data_17302 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17302 _Entry.Title ; 1H and 15N RESONANCE ASSIGNMENT OF HUMAN APO L-FABP ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-11-17 _Entry.Accession_date 2010-11-17 _Entry.Last_release_date 2012-06-05 _Entry.Original_release_date 2012-06-05 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _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 Jun Cai . . . 17302 2 Christian Luecke . . . 17302 3 Zhongjing Chen . . . 17302 4 Ye Qiao . . . 17302 5 Elena Klimtchuk . S. . 17302 6 James Hamilton . A. . 17302 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 1 'not applicable' 'not applicable' . 17302 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'apo form' . 17302 'fatty acid carrier' . 17302 'lipid binding protein' . 17302 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17302 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 140 17302 '1H chemical shifts' 938 17302 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2012-06-05 2010-11-17 original author . 17302 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 15429 'rat apo L-FABP assignment' 17302 BMRB 15433 'rat holo L-FABP assignment' 17302 BMRB 17303 'human apo L-FABP assignment' 17302 PDB 1LFO 'rat holo L-FABP X-ray structure' 17302 PDB 2F73 'human L-FABP X-ray structure' 17302 PDB 2JU3 'rat apo L-FABP solution structure' 17302 PDB 2JU7 'rat holo L-FABP solution structure' 17302 PDB 2L67 'BMRB Entry Tracking System' 17302 PDB 2PY1 'human L-FABP solution structure' 17302 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17302 _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 Structure and Backbone Dynamics of Human Liver Fatty Acid Binding Protein: Fatty Acid Binding Revisited' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biophys. J.' _Citation.Journal_name_full 'Biophysical Journal' _Citation.Journal_volume 102 _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 2585 _Citation.Page_last 2594 _Citation.Year 2012 _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 Jun Cai . . . 17302 1 2 Christian Luecke . . . 17302 1 3 Zhongjing Chen . . . 17302 1 4 Ye Qiao . . . 17302 1 5 Elena Klimtchuk . S. . 17302 1 6 James Hamilton . A. . 17302 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'apo form' 17302 1 'fatty acid carrier' 17302 1 'lipid binding protein' 17302 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17302 _Assembly.ID 1 _Assembly.Name 'human liver fatty acid binding protein' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'human liver fatty acid binding protein' 1 $L-FABP A . yes native no no . . . 17302 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_L-FABP _Entity.Sf_category entity _Entity.Sf_framecode L-FABP _Entity.Entry_ID 17302 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name L-FABP _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 ; SFSGKYQLQSQENFEAFMKA IGLPEELIQKGKDIKGVSEI VQNGKHFKFTITAGSKVIQN EFTVGEECELETMTGEKVKT VVQLEGDNKLVTTFKNIKSV TELNGDIITNTMTLGDIVFK RISKRI ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; the N-terminal residue Met1 is missing; the assignments thus start with Ser2 ; _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 126 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14095.292 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 17303 . L-FABP . . . . . 100.00 126 100.00 100.00 6.53e-82 . . . . 17302 1 2 no BMRB 19160 . hL-FABP . . . . . 100.00 135 99.21 99.21 1.80e-81 . . . . 17302 1 3 no BMRB 19188 . hL-FABP . . . . . 100.00 135 99.21 99.21 1.80e-81 . . . . 17302 1 4 no BMRB 19189 . hL-FABP . . . . . 100.00 135 99.21 99.21 1.80e-81 . . . . 17302 1 5 no BMRB 25333 . hL-FABP . . . . . 100.00 135 99.21 99.21 1.80e-81 . . . . 17302 1 6 no PDB 2F73 . "Crystal Structure Of Human Fatty Acid Binding Protein 1 (Fabp1)" . . . . . 100.00 149 100.00 100.00 3.57e-82 . . . . 17302 1 7 no PDB 2L67 . "Solution Structure Of Human Apo L-fabp" . . . . . 100.00 126 100.00 100.00 6.53e-82 . . . . 17302 1 8 no PDB 2L68 . "Solution Structure Of Human Holo L-fabp" . . . . . 100.00 126 100.00 100.00 6.53e-82 . . . . 17302 1 9 no PDB 2LKK . "Human L-fabp In Complex With Oleate" . . . . . 100.00 126 100.00 100.00 6.53e-82 . . . . 17302 1 10 no PDB 2PY1 . "Solution Structure Of Human Liver Fatty Acid Binding Protein" . . . . . 100.00 129 100.00 100.00 5.85e-82 . . . . 17302 1 11 no PDB 3B2H . "Iodide Derivative Of Human Lfabp At High Resolution" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 12 no PDB 3B2I . "Iodide Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 13 no PDB 3B2J . "Iodide Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 14 no PDB 3B2K . "Iodide Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 15 no PDB 3B2L . "Iodide Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 16 no PDB 3STK . "Crystal Structure Of Human Lfabp Complex With Two Molecules Of Palmitic Acid (Holo-Lfabp)" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 17 no PDB 3STM . "Structure Of Human Lfabp In Complex With One Molecule Of Palmitic Acid" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 18 no PDB 3STN . "Structure Of Human Lfabp (Apo-Lfabp)" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 19 no PDB 3VG2 . "Iodide Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 20 no PDB 3VG3 . "Cadmium Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 21 no PDB 3VG4 . "Cadmium Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 22 no PDB 3VG5 . "Barium Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 23 no PDB 3VG6 . "Barium Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 24 no PDB 3VG7 . "Structure Of Human Lfabp At High Resolution From S-sad" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1 25 no DBJ BAI46102 . "fatty acid binding protein 1, liver [synthetic construct]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1 26 no EMBL CAG46887 . "FABP1 [Homo sapiens]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1 27 no EMBL CAH90116 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 127 97.62 98.41 8.13e-80 . . . . 17302 1 28 no GB AAA52418 . "fatty acid binding protein [Homo sapiens]" . . . . . 100.00 127 99.21 99.21 1.82e-81 . . . . 17302 1 29 no GB AAA52419 . "L-FABP [Homo sapiens]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1 30 no GB AAH22287 . "FABP1 protein, partial [Homo sapiens]" . . . . . 99.21 134 99.20 100.00 7.94e-81 . . . . 17302 1 31 no GB AAH32801 . "Fatty acid binding protein 1, liver [Homo sapiens]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1 32 no GB AAX37108 . "fatty acid binding protein 1 [synthetic construct]" . . . . . 100.00 128 100.00 100.00 5.31e-82 . . . . 17302 1 33 no REF NP_001125017 . "fatty acid-binding protein, liver [Pongo abelii]" . . . . . 100.00 127 97.62 98.41 8.13e-80 . . . . 17302 1 34 no REF NP_001434 . "fatty acid-binding protein, liver [Homo sapiens]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1 35 no REF XP_001140263 . "PREDICTED: fatty acid-binding protein, liver [Pan troglodytes]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1 36 no REF XP_003268834 . "PREDICTED: fatty acid-binding protein, liver [Nomascus leucogenys]" . . . . . 100.00 127 98.41 99.21 1.03e-80 . . . . 17302 1 37 no REF XP_003805902 . "PREDICTED: fatty acid-binding protein, liver [Pan paniscus]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1 38 no SP P07148 . "RecName: Full=Fatty acid-binding protein, liver; AltName: Full=Fatty acid-binding protein 1; AltName: Full=Liver-type fatty aci" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'fatty acid carrier' 17302 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 2 SER . 17302 1 2 3 PHE . 17302 1 3 4 SER . 17302 1 4 5 GLY . 17302 1 5 6 LYS . 17302 1 6 7 TYR . 17302 1 7 8 GLN . 17302 1 8 9 LEU . 17302 1 9 10 GLN . 17302 1 10 11 SER . 17302 1 11 12 GLN . 17302 1 12 13 GLU . 17302 1 13 14 ASN . 17302 1 14 15 PHE . 17302 1 15 16 GLU . 17302 1 16 17 ALA . 17302 1 17 18 PHE . 17302 1 18 19 MET . 17302 1 19 20 LYS . 17302 1 20 21 ALA . 17302 1 21 22 ILE . 17302 1 22 23 GLY . 17302 1 23 24 LEU . 17302 1 24 25 PRO . 17302 1 25 26 GLU . 17302 1 26 27 GLU . 17302 1 27 28 LEU . 17302 1 28 29 ILE . 17302 1 29 30 GLN . 17302 1 30 31 LYS . 17302 1 31 32 GLY . 17302 1 32 33 LYS . 17302 1 33 34 ASP . 17302 1 34 35 ILE . 17302 1 35 36 LYS . 17302 1 36 37 GLY . 17302 1 37 38 VAL . 17302 1 38 39 SER . 17302 1 39 40 GLU . 17302 1 40 41 ILE . 17302 1 41 42 VAL . 17302 1 42 43 GLN . 17302 1 43 44 ASN . 17302 1 44 45 GLY . 17302 1 45 46 LYS . 17302 1 46 47 HIS . 17302 1 47 48 PHE . 17302 1 48 49 LYS . 17302 1 49 50 PHE . 17302 1 50 51 THR . 17302 1 51 52 ILE . 17302 1 52 53 THR . 17302 1 53 54 ALA . 17302 1 54 55 GLY . 17302 1 55 56 SER . 17302 1 56 57 LYS . 17302 1 57 58 VAL . 17302 1 58 59 ILE . 17302 1 59 60 GLN . 17302 1 60 61 ASN . 17302 1 61 62 GLU . 17302 1 62 63 PHE . 17302 1 63 64 THR . 17302 1 64 65 VAL . 17302 1 65 66 GLY . 17302 1 66 67 GLU . 17302 1 67 68 GLU . 17302 1 68 69 CYS . 17302 1 69 70 GLU . 17302 1 70 71 LEU . 17302 1 71 72 GLU . 17302 1 72 73 THR . 17302 1 73 74 MET . 17302 1 74 75 THR . 17302 1 75 76 GLY . 17302 1 76 77 GLU . 17302 1 77 78 LYS . 17302 1 78 79 VAL . 17302 1 79 80 LYS . 17302 1 80 81 THR . 17302 1 81 82 VAL . 17302 1 82 83 VAL . 17302 1 83 84 GLN . 17302 1 84 85 LEU . 17302 1 85 86 GLU . 17302 1 86 87 GLY . 17302 1 87 88 ASP . 17302 1 88 89 ASN . 17302 1 89 90 LYS . 17302 1 90 91 LEU . 17302 1 91 92 VAL . 17302 1 92 93 THR . 17302 1 93 94 THR . 17302 1 94 95 PHE . 17302 1 95 96 LYS . 17302 1 96 97 ASN . 17302 1 97 98 ILE . 17302 1 98 99 LYS . 17302 1 99 100 SER . 17302 1 100 101 VAL . 17302 1 101 102 THR . 17302 1 102 103 GLU . 17302 1 103 104 LEU . 17302 1 104 105 ASN . 17302 1 105 106 GLY . 17302 1 106 107 ASP . 17302 1 107 108 ILE . 17302 1 108 109 ILE . 17302 1 109 110 THR . 17302 1 110 111 ASN . 17302 1 111 112 THR . 17302 1 112 113 MET . 17302 1 113 114 THR . 17302 1 114 115 LEU . 17302 1 115 116 GLY . 17302 1 116 117 ASP . 17302 1 117 118 ILE . 17302 1 118 119 VAL . 17302 1 119 120 PHE . 17302 1 120 121 LYS . 17302 1 121 122 ARG . 17302 1 122 123 ILE . 17302 1 123 124 SER . 17302 1 124 125 LYS . 17302 1 125 126 ARG . 17302 1 126 127 ILE . 17302 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 . SER 1 1 17302 1 . PHE 2 2 17302 1 . SER 3 3 17302 1 . GLY 4 4 17302 1 . LYS 5 5 17302 1 . TYR 6 6 17302 1 . GLN 7 7 17302 1 . LEU 8 8 17302 1 . GLN 9 9 17302 1 . SER 10 10 17302 1 . GLN 11 11 17302 1 . GLU 12 12 17302 1 . ASN 13 13 17302 1 . PHE 14 14 17302 1 . GLU 15 15 17302 1 . ALA 16 16 17302 1 . PHE 17 17 17302 1 . MET 18 18 17302 1 . LYS 19 19 17302 1 . ALA 20 20 17302 1 . ILE 21 21 17302 1 . GLY 22 22 17302 1 . LEU 23 23 17302 1 . PRO 24 24 17302 1 . GLU 25 25 17302 1 . GLU 26 26 17302 1 . LEU 27 27 17302 1 . ILE 28 28 17302 1 . GLN 29 29 17302 1 . LYS 30 30 17302 1 . GLY 31 31 17302 1 . LYS 32 32 17302 1 . ASP 33 33 17302 1 . ILE 34 34 17302 1 . LYS 35 35 17302 1 . GLY 36 36 17302 1 . VAL 37 37 17302 1 . SER 38 38 17302 1 . GLU 39 39 17302 1 . ILE 40 40 17302 1 . VAL 41 41 17302 1 . GLN 42 42 17302 1 . ASN 43 43 17302 1 . GLY 44 44 17302 1 . LYS 45 45 17302 1 . HIS 46 46 17302 1 . PHE 47 47 17302 1 . LYS 48 48 17302 1 . PHE 49 49 17302 1 . THR 50 50 17302 1 . ILE 51 51 17302 1 . THR 52 52 17302 1 . ALA 53 53 17302 1 . GLY 54 54 17302 1 . SER 55 55 17302 1 . LYS 56 56 17302 1 . VAL 57 57 17302 1 . ILE 58 58 17302 1 . GLN 59 59 17302 1 . ASN 60 60 17302 1 . GLU 61 61 17302 1 . PHE 62 62 17302 1 . THR 63 63 17302 1 . VAL 64 64 17302 1 . GLY 65 65 17302 1 . GLU 66 66 17302 1 . GLU 67 67 17302 1 . CYS 68 68 17302 1 . GLU 69 69 17302 1 . LEU 70 70 17302 1 . GLU 71 71 17302 1 . THR 72 72 17302 1 . MET 73 73 17302 1 . THR 74 74 17302 1 . GLY 75 75 17302 1 . GLU 76 76 17302 1 . LYS 77 77 17302 1 . VAL 78 78 17302 1 . LYS 79 79 17302 1 . THR 80 80 17302 1 . VAL 81 81 17302 1 . VAL 82 82 17302 1 . GLN 83 83 17302 1 . LEU 84 84 17302 1 . GLU 85 85 17302 1 . GLY 86 86 17302 1 . ASP 87 87 17302 1 . ASN 88 88 17302 1 . LYS 89 89 17302 1 . LEU 90 90 17302 1 . VAL 91 91 17302 1 . THR 92 92 17302 1 . THR 93 93 17302 1 . PHE 94 94 17302 1 . LYS 95 95 17302 1 . ASN 96 96 17302 1 . ILE 97 97 17302 1 . LYS 98 98 17302 1 . SER 99 99 17302 1 . VAL 100 100 17302 1 . THR 101 101 17302 1 . GLU 102 102 17302 1 . LEU 103 103 17302 1 . ASN 104 104 17302 1 . GLY 105 105 17302 1 . ASP 106 106 17302 1 . ILE 107 107 17302 1 . ILE 108 108 17302 1 . THR 109 109 17302 1 . ASN 110 110 17302 1 . THR 111 111 17302 1 . MET 112 112 17302 1 . THR 113 113 17302 1 . LEU 114 114 17302 1 . GLY 115 115 17302 1 . ASP 116 116 17302 1 . ILE 117 117 17302 1 . VAL 118 118 17302 1 . PHE 119 119 17302 1 . LYS 120 120 17302 1 . ARG 121 121 17302 1 . ILE 122 122 17302 1 . SER 123 123 17302 1 . LYS 124 124 17302 1 . ARG 125 125 17302 1 . ILE 126 126 17302 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 17302 _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 $L-FABP . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17302 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 17302 _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 $L-FABP . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli MG1655 . . . . . . . . . . . . . . . pMON . . . . . . 17302 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17302 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'non-labeled L-FABP' _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 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 17302 1 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 17302 1 3 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % . . . . 17302 1 4 'human liver fatty acid binding protein' 'natural abundance' . . 1 $L-FABP . . . 2 3 mM . . . . 17302 1 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17302 1 6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17302 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 17302 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '15N-labeled L-FABP' _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 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 17302 2 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 17302 2 3 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % . . . . 17302 2 4 'human liver fatty acid binding protein' [U-15N] . . 1 $L-FABP . . . 2 3 mM . . . . 17302 2 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17302 2 6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17302 2 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 17302 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 17302 1 pH 6.0 . pH 17302 1 pressure 1 . atm 17302 1 temperature 298 . K 17302 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 17302 _Software.ID 1 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17302 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17302 1 stop_ save_ save_DISCOVER _Software.Sf_category software _Software.Sf_framecode DISCOVER _Software.Entry_ID 17302 _Software.ID 2 _Software.Name DISCOVER _Software.Version 2000 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 17302 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17302 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 17302 _Software.ID 3 _Software.Name NMRView _Software.Version 8.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 17302 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17302 3 'peak picking' 17302 3 stop_ save_ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 17302 _Software.ID 4 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17302 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17302 4 processing 17302 4 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 17302 _Software.ID 5 _Software.Name TOPSPIN _Software.Version 1.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17302 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17302 5 processing 17302 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17302 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17302 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ 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 17302 _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 Bruker DMX . 500 . . . 17302 1 2 spectrometer_2 Bruker Avance . 800 . . . 17302 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 17302 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17302 1 2 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17302 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17302 1 4 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17302 1 5 '3D 1H-15N TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17302 1 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 17302 _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 . . . . . . . . . 17302 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 17302 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 17302 _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' . . . 17302 1 2 '2D 1H-1H TOCSY' . . . 17302 1 3 '2D 1H-1H NOESY' . . . 17302 1 4 '3D 1H-15N NOESY' . . . 17302 1 5 '3D 1H-15N TOCSY' . . . 17302 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 SER HA H 1 4.30 0.01 . 1 . . . . 2 SER HA . 17302 1 2 . 1 1 1 1 SER HB2 H 1 4.24 0.01 . 2 . . . . 2 SER HB2 . 17302 1 3 . 1 1 1 1 SER HB3 H 1 4.02 0.01 . 2 . . . . 2 SER HB3 . 17302 1 4 . 1 1 2 2 PHE H H 1 9.47 0.01 . 1 . . . . 3 PHE H . 17302 1 5 . 1 1 2 2 PHE HA H 1 4.34 0.01 . 1 . . . . 3 PHE HA . 17302 1 6 . 1 1 2 2 PHE HB2 H 1 3.20 0.01 . 1 . . . . 3 PHE HB2 . 17302 1 7 . 1 1 2 2 PHE HB3 H 1 3.20 0.01 . 1 . . . . 3 PHE HB3 . 17302 1 8 . 1 1 2 2 PHE HD1 H 1 7.41 0.01 . 1 . . . . 3 PHE HD1 . 17302 1 9 . 1 1 2 2 PHE HD2 H 1 7.41 0.01 . 1 . . . . 3 PHE HD2 . 17302 1 10 . 1 1 2 2 PHE HE1 H 1 7.12 0.01 . 1 . . . . 3 PHE HE1 . 17302 1 11 . 1 1 2 2 PHE HE2 H 1 7.12 0.01 . 1 . . . . 3 PHE HE2 . 17302 1 12 . 1 1 2 2 PHE HZ H 1 6.99 0.01 . 1 . . . . 3 PHE HZ . 17302 1 13 . 1 1 2 2 PHE N N 15 119.6 0.1 . 1 . . . . 3 PHE N . 17302 1 14 . 1 1 3 3 SER H H 1 8.38 0.01 . 1 . . . . 4 SER H . 17302 1 15 . 1 1 3 3 SER HA H 1 4.45 0.01 . 1 . . . . 4 SER HA . 17302 1 16 . 1 1 3 3 SER HB2 H 1 3.85 0.01 . 1 . . . . 4 SER HB2 . 17302 1 17 . 1 1 3 3 SER HB3 H 1 4.02 0.01 . 1 . . . . 4 SER HB3 . 17302 1 18 . 1 1 3 3 SER N N 15 116.0 0.1 . 1 . . . . 4 SER N . 17302 1 19 . 1 1 4 4 GLY H H 1 9.05 0.01 . 1 . . . . 5 GLY H . 17302 1 20 . 1 1 4 4 GLY HA2 H 1 3.81 0.01 . 1 . . . . 5 GLY HA2 . 17302 1 21 . 1 1 4 4 GLY HA3 H 1 3.93 0.01 . 1 . . . . 5 GLY HA3 . 17302 1 22 . 1 1 4 4 GLY N N 15 111.5 0.1 . 1 . . . . 5 GLY N . 17302 1 23 . 1 1 5 5 LYS H H 1 8.26 0.01 . 1 . . . . 6 LYS H . 17302 1 24 . 1 1 5 5 LYS HA H 1 5.19 0.01 . 1 . . . . 6 LYS HA . 17302 1 25 . 1 1 5 5 LYS HB2 H 1 1.61 0.01 . 1 . . . . 6 LYS HB2 . 17302 1 26 . 1 1 5 5 LYS HB3 H 1 1.61 0.01 . 1 . . . . 6 LYS HB3 . 17302 1 27 . 1 1 5 5 LYS HG2 H 1 1.19 0.01 . 1 . . . . 6 LYS HG2 . 17302 1 28 . 1 1 5 5 LYS HG3 H 1 1.41 0.01 . 1 . . . . 6 LYS HG3 . 17302 1 29 . 1 1 5 5 LYS HD2 H 1 1.62 0.01 . 1 . . . . 6 LYS HD2 . 17302 1 30 . 1 1 5 5 LYS HD3 H 1 1.62 0.01 . 1 . . . . 6 LYS HD3 . 17302 1 31 . 1 1 5 5 LYS HE2 H 1 2.87 0.01 . 1 . . . . 6 LYS HE2 . 17302 1 32 . 1 1 5 5 LYS HE3 H 1 2.87 0.01 . 1 . . . . 6 LYS HE3 . 17302 1 33 . 1 1 5 5 LYS N N 15 120.2 0.1 . 1 . . . . 6 LYS N . 17302 1 34 . 1 1 6 6 TYR H H 1 9.24 0.01 . 1 . . . . 7 TYR H . 17302 1 35 . 1 1 6 6 TYR HA H 1 5.08 0.01 . 1 . . . . 7 TYR HA . 17302 1 36 . 1 1 6 6 TYR HB2 H 1 2.71 0.01 . 1 . . . . 7 TYR HB2 . 17302 1 37 . 1 1 6 6 TYR HB3 H 1 2.42 0.01 . 1 . . . . 7 TYR HB3 . 17302 1 38 . 1 1 6 6 TYR HD1 H 1 6.79 0.01 . 1 . . . . 7 TYR HD1 . 17302 1 39 . 1 1 6 6 TYR HD2 H 1 6.79 0.01 . 1 . . . . 7 TYR HD2 . 17302 1 40 . 1 1 6 6 TYR HE1 H 1 6.50 0.01 . 1 . . . . 7 TYR HE1 . 17302 1 41 . 1 1 6 6 TYR HE2 H 1 6.50 0.01 . 1 . . . . 7 TYR HE2 . 17302 1 42 . 1 1 6 6 TYR N N 15 119.7 0.1 . 1 . . . . 7 TYR N . 17302 1 43 . 1 1 7 7 GLN H H 1 9.25 0.01 . 1 . . . . 8 GLN H . 17302 1 44 . 1 1 7 7 GLN HA H 1 5.01 0.01 . 1 . . . . 8 GLN HA . 17302 1 45 . 1 1 7 7 GLN HB2 H 1 2.09 0.01 . 1 . . . . 8 GLN HB2 . 17302 1 46 . 1 1 7 7 GLN HB3 H 1 2.09 0.01 . 1 . . . . 8 GLN HB3 . 17302 1 47 . 1 1 7 7 GLN HG2 H 1 2.45 0.01 . 1 . . . . 8 GLN HG2 . 17302 1 48 . 1 1 7 7 GLN HG3 H 1 2.24 0.01 . 1 . . . . 8 GLN HG3 . 17302 1 49 . 1 1 7 7 GLN HE21 H 1 7.54 0.01 . 1 . . . . 8 GLN HE21 . 17302 1 50 . 1 1 7 7 GLN HE22 H 1 6.84 0.01 . 1 . . . . 8 GLN HE22 . 17302 1 51 . 1 1 7 7 GLN N N 15 124.4 0.1 . 1 . . . . 8 GLN N . 17302 1 52 . 1 1 7 7 GLN NE2 N 15 112.2 0.1 . 1 . . . . 8 GLN NE2 . 17302 1 53 . 1 1 8 8 LEU H H 1 8.66 0.01 . 1 . . . . 9 LEU H . 17302 1 54 . 1 1 8 8 LEU HA H 1 4.57 0.01 . 1 . . . . 9 LEU HA . 17302 1 55 . 1 1 8 8 LEU HB2 H 1 1.61 0.01 . 1 . . . . 9 LEU HB2 . 17302 1 56 . 1 1 8 8 LEU HB3 H 1 1.73 0.01 . 1 . . . . 9 LEU HB3 . 17302 1 57 . 1 1 8 8 LEU HG H 1 1.46 0.01 . 1 . . . . 9 LEU HG . 17302 1 58 . 1 1 8 8 LEU HD11 H 1 0.94 0.01 . 1 . . . . 9 LEU MD1 . 17302 1 59 . 1 1 8 8 LEU HD12 H 1 0.94 0.01 . 1 . . . . 9 LEU MD1 . 17302 1 60 . 1 1 8 8 LEU HD13 H 1 0.94 0.01 . 1 . . . . 9 LEU MD1 . 17302 1 61 . 1 1 8 8 LEU HD21 H 1 0.90 0.01 . 1 . . . . 9 LEU MD2 . 17302 1 62 . 1 1 8 8 LEU HD22 H 1 0.90 0.01 . 1 . . . . 9 LEU MD2 . 17302 1 63 . 1 1 8 8 LEU HD23 H 1 0.90 0.01 . 1 . . . . 9 LEU MD2 . 17302 1 64 . 1 1 8 8 LEU N N 15 132.5 0.1 . 1 . . . . 9 LEU N . 17302 1 65 . 1 1 9 9 GLN H H 1 10.19 0.01 . 1 . . . . 10 GLN H . 17302 1 66 . 1 1 9 9 GLN HA H 1 4.56 0.01 . 1 . . . . 10 GLN HA . 17302 1 67 . 1 1 9 9 GLN HB2 H 1 2.22 0.01 . 2 . . . . 10 GLN HB2 . 17302 1 68 . 1 1 9 9 GLN HB3 H 1 2.00 0.01 . 2 . . . . 10 GLN HB3 . 17302 1 69 . 1 1 9 9 GLN HG2 H 1 2.44 0.01 . 2 . . . . 10 GLN HG2 . 17302 1 70 . 1 1 9 9 GLN HG3 H 1 2.41 0.01 . 2 . . . . 10 GLN HG3 . 17302 1 71 . 1 1 9 9 GLN HE21 H 1 7.24 0.01 . 1 . . . . 10 GLN HE21 . 17302 1 72 . 1 1 9 9 GLN HE22 H 1 7.11 0.01 . 1 . . . . 10 GLN HE22 . 17302 1 73 . 1 1 9 9 GLN N N 15 126.1 0.1 . 1 . . . . 10 GLN N . 17302 1 74 . 1 1 9 9 GLN NE2 N 15 113.3 0.1 . 1 . . . . 10 GLN NE2 . 17302 1 75 . 1 1 10 10 SER H H 1 8.04 0.01 . 1 . . . . 11 SER H . 17302 1 76 . 1 1 10 10 SER HA H 1 4.73 0.01 . 1 . . . . 11 SER HA . 17302 1 77 . 1 1 10 10 SER HB2 H 1 3.91 0.01 . 1 . . . . 11 SER HB2 . 17302 1 78 . 1 1 10 10 SER HB3 H 1 3.88 0.01 . 1 . . . . 11 SER HB3 . 17302 1 79 . 1 1 10 10 SER N N 15 111.1 0.1 . 1 . . . . 11 SER N . 17302 1 80 . 1 1 11 11 GLN H H 1 8.65 0.01 . 1 . . . . 12 GLN H . 17302 1 81 . 1 1 11 11 GLN HA H 1 5.55 0.01 . 1 . . . . 12 GLN HA . 17302 1 82 . 1 1 11 11 GLN HB2 H 1 2.34 0.01 . 1 . . . . 12 GLN HB2 . 17302 1 83 . 1 1 11 11 GLN HB3 H 1 2.30 0.01 . 1 . . . . 12 GLN HB3 . 17302 1 84 . 1 1 11 11 GLN HG2 H 1 2.46 0.01 . 1 . . . . 12 GLN HG2 . 17302 1 85 . 1 1 11 11 GLN HG3 H 1 2.52 0.01 . 1 . . . . 12 GLN HG3 . 17302 1 86 . 1 1 11 11 GLN HE21 H 1 6.07 0.01 . 1 . . . . 12 GLN HE21 . 17302 1 87 . 1 1 11 11 GLN HE22 H 1 7.11 0.01 . 1 . . . . 12 GLN HE22 . 17302 1 88 . 1 1 11 11 GLN N N 15 116.6 0.1 . 1 . . . . 12 GLN N . 17302 1 89 . 1 1 11 11 GLN NE2 N 15 109.1 0.1 . 1 . . . . 12 GLN NE2 . 17302 1 90 . 1 1 12 12 GLU H H 1 9.16 0.01 . 1 . . . . 13 GLU H . 17302 1 91 . 1 1 12 12 GLU HA H 1 4.87 0.01 . 1 . . . . 13 GLU HA . 17302 1 92 . 1 1 12 12 GLU HB2 H 1 2.17 0.01 . 1 . . . . 13 GLU HB2 . 17302 1 93 . 1 1 12 12 GLU HB3 H 1 1.95 0.01 . 1 . . . . 13 GLU HB3 . 17302 1 94 . 1 1 12 12 GLU HG2 H 1 2.29 0.01 . 1 . . . . 13 GLU HG2 . 17302 1 95 . 1 1 12 12 GLU HG3 H 1 2.33 0.01 . 1 . . . . 13 GLU HG3 . 17302 1 96 . 1 1 12 12 GLU N N 15 121.1 0.1 . 1 . . . . 13 GLU N . 17302 1 97 . 1 1 13 13 ASN H H 1 9.32 0.01 . 1 . . . . 14 ASN H . 17302 1 98 . 1 1 13 13 ASN HA H 1 4.86 0.01 . 1 . . . . 14 ASN HA . 17302 1 99 . 1 1 13 13 ASN HB2 H 1 3.58 0.01 . 1 . . . . 14 ASN HB2 . 17302 1 100 . 1 1 13 13 ASN HB3 H 1 3.23 0.01 . 1 . . . . 14 ASN HB3 . 17302 1 101 . 1 1 13 13 ASN HD21 H 1 7.18 0.01 . 1 . . . . 14 ASN HD21 . 17302 1 102 . 1 1 13 13 ASN HD22 H 1 7.96 0.01 . 1 . . . . 14 ASN HD22 . 17302 1 103 . 1 1 13 13 ASN N N 15 117.1 0.1 . 1 . . . . 14 ASN N . 17302 1 104 . 1 1 13 13 ASN ND2 N 15 114.7 0.1 . 1 . . . . 14 ASN ND2 . 17302 1 105 . 1 1 14 14 PHE H H 1 8.49 0.01 . 1 . . . . 15 PHE H . 17302 1 106 . 1 1 14 14 PHE HA H 1 3.58 0.01 . 1 . . . . 15 PHE HA . 17302 1 107 . 1 1 14 14 PHE HB2 H 1 3.02 0.01 . 1 . . . . 15 PHE HB2 . 17302 1 108 . 1 1 14 14 PHE HB3 H 1 3.08 0.01 . 1 . . . . 15 PHE HB3 . 17302 1 109 . 1 1 14 14 PHE HD1 H 1 7.10 0.01 . 1 . . . . 15 PHE HD1 . 17302 1 110 . 1 1 14 14 PHE HD2 H 1 7.10 0.01 . 1 . . . . 15 PHE HD2 . 17302 1 111 . 1 1 14 14 PHE HE1 H 1 7.44 0.01 . 1 . . . . 15 PHE HE1 . 17302 1 112 . 1 1 14 14 PHE HE2 H 1 7.44 0.01 . 1 . . . . 15 PHE HE2 . 17302 1 113 . 1 1 14 14 PHE HZ H 1 7.17 0.01 . 1 . . . . 15 PHE HZ . 17302 1 114 . 1 1 14 14 PHE N N 15 118.2 0.1 . 1 . . . . 15 PHE N . 17302 1 115 . 1 1 15 15 GLU H H 1 9.49 0.01 . 1 . . . . 16 GLU H . 17302 1 116 . 1 1 15 15 GLU HA H 1 3.51 0.01 . 1 . . . . 16 GLU HA . 17302 1 117 . 1 1 15 15 GLU HB2 H 1 2.12 0.01 . 1 . . . . 16 GLU HB2 . 17302 1 118 . 1 1 15 15 GLU HB3 H 1 2.08 0.01 . 1 . . . . 16 GLU HB3 . 17302 1 119 . 1 1 15 15 GLU HG2 H 1 2.32 0.01 . 1 . . . . 16 GLU HG2 . 17302 1 120 . 1 1 15 15 GLU HG3 H 1 2.36 0.01 . 1 . . . . 16 GLU HG3 . 17302 1 121 . 1 1 15 15 GLU N N 15 118.6 0.1 . 1 . . . . 16 GLU N . 17302 1 122 . 1 1 16 16 ALA H H 1 8.35 0.01 . 1 . . . . 17 ALA H . 17302 1 123 . 1 1 16 16 ALA HA H 1 3.98 0.01 . 1 . . . . 17 ALA HA . 17302 1 124 . 1 1 16 16 ALA HB1 H 1 1.39 0.01 . 1 . . . . 17 ALA MB . 17302 1 125 . 1 1 16 16 ALA HB2 H 1 1.39 0.01 . 1 . . . . 17 ALA MB . 17302 1 126 . 1 1 16 16 ALA HB3 H 1 1.39 0.01 . 1 . . . . 17 ALA MB . 17302 1 127 . 1 1 16 16 ALA N N 15 119.7 0.1 . 1 . . . . 17 ALA N . 17302 1 128 . 1 1 17 17 PHE H H 1 7.90 0.01 . 1 . . . . 18 PHE H . 17302 1 129 . 1 1 17 17 PHE HA H 1 3.86 0.01 . 1 . . . . 18 PHE HA . 17302 1 130 . 1 1 17 17 PHE HB2 H 1 2.87 0.01 . 1 . . . . 18 PHE HB2 . 17302 1 131 . 1 1 17 17 PHE HB3 H 1 2.49 0.01 . 1 . . . . 18 PHE HB3 . 17302 1 132 . 1 1 17 17 PHE HD1 H 1 6.77 0.01 . 1 . . . . 18 PHE HD1 . 17302 1 133 . 1 1 17 17 PHE HD2 H 1 6.77 0.01 . 1 . . . . 18 PHE HD2 . 17302 1 134 . 1 1 17 17 PHE HE1 H 1 7.08 0.01 . 1 . . . . 18 PHE HE1 . 17302 1 135 . 1 1 17 17 PHE HE2 H 1 7.08 0.01 . 1 . . . . 18 PHE HE2 . 17302 1 136 . 1 1 17 17 PHE HZ H 1 7.17 0.01 . 1 . . . . 18 PHE HZ . 17302 1 137 . 1 1 17 17 PHE N N 15 118.7 0.1 . 1 . . . . 18 PHE N . 17302 1 138 . 1 1 18 18 MET H H 1 8.21 0.01 . 1 . . . . 19 MET H . 17302 1 139 . 1 1 18 18 MET HA H 1 4.11 0.01 . 1 . . . . 19 MET HA . 17302 1 140 . 1 1 18 18 MET HB2 H 1 1.60 0.01 . 1 . . . . 19 MET HB2 . 17302 1 141 . 1 1 18 18 MET HB3 H 1 1.19 0.01 . 1 . . . . 19 MET HB3 . 17302 1 142 . 1 1 18 18 MET HG2 H 1 1.40 0.01 . 1 . . . . 19 MET HG2 . 17302 1 143 . 1 1 18 18 MET HG3 H 1 1.40 0.01 . 1 . . . . 19 MET HG3 . 17302 1 144 . 1 1 18 18 MET HE1 H 1 2.21 0.01 . 9 . . . . 19 MET ME . 17302 1 145 . 1 1 18 18 MET HE2 H 1 2.21 0.01 . 9 . . . . 19 MET ME . 17302 1 146 . 1 1 18 18 MET HE3 H 1 2.21 0.01 . 9 . . . . 19 MET ME . 17302 1 147 . 1 1 18 18 MET N N 15 114.7 0.1 . 1 . . . . 19 MET N . 17302 1 148 . 1 1 19 19 LYS H H 1 8.14 0.01 . 1 . . . . 20 LYS H . 17302 1 149 . 1 1 19 19 LYS HA H 1 3.96 0.01 . 1 . . . . 20 LYS HA . 17302 1 150 . 1 1 19 19 LYS HB2 H 1 1.78 0.01 . 1 . . . . 20 LYS HB2 . 17302 1 151 . 1 1 19 19 LYS HB3 H 1 1.78 0.01 . 1 . . . . 20 LYS HB3 . 17302 1 152 . 1 1 19 19 LYS HG2 H 1 1.33 0.01 . 1 . . . . 20 LYS HG2 . 17302 1 153 . 1 1 19 19 LYS HG3 H 1 1.50 0.01 . 1 . . . . 20 LYS HG3 . 17302 1 154 . 1 1 19 19 LYS HD2 H 1 1.64 0.01 . 1 . . . . 20 LYS HD2 . 17302 1 155 . 1 1 19 19 LYS HD3 H 1 1.64 0.01 . 1 . . . . 20 LYS HD3 . 17302 1 156 . 1 1 19 19 LYS HE2 H 1 2.93 0.01 . 1 . . . . 20 LYS HE2 . 17302 1 157 . 1 1 19 19 LYS HE3 H 1 2.93 0.01 . 1 . . . . 20 LYS HE3 . 17302 1 158 . 1 1 19 19 LYS N N 15 119.0 0.1 . 1 . . . . 20 LYS N . 17302 1 159 . 1 1 20 20 ALA H H 1 7.52 0.01 . 1 . . . . 21 ALA H . 17302 1 160 . 1 1 20 20 ALA HA H 1 4.01 0.01 . 1 . . . . 21 ALA HA . 17302 1 161 . 1 1 20 20 ALA HB1 H 1 1.33 0.01 . 1 . . . . 21 ALA MB . 17302 1 162 . 1 1 20 20 ALA HB2 H 1 1.33 0.01 . 1 . . . . 21 ALA MB . 17302 1 163 . 1 1 20 20 ALA HB3 H 1 1.33 0.01 . 1 . . . . 21 ALA MB . 17302 1 164 . 1 1 20 20 ALA N N 15 123.2 0.1 . 1 . . . . 21 ALA N . 17302 1 165 . 1 1 21 21 ILE H H 1 7.42 0.01 . 1 . . . . 22 ILE H . 17302 1 166 . 1 1 21 21 ILE HA H 1 4.17 0.01 . 1 . . . . 22 ILE HA . 17302 1 167 . 1 1 21 21 ILE HB H 1 1.95 0.01 . 1 . . . . 22 ILE HB . 17302 1 168 . 1 1 21 21 ILE HG12 H 1 1.25 0.01 . 1 . . . . 22 ILE HG12 . 17302 1 169 . 1 1 21 21 ILE HG13 H 1 1.10 0.01 . 1 . . . . 22 ILE HG13 . 17302 1 170 . 1 1 21 21 ILE HG21 H 1 0.42 0.01 . 1 . . . . 22 ILE MG . 17302 1 171 . 1 1 21 21 ILE HG22 H 1 0.42 0.01 . 1 . . . . 22 ILE MG . 17302 1 172 . 1 1 21 21 ILE HG23 H 1 0.42 0.01 . 1 . . . . 22 ILE MG . 17302 1 173 . 1 1 21 21 ILE HD11 H 1 0.78 0.01 . 1 . . . . 22 ILE MD . 17302 1 174 . 1 1 21 21 ILE HD12 H 1 0.78 0.01 . 1 . . . . 22 ILE MD . 17302 1 175 . 1 1 21 21 ILE HD13 H 1 0.78 0.01 . 1 . . . . 22 ILE MD . 17302 1 176 . 1 1 21 21 ILE N N 15 110.0 0.1 . 1 . . . . 22 ILE N . 17302 1 177 . 1 1 22 22 GLY H H 1 7.45 0.01 . 1 . . . . 23 GLY H . 17302 1 178 . 1 1 22 22 GLY HA2 H 1 4.12 0.01 . 1 . . . . 23 GLY HA2 . 17302 1 179 . 1 1 22 22 GLY HA3 H 1 3.67 0.01 . 1 . . . . 23 GLY HA3 . 17302 1 180 . 1 1 22 22 GLY N N 15 108.5 0.1 . 1 . . . . 23 GLY N . 17302 1 181 . 1 1 23 23 LEU H H 1 7.90 0.01 . 1 . . . . 24 LEU H . 17302 1 182 . 1 1 23 23 LEU HA H 1 4.39 0.01 . 1 . . . . 24 LEU HA . 17302 1 183 . 1 1 23 23 LEU HB2 H 1 1.17 0.01 . 1 . . . . 24 LEU HB2 . 17302 1 184 . 1 1 23 23 LEU HB3 H 1 1.40 0.01 . 1 . . . . 24 LEU HB3 . 17302 1 185 . 1 1 23 23 LEU HG H 1 1.66 0.01 . 1 . . . . 24 LEU HG . 17302 1 186 . 1 1 23 23 LEU HD11 H 1 0.77 0.01 . 1 . . . . 24 LEU MD1 . 17302 1 187 . 1 1 23 23 LEU HD12 H 1 0.77 0.01 . 1 . . . . 24 LEU MD1 . 17302 1 188 . 1 1 23 23 LEU HD13 H 1 0.77 0.01 . 1 . . . . 24 LEU MD1 . 17302 1 189 . 1 1 23 23 LEU HD21 H 1 0.88 0.01 . 1 . . . . 24 LEU MD2 . 17302 1 190 . 1 1 23 23 LEU HD22 H 1 0.88 0.01 . 1 . . . . 24 LEU MD2 . 17302 1 191 . 1 1 23 23 LEU HD23 H 1 0.88 0.01 . 1 . . . . 24 LEU MD2 . 17302 1 192 . 1 1 23 23 LEU N N 15 124.6 0.1 . 1 . . . . 24 LEU N . 17302 1 193 . 1 1 24 24 PRO HA H 1 4.42 0.01 . 1 . . . . 25 PRO HA . 17302 1 194 . 1 1 24 24 PRO HB2 H 1 1.92 0.01 . 1 . . . . 25 PRO HB2 . 17302 1 195 . 1 1 24 24 PRO HB3 H 1 2.49 0.01 . 1 . . . . 25 PRO HB3 . 17302 1 196 . 1 1 24 24 PRO HG2 H 1 2.11 0.01 . 1 . . . . 25 PRO HG2 . 17302 1 197 . 1 1 24 24 PRO HG3 H 1 2.11 0.01 . 1 . . . . 25 PRO HG3 . 17302 1 198 . 1 1 24 24 PRO HD2 H 1 3.53 0.01 . 1 . . . . 25 PRO HD2 . 17302 1 199 . 1 1 24 24 PRO HD3 H 1 4.04 0.01 . 1 . . . . 25 PRO HD3 . 17302 1 200 . 1 1 25 25 GLU H H 1 8.82 0.01 . 1 . . . . 26 GLU H . 17302 1 201 . 1 1 25 25 GLU HA H 1 3.87 0.01 . 1 . . . . 26 GLU HA . 17302 1 202 . 1 1 25 25 GLU HB2 H 1 2.12 0.01 . 1 . . . . 26 GLU HB2 . 17302 1 203 . 1 1 25 25 GLU HB3 H 1 2.01 0.01 . 1 . . . . 26 GLU HB3 . 17302 1 204 . 1 1 25 25 GLU HG2 H 1 2.33 0.01 . 1 . . . . 26 GLU HG2 . 17302 1 205 . 1 1 25 25 GLU HG3 H 1 2.33 0.01 . 1 . . . . 26 GLU HG3 . 17302 1 206 . 1 1 25 25 GLU N N 15 124.2 0.1 . 1 . . . . 26 GLU N . 17302 1 207 . 1 1 26 26 GLU H H 1 9.38 0.01 . 1 . . . . 27 GLU H . 17302 1 208 . 1 1 26 26 GLU HA H 1 4.12 0.01 . 1 . . . . 27 GLU HA . 17302 1 209 . 1 1 26 26 GLU HB2 H 1 2.07 0.01 . 1 . . . . 27 GLU HB2 . 17302 1 210 . 1 1 26 26 GLU HB3 H 1 1.97 0.01 . 1 . . . . 27 GLU HB3 . 17302 1 211 . 1 1 26 26 GLU HG2 H 1 2.27 0.01 . 1 . . . . 27 GLU HG2 . 17302 1 212 . 1 1 26 26 GLU HG3 H 1 2.34 0.01 . 1 . . . . 27 GLU HG3 . 17302 1 213 . 1 1 26 26 GLU N N 15 117.6 0.1 . 1 . . . . 27 GLU N . 17302 1 214 . 1 1 27 27 LEU H H 1 7.23 0.01 . 1 . . . . 28 LEU H . 17302 1 215 . 1 1 27 27 LEU HA H 1 4.27 0.01 . 1 . . . . 28 LEU HA . 17302 1 216 . 1 1 27 27 LEU HB2 H 1 1.84 0.01 . 1 . . . . 28 LEU HB2 . 17302 1 217 . 1 1 27 27 LEU HB3 H 1 1.62 0.01 . 1 . . . . 28 LEU HB3 . 17302 1 218 . 1 1 27 27 LEU HG H 1 1.72 0.01 . 1 . . . . 28 LEU HG . 17302 1 219 . 1 1 27 27 LEU HD11 H 1 0.98 0.01 . 1 . . . . 28 LEU MD1 . 17302 1 220 . 1 1 27 27 LEU HD12 H 1 0.98 0.01 . 1 . . . . 28 LEU MD1 . 17302 1 221 . 1 1 27 27 LEU HD13 H 1 0.98 0.01 . 1 . . . . 28 LEU MD1 . 17302 1 222 . 1 1 27 27 LEU HD21 H 1 0.90 0.01 . 1 . . . . 28 LEU MD2 . 17302 1 223 . 1 1 27 27 LEU HD22 H 1 0.90 0.01 . 1 . . . . 28 LEU MD2 . 17302 1 224 . 1 1 27 27 LEU HD23 H 1 0.90 0.01 . 1 . . . . 28 LEU MD2 . 17302 1 225 . 1 1 27 27 LEU N N 15 117.8 0.1 . 1 . . . . 28 LEU N . 17302 1 226 . 1 1 28 28 ILE H H 1 7.86 0.01 . 1 . . . . 29 ILE H . 17302 1 227 . 1 1 28 28 ILE HA H 1 3.61 0.01 . 1 . . . . 29 ILE HA . 17302 1 228 . 1 1 28 28 ILE HB H 1 2.10 0.01 . 1 . . . . 29 ILE HB . 17302 1 229 . 1 1 28 28 ILE HG12 H 1 0.44 0.01 . 1 . . . . 29 ILE HG12 . 17302 1 230 . 1 1 28 28 ILE HG13 H 1 1.70 0.01 . 1 . . . . 29 ILE HG13 . 17302 1 231 . 1 1 28 28 ILE HG21 H 1 0.94 0.01 . 1 . . . . 29 ILE MG . 17302 1 232 . 1 1 28 28 ILE HG22 H 1 0.94 0.01 . 1 . . . . 29 ILE MG . 17302 1 233 . 1 1 28 28 ILE HG23 H 1 0.94 0.01 . 1 . . . . 29 ILE MG . 17302 1 234 . 1 1 28 28 ILE HD11 H 1 0.71 0.01 . 1 . . . . 29 ILE MD . 17302 1 235 . 1 1 28 28 ILE HD12 H 1 0.71 0.01 . 1 . . . . 29 ILE MD . 17302 1 236 . 1 1 28 28 ILE HD13 H 1 0.71 0.01 . 1 . . . . 29 ILE MD . 17302 1 237 . 1 1 28 28 ILE N N 15 123.4 0.1 . 1 . . . . 29 ILE N . 17302 1 238 . 1 1 29 29 GLN H H 1 8.24 0.01 . 1 . . . . 30 GLN H . 17302 1 239 . 1 1 29 29 GLN HA H 1 3.97 0.01 . 1 . . . . 30 GLN HA . 17302 1 240 . 1 1 29 29 GLN HB2 H 1 2.17 0.01 . 1 . . . . 30 GLN HB2 . 17302 1 241 . 1 1 29 29 GLN HB3 H 1 2.11 0.01 . 1 . . . . 30 GLN HB3 . 17302 1 242 . 1 1 29 29 GLN HG2 H 1 2.51 0.01 . 1 . . . . 30 GLN HG2 . 17302 1 243 . 1 1 29 29 GLN HG3 H 1 2.51 0.01 . 1 . . . . 30 GLN HG3 . 17302 1 244 . 1 1 29 29 GLN HE21 H 1 7.00 0.01 . 1 . . . . 30 GLN HE21 . 17302 1 245 . 1 1 29 29 GLN HE22 H 1 7.67 0.01 . 1 . . . . 30 GLN HE22 . 17302 1 246 . 1 1 29 29 GLN N N 15 116.8 0.1 . 1 . . . . 30 GLN N . 17302 1 247 . 1 1 29 29 GLN NE2 N 15 113.4 0.1 . 1 . . . . 30 GLN NE2 . 17302 1 248 . 1 1 30 30 LYS H H 1 7.57 0.01 . 1 . . . . 31 LYS H . 17302 1 249 . 1 1 30 30 LYS HA H 1 4.22 0.01 . 1 . . . . 31 LYS HA . 17302 1 250 . 1 1 30 30 LYS HB2 H 1 1.90 0.01 . 1 . . . . 31 LYS HB2 . 17302 1 251 . 1 1 30 30 LYS HB3 H 1 1.90 0.01 . 1 . . . . 31 LYS HB3 . 17302 1 252 . 1 1 30 30 LYS HG2 H 1 1.53 0.01 . 1 . . . . 31 LYS HG2 . 17302 1 253 . 1 1 30 30 LYS HG3 H 1 1.53 0.01 . 1 . . . . 31 LYS HG3 . 17302 1 254 . 1 1 30 30 LYS HD2 H 1 1.72 0.01 . 1 . . . . 31 LYS HD2 . 17302 1 255 . 1 1 30 30 LYS HD3 H 1 1.72 0.01 . 1 . . . . 31 LYS HD3 . 17302 1 256 . 1 1 30 30 LYS HE2 H 1 3.00 0.01 . 1 . . . . 31 LYS HE2 . 17302 1 257 . 1 1 30 30 LYS HE3 H 1 3.00 0.01 . 1 . . . . 31 LYS HE3 . 17302 1 258 . 1 1 30 30 LYS N N 15 116.1 0.1 . 1 . . . . 31 LYS N . 17302 1 259 . 1 1 31 31 GLY H H 1 7.90 0.01 . 1 . . . . 32 GLY H . 17302 1 260 . 1 1 31 31 GLY HA2 H 1 3.86 0.01 . 1 . . . . 32 GLY HA2 . 17302 1 261 . 1 1 31 31 GLY HA3 H 1 4.17 0.01 . 1 . . . . 32 GLY HA3 . 17302 1 262 . 1 1 31 31 GLY N N 15 105.5 0.1 . 1 . . . . 32 GLY N . 17302 1 263 . 1 1 32 32 LYS H H 1 7.50 0.01 . 1 . . . . 33 LYS H . 17302 1 264 . 1 1 32 32 LYS HA H 1 3.05 0.01 . 1 . . . . 33 LYS HA . 17302 1 265 . 1 1 32 32 LYS HB2 H 1 1.77 0.01 . 1 . . . . 33 LYS HB2 . 17302 1 266 . 1 1 32 32 LYS HB3 H 1 1.77 0.01 . 1 . . . . 33 LYS HB3 . 17302 1 267 . 1 1 32 32 LYS HG2 H 1 1.33 0.01 . 1 . . . . 33 LYS HG2 . 17302 1 268 . 1 1 32 32 LYS HG3 H 1 1.48 0.01 . 1 . . . . 33 LYS HG3 . 17302 1 269 . 1 1 32 32 LYS HD2 H 1 1.66 0.01 . 1 . . . . 33 LYS HD2 . 17302 1 270 . 1 1 32 32 LYS HD3 H 1 1.66 0.01 . 1 . . . . 33 LYS HD3 . 17302 1 271 . 1 1 32 32 LYS HE2 H 1 3.09 0.01 . 1 . . . . 33 LYS HE2 . 17302 1 272 . 1 1 32 32 LYS HE3 H 1 3.09 0.01 . 1 . . . . 33 LYS HE3 . 17302 1 273 . 1 1 32 32 LYS N N 15 119.8 0.1 . 1 . . . . 33 LYS N . 17302 1 274 . 1 1 33 33 ASP H H 1 7.83 0.01 . 1 . . . . 34 ASP H . 17302 1 275 . 1 1 33 33 ASP HA H 1 4.73 0.01 . 1 . . . . 34 ASP HA . 17302 1 276 . 1 1 33 33 ASP HB2 H 1 2.46 0.01 . 1 . . . . 34 ASP HB2 . 17302 1 277 . 1 1 33 33 ASP HB3 H 1 2.81 0.01 . 1 . . . . 34 ASP HB3 . 17302 1 278 . 1 1 33 33 ASP N N 15 117.2 0.1 . 1 . . . . 34 ASP N . 17302 1 279 . 1 1 34 34 ILE H H 1 7.15 0.01 . 1 . . . . 35 ILE H . 17302 1 280 . 1 1 34 34 ILE HA H 1 3.92 0.01 . 1 . . . . 35 ILE HA . 17302 1 281 . 1 1 34 34 ILE HB H 1 1.82 0.01 . 1 . . . . 35 ILE HB . 17302 1 282 . 1 1 34 34 ILE HG12 H 1 1.19 0.01 . 1 . . . . 35 ILE HG12 . 17302 1 283 . 1 1 34 34 ILE HG13 H 1 1.55 0.01 . 1 . . . . 35 ILE HG13 . 17302 1 284 . 1 1 34 34 ILE HG21 H 1 0.79 0.01 . 1 . . . . 35 ILE MG . 17302 1 285 . 1 1 34 34 ILE HG22 H 1 0.79 0.01 . 1 . . . . 35 ILE MG . 17302 1 286 . 1 1 34 34 ILE HG23 H 1 0.79 0.01 . 1 . . . . 35 ILE MG . 17302 1 287 . 1 1 34 34 ILE HD11 H 1 0.81 0.01 . 1 . . . . 35 ILE MD . 17302 1 288 . 1 1 34 34 ILE HD12 H 1 0.81 0.01 . 1 . . . . 35 ILE MD . 17302 1 289 . 1 1 34 34 ILE HD13 H 1 0.81 0.01 . 1 . . . . 35 ILE MD . 17302 1 290 . 1 1 34 34 ILE N N 15 120.4 0.1 . 1 . . . . 35 ILE N . 17302 1 291 . 1 1 35 35 LYS H H 1 8.72 0.01 . 1 . . . . 36 LYS H . 17302 1 292 . 1 1 35 35 LYS HA H 1 4.57 0.01 . 1 . . . . 36 LYS HA . 17302 1 293 . 1 1 35 35 LYS HB2 H 1 1.90 0.01 . 1 . . . . 36 LYS HB2 . 17302 1 294 . 1 1 35 35 LYS HB3 H 1 1.86 0.01 . 1 . . . . 36 LYS HB3 . 17302 1 295 . 1 1 35 35 LYS HG2 H 1 1.48 0.01 . 2 . . . . 36 LYS HG2 . 17302 1 296 . 1 1 35 35 LYS HG3 H 1 1.28 0.01 . 2 . . . . 36 LYS HG3 . 17302 1 297 . 1 1 35 35 LYS HD2 H 1 1.64 0.01 . 1 . . . . 36 LYS HD2 . 17302 1 298 . 1 1 35 35 LYS HD3 H 1 1.64 0.01 . 1 . . . . 36 LYS HD3 . 17302 1 299 . 1 1 35 35 LYS HE2 H 1 2.99 0.01 . 1 . . . . 36 LYS HE2 . 17302 1 300 . 1 1 35 35 LYS HE3 H 1 2.99 0.01 . 1 . . . . 36 LYS HE3 . 17302 1 301 . 1 1 35 35 LYS N N 15 128.9 0.1 . 1 . . . . 36 LYS N . 17302 1 302 . 1 1 36 36 GLY H H 1 7.94 0.01 . 1 . . . . 37 GLY H . 17302 1 303 . 1 1 36 36 GLY HA2 H 1 4.40 0.01 . 2 . . . . 37 GLY HA2 . 17302 1 304 . 1 1 36 36 GLY HA3 H 1 3.98 0.01 . 2 . . . . 37 GLY HA3 . 17302 1 305 . 1 1 36 36 GLY N N 15 111.6 0.1 . 1 . . . . 37 GLY N . 17302 1 306 . 1 1 37 37 VAL H H 1 8.41 0.01 . 1 . . . . 38 VAL H . 17302 1 307 . 1 1 37 37 VAL HA H 1 5.06 0.01 . 1 . . . . 38 VAL HA . 17302 1 308 . 1 1 37 37 VAL HB H 1 2.05 0.01 . 1 . . . . 38 VAL HB . 17302 1 309 . 1 1 37 37 VAL HG11 H 1 0.95 0.01 . 1 . . . . 38 VAL MG1 . 17302 1 310 . 1 1 37 37 VAL HG12 H 1 0.95 0.01 . 1 . . . . 38 VAL MG1 . 17302 1 311 . 1 1 37 37 VAL HG13 H 1 0.95 0.01 . 1 . . . . 38 VAL MG1 . 17302 1 312 . 1 1 37 37 VAL HG21 H 1 1.00 0.01 . 1 . . . . 38 VAL MG2 . 17302 1 313 . 1 1 37 37 VAL HG22 H 1 1.00 0.01 . 1 . . . . 38 VAL MG2 . 17302 1 314 . 1 1 37 37 VAL HG23 H 1 1.00 0.01 . 1 . . . . 38 VAL MG2 . 17302 1 315 . 1 1 37 37 VAL N N 15 120.7 0.1 . 1 . . . . 38 VAL N . 17302 1 316 . 1 1 38 38 SER H H 1 9.31 0.01 . 1 . . . . 39 SER H . 17302 1 317 . 1 1 38 38 SER HA H 1 5.39 0.01 . 1 . . . . 39 SER HA . 17302 1 318 . 1 1 38 38 SER HB2 H 1 3.85 0.01 . 1 . . . . 39 SER HB2 . 17302 1 319 . 1 1 38 38 SER HB3 H 1 3.77 0.01 . 1 . . . . 39 SER HB3 . 17302 1 320 . 1 1 38 38 SER N N 15 122.0 0.1 . 1 . . . . 39 SER N . 17302 1 321 . 1 1 39 39 GLU H H 1 9.50 0.01 . 1 . . . . 40 GLU H . 17302 1 322 . 1 1 39 39 GLU HA H 1 5.33 0.01 . 1 . . . . 40 GLU HA . 17302 1 323 . 1 1 39 39 GLU HB2 H 1 2.12 0.01 . 1 . . . . 40 GLU HB2 . 17302 1 324 . 1 1 39 39 GLU HB3 H 1 1.90 0.01 . 1 . . . . 40 GLU HB3 . 17302 1 325 . 1 1 39 39 GLU HG2 H 1 2.19 0.01 . 1 . . . . 40 GLU HG2 . 17302 1 326 . 1 1 39 39 GLU HG3 H 1 2.02 0.01 . 1 . . . . 40 GLU HG3 . 17302 1 327 . 1 1 39 39 GLU N N 15 125.8 0.1 . 1 . . . . 40 GLU N . 17302 1 328 . 1 1 40 40 ILE H H 1 9.46 0.01 . 1 . . . . 41 ILE H . 17302 1 329 . 1 1 40 40 ILE HA H 1 4.89 0.01 . 1 . . . . 41 ILE HA . 17302 1 330 . 1 1 40 40 ILE HB H 1 2.01 0.01 . 1 . . . . 41 ILE HB . 17302 1 331 . 1 1 40 40 ILE HG12 H 1 1.31 0.01 . 1 . . . . 41 ILE HG12 . 17302 1 332 . 1 1 40 40 ILE HG13 H 1 -0.01 0.01 . 1 . . . . 41 ILE HG13 . 17302 1 333 . 1 1 40 40 ILE HG21 H 1 0.42 0.01 . 1 . . . . 41 ILE MG . 17302 1 334 . 1 1 40 40 ILE HG22 H 1 0.42 0.01 . 1 . . . . 41 ILE MG . 17302 1 335 . 1 1 40 40 ILE HG23 H 1 0.42 0.01 . 1 . . . . 41 ILE MG . 17302 1 336 . 1 1 40 40 ILE HD11 H 1 0.58 0.01 . 1 . . . . 41 ILE MD . 17302 1 337 . 1 1 40 40 ILE HD12 H 1 0.58 0.01 . 1 . . . . 41 ILE MD . 17302 1 338 . 1 1 40 40 ILE HD13 H 1 0.58 0.01 . 1 . . . . 41 ILE MD . 17302 1 339 . 1 1 40 40 ILE N N 15 126.5 0.1 . 1 . . . . 41 ILE N . 17302 1 340 . 1 1 41 41 VAL H H 1 9.10 0.01 . 1 . . . . 42 VAL H . 17302 1 341 . 1 1 41 41 VAL HA H 1 4.17 0.01 . 1 . . . . 42 VAL HA . 17302 1 342 . 1 1 41 41 VAL HB H 1 1.93 0.01 . 1 . . . . 42 VAL HB . 17302 1 343 . 1 1 41 41 VAL HG11 H 1 0.82 0.01 . 1 . . . . 42 VAL MG1 . 17302 1 344 . 1 1 41 41 VAL HG12 H 1 0.82 0.01 . 1 . . . . 42 VAL MG1 . 17302 1 345 . 1 1 41 41 VAL HG13 H 1 0.82 0.01 . 1 . . . . 42 VAL MG1 . 17302 1 346 . 1 1 41 41 VAL HG21 H 1 0.91 0.01 . 1 . . . . 42 VAL MG2 . 17302 1 347 . 1 1 41 41 VAL HG22 H 1 0.91 0.01 . 1 . . . . 42 VAL MG2 . 17302 1 348 . 1 1 41 41 VAL HG23 H 1 0.91 0.01 . 1 . . . . 42 VAL MG2 . 17302 1 349 . 1 1 41 41 VAL N N 15 128.5 0.1 . 1 . . . . 42 VAL N . 17302 1 350 . 1 1 42 42 GLN H H 1 8.64 0.01 . 1 . . . . 43 GLN H . 17302 1 351 . 1 1 42 42 GLN HA H 1 4.41 0.01 . 1 . . . . 43 GLN HA . 17302 1 352 . 1 1 42 42 GLN HB2 H 1 1.92 0.01 . 1 . . . . 43 GLN HB2 . 17302 1 353 . 1 1 42 42 GLN HB3 H 1 1.92 0.01 . 1 . . . . 43 GLN HB3 . 17302 1 354 . 1 1 42 42 GLN HG2 H 1 1.85 0.01 . 1 . . . . 43 GLN HG2 . 17302 1 355 . 1 1 42 42 GLN HG3 H 1 1.85 0.01 . 1 . . . . 43 GLN HG3 . 17302 1 356 . 1 1 42 42 GLN HE21 H 1 7.16 0.01 . 1 . . . . 43 GLN HE21 . 17302 1 357 . 1 1 42 42 GLN HE22 H 1 7.51 0.01 . 1 . . . . 43 GLN HE22 . 17302 1 358 . 1 1 42 42 GLN N N 15 130.8 0.1 . 1 . . . . 43 GLN N . 17302 1 359 . 1 1 42 42 GLN NE2 N 15 108.3 0.1 . 1 . . . . 43 GLN NE2 . 17302 1 360 . 1 1 43 43 ASN H H 1 8.98 0.01 . 1 . . . . 44 ASN H . 17302 1 361 . 1 1 43 43 ASN HA H 1 4.82 0.01 . 1 . . . . 44 ASN HA . 17302 1 362 . 1 1 43 43 ASN HB2 H 1 2.77 0.01 . 1 . . . . 44 ASN HB2 . 17302 1 363 . 1 1 43 43 ASN HB3 H 1 2.54 0.01 . 1 . . . . 44 ASN HB3 . 17302 1 364 . 1 1 43 43 ASN HD21 H 1 7.63 0.01 . 1 . . . . 44 ASN HD21 . 17302 1 365 . 1 1 43 43 ASN HD22 H 1 6.81 0.01 . 1 . . . . 44 ASN HD22 . 17302 1 366 . 1 1 43 43 ASN N N 15 127.3 0.1 . 1 . . . . 44 ASN N . 17302 1 367 . 1 1 43 43 ASN ND2 N 15 112.8 0.1 . 1 . . . . 44 ASN ND2 . 17302 1 368 . 1 1 44 44 GLY H H 1 9.15 0.01 . 1 . . . . 45 GLY H . 17302 1 369 . 1 1 44 44 GLY HA2 H 1 3.63 0.01 . 1 . . . . 45 GLY HA2 . 17302 1 370 . 1 1 44 44 GLY HA3 H 1 4.04 0.01 . 1 . . . . 45 GLY HA3 . 17302 1 371 . 1 1 44 44 GLY N N 15 116.3 0.1 . 1 . . . . 45 GLY N . 17302 1 372 . 1 1 45 45 LYS H H 1 8.85 0.01 . 1 . . . . 46 LYS H . 17302 1 373 . 1 1 45 45 LYS HA H 1 4.38 0.01 . 1 . . . . 46 LYS HA . 17302 1 374 . 1 1 45 45 LYS HB2 H 1 2.31 0.01 . 1 . . . . 46 LYS HB2 . 17302 1 375 . 1 1 45 45 LYS HB3 H 1 1.82 0.01 . 1 . . . . 46 LYS HB3 . 17302 1 376 . 1 1 45 45 LYS HG2 H 1 1.67 0.01 . 2 . . . . 46 LYS HG2 . 17302 1 377 . 1 1 45 45 LYS HG3 H 1 1.42 0.01 . 2 . . . . 46 LYS HG3 . 17302 1 378 . 1 1 45 45 LYS HD2 H 1 1.76 0.01 . 1 . . . . 46 LYS HD2 . 17302 1 379 . 1 1 45 45 LYS HD3 H 1 1.76 0.01 . 1 . . . . 46 LYS HD3 . 17302 1 380 . 1 1 45 45 LYS HE2 H 1 3.04 0.01 . 1 . . . . 46 LYS HE2 . 17302 1 381 . 1 1 45 45 LYS HE3 H 1 3.04 0.01 . 1 . . . . 46 LYS HE3 . 17302 1 382 . 1 1 45 45 LYS N N 15 126.3 0.1 . 1 . . . . 46 LYS N . 17302 1 383 . 1 1 46 46 HIS H H 1 8.19 0.01 . 1 . . . . 47 HIS H . 17302 1 384 . 1 1 46 46 HIS HA H 1 5.19 0.01 . 1 . . . . 47 HIS HA . 17302 1 385 . 1 1 46 46 HIS HB2 H 1 3.34 0.01 . 1 . . . . 47 HIS HB2 . 17302 1 386 . 1 1 46 46 HIS HB3 H 1 3.15 0.01 . 1 . . . . 47 HIS HB3 . 17302 1 387 . 1 1 46 46 HIS HD2 H 1 7.23 0.01 . 1 . . . . 47 HIS HD2 . 17302 1 388 . 1 1 46 46 HIS HE1 H 1 8.44 0.01 . 1 . . . . 47 HIS HE1 . 17302 1 389 . 1 1 46 46 HIS N N 15 120.0 0.1 . 1 . . . . 47 HIS N . 17302 1 390 . 1 1 47 47 PHE H H 1 8.87 0.01 . 1 . . . . 48 PHE H . 17302 1 391 . 1 1 47 47 PHE HA H 1 4.85 0.01 . 1 . . . . 48 PHE HA . 17302 1 392 . 1 1 47 47 PHE HB2 H 1 1.48 0.01 . 1 . . . . 48 PHE HB2 . 17302 1 393 . 1 1 47 47 PHE HB3 H 1 2.01 0.01 . 1 . . . . 48 PHE HB3 . 17302 1 394 . 1 1 47 47 PHE HD1 H 1 6.74 0.01 . 1 . . . . 48 PHE HD1 . 17302 1 395 . 1 1 47 47 PHE HD2 H 1 6.74 0.01 . 1 . . . . 48 PHE HD2 . 17302 1 396 . 1 1 47 47 PHE HE1 H 1 6.82 0.01 . 1 . . . . 48 PHE HE1 . 17302 1 397 . 1 1 47 47 PHE HE2 H 1 6.82 0.01 . 1 . . . . 48 PHE HE2 . 17302 1 398 . 1 1 47 47 PHE HZ H 1 7.02 0.01 . 1 . . . . 48 PHE HZ . 17302 1 399 . 1 1 47 47 PHE N N 15 124.9 0.1 . 1 . . . . 48 PHE N . 17302 1 400 . 1 1 48 48 LYS H H 1 8.38 0.01 . 1 . . . . 49 LYS H . 17302 1 401 . 1 1 48 48 LYS HA H 1 4.85 0.01 . 1 . . . . 49 LYS HA . 17302 1 402 . 1 1 48 48 LYS HB2 H 1 1.82 0.01 . 1 . . . . 49 LYS HB2 . 17302 1 403 . 1 1 48 48 LYS HB3 H 1 1.82 0.01 . 1 . . . . 49 LYS HB3 . 17302 1 404 . 1 1 48 48 LYS HG2 H 1 1.33 0.01 . 1 . . . . 49 LYS HG2 . 17302 1 405 . 1 1 48 48 LYS HG3 H 1 1.33 0.01 . 1 . . . . 49 LYS HG3 . 17302 1 406 . 1 1 48 48 LYS HD2 H 1 1.57 0.01 . 1 . . . . 49 LYS HD2 . 17302 1 407 . 1 1 48 48 LYS HD3 H 1 1.57 0.01 . 1 . . . . 49 LYS HD3 . 17302 1 408 . 1 1 48 48 LYS HE2 H 1 2.85 0.01 . 2 . . . . 49 LYS HE2 . 17302 1 409 . 1 1 48 48 LYS HE3 H 1 2.77 0.01 . 2 . . . . 49 LYS HE3 . 17302 1 410 . 1 1 48 48 LYS N N 15 119.3 0.1 . 1 . . . . 49 LYS N . 17302 1 411 . 1 1 49 49 PHE H H 1 9.56 0.01 . 1 . . . . 50 PHE H . 17302 1 412 . 1 1 49 49 PHE HA H 1 5.27 0.01 . 1 . . . . 50 PHE HA . 17302 1 413 . 1 1 49 49 PHE HB2 H 1 2.99 0.01 . 1 . . . . 50 PHE HB2 . 17302 1 414 . 1 1 49 49 PHE HB3 H 1 3.10 0.01 . 1 . . . . 50 PHE HB3 . 17302 1 415 . 1 1 49 49 PHE HD1 H 1 7.06 0.01 . 1 . . . . 50 PHE HD1 . 17302 1 416 . 1 1 49 49 PHE HD2 H 1 7.06 0.01 . 1 . . . . 50 PHE HD2 . 17302 1 417 . 1 1 49 49 PHE HE1 H 1 7.06 0.01 . 9 . . . . 50 PHE HE1 . 17302 1 418 . 1 1 49 49 PHE HE2 H 1 7.06 0.01 . 9 . . . . 50 PHE HE2 . 17302 1 419 . 1 1 49 49 PHE HZ H 1 6.76 0.01 . 9 . . . . 50 PHE HZ . 17302 1 420 . 1 1 49 49 PHE N N 15 127.7 0.1 . 1 . . . . 50 PHE N . 17302 1 421 . 1 1 50 50 THR H H 1 9.35 0.01 . 1 . . . . 51 THR H . 17302 1 422 . 1 1 50 50 THR HA H 1 5.18 0.01 . 1 . . . . 51 THR HA . 17302 1 423 . 1 1 50 50 THR HB H 1 4.13 0.01 . 1 . . . . 51 THR HB . 17302 1 424 . 1 1 50 50 THR HG21 H 1 1.17 0.01 . 1 . . . . 51 THR MG . 17302 1 425 . 1 1 50 50 THR HG22 H 1 1.17 0.01 . 1 . . . . 51 THR MG . 17302 1 426 . 1 1 50 50 THR HG23 H 1 1.17 0.01 . 1 . . . . 51 THR MG . 17302 1 427 . 1 1 50 50 THR N N 15 121.2 0.1 . 1 . . . . 51 THR N . 17302 1 428 . 1 1 51 51 ILE H H 1 9.48 0.01 . 1 . . . . 52 ILE H . 17302 1 429 . 1 1 51 51 ILE HA H 1 4.92 0.01 . 1 . . . . 52 ILE HA . 17302 1 430 . 1 1 51 51 ILE HB H 1 1.90 0.01 . 1 . . . . 52 ILE HB . 17302 1 431 . 1 1 51 51 ILE HG12 H 1 1.57 0.01 . 2 . . . . 52 ILE HG12 . 17302 1 432 . 1 1 51 51 ILE HG13 H 1 1.32 0.01 . 2 . . . . 52 ILE HG13 . 17302 1 433 . 1 1 51 51 ILE HG21 H 1 0.90 0.01 . 1 . . . . 52 ILE MG . 17302 1 434 . 1 1 51 51 ILE HG22 H 1 0.90 0.01 . 1 . . . . 52 ILE MG . 17302 1 435 . 1 1 51 51 ILE HG23 H 1 0.90 0.01 . 1 . . . . 52 ILE MG . 17302 1 436 . 1 1 51 51 ILE HD11 H 1 0.87 0.01 . 1 . . . . 52 ILE MD . 17302 1 437 . 1 1 51 51 ILE HD12 H 1 0.87 0.01 . 1 . . . . 52 ILE MD . 17302 1 438 . 1 1 51 51 ILE HD13 H 1 0.87 0.01 . 1 . . . . 52 ILE MD . 17302 1 439 . 1 1 51 51 ILE N N 15 128.9 0.1 . 9 . . . . 52 ILE N . 17302 1 440 . 1 1 52 52 THR H H 1 8.78 0.01 . 1 . . . . 53 THR H . 17302 1 441 . 1 1 52 52 THR HA H 1 4.91 0.01 . 1 . . . . 53 THR HA . 17302 1 442 . 1 1 52 52 THR HB H 1 4.11 0.01 . 1 . . . . 53 THR HB . 17302 1 443 . 1 1 52 52 THR HG21 H 1 1.20 0.01 . 1 . . . . 53 THR MG . 17302 1 444 . 1 1 52 52 THR HG22 H 1 1.20 0.01 . 1 . . . . 53 THR MG . 17302 1 445 . 1 1 52 52 THR HG23 H 1 1.20 0.01 . 1 . . . . 53 THR MG . 17302 1 446 . 1 1 52 52 THR N N 15 123.1 0.1 . 1 . . . . 53 THR N . 17302 1 447 . 1 1 53 53 ALA H H 1 8.90 0.01 . 1 . . . . 54 ALA H . 17302 1 448 . 1 1 53 53 ALA HA H 1 4.71 0.01 . 1 . . . . 54 ALA HA . 17302 1 449 . 1 1 53 53 ALA HB1 H 1 1.31 0.01 . 1 . . . . 54 ALA MB . 17302 1 450 . 1 1 53 53 ALA HB2 H 1 1.31 0.01 . 1 . . . . 54 ALA MB . 17302 1 451 . 1 1 53 53 ALA HB3 H 1 1.31 0.01 . 1 . . . . 54 ALA MB . 17302 1 452 . 1 1 53 53 ALA N N 15 131.7 0.1 . 1 . . . . 54 ALA N . 17302 1 453 . 1 1 54 54 GLY H H 1 9.00 0.01 . 1 . . . . 55 GLY H . 17302 1 454 . 1 1 54 54 GLY HA2 H 1 3.72 0.01 . 1 . . . . 55 GLY HA2 . 17302 1 455 . 1 1 54 54 GLY HA3 H 1 4.11 0.01 . 1 . . . . 55 GLY HA3 . 17302 1 456 . 1 1 54 54 GLY N N 15 115.2 0.1 . 1 . . . . 55 GLY N . 17302 1 457 . 1 1 55 55 SER H H 1 8.85 0.01 . 1 . . . . 56 SER H . 17302 1 458 . 1 1 55 55 SER HA H 1 4.38 0.01 . 1 . . . . 56 SER HA . 17302 1 459 . 1 1 55 55 SER HB2 H 1 3.87 0.01 . 1 . . . . 56 SER HB2 . 17302 1 460 . 1 1 55 55 SER HB3 H 1 4.05 0.01 . 1 . . . . 56 SER HB3 . 17302 1 461 . 1 1 55 55 SER N N 15 121.2 0.1 . 1 . . . . 56 SER N . 17302 1 462 . 1 1 56 56 LYS H H 1 7.80 0.01 . 1 . . . . 57 LYS H . 17302 1 463 . 1 1 56 56 LYS HA H 1 4.56 0.01 . 1 . . . . 57 LYS HA . 17302 1 464 . 1 1 56 56 LYS HB2 H 1 1.86 0.01 . 1 . . . . 57 LYS HB2 . 17302 1 465 . 1 1 56 56 LYS HB3 H 1 1.98 0.01 . 1 . . . . 57 LYS HB3 . 17302 1 466 . 1 1 56 56 LYS HG2 H 1 1.42 0.01 . 1 . . . . 57 LYS HG2 . 17302 1 467 . 1 1 56 56 LYS HG3 H 1 1.42 0.01 . 1 . . . . 57 LYS HG3 . 17302 1 468 . 1 1 56 56 LYS HD2 H 1 1.73 0.01 . 1 . . . . 57 LYS HD2 . 17302 1 469 . 1 1 56 56 LYS HD3 H 1 1.73 0.01 . 1 . . . . 57 LYS HD3 . 17302 1 470 . 1 1 56 56 LYS HE2 H 1 2.93 0.01 . 1 . . . . 57 LYS HE2 . 17302 1 471 . 1 1 56 56 LYS HE3 H 1 2.93 0.01 . 1 . . . . 57 LYS HE3 . 17302 1 472 . 1 1 56 56 LYS N N 15 123.4 0.1 . 1 . . . . 57 LYS N . 17302 1 473 . 1 1 57 57 VAL H H 1 8.50 0.01 . 1 . . . . 58 VAL H . 17302 1 474 . 1 1 57 57 VAL HA H 1 4.84 0.01 . 1 . . . . 58 VAL HA . 17302 1 475 . 1 1 57 57 VAL HB H 1 1.92 0.01 . 1 . . . . 58 VAL HB . 17302 1 476 . 1 1 57 57 VAL HG11 H 1 0.80 0.01 . 1 . . . . 58 VAL MG1 . 17302 1 477 . 1 1 57 57 VAL HG12 H 1 0.80 0.01 . 1 . . . . 58 VAL MG1 . 17302 1 478 . 1 1 57 57 VAL HG13 H 1 0.80 0.01 . 1 . . . . 58 VAL MG1 . 17302 1 479 . 1 1 57 57 VAL HG21 H 1 0.93 0.01 . 1 . . . . 58 VAL MG2 . 17302 1 480 . 1 1 57 57 VAL HG22 H 1 0.93 0.01 . 1 . . . . 58 VAL MG2 . 17302 1 481 . 1 1 57 57 VAL HG23 H 1 0.93 0.01 . 1 . . . . 58 VAL MG2 . 17302 1 482 . 1 1 57 57 VAL N N 15 126.0 0.1 . 1 . . . . 58 VAL N . 17302 1 483 . 1 1 58 58 ILE H H 1 9.14 0.01 . 1 . . . . 59 ILE H . 17302 1 484 . 1 1 58 58 ILE HA H 1 4.29 0.01 . 1 . . . . 59 ILE HA . 17302 1 485 . 1 1 58 58 ILE HB H 1 1.70 0.01 . 1 . . . . 59 ILE HB . 17302 1 486 . 1 1 58 58 ILE HG12 H 1 1.45 0.01 . 9 . . . . 59 ILE HG12 . 17302 1 487 . 1 1 58 58 ILE HG13 H 1 1.45 0.01 . 9 . . . . 59 ILE HG13 . 17302 1 488 . 1 1 58 58 ILE HG21 H 1 0.73 0.01 . 1 . . . . 59 ILE MG . 17302 1 489 . 1 1 58 58 ILE HG22 H 1 0.73 0.01 . 1 . . . . 59 ILE MG . 17302 1 490 . 1 1 58 58 ILE HG23 H 1 0.73 0.01 . 1 . . . . 59 ILE MG . 17302 1 491 . 1 1 58 58 ILE HD11 H 1 0.99 0.01 . 9 . . . . 59 ILE MD . 17302 1 492 . 1 1 58 58 ILE HD12 H 1 0.99 0.01 . 9 . . . . 59 ILE MD . 17302 1 493 . 1 1 58 58 ILE HD13 H 1 0.99 0.01 . 9 . . . . 59 ILE MD . 17302 1 494 . 1 1 58 58 ILE N N 15 128.8 0.1 . 1 . . . . 59 ILE N . 17302 1 495 . 1 1 59 59 GLN H H 1 8.89 0.01 . 1 . . . . 60 GLN H . 17302 1 496 . 1 1 59 59 GLN HA H 1 5.46 0.01 . 1 . . . . 60 GLN HA . 17302 1 497 . 1 1 59 59 GLN HB2 H 1 1.95 0.01 . 1 . . . . 60 GLN HB2 . 17302 1 498 . 1 1 59 59 GLN HB3 H 1 2.08 0.01 . 1 . . . . 60 GLN HB3 . 17302 1 499 . 1 1 59 59 GLN HG2 H 1 2.26 0.01 . 1 . . . . 60 GLN HG2 . 17302 1 500 . 1 1 59 59 GLN HG3 H 1 2.33 0.01 . 1 . . . . 60 GLN HG3 . 17302 1 501 . 1 1 59 59 GLN HE21 H 1 6.87 0.01 . 1 . . . . 60 GLN HE21 . 17302 1 502 . 1 1 59 59 GLN HE22 H 1 7.62 0.01 . 1 . . . . 60 GLN HE22 . 17302 1 503 . 1 1 59 59 GLN N N 15 127.6 0.1 . 1 . . . . 60 GLN N . 17302 1 504 . 1 1 59 59 GLN NE2 N 15 112.4 0.1 . 1 . . . . 60 GLN NE2 . 17302 1 505 . 1 1 60 60 ASN H H 1 8.95 0.01 . 1 . . . . 61 ASN H . 17302 1 506 . 1 1 60 60 ASN HA H 1 5.46 0.01 . 1 . . . . 61 ASN HA . 17302 1 507 . 1 1 60 60 ASN HB2 H 1 2.58 0.01 . 1 . . . . 61 ASN HB2 . 17302 1 508 . 1 1 60 60 ASN HB3 H 1 2.68 0.01 . 1 . . . . 61 ASN HB3 . 17302 1 509 . 1 1 60 60 ASN HD21 H 1 7.29 0.01 . 1 . . . . 61 ASN HD21 . 17302 1 510 . 1 1 60 60 ASN HD22 H 1 7.78 0.01 . 1 . . . . 61 ASN HD22 . 17302 1 511 . 1 1 60 60 ASN N N 15 122.0 0.1 . 1 . . . . 61 ASN N . 17302 1 512 . 1 1 60 60 ASN ND2 N 15 113.9 0.1 . 1 . . . . 61 ASN ND2 . 17302 1 513 . 1 1 61 61 GLU H H 1 9.08 0.01 . 1 . . . . 62 GLU H . 17302 1 514 . 1 1 61 61 GLU HA H 1 5.28 0.01 . 1 . . . . 62 GLU HA . 17302 1 515 . 1 1 61 61 GLU HB2 H 1 2.06 0.01 . 1 . . . . 62 GLU HB2 . 17302 1 516 . 1 1 61 61 GLU HB3 H 1 2.06 0.01 . 1 . . . . 62 GLU HB3 . 17302 1 517 . 1 1 61 61 GLU HG2 H 1 2.35 0.01 . 1 . . . . 62 GLU HG2 . 17302 1 518 . 1 1 61 61 GLU HG3 H 1 2.30 0.01 . 1 . . . . 62 GLU HG3 . 17302 1 519 . 1 1 61 61 GLU N N 15 122.5 0.1 . 1 . . . . 62 GLU N . 17302 1 520 . 1 1 62 62 PHE H H 1 8.23 0.01 . 1 . . . . 63 PHE H . 17302 1 521 . 1 1 62 62 PHE HA H 1 5.06 0.01 . 1 . . . . 63 PHE HA . 17302 1 522 . 1 1 62 62 PHE HB2 H 1 3.08 0.01 . 1 . . . . 63 PHE HB2 . 17302 1 523 . 1 1 62 62 PHE HB3 H 1 3.36 0.01 . 1 . . . . 63 PHE HB3 . 17302 1 524 . 1 1 62 62 PHE HD1 H 1 6.59 0.01 . 1 . . . . 63 PHE HD1 . 17302 1 525 . 1 1 62 62 PHE HD2 H 1 6.59 0.01 . 1 . . . . 63 PHE HD2 . 17302 1 526 . 1 1 62 62 PHE HE1 H 1 6.52 0.01 . 1 . . . . 63 PHE HE1 . 17302 1 527 . 1 1 62 62 PHE HE2 H 1 6.52 0.01 . 1 . . . . 63 PHE HE2 . 17302 1 528 . 1 1 62 62 PHE HZ H 1 6.38 0.01 . 1 . . . . 63 PHE HZ . 17302 1 529 . 1 1 62 62 PHE N N 15 117.6 0.1 . 1 . . . . 63 PHE N . 17302 1 530 . 1 1 63 63 THR H H 1 9.20 0.01 . 1 . . . . 64 THR H . 17302 1 531 . 1 1 63 63 THR HA H 1 5.33 0.01 . 1 . . . . 64 THR HA . 17302 1 532 . 1 1 63 63 THR HB H 1 4.03 0.01 . 1 . . . . 64 THR HB . 17302 1 533 . 1 1 63 63 THR HG21 H 1 1.33 0.01 . 1 . . . . 64 THR MG . 17302 1 534 . 1 1 63 63 THR HG22 H 1 1.33 0.01 . 1 . . . . 64 THR MG . 17302 1 535 . 1 1 63 63 THR HG23 H 1 1.33 0.01 . 1 . . . . 64 THR MG . 17302 1 536 . 1 1 63 63 THR N N 15 118.8 0.1 . 1 . . . . 64 THR N . 17302 1 537 . 1 1 64 64 VAL H H 1 9.18 0.01 . 1 . . . . 65 VAL H . 17302 1 538 . 1 1 64 64 VAL HA H 1 4.22 0.01 . 1 . . . . 65 VAL HA . 17302 1 539 . 1 1 64 64 VAL HB H 1 2.38 0.01 . 1 . . . . 65 VAL HB . 17302 1 540 . 1 1 64 64 VAL HG11 H 1 1.14 0.01 . 1 . . . . 65 VAL MG1 . 17302 1 541 . 1 1 64 64 VAL HG12 H 1 1.14 0.01 . 1 . . . . 65 VAL MG1 . 17302 1 542 . 1 1 64 64 VAL HG13 H 1 1.14 0.01 . 1 . . . . 65 VAL MG1 . 17302 1 543 . 1 1 64 64 VAL HG21 H 1 1.35 0.01 . 1 . . . . 65 VAL MG2 . 17302 1 544 . 1 1 64 64 VAL HG22 H 1 1.35 0.01 . 1 . . . . 65 VAL MG2 . 17302 1 545 . 1 1 64 64 VAL HG23 H 1 1.35 0.01 . 1 . . . . 65 VAL MG2 . 17302 1 546 . 1 1 64 64 VAL N N 15 125.8 0.1 . 1 . . . . 65 VAL N . 17302 1 547 . 1 1 65 65 GLY H H 1 8.85 0.01 . 1 . . . . 66 GLY H . 17302 1 548 . 1 1 65 65 GLY HA2 H 1 3.55 0.01 . 1 . . . . 66 GLY HA2 . 17302 1 549 . 1 1 65 65 GLY HA3 H 1 4.38 0.01 . 1 . . . . 66 GLY HA3 . 17302 1 550 . 1 1 65 65 GLY N N 15 109.9 0.1 . 1 . . . . 66 GLY N . 17302 1 551 . 1 1 66 66 GLU H H 1 7.85 0.01 . 1 . . . . 67 GLU H . 17302 1 552 . 1 1 66 66 GLU HA H 1 4.79 0.01 . 1 . . . . 67 GLU HA . 17302 1 553 . 1 1 66 66 GLU HB2 H 1 2.03 0.01 . 1 . . . . 67 GLU HB2 . 17302 1 554 . 1 1 66 66 GLU HB3 H 1 2.03 0.01 . 1 . . . . 67 GLU HB3 . 17302 1 555 . 1 1 66 66 GLU HG2 H 1 2.22 0.01 . 1 . . . . 67 GLU HG2 . 17302 1 556 . 1 1 66 66 GLU HG3 H 1 2.28 0.01 . 1 . . . . 67 GLU HG3 . 17302 1 557 . 1 1 66 66 GLU N N 15 119.4 0.1 . 1 . . . . 67 GLU N . 17302 1 558 . 1 1 67 67 GLU H H 1 9.02 0.01 . 1 . . . . 68 GLU H . 17302 1 559 . 1 1 67 67 GLU HA H 1 4.39 0.01 . 1 . . . . 68 GLU HA . 17302 1 560 . 1 1 67 67 GLU HB2 H 1 2.17 0.01 . 2 . . . . 68 GLU HB2 . 17302 1 561 . 1 1 67 67 GLU HB3 H 1 1.99 0.01 . 2 . . . . 68 GLU HB3 . 17302 1 562 . 1 1 67 67 GLU HG2 H 1 2.31 0.01 . 1 . . . . 68 GLU HG2 . 17302 1 563 . 1 1 67 67 GLU HG3 H 1 2.24 0.01 . 1 . . . . 68 GLU HG3 . 17302 1 564 . 1 1 67 67 GLU N N 15 125.7 0.1 . 1 . . . . 68 GLU N . 17302 1 565 . 1 1 68 68 CYS H H 1 9.29 0.01 . 1 . . . . 69 CYS H . 17302 1 566 . 1 1 68 68 CYS HA H 1 5.19 0.01 . 1 . . . . 69 CYS HA . 17302 1 567 . 1 1 68 68 CYS HB2 H 1 3.38 0.01 . 1 . . . . 69 CYS HB2 . 17302 1 568 . 1 1 68 68 CYS HB3 H 1 3.10 0.01 . 1 . . . . 69 CYS HB3 . 17302 1 569 . 1 1 68 68 CYS N N 15 122.2 0.1 . 1 . . . . 69 CYS N . 17302 1 570 . 1 1 69 69 GLU H H 1 8.49 0.01 . 1 . . . . 70 GLU H . 17302 1 571 . 1 1 69 69 GLU HA H 1 5.06 0.01 . 1 . . . . 70 GLU HA . 17302 1 572 . 1 1 69 69 GLU HB2 H 1 1.92 0.01 . 1 . . . . 70 GLU HB2 . 17302 1 573 . 1 1 69 69 GLU HB3 H 1 1.84 0.01 . 1 . . . . 70 GLU HB3 . 17302 1 574 . 1 1 69 69 GLU HG2 H 1 2.08 0.01 . 1 . . . . 70 GLU HG2 . 17302 1 575 . 1 1 69 69 GLU HG3 H 1 2.08 0.01 . 1 . . . . 70 GLU HG3 . 17302 1 576 . 1 1 69 69 GLU N N 15 119.9 0.1 . 1 . . . . 70 GLU N . 17302 1 577 . 1 1 70 70 LEU H H 1 8.82 0.01 . 1 . . . . 71 LEU H . 17302 1 578 . 1 1 70 70 LEU HA H 1 4.54 0.01 . 1 . . . . 71 LEU HA . 17302 1 579 . 1 1 70 70 LEU HB2 H 1 1.12 0.01 . 1 . . . . 71 LEU HB2 . 17302 1 580 . 1 1 70 70 LEU HB3 H 1 1.05 0.01 . 1 . . . . 71 LEU HB3 . 17302 1 581 . 1 1 70 70 LEU HG H 1 1.25 0.01 . 1 . . . . 71 LEU HG . 17302 1 582 . 1 1 70 70 LEU HD11 H 1 0.28 0.01 . 1 . . . . 71 LEU MD1 . 17302 1 583 . 1 1 70 70 LEU HD12 H 1 0.28 0.01 . 1 . . . . 71 LEU MD1 . 17302 1 584 . 1 1 70 70 LEU HD13 H 1 0.28 0.01 . 1 . . . . 71 LEU MD1 . 17302 1 585 . 1 1 70 70 LEU HD21 H 1 0.44 0.01 . 1 . . . . 71 LEU MD2 . 17302 1 586 . 1 1 70 70 LEU HD22 H 1 0.44 0.01 . 1 . . . . 71 LEU MD2 . 17302 1 587 . 1 1 70 70 LEU HD23 H 1 0.44 0.01 . 1 . . . . 71 LEU MD2 . 17302 1 588 . 1 1 70 70 LEU N N 15 126.1 0.1 . 1 . . . . 71 LEU N . 17302 1 589 . 1 1 71 71 GLU H H 1 9.40 0.01 . 1 . . . . 72 GLU H . 17302 1 590 . 1 1 71 71 GLU HA H 1 4.72 0.01 . 1 . . . . 72 GLU HA . 17302 1 591 . 1 1 71 71 GLU HB2 H 1 1.91 0.01 . 1 . . . . 72 GLU HB2 . 17302 1 592 . 1 1 71 71 GLU HB3 H 1 1.91 0.01 . 1 . . . . 72 GLU HB3 . 17302 1 593 . 1 1 71 71 GLU HG2 H 1 2.37 0.01 . 2 . . . . 72 GLU HG2 . 17302 1 594 . 1 1 71 71 GLU HG3 H 1 2.06 0.01 . 2 . . . . 72 GLU HG3 . 17302 1 595 . 1 1 71 71 GLU N N 15 124.3 0.1 . 1 . . . . 72 GLU N . 17302 1 596 . 1 1 72 72 THR H H 1 8.37 0.01 . 1 . . . . 73 THR H . 17302 1 597 . 1 1 72 72 THR HA H 1 4.60 0.01 . 9 . . . . 73 THR HA . 17302 1 598 . 1 1 72 72 THR HB H 1 4.39 0.01 . 9 . . . . 73 THR HB . 17302 1 599 . 1 1 72 72 THR HG21 H 1 1.17 0.01 . 9 . . . . 73 THR MG . 17302 1 600 . 1 1 72 72 THR HG22 H 1 1.17 0.01 . 9 . . . . 73 THR MG . 17302 1 601 . 1 1 72 72 THR HG23 H 1 1.17 0.01 . 9 . . . . 73 THR MG . 17302 1 602 . 1 1 72 72 THR N N 15 116.3 0.1 . 1 . . . . 73 THR N . 17302 1 603 . 1 1 73 73 MET H H 1 7.67 0.01 . 1 . . . . 74 MET H . 17302 1 604 . 1 1 73 73 MET HA H 1 3.53 0.01 . 1 . . . . 74 MET HA . 17302 1 605 . 1 1 73 73 MET HB2 H 1 2.12 0.01 . 1 . . . . 74 MET HB2 . 17302 1 606 . 1 1 73 73 MET HB3 H 1 1.93 0.01 . 9 . . . . 74 MET HB3 . 17302 1 607 . 1 1 73 73 MET HG2 H 1 2.49 0.01 . 1 . . . . 74 MET HG2 . 17302 1 608 . 1 1 73 73 MET HG3 H 1 2.49 0.01 . 1 . . . . 74 MET HG3 . 17302 1 609 . 1 1 73 73 MET N N 15 119.2 0.1 . 1 . . . . 74 MET N . 17302 1 610 . 1 1 74 74 THR H H 1 7.54 0.01 . 1 . . . . 75 THR H . 17302 1 611 . 1 1 74 74 THR HA H 1 4.26 0.01 . 1 . . . . 75 THR HA . 17302 1 612 . 1 1 74 74 THR HB H 1 4.54 0.01 . 1 . . . . 75 THR HB . 17302 1 613 . 1 1 74 74 THR HG21 H 1 1.11 0.01 . 1 . . . . 75 THR MG . 17302 1 614 . 1 1 74 74 THR HG22 H 1 1.11 0.01 . 1 . . . . 75 THR MG . 17302 1 615 . 1 1 74 74 THR HG23 H 1 1.11 0.01 . 1 . . . . 75 THR MG . 17302 1 616 . 1 1 74 74 THR N N 15 105.0 0.1 . 1 . . . . 75 THR N . 17302 1 617 . 1 1 75 75 GLY H H 1 7.84 0.01 . 1 . . . . 76 GLY H . 17302 1 618 . 1 1 75 75 GLY HA2 H 1 4.36 0.01 . 1 . . . . 76 GLY HA2 . 17302 1 619 . 1 1 75 75 GLY HA3 H 1 3.88 0.01 . 1 . . . . 76 GLY HA3 . 17302 1 620 . 1 1 75 75 GLY N N 15 110.6 0.1 . 1 . . . . 76 GLY N . 17302 1 621 . 1 1 76 76 GLU H H 1 7.38 0.01 . 1 . . . . 77 GLU H . 17302 1 622 . 1 1 76 76 GLU HA H 1 4.25 0.01 . 1 . . . . 77 GLU HA . 17302 1 623 . 1 1 76 76 GLU HB2 H 1 1.79 0.01 . 1 . . . . 77 GLU HB2 . 17302 1 624 . 1 1 76 76 GLU HB3 H 1 1.79 0.01 . 1 . . . . 77 GLU HB3 . 17302 1 625 . 1 1 76 76 GLU HG2 H 1 2.19 0.01 . 2 . . . . 77 GLU HG2 . 17302 1 626 . 1 1 76 76 GLU HG3 H 1 2.08 0.01 . 2 . . . . 77 GLU HG3 . 17302 1 627 . 1 1 76 76 GLU N N 15 120.8 0.1 . 1 . . . . 77 GLU N . 17302 1 628 . 1 1 77 77 LYS H H 1 8.63 0.01 . 1 . . . . 78 LYS H . 17302 1 629 . 1 1 77 77 LYS HA H 1 5.23 0.01 . 1 . . . . 78 LYS HA . 17302 1 630 . 1 1 77 77 LYS HB2 H 1 1.73 0.01 . 1 . . . . 78 LYS HB2 . 17302 1 631 . 1 1 77 77 LYS HB3 H 1 1.49 0.01 . 1 . . . . 78 LYS HB3 . 17302 1 632 . 1 1 77 77 LYS HG2 H 1 1.23 0.01 . 1 . . . . 78 LYS HG2 . 17302 1 633 . 1 1 77 77 LYS HG3 H 1 1.23 0.01 . 1 . . . . 78 LYS HG3 . 17302 1 634 . 1 1 77 77 LYS HD2 H 1 1.61 0.01 . 1 . . . . 78 LYS HD2 . 17302 1 635 . 1 1 77 77 LYS HD3 H 1 1.61 0.01 . 1 . . . . 78 LYS HD3 . 17302 1 636 . 1 1 77 77 LYS HE2 H 1 2.97 0.01 . 1 . . . . 78 LYS HE2 . 17302 1 637 . 1 1 77 77 LYS HE3 H 1 2.97 0.01 . 1 . . . . 78 LYS HE3 . 17302 1 638 . 1 1 77 77 LYS N N 15 124.1 0.1 . 1 . . . . 78 LYS N . 17302 1 639 . 1 1 78 78 VAL H H 1 8.92 0.01 . 1 . . . . 79 VAL H . 17302 1 640 . 1 1 78 78 VAL HA H 1 4.55 0.01 . 1 . . . . 79 VAL HA . 17302 1 641 . 1 1 78 78 VAL HB H 1 1.93 0.01 . 1 . . . . 79 VAL HB . 17302 1 642 . 1 1 78 78 VAL HG11 H 1 0.55 0.01 . 1 . . . . 79 VAL MG1 . 17302 1 643 . 1 1 78 78 VAL HG12 H 1 0.55 0.01 . 1 . . . . 79 VAL MG1 . 17302 1 644 . 1 1 78 78 VAL HG13 H 1 0.55 0.01 . 1 . . . . 79 VAL MG1 . 17302 1 645 . 1 1 78 78 VAL HG21 H 1 0.78 0.01 . 1 . . . . 79 VAL MG2 . 17302 1 646 . 1 1 78 78 VAL HG22 H 1 0.78 0.01 . 1 . . . . 79 VAL MG2 . 17302 1 647 . 1 1 78 78 VAL HG23 H 1 0.78 0.01 . 1 . . . . 79 VAL MG2 . 17302 1 648 . 1 1 78 78 VAL N N 15 119.9 0.1 . 1 . . . . 79 VAL N . 17302 1 649 . 1 1 79 79 LYS H H 1 8.48 0.01 . 1 . . . . 80 LYS H . 17302 1 650 . 1 1 79 79 LYS HA H 1 5.26 0.01 . 1 . . . . 80 LYS HA . 17302 1 651 . 1 1 79 79 LYS HB2 H 1 1.76 0.01 . 1 . . . . 80 LYS HB2 . 17302 1 652 . 1 1 79 79 LYS HB3 H 1 1.76 0.01 . 1 . . . . 80 LYS HB3 . 17302 1 653 . 1 1 79 79 LYS HG2 H 1 1.34 0.01 . 1 . . . . 80 LYS HG2 . 17302 1 654 . 1 1 79 79 LYS HG3 H 1 1.51 0.01 . 1 . . . . 80 LYS HG3 . 17302 1 655 . 1 1 79 79 LYS HD2 H 1 1.65 0.01 . 1 . . . . 80 LYS HD2 . 17302 1 656 . 1 1 79 79 LYS HD3 H 1 1.65 0.01 . 1 . . . . 80 LYS HD3 . 17302 1 657 . 1 1 79 79 LYS HE2 H 1 2.95 0.01 . 1 . . . . 80 LYS HE2 . 17302 1 658 . 1 1 79 79 LYS HE3 H 1 2.95 0.01 . 1 . . . . 80 LYS HE3 . 17302 1 659 . 1 1 79 79 LYS N N 15 124.7 0.1 . 1 . . . . 80 LYS N . 17302 1 660 . 1 1 80 80 THR H H 1 8.87 0.01 . 1 . . . . 81 THR H . 17302 1 661 . 1 1 80 80 THR HA H 1 4.76 0.01 . 1 . . . . 81 THR HA . 17302 1 662 . 1 1 80 80 THR HB H 1 4.20 0.01 . 1 . . . . 81 THR HB . 17302 1 663 . 1 1 80 80 THR HG21 H 1 0.82 0.01 . 1 . . . . 81 THR MG . 17302 1 664 . 1 1 80 80 THR HG22 H 1 0.82 0.01 . 1 . . . . 81 THR MG . 17302 1 665 . 1 1 80 80 THR HG23 H 1 0.82 0.01 . 1 . . . . 81 THR MG . 17302 1 666 . 1 1 80 80 THR N N 15 120.4 0.1 . 1 . . . . 81 THR N . 17302 1 667 . 1 1 81 81 VAL H H 1 8.35 0.01 . 1 . . . . 82 VAL H . 17302 1 668 . 1 1 81 81 VAL HA H 1 4.31 0.01 . 1 . . . . 82 VAL HA . 17302 1 669 . 1 1 81 81 VAL HB H 1 1.88 0.01 . 1 . . . . 82 VAL HB . 17302 1 670 . 1 1 81 81 VAL HG11 H 1 0.73 0.01 . 1 . . . . 82 VAL MG1 . 17302 1 671 . 1 1 81 81 VAL HG12 H 1 0.73 0.01 . 1 . . . . 82 VAL MG1 . 17302 1 672 . 1 1 81 81 VAL HG13 H 1 0.73 0.01 . 1 . . . . 82 VAL MG1 . 17302 1 673 . 1 1 81 81 VAL HG21 H 1 0.82 0.01 . 1 . . . . 82 VAL MG2 . 17302 1 674 . 1 1 81 81 VAL HG22 H 1 0.82 0.01 . 1 . . . . 82 VAL MG2 . 17302 1 675 . 1 1 81 81 VAL HG23 H 1 0.82 0.01 . 1 . . . . 82 VAL MG2 . 17302 1 676 . 1 1 81 81 VAL N N 15 120.2 0.1 . 1 . . . . 82 VAL N . 17302 1 677 . 1 1 82 82 VAL H H 1 9.88 0.01 . 1 . . . . 83 VAL H . 17302 1 678 . 1 1 82 82 VAL HA H 1 4.23 0.01 . 1 . . . . 83 VAL HA . 17302 1 679 . 1 1 82 82 VAL HB H 1 1.31 0.01 . 1 . . . . 83 VAL HB . 17302 1 680 . 1 1 82 82 VAL HG11 H 1 0.35 0.01 . 1 . . . . 83 VAL MG1 . 17302 1 681 . 1 1 82 82 VAL HG12 H 1 0.35 0.01 . 1 . . . . 83 VAL MG1 . 17302 1 682 . 1 1 82 82 VAL HG13 H 1 0.35 0.01 . 1 . . . . 83 VAL MG1 . 17302 1 683 . 1 1 82 82 VAL HG21 H 1 -0.26 0.01 . 1 . . . . 83 VAL MG2 . 17302 1 684 . 1 1 82 82 VAL HG22 H 1 -0.26 0.01 . 1 . . . . 83 VAL MG2 . 17302 1 685 . 1 1 82 82 VAL HG23 H 1 -0.26 0.01 . 1 . . . . 83 VAL MG2 . 17302 1 686 . 1 1 82 82 VAL N N 15 133.5 0.1 . 1 . . . . 83 VAL N . 17302 1 687 . 1 1 83 83 GLN H H 1 8.88 0.01 . 1 . . . . 84 GLN H . 17302 1 688 . 1 1 83 83 GLN HA H 1 4.95 0.01 . 1 . . . . 84 GLN HA . 17302 1 689 . 1 1 83 83 GLN HB2 H 1 1.76 0.01 . 1 . . . . 84 GLN HB2 . 17302 1 690 . 1 1 83 83 GLN HB3 H 1 2.11 0.01 . 1 . . . . 84 GLN HB3 . 17302 1 691 . 1 1 83 83 GLN HG2 H 1 2.41 0.01 . 1 . . . . 84 GLN HG2 . 17302 1 692 . 1 1 83 83 GLN HG3 H 1 2.26 0.01 . 1 . . . . 84 GLN HG3 . 17302 1 693 . 1 1 83 83 GLN HE21 H 1 6.86 0.01 . 1 . . . . 84 GLN HE21 . 17302 1 694 . 1 1 83 83 GLN HE22 H 1 7.44 0.01 . 1 . . . . 84 GLN HE22 . 17302 1 695 . 1 1 83 83 GLN N N 15 124.8 0.1 . 1 . . . . 84 GLN N . 17302 1 696 . 1 1 83 83 GLN NE2 N 15 110.6 0.1 . 1 . . . . 84 GLN NE2 . 17302 1 697 . 1 1 84 84 LEU H H 1 8.56 0.01 . 1 . . . . 85 LEU H . 17302 1 698 . 1 1 84 84 LEU HA H 1 5.30 0.01 . 1 . . . . 85 LEU HA . 17302 1 699 . 1 1 84 84 LEU HB2 H 1 1.98 0.01 . 2 . . . . 85 LEU HB2 . 17302 1 700 . 1 1 84 84 LEU HB3 H 1 1.45 0.01 . 2 . . . . 85 LEU HB3 . 17302 1 701 . 1 1 84 84 LEU HG H 1 1.73 0.01 . 1 . . . . 85 LEU HG . 17302 1 702 . 1 1 84 84 LEU HD11 H 1 1.04 0.01 . 1 . . . . 85 LEU MD1 . 17302 1 703 . 1 1 84 84 LEU HD12 H 1 1.04 0.01 . 1 . . . . 85 LEU MD1 . 17302 1 704 . 1 1 84 84 LEU HD13 H 1 1.04 0.01 . 1 . . . . 85 LEU MD1 . 17302 1 705 . 1 1 84 84 LEU HD21 H 1 1.09 0.01 . 1 . . . . 85 LEU MD2 . 17302 1 706 . 1 1 84 84 LEU HD22 H 1 1.09 0.01 . 1 . . . . 85 LEU MD2 . 17302 1 707 . 1 1 84 84 LEU HD23 H 1 1.09 0.01 . 1 . . . . 85 LEU MD2 . 17302 1 708 . 1 1 84 84 LEU N N 15 123.6 0.1 . 1 . . . . 85 LEU N . 17302 1 709 . 1 1 85 85 GLU H H 1 9.18 0.01 . 1 . . . . 86 GLU H . 17302 1 710 . 1 1 85 85 GLU HA H 1 4.60 0.01 . 1 . . . . 86 GLU HA . 17302 1 711 . 1 1 85 85 GLU HB2 H 1 1.76 0.01 . 1 . . . . 86 GLU HB2 . 17302 1 712 . 1 1 85 85 GLU HB3 H 1 1.95 0.01 . 1 . . . . 86 GLU HB3 . 17302 1 713 . 1 1 85 85 GLU HG2 H 1 2.12 0.01 . 1 . . . . 86 GLU HG2 . 17302 1 714 . 1 1 85 85 GLU HG3 H 1 2.17 0.01 . 1 . . . . 86 GLU HG3 . 17302 1 715 . 1 1 85 85 GLU N N 15 128.6 0.1 . 1 . . . . 86 GLU N . 17302 1 716 . 1 1 86 86 GLY H H 1 8.40 0.01 . 1 . . . . 87 GLY H . 17302 1 717 . 1 1 86 86 GLY HA2 H 1 3.80 0.01 . 1 . . . . 87 GLY HA2 . 17302 1 718 . 1 1 86 86 GLY HA3 H 1 4.17 0.01 . 1 . . . . 87 GLY HA3 . 17302 1 719 . 1 1 86 86 GLY N N 15 112.6 0.1 . 1 . . . . 87 GLY N . 17302 1 720 . 1 1 87 87 ASP H H 1 8.47 0.01 . 1 . . . . 88 ASP H . 17302 1 721 . 1 1 87 87 ASP HA H 1 4.80 0.01 . 1 . . . . 88 ASP HA . 17302 1 722 . 1 1 87 87 ASP HB2 H 1 2.72 0.01 . 1 . . . . 88 ASP HB2 . 17302 1 723 . 1 1 87 87 ASP HB3 H 1 2.72 0.01 . 1 . . . . 88 ASP HB3 . 17302 1 724 . 1 1 87 87 ASP N N 15 117.9 0.1 . 1 . . . . 88 ASP N . 17302 1 725 . 1 1 88 88 ASN H H 1 8.32 0.01 . 1 . . . . 89 ASN H . 17302 1 726 . 1 1 88 88 ASN HA H 1 4.89 0.01 . 1 . . . . 89 ASN HA . 17302 1 727 . 1 1 88 88 ASN HB2 H 1 3.02 0.01 . 1 . . . . 89 ASN HB2 . 17302 1 728 . 1 1 88 88 ASN HB3 H 1 3.20 0.01 . 1 . . . . 89 ASN HB3 . 17302 1 729 . 1 1 88 88 ASN HD21 H 1 6.88 0.01 . 1 . . . . 89 ASN HD21 . 17302 1 730 . 1 1 88 88 ASN HD22 H 1 7.42 0.01 . 1 . . . . 89 ASN HD22 . 17302 1 731 . 1 1 88 88 ASN N N 15 114.9 0.1 . 1 . . . . 89 ASN N . 17302 1 732 . 1 1 88 88 ASN ND2 N 15 112.8 0.1 . 1 . . . . 89 ASN ND2 . 17302 1 733 . 1 1 89 89 LYS H H 1 7.47 0.01 . 1 . . . . 90 LYS H . 17302 1 734 . 1 1 89 89 LYS HA H 1 5.56 0.01 . 1 . . . . 90 LYS HA . 17302 1 735 . 1 1 89 89 LYS HB2 H 1 1.90 0.01 . 2 . . . . 90 LYS HB2 . 17302 1 736 . 1 1 89 89 LYS HB3 H 1 1.81 0.01 . 2 . . . . 90 LYS HB3 . 17302 1 737 . 1 1 89 89 LYS HG2 H 1 1.11 0.01 . 1 . . . . 90 LYS HG2 . 17302 1 738 . 1 1 89 89 LYS HG3 H 1 1.28 0.01 . 1 . . . . 90 LYS HG3 . 17302 1 739 . 1 1 89 89 LYS HD2 H 1 1.61 0.01 . 1 . . . . 90 LYS HD2 . 17302 1 740 . 1 1 89 89 LYS HD3 H 1 1.61 0.01 . 1 . . . . 90 LYS HD3 . 17302 1 741 . 1 1 89 89 LYS HE2 H 1 2.86 0.01 . 1 . . . . 90 LYS HE2 . 17302 1 742 . 1 1 89 89 LYS HE3 H 1 2.76 0.01 . 1 . . . . 90 LYS HE3 . 17302 1 743 . 1 1 89 89 LYS N N 15 119.8 0.1 . 1 . . . . 90 LYS N . 17302 1 744 . 1 1 90 90 LEU H H 1 9.14 0.01 . 1 . . . . 91 LEU H . 17302 1 745 . 1 1 90 90 LEU HA H 1 5.24 0.01 . 1 . . . . 91 LEU HA . 17302 1 746 . 1 1 90 90 LEU HB2 H 1 1.44 0.01 . 1 . . . . 91 LEU HB2 . 17302 1 747 . 1 1 90 90 LEU HB3 H 1 0.82 0.01 . 1 . . . . 91 LEU HB3 . 17302 1 748 . 1 1 90 90 LEU HG H 1 1.10 0.01 . 1 . . . . 91 LEU HG . 17302 1 749 . 1 1 90 90 LEU HD11 H 1 -0.11 0.01 . 1 . . . . 91 LEU MD1 . 17302 1 750 . 1 1 90 90 LEU HD12 H 1 -0.11 0.01 . 1 . . . . 91 LEU MD1 . 17302 1 751 . 1 1 90 90 LEU HD13 H 1 -0.11 0.01 . 1 . . . . 91 LEU MD1 . 17302 1 752 . 1 1 90 90 LEU HD21 H 1 0.18 0.01 . 1 . . . . 91 LEU MD2 . 17302 1 753 . 1 1 90 90 LEU HD22 H 1 0.18 0.01 . 1 . . . . 91 LEU MD2 . 17302 1 754 . 1 1 90 90 LEU HD23 H 1 0.18 0.01 . 1 . . . . 91 LEU MD2 . 17302 1 755 . 1 1 90 90 LEU N N 15 126.1 0.1 . 1 . . . . 91 LEU N . 17302 1 756 . 1 1 91 91 VAL H H 1 9.30 0.01 . 1 . . . . 92 VAL H . 17302 1 757 . 1 1 91 91 VAL HA H 1 5.02 0.01 . 1 . . . . 92 VAL HA . 17302 1 758 . 1 1 91 91 VAL HB H 1 1.88 0.01 . 1 . . . . 92 VAL HB . 17302 1 759 . 1 1 91 91 VAL HG11 H 1 0.89 0.01 . 1 . . . . 92 VAL MG1 . 17302 1 760 . 1 1 91 91 VAL HG12 H 1 0.89 0.01 . 1 . . . . 92 VAL MG1 . 17302 1 761 . 1 1 91 91 VAL HG13 H 1 0.89 0.01 . 1 . . . . 92 VAL MG1 . 17302 1 762 . 1 1 91 91 VAL HG21 H 1 0.89 0.01 . 1 . . . . 92 VAL MG2 . 17302 1 763 . 1 1 91 91 VAL HG22 H 1 0.89 0.01 . 1 . . . . 92 VAL MG2 . 17302 1 764 . 1 1 91 91 VAL HG23 H 1 0.89 0.01 . 1 . . . . 92 VAL MG2 . 17302 1 765 . 1 1 91 91 VAL N N 15 123.2 0.1 . 1 . . . . 92 VAL N . 17302 1 766 . 1 1 92 92 THR H H 1 8.90 0.01 . 1 . . . . 93 THR H . 17302 1 767 . 1 1 92 92 THR HA H 1 4.71 0.01 . 1 . . . . 93 THR HA . 17302 1 768 . 1 1 92 92 THR HB H 1 3.93 0.01 . 1 . . . . 93 THR HB . 17302 1 769 . 1 1 92 92 THR HG21 H 1 0.80 0.01 . 1 . . . . 93 THR MG . 17302 1 770 . 1 1 92 92 THR HG22 H 1 0.80 0.01 . 1 . . . . 93 THR MG . 17302 1 771 . 1 1 92 92 THR HG23 H 1 0.80 0.01 . 1 . . . . 93 THR MG . 17302 1 772 . 1 1 92 92 THR N N 15 121.5 0.1 . 1 . . . . 93 THR N . 17302 1 773 . 1 1 93 93 THR H H 1 8.18 0.01 . 1 . . . . 94 THR H . 17302 1 774 . 1 1 93 93 THR HA H 1 5.24 0.01 . 1 . . . . 94 THR HA . 17302 1 775 . 1 1 93 93 THR HB H 1 3.97 0.01 . 1 . . . . 94 THR HB . 17302 1 776 . 1 1 93 93 THR HG21 H 1 1.05 0.01 . 1 . . . . 94 THR MG . 17302 1 777 . 1 1 93 93 THR HG22 H 1 1.05 0.01 . 1 . . . . 94 THR MG . 17302 1 778 . 1 1 93 93 THR HG23 H 1 1.05 0.01 . 1 . . . . 94 THR MG . 17302 1 779 . 1 1 93 93 THR N N 15 117.7 0.1 . 1 . . . . 94 THR N . 17302 1 780 . 1 1 94 94 PHE H H 1 8.32 0.01 . 1 . . . . 95 PHE H . 17302 1 781 . 1 1 94 94 PHE HA H 1 4.80 0.01 . 1 . . . . 95 PHE HA . 17302 1 782 . 1 1 94 94 PHE HB2 H 1 2.80 0.01 . 1 . . . . 95 PHE HB2 . 17302 1 783 . 1 1 94 94 PHE HB3 H 1 3.13 0.01 . 1 . . . . 95 PHE HB3 . 17302 1 784 . 1 1 94 94 PHE HD1 H 1 6.81 0.01 . 1 . . . . 95 PHE HD1 . 17302 1 785 . 1 1 94 94 PHE HD2 H 1 6.81 0.01 . 1 . . . . 95 PHE HD2 . 17302 1 786 . 1 1 94 94 PHE HE1 H 1 7.10 0.01 . 1 . . . . 95 PHE HE1 . 17302 1 787 . 1 1 94 94 PHE HE2 H 1 7.10 0.01 . 1 . . . . 95 PHE HE2 . 17302 1 788 . 1 1 94 94 PHE HZ H 1 7.17 0.01 . 1 . . . . 95 PHE HZ . 17302 1 789 . 1 1 94 94 PHE N N 15 121.1 0.1 . 1 . . . . 95 PHE N . 17302 1 790 . 1 1 95 95 LYS H H 1 9.35 0.01 . 1 . . . . 96 LYS H . 17302 1 791 . 1 1 95 95 LYS HA H 1 3.84 0.01 . 1 . . . . 96 LYS HA . 17302 1 792 . 1 1 95 95 LYS HB2 H 1 2.01 0.01 . 1 . . . . 96 LYS HB2 . 17302 1 793 . 1 1 95 95 LYS HB3 H 1 2.01 0.01 . 1 . . . . 96 LYS HB3 . 17302 1 794 . 1 1 95 95 LYS HG2 H 1 1.53 0.01 . 1 . . . . 96 LYS HG2 . 17302 1 795 . 1 1 95 95 LYS HG3 H 1 1.63 0.01 . 1 . . . . 96 LYS HG3 . 17302 1 796 . 1 1 95 95 LYS HD2 H 1 1.79 0.01 . 1 . . . . 96 LYS HD2 . 17302 1 797 . 1 1 95 95 LYS HD3 H 1 1.74 0.01 . 1 . . . . 96 LYS HD3 . 17302 1 798 . 1 1 95 95 LYS HE2 H 1 3.01 0.01 . 1 . . . . 96 LYS HE2 . 17302 1 799 . 1 1 95 95 LYS HE3 H 1 3.01 0.01 . 1 . . . . 96 LYS HE3 . 17302 1 800 . 1 1 95 95 LYS N N 15 119.7 0.1 . 1 . . . . 96 LYS N . 17302 1 801 . 1 1 96 96 ASN H H 1 8.52 0.01 . 1 . . . . 97 ASN H . 17302 1 802 . 1 1 96 96 ASN HA H 1 4.38 0.01 . 1 . . . . 97 ASN HA . 17302 1 803 . 1 1 96 96 ASN HB2 H 1 3.05 0.01 . 2 . . . . 97 ASN HB2 . 17302 1 804 . 1 1 96 96 ASN HB3 H 1 2.89 0.01 . 2 . . . . 97 ASN HB3 . 17302 1 805 . 1 1 96 96 ASN HD21 H 1 7.45 0.01 . 1 . . . . 97 ASN HD21 . 17302 1 806 . 1 1 96 96 ASN HD22 H 1 6.81 0.01 . 1 . . . . 97 ASN HD22 . 17302 1 807 . 1 1 96 96 ASN N N 15 113.9 0.1 . 1 . . . . 97 ASN N . 17302 1 808 . 1 1 96 96 ASN ND2 N 15 112.3 0.1 . 1 . . . . 97 ASN ND2 . 17302 1 809 . 1 1 97 97 ILE H H 1 8.44 0.01 . 1 . . . . 98 ILE H . 17302 1 810 . 1 1 97 97 ILE HA H 1 4.54 0.01 . 1 . . . . 98 ILE HA . 17302 1 811 . 1 1 97 97 ILE HB H 1 1.58 0.01 . 1 . . . . 98 ILE HB . 17302 1 812 . 1 1 97 97 ILE HG12 H 1 1.76 0.01 . 9 . . . . 98 ILE HG12 . 17302 1 813 . 1 1 97 97 ILE HG13 H 1 1.76 0.01 . 9 . . . . 98 ILE HG13 . 17302 1 814 . 1 1 97 97 ILE HG21 H 1 0.71 0.01 . 1 . . . . 98 ILE MG . 17302 1 815 . 1 1 97 97 ILE HG22 H 1 0.71 0.01 . 1 . . . . 98 ILE MG . 17302 1 816 . 1 1 97 97 ILE HG23 H 1 0.71 0.01 . 1 . . . . 98 ILE MG . 17302 1 817 . 1 1 97 97 ILE HD11 H 1 0.84 0.01 . 9 . . . . 98 ILE MD . 17302 1 818 . 1 1 97 97 ILE HD12 H 1 0.84 0.01 . 9 . . . . 98 ILE MD . 17302 1 819 . 1 1 97 97 ILE HD13 H 1 0.84 0.01 . 9 . . . . 98 ILE MD . 17302 1 820 . 1 1 97 97 ILE N N 15 122.3 0.1 . 1 . . . . 98 ILE N . 17302 1 821 . 1 1 98 98 LYS H H 1 8.18 0.01 . 1 . . . . 99 LYS H . 17302 1 822 . 1 1 98 98 LYS HA H 1 4.69 0.01 . 1 . . . . 99 LYS HA . 17302 1 823 . 1 1 98 98 LYS HB2 H 1 1.83 0.01 . 2 . . . . 99 LYS HB2 . 17302 1 824 . 1 1 98 98 LYS HB3 H 1 1.68 0.01 . 2 . . . . 99 LYS HB3 . 17302 1 825 . 1 1 98 98 LYS HG2 H 1 1.30 0.01 . 2 . . . . 99 LYS HG2 . 17302 1 826 . 1 1 98 98 LYS HG3 H 1 1.25 0.01 . 2 . . . . 99 LYS HG3 . 17302 1 827 . 1 1 98 98 LYS HD2 H 1 1.59 0.01 . 1 . . . . 99 LYS HD2 . 17302 1 828 . 1 1 98 98 LYS HD3 H 1 1.59 0.01 . 1 . . . . 99 LYS HD3 . 17302 1 829 . 1 1 98 98 LYS HE2 H 1 2.80 0.01 . 1 . . . . 99 LYS HE2 . 17302 1 830 . 1 1 98 98 LYS HE3 H 1 2.80 0.01 . 1 . . . . 99 LYS HE3 . 17302 1 831 . 1 1 98 98 LYS N N 15 127.1 0.1 . 1 . . . . 99 LYS N . 17302 1 832 . 1 1 99 99 SER H H 1 8.96 0.01 . 1 . . . . 100 SER H . 17302 1 833 . 1 1 99 99 SER HA H 1 5.39 0.01 . 1 . . . . 100 SER HA . 17302 1 834 . 1 1 99 99 SER HB2 H 1 3.36 0.01 . 1 . . . . 100 SER HB2 . 17302 1 835 . 1 1 99 99 SER HB3 H 1 3.68 0.01 . 1 . . . . 100 SER HB3 . 17302 1 836 . 1 1 99 99 SER N N 15 121.5 0.1 . 1 . . . . 100 SER N . 17302 1 837 . 1 1 100 100 VAL H H 1 9.00 0.01 . 1 . . . . 101 VAL H . 17302 1 838 . 1 1 100 100 VAL HA H 1 4.93 0.01 . 1 . . . . 101 VAL HA . 17302 1 839 . 1 1 100 100 VAL HB H 1 2.02 0.01 . 1 . . . . 101 VAL HB . 17302 1 840 . 1 1 100 100 VAL HG11 H 1 0.97 0.01 . 1 . . . . 101 VAL MG1 . 17302 1 841 . 1 1 100 100 VAL HG12 H 1 0.97 0.01 . 1 . . . . 101 VAL MG1 . 17302 1 842 . 1 1 100 100 VAL HG13 H 1 0.97 0.01 . 1 . . . . 101 VAL MG1 . 17302 1 843 . 1 1 100 100 VAL HG21 H 1 0.91 0.01 . 1 . . . . 101 VAL MG2 . 17302 1 844 . 1 1 100 100 VAL HG22 H 1 0.91 0.01 . 1 . . . . 101 VAL MG2 . 17302 1 845 . 1 1 100 100 VAL HG23 H 1 0.91 0.01 . 1 . . . . 101 VAL MG2 . 17302 1 846 . 1 1 100 100 VAL N N 15 128.8 0.1 . 1 . . . . 101 VAL N . 17302 1 847 . 1 1 101 101 THR H H 1 9.43 0.01 . 1 . . . . 102 THR H . 17302 1 848 . 1 1 101 101 THR HA H 1 5.18 0.01 . 1 . . . . 102 THR HA . 17302 1 849 . 1 1 101 101 THR HB H 1 3.99 0.01 . 1 . . . . 102 THR HB . 17302 1 850 . 1 1 101 101 THR HG21 H 1 1.15 0.01 . 1 . . . . 102 THR MG . 17302 1 851 . 1 1 101 101 THR HG22 H 1 1.15 0.01 . 1 . . . . 102 THR MG . 17302 1 852 . 1 1 101 101 THR HG23 H 1 1.15 0.01 . 1 . . . . 102 THR MG . 17302 1 853 . 1 1 101 101 THR N N 15 127.6 0.1 . 1 . . . . 102 THR N . 17302 1 854 . 1 1 102 102 GLU H H 1 9.21 0.01 . 1 . . . . 103 GLU H . 17302 1 855 . 1 1 102 102 GLU HA H 1 5.54 0.01 . 1 . . . . 103 GLU HA . 17302 1 856 . 1 1 102 102 GLU HB2 H 1 1.76 0.01 . 1 . . . . 103 GLU HB2 . 17302 1 857 . 1 1 102 102 GLU HB3 H 1 2.02 0.01 . 1 . . . . 103 GLU HB3 . 17302 1 858 . 1 1 102 102 GLU HG2 H 1 2.17 0.01 . 1 . . . . 103 GLU HG2 . 17302 1 859 . 1 1 102 102 GLU HG3 H 1 2.17 0.01 . 1 . . . . 103 GLU HG3 . 17302 1 860 . 1 1 102 102 GLU N N 15 127.9 0.1 . 1 . . . . 103 GLU N . 17302 1 861 . 1 1 103 103 LEU H H 1 8.64 0.01 . 1 . . . . 104 LEU H . 17302 1 862 . 1 1 103 103 LEU HA H 1 4.82 0.01 . 1 . . . . 104 LEU HA . 17302 1 863 . 1 1 103 103 LEU HB2 H 1 1.16 0.01 . 1 . . . . 104 LEU HB2 . 17302 1 864 . 1 1 103 103 LEU HB3 H 1 0.56 0.01 . 1 . . . . 104 LEU HB3 . 17302 1 865 . 1 1 103 103 LEU HG H 1 1.10 0.01 . 1 . . . . 104 LEU HG . 17302 1 866 . 1 1 103 103 LEU HD11 H 1 0.34 0.01 . 1 . . . . 104 LEU MD1 . 17302 1 867 . 1 1 103 103 LEU HD12 H 1 0.34 0.01 . 1 . . . . 104 LEU MD1 . 17302 1 868 . 1 1 103 103 LEU HD13 H 1 0.34 0.01 . 1 . . . . 104 LEU MD1 . 17302 1 869 . 1 1 103 103 LEU HD21 H 1 0.59 0.01 . 1 . . . . 104 LEU MD2 . 17302 1 870 . 1 1 103 103 LEU HD22 H 1 0.59 0.01 . 1 . . . . 104 LEU MD2 . 17302 1 871 . 1 1 103 103 LEU HD23 H 1 0.59 0.01 . 1 . . . . 104 LEU MD2 . 17302 1 872 . 1 1 103 103 LEU N N 15 128.7 0.1 . 1 . . . . 104 LEU N . 17302 1 873 . 1 1 104 104 ASN H H 1 9.05 0.01 . 1 . . . . 105 ASN H . 17302 1 874 . 1 1 104 104 ASN HA H 1 4.88 0.01 . 1 . . . . 105 ASN HA . 17302 1 875 . 1 1 104 104 ASN HB2 H 1 2.78 0.01 . 1 . . . . 105 ASN HB2 . 17302 1 876 . 1 1 104 104 ASN HB3 H 1 2.59 0.01 . 1 . . . . 105 ASN HB3 . 17302 1 877 . 1 1 104 104 ASN HD21 H 1 7.05 0.01 . 1 . . . . 105 ASN HD21 . 17302 1 878 . 1 1 104 104 ASN HD22 H 1 7.58 0.01 . 1 . . . . 105 ASN HD22 . 17302 1 879 . 1 1 104 104 ASN N N 15 126.7 0.1 . 1 . . . . 105 ASN N . 17302 1 880 . 1 1 104 104 ASN ND2 N 15 112.6 0.1 . 1 . . . . 105 ASN ND2 . 17302 1 881 . 1 1 105 105 GLY H H 1 9.00 0.01 . 1 . . . . 106 GLY H . 17302 1 882 . 1 1 105 105 GLY HA2 H 1 3.59 0.01 . 1 . . . . 106 GLY HA2 . 17302 1 883 . 1 1 105 105 GLY HA3 H 1 4.03 0.01 . 1 . . . . 106 GLY HA3 . 17302 1 884 . 1 1 105 105 GLY N N 15 115.4 0.1 . 1 . . . . 106 GLY N . 17302 1 885 . 1 1 106 106 ASP H H 1 8.95 0.01 . 1 . . . . 107 ASP H . 17302 1 886 . 1 1 106 106 ASP HA H 1 4.82 0.01 . 1 . . . . 107 ASP HA . 17302 1 887 . 1 1 106 106 ASP HB2 H 1 2.77 0.01 . 1 . . . . 107 ASP HB2 . 17302 1 888 . 1 1 106 106 ASP HB3 H 1 3.03 0.01 . 1 . . . . 107 ASP HB3 . 17302 1 889 . 1 1 106 106 ASP N N 15 127.8 0.1 . 1 . . . . 107 ASP N . 17302 1 890 . 1 1 107 107 ILE H H 1 7.92 0.01 . 1 . . . . 108 ILE H . 17302 1 891 . 1 1 107 107 ILE HA H 1 5.12 0.01 . 1 . . . . 108 ILE HA . 17302 1 892 . 1 1 107 107 ILE HB H 1 2.12 0.01 . 1 . . . . 108 ILE HB . 17302 1 893 . 1 1 107 107 ILE HG12 H 1 1.59 0.01 . 1 . . . . 108 ILE HG12 . 17302 1 894 . 1 1 107 107 ILE HG13 H 1 1.43 0.01 . 1 . . . . 108 ILE HG13 . 17302 1 895 . 1 1 107 107 ILE HG21 H 1 0.89 0.01 . 1 . . . . 108 ILE MG . 17302 1 896 . 1 1 107 107 ILE HG22 H 1 0.89 0.01 . 1 . . . . 108 ILE MG . 17302 1 897 . 1 1 107 107 ILE HG23 H 1 0.89 0.01 . 1 . . . . 108 ILE MG . 17302 1 898 . 1 1 107 107 ILE HD11 H 1 0.82 0.01 . 1 . . . . 108 ILE MD . 17302 1 899 . 1 1 107 107 ILE HD12 H 1 0.82 0.01 . 1 . . . . 108 ILE MD . 17302 1 900 . 1 1 107 107 ILE HD13 H 1 0.82 0.01 . 1 . . . . 108 ILE MD . 17302 1 901 . 1 1 107 107 ILE N N 15 120.0 0.1 . 1 . . . . 108 ILE N . 17302 1 902 . 1 1 108 108 ILE H H 1 8.86 0.01 . 1 . . . . 109 ILE H . 17302 1 903 . 1 1 108 108 ILE HA H 1 5.15 0.01 . 1 . . . . 109 ILE HA . 17302 1 904 . 1 1 108 108 ILE HB H 1 1.16 0.01 . 1 . . . . 109 ILE HB . 17302 1 905 . 1 1 108 108 ILE HG12 H 1 0.54 0.01 . 1 . . . . 109 ILE HG12 . 17302 1 906 . 1 1 108 108 ILE HG13 H 1 1.00 0.01 . 1 . . . . 109 ILE HG13 . 17302 1 907 . 1 1 108 108 ILE HG21 H 1 0.46 0.01 . 1 . . . . 109 ILE MG . 17302 1 908 . 1 1 108 108 ILE HG22 H 1 0.46 0.01 . 1 . . . . 109 ILE MG . 17302 1 909 . 1 1 108 108 ILE HG23 H 1 0.46 0.01 . 1 . . . . 109 ILE MG . 17302 1 910 . 1 1 108 108 ILE HD11 H 1 0.24 0.01 . 1 . . . . 109 ILE MD . 17302 1 911 . 1 1 108 108 ILE HD12 H 1 0.24 0.01 . 1 . . . . 109 ILE MD . 17302 1 912 . 1 1 108 108 ILE HD13 H 1 0.24 0.01 . 1 . . . . 109 ILE MD . 17302 1 913 . 1 1 108 108 ILE N N 15 126.4 0.1 . 1 . . . . 109 ILE N . 17302 1 914 . 1 1 109 109 THR H H 1 9.04 0.01 . 1 . . . . 110 THR H . 17302 1 915 . 1 1 109 109 THR HA H 1 5.09 0.01 . 1 . . . . 110 THR HA . 17302 1 916 . 1 1 109 109 THR HB H 1 4.00 0.01 . 1 . . . . 110 THR HB . 17302 1 917 . 1 1 109 109 THR HG21 H 1 1.07 0.01 . 1 . . . . 110 THR MG . 17302 1 918 . 1 1 109 109 THR HG22 H 1 1.07 0.01 . 1 . . . . 110 THR MG . 17302 1 919 . 1 1 109 109 THR HG23 H 1 1.07 0.01 . 1 . . . . 110 THR MG . 17302 1 920 . 1 1 109 109 THR N N 15 123.3 0.1 . 1 . . . . 110 THR N . 17302 1 921 . 1 1 110 110 ASN H H 1 9.34 0.01 . 1 . . . . 111 ASN H . 17302 1 922 . 1 1 110 110 ASN HA H 1 5.80 0.01 . 1 . . . . 111 ASN HA . 17302 1 923 . 1 1 110 110 ASN HB2 H 1 2.59 0.01 . 1 . . . . 111 ASN HB2 . 17302 1 924 . 1 1 110 110 ASN HB3 H 1 2.47 0.01 . 1 . . . . 111 ASN HB3 . 17302 1 925 . 1 1 110 110 ASN HD21 H 1 6.24 0.01 . 1 . . . . 111 ASN HD21 . 17302 1 926 . 1 1 110 110 ASN HD22 H 1 7.09 0.01 . 1 . . . . 111 ASN HD22 . 17302 1 927 . 1 1 110 110 ASN N N 15 127.3 0.1 . 1 . . . . 111 ASN N . 17302 1 928 . 1 1 110 110 ASN ND2 N 15 110.2 0.1 . 1 . . . . 111 ASN ND2 . 17302 1 929 . 1 1 111 111 THR H H 1 9.31 0.01 . 1 . . . . 112 THR H . 17302 1 930 . 1 1 111 111 THR HA H 1 4.92 0.01 . 1 . . . . 112 THR HA . 17302 1 931 . 1 1 111 111 THR HB H 1 3.85 0.01 . 1 . . . . 112 THR HB . 17302 1 932 . 1 1 111 111 THR HG21 H 1 0.99 0.01 . 1 . . . . 112 THR MG . 17302 1 933 . 1 1 111 111 THR HG22 H 1 0.99 0.01 . 1 . . . . 112 THR MG . 17302 1 934 . 1 1 111 111 THR HG23 H 1 0.99 0.01 . 1 . . . . 112 THR MG . 17302 1 935 . 1 1 111 111 THR N N 15 122.9 0.1 . 1 . . . . 112 THR N . 17302 1 936 . 1 1 112 112 MET H H 1 9.30 0.01 . 1 . . . . 113 MET H . 17302 1 937 . 1 1 112 112 MET HA H 1 5.52 0.01 . 1 . . . . 113 MET HA . 17302 1 938 . 1 1 112 112 MET HB2 H 1 1.58 0.01 . 1 . . . . 113 MET HB2 . 17302 1 939 . 1 1 112 112 MET HB3 H 1 1.78 0.01 . 1 . . . . 113 MET HB3 . 17302 1 940 . 1 1 112 112 MET HG2 H 1 2.31 0.01 . 1 . . . . 113 MET HG2 . 17302 1 941 . 1 1 112 112 MET HG3 H 1 2.49 0.01 . 1 . . . . 113 MET HG3 . 17302 1 942 . 1 1 112 112 MET HE1 H 1 2.16 0.01 . 9 . . . . 113 MET ME . 17302 1 943 . 1 1 112 112 MET HE2 H 1 2.16 0.01 . 9 . . . . 113 MET ME . 17302 1 944 . 1 1 112 112 MET HE3 H 1 2.16 0.01 . 9 . . . . 113 MET ME . 17302 1 945 . 1 1 112 112 MET N N 15 127.6 0.1 . 1 . . . . 113 MET N . 17302 1 946 . 1 1 113 113 THR H H 1 8.88 0.01 . 1 . . . . 114 THR H . 17302 1 947 . 1 1 113 113 THR HA H 1 5.39 0.01 . 1 . . . . 114 THR HA . 17302 1 948 . 1 1 113 113 THR HB H 1 3.98 0.01 . 1 . . . . 114 THR HB . 17302 1 949 . 1 1 113 113 THR HG21 H 1 1.17 0.01 . 1 . . . . 114 THR MG . 17302 1 950 . 1 1 113 113 THR HG22 H 1 1.17 0.01 . 1 . . . . 114 THR MG . 17302 1 951 . 1 1 113 113 THR HG23 H 1 1.17 0.01 . 1 . . . . 114 THR MG . 17302 1 952 . 1 1 113 113 THR N N 15 118.4 0.1 . 1 . . . . 114 THR N . 17302 1 953 . 1 1 114 114 LEU H H 1 8.89 0.01 . 1 . . . . 115 LEU H . 17302 1 954 . 1 1 114 114 LEU HA H 1 4.74 0.01 . 1 . . . . 115 LEU HA . 17302 1 955 . 1 1 114 114 LEU HB2 H 1 1.74 0.01 . 1 . . . . 115 LEU HB2 . 17302 1 956 . 1 1 114 114 LEU HB3 H 1 1.35 0.01 . 1 . . . . 115 LEU HB3 . 17302 1 957 . 1 1 114 114 LEU HG H 1 1.42 0.01 . 1 . . . . 115 LEU HG . 17302 1 958 . 1 1 114 114 LEU HD11 H 1 0.69 0.01 . 1 . . . . 115 LEU MD1 . 17302 1 959 . 1 1 114 114 LEU HD12 H 1 0.69 0.01 . 1 . . . . 115 LEU MD1 . 17302 1 960 . 1 1 114 114 LEU HD13 H 1 0.69 0.01 . 1 . . . . 115 LEU MD1 . 17302 1 961 . 1 1 114 114 LEU HD21 H 1 0.55 0.01 . 1 . . . . 115 LEU MD2 . 17302 1 962 . 1 1 114 114 LEU HD22 H 1 0.55 0.01 . 1 . . . . 115 LEU MD2 . 17302 1 963 . 1 1 114 114 LEU HD23 H 1 0.55 0.01 . 1 . . . . 115 LEU MD2 . 17302 1 964 . 1 1 114 114 LEU N N 15 130.1 0.1 . 1 . . . . 115 LEU N . 17302 1 965 . 1 1 115 115 GLY H H 1 9.25 0.01 . 1 . . . . 116 GLY H . 17302 1 966 . 1 1 115 115 GLY HA2 H 1 3.63 0.01 . 1 . . . . 116 GLY HA2 . 17302 1 967 . 1 1 115 115 GLY HA3 H 1 3.94 0.01 . 1 . . . . 116 GLY HA3 . 17302 1 968 . 1 1 115 115 GLY N N 15 118.0 0.1 . 1 . . . . 116 GLY N . 17302 1 969 . 1 1 116 116 ASP H H 1 8.69 0.01 . 1 . . . . 117 ASP H . 17302 1 970 . 1 1 116 116 ASP HA H 1 4.62 0.01 . 1 . . . . 117 ASP HA . 17302 1 971 . 1 1 116 116 ASP HB2 H 1 2.70 0.01 . 1 . . . . 117 ASP HB2 . 17302 1 972 . 1 1 116 116 ASP HB3 H 1 2.76 0.01 . 1 . . . . 117 ASP HB3 . 17302 1 973 . 1 1 116 116 ASP N N 15 126.4 0.1 . 1 . . . . 117 ASP N . 17302 1 974 . 1 1 117 117 ILE H H 1 8.43 0.01 . 1 . . . . 118 ILE H . 17302 1 975 . 1 1 117 117 ILE HA H 1 4.03 0.01 . 1 . . . . 118 ILE HA . 17302 1 976 . 1 1 117 117 ILE HB H 1 2.29 0.01 . 1 . . . . 118 ILE HB . 17302 1 977 . 1 1 117 117 ILE HG12 H 1 1.04 0.01 . 1 . . . . 118 ILE HG12 . 17302 1 978 . 1 1 117 117 ILE HG13 H 1 1.73 0.01 . 1 . . . . 118 ILE HG13 . 17302 1 979 . 1 1 117 117 ILE HG21 H 1 0.98 0.01 . 1 . . . . 118 ILE MG . 17302 1 980 . 1 1 117 117 ILE HG22 H 1 0.98 0.01 . 1 . . . . 118 ILE MG . 17302 1 981 . 1 1 117 117 ILE HG23 H 1 0.98 0.01 . 1 . . . . 118 ILE MG . 17302 1 982 . 1 1 117 117 ILE HD11 H 1 0.81 0.01 . 1 . . . . 118 ILE MD . 17302 1 983 . 1 1 117 117 ILE HD12 H 1 0.81 0.01 . 1 . . . . 118 ILE MD . 17302 1 984 . 1 1 117 117 ILE HD13 H 1 0.81 0.01 . 1 . . . . 118 ILE MD . 17302 1 985 . 1 1 117 117 ILE N N 15 122.8 0.1 . 1 . . . . 118 ILE N . 17302 1 986 . 1 1 118 118 VAL H H 1 8.40 0.01 . 1 . . . . 119 VAL H . 17302 1 987 . 1 1 118 118 VAL HA H 1 4.60 0.01 . 1 . . . . 119 VAL HA . 17302 1 988 . 1 1 118 118 VAL HB H 1 2.02 0.01 . 1 . . . . 119 VAL HB . 17302 1 989 . 1 1 118 118 VAL HG11 H 1 0.75 0.01 . 1 . . . . 119 VAL MG1 . 17302 1 990 . 1 1 118 118 VAL HG12 H 1 0.75 0.01 . 1 . . . . 119 VAL MG1 . 17302 1 991 . 1 1 118 118 VAL HG13 H 1 0.75 0.01 . 1 . . . . 119 VAL MG1 . 17302 1 992 . 1 1 118 118 VAL HG21 H 1 0.89 0.01 . 1 . . . . 119 VAL MG2 . 17302 1 993 . 1 1 118 118 VAL HG22 H 1 0.89 0.01 . 1 . . . . 119 VAL MG2 . 17302 1 994 . 1 1 118 118 VAL HG23 H 1 0.89 0.01 . 1 . . . . 119 VAL MG2 . 17302 1 995 . 1 1 118 118 VAL N N 15 127.5 0.1 . 1 . . . . 119 VAL N . 17302 1 996 . 1 1 119 119 PHE H H 1 9.35 0.01 . 1 . . . . 120 PHE H . 17302 1 997 . 1 1 119 119 PHE HA H 1 5.53 0.01 . 1 . . . . 120 PHE HA . 17302 1 998 . 1 1 119 119 PHE HB2 H 1 2.78 0.01 . 1 . . . . 120 PHE HB2 . 17302 1 999 . 1 1 119 119 PHE HB3 H 1 2.43 0.01 . 1 . . . . 120 PHE HB3 . 17302 1 1000 . 1 1 119 119 PHE HD1 H 1 6.82 0.01 . 1 . . . . 120 PHE HD1 . 17302 1 1001 . 1 1 119 119 PHE HD2 H 1 6.82 0.01 . 1 . . . . 120 PHE HD2 . 17302 1 1002 . 1 1 119 119 PHE HE1 H 1 7.10 0.01 . 1 . . . . 120 PHE HE1 . 17302 1 1003 . 1 1 119 119 PHE HE2 H 1 7.10 0.01 . 1 . . . . 120 PHE HE2 . 17302 1 1004 . 1 1 119 119 PHE HZ H 1 7.25 0.01 . 1 . . . . 120 PHE HZ . 17302 1 1005 . 1 1 119 119 PHE N N 15 131.6 0.1 . 1 . . . . 120 PHE N . 17302 1 1006 . 1 1 120 120 LYS H H 1 8.16 0.01 . 1 . . . . 121 LYS H . 17302 1 1007 . 1 1 120 120 LYS HA H 1 5.19 0.01 . 1 . . . . 121 LYS HA . 17302 1 1008 . 1 1 120 120 LYS HB2 H 1 1.60 0.01 . 1 . . . . 121 LYS HB2 . 17302 1 1009 . 1 1 120 120 LYS HB3 H 1 1.60 0.01 . 1 . . . . 121 LYS HB3 . 17302 1 1010 . 1 1 120 120 LYS HG2 H 1 1.47 0.01 . 1 . . . . 121 LYS HG2 . 17302 1 1011 . 1 1 120 120 LYS HG3 H 1 1.17 0.01 . 1 . . . . 121 LYS HG3 . 17302 1 1012 . 1 1 120 120 LYS HD2 H 1 1.56 0.01 . 1 . . . . 121 LYS HD2 . 17302 1 1013 . 1 1 120 120 LYS HD3 H 1 1.56 0.01 . 1 . . . . 121 LYS HD3 . 17302 1 1014 . 1 1 120 120 LYS HE2 H 1 2.78 0.01 . 1 . . . . 121 LYS HE2 . 17302 1 1015 . 1 1 120 120 LYS HE3 H 1 2.78 0.01 . 1 . . . . 121 LYS HE3 . 17302 1 1016 . 1 1 120 120 LYS N N 15 129.6 0.1 . 1 . . . . 121 LYS N . 17302 1 1017 . 1 1 121 121 ARG H H 1 8.76 0.01 . 1 . . . . 122 ARG H . 17302 1 1018 . 1 1 121 121 ARG HA H 1 4.84 0.01 . 1 . . . . 122 ARG HA . 17302 1 1019 . 1 1 121 121 ARG HB2 H 1 1.64 0.01 . 1 . . . . 122 ARG HB2 . 17302 1 1020 . 1 1 121 121 ARG HB3 H 1 1.79 0.01 . 9 . . . . 122 ARG HB3 . 17302 1 1021 . 1 1 121 121 ARG HG2 H 1 1.57 0.01 . 9 . . . . 122 ARG HG2 . 17302 1 1022 . 1 1 121 121 ARG HG3 H 1 1.29 0.01 . 1 . . . . 122 ARG HG3 . 17302 1 1023 . 1 1 121 121 ARG HD2 H 1 3.39 0.01 . 2 . . . . 122 ARG HD2 . 17302 1 1024 . 1 1 121 121 ARG HD3 H 1 3.05 0.01 . 2 . . . . 122 ARG HD3 . 17302 1 1025 . 1 1 121 121 ARG HE H 1 7.50 0.01 . 1 . . . . 122 ARG HE . 17302 1 1026 . 1 1 121 121 ARG N N 15 123.7 0.1 . 1 . . . . 122 ARG N . 17302 1 1027 . 1 1 121 121 ARG NE N 15 81.8 0.1 . 1 . . . . 122 ARG NE . 17302 1 1028 . 1 1 122 122 ILE H H 1 8.82 0.01 . 1 . . . . 123 ILE H . 17302 1 1029 . 1 1 122 122 ILE HA H 1 4.84 0.01 . 1 . . . . 123 ILE HA . 17302 1 1030 . 1 1 122 122 ILE HB H 1 1.88 0.01 . 1 . . . . 123 ILE HB . 17302 1 1031 . 1 1 122 122 ILE HG12 H 1 1.39 0.01 . 9 . . . . 123 ILE HG12 . 17302 1 1032 . 1 1 122 122 ILE HG13 H 1 1.39 0.01 . 9 . . . . 123 ILE HG13 . 17302 1 1033 . 1 1 122 122 ILE HG21 H 1 0.87 0.01 . 1 . . . . 123 ILE MG . 17302 1 1034 . 1 1 122 122 ILE HG22 H 1 0.87 0.01 . 1 . . . . 123 ILE MG . 17302 1 1035 . 1 1 122 122 ILE HG23 H 1 0.87 0.01 . 1 . . . . 123 ILE MG . 17302 1 1036 . 1 1 122 122 ILE HD11 H 1 0.79 0.01 . 9 . . . . 123 ILE MD . 17302 1 1037 . 1 1 122 122 ILE HD12 H 1 0.79 0.01 . 9 . . . . 123 ILE MD . 17302 1 1038 . 1 1 122 122 ILE HD13 H 1 0.79 0.01 . 9 . . . . 123 ILE MD . 17302 1 1039 . 1 1 122 122 ILE N N 15 126.1 0.1 . 1 . . . . 123 ILE N . 17302 1 1040 . 1 1 123 123 SER H H 1 9.36 0.01 . 1 . . . . 124 SER H . 17302 1 1041 . 1 1 123 123 SER HA H 1 5.46 0.01 . 1 . . . . 124 SER HA . 17302 1 1042 . 1 1 123 123 SER HB2 H 1 3.56 0.01 . 1 . . . . 124 SER HB2 . 17302 1 1043 . 1 1 123 123 SER HB3 H 1 3.47 0.01 . 1 . . . . 124 SER HB3 . 17302 1 1044 . 1 1 123 123 SER N N 15 122.8 0.1 . 1 . . . . 124 SER N . 17302 1 1045 . 1 1 124 124 LYS H H 1 8.68 0.01 . 1 . . . . 125 LYS H . 17302 1 1046 . 1 1 124 124 LYS HA H 1 5.53 0.01 . 1 . . . . 125 LYS HA . 17302 1 1047 . 1 1 124 124 LYS HB2 H 1 1.86 0.01 . 1 . . . . 125 LYS HB2 . 17302 1 1048 . 1 1 124 124 LYS HB3 H 1 1.60 0.01 . 1 . . . . 125 LYS HB3 . 17302 1 1049 . 1 1 124 124 LYS HG2 H 1 1.69 0.01 . 2 . . . . 125 LYS HG2 . 17302 1 1050 . 1 1 124 124 LYS HG3 H 1 1.40 0.01 . 2 . . . . 125 LYS HG3 . 17302 1 1051 . 1 1 124 124 LYS HD2 H 1 1.65 0.01 . 1 . . . . 125 LYS HD2 . 17302 1 1052 . 1 1 124 124 LYS HD3 H 1 1.65 0.01 . 1 . . . . 125 LYS HD3 . 17302 1 1053 . 1 1 124 124 LYS HE2 H 1 3.03 0.01 . 1 . . . . 125 LYS HE2 . 17302 1 1054 . 1 1 124 124 LYS HE3 H 1 3.03 0.01 . 1 . . . . 125 LYS HE3 . 17302 1 1055 . 1 1 124 124 LYS N N 15 123.9 0.1 . 1 . . . . 125 LYS N . 17302 1 1056 . 1 1 125 125 ARG H H 1 9.18 0.01 . 1 . . . . 126 ARG H . 17302 1 1057 . 1 1 125 125 ARG HA H 1 4.17 0.01 . 1 . . . . 126 ARG HA . 17302 1 1058 . 1 1 125 125 ARG HB2 H 1 1.65 0.01 . 1 . . . . 126 ARG HB2 . 17302 1 1059 . 1 1 125 125 ARG HB3 H 1 1.65 0.01 . 1 . . . . 126 ARG HB3 . 17302 1 1060 . 1 1 125 125 ARG HG2 H 1 1.17 0.01 . 1 . . . . 126 ARG HG2 . 17302 1 1061 . 1 1 125 125 ARG HG3 H 1 1.17 0.01 . 1 . . . . 126 ARG HG3 . 17302 1 1062 . 1 1 125 125 ARG HD2 H 1 3.22 0.01 . 2 . . . . 126 ARG HD2 . 17302 1 1063 . 1 1 125 125 ARG HD3 H 1 3.08 0.01 . 2 . . . . 126 ARG HD3 . 17302 1 1064 . 1 1 125 125 ARG HE H 1 7.09 0.01 . 1 . . . . 126 ARG HE . 17302 1 1065 . 1 1 125 125 ARG N N 15 129.8 0.1 . 1 . . . . 126 ARG N . 17302 1 1066 . 1 1 125 125 ARG NE N 15 84.7 0.1 . 1 . . . . 126 ARG NE . 17302 1 1067 . 1 1 126 126 ILE H H 1 8.48 0.01 . 1 . . . . 127 ILE H . 17302 1 1068 . 1 1 126 126 ILE HA H 1 4.16 0.01 . 1 . . . . 127 ILE HA . 17302 1 1069 . 1 1 126 126 ILE HB H 1 1.83 0.01 . 1 . . . . 127 ILE HB . 17302 1 1070 . 1 1 126 126 ILE HG12 H 1 1.33 0.01 . 1 . . . . 127 ILE HG12 . 17302 1 1071 . 1 1 126 126 ILE HG13 H 1 1.33 0.01 . 1 . . . . 127 ILE HG13 . 17302 1 1072 . 1 1 126 126 ILE HG21 H 1 0.95 0.01 . 1 . . . . 127 ILE MG . 17302 1 1073 . 1 1 126 126 ILE HG22 H 1 0.95 0.01 . 1 . . . . 127 ILE MG . 17302 1 1074 . 1 1 126 126 ILE HG23 H 1 0.95 0.01 . 1 . . . . 127 ILE MG . 17302 1 1075 . 1 1 126 126 ILE HD11 H 1 0.84 0.01 . 1 . . . . 127 ILE MD . 17302 1 1076 . 1 1 126 126 ILE HD12 H 1 0.84 0.01 . 1 . . . . 127 ILE MD . 17302 1 1077 . 1 1 126 126 ILE HD13 H 1 0.84 0.01 . 1 . . . . 127 ILE MD . 17302 1 1078 . 1 1 126 126 ILE N N 15 130.4 0.1 . 1 . . . . 127 ILE N . 17302 1 stop_ save_