442784 62.094 1.228 4.298 86431936 62.095 4.519 4.297 62444436 62.298 9.301 4.165 5106199 62.303 1.188 4.165 11935270 62.327 1.487 4.167 5584138 62.337 0.660 4.160 12779734 62.350 7.929 4.154 21956958 62.368 0.921 4.158 21699408 62.376 8.899 4.153 2515298 62.390 1.722 4.162 11009565 62.408 2.177 4.176 5078351 62.414 5.197 4.162 10485513 62.478 0.592 3.928 4299659 62.495 0.618 4.024 3546504 62.578 1.485 3.928 7693856 62.578 1.651 3.930 6131377 62.600 8.535 3.928 8565771 62.624 0.277 3.935 11062436 62.651 1.125 4.014 5571884 62.663 8.454 4.010 21163658 62.672 8.454 3.928 24189192 62.674 8.096 3.931 13028673 62.676 1.186 3.935 7837026 62.708 0.914 3.938 8582653 62.723 8.097 4.011 10504485 62.739 0.909 4.016 8031992 62.885 1.487 4.010 11247803 62.961 1.608 3.999 7220554 63.044 3.267 4.013 5128744 63.052 4.298 4.019 68180664 63.058 2.171 4.033 8130876 63.061 7.294 4.023 18688696 63.065 8.659 4.021 52669364 63.522 8.302 3.891 8493240 63.537 5.668 3.890 11328455 63.551 4.390 3.891 95773624 63.559 8.537 3.892 6200378 63.560 8.299 3.959 13704977 63.566 4.390 3.959 102026768 63.581 5.663 3.960 10449563 63.595 8.553 3.960 6223869 64.821 1.802 3.485 10030110 64.841 1.539 3.484 15616492 64.852 8.482 3.495 4738119 64.855 2.040 3.492 10169912 64.862 0.827 3.485 43051916 64.877 7.970 3.481 12964712 64.897 1.141 3.474 6051857 65.933 1.897 3.360 12307305 65.959 7.537 3.357 12535794 65.960 7.362 3.323 4178380 65.963 1.718 3.356 9305930 65.967 0.829 3.355 11546024 65.970 0.592 3.362 27779718 65.970 0.592 3.362 27779718 65.990 7.169 3.824 9852210 66.000 1.114 3.361 9404574 66.028 0.983 3.818 57010920 66.065 8.331 3.816 14974785 66.066 8.182 3.817 11142654 66.135 0.871 3.807 54846180 66.163 2.115 3.805 35560724 66.237 8.904 3.798 13114843 66.261 1.107 3.799 48255832 66.346 7.841 3.928 9627306 66.379 7.949 3.922 18023978 66.388 7.568 3.923 4946545 66.396 8.091 3.923 36892468 66.411 4.132 3.920 54876584 66.539 8.235 3.876 22322696 66.595 2.374 3.755 14740330 66.598 0.990 3.759 52931508 66.600 2.830 3.754 13444634 66.600 2.726 3.754 10164448 66.614 1.226 3.890 108995688 66.620 8.198 3.760 15924599 66.623 8.435 3.887 27420014 66.623 1.077 3.757 64084700 66.642 7.430 3.755 19352888 66.647 1.481 3.895 35349732 66.659 8.871 3.890 9549918 66.699 8.492 3.373 8123948 66.712 0.880 3.692 31386036 66.712 2.412 3.685 8119628 66.720 7.645 3.686 4925731 66.729 1.183 3.689 24375324 66.735 3.385 3.382 55211124 66.747 1.585 3.689 12923241 66.773 0.981 3.382 35916432 66.782 7.973 3.693 9284335 66.796 1.474 3.376 16637580 66.822 2.354 3.379 10473465 66.874 0.997 3.486 35412416 66.894 7.994 3.374 3864705 66.906 2.179 3.490 7777116 66.908 7.612 3.480 6629962 66.911 1.562 3.490 10822229 66.914 8.883 3.490 3625092 66.927 2.338 3.472 8748395 66.944 8.494 3.476 6494874 67.058 0.709 3.484 6324704 67.532 8.449 3.440 12623148 67.566 0.808 3.435 22784870 67.570 9.644 3.452 3670711 67.611 1.109 3.436 23028006 67.622 0.262 3.434 8409437 67.640 2.086 3.437 18875928 67.646 7.988 3.431 5112226 68.413 8.426 4.163 25409874 68.427 8.238 4.165 39656620 68.432 1.226 4.163 94799464 68.436 8.854 4.155 4857048 68.457 3.886 4.163 31777518 68.800 1.546 4.130 9316241 68.800 1.546 4.130 9316241 68.800 4.285 4.135 24302518 68.832 3.930 4.137 31906398 68.845 1.268 4.135 70815248 68.888 7.951 4.133 29120118 68.915 8.086 4.134 36773640 68.963 1.227 4.523 96422424 68.977 4.302 4.523 55216152 69.078 8.808 4.536 2983806 71.045 1.979 4.205 13872661 71.048 0.733 4.196 3425446 71.070 1.119 4.207 32360904 71.075 4.202 4.208 53868436 71.076 7.946 4.215 5009193 71.083 4.390 4.208 20043336 71.132 7.554 4.213 8661382 ; loop_ _Spectral_dim.ID _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Sweep_width _Spectral_dim.Encoding_code _Spectral_dim.Encoded_source_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 C 13 C 1 14108.6 . . c16368_2kko 2 2 H 1 H 2 8916.09 . . c16368_2kko 2 3 H 1 H 1 15243.9 . . c16368_2kko 2 stop_ save_ save_Cnoesy_arom_peak_list _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode Cnoesy_arom_peak_list _Spectral_peak_list.Entry_ID c16368_2kko _Spectral_peak_list.ID 3 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $NC_sample _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 4 _Spectral_peak_list.Experiment_name '3D 1H-13C NOESY' _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Details 600MHz _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; w1 w2 w3 Data Height 118.094 1.651 6.739 209256 118.146 1.290 6.742 514936 118.174 3.131 6.740 276575 118.189 1.899 6.741 569698 118.198 2.117 6.740 792245 118.220 8.909 6.736 226879 118.250 1.529 6.740 405946 118.319 2.593 6.738 164165 118.455 6.762 6.479 1026997 118.474 2.126 6.477 330311 118.481 1.682 6.468 243065 118.484 0.254 6.475 322265 118.487 0.648 6.475 749289 118.495 1.097 6.477 581235 118.567 1.827 6.474 408630 121.099 0.979 7.168 321099 121.102 1.983 7.162 140012 121.148 8.003 7.175 151972 121.159 0.838 7.171 460685 121.171 3.810 7.167 181403 129.963 0.855 7.107 172337 131.019 3.184 7.132 223561 131.019 3.064 7.142 183596 131.045 8.922 7.148 131458 131.054 0.868 7.134 310672 131.054 3.172 7.252 161011 131.055 0.628 7.142 232033 131.069 4.384 7.146 152919 131.078 1.090 7.136 464459 131.078 0.455 7.251 165475 131.083 0.994 7.136 422429 131.086 0.381 7.233 134296 131.092 1.562 7.243 228628 131.107 1.558 7.133 249153 131.109 0.516 7.131 187069 131.109 0.851 7.240 301853 131.117 0.989 7.243 470000 131.117 0.627 7.264 160624 131.123 7.922 7.138 134876 131.153 4.312 7.251 140692 132.463 1.492 6.703 240429 132.469 8.919 6.707 364530 132.488 1.883 6.713 460450 132.503 2.120 6.709 677113 132.511 1.294 6.710 411002 132.551 2.551 6.708 404823 132.638 1.681 6.711 190878 132.814 1.103 6.771 162847 132.843 0.644 6.770 449532 132.843 2.608 6.771 199775 132.848 6.482 6.766 370177 132.936 0.271 6.762 140421 ; loop_ _Spectral_dim.ID _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Sweep_width _Spectral_dim.Encoding_code _Spectral_dim.Encoded_source_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 C 13 'C arom' 1 3310.44 . . c16368_2kko 3 2 H 1 H 2 6582.2 . . c16368_2kko 3 3 H 1 H 1 12001.2 . . c16368_2kko 3 stop_ save_ save_CN_filt_Cnoesy_peak_list _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode CN_filt_Cnoesy_peak_list _Spectral_peak_list.Entry_ID c16368_2kko _Spectral_peak_list.ID 4 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $NC50_sample _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 15 _Spectral_peak_list.Experiment_name '3D CN filt 1H-13C NOESY' _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Details '600mhz cold probe' _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; w1 w2 w3 Data Height 14.635 0.603 0.795 19716 17.559 4.141 1.969 47618 17.601 1.066 1.320 44061 17.940 1.541 1.463 58669 18.019 1.389 1.461 81859 18.132 1.357 1.340 65651 18.147 1.864 1.346 18209 18.160 1.557 1.342 30748 18.294 3.715 1.338 35182 18.689 1.393 1.482 -16074 19.893 1.173 1.442 23216 19.918 3.368 1.456 22319 19.928 0.956 1.447 83355 21.406 2.203 0.813 18614 21.437 1.457 1.151 23631 21.461 0.897 0.819 80688 21.487 1.138 0.819 35768 21.490 0.728 0.815 44428 21.592 2.260 0.814 17180 21.610 1.513 0.817 14834 21.624 4.127 1.097 62293 21.642 7.220 0.816 23581 21.648 0.849 1.160 58238 21.652 7.101 0.818 32821 21.654 1.059 0.819 48964 21.702 4.058 1.184 29232 22.018 1.095 0.865 75968 22.080 0.832 0.862 34499 22.569 0.565 0.639 19604 22.602 0.715 0.616 24221 22.715 1.881 0.963 14569 22.730 0.891 0.968 75644 22.902 1.555 0.967 12875 22.971 0.974 0.636 15583 22.982 0.857 0.627 25022 23.332 1.436 0.914 -15379 23.419 0.836 0.685 45128 23.906 0.870 0.935 131696 23.906 0.870 0.935 131696 23.952 4.321 0.939 20874 23.956 1.459 0.988 32429 23.966 1.465 0.935 70752 23.977 1.060 0.930 136249 23.994 3.805 0.936 29935 24.029 8.166 0.933 15254 24.033 2.125 0.931 32829 24.268 2.840 0.930 13524 24.636 3.784 0.834 14001 24.759 1.559 0.831 26447 24.875 2.116 0.832 24297 25.141 2.258 0.846 23861 25.224 3.899 0.846 36535 25.559 1.339 1.380 29215 25.586 1.563 0.878 21546 25.645 1.357 1.539 19419 25.656 3.446 0.667 14809 25.665 0.877 0.688 25161 25.714 1.857 0.879 18870 25.822 4.047 0.875 32216 26.408 2.336 0.860 12008 26.885 0.848 0.880 46311 27.496 0.873 1.522 21747 27.527 0.946 1.060 56214 27.598 1.305 1.046 16367 30.568 0.877 1.814 24073 30.680 1.092 2.306 20691 31.195 0.862 2.133 33352 32.495 1.345 1.848 17955 34.256 0.860 2.573 23595 34.359 0.848 2.238 18749 35.908 0.936 2.112 21101 38.777 0.976 2.555 18219 38.881 0.994 2.666 16901 41.676 0.964 2.830 12363 41.683 0.943 2.708 16652 41.730 0.889 1.697 19959 42.198 1.353 2.965 27457 57.042 0.951 4.320 36354 58.456 0.876 4.029 33060 59.139 0.853 3.877 21974 59.340 1.364 3.702 31093 59.931 0.966 3.798 21301 66.613 1.459 3.369 15515 ; loop_ _Spectral_dim.ID _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Sweep_width _Spectral_dim.Encoding_code _Spectral_dim.Encoded_source_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 C 13 C 1 9804.4 . . c16368_2kko 4 2 H 1 H 2 6298.4 . . c16368_2kko 4 3 H 1 H 1 10787.5 . . c16368_2kko 4 stop_ save_ ############################## # Structure determinations # ############################## ########################## # Conformer statistics # ########################## save_conformer_statistics _Conformer_stat_list.Sf_category conformer_statistics _Conformer_stat_list.Sf_framecode conformer_statistics _Conformer_stat_list.Entry_ID c16368_2kko _Conformer_stat_list.ID 1 _Conformer_stat_list.Conf_family_coord_set_ID 1 _Conformer_stat_list.Conf_family_coord_set_label $Original_constraints_and_structures _Conformer_stat_list.Conformer_submitted_total_num 20 save_ ##################################### # Conformer family coordinate set # ##################################### save_ensemble_of_conformers _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Sf_framecode ensemble_of_conformers _Conformer_family_coord_set.Entry_ID c16368_2kko _Conformer_family_coord_set.ID 1 loop_ _Conformer_family_refinement.Refine_method _Conformer_family_refinement.Refine_details _Conformer_family_refinement.Software_ID _Conformer_family_refinement.Software_label _Conformer_family_refinement.Entry_ID _Conformer_family_refinement.Conformer_family_coord_set_ID 1 . . . c16368_2kko 1 stop_ loop_ _Conformer_family_software.Software_ID _Conformer_family_software.Software_label _Conformer_family_software.Method_ID _Conformer_family_software.Method_label _Conformer_family_software.Entry_ID _Conformer_family_software.Conformer_family_coord_set_ID . . . . c16368_2kko 1 stop_ loop_ _Atom_site.Assembly_ID _Atom_site.Model_ID _Atom_site.Model_site_ID _Atom_site.ID _Atom_site.Assembly_atom_ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Cartn_x_esd _Atom_site.Cartn_y_esd _Atom_site.Cartn_z_esd _Atom_site.Occupancy _Atom_site.Occupancy_esd _Atom_site.Uncertainty _Atom_site.Ordered_flag _Atom_site.Footnote_ID _Atom_site.PDBX_label_asym_ID _Atom_site.PDBX_label_seq_ID _Atom_site.PDBX_label_comp_ID _Atom_site.PDBX_label_atom_ID _Atom_site.PDBX_formal_charge _Atom_site.PDBX_label_entity_ID _Atom_site.PDB_record_ID _Atom_site.PDB_model_num _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Auth_entity_assembly_ID _Atom_site.Auth_asym_ID _Atom_site.Auth_chain_ID _Atom_site.Auth_seq_ID _Atom_site.Auth_comp_ID _Atom_site.Auth_atom_ID _Atom_site.Auth_alt_ID _Atom_site.Auth_atom_name _Atom_site.Details _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID . 1 . 1 . 1 1 1 MET C C 0.926 4.668 -30.545 . . . 1.0 . . . . . . . . . . . . A . 1 MET C . . . . . . . . . c16368_2kko 1 . 1 . 2 . 1 1 1 MET CA C 1.746 3.447 -30.137 . . . 1.0 . . . . . . . . . . . . A . 1 MET CA . . . . . . . . . c16368_2kko 1 . 1 . 3 . 1 1 1 MET CB C 2.866 3.215 -31.156 . . . 1.0 . . . . . . . . . . . . A . 1 MET CB . . . . . . . . . c16368_2kko 1 . 1 . 4 . 1 1 1 MET CE C 4.012 4.213 -33.988 . . . 1.0 . . . . . . . . . . . . A . 1 MET CE . . . . . . . . . c16368_2kko 1 . 1 . 5 . 1 1 1 MET CG C 3.877 4.351 -31.227 . . . 1.0 . . . . . . . . . . . . A . 1 MET CG . . . . . . . . . c16368_2kko 1 . 1 . 6 . 1 1 1 MET H1 H 0.123 2.397 -29.349 . . . 1.0 . . . . . . . . . . . . A . 1 MET H1 . . . . . . . . . c16368_2kko 1 . 1 . 7 . 1 1 1 MET H2 H 1.462 1.426 -29.723 . . . 1.0 . . . . . . . . . . . . A . 1 MET H2 . . . . . . . . . c16368_2kko 1 . 1 . 8 . 1 1 1 MET H3 H 0.470 2.018 -30.965 . . . 1.0 . . . . . . . . . . . . A . 1 MET H3 . . . . . . . . . c16368_2kko 1 . 1 . 9 . 1 1 1 MET HA H 2.185 3.631 -29.167 . . . 1.0 . . . . . . . . . . . . A . 1 MET HA . . . . . . . . . c16368_2kko 1 . 1 . 10 . 1 1 1 MET HB2 H 3.393 2.309 -30.893 . . . 1.0 . . . . . . . . . . . . A . 1 MET HB2 . . . . . . . . . c16368_2kko 1 . 1 . 11 . 1 1 1 MET HB3 H 2.424 3.092 -32.134 . . . 1.0 . . . . . . . . . . . . A . 1 MET HB3 . . . . . . . . . c16368_2kko 1 . 1 . 12 . 1 1 1 MET HE1 H 4.600 4.065 -34.883 . . . 1.0 . . . . . . . . . . . . A . 1 MET HE1 . . . . . . . . . c16368_2kko 1 . 1 . 13 . 1 1 1 MET HE2 H 3.533 5.180 -34.029 . . . 1.0 . . . . . . . . . . . . A . 1 MET HE2 . . . . . . . . . c16368_2kko 1 . 1 . 14 . 1 1 1 MET HE3 H 3.260 3.440 -33.919 . . . 1.0 . . . . . . . . . . . . A . 1 MET HE3 . . . . . . . . . c16368_2kko 1 . 1 . 15 . 1 1 1 MET HG2 H 3.347 5.276 -31.392 . . . 1.0 . . . . . . . . . . . . A . 1 MET HG2 . . . . . . . . . c16368_2kko 1 . 1 . 16 . 1 1 1 MET HG3 H 4.405 4.404 -30.286 . . . 1.0 . . . . . . . . . . . . A . 1 MET HG3 . . . . . . . . . c16368_2kko 1 . 1 . 17 . 1 1 1 MET N N 0.891 2.241 -30.038 . . . 1.0 . . . . . . . . . . . . A . 1 MET N . . . . . . . . . c16368_2kko 1 . 1 . 18 . 1 1 1 MET O O 1.322 5.802 -30.279 . . . 1.0 . . . . . . . . . . . . A . 1 MET O . . . . . . . . . c16368_2kko 1 . 1 . 19 . 1 1 1 MET SD S 5.081 4.135 -32.552 . . . 1.0 . . . . . . . . . . . . A . 1 MET SD . . . . . . . . . c16368_2kko 1 . 1 . 20 . 1 1 2 ALA C C -1.544 6.367 -30.467 . . . 1.0 . . . . . . . . . . . . A . 2 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 21 . 1 1 2 ALA CA C -1.081 5.513 -31.644 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 22 . 1 1 2 ALA CB C -2.274 4.950 -32.401 . . . 1.0 . . . . . . . . . . . . A . 2 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 23 . 1 1 2 ALA H H -0.473 3.505 -31.389 . . . 1.0 . . . . . . . . . . . . A . 2 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 24 . 1 1 2 ALA HA H -0.516 6.135 -32.324 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 25 . 1 1 2 ALA HB1 H -2.867 4.338 -31.736 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 26 . 1 1 2 ALA HB2 H -1.924 4.348 -33.226 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 27 . 1 1 2 ALA HB3 H -2.878 5.763 -32.777 . . . 1.0 . . . . . . . . . . . . A . 2 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 28 . 1 1 2 ALA N N -0.211 4.432 -31.198 . . . 1.0 . . . . . . . . . . . . A . 2 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 29 . 1 1 2 ALA O O -2.285 5.900 -29.596 . . . 1.0 . . . . . . . . . . . . A . 2 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 30 . 1 1 3 GLY C C -0.673 8.104 -28.080 . . . 1.0 . . . . . . . . . . . . A . 3 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 31 . 1 1 3 GLY CA C -1.406 8.502 -29.345 . . . 1.0 . . . . . . . . . . . . A . 3 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 32 . 1 1 3 GLY H H -0.527 7.932 -31.185 . . . 1.0 . . . . . . . . . . . . A . 3 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 33 . 1 1 3 GLY HA2 H -1.124 9.509 -29.615 . . . 1.0 . . . . . . . . . . . . A . 3 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 34 . 1 1 3 GLY HA3 H -2.470 8.470 -29.159 . . . 1.0 . . . . . . . . . . . . A . 3 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 35 . 1 1 3 GLY N N -1.093 7.614 -30.444 . . . 1.0 . . . . . . . . . . . . A . 3 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 36 . 1 1 3 GLY O O 0.559 8.151 -28.029 . . . 1.0 . . . . . . . . . . . . A . 3 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 37 . 1 1 4 GLN C C -1.966 6.674 -24.914 . . . 1.0 . . . . . . . . . . . . A . 4 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 38 . 1 1 4 GLN CA C -0.865 7.238 -25.804 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 39 . 1 1 4 GLN CB C -0.114 8.366 -25.082 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 40 . 1 1 4 GLN CD C -0.099 10.760 -24.296 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 41 . 1 1 4 GLN CG C -0.926 9.633 -24.881 . . . 1.0 . . . . . . . . . . . . A . 4 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 42 . 1 1 4 GLN H H -2.408 7.701 -27.176 . . . 1.0 . . . . . . . . . . . . A . 4 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 43 . 1 1 4 GLN HA H -0.169 6.445 -26.031 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 44 . 1 1 4 GLN HB2 H 0.195 8.009 -24.111 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 45 . 1 1 4 GLN HB3 H 0.766 8.618 -25.657 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 46 . 1 1 4 GLN HE21 H -1.184 12.100 -25.275 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 47 . 1 1 4 GLN HE22 H 0.096 12.735 -24.305 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 48 . 1 1 4 GLN HG2 H -1.319 9.952 -25.835 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 49 . 1 1 4 GLN HG3 H -1.746 9.419 -24.208 . . . 1.0 . . . . . . . . . . . . A . 4 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 50 . 1 1 4 GLN N N -1.430 7.699 -27.068 . . . 1.0 . . . . . . . . . . . . A . 4 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 51 . 1 1 4 GLN NE2 N -0.430 11.987 -24.660 . . . 1.0 . . . . . . . . . . . . A . 4 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 52 . 1 1 4 GLN O O -3.075 7.212 -24.868 . . . 1.0 . . . . . . . . . . . . A . 4 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 53 . 1 1 4 GLN OE1 O 0.842 10.529 -23.535 . . . 1.0 . . . . . . . . . . . . A . 4 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 54 . 1 1 5 SER C C -2.478 5.413 -21.935 . . . 1.0 . . . . . . . . . . . . A . 5 SER C . . . . . . . . . c16368_2kko 1 . 1 . 55 . 1 1 5 SER CA C -2.635 4.926 -23.371 . . . 1.0 . . . . . . . . . . . . A . 5 SER CA . . . . . . . . . c16368_2kko 1 . 1 . 56 . 1 1 5 SER CB C -2.454 3.408 -23.433 . . . 1.0 . . . . . . . . . . . . A . 5 SER CB . . . . . . . . . c16368_2kko 1 . 1 . 57 . 1 1 5 SER H H -0.758 5.202 -24.309 . . . 1.0 . . . . . . . . . . . . A . 5 SER H . . . . . . . . . c16368_2kko 1 . 1 . 58 . 1 1 5 SER HA H -3.622 5.182 -23.722 . . . 1.0 . . . . . . . . . . . . A . 5 SER HA . . . . . . . . . c16368_2kko 1 . 1 . 59 . 1 1 5 SER HB2 H -1.531 3.139 -22.943 . . . 1.0 . . . . . . . . . . . . A . 5 SER HB2 . . . . . . . . . c16368_2kko 1 . 1 . 60 . 1 1 5 SER HB3 H -3.282 2.928 -22.930 . . . 1.0 . . . . . . . . . . . . A . 5 SER HB3 . . . . . . . . . c16368_2kko 1 . 1 . 61 . 1 1 5 SER HG H -2.510 3.701 -25.382 . . . 1.0 . . . . . . . . . . . . A . 5 SER HG . . . . . . . . . c16368_2kko 1 . 1 . 62 . 1 1 5 SER N N -1.665 5.579 -24.234 . . . 1.0 . . . . . . . . . . . . A . 5 SER N . . . . . . . . . c16368_2kko 1 . 1 . 63 . 1 1 5 SER O O -1.518 5.058 -21.251 . . . 1.0 . . . . . . . . . . . . A . 5 SER O . . . . . . . . . c16368_2kko 1 . 1 . 64 . 1 1 5 SER OG O -2.409 2.950 -24.776 . . . 1.0 . . . . . . . . . . . . A . 5 SER OG . . . . . . . . . c16368_2kko 1 . 1 . 65 . 1 1 6 ASP C C -4.210 5.941 -19.182 . . . 1.0 . . . . . . . . . . . . A . 6 ASP C . . . . . . . . . c16368_2kko 1 . 1 . 66 . 1 1 6 ASP CA C -3.359 6.771 -20.129 . . . 1.0 . . . . . . . . . . . . A . 6 ASP CA . . . . . . . . . c16368_2kko 1 . 1 . 67 . 1 1 6 ASP CB C -3.816 8.232 -20.089 . . . 1.0 . . . . . . . . . . . . A . 6 ASP CB . . . . . . . . . c16368_2kko 1 . 1 . 68 . 1 1 6 ASP CG C -2.844 9.175 -20.767 . . . 1.0 . . . . . . . . . . . . A . 6 ASP CG . . . . . . . . . c16368_2kko 1 . 1 . 69 . 1 1 6 ASP H H -4.167 6.481 -22.074 . . . 1.0 . . . . . . . . . . . . A . 6 ASP H . . . . . . . . . c16368_2kko 1 . 1 . 70 . 1 1 6 ASP HA H -2.333 6.719 -19.800 . . . 1.0 . . . . . . . . . . . . A . 6 ASP HA . . . . . . . . . c16368_2kko 1 . 1 . 71 . 1 1 6 ASP HB2 H -4.771 8.316 -20.584 . . . 1.0 . . . . . . . . . . . . A . 6 ASP HB2 . . . . . . . . . c16368_2kko 1 . 1 . 72 . 1 1 6 ASP HB3 H -3.923 8.537 -19.058 . . . 1.0 . . . . . . . . . . . . A . 6 ASP HB3 . . . . . . . . . c16368_2kko 1 . 1 . 73 . 1 1 6 ASP N N -3.414 6.232 -21.483 . . . 1.0 . . . . . . . . . . . . A . 6 ASP N . . . . . . . . . c16368_2kko 1 . 1 . 74 . 1 1 6 ASP O O -4.403 6.306 -18.023 . . . 1.0 . . . . . . . . . . . . A . 6 ASP O . . . . . . . . . c16368_2kko 1 . 1 . 75 . 1 1 6 ASP OD1 O -1.658 9.205 -20.372 . . . 1.0 . . . . . . . . . . . . A . 6 ASP OD1 . . . . . . . . . c16368_2kko 1 . 1 . 76 . 1 1 6 ASP OD2 O -3.267 9.900 -21.696 . . . 1.0 . . . . . . . . . . . . A . 6 ASP OD2 . . . . . . . . . c16368_2kko 1 . 1 . 77 . 1 1 7 ARG C C -4.749 3.366 -17.671 . . . 1.0 . . . . . . . . . . . . A . 7 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 78 . 1 1 7 ARG CA C -5.528 3.910 -18.867 . . . 1.0 . . . . . . . . . . . . A . 7 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 79 . 1 1 7 ARG CB C -6.062 2.746 -19.707 . . . 1.0 . . . . . . . . . . . . A . 7 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 80 . 1 1 7 ARG CD C -7.607 2.020 -21.550 . . . 1.0 . . . . . . . . . . . . A . 7 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 81 . 1 1 7 ARG CG C -6.820 3.177 -20.953 . . . 1.0 . . . . . . . . . . . . A . 7 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 82 . 1 1 7 ARG CZ C -9.311 0.482 -20.620 . . . 1.0 . . . . . . . . . . . . A . 7 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 83 . 1 1 7 ARG H H -4.486 4.559 -20.597 . . . 1.0 . . . . . . . . . . . . A . 7 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 84 . 1 1 7 ARG HA H -6.363 4.487 -18.499 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 85 . 1 1 7 ARG HB2 H -5.229 2.133 -20.016 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 86 . 1 1 7 ARG HB3 H -6.725 2.153 -19.096 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 87 . 1 1 7 ARG HD2 H -7.912 2.287 -22.550 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 88 . 1 1 7 ARG HD3 H -6.968 1.150 -21.588 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 89 . 1 1 7 ARG HE H -9.245 2.454 -20.305 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 90 . 1 1 7 ARG HG2 H -7.506 3.967 -20.690 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 91 . 1 1 7 ARG HG3 H -6.115 3.537 -21.687 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 92 . 1 1 7 ARG HH11 H -7.896 -0.445 -21.743 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 93 . 1 1 7 ARG HH12 H -9.127 -1.487 -21.094 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 94 . 1 1 7 ARG HH21 H -10.850 1.108 -19.455 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 95 . 1 1 7 ARG HH22 H -10.810 -0.606 -19.782 . . . 1.0 . . . . . . . . . . . . A . 7 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 96 . 1 1 7 ARG N N -4.692 4.801 -19.672 . . . 1.0 . . . . . . . . . . . . A . 7 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 97 . 1 1 7 ARG NE N -8.796 1.704 -20.755 . . . 1.0 . . . . . . . . . . . . A . 7 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 98 . 1 1 7 ARG NH1 N -8.730 -0.564 -21.199 . . . 1.0 . . . . . . . . . . . . A . 7 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 99 . 1 1 7 ARG NH2 N -10.409 0.315 -19.896 . . . 1.0 . . . . . . . . . . . . A . 7 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 100 . 1 1 7 ARG O O -5.334 2.882 -16.706 . . . 1.0 . . . . . . . . . . . . A . 7 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 101 . 1 1 8 LYS C C -2.828 3.870 -15.397 . . . 1.0 . . . . . . . . . . . . A . 8 LYS C . . . . . . . . . c16368_2kko 1 . 1 . 102 . 1 1 8 LYS CA C -2.566 3.029 -16.647 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CA . . . . . . . . . c16368_2kko 1 . 1 . 103 . 1 1 8 LYS CB C -1.094 3.121 -17.062 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CB . . . . . . . . . c16368_2kko 1 . 1 . 104 . 1 1 8 LYS CD C 1.275 2.370 -16.686 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CD . . . . . . . . . c16368_2kko 1 . 1 . 105 . 1 1 8 LYS CE C 2.162 1.392 -15.934 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CE . . . . . . . . . c16368_2kko 1 . 1 . 106 . 1 1 8 LYS CG C -0.147 2.358 -16.147 . . . 1.0 . . . . . . . . . . . . A . 8 LYS CG . . . . . . . . . c16368_2kko 1 . 1 . 107 . 1 1 8 LYS H H -3.018 3.847 -18.542 . . . 1.0 . . . . . . . . . . . . A . 8 LYS H . . . . . . . . . c16368_2kko 1 . 1 . 108 . 1 1 8 LYS HA H -2.807 1.998 -16.430 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HA . . . . . . . . . c16368_2kko 1 . 1 . 109 . 1 1 8 LYS HB2 H -0.990 2.725 -18.062 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 110 . 1 1 8 LYS HB3 H -0.797 4.159 -17.065 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 111 . 1 1 8 LYS HD2 H 1.257 2.094 -17.730 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 112 . 1 1 8 LYS HD3 H 1.681 3.365 -16.582 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HD3 . . . . . . . . . c16368_2kko 1 . 1 . 113 . 1 1 8 LYS HE2 H 2.248 1.720 -14.909 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 114 . 1 1 8 LYS HE3 H 1.700 0.415 -15.961 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HE3 . . . . . . . . . c16368_2kko 1 . 1 . 115 . 1 1 8 LYS HG2 H -0.156 2.816 -15.168 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG2 . . . . . . . . . c16368_2kko 1 . 1 . 116 . 1 1 8 LYS HG3 H -0.485 1.334 -16.070 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HG3 . . . . . . . . . c16368_2kko 1 . 1 . 117 . 1 1 8 LYS HZ1 H 3.461 1.260 -17.570 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ1 . . . . . . . . . c16368_2kko 1 . 1 . 118 . 1 1 8 LYS HZ2 H 4.003 0.444 -16.188 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ2 . . . . . . . . . c16368_2kko 1 . 1 . 119 . 1 1 8 LYS HZ3 H 4.098 2.133 -16.253 . . . 1.0 . . . . . . . . . . . . A . 8 LYS HZ3 . . . . . . . . . c16368_2kko 1 . 1 . 120 . 1 1 8 LYS N N -3.425 3.468 -17.736 . . . 1.0 . . . . . . . . . . . . A . 8 LYS N . . . . . . . . . c16368_2kko 1 . 1 . 121 . 1 1 8 LYS NZ N 3.523 1.303 -16.529 . . . 1.0 . . . . . . . . . . . . A . 8 LYS NZ . . . . . . . . . c16368_2kko 1 . 1 . 122 . 1 1 8 LYS O O -2.543 3.445 -14.276 . . . 1.0 . . . . . . . . . . . . A . 8 LYS O . . . . . . . . . c16368_2kko 1 . 1 . 123 . 1 1 9 ALA C C -4.887 5.273 -13.672 . . . 1.0 . . . . . . . . . . . . A . 9 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 124 . 1 1 9 ALA CA C -3.773 5.919 -14.483 . . . 1.0 . . . . . . . . . . . . A . 9 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 125 . 1 1 9 ALA CB C -4.203 7.288 -14.985 . . . 1.0 . . . . . . . . . . . . A . 9 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 126 . 1 1 9 ALA H H -3.573 5.357 -16.514 . . . 1.0 . . . . . . . . . . . . A . 9 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 127 . 1 1 9 ALA HA H -2.908 6.045 -13.850 . . . 1.0 . . . . . . . . . . . . A . 9 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 128 . 1 1 9 ALA HB1 H -4.431 7.924 -14.143 . . . 1.0 . . . . . . . . . . . . A . 9 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 129 . 1 1 9 ALA HB2 H -5.081 7.184 -15.605 . . . 1.0 . . . . . . . . . . . . A . 9 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 130 . 1 1 9 ALA HB3 H -3.403 7.728 -15.562 . . . 1.0 . . . . . . . . . . . . A . 9 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 131 . 1 1 9 ALA N N -3.395 5.057 -15.595 . . . 1.0 . . . . . . . . . . . . A . 9 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 132 . 1 1 9 ALA O O -4.982 5.467 -12.463 . . . 1.0 . . . . . . . . . . . . A . 9 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 133 . 1 1 10 ALA C C -6.202 2.571 -12.910 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 134 . 1 1 10 ALA CA C -6.784 3.752 -13.675 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 135 . 1 1 10 ALA CB C -7.825 3.280 -14.679 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 136 . 1 1 10 ALA H H -5.609 4.388 -15.317 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 137 . 1 1 10 ALA HA H -7.262 4.421 -12.976 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 138 . 1 1 10 ALA HB1 H -8.235 4.134 -15.198 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 139 . 1 1 10 ALA HB2 H -8.616 2.761 -14.159 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 140 . 1 1 10 ALA HB3 H -7.363 2.613 -15.391 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 141 . 1 1 10 ALA N N -5.719 4.485 -14.345 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 142 . 1 1 10 ALA O O -6.777 2.105 -11.926 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 143 . 1 1 11 LEU C C -3.720 1.610 -11.403 . . . 1.0 . . . . . . . . . . . . A . 11 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 144 . 1 1 11 LEU CA C -4.334 1.041 -12.678 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 145 . 1 1 11 LEU CB C -3.261 0.447 -13.606 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 146 . 1 1 11 LEU CD1 C -1.944 -1.564 -14.302 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 147 . 1 1 11 LEU CD2 C -1.520 -0.546 -12.073 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 148 . 1 1 11 LEU CG C -2.579 -0.842 -13.125 . . . 1.0 . . . . . . . . . . . . A . 11 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 149 . 1 1 11 LEU H H -4.659 2.489 -14.179 . . . 1.0 . . . . . . . . . . . . A . 11 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 150 . 1 1 11 LEU HA H -5.047 0.274 -12.415 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 151 . 1 1 11 LEU HB2 H -3.722 0.244 -14.561 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 152 . 1 1 11 LEU HB3 H -2.496 1.196 -13.753 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 153 . 1 1 11 LEU HD11 H -1.203 -0.925 -14.759 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 154 . 1 1 11 LEU HD12 H -2.705 -1.809 -15.027 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 155 . 1 1 11 LEU HD13 H -1.471 -2.472 -13.956 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 156 . 1 1 11 LEU HD21 H -1.982 -0.059 -11.227 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 157 . 1 1 11 LEU HD22 H -0.768 0.103 -12.493 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 158 . 1 1 11 LEU HD23 H -1.063 -1.469 -11.751 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 159 . 1 1 11 LEU HG H -3.319 -1.496 -12.688 . . . 1.0 . . . . . . . . . . . . A . 11 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 160 . 1 1 11 LEU N N -5.045 2.103 -13.364 . . . 1.0 . . . . . . . . . . . . A . 11 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 161 . 1 1 11 LEU O O -3.804 1.006 -10.334 . . . 1.0 . . . . . . . . . . . . A . 11 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 162 . 1 1 12 LEU C C -3.687 3.896 -9.412 . . . 1.0 . . . . . . . . . . . . A . 12 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 163 . 1 1 12 LEU CA C -2.573 3.501 -10.378 . . . 1.0 . . . . . . . . . . . . A . 12 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 164 . 1 1 12 LEU CB C -1.803 4.745 -10.831 . . . 1.0 . . . . . . . . . . . . A . 12 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 165 . 1 1 12 LEU CD1 C 0.096 5.785 -12.098 . . . 1.0 . . . . . . . . . . . . A . 12 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 166 . 1 1 12 LEU CD2 C 0.384 3.527 -11.060 . . . 1.0 . . . . . . . . . . . . A . 12 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 167 . 1 1 12 LEU CG C -0.595 4.478 -11.738 . . . 1.0 . . . . . . . . . . . . A . 12 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 168 . 1 1 12 LEU H H -3.059 3.200 -12.418 . . . 1.0 . . . . . . . . . . . . A . 12 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 169 . 1 1 12 LEU HA H -1.892 2.830 -9.874 . . . 1.0 . . . . . . . . . . . . A . 12 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 170 . 1 1 12 LEU HB2 H -2.489 5.392 -11.359 . . . 1.0 . . . . . . . . . . . . A . 12 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 171 . 1 1 12 LEU HB3 H -1.454 5.263 -9.951 . . . 1.0 . . . . . . . . . . . . A . 12 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 172 . 1 1 12 LEU HD11 H 0.932 5.583 -12.751 . . . 1.0 . . . . . . . . . . . . A . 12 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 173 . 1 1 12 LEU HD12 H 0.451 6.263 -11.197 . . . 1.0 . . . . . . . . . . . . A . 12 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 174 . 1 1 12 LEU HD13 H -0.604 6.437 -12.600 . . . 1.0 . . . . . . . . . . . . A . 12 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 175 . 1 1 12 LEU HD21 H -0.112 2.593 -10.845 . . . 1.0 . . . . . . . . . . . . A . 12 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 176 . 1 1 12 LEU HD22 H 0.734 3.968 -10.138 . . . 1.0 . . . . . . . . . . . . A . 12 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 177 . 1 1 12 LEU HD23 H 1.224 3.346 -11.715 . . . 1.0 . . . . . . . . . . . . A . 12 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 178 . 1 1 12 LEU HG H -0.934 4.018 -12.655 . . . 1.0 . . . . . . . . . . . . A . 12 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 179 . 1 1 12 LEU N N -3.128 2.794 -11.527 . . . 1.0 . . . . . . . . . . . . A . 12 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 180 . 1 1 12 LEU O O -3.486 3.929 -8.199 . . . 1.0 . . . . . . . . . . . . A . 12 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 181 . 1 1 13 ASP C C -6.364 3.308 -8.241 . . . 1.0 . . . . . . . . . . . . A . 13 ASP C . . . . . . . . . c16368_2kko 1 . 1 . 182 . 1 1 13 ASP CA C -6.048 4.478 -9.163 . . . 1.0 . . . . . . . . . . . . A . 13 ASP CA . . . . . . . . . c16368_2kko 1 . 1 . 183 . 1 1 13 ASP CB C -7.252 4.763 -10.069 . . . 1.0 . . . . . . . . . . . . A . 13 ASP CB . . . . . . . . . c16368_2kko 1 . 1 . 184 . 1 1 13 ASP CG C -8.549 4.931 -9.295 . . . 1.0 . . . . . . . . . . . . A . 13 ASP CG . . . . . . . . . c16368_2kko 1 . 1 . 185 . 1 1 13 ASP H H -4.926 4.231 -10.945 . . . 1.0 . . . . . . . . . . . . A . 13 ASP H . . . . . . . . . c16368_2kko 1 . 1 . 186 . 1 1 13 ASP HA H -5.842 5.352 -8.563 . . . 1.0 . . . . . . . . . . . . A . 13 ASP HA . . . . . . . . . c16368_2kko 1 . 1 . 187 . 1 1 13 ASP HB2 H -7.068 5.672 -10.620 . . . 1.0 . . . . . . . . . . . . A . 13 ASP HB2 . . . . . . . . . c16368_2kko 1 . 1 . 188 . 1 1 13 ASP HB3 H -7.373 3.945 -10.764 . . . 1.0 . . . . . . . . . . . . A . 13 ASP HB3 . . . . . . . . . c16368_2kko 1 . 1 . 189 . 1 1 13 ASP N N -4.860 4.190 -9.965 . . . 1.0 . . . . . . . . . . . . A . 13 ASP N . . . . . . . . . c16368_2kko 1 . 1 . 190 . 1 1 13 ASP O O -6.663 3.499 -7.064 . . . 1.0 . . . . . . . . . . . . A . 13 ASP O . . . . . . . . . c16368_2kko 1 . 1 . 191 . 1 1 13 ASP OD1 O -9.194 3.911 -8.962 . . . 1.0 . . . . . . . . . . . . A . 13 ASP OD1 . . . . . . . . . c16368_2kko 1 . 1 . 192 . 1 1 13 ASP OD2 O -8.941 6.086 -9.026 . . . 1.0 . . . . . . . . . . . . A . 13 ASP OD2 . . . . . . . . . c16368_2kko 1 . 1 . 193 . 1 1 14 GLN C C -5.463 0.665 -6.966 . . . 1.0 . . . . . . . . . . . . A . 14 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 194 . 1 1 14 GLN CA C -6.555 0.891 -8.013 . . . 1.0 . . . . . . . . . . . . A . 14 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 195 . 1 1 14 GLN CB C -6.667 -0.318 -8.947 . . . 1.0 . . . . . . . . . . . . A . 14 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 196 . 1 1 14 GLN CD C -8.561 -1.422 -7.671 . . . 1.0 . . . . . . . . . . . . A . 14 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 197 . 1 1 14 GLN CG C -7.171 -1.582 -8.263 . . . 1.0 . . . . . . . . . . . . A . 14 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 198 . 1 1 14 GLN H H -6.051 2.017 -9.737 . . . 1.0 . . . . . . . . . . . . A . 14 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 199 . 1 1 14 GLN HA H -7.498 1.031 -7.503 . . . 1.0 . . . . . . . . . . . . A . 14 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 200 . 1 1 14 GLN HB2 H -7.347 -0.074 -9.748 . . . 1.0 . . . . . . . . . . . . A . 14 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 201 . 1 1 14 GLN HB3 H -5.693 -0.526 -9.365 . . . 1.0 . . . . . . . . . . . . A . 14 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 202 . 1 1 14 GLN HE21 H -9.403 -2.053 -9.364 . . . 1.0 . . . . . . . . . . . . A . 14 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 203 . 1 1 14 GLN HE22 H -10.488 -1.649 -8.078 . . . 1.0 . . . . . . . . . . . . A . 14 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 204 . 1 1 14 GLN HG2 H -7.198 -2.381 -8.991 . . . 1.0 . . . . . . . . . . . . A . 14 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 205 . 1 1 14 GLN HG3 H -6.486 -1.843 -7.471 . . . 1.0 . . . . . . . . . . . . A . 14 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 206 . 1 1 14 GLN N N -6.285 2.098 -8.785 . . . 1.0 . . . . . . . . . . . . A . 14 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 207 . 1 1 14 GLN NE2 N -9.585 -1.736 -8.449 . . . 1.0 . . . . . . . . . . . . A . 14 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 208 . 1 1 14 GLN O O -5.748 0.270 -5.835 . . . 1.0 . . . . . . . . . . . . A . 14 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 209 . 1 1 14 GLN OE1 O -8.714 -1.021 -6.520 . . . 1.0 . . . . . . . . . . . . A . 14 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 210 . 1 1 15 VAL C C -3.250 1.796 -5.258 . . . 1.0 . . . . . . . . . . . . A . 15 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 211 . 1 1 15 VAL CA C -3.096 0.808 -6.413 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 212 . 1 1 15 VAL CB C -1.740 1.050 -7.113 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 213 . 1 1 15 VAL CG1 C -0.589 0.948 -6.122 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 214 . 1 1 15 VAL CG2 C -1.541 0.068 -8.256 . . . 1.0 . . . . . . . . . . . . A . 15 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 215 . 1 1 15 VAL H H -4.046 1.220 -8.266 . . . 1.0 . . . . . . . . . . . . A . 15 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 216 . 1 1 15 VAL HA H -3.102 -0.198 -6.017 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 217 . 1 1 15 VAL HB H -1.744 2.048 -7.523 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 218 . 1 1 15 VAL HG11 H -0.577 -0.039 -5.682 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 219 . 1 1 15 VAL HG12 H -0.717 1.686 -5.344 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 220 . 1 1 15 VAL HG13 H 0.344 1.124 -6.635 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 221 . 1 1 15 VAL HG21 H -2.336 0.191 -8.977 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 222 . 1 1 15 VAL HG22 H -1.556 -0.942 -7.873 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 223 . 1 1 15 VAL HG23 H -0.591 0.257 -8.732 . . . 1.0 . . . . . . . . . . . . A . 15 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 224 . 1 1 15 VAL N N -4.216 0.933 -7.342 . . . 1.0 . . . . . . . . . . . . A . 15 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 225 . 1 1 15 VAL O O -3.067 1.446 -4.093 . . . 1.0 . . . . . . . . . . . . A . 15 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 226 . 1 1 16 ALA C C -5.074 3.684 -3.740 . . . 1.0 . . . . . . . . . . . . A . 16 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 227 . 1 1 16 ALA CA C -3.848 4.044 -4.571 . . . 1.0 . . . . . . . . . . . . A . 16 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 228 . 1 1 16 ALA CB C -4.020 5.413 -5.214 . . . 1.0 . . . . . . . . . . . . A . 16 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 229 . 1 1 16 ALA H H -3.697 3.268 -6.536 . . . 1.0 . . . . . . . . . . . . A . 16 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 230 . 1 1 16 ALA HA H -2.983 4.081 -3.924 . . . 1.0 . . . . . . . . . . . . A . 16 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 231 . 1 1 16 ALA HB1 H -4.900 5.412 -5.840 . . . 1.0 . . . . . . . . . . . . A . 16 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 232 . 1 1 16 ALA HB2 H -3.151 5.641 -5.815 . . . 1.0 . . . . . . . . . . . . A . 16 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 233 . 1 1 16 ALA HB3 H -4.129 6.160 -4.443 . . . 1.0 . . . . . . . . . . . . A . 16 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 234 . 1 1 16 ALA N N -3.606 3.031 -5.586 . . . 1.0 . . . . . . . . . . . . A . 16 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 235 . 1 1 16 ALA O O -5.136 3.978 -2.551 . . . 1.0 . . . . . . . . . . . . A . 16 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 236 . 1 1 17 ARG C C -7.011 1.647 -2.597 . . . 1.0 . . . . . . . . . . . . A . 17 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 237 . 1 1 17 ARG CA C -7.283 2.640 -3.722 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 238 . 1 1 17 ARG CB C -8.235 2.030 -4.753 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 239 . 1 1 17 ARG CD C -10.561 1.411 -5.437 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 240 . 1 1 17 ARG CG C -9.695 1.982 -4.325 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 241 . 1 1 17 ARG CZ C -12.922 1.435 -6.127 . . . 1.0 . . . . . . . . . . . . A . 17 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 242 . 1 1 17 ARG H H -5.903 2.792 -5.320 . . . 1.0 . . . . . . . . . . . . A . 17 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 243 . 1 1 17 ARG HA H -7.731 3.530 -3.305 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 244 . 1 1 17 ARG HB2 H -8.172 2.609 -5.661 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 245 . 1 1 17 ARG HB3 H -7.912 1.020 -4.962 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 246 . 1 1 17 ARG HD2 H -10.320 1.918 -6.358 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 247 . 1 1 17 ARG HD3 H -10.340 0.359 -5.541 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 248 . 1 1 17 ARG HE H -12.271 1.762 -4.260 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 249 . 1 1 17 ARG HG2 H -9.787 1.355 -3.452 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 250 . 1 1 17 ARG HG3 H -10.030 2.983 -4.093 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 251 . 1 1 17 ARG HH11 H -11.593 1.105 -7.628 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 252 . 1 1 17 ARG HH12 H -13.268 1.087 -8.099 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 253 . 1 1 17 ARG HH21 H -14.470 1.777 -4.865 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 254 . 1 1 17 ARG HH22 H -14.913 1.466 -6.522 . . . 1.0 . . . . . . . . . . . . A . 17 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 255 . 1 1 17 ARG N N -6.036 3.026 -4.375 . . . 1.0 . . . . . . . . . . . . A . 17 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 256 . 1 1 17 ARG NE N -11.991 1.563 -5.182 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 257 . 1 1 17 ARG NH1 N -12.567 1.191 -7.384 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 258 . 1 1 17 ARG NH2 N -14.202 1.571 -5.817 . . . 1.0 . . . . . . . . . . . . A . 17 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 259 . 1 1 17 ARG O O -7.461 1.836 -1.464 . . . 1.0 . . . . . . . . . . . . A . 17 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 260 . 1 1 18 VAL C C -4.962 0.215 -0.858 . . . 1.0 . . . . . . . . . . . . A . 18 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 261 . 1 1 18 VAL CA C -5.898 -0.395 -1.900 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 262 . 1 1 18 VAL CB C -5.250 -1.660 -2.517 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 263 . 1 1 18 VAL CG1 C -6.191 -2.318 -3.515 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 264 . 1 1 18 VAL CG2 C -3.918 -1.344 -3.180 . . . 1.0 . . . . . . . . . . . . A . 18 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 265 . 1 1 18 VAL H H -5.944 0.481 -3.833 . . . 1.0 . . . . . . . . . . . . A . 18 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 266 . 1 1 18 VAL HA H -6.810 -0.695 -1.403 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 267 . 1 1 18 VAL HB H -5.067 -2.365 -1.719 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 268 . 1 1 18 VAL HG11 H -5.728 -3.211 -3.911 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 269 . 1 1 18 VAL HG12 H -6.397 -1.631 -4.322 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 270 . 1 1 18 VAL HG13 H -7.115 -2.579 -3.020 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 271 . 1 1 18 VAL HG21 H -3.228 -0.966 -2.439 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 272 . 1 1 18 VAL HG22 H -4.066 -0.598 -3.947 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 273 . 1 1 18 VAL HG23 H -3.514 -2.242 -3.623 . . . 1.0 . . . . . . . . . . . . A . 18 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 274 . 1 1 18 VAL N N -6.258 0.596 -2.906 . . . 1.0 . . . . . . . . . . . . A . 18 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 275 . 1 1 18 VAL O O -4.982 -0.170 0.314 . . . 1.0 . . . . . . . . . . . . A . 18 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 276 . 1 1 19 GLY C C -4.054 2.713 0.628 . . . 1.0 . . . . . . . . . . . . A . 19 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 277 . 1 1 19 GLY CA C -3.281 1.894 -0.385 . . . 1.0 . . . . . . . . . . . . A . 19 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 278 . 1 1 19 GLY H H -4.152 1.408 -2.246 . . . 1.0 . . . . . . . . . . . . A . 19 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 279 . 1 1 19 GLY HA2 H -2.663 1.180 0.140 . . . 1.0 . . . . . . . . . . . . A . 19 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 280 . 1 1 19 GLY HA3 H -2.647 2.554 -0.958 . . . 1.0 . . . . . . . . . . . . A . 19 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 281 . 1 1 19 GLY N N -4.158 1.183 -1.292 . . . 1.0 . . . . . . . . . . . . A . 19 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 282 . 1 1 19 GLY O O -3.729 2.711 1.810 . . . 1.0 . . . . . . . . . . . . A . 19 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 283 . 1 1 20 LYS C C -6.622 3.352 2.084 . . . 1.0 . . . . . . . . . . . . A . 20 LYS C . . . . . . . . . c16368_2kko 1 . 1 . 284 . 1 1 20 LYS CA C -5.940 4.212 1.031 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CA . . . . . . . . . c16368_2kko 1 . 1 . 285 . 1 1 20 LYS CB C -6.998 4.951 0.210 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CB . . . . . . . . . c16368_2kko 1 . 1 . 286 . 1 1 20 LYS CD C -7.469 6.457 -1.738 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CD . . . . . . . . . c16368_2kko 1 . 1 . 287 . 1 1 20 LYS CE C -6.876 7.415 -2.755 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CE . . . . . . . . . c16368_2kko 1 . 1 . 288 . 1 1 20 LYS CG C -6.424 5.987 -0.741 . . . 1.0 . . . . . . . . . . . . A . 20 LYS CG . . . . . . . . . c16368_2kko 1 . 1 . 289 . 1 1 20 LYS H H -5.286 3.370 -0.803 . . . 1.0 . . . . . . . . . . . . A . 20 LYS H . . . . . . . . . c16368_2kko 1 . 1 . 290 . 1 1 20 LYS HA H -5.311 4.935 1.527 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HA . . . . . . . . . c16368_2kko 1 . 1 . 291 . 1 1 20 LYS HB2 H -7.553 4.229 -0.369 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 292 . 1 1 20 LYS HB3 H -7.675 5.453 0.887 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 293 . 1 1 20 LYS HD2 H -7.867 5.600 -2.258 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 294 . 1 1 20 LYS HD3 H -8.263 6.958 -1.204 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HD3 . . . . . . . . . c16368_2kko 1 . 1 . 295 . 1 1 20 LYS HE2 H -6.551 8.309 -2.245 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 296 . 1 1 20 LYS HE3 H -6.028 6.940 -3.227 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HE3 . . . . . . . . . c16368_2kko 1 . 1 . 297 . 1 1 20 LYS HG2 H -6.076 6.835 -0.169 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HG2 . . . . . . . . . c16368_2kko 1 . 1 . 298 . 1 1 20 LYS HG3 H -5.596 5.550 -1.280 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HG3 . . . . . . . . . c16368_2kko 1 . 1 . 299 . 1 1 20 LYS HZ1 H -7.450 8.476 -4.460 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HZ1 . . . . . . . . . c16368_2kko 1 . 1 . 300 . 1 1 20 LYS HZ2 H -8.712 8.209 -3.356 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HZ2 . . . . . . . . . c16368_2kko 1 . 1 . 301 . 1 1 20 LYS HZ3 H -8.155 6.939 -4.335 . . . 1.0 . . . . . . . . . . . . A . 20 LYS HZ3 . . . . . . . . . c16368_2kko 1 . 1 . 302 . 1 1 20 LYS N N -5.091 3.401 0.161 . . . 1.0 . . . . . . . . . . . . A . 20 LYS N . . . . . . . . . c16368_2kko 1 . 1 . 303 . 1 1 20 LYS NZ N -7.867 7.786 -3.797 . . . 1.0 . . . . . . . . . . . . A . 20 LYS NZ . . . . . . . . . c16368_2kko 1 . 1 . 304 . 1 1 20 LYS O O -6.819 3.781 3.219 . . . 1.0 . . . . . . . . . . . . A . 20 LYS O . . . . . . . . . c16368_2kko 1 . 1 . 305 . 1 1 21 ALA C C -6.620 0.724 3.671 . . . 1.0 . . . . . . . . . . . . A . 21 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 306 . 1 1 21 ALA CA C -7.620 1.209 2.623 . . . 1.0 . . . . . . . . . . . . A . 21 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 307 . 1 1 21 ALA CB C -8.213 0.034 1.859 . . . 1.0 . . . . . . . . . . . . A . 21 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 308 . 1 1 21 ALA H H -6.835 1.862 0.767 . . . 1.0 . . . . . . . . . . . . A . 21 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 309 . 1 1 21 ALA HA H -8.426 1.729 3.122 . . . 1.0 . . . . . . . . . . . . A . 21 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 310 . 1 1 21 ALA HB1 H -7.421 -0.501 1.357 . . . 1.0 . . . . . . . . . . . . A . 21 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 311 . 1 1 21 ALA HB2 H -8.922 0.398 1.129 . . . 1.0 . . . . . . . . . . . . A . 21 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 312 . 1 1 21 ALA HB3 H -8.714 -0.629 2.549 . . . 1.0 . . . . . . . . . . . . A . 21 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 313 . 1 1 21 ALA N N -6.989 2.138 1.699 . . . 1.0 . . . . . . . . . . . . A . 21 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 314 . 1 1 21 ALA O O -6.931 0.661 4.863 . . . 1.0 . . . . . . . . . . . . A . 21 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 315 . 1 1 22 LEU C C -3.793 0.961 5.000 . . . 1.0 . . . . . . . . . . . . A . 22 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 316 . 1 1 22 LEU CA C -4.372 -0.125 4.089 . . . 1.0 . . . . . . . . . . . . A . 22 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 317 . 1 1 22 LEU CB C -3.271 -0.764 3.227 . . . 1.0 . . . . . . . . . . . . A . 22 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 318 . 1 1 22 LEU CD1 C -1.555 -2.586 3.158 . . . 1.0 . . . . . . . . . . . . A . 22 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 319 . 1 1 22 LEU CD2 C -1.016 -0.436 4.289 . . . 1.0 . . . . . . . . . . . . A . 22 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 320 . 1 1 22 LEU CG C -2.119 -1.438 3.981 . . . 1.0 . . . . . . . . . . . . A . 22 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 321 . 1 1 22 LEU H H -5.212 0.549 2.265 . . . 1.0 . . . . . . . . . . . . A . 22 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 322 . 1 1 22 LEU HA H -4.820 -0.890 4.704 . . . 1.0 . . . . . . . . . . . . A . 22 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 323 . 1 1 22 LEU HB2 H -3.734 -1.505 2.593 . . . 1.0 . . . . . . . . . . . . A . 22 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 324 . 1 1 22 LEU HB3 H -2.851 0.006 2.596 . . . 1.0 . . . . . . . . . . . . A . 22 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 325 . 1 1 22 LEU HD11 H -2.329 -3.322 2.991 . . . 1.0 . . . . . . . . . . . . A . 22 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 326 . 1 1 22 LEU HD12 H -0.734 -3.042 3.690 . . . 1.0 . . . . . . . . . . . . A . 22 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 327 . 1 1 22 LEU HD13 H -1.204 -2.209 2.208 . . . 1.0 . . . . . . . . . . . . A . 22 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 328 . 1 1 22 LEU HD21 H -1.417 0.361 4.898 . . . 1.0 . . . . . . . . . . . . A . 22 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 329 . 1 1 22 LEU HD22 H -0.632 -0.026 3.366 . . . 1.0 . . . . . . . . . . . . A . 22 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 330 . 1 1 22 LEU HD23 H -0.218 -0.931 4.823 . . . 1.0 . . . . . . . . . . . . A . 22 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 331 . 1 1 22 LEU HG H -2.486 -1.838 4.915 . . . 1.0 . . . . . . . . . . . . A . 22 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 332 . 1 1 22 LEU N N -5.412 0.413 3.218 . . . 1.0 . . . . . . . . . . . . A . 22 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 333 . 1 1 22 LEU O O -3.470 0.704 6.164 . . . 1.0 . . . . . . . . . . . . A . 22 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 334 . 1 1 23 ALA C C -4.067 3.730 6.338 . . . 1.0 . . . . . . . . . . . . A . 23 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 335 . 1 1 23 ALA CA C -3.120 3.286 5.230 . . . 1.0 . . . . . . . . . . . . A . 23 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 336 . 1 1 23 ALA CB C -2.796 4.452 4.308 . . . 1.0 . . . . . . . . . . . . A . 23 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 337 . 1 1 23 ALA H H -3.979 2.327 3.549 . . . 1.0 . . . . . . . . . . . . A . 23 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 338 . 1 1 23 ALA HA H -2.197 2.948 5.679 . . . 1.0 . . . . . . . . . . . . A . 23 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 339 . 1 1 23 ALA HB1 H -3.704 4.806 3.840 . . . 1.0 . . . . . . . . . . . . A . 23 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 340 . 1 1 23 ALA HB2 H -2.101 4.127 3.548 . . . 1.0 . . . . . . . . . . . . A . 23 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 341 . 1 1 23 ALA HB3 H -2.352 5.252 4.882 . . . 1.0 . . . . . . . . . . . . A . 23 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 342 . 1 1 23 ALA N N -3.680 2.174 4.475 . . . 1.0 . . . . . . . . . . . . A . 23 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 343 . 1 1 23 ALA O O -4.968 4.538 6.117 . . . 1.0 . . . . . . . . . . . . A . 23 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 344 . 1 1 24 ASN C C -4.067 2.914 9.943 . . . 1.0 . . . . . . . . . . . . A . 24 ASN C . . . . . . . . . c16368_2kko 1 . 1 . 345 . 1 1 24 ASN CA C -4.679 3.514 8.687 . . . 1.0 . . . . . . . . . . . . A . 24 ASN CA . . . . . . . . . c16368_2kko 1 . 1 . 346 . 1 1 24 ASN CB C -6.112 3.000 8.509 . . . 1.0 . . . . . . . . . . . . A . 24 ASN CB . . . . . . . . . c16368_2kko 1 . 1 . 347 . 1 1 24 ASN CG C -6.976 3.242 9.731 . . . 1.0 . . . . . . . . . . . . A . 24 ASN CG . . . . . . . . . c16368_2kko 1 . 1 . 348 . 1 1 24 ASN H H -3.136 2.532 7.628 . . . 1.0 . . . . . . . . . . . . A . 24 ASN H . . . . . . . . . c16368_2kko 1 . 1 . 349 . 1 1 24 ASN HA H -4.698 4.590 8.785 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HA . . . . . . . . . c16368_2kko 1 . 1 . 350 . 1 1 24 ASN HB2 H -6.567 3.502 7.668 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 351 . 1 1 24 ASN HB3 H -6.084 1.938 8.316 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 352 . 1 1 24 ASN HD21 H -7.531 5.012 9.023 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HD21 . . . . . . . . . c16368_2kko 1 . 1 . 353 . 1 1 24 ASN HD22 H -8.202 4.569 10.553 . . . 1.0 . . . . . . . . . . . . A . 24 ASN HD22 . . . . . . . . . c16368_2kko 1 . 1 . 354 . 1 1 24 ASN N N -3.863 3.181 7.526 . . . 1.0 . . . . . . . . . . . . A . 24 ASN N . . . . . . . . . c16368_2kko 1 . 1 . 355 . 1 1 24 ASN ND2 N -7.636 4.388 9.774 . . . 1.0 . . . . . . . . . . . . A . 24 ASN ND2 . . . . . . . . . c16368_2kko 1 . 1 . 356 . 1 1 24 ASN O O -4.038 3.544 10.998 . . . 1.0 . . . . . . . . . . . . A . 24 ASN O . . . . . . . . . c16368_2kko 1 . 1 . 357 . 1 1 24 ASN OD1 O -7.051 2.399 10.626 . . . 1.0 . . . . . . . . . . . . A . 24 ASN OD1 . . . . . . . . . c16368_2kko 1 . 1 . 358 . 1 1 25 GLY C C -3.928 0.184 11.752 . . . 1.0 . . . . . . . . . . . . A . 25 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 359 . 1 1 25 GLY CA C -2.955 1.027 10.952 . . . 1.0 . . . . . . . . . . . . A . 25 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 360 . 1 1 25 GLY H H -3.662 1.216 8.964 . . . 1.0 . . . . . . . . . . . . A . 25 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 361 . 1 1 25 GLY HA2 H -2.160 0.391 10.586 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 362 . 1 1 25 GLY HA3 H -2.531 1.778 11.600 . . . 1.0 . . . . . . . . . . . . A . 25 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 363 . 1 1 25 GLY N N -3.586 1.684 9.824 . . . 1.0 . . . . . . . . . . . . A . 25 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 364 . 1 1 25 GLY O O -3.751 -1.024 11.877 . . . 1.0 . . . . . . . . . . . . A . 25 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 365 . 1 1 26 ARG C C -6.760 -0.875 12.286 . . . 1.0 . . . . . . . . . . . . A . 26 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 366 . 1 1 26 ARG CA C -5.949 0.123 13.107 . . . 1.0 . . . . . . . . . . . . A . 26 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 367 . 1 1 26 ARG CB C -6.877 1.131 13.787 . . . 1.0 . . . . . . . . . . . . A . 26 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 368 . 1 1 26 ARG CD C -7.072 3.154 15.280 . . . 1.0 . . . . . . . . . . . . A . 26 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 369 . 1 1 26 ARG CG C -6.129 2.210 14.553 . . . 1.0 . . . . . . . . . . . . A . 26 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 370 . 1 1 26 ARG CZ C -7.924 4.791 13.630 . . . 1.0 . . . . . . . . . . . . A . 26 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 371 . 1 1 26 ARG H H -5.098 1.771 12.077 . . . 1.0 . . . . . . . . . . . . A . 26 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 372 . 1 1 26 ARG HA H -5.402 -0.416 13.866 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 373 . 1 1 26 ARG HB2 H -7.487 1.608 13.034 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 374 . 1 1 26 ARG HB3 H -7.519 0.605 14.479 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 375 . 1 1 26 ARG HD2 H -7.559 2.611 16.076 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 376 . 1 1 26 ARG HD3 H -6.495 3.965 15.700 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 377 . 1 1 26 ARG HE H -8.975 3.260 14.391 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 378 . 1 1 26 ARG HG2 H -5.483 1.739 15.277 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 379 . 1 1 26 ARG HG3 H -5.532 2.780 13.856 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 380 . 1 1 26 ARG HH11 H -5.964 5.050 14.115 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 381 . 1 1 26 ARG HH12 H -6.612 6.211 12.998 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 382 . 1 1 26 ARG HH21 H -9.840 4.804 12.953 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 383 . 1 1 26 ARG HH22 H -8.825 6.087 12.343 . . . 1.0 . . . . . . . . . . . . A . 26 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 384 . 1 1 26 ARG N N -4.975 0.815 12.266 . . . 1.0 . . . . . . . . . . . . A . 26 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 385 . 1 1 26 ARG NE N -8.095 3.710 14.393 . . . 1.0 . . . . . . . . . . . . A . 26 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 386 . 1 1 26 ARG NH1 N -6.740 5.399 13.577 . . . 1.0 . . . . . . . . . . . . A . 26 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 387 . 1 1 26 ARG NH2 N -8.942 5.261 12.916 . . . 1.0 . . . . . . . . . . . . A . 26 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 388 . 1 1 26 ARG O O -7.103 -1.954 12.765 . . . 1.0 . . . . . . . . . . . . A . 26 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 389 . 1 1 27 ARG C C -6.899 -2.589 9.707 . . . 1.0 . . . . . . . . . . . . A . 27 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 390 . 1 1 27 ARG CA C -7.776 -1.414 10.144 . . . 1.0 . . . . . . . . . . . . A . 27 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 391 . 1 1 27 ARG CB C -8.302 -0.654 8.921 . . . 1.0 . . . . . . . . . . . . A . 27 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 392 . 1 1 27 ARG CD C -9.990 1.000 8.039 . . . 1.0 . . . . . . . . . . . . A . 27 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 393 . 1 1 27 ARG CG C -9.294 0.445 9.273 . . . 1.0 . . . . . . . . . . . . A . 27 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 394 . 1 1 27 ARG CZ C -9.304 2.656 6.343 . . . 1.0 . . . . . . . . . . . . A . 27 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 395 . 1 1 27 ARG H H -6.769 0.365 10.718 . . . 1.0 . . . . . . . . . . . . A . 27 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 396 . 1 1 27 ARG HA H -8.617 -1.805 10.697 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 397 . 1 1 27 ARG HB2 H -7.468 -0.203 8.403 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 398 . 1 1 27 ARG HB3 H -8.792 -1.351 8.259 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 399 . 1 1 27 ARG HD2 H -10.544 0.201 7.569 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 400 . 1 1 27 ARG HD3 H -10.677 1.774 8.350 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 401 . 1 1 27 ARG HE H -8.211 1.080 6.914 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 402 . 1 1 27 ARG HG2 H -10.041 0.042 9.941 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 403 . 1 1 27 ARG HG3 H -8.763 1.247 9.767 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 404 . 1 1 27 ARG HH11 H -11.083 3.058 7.237 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 405 . 1 1 27 ARG HH12 H -10.615 4.166 5.978 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 406 . 1 1 27 ARG HH21 H -7.576 2.557 5.285 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 407 . 1 1 27 ARG HH22 H -8.613 3.889 4.889 . . . 1.0 . . . . . . . . . . . . A . 27 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 408 . 1 1 27 ARG N N -7.044 -0.522 11.038 . . . 1.0 . . . . . . . . . . . . A . 27 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 409 . 1 1 27 ARG NE N -9.055 1.561 7.061 . . . 1.0 . . . . . . . . . . . . A . 27 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 410 . 1 1 27 ARG NH1 N -10.419 3.348 6.541 . . . 1.0 . . . . . . . . . . . . A . 27 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 411 . 1 1 27 ARG NH2 N -8.428 3.067 5.435 . . . 1.0 . . . . . . . . . . . . A . 27 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 412 . 1 1 27 ARG O O -7.391 -3.572 9.155 . . . 1.0 . . . . . . . . . . . . A . 27 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 413 . 1 1 28 LEU C C -4.824 -4.700 10.668 . . . 1.0 . . . . . . . . . . . . A . 28 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 414 . 1 1 28 LEU CA C -4.680 -3.578 9.651 . . . 1.0 . . . . . . . . . . . . A . 28 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 415 . 1 1 28 LEU CB C -3.238 -3.067 9.609 . . . 1.0 . . . . . . . . . . . . A . 28 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 416 . 1 1 28 LEU CD1 C -1.516 -1.533 8.631 . . . 1.0 . . . . . . . . . . . . A . 28 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 417 . 1 1 28 LEU CD2 C -3.286 -2.515 7.164 . . . 1.0 . . . . . . . . . . . . A . 28 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 418 . 1 1 28 LEU CG C -2.963 -1.991 8.556 . . . 1.0 . . . . . . . . . . . . A . 28 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 419 . 1 1 28 LEU H H -5.258 -1.689 10.412 . . . 1.0 . . . . . . . . . . . . A . 28 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 420 . 1 1 28 LEU HA H -4.949 -3.959 8.676 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 421 . 1 1 28 LEU HB2 H -2.992 -2.661 10.581 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 422 . 1 1 28 LEU HB3 H -2.586 -3.904 9.413 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 423 . 1 1 28 LEU HD11 H -1.346 -0.751 7.905 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 424 . 1 1 28 LEU HD12 H -0.861 -2.367 8.423 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 425 . 1 1 28 LEU HD13 H -1.311 -1.154 9.622 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 426 . 1 1 28 LEU HD21 H -3.102 -1.738 6.435 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 427 . 1 1 28 LEU HD22 H -4.324 -2.809 7.121 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 428 . 1 1 28 LEU HD23 H -2.661 -3.368 6.946 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 429 . 1 1 28 LEU HG H -3.595 -1.137 8.751 . . . 1.0 . . . . . . . . . . . . A . 28 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 430 . 1 1 28 LEU N N -5.602 -2.496 9.975 . . . 1.0 . . . . . . . . . . . . A . 28 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 431 . 1 1 28 LEU O O -4.497 -5.852 10.391 . . . 1.0 . . . . . . . . . . . . A . 28 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 432 . 1 1 29 GLN C C -6.702 -6.325 12.356 . . . 1.0 . . . . . . . . . . . . A . 29 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 433 . 1 1 29 GLN CA C -5.664 -5.336 12.871 . . . 1.0 . . . . . . . . . . . . A . 29 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 434 . 1 1 29 GLN CB C -6.189 -4.639 14.128 . . . 1.0 . . . . . . . . . . . . A . 29 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 435 . 1 1 29 GLN CD C -4.296 -5.075 15.768 . . . 1.0 . . . . . . . . . . . . A . 29 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 436 . 1 1 29 GLN CG C -5.096 -4.032 15.000 . . . 1.0 . . . . . . . . . . . . A . 29 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 437 . 1 1 29 GLN H H -5.522 -3.402 12.022 . . . 1.0 . . . . . . . . . . . . A . 29 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 438 . 1 1 29 GLN HA H -4.758 -5.871 13.113 . . . 1.0 . . . . . . . . . . . . A . 29 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 439 . 1 1 29 GLN HB2 H -6.859 -3.846 13.827 . . . 1.0 . . . . . . . . . . . . A . 29 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 440 . 1 1 29 GLN HB3 H -6.740 -5.354 14.717 . . . 1.0 . . . . . . . . . . . . A . 29 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 441 . 1 1 29 GLN HE21 H -5.898 -6.227 15.958 . . . 1.0 . . . . . . . . . . . . A . 29 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 442 . 1 1 29 GLN HE22 H -4.453 -6.839 16.666 . . . 1.0 . . . . . . . . . . . . A . 29 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 443 . 1 1 29 GLN HG2 H -4.418 -3.479 14.367 . . . 1.0 . . . . . . . . . . . . A . 29 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 444 . 1 1 29 GLN HG3 H -5.554 -3.357 15.708 . . . 1.0 . . . . . . . . . . . . A . 29 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 445 . 1 1 29 GLN N N -5.346 -4.351 11.842 . . . 1.0 . . . . . . . . . . . . A . 29 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 446 . 1 1 29 GLN NE2 N -4.950 -6.155 16.169 . . . 1.0 . . . . . . . . . . . . A . 29 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 447 . 1 1 29 GLN O O -6.731 -7.484 12.768 . . . 1.0 . . . . . . . . . . . . A . 29 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 448 . 1 1 29 GLN OE1 O -3.106 -4.899 16.024 . . . 1.0 . . . . . . . . . . . . A . 29 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 449 . 1 1 30 ILE C C -7.909 -7.692 9.875 . . . 1.0 . . . . . . . . . . . . A . 30 ILE C . . . . . . . . . c16368_2kko 1 . 1 . 450 . 1 1 30 ILE CA C -8.562 -6.698 10.831 . . . 1.0 . . . . . . . . . . . . A . 30 ILE CA . . . . . . . . . c16368_2kko 1 . 1 . 451 . 1 1 30 ILE CB C -9.601 -5.856 10.059 . . . 1.0 . . . . . . . . . . . . A . 30 ILE CB . . . . . . . . . c16368_2kko 1 . 1 . 452 . 1 1 30 ILE CD1 C -11.175 -3.858 10.279 . . . 1.0 . . . . . . . . . . . . A . 30 ILE CD1 . . . . . . . . . c16368_2kko 1 . 1 . 453 . 1 1 30 ILE CG1 C -10.245 -4.821 10.988 . . . 1.0 . . . . . . . . . . . . A . 30 ILE CG1 . . . . . . . . . c16368_2kko 1 . 1 . 454 . 1 1 30 ILE CG2 C -10.665 -6.758 9.443 . . . 1.0 . . . . . . . . . . . . A . 30 ILE CG2 . . . . . . . . . c16368_2kko 1 . 1 . 455 . 1 1 30 ILE H H -7.488 -4.913 11.184 . . . 1.0 . . . . . . . . . . . . A . 30 ILE H . . . . . . . . . c16368_2kko 1 . 1 . 456 . 1 1 30 ILE HA H -9.072 -7.241 11.614 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HA . . . . . . . . . c16368_2kko 1 . 1 . 457 . 1 1 30 ILE HB H -9.090 -5.345 9.258 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HB . . . . . . . . . c16368_2kko 1 . 1 . 458 . 1 1 30 ILE HD11 H -11.951 -4.413 9.774 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HD11 . . . . . . . . . c16368_2kko 1 . 1 . 459 . 1 1 30 ILE HD12 H -10.614 -3.284 9.556 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HD12 . . . . . . . . . c16368_2kko 1 . 1 . 460 . 1 1 30 ILE HD13 H -11.620 -3.191 11.002 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HD13 . . . . . . . . . c16368_2kko 1 . 1 . 461 . 1 1 30 ILE HG12 H -10.817 -5.333 11.745 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HG12 . . . . . . . . . c16368_2kko 1 . 1 . 462 . 1 1 30 ILE HG13 H -9.467 -4.242 11.463 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HG13 . . . . . . . . . c16368_2kko 1 . 1 . 463 . 1 1 30 ILE HG21 H -10.198 -7.459 8.768 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HG21 . . . . . . . . . c16368_2kko 1 . 1 . 464 . 1 1 30 ILE HG22 H -11.376 -6.154 8.898 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HG22 . . . . . . . . . c16368_2kko 1 . 1 . 465 . 1 1 30 ILE HG23 H -11.176 -7.297 10.228 . . . 1.0 . . . . . . . . . . . . A . 30 ILE HG23 . . . . . . . . . c16368_2kko 1 . 1 . 466 . 1 1 30 ILE N N -7.549 -5.854 11.447 . . . 1.0 . . . . . . . . . . . . A . 30 ILE N . . . . . . . . . c16368_2kko 1 . 1 . 467 . 1 1 30 ILE O O -8.164 -8.893 9.943 . . . 1.0 . . . . . . . . . . . . A . 30 ILE O . . . . . . . . . c16368_2kko 1 . 1 . 468 . 1 1 31 LEU C C -5.480 -9.055 8.722 . . . 1.0 . . . . . . . . . . . . A . 31 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 469 . 1 1 31 LEU CA C -6.339 -8.005 8.028 . . . 1.0 . . . . . . . . . . . . A . 31 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 470 . 1 1 31 LEU CB C -5.463 -7.135 7.123 . . . 1.0 . . . . . . . . . . . . A . 31 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 471 . 1 1 31 LEU CD1 C -5.250 -5.301 5.433 . . . 1.0 . . . . . . . . . . . . A . 31 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 472 . 1 1 31 LEU CD2 C -7.139 -6.923 5.273 . . . 1.0 . . . . . . . . . . . . A . 31 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 473 . 1 1 31 LEU CG C -6.223 -6.164 6.218 . . . 1.0 . . . . . . . . . . . . A . 31 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 474 . 1 1 31 LEU H H -6.876 -6.214 9.018 . . . 1.0 . . . . . . . . . . . . A . 31 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 475 . 1 1 31 LEU HA H -7.080 -8.507 7.422 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 476 . 1 1 31 LEU HB2 H -4.794 -6.561 7.749 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 477 . 1 1 31 LEU HB3 H -4.873 -7.787 6.497 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 478 . 1 1 31 LEU HD11 H -5.801 -4.629 4.792 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 479 . 1 1 31 LEU HD12 H -4.614 -5.931 4.831 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 480 . 1 1 31 LEU HD13 H -4.643 -4.728 6.118 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 481 . 1 1 31 LEU HD21 H -7.687 -6.221 4.661 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 482 . 1 1 31 LEU HD22 H -7.834 -7.520 5.846 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 483 . 1 1 31 LEU HD23 H -6.548 -7.568 4.640 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 484 . 1 1 31 LEU HG H -6.833 -5.513 6.827 . . . 1.0 . . . . . . . . . . . . A . 31 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 485 . 1 1 31 LEU N N -7.044 -7.178 9.004 . . . 1.0 . . . . . . . . . . . . A . 31 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 486 . 1 1 31 LEU O O -5.465 -10.218 8.324 . . . 1.0 . . . . . . . . . . . . A . 31 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 487 . 1 1 32 ASP C C -4.763 -10.637 11.195 . . . 1.0 . . . . . . . . . . . . A . 32 ASP C . . . . . . . . . c16368_2kko 1 . 1 . 488 . 1 1 32 ASP CA C -3.931 -9.534 10.547 . . . 1.0 . . . . . . . . . . . . A . 32 ASP CA . . . . . . . . . c16368_2kko 1 . 1 . 489 . 1 1 32 ASP CB C -3.175 -8.749 11.624 . . . 1.0 . . . . . . . . . . . . A . 32 ASP CB . . . . . . . . . c16368_2kko 1 . 1 . 490 . 1 1 32 ASP CG C -2.281 -9.630 12.480 . . . 1.0 . . . . . . . . . . . . A . 32 ASP CG . . . . . . . . . c16368_2kko 1 . 1 . 491 . 1 1 32 ASP H H -4.830 -7.687 10.027 . . . 1.0 . . . . . . . . . . . . A . 32 ASP H . . . . . . . . . c16368_2kko 1 . 1 . 492 . 1 1 32 ASP HA H -3.215 -9.984 9.873 . . . 1.0 . . . . . . . . . . . . A . 32 ASP HA . . . . . . . . . c16368_2kko 1 . 1 . 493 . 1 1 32 ASP HB2 H -2.557 -8.003 11.147 . . . 1.0 . . . . . . . . . . . . A . 32 ASP HB2 . . . . . . . . . c16368_2kko 1 . 1 . 494 . 1 1 32 ASP HB3 H -3.889 -8.257 12.269 . . . 1.0 . . . . . . . . . . . . A . 32 ASP HB3 . . . . . . . . . c16368_2kko 1 . 1 . 495 . 1 1 32 ASP N N -4.780 -8.634 9.770 . . . 1.0 . . . . . . . . . . . . A . 32 ASP N . . . . . . . . . c16368_2kko 1 . 1 . 496 . 1 1 32 ASP O O -4.347 -11.794 11.252 . . . 1.0 . . . . . . . . . . . . A . 32 ASP O . . . . . . . . . c16368_2kko 1 . 1 . 497 . 1 1 32 ASP OD1 O -2.775 -10.198 13.475 . . . 1.0 . . . . . . . . . . . . A . 32 ASP OD1 . . . . . . . . . c16368_2kko 1 . 1 . 498 . 1 1 32 ASP OD2 O -1.075 -9.744 12.171 . . . 1.0 . . . . . . . . . . . . A . 32 ASP OD2 . . . . . . . . . c16368_2kko 1 . 1 . 499 . 1 1 33 LEU C C -7.478 -12.172 11.317 . . . 1.0 . . . . . . . . . . . . A . 33 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 500 . 1 1 33 LEU CA C -6.833 -11.223 12.329 . . . 1.0 . . . . . . . . . . . . A . 33 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 501 . 1 1 33 LEU CB C -7.913 -10.473 13.116 . . . 1.0 . . . . . . . . . . . . A . 33 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 502 . 1 1 33 LEU CD1 C -7.905 -11.945 15.149 . . . 1.0 . . . . . . . . . . . . A . 33 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 503 . 1 1 33 LEU CD2 C -9.892 -10.511 14.651 . . . 1.0 . . . . . . . . . . . . A . 33 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 504 . 1 1 33 LEU CG C -8.765 -11.336 14.049 . . . 1.0 . . . . . . . . . . . . A . 33 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 505 . 1 1 33 LEU H H -6.243 -9.344 11.553 . . . 1.0 . . . . . . . . . . . . A . 33 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 506 . 1 1 33 LEU HA H -6.234 -11.802 13.016 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 507 . 1 1 33 LEU HB2 H -7.430 -9.710 13.711 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 508 . 1 1 33 LEU HB3 H -8.571 -9.990 12.410 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 509 . 1 1 33 LEU HD11 H -8.519 -12.562 15.787 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 510 . 1 1 33 LEU HD12 H -7.459 -11.155 15.735 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 511 . 1 1 33 LEU HD13 H -7.125 -12.548 14.707 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 512 . 1 1 33 LEU HD21 H -10.491 -11.136 15.297 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 513 . 1 1 33 LEU HD22 H -10.511 -10.114 13.860 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 514 . 1 1 33 LEU HD23 H -9.475 -9.697 15.225 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 515 . 1 1 33 LEU HG H -9.206 -12.144 13.482 . . . 1.0 . . . . . . . . . . . . A . 33 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 516 . 1 1 33 LEU N N -5.952 -10.275 11.660 . . . 1.0 . . . . . . . . . . . . A . 33 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 517 . 1 1 33 LEU O O -7.695 -13.352 11.606 . . . 1.0 . . . . . . . . . . . . A . 33 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 518 . 1 1 34 LEU C C -7.374 -13.372 8.416 . . . 1.0 . . . . . . . . . . . . A . 34 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 519 . 1 1 34 LEU CA C -8.391 -12.454 9.075 . . . 1.0 . . . . . . . . . . . . A . 34 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 520 . 1 1 34 LEU CB C -9.044 -11.563 8.019 . . . 1.0 . . . . . . . . . . . . A . 34 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 521 . 1 1 34 LEU CD1 C -10.869 -9.978 7.353 . . . 1.0 . . . . . . . . . . . . A . 34 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 522 . 1 1 34 LEU CD2 C -11.306 -11.721 9.091 . . . 1.0 . . . . . . . . . . . . A . 34 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 523 . 1 1 34 LEU CG C -10.269 -10.780 8.497 . . . 1.0 . . . . . . . . . . . . A . 34 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 524 . 1 1 34 LEU H H -7.586 -10.704 9.960 . . . 1.0 . . . . . . . . . . . . A . 34 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 525 . 1 1 34 LEU HA H -9.157 -13.063 9.533 . . . 1.0 . . . . . . . . . . . . A . 34 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 526 . 1 1 34 LEU HB2 H -8.304 -10.858 7.666 . . . 1.0 . . . . . . . . . . . . A . 34 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 527 . 1 1 34 LEU HB3 H -9.344 -12.188 7.192 . . . 1.0 . . . . . . . . . . . . A . 34 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 528 . 1 1 34 LEU HD11 H -11.701 -9.394 7.719 . . . 1.0 . . . . . . . . . . . . A . 34 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 529 . 1 1 34 LEU HD12 H -11.215 -10.652 6.583 . . . 1.0 . . . . . . . . . . . . A . 34 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 530 . 1 1 34 LEU HD13 H -10.119 -9.318 6.943 . . . 1.0 . . . . . . . . . . . . A . 34 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 531 . 1 1 34 LEU HD21 H -10.857 -12.297 9.887 . . . 1.0 . . . . . . . . . . . . A . 34 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 532 . 1 1 34 LEU HD22 H -11.669 -12.388 8.323 . . . 1.0 . . . . . . . . . . . . A . 34 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 533 . 1 1 34 LEU HD23 H -12.130 -11.144 9.486 . . . 1.0 . . . . . . . . . . . . A . 34 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 534 . 1 1 34 LEU HG H -9.966 -10.086 9.268 . . . 1.0 . . . . . . . . . . . . A . 34 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 535 . 1 1 34 LEU N N -7.777 -11.653 10.129 . . . 1.0 . . . . . . . . . . . . A . 34 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 536 . 1 1 34 LEU O O -7.729 -14.417 7.877 . . . 1.0 . . . . . . . . . . . . A . 34 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 537 . 1 1 35 ALA C C -4.870 -15.061 8.820 . . . 1.0 . . . . . . . . . . . . A . 35 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 538 . 1 1 35 ALA CA C -5.032 -13.819 7.950 . . . 1.0 . . . . . . . . . . . . A . 35 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 539 . 1 1 35 ALA CB C -3.729 -13.037 7.891 . . . 1.0 . . . . . . . . . . . . A . 35 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 540 . 1 1 35 ALA H H -5.892 -12.095 8.827 . . . 1.0 . . . . . . . . . . . . A . 35 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 541 . 1 1 35 ALA HA H -5.293 -14.124 6.946 . . . 1.0 . . . . . . . . . . . . A . 35 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 542 . 1 1 35 ALA HB1 H -3.871 -12.144 7.302 . . . 1.0 . . . . . . . . . . . . A . 35 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 543 . 1 1 35 ALA HB2 H -2.962 -13.648 7.440 . . . 1.0 . . . . . . . . . . . . A . 35 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 544 . 1 1 35 ALA HB3 H -3.429 -12.764 8.893 . . . 1.0 . . . . . . . . . . . . A . 35 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 545 . 1 1 35 ALA N N -6.108 -12.980 8.461 . . . 1.0 . . . . . . . . . . . . A . 35 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 546 . 1 1 35 ALA O O -4.240 -16.044 8.422 . . . 1.0 . . . . . . . . . . . . A . 35 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 547 . 1 1 36 GLN C C -6.722 -16.927 10.812 . . . 1.0 . . . . . . . . . . . . A . 36 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 548 . 1 1 36 GLN CA C -5.426 -16.127 10.935 . . . 1.0 . . . . . . . . . . . . A . 36 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 549 . 1 1 36 GLN CB C -5.265 -15.632 12.374 . . . 1.0 . . . . . . . . . . . . A . 36 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 550 . 1 1 36 GLN CD C -3.979 -14.198 14.003 . . . 1.0 . . . . . . . . . . . . A . 36 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 551 . 1 1 36 GLN CG C -4.088 -14.694 12.575 . . . 1.0 . . . . . . . . . . . . A . 36 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 552 . 1 1 36 GLN H H -5.900 -14.177 10.283 . . . 1.0 . . . . . . . . . . . . A . 36 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 553 . 1 1 36 GLN HA H -4.590 -16.762 10.677 . . . 1.0 . . . . . . . . . . . . A . 36 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 554 . 1 1 36 GLN HB2 H -6.164 -15.110 12.663 . . . 1.0 . . . . . . . . . . . . A . 36 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 555 . 1 1 36 GLN HB3 H -5.131 -16.486 13.023 . . . 1.0 . . . . . . . . . . . . A . 36 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 556 . 1 1 36 GLN HE21 H -3.254 -12.459 13.365 . . . 1.0 . . . . . . . . . . . . A . 36 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 557 . 1 1 36 GLN HE22 H -3.418 -12.628 15.079 . . . 1.0 . . . . . . . . . . . . A . 36 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 558 . 1 1 36 GLN HG2 H -3.179 -15.219 12.321 . . . 1.0 . . . . . . . . . . . . A . 36 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 559 . 1 1 36 GLN HG3 H -4.206 -13.842 11.923 . . . 1.0 . . . . . . . . . . . . A . 36 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 560 . 1 1 36 GLN N N -5.446 -15.003 10.014 . . . 1.0 . . . . . . . . . . . . A . 36 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 561 . 1 1 36 GLN NE2 N -3.504 -12.974 14.167 . . . 1.0 . . . . . . . . . . . . A . 36 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 562 . 1 1 36 GLN O O -6.953 -17.869 11.567 . . . 1.0 . . . . . . . . . . . . A . 36 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 563 . 1 1 36 GLN OE1 O -4.336 -14.900 14.948 . . . 1.0 . . . . . . . . . . . . A . 36 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 564 . 1 1 37 GLY C C -9.970 -16.221 9.441 . . . 1.0 . . . . . . . . . . . . A . 37 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 565 . 1 1 37 GLY CA C -8.836 -17.201 9.675 . . . 1.0 . . . . . . . . . . . . A . 37 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 566 . 1 1 37 GLY H H -7.324 -15.775 9.289 . . . 1.0 . . . . . . . . . . . . A . 37 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 567 . 1 1 37 GLY HA2 H -8.759 -17.859 8.821 . . . 1.0 . . . . . . . . . . . . A . 37 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 568 . 1 1 37 GLY HA3 H -9.059 -17.789 10.552 . . . 1.0 . . . . . . . . . . . . A . 37 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 569 . 1 1 37 GLY N N -7.566 -16.532 9.868 . . . 1.0 . . . . . . . . . . . . A . 37 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 570 . 1 1 37 GLY O O -9.993 -15.138 10.029 . . . 1.0 . . . . . . . . . . . . A . 37 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 571 . 1 1 38 GLU C C -13.036 -15.749 9.443 . . . 1.0 . . . . . . . . . . . . A . 38 GLU C . . . . . . . . . c16368_2kko 1 . 1 . 572 . 1 1 38 GLU CA C -12.062 -15.772 8.268 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CA . . . . . . . . . c16368_2kko 1 . 1 . 573 . 1 1 38 GLU CB C -12.742 -16.290 6.999 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CB . . . . . . . . . c16368_2kko 1 . 1 . 574 . 1 1 38 GLU CD C -13.348 -18.351 5.678 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CD . . . . . . . . . c16368_2kko 1 . 1 . 575 . 1 1 38 GLU CG C -13.087 -17.769 7.049 . . . 1.0 . . . . . . . . . . . . A . 38 GLU CG . . . . . . . . . c16368_2kko 1 . 1 . 576 . 1 1 38 GLU H H -10.818 -17.478 8.149 . . . 1.0 . . . . . . . . . . . . A . 38 GLU H . . . . . . . . . c16368_2kko 1 . 1 . 577 . 1 1 38 GLU HA H -11.708 -14.767 8.091 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HA . . . . . . . . . c16368_2kko 1 . 1 . 578 . 1 1 38 GLU HB2 H -13.654 -15.735 6.843 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 579 . 1 1 38 GLU HB3 H -12.082 -16.125 6.160 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 580 . 1 1 38 GLU HG2 H -12.264 -18.303 7.499 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HG2 . . . . . . . . . c16368_2kko 1 . 1 . 581 . 1 1 38 GLU HG3 H -13.972 -17.899 7.654 . . . 1.0 . . . . . . . . . . . . A . 38 GLU HG3 . . . . . . . . . c16368_2kko 1 . 1 . 582 . 1 1 38 GLU N N -10.904 -16.604 8.582 . . . 1.0 . . . . . . . . . . . . A . 38 GLU N . . . . . . . . . c16368_2kko 1 . 1 . 583 . 1 1 38 GLU O O -13.296 -16.782 10.066 . . . 1.0 . . . . . . . . . . . . A . 38 GLU O . . . . . . . . . c16368_2kko 1 . 1 . 584 . 1 1 38 GLU OE1 O -14.476 -18.210 5.170 . . . 1.0 . . . . . . . . . . . . A . 38 GLU OE1 . . . . . . . . . c16368_2kko 1 . 1 . 585 . 1 1 38 GLU OE2 O -12.419 -18.955 5.100 . . . 1.0 . . . . . . . . . . . . A . 38 GLU OE2 . . . . . . . . . c16368_2kko 1 . 1 . 586 . 1 1 39 ARG C C -15.554 -13.486 10.716 . . . 1.0 . . . . . . . . . . . . A . 39 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 587 . 1 1 39 ARG CA C -14.356 -14.392 10.971 . . . 1.0 . . . . . . . . . . . . A . 39 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 588 . 1 1 39 ARG CB C -13.479 -13.796 12.078 . . . 1.0 . . . . . . . . . . . . A . 39 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 589 . 1 1 39 ARG CD C -11.258 -13.868 13.270 . . . 1.0 . . . . . . . . . . . . A . 39 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 590 . 1 1 39 ARG CG C -12.195 -14.576 12.310 . . . 1.0 . . . . . . . . . . . . A . 39 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 591 . 1 1 39 ARG CZ C -9.441 -15.227 14.247 . . . 1.0 . . . . . . . . . . . . A . 39 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 592 . 1 1 39 ARG H H -13.429 -13.805 9.151 . . . 1.0 . . . . . . . . . . . . A . 39 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 593 . 1 1 39 ARG HA H -14.709 -15.363 11.287 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 594 . 1 1 39 ARG HB2 H -13.217 -12.783 11.809 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 595 . 1 1 39 ARG HB3 H -14.041 -13.782 13.001 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 596 . 1 1 39 ARG HD2 H -11.173 -12.832 12.976 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 597 . 1 1 39 ARG HD3 H -11.668 -13.928 14.269 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 598 . 1 1 39 ARG HE H -9.377 -14.337 12.453 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 599 . 1 1 39 ARG HG2 H -12.445 -15.544 12.718 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 600 . 1 1 39 ARG HG3 H -11.692 -14.705 11.362 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 601 . 1 1 39 ARG HH11 H -11.034 -14.949 15.473 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 602 . 1 1 39 ARG HH12 H -9.772 -15.956 16.109 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 603 . 1 1 39 ARG HH21 H -7.707 -15.653 13.291 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 604 . 1 1 39 ARG HH22 H -7.883 -16.379 14.860 . . . 1.0 . . . . . . . . . . . . A . 39 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 605 . 1 1 39 ARG N N -13.563 -14.570 9.757 . . . 1.0 . . . . . . . . . . . . A . 39 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 606 . 1 1 39 ARG NE N -9.928 -14.479 13.260 . . . 1.0 . . . . . . . . . . . . A . 39 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 607 . 1 1 39 ARG NH1 N -10.136 -15.393 15.365 . . . 1.0 . . . . . . . . . . . . A . 39 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 608 . 1 1 39 ARG NH2 N -8.246 -15.791 14.123 . . . 1.0 . . . . . . . . . . . . A . 39 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 609 . 1 1 39 ARG O O -15.553 -12.694 9.774 . . . 1.0 . . . . . . . . . . . . A . 39 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 610 . 1 1 40 ALA C C -17.510 -11.387 11.997 . . . 1.0 . . . . . . . . . . . . A . 40 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 611 . 1 1 40 ALA CA C -17.769 -12.784 11.444 . . . 1.0 . . . . . . . . . . . . A . 40 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 612 . 1 1 40 ALA CB C -18.936 -13.439 12.172 . . . 1.0 . . . . . . . . . . . . A . 40 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 613 . 1 1 40 ALA H H -16.519 -14.280 12.279 . . . 1.0 . . . . . . . . . . . . A . 40 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 614 . 1 1 40 ALA HA H -18.026 -12.705 10.396 . . . 1.0 . . . . . . . . . . . . A . 40 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 615 . 1 1 40 ALA HB1 H -18.704 -13.525 13.225 . . . 1.0 . . . . . . . . . . . . A . 40 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 616 . 1 1 40 ALA HB2 H -19.110 -14.423 11.760 . . . 1.0 . . . . . . . . . . . . A . 40 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 617 . 1 1 40 ALA HB3 H -19.822 -12.836 12.047 . . . 1.0 . . . . . . . . . . . . A . 40 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 618 . 1 1 40 ALA N N -16.573 -13.610 11.556 . . . 1.0 . . . . . . . . . . . . A . 40 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 619 . 1 1 40 ALA O O -16.582 -11.184 12.784 . . . 1.0 . . . . . . . . . . . . A . 40 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 620 . 1 1 41 VAL C C -18.164 -8.915 13.521 . . . 1.0 . . . . . . . . . . . . A . 41 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 621 . 1 1 41 VAL CA C -18.188 -9.037 12.000 . . . 1.0 . . . . . . . . . . . . A . 41 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 622 . 1 1 41 VAL CB C -19.333 -8.159 11.448 . . . 1.0 . . . . . . . . . . . . A . 41 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 623 . 1 1 41 VAL CG1 C -19.115 -6.695 11.806 . . . 1.0 . . . . . . . . . . . . A . 41 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 624 . 1 1 41 VAL CG2 C -19.463 -8.329 9.944 . . . 1.0 . . . . . . . . . . . . A . 41 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 625 . 1 1 41 VAL H H -19.072 -10.668 10.976 . . . 1.0 . . . . . . . . . . . . A . 41 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 626 . 1 1 41 VAL HA H -17.254 -8.668 11.601 . . . 1.0 . . . . . . . . . . . . A . 41 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 627 . 1 1 41 VAL HB H -20.257 -8.482 11.905 . . . 1.0 . . . . . . . . . . . . A . 41 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 628 . 1 1 41 VAL HG11 H -19.096 -6.587 12.880 . . . 1.0 . . . . . . . . . . . . A . 41 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 629 . 1 1 41 VAL HG12 H -19.921 -6.101 11.398 . . . 1.0 . . . . . . . . . . . . A . 41 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 630 . 1 1 41 VAL HG13 H -18.176 -6.358 11.392 . . . 1.0 . . . . . . . . . . . . A . 41 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 631 . 1 1 41 VAL HG21 H -19.694 -9.359 9.717 . . . 1.0 . . . . . . . . . . . . A . 41 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 632 . 1 1 41 VAL HG22 H -18.532 -8.055 9.468 . . . 1.0 . . . . . . . . . . . . A . 41 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 633 . 1 1 41 VAL HG23 H -20.255 -7.693 9.577 . . . 1.0 . . . . . . . . . . . . A . 41 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 634 . 1 1 41 VAL N N -18.338 -10.431 11.585 . . . 1.0 . . . . . . . . . . . . A . 41 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 635 . 1 1 41 VAL O O -17.299 -8.241 14.086 . . . 1.0 . . . . . . . . . . . . A . 41 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 636 . 1 1 42 GLU C C -17.928 -10.035 16.283 . . . 1.0 . . . . . . . . . . . . A . 42 GLU C . . . . . . . . . c16368_2kko 1 . 1 . 637 . 1 1 42 GLU CA C -19.227 -9.563 15.628 . . . 1.0 . . . . . . . . . . . . A . 42 GLU CA . . . . . . . . . c16368_2kko 1 . 1 . 638 . 1 1 42 GLU CB C -20.414 -10.443 16.057 . . . 1.0 . . . . . . . . . . . . A . 42 GLU CB . . . . . . . . . c16368_2kko 1 . 1 . 639 . 1 1 42 GLU CD C -19.899 -11.161 18.444 . . . 1.0 . . . . . . . . . . . . A . 42 GLU CD . . . . . . . . . c16368_2kko 1 . 1 . 640 . 1 1 42 GLU CG C -20.792 -10.344 17.531 . . . 1.0 . . . . . . . . . . . . A . 42 GLU CG . . . . . . . . . c16368_2kko 1 . 1 . 641 . 1 1 42 GLU H H -19.761 -10.109 13.653 . . . 1.0 . . . . . . . . . . . . A . 42 GLU H . . . . . . . . . c16368_2kko 1 . 1 . 642 . 1 1 42 GLU HA H -19.419 -8.545 15.929 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HA . . . . . . . . . c16368_2kko 1 . 1 . 643 . 1 1 42 GLU HB2 H -21.278 -10.161 15.474 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 644 . 1 1 42 GLU HB3 H -20.172 -11.474 15.841 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 645 . 1 1 42 GLU HG2 H -20.728 -9.309 17.831 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HG2 . . . . . . . . . c16368_2kko 1 . 1 . 646 . 1 1 42 GLU HG3 H -21.809 -10.685 17.649 . . . 1.0 . . . . . . . . . . . . A . 42 GLU HG3 . . . . . . . . . c16368_2kko 1 . 1 . 647 . 1 1 42 GLU N N -19.112 -9.585 14.172 . . . 1.0 . . . . . . . . . . . . A . 42 GLU N . . . . . . . . . c16368_2kko 1 . 1 . 648 . 1 1 42 GLU O O -17.467 -9.452 17.271 . . . 1.0 . . . . . . . . . . . . A . 42 GLU O . . . . . . . . . c16368_2kko 1 . 1 . 649 . 1 1 42 GLU OE1 O -19.621 -12.335 18.121 . . . 1.0 . . . . . . . . . . . . A . 42 GLU OE1 . . . . . . . . . c16368_2kko 1 . 1 . 650 . 1 1 42 GLU OE2 O -19.488 -10.641 19.503 . . . 1.0 . . . . . . . . . . . . A . 42 GLU OE2 . . . . . . . . . c16368_2kko 1 . 1 . 651 . 1 1 43 ALA C C -14.918 -10.713 16.027 . . . 1.0 . . . . . . . . . . . . A . 43 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 652 . 1 1 43 ALA CA C -16.105 -11.645 16.242 . . . 1.0 . . . . . . . . . . . . A . 43 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 653 . 1 1 43 ALA CB C -15.839 -13.002 15.607 . . . 1.0 . . . . . . . . . . . . A . 43 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 654 . 1 1 43 ALA H H -17.728 -11.460 14.901 . . . 1.0 . . . . . . . . . . . . A . 43 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 655 . 1 1 43 ALA HA H -16.243 -11.794 17.302 . . . 1.0 . . . . . . . . . . . . A . 43 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 656 . 1 1 43 ALA HB1 H -15.646 -12.874 14.553 . . . 1.0 . . . . . . . . . . . . A . 43 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 657 . 1 1 43 ALA HB2 H -16.704 -13.637 15.741 . . . 1.0 . . . . . . . . . . . . A . 43 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 658 . 1 1 43 ALA HB3 H -14.981 -13.457 16.079 . . . 1.0 . . . . . . . . . . . . A . 43 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 659 . 1 1 43 ALA N N -17.332 -11.072 15.709 . . . 1.0 . . . . . . . . . . . . A . 43 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 660 . 1 1 43 ALA O O -14.146 -10.457 16.953 . . . 1.0 . . . . . . . . . . . . A . 43 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 661 . 1 1 44 ILE C C -13.692 -8.057 15.311 . . . 1.0 . . . . . . . . . . . . A . 44 ILE C . . . . . . . . . c16368_2kko 1 . 1 . 662 . 1 1 44 ILE CA C -13.677 -9.316 14.452 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CA . . . . . . . . . c16368_2kko 1 . 1 . 663 . 1 1 44 ILE CB C -13.739 -8.897 12.966 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CB . . . . . . . . . c16368_2kko 1 . 1 . 664 . 1 1 44 ILE CD1 C -13.914 -9.802 10.592 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CD1 . . . . . . . . . c16368_2kko 1 . 1 . 665 . 1 1 44 ILE CG1 C -13.715 -10.128 12.058 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CG1 . . . . . . . . . c16368_2kko 1 . 1 . 666 . 1 1 44 ILE CG2 C -12.580 -7.966 12.629 . . . 1.0 . . . . . . . . . . . . A . 44 ILE CG2 . . . . . . . . . c16368_2kko 1 . 1 . 667 . 1 1 44 ILE H H -15.450 -10.430 14.119 . . . 1.0 . . . . . . . . . . . . A . 44 ILE H . . . . . . . . . c16368_2kko 1 . 1 . 668 . 1 1 44 ILE HA H -12.752 -9.848 14.619 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HA . . . . . . . . . c16368_2kko 1 . 1 . 669 . 1 1 44 ILE HB H -14.662 -8.358 12.806 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HB . . . . . . . . . c16368_2kko 1 . 1 . 670 . 1 1 44 ILE HD11 H -13.126 -9.142 10.261 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HD11 . . . . . . . . . c16368_2kko 1 . 1 . 671 . 1 1 44 ILE HD12 H -14.869 -9.318 10.456 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HD12 . . . . . . . . . c16368_2kko 1 . 1 . 672 . 1 1 44 ILE HD13 H -13.885 -10.714 10.014 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HD13 . . . . . . . . . c16368_2kko 1 . 1 . 673 . 1 1 44 ILE HG12 H -12.762 -10.624 12.160 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG12 . . . . . . . . . c16368_2kko 1 . 1 . 674 . 1 1 44 ILE HG13 H -14.502 -10.806 12.357 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG13 . . . . . . . . . c16368_2kko 1 . 1 . 675 . 1 1 44 ILE HG21 H -12.635 -7.082 13.247 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG21 . . . . . . . . . c16368_2kko 1 . 1 . 676 . 1 1 44 ILE HG22 H -12.635 -7.682 11.589 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG22 . . . . . . . . . c16368_2kko 1 . 1 . 677 . 1 1 44 ILE HG23 H -11.645 -8.475 12.813 . . . 1.0 . . . . . . . . . . . . A . 44 ILE HG23 . . . . . . . . . c16368_2kko 1 . 1 . 678 . 1 1 44 ILE N N -14.783 -10.202 14.805 . . . 1.0 . . . . . . . . . . . . A . 44 ILE N . . . . . . . . . c16368_2kko 1 . 1 . 679 . 1 1 44 ILE O O -12.674 -7.678 15.896 . . . 1.0 . . . . . . . . . . . . A . 44 ILE O . . . . . . . . . c16368_2kko 1 . 1 . 680 . 1 1 45 ALA C C -14.648 -6.326 17.578 . . . 1.0 . . . . . . . . . . . . A . 45 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 681 . 1 1 45 ALA CA C -15.013 -6.170 16.108 . . . 1.0 . . . . . . . . . . . . A . 45 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 682 . 1 1 45 ALA CB C -16.434 -5.648 15.968 . . . 1.0 . . . . . . . . . . . . A . 45 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 683 . 1 1 45 ALA H H -15.646 -7.822 14.946 . . . 1.0 . . . . . . . . . . . . A . 45 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 684 . 1 1 45 ALA HA H -14.346 -5.448 15.658 . . . 1.0 . . . . . . . . . . . . A . 45 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 685 . 1 1 45 ALA HB1 H -17.123 -6.352 16.412 . . . 1.0 . . . . . . . . . . . . A . 45 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 686 . 1 1 45 ALA HB2 H -16.672 -5.523 14.922 . . . 1.0 . . . . . . . . . . . . A . 45 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 687 . 1 1 45 ALA HB3 H -16.519 -4.696 16.473 . . . 1.0 . . . . . . . . . . . . A . 45 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 688 . 1 1 45 ALA N N -14.860 -7.426 15.389 . . . 1.0 . . . . . . . . . . . . A . 45 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 689 . 1 1 45 ALA O O -13.798 -5.603 18.095 . . . 1.0 . . . . . . . . . . . . A . 45 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 690 . 1 1 46 THR C C -13.597 -7.886 19.952 . . . 1.0 . . . . . . . . . . . . A . 46 THR C . . . . . . . . . c16368_2kko 1 . 1 . 691 . 1 1 46 THR CA C -15.051 -7.506 19.661 . . . 1.0 . . . . . . . . . . . . A . 46 THR CA . . . . . . . . . c16368_2kko 1 . 1 . 692 . 1 1 46 THR CB C -15.990 -8.599 20.201 . . . 1.0 . . . . . . . . . . . . A . 46 THR CB . . . . . . . . . c16368_2kko 1 . 1 . 693 . 1 1 46 THR CG2 C -15.925 -8.675 21.721 . . . 1.0 . . . . . . . . . . . . A . 46 THR CG2 . . . . . . . . . c16368_2kko 1 . 1 . 694 . 1 1 46 THR H H -15.897 -7.874 17.759 . . . 1.0 . . . . . . . . . . . . A . 46 THR H . . . . . . . . . c16368_2kko 1 . 1 . 695 . 1 1 46 THR HA H -15.280 -6.583 20.175 . . . 1.0 . . . . . . . . . . . . A . 46 THR HA . . . . . . . . . c16368_2kko 1 . 1 . 696 . 1 1 46 THR HB H -15.686 -9.551 19.792 . . . 1.0 . . . . . . . . . . . . A . 46 THR HB . . . . . . . . . c16368_2kko 1 . 1 . 697 . 1 1 46 THR HG1 H -17.550 -8.858 19.014 . . . 1.0 . . . . . . . . . . . . A . 46 THR HG1 . . . . . . . . . c16368_2kko 1 . 1 . 698 . 1 1 46 THR HG21 H -16.608 -9.435 22.072 . . . 1.0 . . . . . . . . . . . . A . 46 THR HG21 . . . . . . . . . c16368_2kko 1 . 1 . 699 . 1 1 46 THR HG22 H -16.202 -7.722 22.142 . . . 1.0 . . . . . . . . . . . . A . 46 THR HG22 . . . . . . . . . c16368_2kko 1 . 1 . 700 . 1 1 46 THR HG23 H -14.918 -8.924 22.026 . . . 1.0 . . . . . . . . . . . . A . 46 THR HG23 . . . . . . . . . c16368_2kko 1 . 1 . 701 . 1 1 46 THR N N -15.269 -7.292 18.239 . . . 1.0 . . . . . . . . . . . . A . 46 THR N . . . . . . . . . c16368_2kko 1 . 1 . 702 . 1 1 46 THR O O -13.010 -7.421 20.931 . . . 1.0 . . . . . . . . . . . . A . 46 THR O . . . . . . . . . c16368_2kko 1 . 1 . 703 . 1 1 46 THR OG1 O -17.336 -8.323 19.791 . . . 1.0 . . . . . . . . . . . . A . 46 THR OG1 . . . . . . . . . c16368_2kko 1 . 1 . 704 . 1 1 47 ALA C C -10.647 -8.018 19.197 . . . 1.0 . . . . . . . . . . . . A . 47 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 705 . 1 1 47 ALA CA C -11.643 -9.171 19.275 . . . 1.0 . . . . . . . . . . . . A . 47 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 706 . 1 1 47 ALA CB C -11.292 -10.236 18.249 . . . 1.0 . . . . . . . . . . . . A . 47 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 707 . 1 1 47 ALA H H -13.515 -9.005 18.294 . . . 1.0 . . . . . . . . . . . . A . 47 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 708 . 1 1 47 ALA HA H -11.581 -9.618 20.257 . . . 1.0 . . . . . . . . . . . . A . 47 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 709 . 1 1 47 ALA HB1 H -10.292 -10.600 18.436 . . . 1.0 . . . . . . . . . . . . A . 47 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 710 . 1 1 47 ALA HB2 H -11.342 -9.811 17.257 . . . 1.0 . . . . . . . . . . . . A . 47 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 711 . 1 1 47 ALA HB3 H -11.994 -11.054 18.325 . . . 1.0 . . . . . . . . . . . . A . 47 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 712 . 1 1 47 ALA N N -13.013 -8.706 19.084 . . . 1.0 . . . . . . . . . . . . A . 47 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 713 . 1 1 47 ALA O O -9.653 -7.993 19.924 . . . 1.0 . . . . . . . . . . . . A . 47 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 714 . 1 1 48 THR C C -10.387 -4.768 19.060 . . . 1.0 . . . . . . . . . . . . A . 48 THR C . . . . . . . . . c16368_2kko 1 . 1 . 715 . 1 1 48 THR CA C -10.025 -5.929 18.132 . . . 1.0 . . . . . . . . . . . . A . 48 THR CA . . . . . . . . . c16368_2kko 1 . 1 . 716 . 1 1 48 THR CB C -10.042 -5.454 16.666 . . . 1.0 . . . . . . . . . . . . A . 48 THR CB . . . . . . . . . c16368_2kko 1 . 1 . 717 . 1 1 48 THR CG2 C -9.289 -6.429 15.772 . . . 1.0 . . . . . . . . . . . . A . 48 THR CG2 . . . . . . . . . c16368_2kko 1 . 1 . 718 . 1 1 48 THR H H -11.745 -7.112 17.796 . . . 1.0 . . . . . . . . . . . . A . 48 THR H . . . . . . . . . c16368_2kko 1 . 1 . 719 . 1 1 48 THR HA H -9.023 -6.261 18.367 . . . 1.0 . . . . . . . . . . . . A . 48 THR HA . . . . . . . . . c16368_2kko 1 . 1 . 720 . 1 1 48 THR HB H -9.556 -4.491 16.611 . . . 1.0 . . . . . . . . . . . . A . 48 THR HB . . . . . . . . . c16368_2kko 1 . 1 . 721 . 1 1 48 THR HG1 H -11.752 -6.195 16.000 . . . 1.0 . . . . . . . . . . . . A . 48 THR HG1 . . . . . . . . . c16368_2kko 1 . 1 . 722 . 1 1 48 THR HG21 H -8.257 -6.482 16.086 . . . 1.0 . . . . . . . . . . . . A . 48 THR HG21 . . . . . . . . . c16368_2kko 1 . 1 . 723 . 1 1 48 THR HG22 H -9.336 -6.087 14.748 . . . 1.0 . . . . . . . . . . . . A . 48 THR HG22 . . . . . . . . . c16368_2kko 1 . 1 . 724 . 1 1 48 THR HG23 H -9.738 -7.408 15.847 . . . 1.0 . . . . . . . . . . . . A . 48 THR HG23 . . . . . . . . . c16368_2kko 1 . 1 . 725 . 1 1 48 THR N N -10.921 -7.059 18.324 . . . 1.0 . . . . . . . . . . . . A . 48 THR N . . . . . . . . . c16368_2kko 1 . 1 . 726 . 1 1 48 THR O O -9.667 -3.772 19.140 . . . 1.0 . . . . . . . . . . . . A . 48 THR O . . . . . . . . . c16368_2kko 1 . 1 . 727 . 1 1 48 THR OG1 O -11.393 -5.322 16.206 . . . 1.0 . . . . . . . . . . . . A . 48 THR OG1 . . . . . . . . . c16368_2kko 1 . 1 . 728 . 1 1 49 GLY C C -12.596 -2.705 19.985 . . . 1.0 . . . . . . . . . . . . A . 49 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 729 . 1 1 49 GLY CA C -11.932 -3.876 20.688 . . . 1.0 . . . . . . . . . . . . A . 49 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 730 . 1 1 49 GLY H H -12.039 -5.724 19.664 . . . 1.0 . . . . . . . . . . . . A . 49 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 731 . 1 1 49 GLY HA2 H -12.633 -4.305 21.389 . . . 1.0 . . . . . . . . . . . . A . 49 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 732 . 1 1 49 GLY HA3 H -11.072 -3.515 21.231 . . . 1.0 . . . . . . . . . . . . A . 49 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 733 . 1 1 49 GLY N N -11.502 -4.909 19.767 . . . 1.0 . . . . . . . . . . . . A . 49 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 734 . 1 1 49 GLY O O -12.501 -1.563 20.440 . . . 1.0 . . . . . . . . . . . . A . 49 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 735 . 1 1 50 MET C C -15.465 -2.219 18.105 . . . 1.0 . . . . . . . . . . . . A . 50 MET C . . . . . . . . . c16368_2kko 1 . 1 . 736 . 1 1 50 MET CA C -13.967 -1.947 18.124 . . . 1.0 . . . . . . . . . . . . A . 50 MET CA . . . . . . . . . c16368_2kko 1 . 1 . 737 . 1 1 50 MET CB C -13.436 -1.858 16.688 . . . 1.0 . . . . . . . . . . . . A . 50 MET CB . . . . . . . . . c16368_2kko 1 . 1 . 738 . 1 1 50 MET CE C -11.701 -2.738 14.184 . . . 1.0 . . . . . . . . . . . . A . 50 MET CE . . . . . . . . . c16368_2kko 1 . 1 . 739 . 1 1 50 MET CG C -11.990 -1.392 16.595 . . . 1.0 . . . . . . . . . . . . A . 50 MET CG . . . . . . . . . c16368_2kko 1 . 1 . 740 . 1 1 50 MET H H -13.309 -3.914 18.560 . . . 1.0 . . . . . . . . . . . . A . 50 MET H . . . . . . . . . c16368_2kko 1 . 1 . 741 . 1 1 50 MET HA H -13.793 -1.004 18.620 . . . 1.0 . . . . . . . . . . . . A . 50 MET HA . . . . . . . . . c16368_2kko 1 . 1 . 742 . 1 1 50 MET HB2 H -13.507 -2.832 16.228 . . . 1.0 . . . . . . . . . . . . A . 50 MET HB2 . . . . . . . . . c16368_2kko 1 . 1 . 743 . 1 1 50 MET HB3 H -14.050 -1.164 16.132 . . . 1.0 . . . . . . . . . . . . A . 50 MET HB3 . . . . . . . . . c16368_2kko 1 . 1 . 744 . 1 1 50 MET HE1 H -11.395 -2.729 13.148 . . . 1.0 . . . . . . . . . . . . A . 50 MET HE1 . . . . . . . . . c16368_2kko 1 . 1 . 745 . 1 1 50 MET HE2 H -12.746 -3.003 14.247 . . . 1.0 . . . . . . . . . . . . A . 50 MET HE2 . . . . . . . . . c16368_2kko 1 . 1 . 746 . 1 1 50 MET HE3 H -11.112 -3.461 14.728 . . . 1.0 . . . . . . . . . . . . A . 50 MET HE3 . . . . . . . . . c16368_2kko 1 . 1 . 747 . 1 1 50 MET HG2 H -11.888 -0.469 17.145 . . . 1.0 . . . . . . . . . . . . A . 50 MET HG2 . . . . . . . . . c16368_2kko 1 . 1 . 748 . 1 1 50 MET HG3 H -11.355 -2.145 17.038 . . . 1.0 . . . . . . . . . . . . A . 50 MET HG3 . . . . . . . . . c16368_2kko 1 . 1 . 749 . 1 1 50 MET N N -13.268 -2.983 18.876 . . . 1.0 . . . . . . . . . . . . A . 50 MET N . . . . . . . . . c16368_2kko 1 . 1 . 750 . 1 1 50 MET O O -15.900 -3.359 18.250 . . . 1.0 . . . . . . . . . . . . A . 50 MET O . . . . . . . . . c16368_2kko 1 . 1 . 751 . 1 1 50 MET SD S -11.454 -1.111 14.894 . . . 1.0 . . . . . . . . . . . . A . 50 MET SD . . . . . . . . . c16368_2kko 1 . 1 . 752 . 1 1 51 ASN C C -18.120 -1.884 16.530 . . . 1.0 . . . . . . . . . . . . A . 51 ASN C . . . . . . . . . c16368_2kko 1 . 1 . 753 . 1 1 51 ASN CA C -17.695 -1.281 17.867 . . . 1.0 . . . . . . . . . . . . A . 51 ASN CA . . . . . . . . . c16368_2kko 1 . 1 . 754 . 1 1 51 ASN CB C -18.337 0.097 18.050 . . . 1.0 . . . . . . . . . . . . A . 51 ASN CB . . . . . . . . . c16368_2kko 1 . 1 . 755 . 1 1 51 ASN CG C -19.853 0.052 18.017 . . . 1.0 . . . . . . . . . . . . A . 51 ASN CG . . . . . . . . . c16368_2kko 1 . 1 . 756 . 1 1 51 ASN H H -15.830 -0.276 17.841 . . . 1.0 . . . . . . . . . . . . A . 51 ASN H . . . . . . . . . c16368_2kko 1 . 1 . 757 . 1 1 51 ASN HA H -18.016 -1.932 18.667 . . . 1.0 . . . . . . . . . . . . A . 51 ASN HA . . . . . . . . . c16368_2kko 1 . 1 . 758 . 1 1 51 ASN HB2 H -18.032 0.503 19.002 . . . 1.0 . . . . . . . . . . . . A . 51 ASN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 759 . 1 1 51 ASN HB3 H -17.996 0.751 17.260 . . . 1.0 . . . . . . . . . . . . A . 51 ASN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 760 . 1 1 51 ASN HD21 H -19.912 1.852 17.174 . . . 1.0 . . . . . . . . . . . . A . 51 ASN HD21 . . . . . . . . . c16368_2kko 1 . 1 . 761 . 1 1 51 ASN HD22 H -21.445 1.102 17.462 . . . 1.0 . . . . . . . . . . . . A . 51 ASN HD22 . . . . . . . . . c16368_2kko 1 . 1 . 762 . 1 1 51 ASN N N -16.244 -1.165 17.929 . . . 1.0 . . . . . . . . . . . . A . 51 ASN N . . . . . . . . . c16368_2kko 1 . 1 . 763 . 1 1 51 ASN ND2 N -20.465 1.104 17.500 . . . 1.0 . . . . . . . . . . . . A . 51 ASN ND2 . . . . . . . . . c16368_2kko 1 . 1 . 764 . 1 1 51 ASN O O -17.570 -1.530 15.487 . . . 1.0 . . . . . . . . . . . . A . 51 ASN O . . . . . . . . . c16368_2kko 1 . 1 . 765 . 1 1 51 ASN OD1 O -20.470 -0.920 18.450 . . . 1.0 . . . . . . . . . . . . A . 51 ASN OD1 . . . . . . . . . c16368_2kko 1 . 1 . 766 . 1 1 52 LEU C C -20.002 -2.492 14.279 . . . 1.0 . . . . . . . . . . . . A . 52 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 767 . 1 1 52 LEU CA C -19.578 -3.474 15.367 . . . 1.0 . . . . . . . . . . . . A . 52 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 768 . 1 1 52 LEU CB C -20.754 -4.405 15.698 . . . 1.0 . . . . . . . . . . . . A . 52 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 769 . 1 1 52 LEU CD1 C -19.727 -5.680 17.619 . . . 1.0 . . . . . . . . . . . . A . 52 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 770 . 1 1 52 LEU CD2 C -21.624 -6.666 16.342 . . . 1.0 . . . . . . . . . . . . A . 52 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 771 . 1 1 52 LEU CG C -20.387 -5.787 16.256 . . . 1.0 . . . . . . . . . . . . A . 52 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 772 . 1 1 52 LEU H H -19.530 -2.982 17.429 . . . 1.0 . . . . . . . . . . . . A . 52 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 773 . 1 1 52 LEU HA H -18.762 -4.071 14.993 . . . 1.0 . . . . . . . . . . . . A . 52 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 774 . 1 1 52 LEU HB2 H -21.378 -3.908 16.426 . . . 1.0 . . . . . . . . . . . . A . 52 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 775 . 1 1 52 LEU HB3 H -21.332 -4.550 14.797 . . . 1.0 . . . . . . . . . . . . A . 52 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 776 . 1 1 52 LEU HD11 H -19.525 -6.672 17.997 . . . 1.0 . . . . . . . . . . . . A . 52 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 777 . 1 1 52 LEU HD12 H -20.389 -5.164 18.298 . . . 1.0 . . . . . . . . . . . . A . 52 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 778 . 1 1 52 LEU HD13 H -18.802 -5.133 17.530 . . . 1.0 . . . . . . . . . . . . A . 52 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 779 . 1 1 52 LEU HD21 H -22.056 -6.780 15.360 . . . 1.0 . . . . . . . . . . . . A . 52 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 780 . 1 1 52 LEU HD22 H -22.344 -6.206 17.002 . . . 1.0 . . . . . . . . . . . . A . 52 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 781 . 1 1 52 LEU HD23 H -21.349 -7.635 16.730 . . . 1.0 . . . . . . . . . . . . A . 52 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 782 . 1 1 52 LEU HG H -19.687 -6.263 15.585 . . . 1.0 . . . . . . . . . . . . A . 52 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 783 . 1 1 52 LEU N N -19.105 -2.780 16.567 . . . 1.0 . . . . . . . . . . . . A . 52 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 784 . 1 1 52 LEU O O -19.719 -2.702 13.099 . . . 1.0 . . . . . . . . . . . . A . 52 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 785 . 1 1 53 THR C C -19.953 0.220 13.007 . . . 1.0 . . . . . . . . . . . . A . 53 THR C . . . . . . . . . c16368_2kko 1 . 1 . 786 . 1 1 53 THR CA C -21.137 -0.410 13.744 . . . 1.0 . . . . . . . . . . . . A . 53 THR CA . . . . . . . . . c16368_2kko 1 . 1 . 787 . 1 1 53 THR CB C -21.936 0.686 14.475 . . . 1.0 . . . . . . . . . . . . A . 53 THR CB . . . . . . . . . c16368_2kko 1 . 1 . 788 . 1 1 53 THR CG2 C -22.669 1.574 13.484 . . . 1.0 . . . . . . . . . . . . A . 53 THR CG2 . . . . . . . . . c16368_2kko 1 . 1 . 789 . 1 1 53 THR H H -20.888 -1.321 15.634 . . . 1.0 . . . . . . . . . . . . A . 53 THR H . . . . . . . . . c16368_2kko 1 . 1 . 790 . 1 1 53 THR HA H -21.787 -0.886 13.024 . . . 1.0 . . . . . . . . . . . . A . 53 THR HA . . . . . . . . . c16368_2kko 1 . 1 . 791 . 1 1 53 THR HB H -21.248 1.295 15.046 . . . 1.0 . . . . . . . . . . . . A . 53 THR HB . . . . . . . . . c16368_2kko 1 . 1 . 792 . 1 1 53 THR HG1 H -23.514 -0.455 14.847 . . . 1.0 . . . . . . . . . . . . A . 53 THR HG1 . . . . . . . . . c16368_2kko 1 . 1 . 793 . 1 1 53 THR HG21 H -23.272 2.291 14.022 . . . 1.0 . . . . . . . . . . . . A . 53 THR HG21 . . . . . . . . . c16368_2kko 1 . 1 . 794 . 1 1 53 THR HG22 H -23.304 0.966 12.858 . . . 1.0 . . . . . . . . . . . . A . 53 THR HG22 . . . . . . . . . c16368_2kko 1 . 1 . 795 . 1 1 53 THR HG23 H -21.951 2.097 12.869 . . . 1.0 . . . . . . . . . . . . A . 53 THR HG23 . . . . . . . . . c16368_2kko 1 . 1 . 796 . 1 1 53 THR N N -20.681 -1.425 14.682 . . . 1.0 . . . . . . . . . . . . A . 53 THR N . . . . . . . . . c16368_2kko 1 . 1 . 797 . 1 1 53 THR O O -19.955 0.327 11.779 . . . 1.0 . . . . . . . . . . . . A . 53 THR O . . . . . . . . . c16368_2kko 1 . 1 . 798 . 1 1 53 THR OG1 O -22.884 0.081 15.366 . . . 1.0 . . . . . . . . . . . . A . 53 THR OG1 . . . . . . . . . c16368_2kko 1 . 1 . 799 . 1 1 54 THR C C -16.953 0.193 12.368 . . . 1.0 . . . . . . . . . . . . A . 54 THR C . . . . . . . . . c16368_2kko 1 . 1 . 800 . 1 1 54 THR CA C -17.739 1.214 13.192 . . . 1.0 . . . . . . . . . . . . A . 54 THR CA . . . . . . . . . c16368_2kko 1 . 1 . 801 . 1 1 54 THR CB C -16.842 1.792 14.302 . . . 1.0 . . . . . . . . . . . . A . 54 THR CB . . . . . . . . . c16368_2kko 1 . 1 . 802 . 1 1 54 THR CG2 C -15.679 2.578 13.714 . . . 1.0 . . . . . . . . . . . . A . 54 THR CG2 . . . . . . . . . c16368_2kko 1 . 1 . 803 . 1 1 54 THR H H -18.973 0.467 14.731 . . . 1.0 . . . . . . . . . . . . A . 54 THR H . . . . . . . . . c16368_2kko 1 . 1 . 804 . 1 1 54 THR HA H -18.052 2.023 12.548 . . . 1.0 . . . . . . . . . . . . A . 54 THR HA . . . . . . . . . c16368_2kko 1 . 1 . 805 . 1 1 54 THR HB H -16.447 0.975 14.887 . . . 1.0 . . . . . . . . . . . . A . 54 THR HB . . . . . . . . . c16368_2kko 1 . 1 . 806 . 1 1 54 THR HG1 H -18.316 3.075 14.631 . . . 1.0 . . . . . . . . . . . . A . 54 THR HG1 . . . . . . . . . c16368_2kko 1 . 1 . 807 . 1 1 54 THR HG21 H -15.065 2.967 14.512 . . . 1.0 . . . . . . . . . . . . A . 54 THR HG21 . . . . . . . . . c16368_2kko 1 . 1 . 808 . 1 1 54 THR HG22 H -16.060 3.394 13.120 . . . 1.0 . . . . . . . . . . . . A . 54 THR HG22 . . . . . . . . . c16368_2kko 1 . 1 . 809 . 1 1 54 THR HG23 H -15.085 1.924 13.090 . . . 1.0 . . . . . . . . . . . . A . 54 THR HG23 . . . . . . . . . c16368_2kko 1 . 1 . 810 . 1 1 54 THR N N -18.929 0.603 13.763 . . . 1.0 . . . . . . . . . . . . A . 54 THR N . . . . . . . . . c16368_2kko 1 . 1 . 811 . 1 1 54 THR O O -16.380 0.524 11.328 . . . 1.0 . . . . . . . . . . . . A . 54 THR O . . . . . . . . . c16368_2kko 1 . 1 . 812 . 1 1 54 THR OG1 O -17.620 2.647 15.155 . . . 1.0 . . . . . . . . . . . . A . 54 THR OG1 . . . . . . . . . c16368_2kko 1 . 1 . 813 . 1 1 55 ALA C C -16.879 -2.354 10.764 . . . 1.0 . . . . . . . . . . . . A . 55 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 814 . 1 1 55 ALA CA C -16.268 -2.132 12.141 . . . 1.0 . . . . . . . . . . . . A . 55 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 815 . 1 1 55 ALA CB C -16.323 -3.412 12.961 . . . 1.0 . . . . . . . . . . . . A . 55 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 816 . 1 1 55 ALA H H -17.410 -1.245 13.683 . . . 1.0 . . . . . . . . . . . . A . 55 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 817 . 1 1 55 ALA HA H -15.232 -1.851 12.021 . . . 1.0 . . . . . . . . . . . . A . 55 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 818 . 1 1 55 ALA HB1 H -15.889 -3.235 13.934 . . . 1.0 . . . . . . . . . . . . A . 55 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 819 . 1 1 55 ALA HB2 H -15.768 -4.189 12.455 . . . 1.0 . . . . . . . . . . . . A . 55 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 820 . 1 1 55 ALA HB3 H -17.352 -3.721 13.076 . . . 1.0 . . . . . . . . . . . . A . 55 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 821 . 1 1 55 ALA N N -16.947 -1.051 12.838 . . . 1.0 . . . . . . . . . . . . A . 55 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 822 . 1 1 55 ALA O O -16.168 -2.408 9.770 . . . 1.0 . . . . . . . . . . . . A . 55 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 823 . 1 1 56 SER C C -18.540 -1.515 8.474 . . . 1.0 . . . . . . . . . . . . A . 56 SER C . . . . . . . . . c16368_2kko 1 . 1 . 824 . 1 1 56 SER CA C -18.886 -2.654 9.432 . . . 1.0 . . . . . . . . . . . . A . 56 SER CA . . . . . . . . . c16368_2kko 1 . 1 . 825 . 1 1 56 SER CB C -20.403 -2.734 9.648 . . . 1.0 . . . . . . . . . . . . A . 56 SER CB . . . . . . . . . c16368_2kko 1 . 1 . 826 . 1 1 56 SER H H -18.728 -2.431 11.535 . . . 1.0 . . . . . . . . . . . . A . 56 SER H . . . . . . . . . c16368_2kko 1 . 1 . 827 . 1 1 56 SER HA H -18.542 -3.584 9.005 . . . 1.0 . . . . . . . . . . . . A . 56 SER HA . . . . . . . . . c16368_2kko 1 . 1 . 828 . 1 1 56 SER HB2 H -20.614 -3.460 10.418 . . . 1.0 . . . . . . . . . . . . A . 56 SER HB2 . . . . . . . . . c16368_2kko 1 . 1 . 829 . 1 1 56 SER HB3 H -20.769 -1.767 9.958 . . . 1.0 . . . . . . . . . . . . A . 56 SER HB3 . . . . . . . . . c16368_2kko 1 . 1 . 830 . 1 1 56 SER HG H -20.672 -2.684 7.700 . . . 1.0 . . . . . . . . . . . . A . 56 SER HG . . . . . . . . . c16368_2kko 1 . 1 . 831 . 1 1 56 SER N N -18.201 -2.466 10.704 . . . 1.0 . . . . . . . . . . . . A . 56 SER N . . . . . . . . . c16368_2kko 1 . 1 . 832 . 1 1 56 SER O O -18.341 -1.732 7.281 . . . 1.0 . . . . . . . . . . . . A . 56 SER O . . . . . . . . . c16368_2kko 1 . 1 . 833 . 1 1 56 SER OG O -21.080 -3.119 8.461 . . . 1.0 . . . . . . . . . . . . A . 56 SER OG . . . . . . . . . c16368_2kko 1 . 1 . 834 . 1 1 57 ALA C C -16.741 0.743 7.551 . . . 1.0 . . . . . . . . . . . . A . 57 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 835 . 1 1 57 ALA CA C -18.113 0.871 8.218 . . . 1.0 . . . . . . . . . . . . A . 57 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 836 . 1 1 57 ALA CB C -18.165 2.123 9.081 . . . 1.0 . . . . . . . . . . . . A . 57 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 837 . 1 1 57 ALA H H -18.598 -0.199 9.978 . . . 1.0 . . . . . . . . . . . . A . 57 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 838 . 1 1 57 ALA HA H -18.863 0.967 7.446 . . . 1.0 . . . . . . . . . . . . A . 57 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 839 . 1 1 57 ALA HB1 H -17.403 2.067 9.844 . . . 1.0 . . . . . . . . . . . . A . 57 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 840 . 1 1 57 ALA HB2 H -19.136 2.198 9.548 . . . 1.0 . . . . . . . . . . . . A . 57 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 841 . 1 1 57 ALA HB3 H -17.995 2.993 8.464 . . . 1.0 . . . . . . . . . . . . A . 57 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 842 . 1 1 57 ALA N N -18.441 -0.305 9.014 . . . 1.0 . . . . . . . . . . . . A . 57 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 843 . 1 1 57 ALA O O -16.612 0.935 6.337 . . . 1.0 . . . . . . . . . . . . A . 57 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 844 . 1 1 58 ASN C C -14.094 -0.963 7.067 . . . 1.0 . . . . . . . . . . . . A . 58 ASN C . . . . . . . . . c16368_2kko 1 . 1 . 845 . 1 1 58 ASN CA C -14.360 0.352 7.799 . . . 1.0 . . . . . . . . . . . . A . 58 ASN CA . . . . . . . . . c16368_2kko 1 . 1 . 846 . 1 1 58 ASN CB C -13.305 0.616 8.891 . . . 1.0 . . . . . . . . . . . . A . 58 ASN CB . . . . . . . . . c16368_2kko 1 . 1 . 847 . 1 1 58 ASN CG C -13.313 -0.370 10.051 . . . 1.0 . . . . . . . . . . . . A . 58 ASN CG . . . . . . . . . c16368_2kko 1 . 1 . 848 . 1 1 58 ASN H H -15.879 0.188 9.278 . . . 1.0 . . . . . . . . . . . . A . 58 ASN H . . . . . . . . . c16368_2kko 1 . 1 . 849 . 1 1 58 ASN HA H -14.288 1.146 7.068 . . . 1.0 . . . . . . . . . . . . A . 58 ASN HA . . . . . . . . . c16368_2kko 1 . 1 . 850 . 1 1 58 ASN HB2 H -12.326 0.585 8.439 . . . 1.0 . . . . . . . . . . . . A . 58 ASN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 851 . 1 1 58 ASN HB3 H -13.469 1.606 9.290 . . . 1.0 . . . . . . . . . . . . A . 58 ASN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 852 . 1 1 58 ASN HD21 H -12.684 1.064 11.278 . . . 1.0 . . . . . . . . . . . . A . 58 ASN HD21 . . . . . . . . . c16368_2kko 1 . 1 . 853 . 1 1 58 ASN HD22 H -12.939 -0.494 11.997 . . . 1.0 . . . . . . . . . . . . A . 58 ASN HD22 . . . . . . . . . c16368_2kko 1 . 1 . 854 . 1 1 58 ASN N N -15.718 0.408 8.332 . . . 1.0 . . . . . . . . . . . . A . 58 ASN N . . . . . . . . . c16368_2kko 1 . 1 . 855 . 1 1 58 ASN ND2 N -12.942 0.112 11.226 . . . 1.0 . . . . . . . . . . . . A . 58 ASN ND2 . . . . . . . . . c16368_2kko 1 . 1 . 856 . 1 1 58 ASN O O -13.191 -1.040 6.233 . . . 1.0 . . . . . . . . . . . . A . 58 ASN O . . . . . . . . . c16368_2kko 1 . 1 . 857 . 1 1 58 ASN OD1 O -13.630 -1.541 9.899 . . . 1.0 . . . . . . . . . . . . A . 58 ASN OD1 . . . . . . . . . c16368_2kko 1 . 1 . 858 . 1 1 59 LEU C C -15.305 -2.977 5.176 . . . 1.0 . . . . . . . . . . . . A . 59 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 859 . 1 1 59 LEU CA C -14.836 -3.230 6.602 . . . 1.0 . . . . . . . . . . . . A . 59 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 860 . 1 1 59 LEU CB C -15.695 -4.315 7.258 . . . 1.0 . . . . . . . . . . . . A . 59 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 861 . 1 1 59 LEU CD1 C -16.104 -5.849 9.202 . . . 1.0 . . . . . . . . . . . . A . 59 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 862 . 1 1 59 LEU CD2 C -13.827 -5.695 8.193 . . . 1.0 . . . . . . . . . . . . A . 59 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 863 . 1 1 59 LEU CG C -15.099 -4.932 8.525 . . . 1.0 . . . . . . . . . . . . A . 59 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 864 . 1 1 59 LEU H H -15.492 -1.922 8.136 . . . 1.0 . . . . . . . . . . . . A . 59 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 865 . 1 1 59 LEU HA H -13.807 -3.562 6.577 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 866 . 1 1 59 LEU HB2 H -16.653 -3.883 7.507 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 867 . 1 1 59 LEU HB3 H -15.850 -5.105 6.539 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 868 . 1 1 59 LEU HD11 H -16.996 -5.290 9.445 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 869 . 1 1 59 LEU HD12 H -15.672 -6.248 10.108 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 870 . 1 1 59 LEU HD13 H -16.357 -6.661 8.537 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 871 . 1 1 59 LEU HD21 H -14.056 -6.500 7.509 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 872 . 1 1 59 LEU HD22 H -13.404 -6.102 9.099 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 873 . 1 1 59 LEU HD23 H -13.114 -5.025 7.734 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 874 . 1 1 59 LEU HG H -14.846 -4.143 9.217 . . . 1.0 . . . . . . . . . . . . A . 59 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 875 . 1 1 59 LEU N N -14.884 -1.989 7.366 . . . 1.0 . . . . . . . . . . . . A . 59 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 876 . 1 1 59 LEU O O -14.739 -3.506 4.221 . . . 1.0 . . . . . . . . . . . . A . 59 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 877 . 1 1 60 GLN C C -15.767 -0.892 3.020 . . . 1.0 . . . . . . . . . . . . A . 60 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 878 . 1 1 60 GLN CA C -16.822 -1.726 3.734 . . . 1.0 . . . . . . . . . . . . A . 60 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 879 . 1 1 60 GLN CB C -18.119 -0.928 3.875 . . . 1.0 . . . . . . . . . . . . A . 60 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 880 . 1 1 60 GLN CD C -20.485 -0.900 4.764 . . . 1.0 . . . . . . . . . . . . A . 60 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 881 . 1 1 60 GLN CG C -19.272 -1.745 4.429 . . . 1.0 . . . . . . . . . . . . A . 60 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 882 . 1 1 60 GLN H H -16.790 -1.820 5.851 . . . 1.0 . . . . . . . . . . . . A . 60 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 883 . 1 1 60 GLN HA H -17.015 -2.614 3.150 . . . 1.0 . . . . . . . . . . . . A . 60 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 884 . 1 1 60 GLN HB2 H -17.945 -0.094 4.540 . . . 1.0 . . . . . . . . . . . . A . 60 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 885 . 1 1 60 GLN HB3 H -18.406 -0.550 2.905 . . . 1.0 . . . . . . . . . . . . A . 60 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 886 . 1 1 60 GLN HE21 H -20.070 0.366 3.288 . . . 1.0 . . . . . . . . . . . . A . 60 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 887 . 1 1 60 GLN HE22 H -21.484 0.731 4.221 . . . 1.0 . . . . . . . . . . . . A . 60 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 888 . 1 1 60 GLN HG2 H -19.561 -2.478 3.692 . . . 1.0 . . . . . . . . . . . . A . 60 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 889 . 1 1 60 GLN HG3 H -18.938 -2.248 5.324 . . . 1.0 . . . . . . . . . . . . A . 60 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 890 . 1 1 60 GLN N N -16.336 -2.148 5.043 . . . 1.0 . . . . . . . . . . . . A . 60 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 891 . 1 1 60 GLN NE2 N -20.698 0.172 4.016 . . . 1.0 . . . . . . . . . . . . A . 60 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 892 . 1 1 60 GLN O O -15.633 -0.959 1.799 . . . 1.0 . . . . . . . . . . . . A . 60 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 893 . 1 1 60 GLN OE1 O -21.227 -1.209 5.694 . . . 1.0 . . . . . . . . . . . . A . 60 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 894 . 1 1 61 ALA C C -12.837 -0.253 2.672 . . . 1.0 . . . . . . . . . . . . A . 61 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 895 . 1 1 61 ALA CA C -13.915 0.671 3.238 . . . 1.0 . . . . . . . . . . . . A . 61 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 896 . 1 1 61 ALA CB C -13.326 1.589 4.299 . . . 1.0 . . . . . . . . . . . . A . 61 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 897 . 1 1 61 ALA H H -15.219 -0.048 4.750 . . . 1.0 . . . . . . . . . . . . A . 61 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 898 . 1 1 61 ALA HA H -14.307 1.284 2.438 . . . 1.0 . . . . . . . . . . . . A . 61 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 899 . 1 1 61 ALA HB1 H -14.103 2.230 4.690 . . . 1.0 . . . . . . . . . . . . A . 61 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 900 . 1 1 61 ALA HB2 H -12.547 2.193 3.859 . . . 1.0 . . . . . . . . . . . . A . 61 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 901 . 1 1 61 ALA HB3 H -12.913 0.994 5.099 . . . 1.0 . . . . . . . . . . . . A . 61 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 902 . 1 1 61 ALA N N -15.019 -0.108 3.789 . . . 1.0 . . . . . . . . . . . . A . 61 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 903 . 1 1 61 ALA O O -12.303 -0.016 1.588 . . . 1.0 . . . . . . . . . . . . A . 61 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 904 . 1 1 62 LEU C C -12.102 -3.130 1.805 . . . 1.0 . . . . . . . . . . . . A . 62 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 905 . 1 1 62 LEU CA C -11.550 -2.301 2.962 . . . 1.0 . . . . . . . . . . . . A . 62 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 906 . 1 1 62 LEU CB C -11.155 -3.224 4.119 . . . 1.0 . . . . . . . . . . . . A . 62 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 907 . 1 1 62 LEU CD1 C -10.280 -3.529 6.449 . . . 1.0 . . . . . . . . . . . . A . 62 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 908 . 1 1 62 LEU CD2 C -9.234 -1.834 4.940 . . . 1.0 . . . . . . . . . . . . A . 62 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 909 . 1 1 62 LEU CG C -10.530 -2.528 5.332 . . . 1.0 . . . . . . . . . . . . A . 62 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 910 . 1 1 62 LEU H H -12.975 -1.442 4.277 . . . 1.0 . . . . . . . . . . . . A . 62 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 911 . 1 1 62 LEU HA H -10.676 -1.766 2.624 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 912 . 1 1 62 LEU HB2 H -12.040 -3.751 4.449 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 913 . 1 1 62 LEU HB3 H -10.446 -3.948 3.745 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 914 . 1 1 62 LEU HD11 H -9.871 -3.017 7.308 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 915 . 1 1 62 LEU HD12 H -9.581 -4.281 6.110 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 916 . 1 1 62 LEU HD13 H -11.212 -4.003 6.722 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 917 . 1 1 62 LEU HD21 H -8.535 -2.564 4.555 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 918 . 1 1 62 LEU HD22 H -8.808 -1.350 5.806 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 919 . 1 1 62 LEU HD23 H -9.436 -1.095 4.179 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 920 . 1 1 62 LEU HG H -11.215 -1.779 5.702 . . . 1.0 . . . . . . . . . . . . A . 62 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 921 . 1 1 62 LEU N N -12.533 -1.318 3.407 . . . 1.0 . . . . . . . . . . . . A . 62 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 922 . 1 1 62 LEU O O -11.361 -3.552 0.914 . . . 1.0 . . . . . . . . . . . . A . 62 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 923 . 1 1 63 LYS C C -14.066 -3.388 -0.528 . . . 1.0 . . . . . . . . . . . . A . 63 LYS C . . . . . . . . . c16368_2kko 1 . 1 . 924 . 1 1 63 LYS CA C -14.076 -4.139 0.799 . . . 1.0 . . . . . . . . . . . . A . 63 LYS CA . . . . . . . . . c16368_2kko 1 . 1 . 925 . 1 1 63 LYS CB C -15.519 -4.450 1.216 . . . 1.0 . . . . . . . . . . . . A . 63 LYS CB . . . . . . . . . c16368_2kko 1 . 1 . 926 . 1 1 63 LYS CD C -17.665 -5.656 0.701 . . . 1.0 . . . . . . . . . . . . A . 63 LYS CD . . . . . . . . . c16368_2kko 1 . 1 . 927 . 1 1 63 LYS CE C -18.315 -6.781 -0.091 . . . 1.0 . . . . . . . . . . . . A . 63 LYS CE . . . . . . . . . c16368_2kko 1 . 1 . 928 . 1 1 63 LYS CG C -16.198 -5.489 0.340 . . . 1.0 . . . . . . . . . . . . A . 63 LYS CG . . . . . . . . . c16368_2kko 1 . 1 . 929 . 1 1 63 LYS H H -13.937 -3.003 2.579 . . . 1.0 . . . . . . . . . . . . A . 63 LYS H . . . . . . . . . c16368_2kko 1 . 1 . 930 . 1 1 63 LYS HA H -13.535 -5.066 0.681 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HA . . . . . . . . . c16368_2kko 1 . 1 . 931 . 1 1 63 LYS HB2 H -15.515 -4.813 2.233 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 932 . 1 1 63 LYS HB3 H -16.097 -3.537 1.172 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 933 . 1 1 63 LYS HD2 H -17.743 -5.879 1.754 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 934 . 1 1 63 LYS HD3 H -18.185 -4.732 0.489 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HD3 . . . . . . . . . c16368_2kko 1 . 1 . 935 . 1 1 63 LYS HE2 H -17.918 -7.724 0.255 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 936 . 1 1 63 LYS HE3 H -19.381 -6.756 0.085 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HE3 . . . . . . . . . c16368_2kko 1 . 1 . 937 . 1 1 63 LYS HG2 H -16.127 -5.178 -0.690 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HG2 . . . . . . . . . c16368_2kko 1 . 1 . 938 . 1 1 63 LYS HG3 H -15.694 -6.436 0.469 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HG3 . . . . . . . . . c16368_2kko 1 . 1 . 939 . 1 1 63 LYS HZ1 H -18.718 -7.277 -2.083 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HZ1 . . . . . . . . . c16368_2kko 1 . 1 . 940 . 1 1 63 LYS HZ2 H -17.082 -6.950 -1.772 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HZ2 . . . . . . . . . c16368_2kko 1 . 1 . 941 . 1 1 63 LYS HZ3 H -18.202 -5.674 -1.862 . . . 1.0 . . . . . . . . . . . . A . 63 LYS HZ3 . . . . . . . . . c16368_2kko 1 . 1 . 942 . 1 1 63 LYS N N -13.408 -3.359 1.831 . . . 1.0 . . . . . . . . . . . . A . 63 LYS N . . . . . . . . . c16368_2kko 1 . 1 . 943 . 1 1 63 LYS NZ N -18.063 -6.660 -1.551 . . . 1.0 . . . . . . . . . . . . A . 63 LYS NZ . . . . . . . . . c16368_2kko 1 . 1 . 944 . 1 1 63 LYS O O -13.740 -3.956 -1.568 . . . 1.0 . . . . . . . . . . . . A . 63 LYS O . . . . . . . . . c16368_2kko 1 . 1 . 945 . 1 1 64 SER C C -13.002 -1.084 -2.220 . . . 1.0 . . . . . . . . . . . . A . 64 SER C . . . . . . . . . c16368_2kko 1 . 1 . 946 . 1 1 64 SER CA C -14.417 -1.267 -1.672 . . . 1.0 . . . . . . . . . . . . A . 64 SER CA . . . . . . . . . c16368_2kko 1 . 1 . 947 . 1 1 64 SER CB C -15.055 0.091 -1.365 . . . 1.0 . . . . . . . . . . . . A . 64 SER CB . . . . . . . . . c16368_2kko 1 . 1 . 948 . 1 1 64 SER H H -14.669 -1.710 0.382 . . . 1.0 . . . . . . . . . . . . A . 64 SER H . . . . . . . . . c16368_2kko 1 . 1 . 949 . 1 1 64 SER HA H -15.012 -1.769 -2.420 . . . 1.0 . . . . . . . . . . . . A . 64 SER HA . . . . . . . . . c16368_2kko 1 . 1 . 950 . 1 1 64 SER HB2 H -14.822 0.780 -2.164 . . . 1.0 . . . . . . . . . . . . A . 64 SER HB2 . . . . . . . . . c16368_2kko 1 . 1 . 951 . 1 1 64 SER HB3 H -16.125 -0.025 -1.291 . . . 1.0 . . . . . . . . . . . . A . 64 SER HB3 . . . . . . . . . c16368_2kko 1 . 1 . 952 . 1 1 64 SER HG H -15.042 0.222 0.595 . . . 1.0 . . . . . . . . . . . . A . 64 SER HG . . . . . . . . . c16368_2kko 1 . 1 . 953 . 1 1 64 SER N N -14.409 -2.104 -0.479 . . . 1.0 . . . . . . . . . . . . A . 64 SER N . . . . . . . . . c16368_2kko 1 . 1 . 954 . 1 1 64 SER O O -12.806 -0.915 -3.426 . . . 1.0 . . . . . . . . . . . . A . 64 SER O . . . . . . . . . c16368_2kko 1 . 1 . 955 . 1 1 64 SER OG O -14.568 0.630 -0.144 . . . 1.0 . . . . . . . . . . . . A . 64 SER OG . . . . . . . . . c16368_2kko 1 . 1 . 956 . 1 1 65 GLY C C -10.227 -2.322 -2.492 . . . 1.0 . . . . . . . . . . . . A . 65 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 957 . 1 1 65 GLY CA C -10.634 -1.071 -1.740 . . . 1.0 . . . . . . . . . . . . A . 65 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 958 . 1 1 65 GLY H H -12.241 -1.173 -0.369 . . . 1.0 . . . . . . . . . . . . A . 65 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 959 . 1 1 65 GLY HA2 H -10.491 -0.212 -2.381 . . . 1.0 . . . . . . . . . . . . A . 65 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 960 . 1 1 65 GLY HA3 H -10.008 -0.968 -0.867 . . . 1.0 . . . . . . . . . . . . A . 65 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 961 . 1 1 65 GLY N N -12.020 -1.122 -1.324 . . . 1.0 . . . . . . . . . . . . A . 65 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 962 . 1 1 65 GLY O O -9.404 -2.268 -3.400 . . . 1.0 . . . . . . . . . . . . A . 65 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 963 . 1 1 66 GLY C C -9.679 -5.612 -1.897 . . . 1.0 . . . . . . . . . . . . A . 66 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 964 . 1 1 66 GLY CA C -10.517 -4.705 -2.772 . . . 1.0 . . . . . . . . . . . . A . 66 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 965 . 1 1 66 GLY H H -11.501 -3.420 -1.411 . . . 1.0 . . . . . . . . . . . . A . 66 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 966 . 1 1 66 GLY HA2 H -11.441 -5.208 -3.016 . . . 1.0 . . . . . . . . . . . . A . 66 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 967 . 1 1 66 GLY HA3 H -9.976 -4.504 -3.684 . . . 1.0 . . . . . . . . . . . . A . 66 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 968 . 1 1 66 GLY N N -10.828 -3.447 -2.123 . . . 1.0 . . . . . . . . . . . . A . 66 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 969 . 1 1 66 GLY O O -9.097 -6.585 -2.376 . . . 1.0 . . . . . . . . . . . . A . 66 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 970 . 1 1 67 LEU C C -9.604 -7.252 0.888 . . . 1.0 . . . . . . . . . . . . A . 67 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 971 . 1 1 67 LEU CA C -8.823 -6.068 0.333 . . . 1.0 . . . . . . . . . . . . A . 67 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 972 . 1 1 67 LEU CB C -8.336 -5.174 1.479 . . . 1.0 . . . . . . . . . . . . A . 67 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 973 . 1 1 67 LEU CD1 C -6.970 -3.721 -0.063 . . . 1.0 . . . . . . . . . . . . A . 67 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 974 . 1 1 67 LEU CD2 C -6.668 -3.549 2.404 . . . 1.0 . . . . . . . . . . . . A . 67 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 975 . 1 1 67 LEU CG C -6.986 -4.484 1.251 . . . 1.0 . . . . . . . . . . . . A . 67 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 976 . 1 1 67 LEU H H -10.135 -4.525 -0.286 . . . 1.0 . . . . . . . . . . . . A . 67 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 977 . 1 1 67 LEU HA H -7.966 -6.446 -0.200 . . . 1.0 . . . . . . . . . . . . A . 67 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 978 . 1 1 67 LEU HB2 H -9.081 -4.412 1.652 . . . 1.0 . . . . . . . . . . . . A . 67 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 979 . 1 1 67 LEU HB3 H -8.257 -5.781 2.370 . . . 1.0 . . . . . . . . . . . . A . 67 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 980 . 1 1 67 LEU HD11 H -7.789 -3.019 -0.081 . . . 1.0 . . . . . . . . . . . . A . 67 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 981 . 1 1 67 LEU HD12 H -7.069 -4.416 -0.884 . . . 1.0 . . . . . . . . . . . . A . 67 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 982 . 1 1 67 LEU HD13 H -6.035 -3.186 -0.156 . . . 1.0 . . . . . . . . . . . . A . 67 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 983 . 1 1 67 LEU HD21 H -6.606 -4.115 3.321 . . . 1.0 . . . . . . . . . . . . A . 67 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 984 . 1 1 67 LEU HD22 H -7.450 -2.808 2.489 . . . 1.0 . . . . . . . . . . . . A . 67 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 985 . 1 1 67 LEU HD23 H -5.725 -3.057 2.218 . . . 1.0 . . . . . . . . . . . . A . 67 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 986 . 1 1 67 LEU HG H -6.210 -5.235 1.207 . . . 1.0 . . . . . . . . . . . . A . 67 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 987 . 1 1 67 LEU N N -9.623 -5.296 -0.611 . . . 1.0 . . . . . . . . . . . . A . 67 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 988 . 1 1 67 LEU O O -9.113 -8.382 0.895 . . . 1.0 . . . . . . . . . . . . A . 67 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 989 . 1 1 68 VAL C C -12.970 -8.193 1.277 . . . 1.0 . . . . . . . . . . . . A . 68 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 990 . 1 1 68 VAL CA C -11.618 -8.052 1.959 . . . 1.0 . . . . . . . . . . . . A . 68 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 991 . 1 1 68 VAL CB C -11.839 -7.809 3.469 . . . 1.0 . . . . . . . . . . . . A . 68 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 992 . 1 1 68 VAL CG1 C -10.516 -7.813 4.216 . . . 1.0 . . . . . . . . . . . . A . 68 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 993 . 1 1 68 VAL CG2 C -12.585 -6.506 3.709 . . . 1.0 . . . . . . . . . . . . A . 68 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 994 . 1 1 68 VAL H H -11.195 -6.102 1.257 . . . 1.0 . . . . . . . . . . . . A . 68 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 995 . 1 1 68 VAL HA H -11.077 -8.981 1.847 . . . 1.0 . . . . . . . . . . . . A . 68 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 996 . 1 1 68 VAL HB H -12.443 -8.617 3.854 . . . 1.0 . . . . . . . . . . . . A . 68 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 997 . 1 1 68 VAL HG11 H -10.042 -8.776 4.102 . . . 1.0 . . . . . . . . . . . . A . 68 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 998 . 1 1 68 VAL HG12 H -10.694 -7.621 5.263 . . . 1.0 . . . . . . . . . . . . A . 68 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 999 . 1 1 68 VAL HG13 H -9.873 -7.045 3.813 . . . 1.0 . . . . . . . . . . . . A . 68 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 1000 . 1 1 68 VAL HG21 H -12.016 -5.685 3.298 . . . 1.0 . . . . . . . . . . . . A . 68 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 1001 . 1 1 68 VAL HG22 H -12.716 -6.355 4.771 . . . 1.0 . . . . . . . . . . . . A . 68 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 1002 . 1 1 68 VAL HG23 H -13.551 -6.551 3.230 . . . 1.0 . . . . . . . . . . . . A . 68 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 1003 . 1 1 68 VAL N N -10.819 -7.002 1.347 . . . 1.0 . . . . . . . . . . . . A . 68 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 1004 . 1 1 68 VAL O O -13.465 -7.260 0.646 . . . 1.0 . . . . . . . . . . . . A . 68 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 1005 . 1 1 69 GLU C C -15.701 -10.314 2.013 . . . 1.0 . . . . . . . . . . . . A . 69 GLU C . . . . . . . . . c16368_2kko 1 . 1 . 1006 . 1 1 69 GLU CA C -14.880 -9.661 0.912 . . . 1.0 . . . . . . . . . . . . A . 69 GLU CA . . . . . . . . . c16368_2kko 1 . 1 . 1007 . 1 1 69 GLU CB C -14.820 -10.573 -0.316 . . . 1.0 . . . . . . . . . . . . A . 69 GLU CB . . . . . . . . . c16368_2kko 1 . 1 . 1008 . 1 1 69 GLU CD C -15.830 -8.946 -1.954 . . . 1.0 . . . . . . . . . . . . A . 69 GLU CD . . . . . . . . . c16368_2kko 1 . 1 . 1009 . 1 1 69 GLU CG C -14.639 -9.824 -1.628 . . . 1.0 . . . . . . . . . . . . A . 69 GLU CG . . . . . . . . . c16368_2kko 1 . 1 . 1010 . 1 1 69 GLU H H -13.056 -10.089 1.878 . . . 1.0 . . . . . . . . . . . . A . 69 GLU H . . . . . . . . . c16368_2kko 1 . 1 . 1011 . 1 1 69 GLU HA H -15.343 -8.724 0.638 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HA . . . . . . . . . c16368_2kko 1 . 1 . 1012 . 1 1 69 GLU HB2 H -13.992 -11.257 -0.201 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1013 . 1 1 69 GLU HB3 H -15.738 -11.139 -0.374 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1014 . 1 1 69 GLU HG2 H -13.759 -9.201 -1.557 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1015 . 1 1 69 GLU HG3 H -14.508 -10.542 -2.425 . . . 1.0 . . . . . . . . . . . . A . 69 GLU HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1016 . 1 1 69 GLU N N -13.547 -9.374 1.410 . . . 1.0 . . . . . . . . . . . . A . 69 GLU N . . . . . . . . . c16368_2kko 1 . 1 . 1017 . 1 1 69 GLU O O -15.162 -10.687 3.056 . . . 1.0 . . . . . . . . . . . . A . 69 GLU O . . . . . . . . . c16368_2kko 1 . 1 . 1018 . 1 1 69 GLU OE1 O -16.942 -9.489 -2.121 . . . 1.0 . . . . . . . . . . . . A . 69 GLU OE1 . . . . . . . . . c16368_2kko 1 . 1 . 1019 . 1 1 69 GLU OE2 O -15.670 -7.710 -2.026 . . . 1.0 . . . . . . . . . . . . A . 69 GLU OE2 . . . . . . . . . c16368_2kko 1 . 1 . 1020 . 1 1 70 ALA C C -18.656 -12.200 2.258 . . . 1.0 . . . . . . . . . . . . A . 70 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1021 . 1 1 70 ALA CA C -17.871 -11.015 2.797 . . . 1.0 . . . . . . . . . . . . A . 70 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 1022 . 1 1 70 ALA CB C -18.817 -9.946 3.316 . . . 1.0 . . . . . . . . . . . . A . 70 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 1023 . 1 1 70 ALA H H -17.363 -10.205 0.913 . . . 1.0 . . . . . . . . . . . . A . 70 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 1024 . 1 1 70 ALA HA H -17.258 -11.349 3.621 . . . 1.0 . . . . . . . . . . . . A . 70 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 1025 . 1 1 70 ALA HB1 H -18.246 -9.102 3.674 . . . 1.0 . . . . . . . . . . . . A . 70 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 1026 . 1 1 70 ALA HB2 H -19.408 -10.351 4.125 . . . 1.0 . . . . . . . . . . . . A . 70 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1027 . 1 1 70 ALA HB3 H -19.470 -9.626 2.519 . . . 1.0 . . . . . . . . . . . . A . 70 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1028 . 1 1 70 ALA N N -16.994 -10.461 1.784 . . . 1.0 . . . . . . . . . . . . A . 70 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 1029 . 1 1 70 ALA O O -19.063 -12.213 1.095 . . . 1.0 . . . . . . . . . . . . A . 70 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 1030 . 1 1 71 ARG C C -20.751 -14.530 3.817 . . . 1.0 . . . . . . . . . . . . A . 71 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 1031 . 1 1 71 ARG CA C -19.653 -14.357 2.775 . . . 1.0 . . . . . . . . . . . . A . 71 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 1032 . 1 1 71 ARG CB C -18.769 -15.607 2.695 . . . 1.0 . . . . . . . . . . . . A . 71 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 1033 . 1 1 71 ARG CD C -18.613 -18.074 2.243 . . . 1.0 . . . . . . . . . . . . A . 71 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 1034 . 1 1 71 ARG CG C -19.543 -16.904 2.521 . . . 1.0 . . . . . . . . . . . . A . 71 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 1035 . 1 1 71 ARG CZ C -16.726 -18.406 0.690 . . . 1.0 . . . . . . . . . . . . A . 71 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 1036 . 1 1 71 ARG H H -18.437 -13.141 4.002 . . . 1.0 . . . . . . . . . . . . A . 71 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 1037 . 1 1 71 ARG HA H -20.110 -14.182 1.810 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 1038 . 1 1 71 ARG HB2 H -18.097 -15.503 1.856 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1039 . 1 1 71 ARG HB3 H -18.187 -15.682 3.602 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1040 . 1 1 71 ARG HD2 H -17.858 -18.106 3.014 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1041 . 1 1 71 ARG HD3 H -19.187 -18.988 2.266 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 1042 . 1 1 71 ARG HE H -18.468 -17.534 0.213 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 1043 . 1 1 71 ARG HG2 H -20.097 -17.106 3.426 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1044 . 1 1 71 ARG HG3 H -20.228 -16.794 1.692 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1045 . 1 1 71 ARG HH11 H -16.395 -19.076 2.581 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 1046 . 1 1 71 ARG HH12 H -15.077 -19.302 1.463 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 1047 . 1 1 71 ARG HH21 H -16.742 -17.851 -1.265 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 1048 . 1 1 71 ARG HH22 H -15.283 -18.616 -0.714 . . . 1.0 . . . . . . . . . . . . A . 71 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 1049 . 1 1 71 ARG N N -18.851 -13.192 3.108 . . . 1.0 . . . . . . . . . . . . A . 71 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 1050 . 1 1 71 ARG NE N -17.955 -17.961 0.941 . . . 1.0 . . . . . . . . . . . . A . 71 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 1051 . 1 1 71 ARG NH1 N -16.012 -18.976 1.652 . . . 1.0 . . . . . . . . . . . . A . 71 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 1052 . 1 1 71 ARG NH2 N -16.208 -18.282 -0.525 . . . 1.0 . . . . . . . . . . . . A . 71 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 1053 . 1 1 71 ARG O O -20.526 -14.308 5.009 . . . 1.0 . . . . . . . . . . . . A . 71 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 1054 . 1 1 72 ARG C C -23.322 -16.472 4.649 . . . 1.0 . . . . . . . . . . . . A . 72 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 1055 . 1 1 72 ARG CA C -23.067 -15.017 4.286 . . . 1.0 . . . . . . . . . . . . A . 72 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 1056 . 1 1 72 ARG CB C -24.329 -14.418 3.670 . . . 1.0 . . . . . . . . . . . . A . 72 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 1057 . 1 1 72 ARG CD C -25.006 -12.854 5.510 . . . 1.0 . . . . . . . . . . . . A . 72 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 1058 . 1 1 72 ARG CG C -25.389 -14.085 4.705 . . . 1.0 . . . . . . . . . . . . A . 72 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 1059 . 1 1 72 ARG CZ C -24.316 -10.907 4.136 . . . 1.0 . . . . . . . . . . . . A . 72 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 1060 . 1 1 72 ARG H H -22.067 -15.092 2.422 . . . 1.0 . . . . . . . . . . . . A . 72 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 1061 . 1 1 72 ARG HA H -22.824 -14.472 5.186 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 1062 . 1 1 72 ARG HB2 H -24.066 -13.512 3.144 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1063 . 1 1 72 ARG HB3 H -24.748 -15.125 2.969 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1064 . 1 1 72 ARG HD2 H -25.590 -12.836 6.419 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1065 . 1 1 72 ARG HD3 H -23.956 -12.910 5.757 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 1066 . 1 1 72 ARG HE H -26.189 -11.298 4.729 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 1067 . 1 1 72 ARG HG2 H -26.324 -13.896 4.200 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1068 . 1 1 72 ARG HG3 H -25.500 -14.923 5.377 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1069 . 1 1 72 ARG HH11 H -22.788 -12.160 4.580 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 1070 . 1 1 72 ARG HH12 H -22.356 -10.768 3.637 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 1071 . 1 1 72 ARG HH21 H -25.604 -9.472 3.510 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 1072 . 1 1 72 ARG HH22 H -23.947 -9.238 3.036 . . . 1.0 . . . . . . . . . . . . A . 72 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 1073 . 1 1 72 ARG N N -21.943 -14.895 3.375 . . . 1.0 . . . . . . . . . . . . A . 72 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 1074 . 1 1 72 ARG NE N -25.253 -11.621 4.761 . . . 1.0 . . . . . . . . . . . . A . 72 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 1075 . 1 1 72 ARG NH1 N -23.051 -11.313 4.121 . . . 1.0 . . . . . . . . . . . . A . 72 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 1076 . 1 1 72 ARG NH2 N -24.650 -9.784 3.512 . . . 1.0 . . . . . . . . . . . . A . 72 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 1077 . 1 1 72 ARG O O -23.769 -17.262 3.816 . . . 1.0 . . . . . . . . . . . . A . 72 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 1078 . 1 1 73 GLU C C -24.478 -18.042 7.397 . . . 1.0 . . . . . . . . . . . . A . 73 GLU C . . . . . . . . . c16368_2kko 1 . 1 . 1079 . 1 1 73 GLU CA C -23.333 -18.145 6.399 . . . 1.0 . . . . . . . . . . . . A . 73 GLU CA . . . . . . . . . c16368_2kko 1 . 1 . 1080 . 1 1 73 GLU CB C -22.094 -18.769 7.052 . . . 1.0 . . . . . . . . . . . . A . 73 GLU CB . . . . . . . . . c16368_2kko 1 . 1 . 1081 . 1 1 73 GLU CD C -21.111 -20.724 8.310 . . . 1.0 . . . . . . . . . . . . A . 73 GLU CD . . . . . . . . . c16368_2kko 1 . 1 . 1082 . 1 1 73 GLU CG C -22.319 -20.175 7.578 . . . 1.0 . . . . . . . . . . . . A . 73 GLU CG . . . . . . . . . c16368_2kko 1 . 1 . 1083 . 1 1 73 GLU H H -22.616 -16.162 6.489 . . . 1.0 . . . . . . . . . . . . A . 73 GLU H . . . . . . . . . c16368_2kko 1 . 1 . 1084 . 1 1 73 GLU HA H -23.645 -18.760 5.567 . . . 1.0 . . . . . . . . . . . . A . 73 GLU HA . . . . . . . . . c16368_2kko 1 . 1 . 1085 . 1 1 73 GLU HB2 H -21.298 -18.807 6.324 . . . 1.0 . . . . . . . . . . . . A . 73 GLU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1086 . 1 1 73 GLU HB3 H -21.784 -18.146 7.877 . . . 1.0 . . . . . . . . . . . . A . 73 GLU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1087 . 1 1 73 GLU HG2 H -23.156 -20.161 8.259 . . . 1.0 . . . . . . . . . . . . A . 73 GLU HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1088 . 1 1 73 GLU HG3 H -22.544 -20.826 6.746 . . . 1.0 . . . . . . . . . . . . A . 73 GLU HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1089 . 1 1 73 GLU N N -23.032 -16.820 5.890 . . . 1.0 . . . . . . . . . . . . A . 73 GLU N . . . . . . . . . c16368_2kko 1 . 1 . 1090 . 1 1 73 GLU O O -24.289 -17.587 8.525 . . . 1.0 . . . . . . . . . . . . A . 73 GLU O . . . . . . . . . c16368_2kko 1 . 1 . 1091 . 1 1 73 GLU OE1 O -20.155 -21.166 7.642 . . . 1.0 . . . . . . . . . . . . A . 73 GLU OE1 . . . . . . . . . c16368_2kko 1 . 1 . 1092 . 1 1 73 GLU OE2 O -21.118 -20.725 9.561 . . . 1.0 . . . . . . . . . . . . A . 73 GLU OE2 . . . . . . . . . c16368_2kko 1 . 1 . 1093 . 1 1 74 GLY C C -27.316 -16.867 7.911 . . . 1.0 . . . . . . . . . . . . A . 74 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 1094 . 1 1 74 GLY CA C -26.845 -18.302 7.798 . . . 1.0 . . . . . . . . . . . . A . 74 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 1095 . 1 1 74 GLY H H -25.760 -18.769 6.040 . . . 1.0 . . . . . . . . . . . . A . 74 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 1096 . 1 1 74 GLY HA2 H -27.640 -18.901 7.378 . . . 1.0 . . . . . . . . . . . . A . 74 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 1097 . 1 1 74 GLY HA3 H -26.608 -18.673 8.785 . . . 1.0 . . . . . . . . . . . . A . 74 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 1098 . 1 1 74 GLY N N -25.672 -18.418 6.957 . . . 1.0 . . . . . . . . . . . . A . 74 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 1099 . 1 1 74 GLY O O -27.861 -16.305 6.959 . . . 1.0 . . . . . . . . . . . . A . 74 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 1100 . 1 1 75 THR C C -26.252 -14.054 9.712 . . . 1.0 . . . . . . . . . . . . A . 75 THR C . . . . . . . . . c16368_2kko 1 . 1 . 1101 . 1 1 75 THR CA C -27.464 -14.882 9.295 . . . 1.0 . . . . . . . . . . . . A . 75 THR CA . . . . . . . . . c16368_2kko 1 . 1 . 1102 . 1 1 75 THR CB C -28.563 -14.772 10.369 . . . 1.0 . . . . . . . . . . . . A . 75 THR CB . . . . . . . . . c16368_2kko 1 . 1 . 1103 . 1 1 75 THR CG2 C -29.938 -15.028 9.775 . . . 1.0 . . . . . . . . . . . . A . 75 THR CG2 . . . . . . . . . c16368_2kko 1 . 1 . 1104 . 1 1 75 THR H H -26.663 -16.777 9.799 . . . 1.0 . . . . . . . . . . . . A . 75 THR H . . . . . . . . . c16368_2kko 1 . 1 . 1105 . 1 1 75 THR HA H -27.855 -14.487 8.368 . . . 1.0 . . . . . . . . . . . . A . 75 THR HA . . . . . . . . . c16368_2kko 1 . 1 . 1106 . 1 1 75 THR HB H -28.544 -13.772 10.779 . . . 1.0 . . . . . . . . . . . . A . 75 THR HB . . . . . . . . . c16368_2kko 1 . 1 . 1107 . 1 1 75 THR HG1 H -28.474 -16.609 11.095 . . . 1.0 . . . . . . . . . . . . A . 75 THR HG1 . . . . . . . . . c16368_2kko 1 . 1 . 1108 . 1 1 75 THR HG21 H -30.687 -14.929 10.547 . . . 1.0 . . . . . . . . . . . . A . 75 THR HG21 . . . . . . . . . c16368_2kko 1 . 1 . 1109 . 1 1 75 THR HG22 H -29.974 -16.029 9.367 . . . 1.0 . . . . . . . . . . . . A . 75 THR HG22 . . . . . . . . . c16368_2kko 1 . 1 . 1110 . 1 1 75 THR HG23 H -30.131 -14.312 8.991 . . . 1.0 . . . . . . . . . . . . A . 75 THR HG23 . . . . . . . . . c16368_2kko 1 . 1 . 1111 . 1 1 75 THR N N -27.092 -16.268 9.068 . . . 1.0 . . . . . . . . . . . . A . 75 THR N . . . . . . . . . c16368_2kko 1 . 1 . 1112 . 1 1 75 THR O O -26.373 -12.879 10.067 . . . 1.0 . . . . . . . . . . . . A . 75 THR O . . . . . . . . . c16368_2kko 1 . 1 . 1113 . 1 1 75 THR OG1 O -28.311 -15.714 11.422 . . . 1.0 . . . . . . . . . . . . A . 75 THR OG1 . . . . . . . . . c16368_2kko 1 . 1 . 1114 . 1 1 76 ARG C C -23.051 -13.616 8.795 . . . 1.0 . . . . . . . . . . . . A . 76 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 1115 . 1 1 76 ARG CA C -23.849 -13.997 10.029 . . . 1.0 . . . . . . . . . . . . A . 76 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 1116 . 1 1 76 ARG CB C -22.999 -14.881 10.936 . . . 1.0 . . . . . . . . . . . . A . 76 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 1117 . 1 1 76 ARG CD C -22.756 -16.067 13.123 . . . 1.0 . . . . . . . . . . . . A . 76 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 1118 . 1 1 76 ARG CG C -23.642 -15.176 12.276 . . . 1.0 . . . . . . . . . . . . A . 76 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 1119 . 1 1 76 ARG CZ C -23.273 -17.566 15.006 . . . 1.0 . . . . . . . . . . . . A . 76 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 1120 . 1 1 76 ARG H H -25.045 -15.605 9.351 . . . 1.0 . . . . . . . . . . . . A . 76 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 1121 . 1 1 76 ARG HA H -24.113 -13.098 10.563 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 1122 . 1 1 76 ARG HB2 H -22.814 -15.819 10.434 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1123 . 1 1 76 ARG HB3 H -22.057 -14.388 11.116 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1124 . 1 1 76 ARG HD2 H -22.575 -16.986 12.586 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1125 . 1 1 76 ARG HD3 H -21.819 -15.559 13.294 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 1126 . 1 1 76 ARG HE H -23.882 -15.661 14.852 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 1127 . 1 1 76 ARG HG2 H -23.804 -14.246 12.800 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1128 . 1 1 76 ARG HG3 H -24.589 -15.671 12.113 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1129 . 1 1 76 ARG HH11 H -22.109 -18.386 13.566 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 1130 . 1 1 76 ARG HH12 H -22.505 -19.445 14.886 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 1131 . 1 1 76 ARG HH21 H -24.411 -17.032 16.602 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 1132 . 1 1 76 ARG HH22 H -23.796 -18.663 16.632 . . . 1.0 . . . . . . . . . . . . A . 76 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 1133 . 1 1 76 ARG N N -25.081 -14.672 9.658 . . . 1.0 . . . . . . . . . . . . A . 76 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 1134 . 1 1 76 ARG NE N -23.367 -16.382 14.409 . . . 1.0 . . . . . . . . . . . . A . 76 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 1135 . 1 1 76 ARG NH1 N -22.571 -18.541 14.441 . . . 1.0 . . . . . . . . . . . . A . 76 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 1136 . 1 1 76 ARG NH2 N -23.875 -17.771 16.169 . . . 1.0 . . . . . . . . . . . . A . 76 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 1137 . 1 1 76 ARG O O -23.022 -14.351 7.801 . . . 1.0 . . . . . . . . . . . . A . 76 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 1138 . 1 1 77 GLN C C -20.106 -12.235 8.116 . . . 1.0 . . . . . . . . . . . . A . 77 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 1139 . 1 1 77 GLN CA C -21.570 -11.997 7.773 . . . 1.0 . . . . . . . . . . . . A . 77 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 1140 . 1 1 77 GLN CB C -21.824 -10.512 7.498 . . . 1.0 . . . . . . . . . . . . A . 77 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 1141 . 1 1 77 GLN CD C -21.316 -8.492 6.057 . . . 1.0 . . . . . . . . . . . . A . 77 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 1142 . 1 1 77 GLN CG C -21.022 -9.957 6.332 . . . 1.0 . . . . . . . . . . . . A . 77 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 1143 . 1 1 77 GLN H H -22.504 -11.910 9.667 . . . 1.0 . . . . . . . . . . . . A . 77 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 1144 . 1 1 77 GLN HA H -21.817 -12.568 6.890 . . . 1.0 . . . . . . . . . . . . A . 77 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 1145 . 1 1 77 GLN HB2 H -22.873 -10.373 7.283 . . . 1.0 . . . . . . . . . . . . A . 77 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1146 . 1 1 77 GLN HB3 H -21.569 -9.947 8.382 . . . 1.0 . . . . . . . . . . . . A . 77 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1147 . 1 1 77 GLN HE21 H -21.678 -8.163 7.984 . . . 1.0 . . . . . . . . . . . . A . 77 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 1148 . 1 1 77 GLN HE22 H -21.829 -6.792 6.946 . . . 1.0 . . . . . . . . . . . . A . 77 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 1149 . 1 1 77 GLN HG2 H -19.971 -10.061 6.554 . . . 1.0 . . . . . . . . . . . . A . 77 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1150 . 1 1 77 GLN HG3 H -21.259 -10.528 5.447 . . . 1.0 . . . . . . . . . . . . A . 77 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1151 . 1 1 77 GLN N N -22.411 -12.464 8.859 . . . 1.0 . . . . . . . . . . . . A . 77 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 1152 . 1 1 77 GLN NE2 N -21.639 -7.742 7.099 . . . 1.0 . . . . . . . . . . . . A . 77 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1153 . 1 1 77 GLN O O -19.537 -11.555 8.971 . . . 1.0 . . . . . . . . . . . . A . 77 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 1154 . 1 1 77 GLN OE1 O -21.242 -8.037 4.916 . . . 1.0 . . . . . . . . . . . . A . 77 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 1155 . 1 1 78 TYR C C -17.244 -12.822 6.689 . . . 1.0 . . . . . . . . . . . . A . 78 TYR C . . . . . . . . . c16368_2kko 1 . 1 . 1156 . 1 1 78 TYR CA C -18.116 -13.548 7.697 . . . 1.0 . . . . . . . . . . . . A . 78 TYR CA . . . . . . . . . c16368_2kko 1 . 1 . 1157 . 1 1 78 TYR CB C -17.884 -15.057 7.587 . . . 1.0 . . . . . . . . . . . . A . 78 TYR CB . . . . . . . . . c16368_2kko 1 . 1 . 1158 . 1 1 78 TYR CD1 C -19.952 -16.184 8.511 . . . 1.0 . . . . . . . . . . . . A . 78 TYR CD1 . . . . . . . . . c16368_2kko 1 . 1 . 1159 . 1 1 78 TYR CD2 C -17.930 -16.346 9.762 . . . 1.0 . . . . . . . . . . . . A . 78 TYR CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1160 . 1 1 78 TYR CE1 C -20.608 -16.935 9.467 . . . 1.0 . . . . . . . . . . . . A . 78 TYR CE1 . . . . . . . . . c16368_2kko 1 . 1 . 1161 . 1 1 78 TYR CE2 C -18.581 -17.102 10.721 . . . 1.0 . . . . . . . . . . . . A . 78 TYR CE2 . . . . . . . . . c16368_2kko 1 . 1 . 1162 . 1 1 78 TYR CG C -18.604 -15.875 8.642 . . . 1.0 . . . . . . . . . . . . A . 78 TYR CG . . . . . . . . . c16368_2kko 1 . 1 . 1163 . 1 1 78 TYR CZ C -19.921 -17.392 10.567 . . . 1.0 . . . . . . . . . . . . A . 78 TYR CZ . . . . . . . . . c16368_2kko 1 . 1 . 1164 . 1 1 78 TYR H H -20.023 -13.744 6.811 . . . 1.0 . . . . . . . . . . . . A . 78 TYR H . . . . . . . . . c16368_2kko 1 . 1 . 1165 . 1 1 78 TYR HA H -17.853 -13.220 8.691 . . . 1.0 . . . . . . . . . . . . A . 78 TYR HA . . . . . . . . . c16368_2kko 1 . 1 . 1166 . 1 1 78 TYR HB2 H -18.224 -15.395 6.620 . . . 1.0 . . . . . . . . . . . . A . 78 TYR HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1167 . 1 1 78 TYR HB3 H -16.827 -15.256 7.679 . . . 1.0 . . . . . . . . . . . . A . 78 TYR HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1168 . 1 1 78 TYR HD1 H -20.491 -15.827 7.646 . . . 1.0 . . . . . . . . . . . . A . 78 TYR HD1 . . . . . . . . . c16368_2kko 1 . 1 . 1169 . 1 1 78 TYR HD2 H -16.882 -16.117 9.878 . . . 1.0 . . . . . . . . . . . . A . 78 TYR HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1170 . 1 1 78 TYR HE1 H -21.657 -17.161 9.348 . . . 1.0 . . . . . . . . . . . . A . 78 TYR HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1171 . 1 1 78 TYR HE2 H -18.040 -17.459 11.585 . . . 1.0 . . . . . . . . . . . . A . 78 TYR HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1172 . 1 1 78 TYR HH H -21.074 -18.852 11.070 . . . 1.0 . . . . . . . . . . . . A . 78 TYR HH . . . . . . . . . c16368_2kko 1 . 1 . 1173 . 1 1 78 TYR N N -19.512 -13.223 7.469 . . . 1.0 . . . . . . . . . . . . A . 78 TYR N . . . . . . . . . c16368_2kko 1 . 1 . 1174 . 1 1 78 TYR O O -17.520 -12.848 5.488 . . . 1.0 . . . . . . . . . . . . A . 78 TYR O . . . . . . . . . c16368_2kko 1 . 1 . 1175 . 1 1 78 TYR OH O -20.576 -18.151 11.513 . . . 1.0 . . . . . . . . . . . . A . 78 TYR OH . . . . . . . . . c16368_2kko 1 . 1 . 1176 . 1 1 79 TYR C C -14.025 -12.275 6.087 . . . 1.0 . . . . . . . . . . . . A . 79 TYR C . . . . . . . . . c16368_2kko 1 . 1 . 1177 . 1 1 79 TYR CA C -15.288 -11.463 6.305 . . . 1.0 . . . . . . . . . . . . A . 79 TYR CA . . . . . . . . . c16368_2kko 1 . 1 . 1178 . 1 1 79 TYR CB C -14.944 -10.084 6.868 . . . 1.0 . . . . . . . . . . . . A . 79 TYR CB . . . . . . . . . c16368_2kko 1 . 1 . 1179 . 1 1 79 TYR CD1 C -17.072 -8.771 7.213 . . . 1.0 . . . . . . . . . . . . A . 79 TYR CD1 . . . . . . . . . c16368_2kko 1 . 1 . 1180 . 1 1 79 TYR CD2 C -15.701 -8.229 5.342 . . . 1.0 . . . . . . . . . . . . A . 79 TYR CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1181 . 1 1 79 TYR CE1 C -17.966 -7.785 6.846 . . . 1.0 . . . . . . . . . . . . A . 79 TYR CE1 . . . . . . . . . c16368_2kko 1 . 1 . 1182 . 1 1 79 TYR CE2 C -16.590 -7.241 4.969 . . . 1.0 . . . . . . . . . . . . A . 79 TYR CE2 . . . . . . . . . c16368_2kko 1 . 1 . 1183 . 1 1 79 TYR CG C -15.925 -9.008 6.470 . . . 1.0 . . . . . . . . . . . . A . 79 TYR CG . . . . . . . . . c16368_2kko 1 . 1 . 1184 . 1 1 79 TYR CZ C -17.722 -7.025 5.724 . . . 1.0 . . . . . . . . . . . . A . 79 TYR CZ . . . . . . . . . c16368_2kko 1 . 1 . 1185 . 1 1 79 TYR H H -16.038 -12.182 8.142 . . . 1.0 . . . . . . . . . . . . A . 79 TYR H . . . . . . . . . c16368_2kko 1 . 1 . 1186 . 1 1 79 TYR HA H -15.777 -11.335 5.350 . . . 1.0 . . . . . . . . . . . . A . 79 TYR HA . . . . . . . . . c16368_2kko 1 . 1 . 1187 . 1 1 79 TYR HB2 H -14.931 -10.135 7.946 . . . 1.0 . . . . . . . . . . . . A . 79 TYR HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1188 . 1 1 79 TYR HB3 H -13.968 -9.791 6.512 . . . 1.0 . . . . . . . . . . . . A . 79 TYR HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1189 . 1 1 79 TYR HD1 H -17.262 -9.370 8.092 . . . 1.0 . . . . . . . . . . . . A . 79 TYR HD1 . . . . . . . . . c16368_2kko 1 . 1 . 1190 . 1 1 79 TYR HD2 H -14.814 -8.403 4.752 . . . 1.0 . . . . . . . . . . . . A . 79 TYR HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1191 . 1 1 79 TYR HE1 H -18.854 -7.614 7.438 . . . 1.0 . . . . . . . . . . . . A . 79 TYR HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1192 . 1 1 79 TYR HE2 H -16.398 -6.645 4.090 . . . 1.0 . . . . . . . . . . . . A . 79 TYR HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1193 . 1 1 79 TYR HH H -18.860 -6.164 4.437 . . . 1.0 . . . . . . . . . . . . A . 79 TYR HH . . . . . . . . . c16368_2kko 1 . 1 . 1194 . 1 1 79 TYR N N -16.206 -12.171 7.173 . . . 1.0 . . . . . . . . . . . . A . 79 TYR N . . . . . . . . . c16368_2kko 1 . 1 . 1195 . 1 1 79 TYR O O -13.512 -12.921 7.006 . . . 1.0 . . . . . . . . . . . . A . 79 TYR O . . . . . . . . . c16368_2kko 1 . 1 . 1196 . 1 1 79 TYR OH O -18.611 -6.043 5.356 . . . 1.0 . . . . . . . . . . . . A . 79 TYR OH . . . . . . . . . c16368_2kko 1 . 1 . 1197 . 1 1 80 ARG C C -11.582 -12.078 3.495 . . . 1.0 . . . . . . . . . . . . A . 80 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 1198 . 1 1 80 ARG CA C -12.340 -12.949 4.477 . . . 1.0 . . . . . . . . . . . . A . 80 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 1199 . 1 1 80 ARG CB C -12.691 -14.293 3.824 . . . 1.0 . . . . . . . . . . . . A . 80 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 1200 . 1 1 80 ARG CD C -11.893 -16.457 2.838 . . . 1.0 . . . . . . . . . . . . A . 80 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 1201 . 1 1 80 ARG CG C -11.516 -15.249 3.681 . . . 1.0 . . . . . . . . . . . . A . 80 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 1202 . 1 1 80 ARG CZ C -10.163 -18.040 2.047 . . . 1.0 . . . . . . . . . . . . A . 80 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 1203 . 1 1 80 ARG H H -14.029 -11.726 4.175 . . . 1.0 . . . . . . . . . . . . A . 80 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 1204 . 1 1 80 ARG HA H -11.739 -13.114 5.358 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 1205 . 1 1 80 ARG HB2 H -13.447 -14.781 4.421 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1206 . 1 1 80 ARG HB3 H -13.093 -14.104 2.839 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1207 . 1 1 80 ARG HD2 H -12.879 -16.786 3.127 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1208 . 1 1 80 ARG HD3 H -11.903 -16.165 1.798 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 1209 . 1 1 80 ARG HE H -10.942 -18.003 3.893 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 1210 . 1 1 80 ARG HG2 H -10.696 -14.732 3.205 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1211 . 1 1 80 ARG HG3 H -11.215 -15.584 4.663 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1212 . 1 1 80 ARG HH11 H -10.725 -16.670 0.657 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 1213 . 1 1 80 ARG HH12 H -9.540 -17.827 0.125 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 1214 . 1 1 80 ARG HH21 H -9.375 -19.519 3.191 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 1215 . 1 1 80 ARG HH22 H -8.786 -19.447 1.564 . . . 1.0 . . . . . . . . . . . . A . 80 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 1216 . 1 1 80 ARG N N -13.549 -12.249 4.859 . . . 1.0 . . . . . . . . . . . . A . 80 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 1217 . 1 1 80 ARG NE N -10.958 -17.568 3.010 . . . 1.0 . . . . . . . . . . . . A . 80 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 1218 . 1 1 80 ARG NH1 N -10.143 -17.467 0.849 . . . 1.0 . . . . . . . . . . . . A . 80 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 1219 . 1 1 80 ARG NH2 N -9.378 -19.084 2.288 . . . 1.0 . . . . . . . . . . . . A . 80 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 1220 . 1 1 80 ARG O O -12.190 -11.258 2.809 . . . 1.0 . . . . . . . . . . . . A . 80 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 1221 . 1 1 81 ILE C C -9.973 -11.879 1.051 . . . 1.0 . . . . . . . . . . . . A . 81 ILE C . . . . . . . . . c16368_2kko 1 . 1 . 1222 . 1 1 81 ILE CA C -9.482 -11.505 2.451 . . . 1.0 . . . . . . . . . . . . A . 81 ILE CA . . . . . . . . . c16368_2kko 1 . 1 . 1223 . 1 1 81 ILE CB C -7.976 -11.819 2.597 . . . 1.0 . . . . . . . . . . . . A . 81 ILE CB . . . . . . . . . c16368_2kko 1 . 1 . 1224 . 1 1 81 ILE CD1 C -6.070 -11.848 4.301 . . . 1.0 . . . . . . . . . . . . A . 81 ILE CD1 . . . . . . . . . c16368_2kko 1 . 1 . 1225 . 1 1 81 ILE CG1 C -7.521 -11.516 4.030 . . . 1.0 . . . . . . . . . . . . A . 81 ILE CG1 . . . . . . . . . c16368_2kko 1 . 1 . 1226 . 1 1 81 ILE CG2 C -7.164 -11.008 1.594 . . . 1.0 . . . . . . . . . . . . A . 81 ILE CG2 . . . . . . . . . c16368_2kko 1 . 1 . 1227 . 1 1 81 ILE H H -9.823 -12.822 4.072 . . . 1.0 . . . . . . . . . . . . A . 81 ILE H . . . . . . . . . c16368_2kko 1 . 1 . 1228 . 1 1 81 ILE HA H -9.633 -10.446 2.608 . . . 1.0 . . . . . . . . . . . . A . 81 ILE HA . . . . . . . . . c16368_2kko 1 . 1 . 1229 . 1 1 81 ILE HB H -7.824 -12.868 2.390 . . . 1.0 . . . . . . . . . . . . A . 81 ILE HB . . . . . . . . . c16368_2kko 1 . 1 . 1230 . 1 1 81 ILE HD11 H -5.905 -12.903 4.142 . . . 1.0 . . . . . . . . . . . . A . 81 ILE HD11 . . . . . . . . . c16368_2kko 1 . 1 . 1231 . 1 1 81 ILE HD12 H -5.829 -11.596 5.323 . . . 1.0 . . . . . . . . . . . . A . 81 ILE HD12 . . . . . . . . . c16368_2kko 1 . 1 . 1232 . 1 1 81 ILE HD13 H -5.440 -11.280 3.633 . . . 1.0 . . . . . . . . . . . . A . 81 ILE HD13 . . . . . . . . . c16368_2kko 1 . 1 . 1233 . 1 1 81 ILE HG12 H -7.660 -10.465 4.228 . . . 1.0 . . . . . . . . . . . . A . 81 ILE HG12 . . . . . . . . . c16368_2kko 1 . 1 . 1234 . 1 1 81 ILE HG13 H -8.126 -12.089 4.718 . . . 1.0 . . . . . . . . . . . . A . 81 ILE HG13 . . . . . . . . . c16368_2kko 1 . 1 . 1235 . 1 1 81 ILE HG21 H -6.115 -11.241 1.706 . . . 1.0 . . . . . . . . . . . . A . 81 ILE HG21 . . . . . . . . . c16368_2kko 1 . 1 . 1236 . 1 1 81 ILE HG22 H -7.320 -9.956 1.773 . . . 1.0 . . . . . . . . . . . . A . 81 ILE HG22 . . . . . . . . . c16368_2kko 1 . 1 . 1237 . 1 1 81 ILE HG23 H -7.482 -11.254 0.592 . . . 1.0 . . . . . . . . . . . . A . 81 ILE HG23 . . . . . . . . . c16368_2kko 1 . 1 . 1238 . 1 1 81 ILE N N -10.270 -12.224 3.439 . . . 1.0 . . . . . . . . . . . . A . 81 ILE N . . . . . . . . . c16368_2kko 1 . 1 . 1239 . 1 1 81 ILE O O -10.217 -13.057 0.779 . . . 1.0 . . . . . . . . . . . . A . 81 ILE O . . . . . . . . . c16368_2kko 1 . 1 . 1240 . 1 1 82 ALA C C -10.070 -12.220 -1.891 . . . 1.0 . . . . . . . . . . . . A . 82 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1241 . 1 1 82 ALA CA C -10.736 -11.070 -1.140 . . . 1.0 . . . . . . . . . . . . A . 82 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 1242 . 1 1 82 ALA CB C -10.641 -9.789 -1.953 . . . 1.0 . . . . . . . . . . . . A . 82 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 1243 . 1 1 82 ALA H H -9.861 -9.969 0.451 . . . 1.0 . . . . . . . . . . . . A . 82 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 1244 . 1 1 82 ALA HA H -11.783 -11.303 -1.004 . . . 1.0 . . . . . . . . . . . . A . 82 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 1245 . 1 1 82 ALA HB1 H -9.602 -9.540 -2.110 . . . 1.0 . . . . . . . . . . . . A . 82 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 1246 . 1 1 82 ALA HB2 H -11.126 -8.985 -1.420 . . . 1.0 . . . . . . . . . . . . A . 82 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1247 . 1 1 82 ALA HB3 H -11.125 -9.931 -2.908 . . . 1.0 . . . . . . . . . . . . A . 82 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1248 . 1 1 82 ALA N N -10.145 -10.875 0.188 . . . 1.0 . . . . . . . . . . . . A . 82 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 1249 . 1 1 82 ALA O O -10.744 -13.061 -2.487 . . . 1.0 . . . . . . . . . . . . A . 82 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 1250 . 1 1 83 GLY C C -6.610 -13.405 -1.875 . . . 1.0 . . . . . . . . . . . . A . 83 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 1251 . 1 1 83 GLY CA C -7.997 -13.319 -2.461 . . . 1.0 . . . . . . . . . . . . A . 83 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 1252 . 1 1 83 GLY H H -8.272 -11.533 -1.376 . . . 1.0 . . . . . . . . . . . . A . 83 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 1253 . 1 1 83 GLY HA2 H -8.513 -14.256 -2.297 . . . 1.0 . . . . . . . . . . . . A . 83 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 1254 . 1 1 83 GLY HA3 H -7.920 -13.136 -3.522 . . . 1.0 . . . . . . . . . . . . A . 83 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 1255 . 1 1 83 GLY N N -8.749 -12.249 -1.845 . . . 1.0 . . . . . . . . . . . . A . 83 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 1256 . 1 1 83 GLY O O -6.202 -12.514 -1.126 . . . 1.0 . . . . . . . . . . . . A . 83 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 1257 . 1 1 84 GLU C C -3.610 -13.518 -2.222 . . . 1.0 . . . . . . . . . . . . A . 84 GLU C . . . . . . . . . c16368_2kko 1 . 1 . 1258 . 1 1 84 GLU CA C -4.517 -14.625 -1.699 . . . 1.0 . . . . . . . . . . . . A . 84 GLU CA . . . . . . . . . c16368_2kko 1 . 1 . 1259 . 1 1 84 GLU CB C -3.959 -15.990 -2.090 . . . 1.0 . . . . . . . . . . . . A . 84 GLU CB . . . . . . . . . c16368_2kko 1 . 1 . 1260 . 1 1 84 GLU CD C -3.315 -17.566 -3.942 . . . 1.0 . . . . . . . . . . . . A . 84 GLU CD . . . . . . . . . c16368_2kko 1 . 1 . 1261 . 1 1 84 GLU CG C -3.806 -16.181 -3.588 . . . 1.0 . . . . . . . . . . . . A . 84 GLU CG . . . . . . . . . c16368_2kko 1 . 1 . 1262 . 1 1 84 GLU H H -6.251 -15.137 -2.810 . . . 1.0 . . . . . . . . . . . . A . 84 GLU H . . . . . . . . . c16368_2kko 1 . 1 . 1263 . 1 1 84 GLU HA H -4.560 -14.558 -0.621 . . . 1.0 . . . . . . . . . . . . A . 84 GLU HA . . . . . . . . . c16368_2kko 1 . 1 . 1264 . 1 1 84 GLU HB2 H -2.989 -16.115 -1.630 . . . 1.0 . . . . . . . . . . . . A . 84 GLU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1265 . 1 1 84 GLU HB3 H -4.624 -16.755 -1.718 . . . 1.0 . . . . . . . . . . . . A . 84 GLU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1266 . 1 1 84 GLU HG2 H -4.765 -16.024 -4.060 . . . 1.0 . . . . . . . . . . . . A . 84 GLU HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1267 . 1 1 84 GLU HG3 H -3.097 -15.456 -3.961 . . . 1.0 . . . . . . . . . . . . A . 84 GLU HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1268 . 1 1 84 GLU N N -5.874 -14.457 -2.210 . . . 1.0 . . . . . . . . . . . . A . 84 GLU N . . . . . . . . . c16368_2kko 1 . 1 . 1269 . 1 1 84 GLU O O -2.548 -13.255 -1.664 . . . 1.0 . . . . . . . . . . . . A . 84 GLU O . . . . . . . . . c16368_2kko 1 . 1 . 1270 . 1 1 84 GLU OE1 O -4.162 -18.474 -4.093 . . . 1.0 . . . . . . . . . . . . A . 84 GLU OE1 . . . . . . . . . c16368_2kko 1 . 1 . 1271 . 1 1 84 GLU OE2 O -2.087 -17.755 -4.065 . . . 1.0 . . . . . . . . . . . . A . 84 GLU OE2 . . . . . . . . . c16368_2kko 1 . 1 . 1272 . 1 1 85 ASP C C -3.074 -10.685 -2.830 . . . 1.0 . . . . . . . . . . . . A . 85 ASP C . . . . . . . . . c16368_2kko 1 . 1 . 1273 . 1 1 85 ASP CA C -3.341 -11.749 -3.888 . . . 1.0 . . . . . . . . . . . . A . 85 ASP CA . . . . . . . . . c16368_2kko 1 . 1 . 1274 . 1 1 85 ASP CB C -4.175 -11.136 -5.021 . . . 1.0 . . . . . . . . . . . . A . 85 ASP CB . . . . . . . . . c16368_2kko 1 . 1 . 1275 . 1 1 85 ASP CG C -4.813 -12.179 -5.921 . . . 1.0 . . . . . . . . . . . . A . 85 ASP CG . . . . . . . . . c16368_2kko 1 . 1 . 1276 . 1 1 85 ASP H H -4.889 -13.174 -3.712 . . . 1.0 . . . . . . . . . . . . A . 85 ASP H . . . . . . . . . c16368_2kko 1 . 1 . 1277 . 1 1 85 ASP HA H -2.402 -12.106 -4.285 . . . 1.0 . . . . . . . . . . . . A . 85 ASP HA . . . . . . . . . c16368_2kko 1 . 1 . 1278 . 1 1 85 ASP HB2 H -4.961 -10.530 -4.594 . . . 1.0 . . . . . . . . . . . . A . 85 ASP HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1279 . 1 1 85 ASP HB3 H -3.535 -10.509 -5.626 . . . 1.0 . . . . . . . . . . . . A . 85 ASP HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1280 . 1 1 85 ASP N N -4.052 -12.874 -3.295 . . . 1.0 . . . . . . . . . . . . A . 85 ASP N . . . . . . . . . c16368_2kko 1 . 1 . 1281 . 1 1 85 ASP O O -1.930 -10.296 -2.590 . . . 1.0 . . . . . . . . . . . . A . 85 ASP O . . . . . . . . . c16368_2kko 1 . 1 . 1282 . 1 1 85 ASP OD1 O -5.796 -12.821 -5.487 . . . 1.0 . . . . . . . . . . . . A . 85 ASP OD1 . . . . . . . . . c16368_2kko 1 . 1 . 1283 . 1 1 85 ASP OD2 O -4.351 -12.355 -7.066 . . . 1.0 . . . . . . . . . . . . A . 85 ASP OD2 . . . . . . . . . c16368_2kko 1 . 1 . 1284 . 1 1 86 VAL C C -3.441 -9.802 0.124 . . . 1.0 . . . . . . . . . . . . A . 86 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 1285 . 1 1 86 VAL CA C -4.064 -9.225 -1.143 . . . 1.0 . . . . . . . . . . . . A . 86 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 1286 . 1 1 86 VAL CB C -5.456 -8.648 -0.814 . . . 1.0 . . . . . . . . . . . . A . 86 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 1287 . 1 1 86 VAL CG1 C -5.350 -7.524 0.205 . . . 1.0 . . . . . . . . . . . . A . 86 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 1288 . 1 1 86 VAL CG2 C -6.144 -8.161 -2.080 . . . 1.0 . . . . . . . . . . . . A . 86 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 1289 . 1 1 86 VAL H H -5.023 -10.618 -2.412 . . . 1.0 . . . . . . . . . . . . A . 86 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 1290 . 1 1 86 VAL HA H -3.441 -8.420 -1.508 . . . 1.0 . . . . . . . . . . . . A . 86 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 1291 . 1 1 86 VAL HB H -6.058 -9.437 -0.385 . . . 1.0 . . . . . . . . . . . . A . 86 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 1292 . 1 1 86 VAL HG11 H -4.711 -6.745 -0.184 . . . 1.0 . . . . . . . . . . . . A . 86 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 1293 . 1 1 86 VAL HG12 H -4.930 -7.909 1.123 . . . 1.0 . . . . . . . . . . . . A . 86 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 1294 . 1 1 86 VAL HG13 H -6.332 -7.121 0.400 . . . 1.0 . . . . . . . . . . . . A . 86 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 1295 . 1 1 86 VAL HG21 H -5.537 -7.400 -2.549 . . . 1.0 . . . . . . . . . . . . A . 86 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 1296 . 1 1 86 VAL HG22 H -7.109 -7.747 -1.830 . . . 1.0 . . . . . . . . . . . . A . 86 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 1297 . 1 1 86 VAL HG23 H -6.273 -8.989 -2.762 . . . 1.0 . . . . . . . . . . . . A . 86 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 1298 . 1 1 86 VAL N N -4.147 -10.243 -2.183 . . . 1.0 . . . . . . . . . . . . A . 86 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 1299 . 1 1 86 VAL O O -2.678 -9.127 0.815 . . . 1.0 . . . . . . . . . . . . A . 86 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 1300 . 1 1 87 ALA C C -1.718 -11.814 1.581 . . . 1.0 . . . . . . . . . . . . A . 87 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1301 . 1 1 87 ALA CA C -3.243 -11.733 1.601 . . . 1.0 . . . . . . . . . . . . A . 87 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 1302 . 1 1 87 ALA CB C -3.845 -13.125 1.720 . . . 1.0 . . . . . . . . . . . . A . 87 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 1303 . 1 1 87 ALA H H -4.345 -11.556 -0.201 . . . 1.0 . . . . . . . . . . . . A . 87 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 1304 . 1 1 87 ALA HA H -3.554 -11.159 2.463 . . . 1.0 . . . . . . . . . . . . A . 87 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 1305 . 1 1 87 ALA HB1 H -3.485 -13.743 0.912 . . . 1.0 . . . . . . . . . . . . A . 87 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 1306 . 1 1 87 ALA HB2 H -4.922 -13.058 1.669 . . . 1.0 . . . . . . . . . . . . A . 87 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1307 . 1 1 87 ALA HB3 H -3.555 -13.562 2.664 . . . 1.0 . . . . . . . . . . . . A . 87 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1308 . 1 1 87 ALA N N -3.753 -11.063 0.408 . . . 1.0 . . . . . . . . . . . . A . 87 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 1309 . 1 1 87 ALA O O -1.053 -11.450 2.551 . . . 1.0 . . . . . . . . . . . . A . 87 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 1310 . 1 1 88 ARG C C 0.927 -11.032 0.245 . . . 1.0 . . . . . . . . . . . . A . 88 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 1311 . 1 1 88 ARG CA C 0.273 -12.407 0.312 . . . 1.0 . . . . . . . . . . . . A . 88 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 1312 . 1 1 88 ARG CB C 0.602 -13.228 -0.939 . . . 1.0 . . . . . . . . . . . . A . 88 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 1313 . 1 1 88 ARG CD C 0.203 -15.376 -2.200 . . . 1.0 . . . . . . . . . . . . A . 88 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 1314 . 1 1 88 ARG CG C 0.072 -14.652 -0.869 . . . 1.0 . . . . . . . . . . . . A . 88 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 1315 . 1 1 88 ARG CZ C 2.087 -16.761 -2.982 . . . 1.0 . . . . . . . . . . . . A . 88 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 1316 . 1 1 88 ARG H H -1.755 -12.537 -0.284 . . . 1.0 . . . . . . . . . . . . A . 88 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 1317 . 1 1 88 ARG HA H 0.649 -12.926 1.182 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 1318 . 1 1 88 ARG HB2 H 0.167 -12.745 -1.802 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1319 . 1 1 88 ARG HB3 H 1.674 -13.271 -1.061 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1320 . 1 1 88 ARG HD2 H -0.287 -16.336 -2.123 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1321 . 1 1 88 ARG HD3 H -0.285 -14.787 -2.963 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 1322 . 1 1 88 ARG HE H 2.202 -14.809 -2.545 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 1323 . 1 1 88 ARG HG2 H 0.632 -15.197 -0.123 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1324 . 1 1 88 ARG HG3 H -0.970 -14.621 -0.588 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1325 . 1 1 88 ARG HH11 H 0.320 -17.748 -2.837 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 1326 . 1 1 88 ARG HH12 H 1.662 -18.711 -3.373 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 1327 . 1 1 88 ARG HH21 H 3.965 -16.054 -3.250 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 1328 . 1 1 88 ARG HH22 H 3.755 -17.745 -3.601 . . . 1.0 . . . . . . . . . . . . A . 88 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 1329 . 1 1 88 ARG N N -1.170 -12.276 0.463 . . . 1.0 . . . . . . . . . . . . A . 88 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 1330 . 1 1 88 ARG NE N 1.596 -15.588 -2.583 . . . 1.0 . . . . . . . . . . . . A . 88 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 1331 . 1 1 88 ARG NH1 N 1.293 -17.824 -3.070 . . . 1.0 . . . . . . . . . . . . A . 88 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 1332 . 1 1 88 ARG NH2 N 3.371 -16.861 -3.305 . . . 1.0 . . . . . . . . . . . . A . 88 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 1333 . 1 1 88 ARG O O 2.072 -10.861 0.658 . . . 1.0 . . . . . . . . . . . . A . 88 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 1334 . 1 1 89 LEU C C 0.799 -8.124 1.111 . . . 1.0 . . . . . . . . . . . . A . 89 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 1335 . 1 1 89 LEU CA C 0.664 -8.677 -0.310 . . . 1.0 . . . . . . . . . . . . A . 89 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 1336 . 1 1 89 LEU CB C -0.298 -7.821 -1.152 . . . 1.0 . . . . . . . . . . . . A . 89 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 1337 . 1 1 89 LEU CD1 C -0.549 -5.940 -2.784 . . . 1.0 . . . . . . . . . . . . A . 89 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 1338 . 1 1 89 LEU CD2 C 0.028 -5.431 -0.417 . . . 1.0 . . . . . . . . . . . . A . 89 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1339 . 1 1 89 LEU CG C 0.203 -6.428 -1.555 . . . 1.0 . . . . . . . . . . . . A . 89 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 1340 . 1 1 89 LEU H H -0.699 -10.265 -0.633 . . . 1.0 . . . . . . . . . . . . A . 89 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 1341 . 1 1 89 LEU HA H 1.639 -8.677 -0.777 . . . 1.0 . . . . . . . . . . . . A . 89 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 1342 . 1 1 89 LEU HB2 H -0.525 -8.368 -2.055 . . . 1.0 . . . . . . . . . . . . A . 89 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1343 . 1 1 89 LEU HB3 H -1.214 -7.697 -0.592 . . . 1.0 . . . . . . . . . . . . A . 89 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1344 . 1 1 89 LEU HD11 H -0.175 -4.969 -3.072 . . . 1.0 . . . . . . . . . . . . A . 89 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 1345 . 1 1 89 LEU HD12 H -1.602 -5.867 -2.556 . . . 1.0 . . . . . . . . . . . . A . 89 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 1346 . 1 1 89 LEU HD13 H -0.403 -6.637 -3.596 . . . 1.0 . . . . . . . . . . . . A . 89 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 1347 . 1 1 89 LEU HD21 H 0.608 -5.753 0.435 . . . 1.0 . . . . . . . . . . . . A . 89 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 1348 . 1 1 89 LEU HD22 H -1.015 -5.378 -0.142 . . . 1.0 . . . . . . . . . . . . A . 89 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 1349 . 1 1 89 LEU HD23 H 0.366 -4.456 -0.736 . . . 1.0 . . . . . . . . . . . . A . 89 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 1350 . 1 1 89 LEU HG H 1.254 -6.483 -1.803 . . . 1.0 . . . . . . . . . . . . A . 89 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 1351 . 1 1 89 LEU N N 0.187 -10.054 -0.265 . . . 1.0 . . . . . . . . . . . . A . 89 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 1352 . 1 1 89 LEU O O 1.804 -7.497 1.450 . . . 1.0 . . . . . . . . . . . . A . 89 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 1353 . 1 1 90 PHE C C 0.918 -8.654 4.108 . . . 1.0 . . . . . . . . . . . . A . 90 PHE C . . . . . . . . . c16368_2kko 1 . 1 . 1354 . 1 1 90 PHE CA C -0.184 -7.933 3.333 . . . 1.0 . . . . . . . . . . . . A . 90 PHE CA . . . . . . . . . c16368_2kko 1 . 1 . 1355 . 1 1 90 PHE CB C -1.545 -8.160 4.000 . . . 1.0 . . . . . . . . . . . . A . 90 PHE CB . . . . . . . . . c16368_2kko 1 . 1 . 1356 . 1 1 90 PHE CD1 C -1.564 -6.346 5.739 . . . 1.0 . . . . . . . . . . . . A . 90 PHE CD1 . . . . . . . . . c16368_2kko 1 . 1 . 1357 . 1 1 90 PHE CD2 C -1.673 -8.613 6.470 . . . 1.0 . . . . . . . . . . . . A . 90 PHE CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1358 . 1 1 90 PHE CE1 C -1.608 -5.917 7.052 . . . 1.0 . . . . . . . . . . . . A . 90 PHE CE1 . . . . . . . . . c16368_2kko 1 . 1 . 1359 . 1 1 90 PHE CE2 C -1.716 -8.190 7.786 . . . 1.0 . . . . . . . . . . . . A . 90 PHE CE2 . . . . . . . . . c16368_2kko 1 . 1 . 1360 . 1 1 90 PHE CG C -1.598 -7.697 5.432 . . . 1.0 . . . . . . . . . . . . A . 90 PHE CG . . . . . . . . . c16368_2kko 1 . 1 . 1361 . 1 1 90 PHE CZ C -1.683 -6.841 8.077 . . . 1.0 . . . . . . . . . . . . A . 90 PHE CZ . . . . . . . . . c16368_2kko 1 . 1 . 1362 . 1 1 90 PHE H H -0.991 -8.875 1.612 . . . 1.0 . . . . . . . . . . . . A . 90 PHE H . . . . . . . . . c16368_2kko 1 . 1 . 1363 . 1 1 90 PHE HA H 0.031 -6.874 3.333 . . . 1.0 . . . . . . . . . . . . A . 90 PHE HA . . . . . . . . . c16368_2kko 1 . 1 . 1364 . 1 1 90 PHE HB2 H -2.303 -7.624 3.449 . . . 1.0 . . . . . . . . . . . . A . 90 PHE HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1365 . 1 1 90 PHE HB3 H -1.774 -9.216 3.983 . . . 1.0 . . . . . . . . . . . . A . 90 PHE HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1366 . 1 1 90 PHE HD1 H -1.505 -5.623 4.939 . . . 1.0 . . . . . . . . . . . . A . 90 PHE HD1 . . . . . . . . . c16368_2kko 1 . 1 . 1367 . 1 1 90 PHE HD2 H -1.698 -9.668 6.244 . . . 1.0 . . . . . . . . . . . . A . 90 PHE HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1368 . 1 1 90 PHE HE1 H -1.583 -4.861 7.278 . . . 1.0 . . . . . . . . . . . . A . 90 PHE HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1369 . 1 1 90 PHE HE2 H -1.775 -8.915 8.585 . . . 1.0 . . . . . . . . . . . . A . 90 PHE HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1370 . 1 1 90 PHE HZ H -1.716 -6.509 9.102 . . . 1.0 . . . . . . . . . . . . A . 90 PHE HZ . . . . . . . . . c16368_2kko 1 . 1 . 1371 . 1 1 90 PHE N N -0.208 -8.379 1.943 . . . 1.0 . . . . . . . . . . . . A . 90 PHE N . . . . . . . . . c16368_2kko 1 . 1 . 1372 . 1 1 90 PHE O O 1.588 -8.060 4.955 . . . 1.0 . . . . . . . . . . . . A . 90 PHE O . . . . . . . . . c16368_2kko 1 . 1 . 1373 . 1 1 91 ALA C C 3.536 -10.104 3.992 . . . 1.0 . . . . . . . . . . . . A . 91 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1374 . 1 1 91 ALA CA C 2.194 -10.693 4.415 . . . 1.0 . . . . . . . . . . . . A . 91 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 1375 . 1 1 91 ALA CB C 2.102 -12.161 4.016 . . . 1.0 . . . . . . . . . . . . A . 91 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 1376 . 1 1 91 ALA H H 0.489 -10.383 3.195 . . . 1.0 . . . . . . . . . . . . A . 91 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 1377 . 1 1 91 ALA HA H 2.103 -10.626 5.489 . . . 1.0 . . . . . . . . . . . . A . 91 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 1378 . 1 1 91 ALA HB1 H 2.216 -12.253 2.946 . . . 1.0 . . . . . . . . . . . . A . 91 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 1379 . 1 1 91 ALA HB2 H 1.141 -12.556 4.310 . . . 1.0 . . . . . . . . . . . . A . 91 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1380 . 1 1 91 ALA HB3 H 2.885 -12.717 4.510 . . . 1.0 . . . . . . . . . . . . A . 91 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1381 . 1 1 91 ALA N N 1.104 -9.935 3.818 . . . 1.0 . . . . . . . . . . . . A . 91 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 1382 . 1 1 91 ALA O O 4.459 -9.981 4.797 . . . 1.0 . . . . . . . . . . . . A . 91 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 1383 . 1 1 92 LEU C C 5.199 -7.843 2.873 . . . 1.0 . . . . . . . . . . . . A . 92 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 1384 . 1 1 92 LEU CA C 4.829 -9.140 2.156 . . . 1.0 . . . . . . . . . . . . A . 92 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 1385 . 1 1 92 LEU CB C 4.625 -8.895 0.650 . . . 1.0 . . . . . . . . . . . . A . 92 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 1386 . 1 1 92 LEU CD1 C 5.605 -8.814 -1.651 . . . 1.0 . . . . . . . . . . . . A . 92 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 1387 . 1 1 92 LEU CD2 C 6.342 -7.145 0.037 . . . 1.0 . . . . . . . . . . . . A . 92 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1388 . 1 1 92 LEU CG C 5.883 -8.581 -0.175 . . . 1.0 . . . . . . . . . . . . A . 92 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 1389 . 1 1 92 LEU H H 2.830 -9.826 2.146 . . . 1.0 . . . . . . . . . . . . A . 92 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 1390 . 1 1 92 LEU HA H 5.628 -9.854 2.290 . . . 1.0 . . . . . . . . . . . . A . 92 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 1391 . 1 1 92 LEU HB2 H 4.164 -9.776 0.228 . . . 1.0 . . . . . . . . . . . . A . 92 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1392 . 1 1 92 LEU HB3 H 3.938 -8.069 0.539 . . . 1.0 . . . . . . . . . . . . A . 92 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1393 . 1 1 92 LEU HD11 H 6.488 -8.575 -2.227 . . . 1.0 . . . . . . . . . . . . A . 92 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 1394 . 1 1 92 LEU HD12 H 4.787 -8.183 -1.967 . . . 1.0 . . . . . . . . . . . . A . 92 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 1395 . 1 1 92 LEU HD13 H 5.342 -9.849 -1.807 . . . 1.0 . . . . . . . . . . . . A . 92 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 1396 . 1 1 92 LEU HD21 H 6.573 -6.991 1.081 . . . 1.0 . . . . . . . . . . . . A . 92 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 1397 . 1 1 92 LEU HD22 H 5.553 -6.470 -0.260 . . . 1.0 . . . . . . . . . . . . A . 92 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 1398 . 1 1 92 LEU HD23 H 7.222 -6.956 -0.560 . . . 1.0 . . . . . . . . . . . . A . 92 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 1399 . 1 1 92 LEU HG H 6.683 -9.241 0.126 . . . 1.0 . . . . . . . . . . . . A . 92 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 1400 . 1 1 92 LEU N N 3.617 -9.715 2.724 . . . 1.0 . . . . . . . . . . . . A . 92 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 1401 . 1 1 92 LEU O O 6.331 -7.690 3.335 . . . 1.0 . . . . . . . . . . . . A . 92 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 1402 . 1 1 93 VAL C C 4.884 -5.773 5.066 . . . 1.0 . . . . . . . . . . . . A . 93 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 1403 . 1 1 93 VAL CA C 4.506 -5.620 3.595 . . . 1.0 . . . . . . . . . . . . A . 93 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 1404 . 1 1 93 VAL CB C 3.312 -4.642 3.458 . . . 1.0 . . . . . . . . . . . . A . 93 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 1405 . 1 1 93 VAL CG1 C 3.013 -4.360 1.997 . . . 1.0 . . . . . . . . . . . . A . 93 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 1406 . 1 1 93 VAL CG2 C 2.070 -5.172 4.154 . . . 1.0 . . . . . . . . . . . . A . 93 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 1407 . 1 1 93 VAL H H 3.344 -7.114 2.627 . . . 1.0 . . . . . . . . . . . . A . 93 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 1408 . 1 1 93 VAL HA H 5.350 -5.186 3.077 . . . 1.0 . . . . . . . . . . . . A . 93 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 1409 . 1 1 93 VAL HB H 3.587 -3.710 3.927 . . . 1.0 . . . . . . . . . . . . A . 93 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 1410 . 1 1 93 VAL HG11 H 2.173 -3.685 1.926 . . . 1.0 . . . . . . . . . . . . A . 93 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 1411 . 1 1 93 VAL HG12 H 2.774 -5.286 1.496 . . . 1.0 . . . . . . . . . . . . A . 93 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 1412 . 1 1 93 VAL HG13 H 3.879 -3.910 1.532 . . . 1.0 . . . . . . . . . . . . A . 93 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 1413 . 1 1 93 VAL HG21 H 2.274 -5.301 5.207 . . . 1.0 . . . . . . . . . . . . A . 93 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 1414 . 1 1 93 VAL HG22 H 1.794 -6.121 3.721 . . . 1.0 . . . . . . . . . . . . A . 93 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 1415 . 1 1 93 VAL HG23 H 1.260 -4.469 4.028 . . . 1.0 . . . . . . . . . . . . A . 93 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 1416 . 1 1 93 VAL N N 4.243 -6.919 2.977 . . . 1.0 . . . . . . . . . . . . A . 93 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 1417 . 1 1 93 VAL O O 5.673 -4.993 5.596 . . . 1.0 . . . . . . . . . . . . A . 93 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 1418 . 1 1 94 GLN C C 6.114 -7.529 7.222 . . . 1.0 . . . . . . . . . . . . A . 94 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 1419 . 1 1 94 GLN CA C 4.663 -7.069 7.105 . . . 1.0 . . . . . . . . . . . . A . 94 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 1420 . 1 1 94 GLN CB C 3.726 -8.135 7.679 . . . 1.0 . . . . . . . . . . . . A . 94 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 1421 . 1 1 94 GLN CD C 3.083 -9.544 9.686 . . . 1.0 . . . . . . . . . . . . A . 94 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 1422 . 1 1 94 GLN CG C 4.007 -8.474 9.137 . . . 1.0 . . . . . . . . . . . . A . 94 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 1423 . 1 1 94 GLN H H 3.688 -7.368 5.249 . . . 1.0 . . . . . . . . . . . . A . 94 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 1424 . 1 1 94 GLN HA H 4.540 -6.153 7.664 . . . 1.0 . . . . . . . . . . . . A . 94 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 1425 . 1 1 94 GLN HB2 H 2.708 -7.780 7.603 . . . 1.0 . . . . . . . . . . . . A . 94 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1426 . 1 1 94 GLN HB3 H 3.826 -9.039 7.096 . . . 1.0 . . . . . . . . . . . . A . 94 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1427 . 1 1 94 GLN HE21 H 1.632 -8.958 8.469 . . . 1.0 . . . . . . . . . . . . A . 94 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 1428 . 1 1 94 GLN HE22 H 1.240 -10.278 9.520 . . . 1.0 . . . . . . . . . . . . A . 94 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 1429 . 1 1 94 GLN HG2 H 5.025 -8.823 9.223 . . . 1.0 . . . . . . . . . . . . A . 94 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1430 . 1 1 94 GLN HG3 H 3.885 -7.578 9.729 . . . 1.0 . . . . . . . . . . . . A . 94 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1431 . 1 1 94 GLN N N 4.334 -6.792 5.716 . . . 1.0 . . . . . . . . . . . . A . 94 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 1432 . 1 1 94 GLN NE2 N 1.866 -9.599 9.169 . . . 1.0 . . . . . . . . . . . . A . 94 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1433 . 1 1 94 GLN O O 6.878 -7.003 8.028 . . . 1.0 . . . . . . . . . . . . A . 94 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 1434 . 1 1 94 GLN OE1 O 3.462 -10.315 10.567 . . . 1.0 . . . . . . . . . . . . A . 94 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 1435 . 1 1 95 VAL C C 8.885 -8.031 6.025 . . . 1.0 . . . . . . . . . . . . A . 95 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 1436 . 1 1 95 VAL CA C 7.829 -9.065 6.416 . . . 1.0 . . . . . . . . . . . . A . 95 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 1437 . 1 1 95 VAL CB C 7.938 -10.288 5.478 . . . 1.0 . . . . . . . . . . . . A . 95 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 1438 . 1 1 95 VAL CG1 C 9.373 -10.781 5.393 . . . 1.0 . . . . . . . . . . . . A . 95 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 1439 . 1 1 95 VAL CG2 C 7.020 -11.407 5.949 . . . 1.0 . . . . . . . . . . . . A . 95 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 1440 . 1 1 95 VAL H H 5.830 -8.855 5.753 . . . 1.0 . . . . . . . . . . . . A . 95 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 1441 . 1 1 95 VAL HA H 8.029 -9.396 7.424 . . . 1.0 . . . . . . . . . . . . A . 95 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 1442 . 1 1 95 VAL HB H 7.625 -9.988 4.488 . . . 1.0 . . . . . . . . . . . . A . 95 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 1443 . 1 1 95 VAL HG11 H 9.713 -11.069 6.377 . . . 1.0 . . . . . . . . . . . . A . 95 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 1444 . 1 1 95 VAL HG12 H 10.003 -9.992 5.011 . . . 1.0 . . . . . . . . . . . . A . 95 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 1445 . 1 1 95 VAL HG13 H 9.422 -11.633 4.731 . . . 1.0 . . . . . . . . . . . . A . 95 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 1446 . 1 1 95 VAL HG21 H 5.997 -11.060 5.940 . . . 1.0 . . . . . . . . . . . . A . 95 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 1447 . 1 1 95 VAL HG22 H 7.291 -11.699 6.953 . . . 1.0 . . . . . . . . . . . . A . 95 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 1448 . 1 1 95 VAL HG23 H 7.118 -12.255 5.289 . . . 1.0 . . . . . . . . . . . . A . 95 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 1449 . 1 1 95 VAL N N 6.485 -8.501 6.396 . . . 1.0 . . . . . . . . . . . . A . 95 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 1450 . 1 1 95 VAL O O 9.913 -7.901 6.696 . . . 1.0 . . . . . . . . . . . . A . 95 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 1451 . 1 1 96 VAL C C 9.824 -5.204 5.489 . . . 1.0 . . . . . . . . . . . . A . 96 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 1452 . 1 1 96 VAL CA C 9.602 -6.315 4.459 . . . 1.0 . . . . . . . . . . . . A . 96 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 1453 . 1 1 96 VAL CB C 9.187 -5.708 3.092 . . . 1.0 . . . . . . . . . . . . A . 96 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 1454 . 1 1 96 VAL CG1 C 7.949 -4.830 3.218 . . . 1.0 . . . . . . . . . . . . A . 96 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 1455 . 1 1 96 VAL CG2 C 10.343 -4.930 2.476 . . . 1.0 . . . . . . . . . . . . A . 96 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 1456 . 1 1 96 VAL H H 7.773 -7.392 4.480 . . . 1.0 . . . . . . . . . . . . A . 96 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 1457 . 1 1 96 VAL HA H 10.539 -6.839 4.320 . . . 1.0 . . . . . . . . . . . . A . 96 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 1458 . 1 1 96 VAL HB H 8.945 -6.524 2.426 . . . 1.0 . . . . . . . . . . . . A . 96 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 1459 . 1 1 96 VAL HG11 H 7.127 -5.417 3.600 . . . 1.0 . . . . . . . . . . . . A . 96 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 1460 . 1 1 96 VAL HG12 H 7.688 -4.434 2.248 . . . 1.0 . . . . . . . . . . . . A . 96 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 1461 . 1 1 96 VAL HG13 H 8.155 -4.015 3.896 . . . 1.0 . . . . . . . . . . . . A . 96 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 1462 . 1 1 96 VAL HG21 H 10.651 -4.146 3.152 . . . 1.0 . . . . . . . . . . . . A . 96 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 1463 . 1 1 96 VAL HG22 H 10.026 -4.495 1.541 . . . 1.0 . . . . . . . . . . . . A . 96 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 1464 . 1 1 96 VAL HG23 H 11.173 -5.598 2.298 . . . 1.0 . . . . . . . . . . . . A . 96 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 1465 . 1 1 96 VAL N N 8.630 -7.286 4.950 . . . 1.0 . . . . . . . . . . . . A . 96 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 1466 . 1 1 96 VAL O O 10.931 -4.687 5.628 . . . 1.0 . . . . . . . . . . . . A . 96 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 1467 . 1 1 97 ALA C C 9.586 -4.450 8.495 . . . 1.0 . . . . . . . . . . . . A . 97 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1468 . 1 1 97 ALA CA C 8.887 -3.857 7.277 . . . 1.0 . . . . . . . . . . . . A . 97 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 1469 . 1 1 97 ALA CB C 7.512 -3.327 7.660 . . . 1.0 . . . . . . . . . . . . A . 97 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 1470 . 1 1 97 ALA H H 7.905 -5.277 6.052 . . . 1.0 . . . . . . . . . . . . A . 97 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 1471 . 1 1 97 ALA HA H 9.476 -3.034 6.897 . . . 1.0 . . . . . . . . . . . . A . 97 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 1472 . 1 1 97 ALA HB1 H 7.054 -2.863 6.801 . . . 1.0 . . . . . . . . . . . . A . 97 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 1473 . 1 1 97 ALA HB2 H 7.613 -2.599 8.453 . . . 1.0 . . . . . . . . . . . . A . 97 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1474 . 1 1 97 ALA HB3 H 6.893 -4.143 7.999 . . . 1.0 . . . . . . . . . . . . A . 97 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1475 . 1 1 97 ALA N N 8.775 -4.856 6.224 . . . 1.0 . . . . . . . . . . . . A . 97 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 1476 . 1 1 97 ALA O O 10.456 -3.814 9.096 . . . 1.0 . . . . . . . . . . . . A . 97 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 1477 . 1 1 98 ASP C C 11.276 -6.487 9.928 . . . 1.0 . . . . . . . . . . . . A . 98 ASP C . . . . . . . . . c16368_2kko 1 . 1 . 1478 . 1 1 98 ASP CA C 9.760 -6.371 9.997 . . . 1.0 . . . . . . . . . . . . A . 98 ASP CA . . . . . . . . . c16368_2kko 1 . 1 . 1479 . 1 1 98 ASP CB C 9.150 -7.768 10.139 . . . 1.0 . . . . . . . . . . . . A . 98 ASP CB . . . . . . . . . c16368_2kko 1 . 1 . 1480 . 1 1 98 ASP CG C 9.722 -8.535 11.319 . . . 1.0 . . . . . . . . . . . . A . 98 ASP CG . . . . . . . . . c16368_2kko 1 . 1 . 1481 . 1 1 98 ASP H H 8.547 -6.146 8.276 . . . 1.0 . . . . . . . . . . . . A . 98 ASP H . . . . . . . . . c16368_2kko 1 . 1 . 1482 . 1 1 98 ASP HA H 9.499 -5.791 10.868 . . . 1.0 . . . . . . . . . . . . A . 98 ASP HA . . . . . . . . . c16368_2kko 1 . 1 . 1483 . 1 1 98 ASP HB2 H 8.083 -7.675 10.277 . . . 1.0 . . . . . . . . . . . . A . 98 ASP HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1484 . 1 1 98 ASP HB3 H 9.344 -8.331 9.239 . . . 1.0 . . . . . . . . . . . . A . 98 ASP HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1485 . 1 1 98 ASP N N 9.216 -5.683 8.829 . . . 1.0 . . . . . . . . . . . . A . 98 ASP N . . . . . . . . . c16368_2kko 1 . 1 . 1486 . 1 1 98 ASP O O 11.972 -6.073 10.854 . . . 1.0 . . . . . . . . . . . . A . 98 ASP O . . . . . . . . . c16368_2kko 1 . 1 . 1487 . 1 1 98 ASP OD1 O 9.319 -8.249 12.470 . . . 1.0 . . . . . . . . . . . . A . 98 ASP OD1 . . . . . . . . . c16368_2kko 1 . 1 . 1488 . 1 1 98 ASP OD2 O 10.569 -9.429 11.105 . . . 1.0 . . . . . . . . . . . . A . 98 ASP OD2 . . . . . . . . . c16368_2kko 1 . 1 . 1489 . 1 1 99 GLU C C 14.016 -5.986 8.449 . . . 1.0 . . . . . . . . . . . . A . 99 GLU C . . . . . . . . . c16368_2kko 1 . 1 . 1490 . 1 1 99 GLU CA C 13.223 -7.272 8.694 . . . 1.0 . . . . . . . . . . . . A . 99 GLU CA . . . . . . . . . c16368_2kko 1 . 1 . 1491 . 1 1 99 GLU CB C 13.502 -8.294 7.588 . . . 1.0 . . . . . . . . . . . . A . 99 GLU CB . . . . . . . . . c16368_2kko 1 . 1 . 1492 . 1 1 99 GLU CD C 13.553 -10.758 7.028 . . . 1.0 . . . . . . . . . . . . A . 99 GLU CD . . . . . . . . . c16368_2kko 1 . 1 . 1493 . 1 1 99 GLU CG C 12.962 -9.678 7.908 . . . 1.0 . . . . . . . . . . . . A . 99 GLU CG . . . . . . . . . c16368_2kko 1 . 1 . 1494 . 1 1 99 GLU H H 11.187 -7.267 8.083 . . . 1.0 . . . . . . . . . . . . A . 99 GLU H . . . . . . . . . c16368_2kko 1 . 1 . 1495 . 1 1 99 GLU HA H 13.555 -7.693 9.632 . . . 1.0 . . . . . . . . . . . . A . 99 GLU HA . . . . . . . . . c16368_2kko 1 . 1 . 1496 . 1 1 99 GLU HB2 H 13.043 -7.954 6.671 . . . 1.0 . . . . . . . . . . . . A . 99 GLU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1497 . 1 1 99 GLU HB3 H 14.568 -8.372 7.443 . . . 1.0 . . . . . . . . . . . . A . 99 GLU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1498 . 1 1 99 GLU HG2 H 13.194 -9.909 8.937 . . . 1.0 . . . . . . . . . . . . A . 99 GLU HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1499 . 1 1 99 GLU HG3 H 11.889 -9.670 7.775 . . . 1.0 . . . . . . . . . . . . A . 99 GLU HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1500 . 1 1 99 GLU N N 11.789 -7.023 8.823 . . . 1.0 . . . . . . . . . . . . A . 99 GLU N . . . . . . . . . c16368_2kko 1 . 1 . 1501 . 1 1 99 GLU O O 15.246 -6.012 8.379 . . . 1.0 . . . . . . . . . . . . A . 99 GLU O . . . . . . . . . c16368_2kko 1 . 1 . 1502 . 1 1 99 GLU OE1 O 14.679 -11.219 7.322 . . . 1.0 . . . . . . . . . . . . A . 99 GLU OE1 . . . . . . . . . c16368_2kko 1 . 1 . 1503 . 1 1 99 GLU OE2 O 12.890 -11.165 6.050 . . . 1.0 . . . . . . . . . . . . A . 99 GLU OE2 . . . . . . . . . c16368_2kko 1 . 1 . 1504 . 1 1 100 HIS C C 14.020 -2.889 9.591 . . . 1.0 . . . . . . . . . . . . A . 100 HIS C . . . . . . . . . c16368_2kko 1 . 1 . 1505 . 1 1 100 HIS CA C 13.993 -3.570 8.230 . . . 1.0 . . . . . . . . . . . . A . 100 HIS CA . . . . . . . . . c16368_2kko 1 . 1 . 1506 . 1 1 100 HIS CB C 13.344 -2.660 7.183 . . . 1.0 . . . . . . . . . . . . A . 100 HIS CB . . . . . . . . . c16368_2kko 1 . 1 . 1507 . 1 1 100 HIS CD2 C 13.379 -3.348 4.676 . . . 1.0 . . . . . . . . . . . . A . 100 HIS CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1508 . 1 1 100 HIS CE1 C 15.434 -2.750 4.209 . . . 1.0 . . . . . . . . . . . . A . 100 HIS CE1 . . . . . . . . . c16368_2kko 1 . 1 . 1509 . 1 1 100 HIS CG C 13.918 -2.836 5.808 . . . 1.0 . . . . . . . . . . . . A . 100 HIS CG . . . . . . . . . c16368_2kko 1 . 1 . 1510 . 1 1 100 HIS H H 12.340 -4.902 8.289 . . . 1.0 . . . . . . . . . . . . A . 100 HIS H . . . . . . . . . c16368_2kko 1 . 1 . 1511 . 1 1 100 HIS HA H 15.013 -3.763 7.931 . . . 1.0 . . . . . . . . . . . . A . 100 HIS HA . . . . . . . . . c16368_2kko 1 . 1 . 1512 . 1 1 100 HIS HB2 H 12.287 -2.877 7.134 . . . 1.0 . . . . . . . . . . . . A . 100 HIS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1513 . 1 1 100 HIS HB3 H 13.482 -1.629 7.474 . . . 1.0 . . . . . . . . . . . . A . 100 HIS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1514 . 1 1 100 HIS HD1 H 15.872 -2.069 6.094 . . . 1.0 . . . . . . . . . . . . A . 100 HIS HD1 . . . . . . . . . c16368_2kko 1 . 1 . 1515 . 1 1 100 HIS HD2 H 12.376 -3.734 4.561 . . . 1.0 . . . . . . . . . . . . A . 100 HIS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1516 . 1 1 100 HIS HE1 H 16.357 -2.569 3.677 . . . 1.0 . . . . . . . . . . . . A . 100 HIS HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1517 . 1 1 100 HIS HE2 H 14.240 -3.587 2.765 . . . 1.0 . . . . . . . . . . . . A . 100 HIS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1518 . 1 1 100 HIS N N 13.321 -4.862 8.319 . . . 1.0 . . . . . . . . . . . . A . 100 HIS N . . . . . . . . . c16368_2kko 1 . 1 . 1519 . 1 1 100 HIS ND1 N 15.209 -2.472 5.479 . . . 1.0 . . . . . . . . . . . . A . 100 HIS ND1 . . . . . . . . . c16368_2kko 1 . 1 . 1520 . 1 1 100 HIS NE2 N 14.343 -3.282 3.701 . . . 1.0 . . . . . . . . . . . . A . 100 HIS NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1521 . 1 1 100 HIS O O 15.029 -2.302 9.976 . . . 1.0 . . . . . . . . . . . . A . 100 HIS O . . . . . . . . . c16368_2kko 1 . 1 . 1522 . 1 1 101 LEU C C 13.700 -3.319 12.605 . . . 1.0 . . . . . . . . . . . . A . 101 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 1523 . 1 1 101 LEU CA C 12.851 -2.454 11.681 . . . 1.0 . . . . . . . . . . . . A . 101 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 1524 . 1 1 101 LEU CB C 11.403 -2.412 12.180 . . . 1.0 . . . . . . . . . . . . A . 101 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 1525 . 1 1 101 LEU CD1 C 9.054 -1.568 11.962 . . . 1.0 . . . . . . . . . . . . A . 101 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 1526 . 1 1 101 LEU CD2 C 10.971 -0.078 11.365 . . . 1.0 . . . . . . . . . . . . A . 101 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1527 . 1 1 101 LEU CG C 10.458 -1.510 11.381 . . . 1.0 . . . . . . . . . . . . A . 101 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 1528 . 1 1 101 LEU H H 12.115 -3.406 9.937 . . . 1.0 . . . . . . . . . . . . A . 101 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 1529 . 1 1 101 LEU HA H 13.254 -1.453 11.670 . . . 1.0 . . . . . . . . . . . . A . 101 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 1530 . 1 1 101 LEU HB2 H 11.008 -3.417 12.160 . . . 1.0 . . . . . . . . . . . . A . 101 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1531 . 1 1 101 LEU HB3 H 11.409 -2.068 13.204 . . . 1.0 . . . . . . . . . . . . A . 101 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1532 . 1 1 101 LEU HD11 H 8.692 -2.584 11.924 . . . 1.0 . . . . . . . . . . . . A . 101 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 1533 . 1 1 101 LEU HD12 H 8.398 -0.930 11.386 . . . 1.0 . . . . . . . . . . . . A . 101 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 1534 . 1 1 101 LEU HD13 H 9.074 -1.232 12.988 . . . 1.0 . . . . . . . . . . . . A . 101 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 1535 . 1 1 101 LEU HD21 H 11.030 0.294 12.377 . . . 1.0 . . . . . . . . . . . . A . 101 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 1536 . 1 1 101 LEU HD22 H 10.295 0.541 10.792 . . . 1.0 . . . . . . . . . . . . A . 101 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 1537 . 1 1 101 LEU HD23 H 11.952 -0.053 10.915 . . . 1.0 . . . . . . . . . . . . A . 101 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 1538 . 1 1 101 LEU HG H 10.411 -1.862 10.360 . . . 1.0 . . . . . . . . . . . . A . 101 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 1539 . 1 1 101 LEU N N 12.913 -2.980 10.322 . . . 1.0 . . . . . . . . . . . . A . 101 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 1540 . 1 1 101 LEU O O 14.341 -2.825 13.534 . . . 1.0 . . . . . . . . . . . . A . 101 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 1541 . 1 1 102 GLU C C 15.716 -5.922 12.153 . . . 1.0 . . . . . . . . . . . . A . 102 GLU C . . . . . . . . . c16368_2kko 1 . 1 . 1542 . 1 1 102 GLU CA C 14.536 -5.558 13.046 . . . 1.0 . . . . . . . . . . . . A . 102 GLU CA . . . . . . . . . c16368_2kko 1 . 1 . 1543 . 1 1 102 GLU CB C 13.720 -6.804 13.426 . . . 1.0 . . . . . . . . . . . . A . 102 GLU CB . . . . . . . . . c16368_2kko 1 . 1 . 1544 . 1 1 102 GLU CD C 15.503 -8.226 14.554 . . . 1.0 . . . . . . . . . . . . A . 102 GLU CD . . . . . . . . . c16368_2kko 1 . 1 . 1545 . 1 1 102 GLU CG C 14.177 -7.506 14.698 . . . 1.0 . . . . . . . . . . . . A . 102 GLU CG . . . . . . . . . c16368_2kko 1 . 1 . 1546 . 1 1 102 GLU H H 13.107 -4.950 11.621 . . . 1.0 . . . . . . . . . . . . A . 102 GLU H . . . . . . . . . c16368_2kko 1 . 1 . 1547 . 1 1 102 GLU HA H 14.903 -5.078 13.940 . . . 1.0 . . . . . . . . . . . . A . 102 GLU HA . . . . . . . . . c16368_2kko 1 . 1 . 1548 . 1 1 102 GLU HB2 H 12.690 -6.511 13.559 . . . 1.0 . . . . . . . . . . . . A . 102 GLU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1549 . 1 1 102 GLU HB3 H 13.776 -7.514 12.614 . . . 1.0 . . . . . . . . . . . . A . 102 GLU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1550 . 1 1 102 GLU HG2 H 14.274 -6.770 15.481 . . . 1.0 . . . . . . . . . . . . A . 102 GLU HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1551 . 1 1 102 GLU HG3 H 13.424 -8.228 14.981 . . . 1.0 . . . . . . . . . . . . A . 102 GLU HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1552 . 1 1 102 GLU N N 13.697 -4.615 12.332 . . . 1.0 . . . . . . . . . . . . A . 102 GLU N . . . . . . . . . c16368_2kko 1 . 1 . 1553 . 1 1 102 GLU O O 15.863 -7.064 11.720 . . . 1.0 . . . . . . . . . . . . A . 102 GLU O . . . . . . . . . c16368_2kko 1 . 1 . 1554 . 1 1 102 GLU OE1 O 15.535 -9.300 13.920 . . . 1.0 . . . . . . . . . . . . A . 102 GLU OE1 . . . . . . . . . c16368_2kko 1 . 1 . 1555 . 1 1 102 GLU OE2 O 16.512 -7.743 15.111 . . . 1.0 . . . . . . . . . . . . A . 102 GLU OE2 . . . . . . . . . c16368_2kko 1 . 1 . 1556 . 1 1 103 HIS C C 18.798 -5.725 11.912 . . . 1.0 . . . . . . . . . . . . A . 103 HIS C . . . . . . . . . c16368_2kko 1 . 1 . 1557 . 1 1 103 HIS CA C 17.712 -5.137 11.025 . . . 1.0 . . . . . . . . . . . . A . 103 HIS CA . . . . . . . . . c16368_2kko 1 . 1 . 1558 . 1 1 103 HIS CB C 18.181 -3.829 10.375 . . . 1.0 . . . . . . . . . . . . A . 103 HIS CB . . . . . . . . . c16368_2kko 1 . 1 . 1559 . 1 1 103 HIS CD2 C 20.536 -4.415 9.441 . . . 1.0 . . . . . . . . . . . . A . 103 HIS CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1560 . 1 1 103 HIS CE1 C 20.168 -3.971 7.329 . . . 1.0 . . . . . . . . . . . . A . 103 HIS CE1 . . . . . . . . . c16368_2kko 1 . 1 . 1561 . 1 1 103 HIS CG C 19.249 -4.007 9.333 . . . 1.0 . . . . . . . . . . . . A . 103 HIS CG . . . . . . . . . c16368_2kko 1 . 1 . 1562 . 1 1 103 HIS H H 16.314 -4.016 12.143 . . . 1.0 . . . . . . . . . . . . A . 103 HIS H . . . . . . . . . c16368_2kko 1 . 1 . 1563 . 1 1 103 HIS HA H 17.464 -5.852 10.253 . . . 1.0 . . . . . . . . . . . . A . 103 HIS HA . . . . . . . . . c16368_2kko 1 . 1 . 1564 . 1 1 103 HIS HB2 H 17.336 -3.348 9.905 . . . 1.0 . . . . . . . . . . . . A . 103 HIS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1565 . 1 1 103 HIS HB3 H 18.573 -3.178 11.144 . . . 1.0 . . . . . . . . . . . . A . 103 HIS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1566 . 1 1 103 HIS HD1 H 18.216 -3.415 7.588 . . . 1.0 . . . . . . . . . . . . A . 103 HIS HD1 . . . . . . . . . c16368_2kko 1 . 1 . 1567 . 1 1 103 HIS HD2 H 21.041 -4.709 10.350 . . . 1.0 . . . . . . . . . . . . A . 103 HIS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1568 . 1 1 103 HIS HE1 H 20.309 -3.845 6.265 . . . 1.0 . . . . . . . . . . . . A . 103 HIS HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1569 . 1 1 103 HIS HE2 H 21.979 -4.725 7.938 . . . 1.0 . . . . . . . . . . . . A . 103 HIS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1570 . 1 1 103 HIS N N 16.523 -4.920 11.828 . . . 1.0 . . . . . . . . . . . . A . 103 HIS N . . . . . . . . . c16368_2kko 1 . 1 . 1571 . 1 1 103 HIS ND1 N 19.051 -3.735 7.994 . . . 1.0 . . . . . . . . . . . . A . 103 HIS ND1 . . . . . . . . . c16368_2kko 1 . 1 . 1572 . 1 1 103 HIS NE2 N 21.082 -4.382 8.184 . . . 1.0 . . . . . . . . . . . . A . 103 HIS NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1573 . 1 1 103 HIS O O 19.561 -4.998 12.554 . . . 1.0 . . . . . . . . . . . . A . 103 HIS O . . . . . . . . . c16368_2kko 1 . 1 . 1574 . 1 1 104 HIS C C 21.127 -7.769 12.436 . . . 1.0 . . . . . . . . . . . . A . 104 HIS C . . . . . . . . . c16368_2kko 1 . 1 . 1575 . 1 1 104 HIS CA C 19.679 -7.754 12.899 . . . 1.0 . . . . . . . . . . . . A . 104 HIS CA . . . . . . . . . c16368_2kko 1 . 1 . 1576 . 1 1 104 HIS CB C 19.167 -9.185 13.065 . . . 1.0 . . . . . . . . . . . . A . 104 HIS CB . . . . . . . . . c16368_2kko 1 . 1 . 1577 . 1 1 104 HIS CD2 C 20.345 -10.589 14.908 . . . 1.0 . . . . . . . . . . . . A . 104 HIS CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1578 . 1 1 104 HIS CE1 C 18.993 -10.109 16.563 . . . 1.0 . . . . . . . . . . . . A . 104 HIS CE1 . . . . . . . . . c16368_2kko 1 . 1 . 1579 . 1 1 104 HIS CG C 19.392 -9.752 14.430 . . . 1.0 . . . . . . . . . . . . A . 104 HIS CG . . . . . . . . . c16368_2kko 1 . 1 . 1580 . 1 1 104 HIS H H 18.279 -7.557 11.336 . . . 1.0 . . . . . . . . . . . . A . 104 HIS H . . . . . . . . . c16368_2kko 1 . 1 . 1581 . 1 1 104 HIS HA H 19.619 -7.246 13.850 . . . 1.0 . . . . . . . . . . . . A . 104 HIS HA . . . . . . . . . c16368_2kko 1 . 1 . 1582 . 1 1 104 HIS HB2 H 18.105 -9.203 12.871 . . . 1.0 . . . . . . . . . . . . A . 104 HIS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1583 . 1 1 104 HIS HB3 H 19.668 -9.822 12.352 . . . 1.0 . . . . . . . . . . . . A . 104 HIS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1584 . 1 1 104 HIS HD1 H 17.766 -8.887 15.458 . . . 1.0 . . . . . . . . . . . . A . 104 HIS HD1 . . . . . . . . . c16368_2kko 1 . 1 . 1585 . 1 1 104 HIS HD2 H 21.164 -11.019 14.347 . . . 1.0 . . . . . . . . . . . . A . 104 HIS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1586 . 1 1 104 HIS HE1 H 18.536 -10.078 17.542 . . . 1.0 . . . . . . . . . . . . A . 104 HIS HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1587 . 1 1 104 HIS HE2 H 20.509 -11.470 16.815 . . . 1.0 . . . . . . . . . . . . A . 104 HIS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1588 . 1 1 104 HIS N N 18.838 -7.043 11.958 . . . 1.0 . . . . . . . . . . . . A . 104 HIS N . . . . . . . . . c16368_2kko 1 . 1 . 1589 . 1 1 104 HIS ND1 N 18.564 -9.474 15.491 . . . 1.0 . . . . . . . . . . . . A . 104 HIS ND1 . . . . . . . . . c16368_2kko 1 . 1 . 1590 . 1 1 104 HIS NE2 N 20.072 -10.795 16.238 . . . 1.0 . . . . . . . . . . . . A . 104 HIS NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1591 . 1 1 104 HIS O O 21.414 -7.991 11.259 . . . 1.0 . . . . . . . . . . . . A . 104 HIS O . . . . . . . . . c16368_2kko 1 . 1 . 1592 . 1 1 105 HIS C C 23.910 -9.046 13.112 . . . 1.0 . . . . . . . . . . . . A . 105 HIS C . . . . . . . . . c16368_2kko 1 . 1 . 1593 . 1 1 105 HIS CA C 23.458 -7.598 13.074 . . . 1.0 . . . . . . . . . . . . A . 105 HIS CA . . . . . . . . . c16368_2kko 1 . 1 . 1594 . 1 1 105 HIS CB C 24.286 -6.774 14.067 . . . 1.0 . . . . . . . . . . . . A . 105 HIS CB . . . . . . . . . c16368_2kko 1 . 1 . 1595 . 1 1 105 HIS CD2 C 23.342 -4.541 13.133 . . . 1.0 . . . . . . . . . . . . A . 105 HIS CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1596 . 1 1 105 HIS CE1 C 24.085 -3.208 14.701 . . . 1.0 . . . . . . . . . . . . A . 105 HIS CE1 . . . . . . . . . c16368_2kko 1 . 1 . 1597 . 1 1 105 HIS CG C 24.016 -5.301 14.028 . . . 1.0 . . . . . . . . . . . . A . 105 HIS CG . . . . . . . . . c16368_2kko 1 . 1 . 1598 . 1 1 105 HIS H H 21.743 -7.324 14.287 . . . 1.0 . . . . . . . . . . . . A . 105 HIS H . . . . . . . . . c16368_2kko 1 . 1 . 1599 . 1 1 105 HIS HA H 23.608 -7.212 12.077 . . . 1.0 . . . . . . . . . . . . A . 105 HIS HA . . . . . . . . . c16368_2kko 1 . 1 . 1600 . 1 1 105 HIS HB2 H 24.076 -7.118 15.066 . . . 1.0 . . . . . . . . . . . . A . 105 HIS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1601 . 1 1 105 HIS HB3 H 25.336 -6.928 13.856 . . . 1.0 . . . . . . . . . . . . A . 105 HIS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1602 . 1 1 105 HIS HD1 H 25.010 -4.680 15.789 . . . 1.0 . . . . . . . . . . . . A . 105 HIS HD1 . . . . . . . . . c16368_2kko 1 . 1 . 1603 . 1 1 105 HIS HD2 H 22.851 -4.892 12.238 . . . 1.0 . . . . . . . . . . . . A . 105 HIS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1604 . 1 1 105 HIS HE1 H 24.297 -2.325 15.285 . . . 1.0 . . . . . . . . . . . . A . 105 HIS HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1605 . 1 1 105 HIS HE2 H 23.202 -2.446 13.023 . . . 1.0 . . . . . . . . . . . . A . 105 HIS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1606 . 1 1 105 HIS N N 22.037 -7.532 13.368 . . . 1.0 . . . . . . . . . . . . A . 105 HIS N . . . . . . . . . c16368_2kko 1 . 1 . 1607 . 1 1 105 HIS ND1 N 24.469 -4.433 14.994 . . . 1.0 . . . . . . . . . . . . A . 105 HIS ND1 . . . . . . . . . c16368_2kko 1 . 1 . 1608 . 1 1 105 HIS NE2 N 23.399 -3.242 13.576 . . . 1.0 . . . . . . . . . . . . A . 105 HIS NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1609 . 1 1 105 HIS O O 24.528 -9.491 14.080 . . . 1.0 . . . . . . . . . . . . A . 105 HIS O . . . . . . . . . c16368_2kko 1 . 1 . 1610 . 1 1 106 HIS C C 25.422 -11.340 11.950 . . . 1.0 . . . . . . . . . . . . A . 106 HIS C . . . . . . . . . c16368_2kko 1 . 1 . 1611 . 1 1 106 HIS CA C 23.906 -11.188 11.957 . . . 1.0 . . . . . . . . . . . . A . 106 HIS CA . . . . . . . . . c16368_2kko 1 . 1 . 1612 . 1 1 106 HIS CB C 23.274 -11.814 10.701 . . . 1.0 . . . . . . . . . . . . A . 106 HIS CB . . . . . . . . . c16368_2kko 1 . 1 . 1613 . 1 1 106 HIS CD2 C 23.649 -9.844 9.037 . . . 1.0 . . . . . . . . . . . . A . 106 HIS CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1614 . 1 1 106 HIS CE1 C 24.289 -11.013 7.306 . . . 1.0 . . . . . . . . . . . . A . 106 HIS CE1 . . . . . . . . . c16368_2kko 1 . 1 . 1615 . 1 1 106 HIS CG C 23.642 -11.150 9.402 . . . 1.0 . . . . . . . . . . . . A . 106 HIS CG . . . . . . . . . c16368_2kko 1 . 1 . 1616 . 1 1 106 HIS H H 22.991 -9.374 11.376 . . . 1.0 . . . . . . . . . . . . A . 106 HIS H . . . . . . . . . c16368_2kko 1 . 1 . 1617 . 1 1 106 HIS HA H 23.519 -11.696 12.829 . . . 1.0 . . . . . . . . . . . . A . 106 HIS HA . . . . . . . . . c16368_2kko 1 . 1 . 1618 . 1 1 106 HIS HB2 H 23.583 -12.847 10.635 . . . 1.0 . . . . . . . . . . . . A . 106 HIS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1619 . 1 1 106 HIS HB3 H 22.198 -11.776 10.799 . . . 1.0 . . . . . . . . . . . . A . 106 HIS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1620 . 1 1 106 HIS HD1 H 24.138 -12.836 8.228 . . . 1.0 . . . . . . . . . . . . A . 106 HIS HD1 . . . . . . . . . c16368_2kko 1 . 1 . 1621 . 1 1 106 HIS HD2 H 23.382 -9.005 9.661 . . . 1.0 . . . . . . . . . . . . A . 106 HIS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1622 . 1 1 106 HIS HE1 H 24.623 -11.284 6.316 . . . 1.0 . . . . . . . . . . . . A . 106 HIS HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1623 . 1 1 106 HIS HE2 H 24.403 -8.970 7.285 . . . 1.0 . . . . . . . . . . . . A . 106 HIS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1624 . 1 1 106 HIS N N 23.537 -9.786 12.078 . . . 1.0 . . . . . . . . . . . . A . 106 HIS N . . . . . . . . . c16368_2kko 1 . 1 . 1625 . 1 1 106 HIS ND1 N 24.045 -11.853 8.291 . . . 1.0 . . . . . . . . . . . . A . 106 HIS ND1 . . . . . . . . . c16368_2kko 1 . 1 . 1626 . 1 1 106 HIS NE2 N 24.056 -9.786 7.729 . . . 1.0 . . . . . . . . . . . . A . 106 HIS NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1627 . 1 1 106 HIS O O 26.107 -10.884 11.033 . . . 1.0 . . . . . . . . . . . . A . 106 HIS O . . . . . . . . . c16368_2kko 1 . 1 . 1628 . 1 1 107 HIS C C 27.673 -13.244 14.120 . . . 1.0 . . . . . . . . . . . . A . 107 HIS C . . . . . . . . . c16368_2kko 1 . 1 . 1629 . 1 1 107 HIS CA C 27.364 -12.065 13.207 . . . 1.0 . . . . . . . . . . . . A . 107 HIS CA . . . . . . . . . c16368_2kko 1 . 1 . 1630 . 1 1 107 HIS CB C 27.885 -10.761 13.826 . . . 1.0 . . . . . . . . . . . . A . 107 HIS CB . . . . . . . . . c16368_2kko 1 . 1 . 1631 . 1 1 107 HIS CD2 C 30.126 -11.191 15.062 . . . 1.0 . . . . . . . . . . . . A . 107 HIS CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1632 . 1 1 107 HIS CE1 C 31.472 -10.247 13.618 . . . 1.0 . . . . . . . . . . . . A . 107 HIS CE1 . . . . . . . . . c16368_2kko 1 . 1 . 1633 . 1 1 107 HIS CG C 29.367 -10.726 14.043 . . . 1.0 . . . . . . . . . . . . A . 107 HIS CG . . . . . . . . . c16368_2kko 1 . 1 . 1634 . 1 1 107 HIS H H 25.326 -12.391 13.639 . . . 1.0 . . . . . . . . . . . . A . 107 HIS H . . . . . . . . . c16368_2kko 1 . 1 . 1635 . 1 1 107 HIS HA H 27.839 -12.222 12.250 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HA . . . . . . . . . c16368_2kko 1 . 1 . 1636 . 1 1 107 HIS HB2 H 27.630 -9.938 13.174 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1637 . 1 1 107 HIS HB3 H 27.407 -10.610 14.783 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1638 . 1 1 107 HIS HD1 H 29.991 -9.712 12.301 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HD1 . . . . . . . . . c16368_2kko 1 . 1 . 1639 . 1 1 107 HIS HD2 H 29.770 -11.709 15.943 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1640 . 1 1 107 HIS HE1 H 32.365 -9.880 13.132 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1641 . 1 1 107 HIS HE2 H 32.205 -11.073 15.352 . . . 1.0 . . . . . . . . . . . . A . 107 HIS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1642 . 1 1 107 HIS N N 25.933 -11.967 12.993 . . . 1.0 . . . . . . . . . . . . A . 107 HIS N . . . . . . . . . c16368_2kko 1 . 1 . 1643 . 1 1 107 HIS ND1 N 30.241 -10.142 13.155 . . . 1.0 . . . . . . . . . . . . A . 107 HIS ND1 . . . . . . . . . c16368_2kko 1 . 1 . 1644 . 1 1 107 HIS NE2 N 31.427 -10.879 14.773 . . . 1.0 . . . . . . . . . . . . A . 107 HIS NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1645 . 1 1 107 HIS O O 27.169 -13.320 15.239 . . . 1.0 . . . . . . . . . . . . A . 107 HIS O . . . . . . . . . c16368_2kko 1 . 1 . 1646 . 1 1 108 HIS C C 30.397 -15.424 14.487 . . . 1.0 . . . . . . . . . . . . A . 108 HIS C . . . . . . . . . c16368_2kko 1 . 1 . 1647 . 1 1 108 HIS CA C 28.883 -15.320 14.426 . . . 1.0 . . . . . . . . . . . . A . 108 HIS CA . . . . . . . . . c16368_2kko 1 . 1 . 1648 . 1 1 108 HIS CB C 28.264 -16.606 13.855 . . . 1.0 . . . . . . . . . . . . A . 108 HIS CB . . . . . . . . . c16368_2kko 1 . 1 . 1649 . 1 1 108 HIS CD2 C 29.616 -17.389 11.778 . . . 1.0 . . . . . . . . . . . . A . 108 HIS CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1650 . 1 1 108 HIS CE1 C 28.168 -16.834 10.233 . . . 1.0 . . . . . . . . . . . . A . 108 HIS CE1 . . . . . . . . . c16368_2kko 1 . 1 . 1651 . 1 1 108 HIS CG C 28.547 -16.839 12.400 . . . 1.0 . . . . . . . . . . . . A . 108 HIS CG . . . . . . . . . c16368_2kko 1 . 1 . 1652 . 1 1 108 HIS H H 28.863 -14.049 12.737 . . . 1.0 . . . . . . . . . . . . A . 108 HIS H . . . . . . . . . c16368_2kko 1 . 1 . 1653 . 1 1 108 HIS HA H 28.512 -15.174 15.429 . . . 1.0 . . . . . . . . . . . . A . 108 HIS HA . . . . . . . . . c16368_2kko 1 . 1 . 1654 . 1 1 108 HIS HB2 H 28.647 -17.453 14.403 . . . 1.0 . . . . . . . . . . . . A . 108 HIS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1655 . 1 1 108 HIS HB3 H 27.192 -16.563 13.981 . . . 1.0 . . . . . . . . . . . . A . 108 HIS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1656 . 1 1 108 HIS HD1 H 26.775 -16.077 11.537 . . . 1.0 . . . . . . . . . . . . A . 108 HIS HD1 . . . . . . . . . c16368_2kko 1 . 1 . 1657 . 1 1 108 HIS HD2 H 30.511 -17.765 12.252 . . . 1.0 . . . . . . . . . . . . A . 108 HIS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1658 . 1 1 108 HIS HE1 H 27.693 -16.686 9.274 . . . 1.0 . . . . . . . . . . . . A . 108 HIS HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1659 . 1 1 108 HIS HE2 H 29.920 -17.780 9.736 . . . 1.0 . . . . . . . . . . . . A . 108 HIS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1660 . 1 1 108 HIS N N 28.495 -14.158 13.642 . . . 1.0 . . . . . . . . . . . . A . 108 HIS N . . . . . . . . . c16368_2kko 1 . 1 . 1661 . 1 1 108 HIS ND1 N 27.659 -16.502 11.404 . . . 1.0 . . . . . . . . . . . . A . 108 HIS ND1 . . . . . . . . . c16368_2kko 1 . 1 . 1662 . 1 1 108 HIS NE2 N 29.355 -17.371 10.432 . . . 1.0 . . . . . . . . . . . . A . 108 HIS NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1663 . 1 1 108 HIS O O 31.041 -15.256 13.434 . . . 1.0 . . . . . . . . . . . . A . 108 HIS O . . . . . . . . . c16368_2kko 1 . 1 . 1664 . 1 1 108 HIS OXT O 30.932 -15.668 15.581 . . . 1.0 . . . . . . . . . . . . A . 108 HIS OXT . . . . . . . . . c16368_2kko 1 . 1 . 1665 . 2 1 1 MET C C 6.255 -13.152 31.368 . . . 1.0 . . . . . . . . . . . . B . 1 MET C . . . . . . . . . c16368_2kko 1 . 1 . 1666 . 2 1 1 MET CA C 6.873 -14.275 32.193 . . . 1.0 . . . . . . . . . . . . B . 1 MET CA . . . . . . . . . c16368_2kko 1 . 1 . 1667 . 2 1 1 MET CB C 5.791 -15.249 32.672 . . . 1.0 . . . . . . . . . . . . B . 1 MET CB . . . . . . . . . c16368_2kko 1 . 1 . 1668 . 2 1 1 MET CE C 2.655 -14.846 35.395 . . . 1.0 . . . . . . . . . . . . B . 1 MET CE . . . . . . . . . c16368_2kko 1 . 1 . 1669 . 2 1 1 MET CG C 4.815 -14.649 33.672 . . . 1.0 . . . . . . . . . . . . B . 1 MET CG . . . . . . . . . c16368_2kko 1 . 1 . 1670 . 2 1 1 MET H1 H 6.980 -13.096 33.905 . . . 1.0 . . . . . . . . . . . . B . 1 MET H1 . . . . . . . . . c16368_2kko 1 . 1 . 1671 . 2 1 1 MET H2 H 8.423 -13.159 33.023 . . . 1.0 . . . . . . . . . . . . B . 1 MET H2 . . . . . . . . . c16368_2kko 1 . 1 . 1672 . 2 1 1 MET H3 H 7.950 -14.483 33.965 . . . 1.0 . . . . . . . . . . . . B . 1 MET H3 . . . . . . . . . c16368_2kko 1 . 1 . 1673 . 2 1 1 MET HA H 7.580 -14.809 31.571 . . . 1.0 . . . . . . . . . . . . B . 1 MET HA . . . . . . . . . c16368_2kko 1 . 1 . 1674 . 2 1 1 MET HB2 H 5.228 -15.591 31.817 . . . 1.0 . . . . . . . . . . . . B . 1 MET HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1675 . 2 1 1 MET HB3 H 6.270 -16.098 33.137 . . . 1.0 . . . . . . . . . . . . B . 1 MET HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1676 . 2 1 1 MET HE1 H 1.871 -15.445 35.836 . . . 1.0 . . . . . . . . . . . . B . 1 MET HE1 . . . . . . . . . c16368_2kko 1 . 1 . 1677 . 2 1 1 MET HE2 H 2.218 -14.010 34.870 . . . 1.0 . . . . . . . . . . . . B . 1 MET HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1678 . 2 1 1 MET HE3 H 3.309 -14.480 36.173 . . . 1.0 . . . . . . . . . . . . B . 1 MET HE3 . . . . . . . . . c16368_2kko 1 . 1 . 1679 . 2 1 1 MET HG2 H 5.371 -14.284 34.523 . . . 1.0 . . . . . . . . . . . . B . 1 MET HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1680 . 2 1 1 MET HG3 H 4.296 -13.827 33.201 . . . 1.0 . . . . . . . . . . . . B . 1 MET HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1681 . 2 1 1 MET N N 7.608 -13.717 33.349 . . . 1.0 . . . . . . . . . . . . B . 1 MET N . . . . . . . . . c16368_2kko 1 . 1 . 1682 . 2 1 1 MET O O 6.212 -12.003 31.809 . . . 1.0 . . . . . . . . . . . . B . 1 MET O . . . . . . . . . c16368_2kko 1 . 1 . 1683 . 2 1 1 MET SD S 3.596 -15.848 34.248 . . . 1.0 . . . . . . . . . . . . B . 1 MET SD . . . . . . . . . c16368_2kko 1 . 1 . 1684 . 2 1 2 ALA C C 3.688 -12.755 29.137 . . . 1.0 . . . . . . . . . . . . B . 2 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1685 . 2 1 2 ALA CA C 5.178 -12.487 29.298 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 1686 . 2 1 2 ALA CB C 5.869 -12.478 27.942 . . . 1.0 . . . . . . . . . . . . B . 2 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 1687 . 2 1 2 ALA H H 5.847 -14.416 29.868 . . . 1.0 . . . . . . . . . . . . B . 2 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 1688 . 2 1 2 ALA HA H 5.312 -11.514 29.750 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 1689 . 2 1 2 ALA HB1 H 5.453 -11.691 27.330 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 1690 . 2 1 2 ALA HB2 H 5.719 -13.430 27.456 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1691 . 2 1 2 ALA HB3 H 6.928 -12.307 28.079 . . . 1.0 . . . . . . . . . . . . B . 2 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1692 . 2 1 2 ALA N N 5.787 -13.478 30.172 . . . 1.0 . . . . . . . . . . . . B . 2 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 1693 . 2 1 2 ALA O O 3.286 -13.739 28.509 . . . 1.0 . . . . . . . . . . . . B . 2 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 1694 . 2 1 3 GLY C C 0.862 -11.357 28.413 . . . 1.0 . . . . . . . . . . . . B . 3 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 1695 . 2 1 3 GLY CA C 1.436 -12.041 29.636 . . . 1.0 . . . . . . . . . . . . B . 3 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 1696 . 2 1 3 GLY H H 3.256 -11.133 30.231 . . . 1.0 . . . . . . . . . . . . B . 3 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 1697 . 2 1 3 GLY HA2 H 1.199 -13.094 29.592 . . . 1.0 . . . . . . . . . . . . B . 3 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 1698 . 2 1 3 GLY HA3 H 0.982 -11.615 30.518 . . . 1.0 . . . . . . . . . . . . B . 3 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 1699 . 2 1 3 GLY N N 2.873 -11.889 29.724 . . . 1.0 . . . . . . . . . . . . B . 3 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 1700 . 2 1 3 GLY O O 0.364 -12.016 27.500 . . . 1.0 . . . . . . . . . . . . B . 3 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 1701 . 2 1 4 GLN C C 1.311 -8.085 26.948 . . . 1.0 . . . . . . . . . . . . B . 4 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 1702 . 2 1 4 GLN CA C 0.401 -9.264 27.276 . . . 1.0 . . . . . . . . . . . . B . 4 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 1703 . 2 1 4 GLN CB C -1.013 -8.766 27.601 . . . 1.0 . . . . . . . . . . . . B . 4 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 1704 . 2 1 4 GLN CD C -2.477 -7.352 29.094 . . . 1.0 . . . . . . . . . . . . B . 4 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 1705 . 2 1 4 GLN CG C -1.089 -7.905 28.853 . . . 1.0 . . . . . . . . . . . . B . 4 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 1706 . 2 1 4 GLN H H 1.385 -9.564 29.122 . . . 1.0 . . . . . . . . . . . . B . 4 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 1707 . 2 1 4 GLN HA H 0.354 -9.915 26.415 . . . 1.0 . . . . . . . . . . . . B . 4 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 1708 . 2 1 4 GLN HB2 H -1.376 -8.183 26.769 . . . 1.0 . . . . . . . . . . . . B . 4 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1709 . 2 1 4 GLN HB3 H -1.660 -9.620 27.740 . . . 1.0 . . . . . . . . . . . . B . 4 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1710 . 2 1 4 GLN HE21 H -2.057 -5.765 27.972 . . . 1.0 . . . . . . . . . . . . B . 4 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 1711 . 2 1 4 GLN HE22 H -3.648 -5.813 28.656 . . . 1.0 . . . . . . . . . . . . B . 4 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 1712 . 2 1 4 GLN HG2 H -0.803 -8.506 29.703 . . . 1.0 . . . . . . . . . . . . B . 4 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1713 . 2 1 4 GLN HG3 H -0.401 -7.079 28.748 . . . 1.0 . . . . . . . . . . . . B . 4 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1714 . 2 1 4 GLN N N 0.942 -10.034 28.386 . . . 1.0 . . . . . . . . . . . . B . 4 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 1715 . 2 1 4 GLN NE2 N -2.756 -6.194 28.520 . . . 1.0 . . . . . . . . . . . . B . 4 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1716 . 2 1 4 GLN O O 1.773 -7.375 27.843 . . . 1.0 . . . . . . . . . . . . B . 4 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 1717 . 2 1 4 GLN OE1 O -3.297 -7.965 29.779 . . . 1.0 . . . . . . . . . . . . B . 4 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 1718 . 2 1 5 SER C C 2.080 -6.535 23.712 . . . 1.0 . . . . . . . . . . . . B . 5 SER C . . . . . . . . . c16368_2kko 1 . 1 . 1719 . 2 1 5 SER CA C 2.381 -6.780 25.186 . . . 1.0 . . . . . . . . . . . . B . 5 SER CA . . . . . . . . . c16368_2kko 1 . 1 . 1720 . 2 1 5 SER CB C 3.880 -7.045 25.383 . . . 1.0 . . . . . . . . . . . . B . 5 SER CB . . . . . . . . . c16368_2kko 1 . 1 . 1721 . 2 1 5 SER H H 1.237 -8.545 25.010 . . . 1.0 . . . . . . . . . . . . B . 5 SER H . . . . . . . . . c16368_2kko 1 . 1 . 1722 . 2 1 5 SER HA H 2.098 -5.904 25.751 . . . 1.0 . . . . . . . . . . . . B . 5 SER HA . . . . . . . . . c16368_2kko 1 . 1 . 1723 . 2 1 5 SER HB2 H 4.150 -7.957 24.873 . . . 1.0 . . . . . . . . . . . . B . 5 SER HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1724 . 2 1 5 SER HB3 H 4.444 -6.222 24.969 . . . 1.0 . . . . . . . . . . . . B . 5 SER HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1725 . 2 1 5 SER HG H 3.390 -7.169 27.282 . . . 1.0 . . . . . . . . . . . . B . 5 SER HG . . . . . . . . . c16368_2kko 1 . 1 . 1726 . 2 1 5 SER N N 1.585 -7.903 25.665 . . . 1.0 . . . . . . . . . . . . B . 5 SER N . . . . . . . . . c16368_2kko 1 . 1 . 1727 . 2 1 5 SER O O 2.451 -7.338 22.852 . . . 1.0 . . . . . . . . . . . . B . 5 SER O . . . . . . . . . c16368_2kko 1 . 1 . 1728 . 2 1 5 SER OG O 4.206 -7.176 26.758 . . . 1.0 . . . . . . . . . . . . B . 5 SER OG . . . . . . . . . c16368_2kko 1 . 1 . 1729 . 2 1 6 ASP C C 2.106 -4.380 21.332 . . . 1.0 . . . . . . . . . . . . B . 6 ASP C . . . . . . . . . c16368_2kko 1 . 1 . 1730 . 2 1 6 ASP CA C 0.994 -5.122 22.060 . . . 1.0 . . . . . . . . . . . . B . 6 ASP CA . . . . . . . . . c16368_2kko 1 . 1 . 1731 . 2 1 6 ASP CB C -0.294 -4.291 22.049 . . . 1.0 . . . . . . . . . . . . B . 6 ASP CB . . . . . . . . . c16368_2kko 1 . 1 . 1732 . 2 1 6 ASP CG C -1.472 -5.043 22.636 . . . 1.0 . . . . . . . . . . . . B . 6 ASP CG . . . . . . . . . c16368_2kko 1 . 1 . 1733 . 2 1 6 ASP H H 1.158 -4.815 24.151 . . . 1.0 . . . . . . . . . . . . B . 6 ASP H . . . . . . . . . c16368_2kko 1 . 1 . 1734 . 2 1 6 ASP HA H 0.811 -6.056 21.549 . . . 1.0 . . . . . . . . . . . . B . 6 ASP HA . . . . . . . . . c16368_2kko 1 . 1 . 1735 . 2 1 6 ASP HB2 H -0.142 -3.392 22.626 . . . 1.0 . . . . . . . . . . . . B . 6 ASP HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1736 . 2 1 6 ASP HB3 H -0.534 -4.024 21.029 . . . 1.0 . . . . . . . . . . . . B . 6 ASP HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1737 . 2 1 6 ASP N N 1.396 -5.437 23.426 . . . 1.0 . . . . . . . . . . . . B . 6 ASP N . . . . . . . . . c16368_2kko 1 . 1 . 1738 . 2 1 6 ASP O O 2.135 -3.149 21.297 . . . 1.0 . . . . . . . . . . . . B . 6 ASP O . . . . . . . . . c16368_2kko 1 . 1 . 1739 . 2 1 6 ASP OD1 O -2.111 -5.815 21.900 . . . 1.0 . . . . . . . . . . . . B . 6 ASP OD1 . . . . . . . . . c16368_2kko 1 . 1 . 1740 . 2 1 6 ASP OD2 O -1.760 -4.868 23.843 . . . 1.0 . . . . . . . . . . . . B . 6 ASP OD2 . . . . . . . . . c16368_2kko 1 . 1 . 1741 . 2 1 7 ARG C C 3.919 -4.516 18.580 . . . 1.0 . . . . . . . . . . . . B . 7 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 1742 . 2 1 7 ARG CA C 4.183 -4.578 20.082 . . . 1.0 . . . . . . . . . . . . B . 7 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 1743 . 2 1 7 ARG CB C 5.425 -5.426 20.368 . . . 1.0 . . . . . . . . . . . . B . 7 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 1744 . 2 1 7 ARG CD C 7.926 -5.604 20.426 . . . 1.0 . . . . . . . . . . . . B . 7 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 1745 . 2 1 7 ARG CG C 6.738 -4.689 20.173 . . . 1.0 . . . . . . . . . . . . B . 7 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 1746 . 2 1 7 ARG CZ C 9.982 -4.558 19.526 . . . 1.0 . . . . . . . . . . . . B . 7 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 1747 . 2 1 7 ARG H H 2.940 -6.122 20.826 . . . 1.0 . . . . . . . . . . . . B . 7 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 1748 . 2 1 7 ARG HA H 4.341 -3.577 20.454 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 1749 . 2 1 7 ARG HB2 H 5.381 -5.772 21.390 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1750 . 2 1 7 ARG HB3 H 5.416 -6.283 19.708 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1751 . 2 1 7 ARG HD2 H 7.755 -6.150 21.342 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1752 . 2 1 7 ARG HD3 H 8.012 -6.299 19.604 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 1753 . 2 1 7 ARG HE H 9.433 -4.557 21.453 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 1754 . 2 1 7 ARG HG2 H 6.786 -4.324 19.159 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1755 . 2 1 7 ARG HG3 H 6.780 -3.858 20.862 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1756 . 2 1 7 ARG HH11 H 8.843 -5.474 18.126 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 1757 . 2 1 7 ARG HH12 H 10.290 -4.730 17.521 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 1758 . 2 1 7 ARG HH21 H 11.327 -3.561 20.664 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 1759 . 2 1 7 ARG HH22 H 11.703 -3.628 18.969 . . . 1.0 . . . . . . . . . . . . B . 7 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 1760 . 2 1 7 ARG N N 3.034 -5.142 20.775 . . . 1.0 . . . . . . . . . . . . B . 7 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 1761 . 2 1 7 ARG NE N 9.177 -4.855 20.548 . . . 1.0 . . . . . . . . . . . . B . 7 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 1762 . 2 1 7 ARG NH1 N 9.677 -4.953 18.295 . . . 1.0 . . . . . . . . . . . . B . 7 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 1763 . 2 1 7 ARG NH2 N 11.092 -3.863 19.740 . . . 1.0 . . . . . . . . . . . . B . 7 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 1764 . 2 1 7 ARG O O 4.526 -3.726 17.857 . . . 1.0 . . . . . . . . . . . . B . 7 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 1765 . 2 1 8 LYS C C 2.028 -4.146 16.206 . . . 1.0 . . . . . . . . . . . . B . 8 LYS C . . . . . . . . . c16368_2kko 1 . 1 . 1766 . 2 1 8 LYS CA C 2.660 -5.443 16.703 . . . 1.0 . . . . . . . . . . . . B . 8 LYS CA . . . . . . . . . c16368_2kko 1 . 1 . 1767 . 2 1 8 LYS CB C 1.709 -6.619 16.459 . . . 1.0 . . . . . . . . . . . . B . 8 LYS CB . . . . . . . . . c16368_2kko 1 . 1 . 1768 . 2 1 8 LYS CD C -0.452 -7.770 17.047 . . . 1.0 . . . . . . . . . . . . B . 8 LYS CD . . . . . . . . . c16368_2kko 1 . 1 . 1769 . 2 1 8 LYS CE C -1.748 -7.681 17.840 . . . 1.0 . . . . . . . . . . . . B . 8 LYS CE . . . . . . . . . c16368_2kko 1 . 1 . 1770 . 2 1 8 LYS CG C 0.410 -6.533 17.248 . . . 1.0 . . . . . . . . . . . . B . 8 LYS CG . . . . . . . . . c16368_2kko 1 . 1 . 1771 . 2 1 8 LYS H H 2.551 -5.962 18.754 . . . 1.0 . . . . . . . . . . . . B . 8 LYS H . . . . . . . . . c16368_2kko 1 . 1 . 1772 . 2 1 8 LYS HA H 3.574 -5.617 16.152 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HA . . . . . . . . . c16368_2kko 1 . 1 . 1773 . 2 1 8 LYS HB2 H 1.465 -6.656 15.409 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1774 . 2 1 8 LYS HB3 H 2.212 -7.533 16.736 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1775 . 2 1 8 LYS HD2 H -0.687 -7.867 15.999 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1776 . 2 1 8 LYS HD3 H 0.103 -8.636 17.376 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HD3 . . . . . . . . . c16368_2kko 1 . 1 . 1777 . 2 1 8 LYS HE2 H -1.506 -7.583 18.886 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1778 . 2 1 8 LYS HE3 H -2.294 -6.806 17.516 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HE3 . . . . . . . . . c16368_2kko 1 . 1 . 1779 . 2 1 8 LYS HG2 H 0.645 -6.438 18.297 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1780 . 2 1 8 LYS HG3 H -0.141 -5.663 16.920 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1781 . 2 1 8 LYS HZ1 H -3.527 -8.733 18.132 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HZ1 . . . . . . . . . c16368_2kko 1 . 1 . 1782 . 2 1 8 LYS HZ2 H -2.154 -9.722 18.074 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HZ2 . . . . . . . . . c16368_2kko 1 . 1 . 1783 . 2 1 8 LYS HZ3 H -2.781 -9.059 16.645 . . . 1.0 . . . . . . . . . . . . B . 8 LYS HZ3 . . . . . . . . . c16368_2kko 1 . 1 . 1784 . 2 1 8 LYS N N 3.003 -5.361 18.120 . . . 1.0 . . . . . . . . . . . . B . 8 LYS N . . . . . . . . . c16368_2kko 1 . 1 . 1785 . 2 1 8 LYS NZ N -2.608 -8.882 17.659 . . . 1.0 . . . . . . . . . . . . B . 8 LYS NZ . . . . . . . . . c16368_2kko 1 . 1 . 1786 . 2 1 8 LYS O O 2.066 -3.847 15.014 . . . 1.0 . . . . . . . . . . . . B . 8 LYS O . . . . . . . . . c16368_2kko 1 . 1 . 1787 . 2 1 9 ALA C C 1.766 -1.161 16.080 . . . 1.0 . . . . . . . . . . . . B . 9 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1788 . 2 1 9 ALA CA C 0.804 -2.123 16.775 . . . 1.0 . . . . . . . . . . . . B . 9 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 1789 . 2 1 9 ALA CB C 0.204 -1.477 18.012 . . . 1.0 . . . . . . . . . . . . B . 9 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 1790 . 2 1 9 ALA H H 1.500 -3.648 18.065 . . . 1.0 . . . . . . . . . . . . B . 9 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 1791 . 2 1 9 ALA HA H -0.005 -2.358 16.096 . . . 1.0 . . . . . . . . . . . . B . 9 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 1792 . 2 1 9 ALA HB1 H -0.349 -0.594 17.723 . . . 1.0 . . . . . . . . . . . . B . 9 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 1793 . 2 1 9 ALA HB2 H 0.994 -1.201 18.693 . . . 1.0 . . . . . . . . . . . . B . 9 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1794 . 2 1 9 ALA HB3 H -0.463 -2.175 18.496 . . . 1.0 . . . . . . . . . . . . B . 9 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1795 . 2 1 9 ALA N N 1.467 -3.372 17.126 . . . 1.0 . . . . . . . . . . . . B . 9 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 1796 . 2 1 9 ALA O O 1.427 -0.567 15.058 . . . 1.0 . . . . . . . . . . . . B . 9 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 1797 . 2 1 10 ALA C C 4.372 -0.669 14.639 . . . 1.0 . . . . . . . . . . . . B . 10 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1798 . 2 1 10 ALA CA C 4.000 -0.179 16.037 . . . 1.0 . . . . . . . . . . . . B . 10 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 1799 . 2 1 10 ALA CB C 5.233 -0.136 16.932 . . . 1.0 . . . . . . . . . . . . B . 10 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 1800 . 2 1 10 ALA H H 3.167 -1.503 17.470 . . . 1.0 . . . . . . . . . . . . B . 10 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 1801 . 2 1 10 ALA HA H 3.602 0.822 15.964 . . . 1.0 . . . . . . . . . . . . B . 10 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 1802 . 2 1 10 ALA HB1 H 4.964 0.262 17.899 . . . 1.0 . . . . . . . . . . . . B . 10 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 1803 . 2 1 10 ALA HB2 H 5.985 0.495 16.480 . . . 1.0 . . . . . . . . . . . . B . 10 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1804 . 2 1 10 ALA HB3 H 5.626 -1.134 17.052 . . . 1.0 . . . . . . . . . . . . B . 10 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1805 . 2 1 10 ALA N N 2.970 -1.029 16.631 . . . 1.0 . . . . . . . . . . . . B . 10 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 1806 . 2 1 10 ALA O O 4.694 0.125 13.746 . . . 1.0 . . . . . . . . . . . . B . 10 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 1807 . 2 1 11 LEU C C 3.572 -2.160 12.135 . . . 1.0 . . . . . . . . . . . . B . 11 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 1808 . 2 1 11 LEU CA C 4.614 -2.592 13.165 . . . 1.0 . . . . . . . . . . . . B . 11 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 1809 . 2 1 11 LEU CB C 4.663 -4.126 13.325 . . . 1.0 . . . . . . . . . . . . B . 11 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 1810 . 2 1 11 LEU CD1 C 4.166 -5.094 11.043 . . . 1.0 . . . . . . . . . . . . B . 11 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 1811 . 2 1 11 LEU CD2 C 6.477 -4.311 11.588 . . . 1.0 . . . . . . . . . . . . B . 11 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1812 . 2 1 11 LEU CG C 5.208 -4.943 12.140 . . . 1.0 . . . . . . . . . . . . B . 11 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 1813 . 2 1 11 LEU H H 3.994 -2.552 15.183 . . . 1.0 . . . . . . . . . . . . B . 11 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 1814 . 2 1 11 LEU HA H 5.584 -2.231 12.856 . . . 1.0 . . . . . . . . . . . . B . 11 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 1815 . 2 1 11 LEU HB2 H 5.273 -4.349 14.188 . . . 1.0 . . . . . . . . . . . . B . 11 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1816 . 2 1 11 LEU HB3 H 3.659 -4.468 13.530 . . . 1.0 . . . . . . . . . . . . B . 11 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1817 . 2 1 11 LEU HD11 H 4.568 -5.696 10.242 . . . 1.0 . . . . . . . . . . . . B . 11 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 1818 . 2 1 11 LEU HD12 H 3.902 -4.118 10.662 . . . 1.0 . . . . . . . . . . . . B . 11 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 1819 . 2 1 11 LEU HD13 H 3.286 -5.572 11.447 . . . 1.0 . . . . . . . . . . . . B . 11 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 1820 . 2 1 11 LEU HD21 H 6.825 -4.882 10.739 . . . 1.0 . . . . . . . . . . . . B . 11 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 1821 . 2 1 11 LEU HD22 H 7.238 -4.304 12.353 . . . 1.0 . . . . . . . . . . . . B . 11 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 1822 . 2 1 11 LEU HD23 H 6.267 -3.297 11.278 . . . 1.0 . . . . . . . . . . . . B . 11 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 1823 . 2 1 11 LEU HG H 5.459 -5.934 12.489 . . . 1.0 . . . . . . . . . . . . B . 11 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 1824 . 2 1 11 LEU N N 4.295 -1.981 14.446 . . . 1.0 . . . . . . . . . . . . B . 11 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 1825 . 2 1 11 LEU O O 3.893 -1.895 10.977 . . . 1.0 . . . . . . . . . . . . B . 11 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 1826 . 2 1 12 LEU C C 1.361 -0.163 11.334 . . . 1.0 . . . . . . . . . . . . B . 12 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 1827 . 2 1 12 LEU CA C 1.235 -1.636 11.715 . . . 1.0 . . . . . . . . . . . . B . 12 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 1828 . 2 1 12 LEU CB C -0.115 -1.899 12.385 . . . 1.0 . . . . . . . . . . . . B . 12 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 1829 . 2 1 12 LEU CD1 C -1.787 -3.518 13.314 . . . 1.0 . . . . . . . . . . . . B . 12 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 1830 . 2 1 12 LEU CD2 C -0.319 -4.210 11.414 . . . 1.0 . . . . . . . . . . . . B . 12 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1831 . 2 1 12 LEU CG C -0.413 -3.371 12.682 . . . 1.0 . . . . . . . . . . . . B . 12 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 1832 . 2 1 12 LEU H H 2.140 -2.245 13.526 . . . 1.0 . . . . . . . . . . . . B . 12 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 1833 . 2 1 12 LEU HA H 1.296 -2.229 10.814 . . . 1.0 . . . . . . . . . . . . B . 12 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 1834 . 2 1 12 LEU HB2 H -0.143 -1.354 13.319 . . . 1.0 . . . . . . . . . . . . B . 12 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1835 . 2 1 12 LEU HB3 H -0.894 -1.519 11.742 . . . 1.0 . . . . . . . . . . . . B . 12 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1836 . 2 1 12 LEU HD11 H -2.542 -3.159 12.628 . . . 1.0 . . . . . . . . . . . . B . 12 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 1837 . 2 1 12 LEU HD12 H -1.825 -2.940 14.226 . . . 1.0 . . . . . . . . . . . . B . 12 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 1838 . 2 1 12 LEU HD13 H -1.971 -4.557 13.539 . . . 1.0 . . . . . . . . . . . . B . 12 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 1839 . 2 1 12 LEU HD21 H 0.671 -4.116 10.992 . . . 1.0 . . . . . . . . . . . . B . 12 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 1840 . 2 1 12 LEU HD22 H -1.049 -3.866 10.697 . . . 1.0 . . . . . . . . . . . . B . 12 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 1841 . 2 1 12 LEU HD23 H -0.510 -5.245 11.654 . . . 1.0 . . . . . . . . . . . . B . 12 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 1842 . 2 1 12 LEU HG H 0.319 -3.743 13.385 . . . 1.0 . . . . . . . . . . . . B . 12 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 1843 . 2 1 12 LEU N N 2.328 -2.047 12.583 . . . 1.0 . . . . . . . . . . . . B . 12 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 1844 . 2 1 12 LEU O O 0.945 0.235 10.247 . . . 1.0 . . . . . . . . . . . . B . 12 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 1845 . 2 1 13 ASP C C 3.145 2.173 10.738 . . . 1.0 . . . . . . . . . . . . B . 13 ASP C . . . . . . . . . c16368_2kko 1 . 1 . 1846 . 2 1 13 ASP CA C 2.196 2.050 11.923 . . . 1.0 . . . . . . . . . . . . B . 13 ASP CA . . . . . . . . . c16368_2kko 1 . 1 . 1847 . 2 1 13 ASP CB C 2.791 2.789 13.126 . . . 1.0 . . . . . . . . . . . . B . 13 ASP CB . . . . . . . . . c16368_2kko 1 . 1 . 1848 . 2 1 13 ASP CG C 1.756 3.186 14.159 . . . 1.0 . . . . . . . . . . . . B . 13 ASP CG . . . . . . . . . c16368_2kko 1 . 1 . 1849 . 2 1 13 ASP H H 2.195 0.282 13.103 . . . 1.0 . . . . . . . . . . . . B . 13 ASP H . . . . . . . . . c16368_2kko 1 . 1 . 1850 . 2 1 13 ASP HA H 1.255 2.506 11.660 . . . 1.0 . . . . . . . . . . . . B . 13 ASP HA . . . . . . . . . c16368_2kko 1 . 1 . 1851 . 2 1 13 ASP HB2 H 3.515 2.149 13.605 . . . 1.0 . . . . . . . . . . . . B . 13 ASP HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1852 . 2 1 13 ASP HB3 H 3.285 3.684 12.776 . . . 1.0 . . . . . . . . . . . . B . 13 ASP HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1853 . 2 1 13 ASP N N 1.941 0.641 12.225 . . . 1.0 . . . . . . . . . . . . B . 13 ASP N . . . . . . . . . c16368_2kko 1 . 1 . 1854 . 2 1 13 ASP O O 2.935 2.988 9.839 . . . 1.0 . . . . . . . . . . . . B . 13 ASP O . . . . . . . . . c16368_2kko 1 . 1 . 1855 . 2 1 13 ASP OD1 O 0.930 4.076 13.870 . . . 1.0 . . . . . . . . . . . . B . 13 ASP OD1 . . . . . . . . . c16368_2kko 1 . 1 . 1856 . 2 1 13 ASP OD2 O 1.781 2.628 15.277 . . . 1.0 . . . . . . . . . . . . B . 13 ASP OD2 . . . . . . . . . c16368_2kko 1 . 1 . 1857 . 2 1 14 GLN C C 4.476 0.911 8.342 . . . 1.0 . . . . . . . . . . . . B . 14 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 1858 . 2 1 14 GLN CA C 5.152 1.334 9.646 . . . 1.0 . . . . . . . . . . . . B . 14 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 1859 . 2 1 14 GLN CB C 6.318 0.394 9.968 . . . 1.0 . . . . . . . . . . . . B . 14 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 1860 . 2 1 14 GLN CD C 8.024 1.705 8.624 . . . 1.0 . . . . . . . . . . . . B . 14 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 1861 . 2 1 14 GLN CG C 7.387 0.350 8.885 . . . 1.0 . . . . . . . . . . . . B . 14 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 1862 . 2 1 14 GLN H H 4.321 0.745 11.510 . . . 1.0 . . . . . . . . . . . . B . 14 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 1863 . 2 1 14 GLN HA H 5.535 2.338 9.527 . . . 1.0 . . . . . . . . . . . . B . 14 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 1864 . 2 1 14 GLN HB2 H 6.783 0.717 10.889 . . . 1.0 . . . . . . . . . . . . B . 14 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1865 . 2 1 14 GLN HB3 H 5.931 -0.604 10.102 . . . 1.0 . . . . . . . . . . . . B . 14 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1866 . 2 1 14 GLN HE21 H 8.345 1.222 6.723 . . . 1.0 . . . . . . . . . . . . B . 14 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 1867 . 2 1 14 GLN HE22 H 8.871 2.796 7.198 . . . 1.0 . . . . . . . . . . . . B . 14 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 1868 . 2 1 14 GLN HG2 H 8.162 -0.337 9.192 . . . 1.0 . . . . . . . . . . . . B . 14 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1869 . 2 1 14 GLN HG3 H 6.937 -0.003 7.970 . . . 1.0 . . . . . . . . . . . . B . 14 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1870 . 2 1 14 GLN N N 4.191 1.351 10.743 . . . 1.0 . . . . . . . . . . . . B . 14 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 1871 . 2 1 14 GLN NE2 N 8.455 1.931 7.392 . . . 1.0 . . . . . . . . . . . . B . 14 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 1872 . 2 1 14 GLN O O 4.745 1.473 7.281 . . . 1.0 . . . . . . . . . . . . B . 14 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 1873 . 2 1 14 GLN OE1 O 8.117 2.547 9.518 . . . 1.0 . . . . . . . . . . . . B . 14 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 1874 . 2 1 15 VAL C C 1.917 0.536 6.730 . . . 1.0 . . . . . . . . . . . . B . 15 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 1875 . 2 1 15 VAL CA C 2.858 -0.548 7.261 . . . 1.0 . . . . . . . . . . . . B . 15 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 1876 . 2 1 15 VAL CB C 2.055 -1.829 7.582 . . . 1.0 . . . . . . . . . . . . B . 15 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 1877 . 2 1 15 VAL CG1 C 1.280 -2.308 6.363 . . . 1.0 . . . . . . . . . . . . B . 15 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 1878 . 2 1 15 VAL CG2 C 2.977 -2.930 8.085 . . . 1.0 . . . . . . . . . . . . B . 15 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 1879 . 2 1 15 VAL H H 3.415 -0.484 9.305 . . . 1.0 . . . . . . . . . . . . B . 15 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 1880 . 2 1 15 VAL HA H 3.583 -0.786 6.495 . . . 1.0 . . . . . . . . . . . . B . 15 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 1881 . 2 1 15 VAL HB H 1.348 -1.598 8.364 . . . 1.0 . . . . . . . . . . . . B . 15 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 1882 . 2 1 15 VAL HG11 H 0.591 -1.538 6.050 . . . 1.0 . . . . . . . . . . . . B . 15 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 1883 . 2 1 15 VAL HG12 H 0.730 -3.202 6.616 . . . 1.0 . . . . . . . . . . . . B . 15 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 1884 . 2 1 15 VAL HG13 H 1.969 -2.524 5.560 . . . 1.0 . . . . . . . . . . . . B . 15 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 1885 . 2 1 15 VAL HG21 H 3.512 -2.581 8.958 . . . 1.0 . . . . . . . . . . . . B . 15 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 1886 . 2 1 15 VAL HG22 H 3.683 -3.192 7.312 . . . 1.0 . . . . . . . . . . . . B . 15 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 1887 . 2 1 15 VAL HG23 H 2.389 -3.796 8.346 . . . 1.0 . . . . . . . . . . . . B . 15 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 1888 . 2 1 15 VAL N N 3.587 -0.070 8.431 . . . 1.0 . . . . . . . . . . . . B . 15 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 1889 . 2 1 15 VAL O O 1.803 0.740 5.522 . . . 1.0 . . . . . . . . . . . . B . 15 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 1890 . 2 1 16 ALA C C 1.160 3.453 6.573 . . . 1.0 . . . . . . . . . . . . B . 16 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1891 . 2 1 16 ALA CA C 0.374 2.338 7.258 . . . 1.0 . . . . . . . . . . . . B . 16 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 1892 . 2 1 16 ALA CB C -0.358 2.876 8.478 . . . 1.0 . . . . . . . . . . . . B . 16 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 1893 . 2 1 16 ALA H H 1.353 1.010 8.590 . . . 1.0 . . . . . . . . . . . . B . 16 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 1894 . 2 1 16 ALA HA H -0.360 1.951 6.567 . . . 1.0 . . . . . . . . . . . . B . 16 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 1895 . 2 1 16 ALA HB1 H -1.025 3.669 8.175 . . . 1.0 . . . . . . . . . . . . B . 16 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 1896 . 2 1 16 ALA HB2 H 0.359 3.259 9.190 . . . 1.0 . . . . . . . . . . . . B . 16 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1897 . 2 1 16 ALA HB3 H -0.930 2.081 8.934 . . . 1.0 . . . . . . . . . . . . B . 16 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1898 . 2 1 16 ALA N N 1.255 1.240 7.638 . . . 1.0 . . . . . . . . . . . . B . 16 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 1899 . 2 1 16 ALA O O 0.649 4.137 5.686 . . . 1.0 . . . . . . . . . . . . B . 16 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 1900 . 2 1 17 ARG C C 3.555 4.383 4.952 . . . 1.0 . . . . . . . . . . . . B . 17 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 1901 . 2 1 17 ARG CA C 3.286 4.642 6.436 . . . 1.0 . . . . . . . . . . . . B . 17 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 1902 . 2 1 17 ARG CB C 4.597 4.668 7.221 . . . 1.0 . . . . . . . . . . . . B . 17 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 1903 . 2 1 17 ARG CD C 6.723 5.841 7.801 . . . 1.0 . . . . . . . . . . . . B . 17 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 1904 . 2 1 17 ARG CG C 5.450 5.901 6.976 . . . 1.0 . . . . . . . . . . . . B . 17 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 1905 . 2 1 17 ARG CZ C 8.590 7.299 8.470 . . . 1.0 . . . . . . . . . . . . B . 17 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 1906 . 2 1 17 ARG H H 2.755 3.027 7.693 . . . 1.0 . . . . . . . . . . . . B . 17 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 1907 . 2 1 17 ARG HA H 2.793 5.596 6.541 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 1908 . 2 1 17 ARG HB2 H 4.368 4.625 8.274 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1909 . 2 1 17 ARG HB3 H 5.178 3.798 6.954 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1910 . 2 1 17 ARG HD2 H 6.463 5.577 8.815 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1911 . 2 1 17 ARG HD3 H 7.366 5.079 7.387 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 1912 . 2 1 17 ARG HE H 7.046 7.867 7.326 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 1913 . 2 1 17 ARG HG2 H 5.709 5.950 5.928 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1914 . 2 1 17 ARG HG3 H 4.890 6.779 7.255 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1915 . 2 1 17 ARG HH11 H 8.718 5.395 9.151 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 1916 . 2 1 17 ARG HH12 H 10.022 6.437 9.633 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 1917 . 2 1 17 ARG HH21 H 8.741 9.256 7.962 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 1918 . 2 1 17 ARG HH22 H 10.038 8.635 8.938 . . . 1.0 . . . . . . . . . . . . B . 17 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 1919 . 2 1 17 ARG N N 2.410 3.616 6.987 . . . 1.0 . . . . . . . . . . . . B . 17 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 1920 . 2 1 17 ARG NE N 7.443 7.110 7.819 . . . 1.0 . . . . . . . . . . . . B . 17 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 1921 . 2 1 17 ARG NH1 N 9.153 6.296 9.136 . . . 1.0 . . . . . . . . . . . . B . 17 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 1922 . 2 1 17 ARG NH2 N 9.170 8.492 8.459 . . . 1.0 . . . . . . . . . . . . B . 17 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 1923 . 2 1 17 ARG O O 3.397 5.280 4.115 . . . 1.0 . . . . . . . . . . . . B . 17 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 1924 . 2 1 18 VAL C C 2.919 2.791 2.431 . . . 1.0 . . . . . . . . . . . . B . 18 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 1925 . 2 1 18 VAL CA C 4.214 2.791 3.237 . . . 1.0 . . . . . . . . . . . . B . 18 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 1926 . 2 1 18 VAL CB C 4.922 1.415 3.102 . . . 1.0 . . . . . . . . . . . . B . 18 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 1927 . 2 1 18 VAL CG1 C 6.192 1.378 3.938 . . . 1.0 . . . . . . . . . . . . B . 18 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 1928 . 2 1 18 VAL CG2 C 4.003 0.268 3.488 . . . 1.0 . . . . . . . . . . . . B . 18 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 1929 . 2 1 18 VAL H H 4.034 2.471 5.330 . . . 1.0 . . . . . . . . . . . . B . 18 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 1930 . 2 1 18 VAL HA H 4.869 3.549 2.830 . . . 1.0 . . . . . . . . . . . . B . 18 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 1931 . 2 1 18 VAL HB H 5.204 1.285 2.067 . . . 1.0 . . . . . . . . . . . . B . 18 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 1932 . 2 1 18 VAL HG11 H 6.681 0.424 3.810 . . . 1.0 . . . . . . . . . . . . B . 18 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 1933 . 2 1 18 VAL HG12 H 5.940 1.516 4.979 . . . 1.0 . . . . . . . . . . . . B . 18 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 1934 . 2 1 18 VAL HG13 H 6.855 2.170 3.621 . . . 1.0 . . . . . . . . . . . . B . 18 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 1935 . 2 1 18 VAL HG21 H 3.711 0.376 4.522 . . . 1.0 . . . . . . . . . . . . B . 18 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 1936 . 2 1 18 VAL HG22 H 4.520 -0.671 3.356 . . . 1.0 . . . . . . . . . . . . B . 18 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 1937 . 2 1 18 VAL HG23 H 3.123 0.287 2.862 . . . 1.0 . . . . . . . . . . . . B . 18 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 1938 . 2 1 18 VAL N N 3.940 3.150 4.625 . . . 1.0 . . . . . . . . . . . . B . 18 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 1939 . 2 1 18 VAL O O 2.925 3.040 1.226 . . . 1.0 . . . . . . . . . . . . B . 18 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 1940 . 2 1 19 GLY C C 0.154 3.982 2.018 . . . 1.0 . . . . . . . . . . . . B . 19 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 1941 . 2 1 19 GLY CA C 0.509 2.582 2.475 . . . 1.0 . . . . . . . . . . . . B . 19 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 1942 . 2 1 19 GLY H H 1.870 2.308 4.068 . . . 1.0 . . . . . . . . . . . . B . 19 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 1943 . 2 1 19 GLY HA2 H 0.518 1.924 1.619 . . . 1.0 . . . . . . . . . . . . B . 19 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 1944 . 2 1 19 GLY HA3 H -0.242 2.240 3.173 . . . 1.0 . . . . . . . . . . . . B . 19 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 1945 . 2 1 19 GLY N N 1.806 2.536 3.115 . . . 1.0 . . . . . . . . . . . . B . 19 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 1946 . 2 1 19 GLY O O -0.386 4.163 0.930 . . . 1.0 . . . . . . . . . . . . B . 19 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 1947 . 2 1 20 LYS C C 1.038 6.755 1.261 . . . 1.0 . . . . . . . . . . . . B . 20 LYS C . . . . . . . . . c16368_2kko 1 . 1 . 1948 . 2 1 20 LYS CA C 0.231 6.370 2.493 . . . 1.0 . . . . . . . . . . . . B . 20 LYS CA . . . . . . . . . c16368_2kko 1 . 1 . 1949 . 2 1 20 LYS CB C 0.598 7.305 3.647 . . . 1.0 . . . . . . . . . . . . B . 20 LYS CB . . . . . . . . . c16368_2kko 1 . 1 . 1950 . 2 1 20 LYS CD C 0.061 8.195 5.922 . . . 1.0 . . . . . . . . . . . . B . 20 LYS CD . . . . . . . . . c16368_2kko 1 . 1 . 1951 . 2 1 20 LYS CE C -0.792 8.044 7.167 . . . 1.0 . . . . . . . . . . . . B . 20 LYS CE . . . . . . . . . c16368_2kko 1 . 1 . 1952 . 2 1 20 LYS CG C -0.247 7.121 4.895 . . . 1.0 . . . . . . . . . . . . B . 20 LYS CG . . . . . . . . . c16368_2kko 1 . 1 . 1953 . 2 1 20 LYS H H 0.873 4.761 3.716 . . . 1.0 . . . . . . . . . . . . B . 20 LYS H . . . . . . . . . c16368_2kko 1 . 1 . 1954 . 2 1 20 LYS HA H -0.820 6.479 2.270 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HA . . . . . . . . . c16368_2kko 1 . 1 . 1955 . 2 1 20 LYS HB2 H 1.631 7.139 3.913 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1956 . 2 1 20 LYS HB3 H 0.484 8.325 3.313 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1957 . 2 1 20 LYS HD2 H 1.101 8.122 6.204 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HD2 . . . . . . . . . c16368_2kko 1 . 1 . 1958 . 2 1 20 LYS HD3 H -0.128 9.164 5.481 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HD3 . . . . . . . . . c16368_2kko 1 . 1 . 1959 . 2 1 20 LYS HE2 H -1.833 8.040 6.877 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HE2 . . . . . . . . . c16368_2kko 1 . 1 . 1960 . 2 1 20 LYS HE3 H -0.548 7.106 7.647 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HE3 . . . . . . . . . c16368_2kko 1 . 1 . 1961 . 2 1 20 LYS HG2 H -1.290 7.179 4.626 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HG2 . . . . . . . . . c16368_2kko 1 . 1 . 1962 . 2 1 20 LYS HG3 H -0.035 6.154 5.325 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HG3 . . . . . . . . . c16368_2kko 1 . 1 . 1963 . 2 1 20 LYS HZ1 H -0.884 10.058 7.716 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HZ1 . . . . . . . . . c16368_2kko 1 . 1 . 1964 . 2 1 20 LYS HZ2 H 0.451 9.231 8.355 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HZ2 . . . . . . . . . c16368_2kko 1 . 1 . 1965 . 2 1 20 LYS HZ3 H -1.092 8.979 9.011 . . . 1.0 . . . . . . . . . . . . B . 20 LYS HZ3 . . . . . . . . . c16368_2kko 1 . 1 . 1966 . 2 1 20 LYS N N 0.473 4.974 2.846 . . . 1.0 . . . . . . . . . . . . B . 20 LYS N . . . . . . . . . c16368_2kko 1 . 1 . 1967 . 2 1 20 LYS NZ N -0.565 9.155 8.128 . . . 1.0 . . . . . . . . . . . . B . 20 LYS NZ . . . . . . . . . c16368_2kko 1 . 1 . 1968 . 2 1 20 LYS O O 0.550 7.465 0.382 . . . 1.0 . . . . . . . . . . . . B . 20 LYS O . . . . . . . . . c16368_2kko 1 . 1 . 1969 . 2 1 21 ALA C C 2.563 5.954 -1.216 . . . 1.0 . . . . . . . . . . . . B . 21 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1970 . 2 1 21 ALA CA C 3.146 6.549 0.066 . . . 1.0 . . . . . . . . . . . . B . 21 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 1971 . 2 1 21 ALA CB C 4.540 6.002 0.330 . . . 1.0 . . . . . . . . . . . . B . 21 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 1972 . 2 1 21 ALA H H 2.619 5.739 1.954 . . . 1.0 . . . . . . . . . . . . B . 21 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 1973 . 2 1 21 ALA HA H 3.221 7.622 -0.049 . . . 1.0 . . . . . . . . . . . . B . 21 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 1974 . 2 1 21 ALA HB1 H 4.489 4.930 0.450 . . . 1.0 . . . . . . . . . . . . B . 21 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 1975 . 2 1 21 ALA HB2 H 4.938 6.447 1.231 . . . 1.0 . . . . . . . . . . . . B . 21 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1976 . 2 1 21 ALA HB3 H 5.185 6.240 -0.503 . . . 1.0 . . . . . . . . . . . . B . 21 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1977 . 2 1 21 ALA N N 2.278 6.281 1.205 . . . 1.0 . . . . . . . . . . . . B . 21 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 1978 . 2 1 21 ALA O O 2.691 6.533 -2.295 . . . 1.0 . . . . . . . . . . . . B . 21 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 1979 . 2 1 22 LEU C C -0.086 4.687 -2.549 . . . 1.0 . . . . . . . . . . . . B . 22 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 1980 . 2 1 22 LEU CA C 1.300 4.129 -2.229 . . . 1.0 . . . . . . . . . . . . B . 22 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 1981 . 2 1 22 LEU CB C 1.201 2.621 -1.965 . . . 1.0 . . . . . . . . . . . . B . 22 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 1982 . 2 1 22 LEU CD1 C 2.305 0.437 -1.434 . . . 1.0 . . . . . . . . . . . . B . 22 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 1983 . 2 1 22 LEU CD2 C 3.382 2.019 -3.044 . . . 1.0 . . . . . . . . . . . . B . 22 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 1984 . 2 1 22 LEU CG C 2.535 1.898 -1.785 . . . 1.0 . . . . . . . . . . . . B . 22 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 1985 . 2 1 22 LEU H H 1.797 4.417 -0.189 . . . 1.0 . . . . . . . . . . . . B . 22 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 1986 . 2 1 22 LEU HA H 1.946 4.293 -3.078 . . . 1.0 . . . . . . . . . . . . B . 22 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 1987 . 2 1 22 LEU HB2 H 0.613 2.473 -1.071 . . . 1.0 . . . . . . . . . . . . B . 22 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 1988 . 2 1 22 LEU HB3 H 0.681 2.166 -2.796 . . . 1.0 . . . . . . . . . . . . B . 22 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 1989 . 2 1 22 LEU HD11 H 1.762 -0.045 -2.233 . . . 1.0 . . . . . . . . . . . . B . 22 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 1990 . 2 1 22 LEU HD12 H 1.733 0.372 -0.520 . . . 1.0 . . . . . . . . . . . . B . 22 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 1991 . 2 1 22 LEU HD13 H 3.257 -0.054 -1.299 . . . 1.0 . . . . . . . . . . . . B . 22 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 1992 . 2 1 22 LEU HD21 H 2.845 1.596 -3.881 . . . 1.0 . . . . . . . . . . . . B . 22 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 1993 . 2 1 22 LEU HD22 H 4.310 1.485 -2.905 . . . 1.0 . . . . . . . . . . . . B . 22 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 1994 . 2 1 22 LEU HD23 H 3.589 3.060 -3.238 . . . 1.0 . . . . . . . . . . . . B . 22 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 1995 . 2 1 22 LEU HG H 3.078 2.357 -0.970 . . . 1.0 . . . . . . . . . . . . B . 22 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 1996 . 2 1 22 LEU N N 1.894 4.813 -1.082 . . . 1.0 . . . . . . . . . . . . B . 22 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 1997 . 2 1 22 LEU O O -0.688 4.332 -3.561 . . . 1.0 . . . . . . . . . . . . B . 22 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 1998 . 2 1 23 ALA C C -1.864 7.440 -2.656 . . . 1.0 . . . . . . . . . . . . B . 23 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 1999 . 2 1 23 ALA CA C -1.918 6.137 -1.862 . . . 1.0 . . . . . . . . . . . . B . 23 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 2000 . 2 1 23 ALA CB C -2.572 6.366 -0.506 . . . 1.0 . . . . . . . . . . . . B . 23 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 2001 . 2 1 23 ALA H H -0.045 5.839 -0.917 . . . 1.0 . . . . . . . . . . . . B . 23 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 2002 . 2 1 23 ALA HA H -2.517 5.421 -2.407 . . . 1.0 . . . . . . . . . . . . B . 23 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 2003 . 2 1 23 ALA HB1 H -2.012 7.108 0.044 . . . 1.0 . . . . . . . . . . . . B . 23 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 2004 . 2 1 23 ALA HB2 H -2.581 5.438 0.050 . . . 1.0 . . . . . . . . . . . . B . 23 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2005 . 2 1 23 ALA HB3 H -3.586 6.711 -0.647 . . . 1.0 . . . . . . . . . . . . B . 23 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2006 . 2 1 23 ALA N N -0.585 5.568 -1.690 . . . 1.0 . . . . . . . . . . . . B . 23 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 2007 . 2 1 23 ALA O O -2.839 8.189 -2.711 . . . 1.0 . . . . . . . . . . . . B . 23 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 2008 . 2 1 24 ASN C C -0.274 8.560 -5.531 . . . 1.0 . . . . . . . . . . . . B . 24 ASN C . . . . . . . . . c16368_2kko 1 . 1 . 2009 . 2 1 24 ASN CA C -0.542 8.907 -4.072 . . . 1.0 . . . . . . . . . . . . B . 24 ASN CA . . . . . . . . . c16368_2kko 1 . 1 . 2010 . 2 1 24 ASN CB C 0.603 9.752 -3.506 . . . 1.0 . . . . . . . . . . . . B . 24 ASN CB . . . . . . . . . c16368_2kko 1 . 1 . 2011 . 2 1 24 ASN CG C 0.218 10.503 -2.240 . . . 1.0 . . . . . . . . . . . . B . 24 ASN CG . . . . . . . . . c16368_2kko 1 . 1 . 2012 . 2 1 24 ASN H H 0.009 7.050 -3.221 . . . 1.0 . . . . . . . . . . . . B . 24 ASN H . . . . . . . . . c16368_2kko 1 . 1 . 2013 . 2 1 24 ASN HA H -1.457 9.477 -4.016 . . . 1.0 . . . . . . . . . . . . B . 24 ASN HA . . . . . . . . . c16368_2kko 1 . 1 . 2014 . 2 1 24 ASN HB2 H 1.438 9.107 -3.278 . . . 1.0 . . . . . . . . . . . . B . 24 ASN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2015 . 2 1 24 ASN HB3 H 0.907 10.474 -4.250 . . . 1.0 . . . . . . . . . . . . B . 24 ASN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2016 . 2 1 24 ASN HD21 H 0.717 8.946 -1.105 . . . 1.0 . . . . . . . . . . . . B . 24 ASN HD21 . . . . . . . . . c16368_2kko 1 . 1 . 2017 . 2 1 24 ASN HD22 H 0.131 10.339 -0.265 . . . 1.0 . . . . . . . . . . . . B . 24 ASN HD22 . . . . . . . . . c16368_2kko 1 . 1 . 2018 . 2 1 24 ASN N N -0.725 7.698 -3.282 . . . 1.0 . . . . . . . . . . . . B . 24 ASN N . . . . . . . . . c16368_2kko 1 . 1 . 2019 . 2 1 24 ASN ND2 N 0.370 9.866 -1.090 . . . 1.0 . . . . . . . . . . . . B . 24 ASN ND2 . . . . . . . . . c16368_2kko 1 . 1 . 2020 . 2 1 24 ASN O O 0.840 8.183 -5.894 . . . 1.0 . . . . . . . . . . . . B . 24 ASN O . . . . . . . . . c16368_2kko 1 . 1 . 2021 . 2 1 24 ASN OD1 O -0.211 11.655 -2.297 . . . 1.0 . . . . . . . . . . . . B . 24 ASN OD1 . . . . . . . . . c16368_2kko 1 . 1 . 2022 . 2 1 25 GLY C C -0.116 9.027 -8.525 . . . 1.0 . . . . . . . . . . . . B . 25 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 2023 . 2 1 25 GLY CA C -1.222 8.319 -7.762 . . . 1.0 . . . . . . . . . . . . B . 25 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 2024 . 2 1 25 GLY H H -2.140 9.078 -6.011 . . . 1.0 . . . . . . . . . . . . B . 25 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 2025 . 2 1 25 GLY HA2 H -1.051 7.254 -7.818 . . . 1.0 . . . . . . . . . . . . B . 25 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 2026 . 2 1 25 GLY HA3 H -2.166 8.542 -8.236 . . . 1.0 . . . . . . . . . . . . B . 25 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 2027 . 2 1 25 GLY N N -1.304 8.703 -6.359 . . . 1.0 . . . . . . . . . . . . B . 25 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 2028 . 2 1 25 GLY O O 0.576 8.410 -9.336 . . . 1.0 . . . . . . . . . . . . B . 25 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 2029 . 2 1 26 ARG C C 2.478 10.597 -8.631 . . . 1.0 . . . . . . . . . . . . B . 26 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 2030 . 2 1 26 ARG CA C 1.081 11.109 -8.949 . . . 1.0 . . . . . . . . . . . . B . 26 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 2031 . 2 1 26 ARG CB C 0.981 12.583 -8.552 . . . 1.0 . . . . . . . . . . . . B . 26 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 2032 . 2 1 26 ARG CD C -0.290 14.738 -8.630 . . . 1.0 . . . . . . . . . . . . B . 26 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 2033 . 2 1 26 ARG CG C -0.243 13.294 -9.100 . . . 1.0 . . . . . . . . . . . . B . 26 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 2034 . 2 1 26 ARG CZ C -1.636 16.765 -9.029 . . . 1.0 . . . . . . . . . . . . B . 26 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 2035 . 2 1 26 ARG H H -0.493 10.748 -7.570 . . . 1.0 . . . . . . . . . . . . B . 26 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 2036 . 2 1 26 ARG HA H 0.908 11.017 -10.011 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 2037 . 2 1 26 ARG HB2 H 0.955 12.651 -7.475 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2038 . 2 1 26 ARG HB3 H 1.860 13.097 -8.913 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2039 . 2 1 26 ARG HD2 H -0.514 14.752 -7.574 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 2040 . 2 1 26 ARG HD3 H 0.677 15.190 -8.797 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 2041 . 2 1 26 ARG HE H -1.741 15.084 -10.111 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 2042 . 2 1 26 ARG HG2 H -0.209 13.278 -10.179 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 2043 . 2 1 26 ARG HG3 H -1.131 12.782 -8.756 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 2044 . 2 1 26 ARG HH11 H -0.479 16.863 -7.362 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 2045 . 2 1 26 ARG HH12 H -1.365 18.311 -7.750 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 2046 . 2 1 26 ARG HH21 H -2.906 16.981 -10.592 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 2047 . 2 1 26 ARG HH22 H -2.766 18.362 -9.545 . . . 1.0 . . . . . . . . . . . . B . 26 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 2048 . 2 1 26 ARG N N 0.065 10.317 -8.258 . . . 1.0 . . . . . . . . . . . . B . 26 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 2049 . 2 1 26 ARG NE N -1.302 15.514 -9.339 . . . 1.0 . . . . . . . . . . . . B . 26 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 2050 . 2 1 26 ARG NH1 N -1.121 17.357 -7.959 . . . 1.0 . . . . . . . . . . . . B . 26 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 2051 . 2 1 26 ARG NH2 N -2.502 17.421 -9.783 . . . 1.0 . . . . . . . . . . . . B . 26 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 2052 . 2 1 26 ARG O O 3.400 10.724 -9.435 . . . 1.0 . . . . . . . . . . . . B . 26 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 2053 . 2 1 27 ARG C C 4.119 8.064 -7.403 . . . 1.0 . . . . . . . . . . . . B . 27 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 2054 . 2 1 27 ARG CA C 3.924 9.526 -7.016 . . . 1.0 . . . . . . . . . . . . B . 27 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 2055 . 2 1 27 ARG CB C 4.074 9.730 -5.508 . . . 1.0 . . . . . . . . . . . . B . 27 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 2056 . 2 1 27 ARG CD C 4.206 11.406 -3.621 . . . 1.0 . . . . . . . . . . . . B . 27 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 2057 . 2 1 27 ARG CG C 4.151 11.199 -5.125 . . . 1.0 . . . . . . . . . . . . B . 27 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 2058 . 2 1 27 ARG CZ C 2.992 13.169 -2.385 . . . 1.0 . . . . . . . . . . . . B . 27 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 2059 . 2 1 27 ARG H H 1.844 9.877 -6.882 . . . 1.0 . . . . . . . . . . . . B . 27 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 2060 . 2 1 27 ARG HA H 4.676 10.117 -7.523 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 2061 . 2 1 27 ARG HB2 H 3.225 9.287 -5.005 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2062 . 2 1 27 ARG HB3 H 4.978 9.242 -5.174 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2063 . 2 1 27 ARG HD2 H 4.317 10.446 -3.138 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 2064 . 2 1 27 ARG HD3 H 5.059 12.027 -3.386 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 2065 . 2 1 27 ARG HE H 2.136 11.631 -3.331 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 2066 . 2 1 27 ARG HG2 H 5.038 11.629 -5.565 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 2067 . 2 1 27 ARG HG3 H 3.277 11.701 -5.515 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 2068 . 2 1 27 ARG HH11 H 4.998 13.432 -2.457 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 2069 . 2 1 27 ARG HH12 H 4.130 14.649 -1.575 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 2070 . 2 1 27 ARG HH21 H 0.975 13.206 -2.156 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 2071 . 2 1 27 ARG HH22 H 1.834 14.503 -1.370 . . . 1.0 . . . . . . . . . . . . B . 27 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 2072 . 2 1 27 ARG N N 2.628 10.006 -7.457 . . . 1.0 . . . . . . . . . . . . B . 27 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 2073 . 2 1 27 ARG NE N 2.995 12.055 -3.118 . . . 1.0 . . . . . . . . . . . . B . 27 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 2074 . 2 1 27 ARG NH1 N 4.132 13.793 -2.116 . . . 1.0 . . . . . . . . . . . . B . 27 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 2075 . 2 1 27 ARG NH2 N 1.843 13.666 -1.940 . . . 1.0 . . . . . . . . . . . . B . 27 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 2076 . 2 1 27 ARG O O 5.247 7.584 -7.496 . . . 1.0 . . . . . . . . . . . . B . 27 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 2077 . 2 1 28 LEU C C 3.640 5.923 -9.526 . . . 1.0 . . . . . . . . . . . . B . 28 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 2078 . 2 1 28 LEU CA C 3.068 5.988 -8.116 . . . 1.0 . . . . . . . . . . . . B . 28 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 2079 . 2 1 28 LEU CB C 1.677 5.352 -8.094 . . . 1.0 . . . . . . . . . . . . B . 28 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 2080 . 2 1 28 LEU CD1 C -0.299 4.513 -6.817 . . . 1.0 . . . . . . . . . . . . B . 28 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 2081 . 2 1 28 LEU CD2 C 1.978 4.373 -5.811 . . . 1.0 . . . . . . . . . . . . B . 28 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 2082 . 2 1 28 LEU CG C 1.059 5.181 -6.709 . . . 1.0 . . . . . . . . . . . . B . 28 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 2083 . 2 1 28 LEU H H 2.139 7.794 -7.518 . . . 1.0 . . . . . . . . . . . . B . 28 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 2084 . 2 1 28 LEU HA H 3.719 5.440 -7.450 . . . 1.0 . . . . . . . . . . . . B . 28 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 2085 . 2 1 28 LEU HB2 H 1.015 5.968 -8.684 . . . 1.0 . . . . . . . . . . . . B . 28 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2086 . 2 1 28 LEU HB3 H 1.743 4.377 -8.557 . . . 1.0 . . . . . . . . . . . . B . 28 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2087 . 2 1 28 LEU HD11 H -0.943 5.107 -7.448 . . . 1.0 . . . . . . . . . . . . B . 28 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 2088 . 2 1 28 LEU HD12 H -0.735 4.426 -5.834 . . . 1.0 . . . . . . . . . . . . B . 28 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 2089 . 2 1 28 LEU HD13 H -0.181 3.528 -7.246 . . . 1.0 . . . . . . . . . . . . B . 28 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 2090 . 2 1 28 LEU HD21 H 1.525 4.267 -4.837 . . . 1.0 . . . . . . . . . . . . B . 28 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 2091 . 2 1 28 LEU HD22 H 2.924 4.884 -5.714 . . . 1.0 . . . . . . . . . . . . B . 28 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 2092 . 2 1 28 LEU HD23 H 2.138 3.396 -6.242 . . . 1.0 . . . . . . . . . . . . B . 28 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 2093 . 2 1 28 LEU HG H 0.919 6.154 -6.260 . . . 1.0 . . . . . . . . . . . . B . 28 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 2094 . 2 1 28 LEU N N 3.014 7.370 -7.654 . . . 1.0 . . . . . . . . . . . . B . 28 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 2095 . 2 1 28 LEU O O 4.361 4.988 -9.873 . . . 1.0 . . . . . . . . . . . . B . 28 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 2096 . 2 1 29 GLN C C 5.366 7.148 -11.649 . . . 1.0 . . . . . . . . . . . . B . 29 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 2097 . 2 1 29 GLN CA C 3.848 7.015 -11.686 . . . 1.0 . . . . . . . . . . . . B . 29 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 2098 . 2 1 29 GLN CB C 3.235 8.205 -12.428 . . . 1.0 . . . . . . . . . . . . B . 29 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 2099 . 2 1 29 GLN CD C 3.112 9.500 -14.601 . . . 1.0 . . . . . . . . . . . . B . 29 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 2100 . 2 1 29 GLN CG C 3.602 8.247 -13.904 . . . 1.0 . . . . . . . . . . . . B . 29 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 2101 . 2 1 29 GLN H H 2.716 7.631 -10.006 . . . 1.0 . . . . . . . . . . . . B . 29 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 2102 . 2 1 29 GLN HA H 3.588 6.102 -12.202 . . . 1.0 . . . . . . . . . . . . B . 29 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 2103 . 2 1 29 GLN HB2 H 2.160 8.152 -12.345 . . . 1.0 . . . . . . . . . . . . B . 29 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2104 . 2 1 29 GLN HB3 H 3.580 9.118 -11.966 . . . 1.0 . . . . . . . . . . . . B . 29 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2105 . 2 1 29 GLN HE21 H 1.404 8.610 -15.075 . . . 1.0 . . . . . . . . . . . . B . 29 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 2106 . 2 1 29 GLN HE22 H 1.577 10.242 -15.620 . . . 1.0 . . . . . . . . . . . . B . 29 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 2107 . 2 1 29 GLN HG2 H 4.675 8.203 -13.994 . . . 1.0 . . . . . . . . . . . . B . 29 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 2108 . 2 1 29 GLN HG3 H 3.164 7.386 -14.392 . . . 1.0 . . . . . . . . . . . . B . 29 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 2109 . 2 1 29 GLN N N 3.323 6.931 -10.331 . . . 1.0 . . . . . . . . . . . . B . 29 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 2110 . 2 1 29 GLN NE2 N 1.909 9.444 -15.150 . . . 1.0 . . . . . . . . . . . . B . 29 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 2111 . 2 1 29 GLN O O 6.074 6.610 -12.499 . . . 1.0 . . . . . . . . . . . . B . 29 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 2112 . 2 1 29 GLN OE1 O 3.813 10.508 -14.653 . . . 1.0 . . . . . . . . . . . . B . 29 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 2113 . 2 1 30 ILE C C 7.955 6.724 -10.105 . . . 1.0 . . . . . . . . . . . . B . 30 ILE C . . . . . . . . . c16368_2kko 1 . 1 . 2114 . 2 1 30 ILE CA C 7.285 8.048 -10.463 . . . 1.0 . . . . . . . . . . . . B . 30 ILE CA . . . . . . . . . c16368_2kko 1 . 1 . 2115 . 2 1 30 ILE CB C 7.582 9.092 -9.366 . . . 1.0 . . . . . . . . . . . . B . 30 ILE CB . . . . . . . . . c16368_2kko 1 . 1 . 2116 . 2 1 30 ILE CD1 C 7.045 11.473 -8.618 . . . 1.0 . . . . . . . . . . . . B . 30 ILE CD1 . . . . . . . . . c16368_2kko 1 . 1 . 2117 . 2 1 30 ILE CG1 C 6.867 10.410 -9.683 . . . 1.0 . . . . . . . . . . . . B . 30 ILE CG1 . . . . . . . . . c16368_2kko 1 . 1 . 2118 . 2 1 30 ILE CG2 C 9.082 9.314 -9.241 . . . 1.0 . . . . . . . . . . . . B . 30 ILE CG2 . . . . . . . . . c16368_2kko 1 . 1 . 2119 . 2 1 30 ILE H H 5.236 8.270 -10.005 . . . 1.0 . . . . . . . . . . . . B . 30 ILE H . . . . . . . . . c16368_2kko 1 . 1 . 2120 . 2 1 30 ILE HA H 7.693 8.406 -11.397 . . . 1.0 . . . . . . . . . . . . B . 30 ILE HA . . . . . . . . . c16368_2kko 1 . 1 . 2121 . 2 1 30 ILE HB H 7.219 8.709 -8.426 . . . 1.0 . . . . . . . . . . . . B . 30 ILE HB . . . . . . . . . c16368_2kko 1 . 1 . 2122 . 2 1 30 ILE HD11 H 6.655 11.113 -7.679 . . . 1.0 . . . . . . . . . . . . B . 30 ILE HD11 . . . . . . . . . c16368_2kko 1 . 1 . 2123 . 2 1 30 ILE HD12 H 6.515 12.368 -8.910 . . . 1.0 . . . . . . . . . . . . B . 30 ILE HD12 . . . . . . . . . c16368_2kko 1 . 1 . 2124 . 2 1 30 ILE HD13 H 8.097 11.697 -8.509 . . . 1.0 . . . . . . . . . . . . B . 30 ILE HD13 . . . . . . . . . c16368_2kko 1 . 1 . 2125 . 2 1 30 ILE HG12 H 7.251 10.804 -10.611 . . . 1.0 . . . . . . . . . . . . B . 30 ILE HG12 . . . . . . . . . c16368_2kko 1 . 1 . 2126 . 2 1 30 ILE HG13 H 5.809 10.219 -9.789 . . . 1.0 . . . . . . . . . . . . B . 30 ILE HG13 . . . . . . . . . c16368_2kko 1 . 1 . 2127 . 2 1 30 ILE HG21 H 9.276 10.033 -8.459 . . . 1.0 . . . . . . . . . . . . B . 30 ILE HG21 . . . . . . . . . c16368_2kko 1 . 1 . 2128 . 2 1 30 ILE HG22 H 9.471 9.687 -10.177 . . . 1.0 . . . . . . . . . . . . B . 30 ILE HG22 . . . . . . . . . c16368_2kko 1 . 1 . 2129 . 2 1 30 ILE HG23 H 9.566 8.379 -8.998 . . . 1.0 . . . . . . . . . . . . B . 30 ILE HG23 . . . . . . . . . c16368_2kko 1 . 1 . 2130 . 2 1 30 ILE N N 5.855 7.860 -10.643 . . . 1.0 . . . . . . . . . . . . B . 30 ILE N . . . . . . . . . c16368_2kko 1 . 1 . 2131 . 2 1 30 ILE O O 9.053 6.431 -10.571 . . . 1.0 . . . . . . . . . . . . B . 30 ILE O . . . . . . . . . c16368_2kko 1 . 1 . 2132 . 2 1 31 LEU C C 7.929 3.703 -10.127 . . . 1.0 . . . . . . . . . . . . B . 31 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 2133 . 2 1 31 LEU CA C 7.788 4.609 -8.907 . . . 1.0 . . . . . . . . . . . . B . 31 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 2134 . 2 1 31 LEU CB C 6.863 3.956 -7.876 . . . 1.0 . . . . . . . . . . . . B . 31 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 2135 . 2 1 31 LEU CD1 C 5.712 4.033 -5.651 . . . 1.0 . . . . . . . . . . . . B . 31 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 2136 . 2 1 31 LEU CD2 C 8.092 4.752 -5.843 . . . 1.0 . . . . . . . . . . . . B . 31 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 2137 . 2 1 31 LEU CG C 6.744 4.699 -6.544 . . . 1.0 . . . . . . . . . . . . B . 31 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 2138 . 2 1 31 LEU H H 6.410 6.220 -8.941 . . . 1.0 . . . . . . . . . . . . B . 31 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 2139 . 2 1 31 LEU HA H 8.763 4.752 -8.466 . . . 1.0 . . . . . . . . . . . . B . 31 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 2140 . 2 1 31 LEU HB2 H 5.876 3.878 -8.310 . . . 1.0 . . . . . . . . . . . . B . 31 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2141 . 2 1 31 LEU HB3 H 7.229 2.961 -7.676 . . . 1.0 . . . . . . . . . . . . B . 31 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2142 . 2 1 31 LEU HD11 H 6.004 3.009 -5.465 . . . 1.0 . . . . . . . . . . . . B . 31 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 2143 . 2 1 31 LEU HD12 H 4.749 4.050 -6.139 . . . 1.0 . . . . . . . . . . . . B . 31 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 2144 . 2 1 31 LEU HD13 H 5.650 4.566 -4.713 . . . 1.0 . . . . . . . . . . . . B . 31 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 2145 . 2 1 31 LEU HD21 H 8.804 5.266 -6.471 . . . 1.0 . . . . . . . . . . . . B . 31 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 2146 . 2 1 31 LEU HD22 H 8.438 3.747 -5.654 . . . 1.0 . . . . . . . . . . . . B . 31 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 2147 . 2 1 31 LEU HD23 H 7.990 5.279 -4.907 . . . 1.0 . . . . . . . . . . . . B . 31 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 2148 . 2 1 31 LEU HG H 6.422 5.713 -6.730 . . . 1.0 . . . . . . . . . . . . B . 31 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 2149 . 2 1 31 LEU N N 7.276 5.921 -9.293 . . . 1.0 . . . . . . . . . . . . B . 31 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 2150 . 2 1 31 LEU O O 8.914 2.979 -10.265 . . . 1.0 . . . . . . . . . . . . B . 31 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 2151 . 2 1 32 ASP C C 8.051 3.441 -13.180 . . . 1.0 . . . . . . . . . . . . B . 32 ASP C . . . . . . . . . c16368_2kko 1 . 1 . 2152 . 2 1 32 ASP CA C 6.939 2.972 -12.243 . . . 1.0 . . . . . . . . . . . . B . 32 ASP CA . . . . . . . . . c16368_2kko 1 . 1 . 2153 . 2 1 32 ASP CB C 5.571 3.085 -12.932 . . . 1.0 . . . . . . . . . . . . B . 32 ASP CB . . . . . . . . . c16368_2kko 1 . 1 . 2154 . 2 1 32 ASP CG C 5.407 2.143 -14.115 . . . 1.0 . . . . . . . . . . . . B . 32 ASP CG . . . . . . . . . c16368_2kko 1 . 1 . 2155 . 2 1 32 ASP H H 6.184 4.367 -10.837 . . . 1.0 . . . . . . . . . . . . B . 32 ASP H . . . . . . . . . c16368_2kko 1 . 1 . 2156 . 2 1 32 ASP HA H 7.118 1.942 -11.974 . . . 1.0 . . . . . . . . . . . . B . 32 ASP HA . . . . . . . . . c16368_2kko 1 . 1 . 2157 . 2 1 32 ASP HB2 H 4.797 2.860 -12.214 . . . 1.0 . . . . . . . . . . . . B . 32 ASP HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2158 . 2 1 32 ASP HB3 H 5.440 4.097 -13.285 . . . 1.0 . . . . . . . . . . . . B . 32 ASP HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2159 . 2 1 32 ASP N N 6.941 3.768 -11.015 . . . 1.0 . . . . . . . . . . . . B . 32 ASP N . . . . . . . . . c16368_2kko 1 . 1 . 2160 . 2 1 32 ASP O O 8.604 2.662 -13.957 . . . 1.0 . . . . . . . . . . . . B . 32 ASP O . . . . . . . . . c16368_2kko 1 . 1 . 2161 . 2 1 32 ASP OD1 O 5.194 0.929 -13.895 . . . 1.0 . . . . . . . . . . . . B . 32 ASP OD1 . . . . . . . . . c16368_2kko 1 . 1 . 2162 . 2 1 32 ASP OD2 O 5.448 2.618 -15.271 . . . 1.0 . . . . . . . . . . . . B . 32 ASP OD2 . . . . . . . . . c16368_2kko 1 . 1 . 2163 . 2 1 33 LEU C C 10.825 4.955 -13.310 . . . 1.0 . . . . . . . . . . . . B . 33 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 2164 . 2 1 33 LEU CA C 9.450 5.308 -13.880 . . . 1.0 . . . . . . . . . . . . B . 33 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 2165 . 2 1 33 LEU CB C 9.282 6.829 -13.937 . . . 1.0 . . . . . . . . . . . . B . 33 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 2166 . 2 1 33 LEU CD1 C 10.015 7.190 -16.309 . . . 1.0 . . . . . . . . . . . . B . 33 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 2167 . 2 1 33 LEU CD2 C 10.147 9.069 -14.660 . . . 1.0 . . . . . . . . . . . . B . 33 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 2168 . 2 1 33 LEU CG C 10.262 7.564 -14.855 . . . 1.0 . . . . . . . . . . . . B . 33 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 2169 . 2 1 33 LEU H H 7.899 5.288 -12.444 . . . 1.0 . . . . . . . . . . . . B . 33 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 2170 . 2 1 33 LEU HA H 9.373 4.907 -14.880 . . . 1.0 . . . . . . . . . . . . B . 33 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 2171 . 2 1 33 LEU HB2 H 8.277 7.044 -14.274 . . . 1.0 . . . . . . . . . . . . B . 33 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2172 . 2 1 33 LEU HB3 H 9.397 7.220 -12.936 . . . 1.0 . . . . . . . . . . . . B . 33 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2173 . 2 1 33 LEU HD11 H 10.712 7.721 -16.943 . . . 1.0 . . . . . . . . . . . . B . 33 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 2174 . 2 1 33 LEU HD12 H 9.006 7.459 -16.581 . . . 1.0 . . . . . . . . . . . . B . 33 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 2175 . 2 1 33 LEU HD13 H 10.151 6.127 -16.436 . . . 1.0 . . . . . . . . . . . . B . 33 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 2176 . 2 1 33 LEU HD21 H 10.847 9.569 -15.311 . . . 1.0 . . . . . . . . . . . . B . 33 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 2177 . 2 1 33 LEU HD22 H 10.369 9.317 -13.632 . . . 1.0 . . . . . . . . . . . . B . 33 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 2178 . 2 1 33 LEU HD23 H 9.143 9.386 -14.898 . . . 1.0 . . . . . . . . . . . . B . 33 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 2179 . 2 1 33 LEU HG H 11.270 7.270 -14.604 . . . 1.0 . . . . . . . . . . . . B . 33 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 2180 . 2 1 33 LEU N N 8.388 4.719 -13.076 . . . 1.0 . . . . . . . . . . . . B . 33 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 2181 . 2 1 33 LEU O O 11.745 4.602 -14.051 . . . 1.0 . . . . . . . . . . . . B . 33 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 2182 . 2 1 34 LEU C C 12.550 3.287 -11.301 . . . 1.0 . . . . . . . . . . . . B . 34 LEU C . . . . . . . . . c16368_2kko 1 . 1 . 2183 . 2 1 34 LEU CA C 12.230 4.775 -11.321 . . . 1.0 . . . . . . . . . . . . B . 34 LEU CA . . . . . . . . . c16368_2kko 1 . 1 . 2184 . 2 1 34 LEU CB C 12.219 5.323 -9.893 . . . 1.0 . . . . . . . . . . . . B . 34 LEU CB . . . . . . . . . c16368_2kko 1 . 1 . 2185 . 2 1 34 LEU CD1 C 12.161 7.273 -8.332 . . . 1.0 . . . . . . . . . . . . B . 34 LEU CD1 . . . . . . . . . c16368_2kko 1 . 1 . 2186 . 2 1 34 LEU CD2 C 13.235 7.508 -10.574 . . . 1.0 . . . . . . . . . . . . B . 34 LEU CD2 . . . . . . . . . c16368_2kko 1 . 1 . 2187 . 2 1 34 LEU CG C 12.118 6.843 -9.786 . . . 1.0 . . . . . . . . . . . . B . 34 LEU CG . . . . . . . . . c16368_2kko 1 . 1 . 2188 . 2 1 34 LEU H H 10.176 5.300 -11.449 . . . 1.0 . . . . . . . . . . . . B . 34 LEU H . . . . . . . . . c16368_2kko 1 . 1 . 2189 . 2 1 34 LEU HA H 13.002 5.283 -11.879 . . . 1.0 . . . . . . . . . . . . B . 34 LEU HA . . . . . . . . . c16368_2kko 1 . 1 . 2190 . 2 1 34 LEU HB2 H 11.379 4.890 -9.370 . . . 1.0 . . . . . . . . . . . . B . 34 LEU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2191 . 2 1 34 LEU HB3 H 13.128 5.011 -9.400 . . . 1.0 . . . . . . . . . . . . B . 34 LEU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2192 . 2 1 34 LEU HD11 H 12.109 8.350 -8.275 . . . 1.0 . . . . . . . . . . . . B . 34 LEU HD11 . . . . . . . . . c16368_2kko 1 . 1 . 2193 . 2 1 34 LEU HD12 H 13.082 6.931 -7.884 . . . 1.0 . . . . . . . . . . . . B . 34 LEU HD12 . . . . . . . . . c16368_2kko 1 . 1 . 2194 . 2 1 34 LEU HD13 H 11.322 6.844 -7.804 . . . 1.0 . . . . . . . . . . . . B . 34 LEU HD13 . . . . . . . . . c16368_2kko 1 . 1 . 2195 . 2 1 34 LEU HD21 H 13.163 7.222 -11.612 . . . 1.0 . . . . . . . . . . . . B . 34 LEU HD21 . . . . . . . . . c16368_2kko 1 . 1 . 2196 . 2 1 34 LEU HD22 H 14.190 7.195 -10.179 . . . 1.0 . . . . . . . . . . . . B . 34 LEU HD22 . . . . . . . . . c16368_2kko 1 . 1 . 2197 . 2 1 34 LEU HD23 H 13.146 8.582 -10.489 . . . 1.0 . . . . . . . . . . . . B . 34 LEU HD23 . . . . . . . . . c16368_2kko 1 . 1 . 2198 . 2 1 34 LEU HG H 11.174 7.166 -10.202 . . . 1.0 . . . . . . . . . . . . B . 34 LEU HG . . . . . . . . . c16368_2kko 1 . 1 . 2199 . 2 1 34 LEU N N 10.956 5.040 -11.990 . . . 1.0 . . . . . . . . . . . . B . 34 LEU N . . . . . . . . . c16368_2kko 1 . 1 . 2200 . 2 1 34 LEU O O 13.687 2.891 -11.048 . . . 1.0 . . . . . . . . . . . . B . 34 LEU O . . . . . . . . . c16368_2kko 1 . 1 . 2201 . 2 1 35 ALA C C 12.502 0.666 -12.940 . . . 1.0 . . . . . . . . . . . . B . 35 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 2202 . 2 1 35 ALA CA C 11.747 1.024 -11.664 . . . 1.0 . . . . . . . . . . . . B . 35 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 2203 . 2 1 35 ALA CB C 10.410 0.296 -11.612 . . . 1.0 . . . . . . . . . . . . B . 35 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 2204 . 2 1 35 ALA H H 10.648 2.832 -11.715 . . . 1.0 . . . . . . . . . . . . B . 35 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 2205 . 2 1 35 ALA HA H 12.334 0.716 -10.811 . . . 1.0 . . . . . . . . . . . . B . 35 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 2206 . 2 1 35 ALA HB1 H 9.889 0.566 -10.705 . . . 1.0 . . . . . . . . . . . . B . 35 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 2207 . 2 1 35 ALA HB2 H 10.578 -0.770 -11.625 . . . 1.0 . . . . . . . . . . . . B . 35 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2208 . 2 1 35 ALA HB3 H 9.812 0.576 -12.467 . . . 1.0 . . . . . . . . . . . . B . 35 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2209 . 2 1 35 ALA N N 11.548 2.464 -11.577 . . . 1.0 . . . . . . . . . . . . B . 35 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 2210 . 2 1 35 ALA O O 12.884 -0.483 -13.152 . . . 1.0 . . . . . . . . . . . . B . 35 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 2211 . 2 1 36 GLN C C 14.890 1.857 -14.905 . . . 1.0 . . . . . . . . . . . . B . 36 GLN C . . . . . . . . . c16368_2kko 1 . 1 . 2212 . 2 1 36 GLN CA C 13.420 1.465 -15.041 . . . 1.0 . . . . . . . . . . . . B . 36 GLN CA . . . . . . . . . c16368_2kko 1 . 1 . 2213 . 2 1 36 GLN CB C 12.737 2.284 -16.135 . . . 1.0 . . . . . . . . . . . . B . 36 GLN CB . . . . . . . . . c16368_2kko 1 . 1 . 2214 . 2 1 36 GLN CD C 10.519 2.941 -17.184 . . . 1.0 . . . . . . . . . . . . B . 36 GLN CD . . . . . . . . . c16368_2kko 1 . 1 . 2215 . 2 1 36 GLN CG C 11.238 2.027 -16.213 . . . 1.0 . . . . . . . . . . . . B . 36 GLN CG . . . . . . . . . c16368_2kko 1 . 1 . 2216 . 2 1 36 GLN H H 12.397 2.562 -13.554 . . . 1.0 . . . . . . . . . . . . B . 36 GLN H . . . . . . . . . c16368_2kko 1 . 1 . 2217 . 2 1 36 GLN HA H 13.359 0.416 -15.295 . . . 1.0 . . . . . . . . . . . . B . 36 GLN HA . . . . . . . . . c16368_2kko 1 . 1 . 2218 . 2 1 36 GLN HB2 H 12.895 3.335 -15.936 . . . 1.0 . . . . . . . . . . . . B . 36 GLN HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2219 . 2 1 36 GLN HB3 H 13.176 2.033 -17.089 . . . 1.0 . . . . . . . . . . . . B . 36 GLN HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2220 . 2 1 36 GLN HE21 H 8.895 2.906 -16.037 . . . 1.0 . . . . . . . . . . . . B . 36 GLN HE21 . . . . . . . . . c16368_2kko 1 . 1 . 2221 . 2 1 36 GLN HE22 H 8.780 3.854 -17.480 . . . 1.0 . . . . . . . . . . . . B . 36 GLN HE22 . . . . . . . . . c16368_2kko 1 . 1 . 2222 . 2 1 36 GLN HG2 H 11.078 1.007 -16.527 . . . 1.0 . . . . . . . . . . . . B . 36 GLN HG2 . . . . . . . . . c16368_2kko 1 . 1 . 2223 . 2 1 36 GLN HG3 H 10.814 2.167 -15.229 . . . 1.0 . . . . . . . . . . . . B . 36 GLN HG3 . . . . . . . . . c16368_2kko 1 . 1 . 2224 . 2 1 36 GLN N N 12.720 1.663 -13.784 . . . 1.0 . . . . . . . . . . . . B . 36 GLN N . . . . . . . . . c16368_2kko 1 . 1 . 2225 . 2 1 36 GLN NE2 N 9.275 3.269 -16.870 . . . 1.0 . . . . . . . . . . . . B . 36 GLN NE2 . . . . . . . . . c16368_2kko 1 . 1 . 2226 . 2 1 36 GLN O O 15.695 1.618 -15.804 . . . 1.0 . . . . . . . . . . . . B . 36 GLN O . . . . . . . . . c16368_2kko 1 . 1 . 2227 . 2 1 36 GLN OE1 O 11.079 3.362 -18.198 . . . 1.0 . . . . . . . . . . . . B . 36 GLN OE1 . . . . . . . . . c16368_2kko 1 . 1 . 2228 . 2 1 37 GLY C C 16.690 4.057 -12.604 . . . 1.0 . . . . . . . . . . . . B . 37 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 2229 . 2 1 37 GLY CA C 16.606 2.847 -13.511 . . . 1.0 . . . . . . . . . . . . B . 37 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 2230 . 2 1 37 GLY H H 14.544 2.633 -13.094 . . . 1.0 . . . . . . . . . . . . B . 37 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 2231 . 2 1 37 GLY HA2 H 17.129 2.022 -13.049 . . . 1.0 . . . . . . . . . . . . B . 37 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 2232 . 2 1 37 GLY HA3 H 17.083 3.082 -14.451 . . . 1.0 . . . . . . . . . . . . B . 37 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 2233 . 2 1 37 GLY N N 15.233 2.452 -13.767 . . . 1.0 . . . . . . . . . . . . B . 37 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 2234 . 2 1 37 GLY O O 15.691 4.747 -12.393 . . . 1.0 . . . . . . . . . . . . B . 37 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 2235 . 2 1 38 GLU C C 18.294 6.726 -12.051 . . . 1.0 . . . . . . . . . . . . B . 38 GLU C . . . . . . . . . c16368_2kko 1 . 1 . 2236 . 2 1 38 GLU CA C 18.070 5.486 -11.209 . . . 1.0 . . . . . . . . . . . . B . 38 GLU CA . . . . . . . . . c16368_2kko 1 . 1 . 2237 . 2 1 38 GLU CB C 19.232 5.297 -10.222 . . . 1.0 . . . . . . . . . . . . B . 38 GLU CB . . . . . . . . . c16368_2kko 1 . 1 . 2238 . 2 1 38 GLU CD C 20.981 4.444 -11.861 . . . 1.0 . . . . . . . . . . . . B . 38 GLU CD . . . . . . . . . c16368_2kko 1 . 1 . 2239 . 2 1 38 GLU CG C 20.208 4.189 -10.582 . . . 1.0 . . . . . . . . . . . . B . 38 GLU CG . . . . . . . . . c16368_2kko 1 . 1 . 2240 . 2 1 38 GLU H H 18.641 3.745 -12.273 . . . 1.0 . . . . . . . . . . . . B . 38 GLU H . . . . . . . . . c16368_2kko 1 . 1 . 2241 . 2 1 38 GLU HA H 17.158 5.623 -10.646 . . . 1.0 . . . . . . . . . . . . B . 38 GLU HA . . . . . . . . . c16368_2kko 1 . 1 . 2242 . 2 1 38 GLU HB2 H 19.784 6.222 -10.163 . . . 1.0 . . . . . . . . . . . . B . 38 GLU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2243 . 2 1 38 GLU HB3 H 18.822 5.077 -9.248 . . . 1.0 . . . . . . . . . . . . B . 38 GLU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2244 . 2 1 38 GLU HG2 H 20.912 4.080 -9.774 . . . 1.0 . . . . . . . . . . . . B . 38 GLU HG2 . . . . . . . . . c16368_2kko 1 . 1 . 2245 . 2 1 38 GLU HG3 H 19.648 3.274 -10.695 . . . 1.0 . . . . . . . . . . . . B . 38 GLU HG3 . . . . . . . . . c16368_2kko 1 . 1 . 2246 . 2 1 38 GLU N N 17.876 4.324 -12.066 . . . 1.0 . . . . . . . . . . . . B . 38 GLU N . . . . . . . . . c16368_2kko 1 . 1 . 2247 . 2 1 38 GLU O O 19.081 6.721 -12.998 . . . 1.0 . . . . . . . . . . . . B . 38 GLU O . . . . . . . . . c16368_2kko 1 . 1 . 2248 . 2 1 38 GLU OE1 O 22.012 5.153 -11.819 . . . 1.0 . . . . . . . . . . . . B . 38 GLU OE1 . . . . . . . . . c16368_2kko 1 . 1 . 2249 . 2 1 38 GLU OE2 O 20.575 3.911 -12.915 . . . 1.0 . . . . . . . . . . . . B . 38 GLU OE2 . . . . . . . . . c16368_2kko 1 . 1 . 2250 . 2 1 39 ARG C C 17.625 10.237 -11.577 . . . 1.0 . . . . . . . . . . . . B . 39 ARG C . . . . . . . . . c16368_2kko 1 . 1 . 2251 . 2 1 39 ARG CA C 17.637 9.015 -12.482 . . . 1.0 . . . . . . . . . . . . B . 39 ARG CA . . . . . . . . . c16368_2kko 1 . 1 . 2252 . 2 1 39 ARG CB C 16.465 9.068 -13.467 . . . 1.0 . . . . . . . . . . . . B . 39 ARG CB . . . . . . . . . c16368_2kko 1 . 1 . 2253 . 2 1 39 ARG CD C 15.312 7.988 -15.428 . . . 1.0 . . . . . . . . . . . . B . 39 ARG CD . . . . . . . . . c16368_2kko 1 . 1 . 2254 . 2 1 39 ARG CG C 16.509 7.957 -14.501 . . . 1.0 . . . . . . . . . . . . B . 39 ARG CG . . . . . . . . . c16368_2kko 1 . 1 . 2255 . 2 1 39 ARG CZ C 14.357 6.577 -17.215 . . . 1.0 . . . . . . . . . . . . B . 39 ARG CZ . . . . . . . . . c16368_2kko 1 . 1 . 2256 . 2 1 39 ARG H H 17.038 7.741 -10.891 . . . 1.0 . . . . . . . . . . . . B . 39 ARG H . . . . . . . . . c16368_2kko 1 . 1 . 2257 . 2 1 39 ARG HA H 18.559 9.014 -13.043 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HA . . . . . . . . . c16368_2kko 1 . 1 . 2258 . 2 1 39 ARG HB2 H 15.538 8.985 -12.916 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2259 . 2 1 39 ARG HB3 H 16.486 10.017 -13.985 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2260 . 2 1 39 ARG HD2 H 14.411 7.912 -14.836 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HD2 . . . . . . . . . c16368_2kko 1 . 1 . 2261 . 2 1 39 ARG HD3 H 15.314 8.924 -15.966 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HD3 . . . . . . . . . c16368_2kko 1 . 1 . 2262 . 2 1 39 ARG HE H 16.174 6.330 -16.403 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HE . . . . . . . . . c16368_2kko 1 . 1 . 2263 . 2 1 39 ARG HG2 H 17.406 8.066 -15.090 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HG2 . . . . . . . . . c16368_2kko 1 . 1 . 2264 . 2 1 39 ARG HG3 H 16.529 7.005 -13.988 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HG3 . . . . . . . . . c16368_2kko 1 . 1 . 2265 . 2 1 39 ARG HH11 H 13.156 8.093 -16.628 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HH11 . . . . . . . . . c16368_2kko 1 . 1 . 2266 . 2 1 39 ARG HH12 H 12.504 7.069 -17.872 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HH12 . . . . . . . . . c16368_2kko 1 . 1 . 2267 . 2 1 39 ARG HH21 H 15.307 4.986 -18.034 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HH21 . . . . . . . . . c16368_2kko 1 . 1 . 2268 . 2 1 39 ARG HH22 H 13.719 5.313 -18.662 . . . 1.0 . . . . . . . . . . . . B . 39 ARG HH22 . . . . . . . . . c16368_2kko 1 . 1 . 2269 . 2 1 39 ARG N N 17.592 7.785 -11.704 . . . 1.0 . . . . . . . . . . . . B . 39 ARG N . . . . . . . . . c16368_2kko 1 . 1 . 2270 . 2 1 39 ARG NE N 15.349 6.884 -16.386 . . . 1.0 . . . . . . . . . . . . B . 39 ARG NE . . . . . . . . . c16368_2kko 1 . 1 . 2271 . 2 1 39 ARG NH1 N 13.251 7.306 -17.236 . . . 1.0 . . . . . . . . . . . . B . 39 ARG NH1 . . . . . . . . . c16368_2kko 1 . 1 . 2272 . 2 1 39 ARG NH2 N 14.471 5.541 -18.034 . . . 1.0 . . . . . . . . . . . . B . 39 ARG NH2 . . . . . . . . . c16368_2kko 1 . 1 . 2273 . 2 1 39 ARG O O 17.072 10.202 -10.477 . . . 1.0 . . . . . . . . . . . . B . 39 ARG O . . . . . . . . . c16368_2kko 1 . 1 . 2274 . 2 1 40 ALA C C 17.006 13.264 -11.233 . . . 1.0 . . . . . . . . . . . . B . 40 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 2275 . 2 1 40 ALA CA C 18.346 12.542 -11.276 . . . 1.0 . . . . . . . . . . . . B . 40 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 2276 . 2 1 40 ALA CB C 19.415 13.451 -11.866 . . . 1.0 . . . . . . . . . . . . B . 40 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 2277 . 2 1 40 ALA H H 18.655 11.273 -12.934 . . . 1.0 . . . . . . . . . . . . B . 40 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 2278 . 2 1 40 ALA HA H 18.640 12.286 -10.268 . . . 1.0 . . . . . . . . . . . . B . 40 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 2279 . 2 1 40 ALA HB1 H 19.129 13.739 -12.867 . . . 1.0 . . . . . . . . . . . . B . 40 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 2280 . 2 1 40 ALA HB2 H 20.357 12.925 -11.897 . . . 1.0 . . . . . . . . . . . . B . 40 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2281 . 2 1 40 ALA HB3 H 19.514 14.334 -11.252 . . . 1.0 . . . . . . . . . . . . B . 40 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2282 . 2 1 40 ALA N N 18.251 11.310 -12.045 . . . 1.0 . . . . . . . . . . . . B . 40 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 2283 . 2 1 40 ALA O O 16.169 13.084 -12.119 . . . 1.0 . . . . . . . . . . . . B . 40 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 2284 . 2 1 41 VAL C C 15.173 15.609 -11.261 . . . 1.0 . . . . . . . . . . . . B . 41 VAL C . . . . . . . . . c16368_2kko 1 . 1 . 2285 . 2 1 41 VAL CA C 15.582 14.839 -10.003 . . . 1.0 . . . . . . . . . . . . B . 41 VAL CA . . . . . . . . . c16368_2kko 1 . 1 . 2286 . 2 1 41 VAL CB C 15.718 15.835 -8.830 . . . 1.0 . . . . . . . . . . . . B . 41 VAL CB . . . . . . . . . c16368_2kko 1 . 1 . 2287 . 2 1 41 VAL CG1 C 14.396 16.541 -8.562 . . . 1.0 . . . . . . . . . . . . B . 41 VAL CG1 . . . . . . . . . c16368_2kko 1 . 1 . 2288 . 2 1 41 VAL CG2 C 16.212 15.127 -7.578 . . . 1.0 . . . . . . . . . . . . B . 41 VAL CG2 . . . . . . . . . c16368_2kko 1 . 1 . 2289 . 2 1 41 VAL H H 17.547 14.182 -9.544 . . . 1.0 . . . . . . . . . . . . B . 41 VAL H . . . . . . . . . c16368_2kko 1 . 1 . 2290 . 2 1 41 VAL HA H 14.802 14.134 -9.756 . . . 1.0 . . . . . . . . . . . . B . 41 VAL HA . . . . . . . . . c16368_2kko 1 . 1 . 2291 . 2 1 41 VAL HB H 16.448 16.584 -9.105 . . . 1.0 . . . . . . . . . . . . B . 41 VAL HB . . . . . . . . . c16368_2kko 1 . 1 . 2292 . 2 1 41 VAL HG11 H 13.646 15.811 -8.298 . . . 1.0 . . . . . . . . . . . . B . 41 VAL HG11 . . . . . . . . . c16368_2kko 1 . 1 . 2293 . 2 1 41 VAL HG12 H 14.085 17.070 -9.451 . . . 1.0 . . . . . . . . . . . . B . 41 VAL HG12 . . . . . . . . . c16368_2kko 1 . 1 . 2294 . 2 1 41 VAL HG13 H 14.520 17.243 -7.751 . . . 1.0 . . . . . . . . . . . . B . 41 VAL HG13 . . . . . . . . . c16368_2kko 1 . 1 . 2295 . 2 1 41 VAL HG21 H 17.171 14.671 -7.778 . . . 1.0 . . . . . . . . . . . . B . 41 VAL HG21 . . . . . . . . . c16368_2kko 1 . 1 . 2296 . 2 1 41 VAL HG22 H 15.504 14.362 -7.294 . . . 1.0 . . . . . . . . . . . . B . 41 VAL HG22 . . . . . . . . . c16368_2kko 1 . 1 . 2297 . 2 1 41 VAL HG23 H 16.314 15.841 -6.774 . . . 1.0 . . . . . . . . . . . . B . 41 VAL HG23 . . . . . . . . . c16368_2kko 1 . 1 . 2298 . 2 1 41 VAL N N 16.823 14.087 -10.205 . . . 1.0 . . . . . . . . . . . . B . 41 VAL N . . . . . . . . . c16368_2kko 1 . 1 . 2299 . 2 1 41 VAL O O 14.000 15.627 -11.631 . . . 1.0 . . . . . . . . . . . . B . 41 VAL O . . . . . . . . . c16368_2kko 1 . 1 . 2300 . 2 1 42 GLU C C 15.259 16.172 -14.207 . . . 1.0 . . . . . . . . . . . . B . 42 GLU C . . . . . . . . . c16368_2kko 1 . 1 . 2301 . 2 1 42 GLU CA C 15.896 17.028 -13.112 . . . 1.0 . . . . . . . . . . . . B . 42 GLU CA . . . . . . . . . c16368_2kko 1 . 1 . 2302 . 2 1 42 GLU CB C 17.207 17.668 -13.599 . . . 1.0 . . . . . . . . . . . . B . 42 GLU CB . . . . . . . . . c16368_2kko 1 . 1 . 2303 . 2 1 42 GLU CD C 17.118 18.104 -16.100 . . . 1.0 . . . . . . . . . . . . B . 42 GLU CD . . . . . . . . . c16368_2kko 1 . 1 . 2304 . 2 1 42 GLU CG C 17.038 18.700 -14.708 . . . 1.0 . . . . . . . . . . . . B . 42 GLU CG . . . . . . . . . c16368_2kko 1 . 1 . 2305 . 2 1 42 GLU H H 17.068 16.147 -11.585 . . . 1.0 . . . . . . . . . . . . B . 42 GLU H . . . . . . . . . c16368_2kko 1 . 1 . 2306 . 2 1 42 GLU HA H 15.204 17.811 -12.842 . . . 1.0 . . . . . . . . . . . . B . 42 GLU HA . . . . . . . . . c16368_2kko 1 . 1 . 2307 . 2 1 42 GLU HB2 H 17.683 18.157 -12.762 . . . 1.0 . . . . . . . . . . . . B . 42 GLU HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2308 . 2 1 42 GLU HB3 H 17.860 16.887 -13.963 . . . 1.0 . . . . . . . . . . . . B . 42 GLU HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2309 . 2 1 42 GLU HG2 H 16.073 19.171 -14.594 . . . 1.0 . . . . . . . . . . . . B . 42 GLU HG2 . . . . . . . . . c16368_2kko 1 . 1 . 2310 . 2 1 42 GLU HG3 H 17.813 19.446 -14.606 . . . 1.0 . . . . . . . . . . . . B . 42 GLU HG3 . . . . . . . . . c16368_2kko 1 . 1 . 2311 . 2 1 42 GLU N N 16.151 16.229 -11.916 . . . 1.0 . . . . . . . . . . . . B . 42 GLU N . . . . . . . . . c16368_2kko 1 . 1 . 2312 . 2 1 42 GLU O O 14.274 16.575 -14.834 . . . 1.0 . . . . . . . . . . . . B . 42 GLU O . . . . . . . . . c16368_2kko 1 . 1 . 2313 . 2 1 42 GLU OE1 O 18.239 17.779 -16.549 . . . 1.0 . . . . . . . . . . . . B . 42 GLU OE1 . . . . . . . . . c16368_2kko 1 . 1 . 2314 . 2 1 42 GLU OE2 O 16.070 17.978 -16.765 . . . 1.0 . . . . . . . . . . . . B . 42 GLU OE2 . . . . . . . . . c16368_2kko 1 . 1 . 2315 . 2 1 43 ALA C C 13.891 13.582 -15.048 . . . 1.0 . . . . . . . . . . . . B . 43 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 2316 . 2 1 43 ALA CA C 15.294 14.058 -15.408 . . . 1.0 . . . . . . . . . . . . B . 43 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 2317 . 2 1 43 ALA CB C 16.232 12.870 -15.565 . . . 1.0 . . . . . . . . . . . . B . 43 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 2318 . 2 1 43 ALA H H 16.566 14.708 -13.851 . . . 1.0 . . . . . . . . . . . . B . 43 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 2319 . 2 1 43 ALA HA H 15.255 14.584 -16.352 . . . 1.0 . . . . . . . . . . . . B . 43 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 2320 . 2 1 43 ALA HB1 H 16.264 12.312 -14.641 . . . 1.0 . . . . . . . . . . . . B . 43 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 2321 . 2 1 43 ALA HB2 H 17.224 13.224 -15.807 . . . 1.0 . . . . . . . . . . . . B . 43 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2322 . 2 1 43 ALA HB3 H 15.873 12.231 -16.358 . . . 1.0 . . . . . . . . . . . . B . 43 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2323 . 2 1 43 ALA N N 15.804 14.978 -14.402 . . . 1.0 . . . . . . . . . . . . B . 43 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 2324 . 2 1 43 ALA O O 13.012 13.508 -15.908 . . . 1.0 . . . . . . . . . . . . B . 43 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 2325 . 2 1 44 ILE C C 11.313 13.854 -13.458 . . . 1.0 . . . . . . . . . . . . B . 44 ILE C . . . . . . . . . c16368_2kko 1 . 1 . 2326 . 2 1 44 ILE CA C 12.394 12.789 -13.291 . . . 1.0 . . . . . . . . . . . . B . 44 ILE CA . . . . . . . . . c16368_2kko 1 . 1 . 2327 . 2 1 44 ILE CB C 12.468 12.386 -11.801 . . . 1.0 . . . . . . . . . . . . B . 44 ILE CB . . . . . . . . . c16368_2kko 1 . 1 . 2328 . 2 1 44 ILE CD1 C 13.810 11.009 -10.124 . . . 1.0 . . . . . . . . . . . . B . 44 ILE CD1 . . . . . . . . . c16368_2kko 1 . 1 . 2329 . 2 1 44 ILE CG1 C 13.570 11.345 -11.581 . . . 1.0 . . . . . . . . . . . . B . 44 ILE CG1 . . . . . . . . . c16368_2kko 1 . 1 . 2330 . 2 1 44 ILE CG2 C 11.124 11.848 -11.328 . . . 1.0 . . . . . . . . . . . . B . 44 ILE CG2 . . . . . . . . . c16368_2kko 1 . 1 . 2331 . 2 1 44 ILE H H 14.429 13.364 -13.136 . . . 1.0 . . . . . . . . . . . . B . 44 ILE H . . . . . . . . . c16368_2kko 1 . 1 . 2332 . 2 1 44 ILE HA H 12.125 11.916 -13.869 . . . 1.0 . . . . . . . . . . . . B . 44 ILE HA . . . . . . . . . c16368_2kko 1 . 1 . 2333 . 2 1 44 ILE HB H 12.698 13.270 -11.225 . . . 1.0 . . . . . . . . . . . . B . 44 ILE HB . . . . . . . . . c16368_2kko 1 . 1 . 2334 . 2 1 44 ILE HD11 H 14.100 11.903 -9.593 . . . 1.0 . . . . . . . . . . . . B . 44 ILE HD11 . . . . . . . . . c16368_2kko 1 . 1 . 2335 . 2 1 44 ILE HD12 H 14.598 10.275 -10.048 . . . 1.0 . . . . . . . . . . . . B . 44 ILE HD12 . . . . . . . . . c16368_2kko 1 . 1 . 2336 . 2 1 44 ILE HD13 H 12.903 10.612 -9.691 . . . 1.0 . . . . . . . . . . . . B . 44 ILE HD13 . . . . . . . . . c16368_2kko 1 . 1 . 2337 . 2 1 44 ILE HG12 H 13.300 10.431 -12.091 . . . 1.0 . . . . . . . . . . . . B . 44 ILE HG12 . . . . . . . . . c16368_2kko 1 . 1 . 2338 . 2 1 44 ILE HG13 H 14.496 11.721 -11.992 . . . 1.0 . . . . . . . . . . . . B . 44 ILE HG13 . . . . . . . . . c16368_2kko 1 . 1 . 2339 . 2 1 44 ILE HG21 H 10.368 12.608 -11.456 . . . 1.0 . . . . . . . . . . . . B . 44 ILE HG21 . . . . . . . . . c16368_2kko 1 . 1 . 2340 . 2 1 44 ILE HG22 H 11.191 11.580 -10.284 . . . 1.0 . . . . . . . . . . . . B . 44 ILE HG22 . . . . . . . . . c16368_2kko 1 . 1 . 2341 . 2 1 44 ILE HG23 H 10.860 10.976 -11.907 . . . 1.0 . . . . . . . . . . . . B . 44 ILE HG23 . . . . . . . . . c16368_2kko 1 . 1 . 2342 . 2 1 44 ILE N N 13.687 13.271 -13.773 . . . 1.0 . . . . . . . . . . . . B . 44 ILE N . . . . . . . . . c16368_2kko 1 . 1 . 2343 . 2 1 44 ILE O O 10.222 13.577 -13.967 . . . 1.0 . . . . . . . . . . . . B . 44 ILE O . . . . . . . . . c16368_2kko 1 . 1 . 2344 . 2 1 45 ALA C C 10.255 16.458 -14.529 . . . 1.0 . . . . . . . . . . . . B . 45 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 2345 . 2 1 45 ALA CA C 10.684 16.178 -13.094 . . . 1.0 . . . . . . . . . . . . B . 45 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 2346 . 2 1 45 ALA CB C 11.302 17.420 -12.472 . . . 1.0 . . . . . . . . . . . . B . 45 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 2347 . 2 1 45 ALA H H 12.527 15.231 -12.667 . . . 1.0 . . . . . . . . . . . . B . 45 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 2348 . 2 1 45 ALA HA H 9.813 15.909 -12.513 . . . 1.0 . . . . . . . . . . . . B . 45 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 2349 . 2 1 45 ALA HB1 H 11.605 17.203 -11.459 . . . 1.0 . . . . . . . . . . . . B . 45 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 2350 . 2 1 45 ALA HB2 H 10.576 18.219 -12.468 . . . 1.0 . . . . . . . . . . . . B . 45 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2351 . 2 1 45 ALA HB3 H 12.165 17.720 -13.050 . . . 1.0 . . . . . . . . . . . . B . 45 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2352 . 2 1 45 ALA N N 11.627 15.071 -13.034 . . . 1.0 . . . . . . . . . . . . B . 45 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 2353 . 2 1 45 ALA O O 9.063 16.505 -14.835 . . . 1.0 . . . . . . . . . . . . B . 45 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 2354 . 2 1 46 THR C C 10.150 15.811 -17.473 . . . 1.0 . . . . . . . . . . . . B . 46 THR C . . . . . . . . . c16368_2kko 1 . 1 . 2355 . 2 1 46 THR CA C 10.967 16.921 -16.806 . . . 1.0 . . . . . . . . . . . . B . 46 THR CA . . . . . . . . . c16368_2kko 1 . 1 . 2356 . 2 1 46 THR CB C 12.284 17.136 -17.576 . . . 1.0 . . . . . . . . . . . . B . 46 THR CB . . . . . . . . . c16368_2kko 1 . 1 . 2357 . 2 1 46 THR CG2 C 12.020 17.643 -18.987 . . . 1.0 . . . . . . . . . . . . B . 46 THR CG2 . . . . . . . . . c16368_2kko 1 . 1 . 2358 . 2 1 46 THR H H 12.164 16.537 -15.109 . . . 1.0 . . . . . . . . . . . . B . 46 THR H . . . . . . . . . c16368_2kko 1 . 1 . 2359 . 2 1 46 THR HA H 10.400 17.840 -16.843 . . . 1.0 . . . . . . . . . . . . B . 46 THR HA . . . . . . . . . c16368_2kko 1 . 1 . 2360 . 2 1 46 THR HB H 12.808 16.194 -17.637 . . . 1.0 . . . . . . . . . . . . B . 46 THR HB . . . . . . . . . c16368_2kko 1 . 1 . 2361 . 2 1 46 THR HG1 H 13.818 17.619 -16.420 . . . 1.0 . . . . . . . . . . . . B . 46 THR HG1 . . . . . . . . . c16368_2kko 1 . 1 . 2362 . 2 1 46 THR HG21 H 11.405 16.931 -19.515 . . . 1.0 . . . . . . . . . . . . B . 46 THR HG21 . . . . . . . . . c16368_2kko 1 . 1 . 2363 . 2 1 46 THR HG22 H 12.959 17.763 -19.507 . . . 1.0 . . . . . . . . . . . . B . 46 THR HG22 . . . . . . . . . c16368_2kko 1 . 1 . 2364 . 2 1 46 THR HG23 H 11.511 18.594 -18.938 . . . 1.0 . . . . . . . . . . . . B . 46 THR HG23 . . . . . . . . . c16368_2kko 1 . 1 . 2365 . 2 1 46 THR N N 11.234 16.616 -15.410 . . . 1.0 . . . . . . . . . . . . B . 46 THR N . . . . . . . . . c16368_2kko 1 . 1 . 2366 . 2 1 46 THR O O 9.166 16.084 -18.163 . . . 1.0 . . . . . . . . . . . . B . 46 THR O . . . . . . . . . c16368_2kko 1 . 1 . 2367 . 2 1 46 THR OG1 O 13.101 18.086 -16.875 . . . 1.0 . . . . . . . . . . . . B . 46 THR OG1 . . . . . . . . . c16368_2kko 1 . 1 . 2368 . 2 1 47 ALA C C 8.412 13.332 -17.496 . . . 1.0 . . . . . . . . . . . . B . 47 ALA C . . . . . . . . . c16368_2kko 1 . 1 . 2369 . 2 1 47 ALA CA C 9.890 13.416 -17.865 . . . 1.0 . . . . . . . . . . . . B . 47 ALA CA . . . . . . . . . c16368_2kko 1 . 1 . 2370 . 2 1 47 ALA CB C 10.600 12.125 -17.487 . . . 1.0 . . . . . . . . . . . . B . 47 ALA CB . . . . . . . . . c16368_2kko 1 . 1 . 2371 . 2 1 47 ALA H H 11.280 14.403 -16.606 . . . 1.0 . . . . . . . . . . . . B . 47 ALA H . . . . . . . . . c16368_2kko 1 . 1 . 2372 . 2 1 47 ALA HA H 9.973 13.543 -18.935 . . . 1.0 . . . . . . . . . . . . B . 47 ALA HA . . . . . . . . . c16368_2kko 1 . 1 . 2373 . 2 1 47 ALA HB1 H 10.143 11.298 -18.010 . . . 1.0 . . . . . . . . . . . . B . 47 ALA HB1 . . . . . . . . . c16368_2kko 1 . 1 . 2374 . 2 1 47 ALA HB2 H 10.518 11.968 -16.421 . . . 1.0 . . . . . . . . . . . . B . 47 ALA HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2375 . 2 1 47 ALA HB3 H 11.642 12.194 -17.762 . . . 1.0 . . . . . . . . . . . . B . 47 ALA HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2376 . 2 1 47 ALA N N 10.540 14.560 -17.231 . . . 1.0 . . . . . . . . . . . . B . 47 ALA N . . . . . . . . . c16368_2kko 1 . 1 . 2377 . 2 1 47 ALA O O 7.574 12.980 -18.330 . . . 1.0 . . . . . . . . . . . . B . 47 ALA O . . . . . . . . . c16368_2kko 1 . 1 . 2378 . 2 1 48 THR C C 5.948 14.869 -16.083 . . . 1.0 . . . . . . . . . . . . B . 48 THR C . . . . . . . . . c16368_2kko 1 . 1 . 2379 . 2 1 48 THR CA C 6.720 13.588 -15.776 . . . 1.0 . . . . . . . . . . . . B . 48 THR CA . . . . . . . . . c16368_2kko 1 . 1 . 2380 . 2 1 48 THR CB C 6.680 13.307 -14.261 . . . 1.0 . . . . . . . . . . . . B . 48 THR CB . . . . . . . . . c16368_2kko 1 . 1 . 2381 . 2 1 48 THR CG2 C 7.071 11.866 -13.965 . . . 1.0 . . . . . . . . . . . . B . 48 THR CG2 . . . . . . . . . c16368_2kko 1 . 1 . 2382 . 2 1 48 THR H H 8.794 13.979 -15.646 . . . 1.0 . . . . . . . . . . . . B . 48 THR H . . . . . . . . . c16368_2kko 1 . 1 . 2383 . 2 1 48 THR HA H 6.239 12.765 -16.284 . . . 1.0 . . . . . . . . . . . . B . 48 THR HA . . . . . . . . . c16368_2kko 1 . 1 . 2384 . 2 1 48 THR HB H 5.673 13.471 -13.907 . . . 1.0 . . . . . . . . . . . . B . 48 THR HB . . . . . . . . . c16368_2kko 1 . 1 . 2385 . 2 1 48 THR HG1 H 8.469 13.840 -13.607 . . . 1.0 . . . . . . . . . . . . B . 48 THR HG1 . . . . . . . . . c16368_2kko 1 . 1 . 2386 . 2 1 48 THR HG21 H 8.071 11.684 -14.329 . . . 1.0 . . . . . . . . . . . . B . 48 THR HG21 . . . . . . . . . c16368_2kko 1 . 1 . 2387 . 2 1 48 THR HG22 H 6.382 11.196 -14.457 . . . 1.0 . . . . . . . . . . . . B . 48 THR HG22 . . . . . . . . . c16368_2kko 1 . 1 . 2388 . 2 1 48 THR HG23 H 7.039 11.698 -12.899 . . . 1.0 . . . . . . . . . . . . B . 48 THR HG23 . . . . . . . . . c16368_2kko 1 . 1 . 2389 . 2 1 48 THR N N 8.092 13.668 -16.255 . . . 1.0 . . . . . . . . . . . . B . 48 THR N . . . . . . . . . c16368_2kko 1 . 1 . 2390 . 2 1 48 THR O O 4.713 14.876 -16.094 . . . 1.0 . . . . . . . . . . . . B . 48 THR O . . . . . . . . . c16368_2kko 1 . 1 . 2391 . 2 1 48 THR OG1 O 7.570 14.196 -13.574 . . . 1.0 . . . . . . . . . . . . B . 48 THR OG1 . . . . . . . . . c16368_2kko 1 . 1 . 2392 . 2 1 49 GLY C C 5.721 17.955 -15.322 . . . 1.0 . . . . . . . . . . . . B . 49 GLY C . . . . . . . . . c16368_2kko 1 . 1 . 2393 . 2 1 49 GLY CA C 6.053 17.225 -16.608 . . . 1.0 . . . . . . . . . . . . B . 49 GLY CA . . . . . . . . . c16368_2kko 1 . 1 . 2394 . 2 1 49 GLY H H 7.659 15.867 -16.389 . . . 1.0 . . . . . . . . . . . . B . 49 GLY H . . . . . . . . . c16368_2kko 1 . 1 . 2395 . 2 1 49 GLY HA2 H 6.723 17.835 -17.196 . . . 1.0 . . . . . . . . . . . . B . 49 GLY HA2 . . . . . . . . . c16368_2kko 1 . 1 . 2396 . 2 1 49 GLY HA3 H 5.141 17.067 -17.165 . . . 1.0 . . . . . . . . . . . . B . 49 GLY HA3 . . . . . . . . . c16368_2kko 1 . 1 . 2397 . 2 1 49 GLY N N 6.679 15.944 -16.357 . . . 1.0 . . . . . . . . . . . . B . 49 GLY N . . . . . . . . . c16368_2kko 1 . 1 . 2398 . 2 1 49 GLY O O 4.704 18.646 -15.229 . . . 1.0 . . . . . . . . . . . . B . 49 GLY O . . . . . . . . . c16368_2kko 1 . 1 . 2399 . 2 1 50 MET C C 7.580 19.289 -12.660 . . . 1.0 . . . . . . . . . . . . B . 50 MET C . . . . . . . . . c16368_2kko 1 . 1 . 2400 . 2 1 50 MET CA C 6.373 18.439 -13.033 . . . 1.0 . . . . . . . . . . . . B . 50 MET CA . . . . . . . . . c16368_2kko 1 . 1 . 2401 . 2 1 50 MET CB C 6.095 17.399 -11.938 . . . 1.0 . . . . . . . . . . . . B . 50 MET CB . . . . . . . . . c16368_2kko 1 . 1 . 2402 . 2 1 50 MET CE C 5.389 14.277 -10.968 . . . 1.0 . . . . . . . . . . . . B . 50 MET CE . . . . . . . . . c16368_2kko 1 . 1 . 2403 . 2 1 50 MET CG C 4.716 16.764 -12.040 . . . 1.0 . . . . . . . . . . . . B . 50 MET CG . . . . . . . . . c16368_2kko 1 . 1 . 2404 . 2 1 50 MET H H 7.379 17.243 -14.459 . . . 1.0 . . . . . . . . . . . . B . 50 MET H . . . . . . . . . c16368_2kko 1 . 1 . 2405 . 2 1 50 MET HA H 5.513 19.086 -13.123 . . . 1.0 . . . . . . . . . . . . B . 50 MET HA . . . . . . . . . c16368_2kko 1 . 1 . 2406 . 2 1 50 MET HB2 H 6.835 16.614 -12.002 . . . 1.0 . . . . . . . . . . . . B . 50 MET HB2 . . . . . . . . . c16368_2kko 1 . 1 . 2407 . 2 1 50 MET HB3 H 6.174 17.878 -10.973 . . . 1.0 . . . . . . . . . . . . B . 50 MET HB3 . . . . . . . . . c16368_2kko 1 . 1 . 2408 . 2 1 50 MET HE1 H 5.236 13.526 -10.204 . . . 1.0 . . . . . . . . . . . . B . 50 MET HE1 . . . . . . . . . c16368_2kko 1 . 1 . 2409 . 2 1 50 MET HE2 H 6.422 14.595 -10.958 . . . 1.0 . . . . . . . . . . . . B . 50 MET HE2 . . . . . . . . . c16368_2kko 1 . 1 . 2410 . 2 1 50 MET HE3 H 5.150 13.859 -11.935 . . . 1.0 . . . . . . . . . . . . B . 50 MET HE3 . . . . . . . . . c16368_2kko 1 . 1 . 2411 . 2 1 50 MET HG2 H 3.977 17.551 -12.082 . . . 1.0 . . . . . . . . . . . . B . 50 MET HG2 . . . . . . . . . c16368_2kko 1 . 1 . 2412 . 2 1 50 MET HG3 H 4.669 16.184 -12.951 . . . 1.0 . . . . . . . . . . . . B . 50 MET HG3 . . . . . . . . . c16368_2kko 1 . 1 . 2413 . 2 1 50 MET N N 6.576 17.796 -14.322 . . . 1.0 . . . . . . . . . . . . B . 50 MET N . . . . . . . . . c16368_2kko 1 . 1 . 2414 . 2 1 50 MET O O 8.685 19.063 -13.150 . . . 1.0 . . . . . . . . . . . . B . 50 MET O . . . . . . . . . c16368_2kko 1 . 1 . 2415 . 2 1 50 MET SD S 4.325 15.683 -10.644 . . . 1.0 . . . . . . . . . . . . B . 50 MET SD . . . . . . . . . c16368_2kko 1 . 1 . 2416 . 2 1 51 ASN C C 9.438 20.373 -10.515 . . . 1.0 . . . . . . . . . . . . B . 51 ASN C . . . . . . . . . c16368_2kko 1 . 1 . 2417 . 2 1 51 ASN CA C 8.429 21.152 -11.345 . . . 1.0 . . . . . . . . . . . . B . 51 ASN CA . . . . . . . . . c16368_2kko 1 . 1 . 2418 . 2 1 51 ASN CB C 7.862 22.305 -10.511 . . . 1.0 . . . . . . . . . . . . B . 51