data_15960 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15960 _Entry.Title ; Solution structure of human acidic fibroblast growth factor in complex with anti-angiogenic drug inositol hexaphosphate (IP6) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-09-22 _Entry.Accession_date 2008-09-22 _Entry.Last_release_date 2011-06-01 _Entry.Original_release_date 2011-06-01 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _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 Sriramoju Kumar . M. . 15960 2 Sepuru Mohan . K. . 15960 3 Yu Chin . . . 15960 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 . 'not applicable' 'not applicable' . 15960 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Acidic Fibroblast growth factor' . 15960 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15960 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 357 15960 '15N chemical shifts' 130 15960 '1H chemical shifts' 676 15960 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 . . 2011-06-01 2008-09-24 original author . 15960 stop_ save_ ############### # Citations # ############### save_reference_1 _Citation.Sf_category citations _Citation.Sf_framecode reference_1 _Citation.Entry_ID 15960 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21077672 _Citation.Full_citation . _Citation.Title 'Molecular level interaction of the human acidic fibroblast growth factor with the antiangiogenic agent, inositol hexaphosphate .' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume 49 _Citation.Journal_issue 50 _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 10756 _Citation.Page_last 10764 _Citation.Year 2010 _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 Sriramoju Kumar . M. . 15960 1 2 Han-Min Wang . . . 15960 1 3 Sepuru Mohan . K. . 15960 1 4 Ruey-Hwang Chou . . . 15960 1 5 Chin Yu . . . 15960 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15960 _Assembly.ID 1 _Assembly.Name 'FGF-1/IHP complex' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 FGF-1 1 $FGF-1 A . yes native no no . . . 15960 1 2 'INOSITOL HEXAKISPHOSPHATE' 2 $IHP B . no native no no . . . 15960 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_FGF-1 _Entity.Sf_category entity _Entity.Sf_framecode FGF-1 _Entity.Entry_ID 15960 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name FGF-1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; YKKPKLLYCSNGGHFLRILP DGTVDGTRDRSDQHIQLQLS AESVGEVYIKSTETGQYLAM DTDGLLYGSQTPNEECLFLE RLEENHYNTYISKKHAEKNW FVGLKKNGSCKRGPRTHYGQ KAILFLPLPVSSD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 133 _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 15118.163 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 15783 . FGF-1 . . . . . 100.00 133 100.00 100.00 2.22e-93 . . . . 15960 1 2 no BMRB 16493 . aFGF . . . . . 99.25 132 100.00 100.00 2.02e-92 . . . . 15960 1 3 no BMRB 16494 . aFGF . . . . . 99.25 132 100.00 100.00 2.02e-92 . . . . 15960 1 4 no BMRB 16502 . aFGF . . . . . 99.25 132 100.00 100.00 2.02e-92 . . . . 15960 1 5 no BMRB 17464 . FGF . . . . . 99.25 132 100.00 100.00 2.02e-92 . . . . 15960 1 6 no BMRB 17674 . FGF1 . . . . . 97.74 130 100.00 100.00 4.25e-91 . . . . 15960 1 7 no PDB 1AXM . "Heparin-Linked Biologically-Active Dimer Of Fibroblast Growth Factor" . . . . . 100.00 135 99.25 99.25 3.56e-92 . . . . 15960 1 8 no PDB 1DJS . "Ligand-binding Portion Of Fibroblast Growth Factor Receptor 2 In Complex With Fgf1" . . . . . 100.00 135 99.25 99.25 3.56e-92 . . . . 15960 1 9 no PDB 1DZC . "High Resolution Structure Of Acidic Fibroblast Growth Factor. Mutant Fgf-4-ala-(23-154), 24 Nmr Structures" . . . . . 96.24 131 100.00 100.00 1.05e-89 . . . . 15960 1 10 no PDB 1DZD . "High Resolution Structure Of Acidic Fibroblast Growth Factor (27-154), 24 Nmr Structures" . . . . . 95.49 127 100.00 100.00 1.07e-88 . . . . 15960 1 11 no PDB 1E0O . "Crystal Structure Of A Ternary Fgf1-Fgfr2-Heparin Complex" . . . . . 100.00 140 100.00 100.00 7.24e-93 . . . . 15960 1 12 no PDB 1EVT . "Crystal Structure Of Fgf1 In Complex With The Extracellular Ligand Binding Domain Of Fgf Receptor 1 (Fgfr1)" . . . . . 100.00 134 100.00 100.00 2.29e-93 . . . . 15960 1 13 no PDB 1HKN . "A Complex Between Acidic Fibroblast Growth Factor And 5- Amino-2-Naphthalenesulfonate" . . . . . 100.00 139 100.00 100.00 6.56e-93 . . . . 15960 1 14 no PDB 1JQZ . "Human Acidic Fibroblast Growth Factor. 141 Amino Acid Form With Amino Terminal His Tag." . . . . . 100.00 146 100.00 100.00 1.15e-92 . . . . 15960 1 15 no PDB 1JT3 . "Human Acidic Fibroblast Growth Factor. 141 Amino Acid Form With Amino Histidine Tag And Leu 73 Replaced By Val (L73v)" . . . . . 100.00 146 99.25 100.00 2.81e-92 . . . . 15960 1 16 no PDB 1JT4 . "Human Acidic Fibroblast Growth Factor. 141 Amino Acid Form With Amino Terminal His Tag And Val 109 Replaced By Leu (v109l)" . . . . . 100.00 146 99.25 100.00 3.95e-92 . . . . 15960 1 17 no PDB 1JT5 . "Human Acidic Fibroblast Growth Factor. 141 Amino Acid Form With Amino Terminal His Tag And Leu 73 Replaced By Val And Val 109 R" . . . . . 100.00 146 98.50 100.00 1.01e-91 . . . . 15960 1 18 no PDB 1JT7 . "Human Acidic Fibroblast Growth Factor. 141 Amino Acid Form With Amino Terminal His Tag And Leu 44 Replaced By Phe And Leu 73 Re" . . . . . 100.00 146 97.74 99.25 2.98e-91 . . . . 15960 1 19 no PDB 1JTC . "Human Acidic Fibroblast Growth Factor. 141 Amino Acid Form With Amino Terminal His Tag And Leu 44 Replaced By Phe (L44f)" . . . . . 100.00 146 99.25 99.25 3.35e-92 . . . . 15960 1 20 no PDB 1JY0 . "Human Acidic Fibroblast Growth Factor. 141 Amino Acid Form With Amino Terminal His Tag And Cys 117 Replaced With Val (C117v)" . . . . . 100.00 146 99.25 99.25 1.24e-91 . . . . 15960 1 21 no PDB 1K5U . "Human Acidic Fibroblast Growth Factor. 141 Amino Acid Form With Amino Terminal His Tag With His93 Replaced By Gly (H93g)" . . . . . 100.00 146 99.25 99.25 4.17e-91 . . . . 15960 1 22 no PDB 1K5V . "Human Acidic Fibroblast Growth Factor. 141 Amino Acid Form With Amino Terminal His Tag With Asn106 Replaced By Gly (N106g)" . . . . . 100.00 146 99.25 99.25 1.13e-91 . . . . 15960 1 23 no PDB 1M16 . "Human Acidic Fibroblast Growth Factor. 141 Amino Acid Form With Amino Terminal His Tag And Leu 44 Replaced With Phe (L44f), Leu" . . . . . 100.00 146 96.99 98.50 3.59e-90 . . . . 15960 1 24 no PDB 1P63 . "Human Acidic Fibroblast Growth Factor. 140 Amino Acid Form With Amino Terminal His Tag And Leu111 Replaced With Ile (L111i)" . . . . . 100.00 144 99.25 100.00 2.07e-92 . . . . 15960 1 25 no PDB 1PZZ . "Crystal Structure Of Fgf-1, V51n Mutant" . . . . . 100.00 146 99.25 99.25 1.46e-91 . . . . 15960 1 26 no PDB 1Q03 . "Crystal Structure Of Fgf-1, S50gV51G MUTANT" . . . . . 100.00 146 98.50 98.50 1.06e-90 . . . . 15960 1 27 no PDB 1Q04 . "Crystal Structure Of Fgf-1, S50e/v51n" . . . . . 100.00 146 98.50 98.50 6.32e-91 . . . . 15960 1 28 no PDB 1RG8 . "Human Acidic Fibroblast Growth Factor (Hafgf-1) At 1.10 Angstrom Resolution (140 Amino Acid Form)" . . . . . 100.00 146 100.00 100.00 1.15e-92 . . . . 15960 1 29 no PDB 1RML . "Nmr Study Of Acid Fibroblast Growth Factor Bound To 1,3,6- Naphthalene Trisulphonate, 26 Structures" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 30 no PDB 1RY7 . "Crystal Structure Of The 3 Ig Form Of Fgfr3c In Complex With Fgf1" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 31 no PDB 1YTO . "Crystal Structure Of Gly19 Deletion Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 145 99.25 99.25 3.79e-90 . . . . 15960 1 32 no PDB 1Z2V . "Crystal Structure Of Glu60 Deletion Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 145 99.25 99.25 3.96e-90 . . . . 15960 1 33 no PDB 1Z4S . "Crystal Structure Of Gly19 And Glu60 Deletion Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 144 98.50 98.50 1.59e-87 . . . . 15960 1 34 no PDB 2AFG . "2.0 Angstrom X-Ray Structure Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 140 100.00 100.00 7.24e-93 . . . . 15960 1 35 no PDB 2AQZ . "Crystal Structure Of Fgf-1, S17tN18TG19 DELETION MUTANT" . . . . . 100.00 145 97.74 98.50 7.63e-89 . . . . 15960 1 36 no PDB 2AXM . "Heparin-Linked Biologically-Active Dimer Of Fibroblast Growth Factor" . . . . . 100.00 135 100.00 100.00 3.52e-93 . . . . 15960 1 37 no PDB 2ERM . "Solution Structure Of A Biologically Active Human Fgf-1 Monomer, Complexed To A Hexasaccharide Heparin-Analogue" . . . . . 100.00 139 100.00 100.00 6.56e-93 . . . . 15960 1 38 no PDB 2HW9 . "Crystal Structure Of Lys12cysCYS117VAL MUTANT OF HUMAN Acidic Fibroblast Growth Factor At 1.60 Angstrom Resolution" . . . . . 100.00 146 98.50 98.50 4.56e-90 . . . . 15960 1 39 no PDB 2HWA . "Crystal Structure Of Lys12thrCYS117VAL MUTANT OF HUMAN Acidic Fibroblast Growth Factor At 1.65 Angstrom Resolution" . . . . . 100.00 146 98.50 98.50 7.45e-91 . . . . 15960 1 40 no PDB 2HWM . "Crystal Structure Of Lys12valCYS117VAL MUTANT OF HUMAN Acidic Fibroblast Growth Factor At 1.60 Angstrom Resolution" . . . . . 100.00 146 98.50 98.50 1.40e-90 . . . . 15960 1 41 no PDB 2HZ9 . "Crystal Structure Of Lys12valASN95VALCYS117VAL MUTANT OF Human Acidic Fibroblast Growth Factor At 1.70 Angstrom Resolution" . . . . . 100.00 146 97.74 97.74 2.06e-89 . . . . 15960 1 42 no PDB 2J3P . "Crystal Structure Of Rat Fgf1 At 1.4 A" . . . . . 100.00 134 96.99 97.74 1.34e-90 . . . . 15960 1 43 no PDB 2K43 . "Acidic Fibroblast Growth Factor Solution Structure In The Fgf-1-C2a Binary Complex: Key Component In The Fibroblast Growthfacto" . . . . . 100.00 133 100.00 100.00 2.22e-93 . . . . 15960 1 44 no PDB 2K4A . "Fgf-1-C2a Binary Complex Structure: A Key Component In The Fibroblast Growthfactor Non-Classical Pathway" . . . . . 100.00 133 100.00 100.00 2.22e-93 . . . . 15960 1 45 no PDB 2K8R . "Solution Structure Of Human Acidic Fibroblast Growth Factor In Complex With Anti-Angiogenic Drug Inositol Hexaphosphate (Ip6)" . . . . . 100.00 133 100.00 100.00 2.22e-93 . . . . 15960 1 46 no PDB 2KI4 . "Fgf1-S100a13 Complex Structure: Key Component In Non-Classic Way Of Fgf1" . . . . . 100.00 133 100.00 100.00 2.22e-93 . . . . 15960 1 47 no PDB 2KI6 . "The Fgf1-S100a13-C2a Hetero-Hexameric Complex Structure: A C In The Non-Classical Pathway For Fgf1 Secretion" . . . . . 100.00 133 100.00 100.00 2.22e-93 . . . . 15960 1 48 no PDB 2NTD . "Human Fibroblast Growth Factor-1 (140 Amino Acid Form) With Cys117valPRO134CYS MUTATIONS" . . . . . 100.00 146 98.50 98.50 5.99e-90 . . . . 15960 1 49 no PDB 2Q9X . "Crystal Structure Of Highly Stable Mutant Q40p/s47i/h93g Of Human Fibroblast Growth Factor-1" . . . . . 100.00 140 97.74 97.74 1.56e-89 . . . . 15960 1 50 no PDB 2RQ9 . "Solution Structure Of Human Acidic Fibroblast Growth Factor (Afgf) In The Presence Of A Protein Stabilizer Ndsb-New" . . . . . 100.00 143 100.00 100.00 3.37e-93 . . . . 15960 1 51 no PDB 2UUS . "Crystal Structure Of The Rat Fgf1-sucrose Octasulfate (sos) Complex" . . . . . 98.50 132 96.95 97.71 4.08e-89 . . . . 15960 1 52 no PDB 3B9U . "Crystal Structure Of L26nD28NH93G MUTANT OF HUMAN ACIDIC Fibroblast Growth Factor" . . . . . 100.00 146 97.74 98.50 2.15e-89 . . . . 15960 1 53 no PDB 3BA4 . "Crystal Structure Of L26d Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 1.70e-91 . . . . 15960 1 54 no PDB 3BA5 . "Crystal Structure Of D28a Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 9.45e-92 . . . . 15960 1 55 no PDB 3BA7 . "Crystal Structure Of L26nD28A MUTANT OF HUMAN ACIDIC Fibroblast Growth Factor" . . . . . 100.00 146 98.50 98.50 1.47e-90 . . . . 15960 1 56 no PDB 3BAD . "Crystal Structure Of D70aH93G MUTANT OF HUMAN ACIDIC Fibroblast Growth Factor" . . . . . 100.00 146 98.50 98.50 4.27e-90 . . . . 15960 1 57 no PDB 3BAG . "Crystal Structure Of K112nN114A MUTANT OF HUMAN ACIDIC Fibroblast Growth Factor" . . . . . 100.00 146 98.50 98.50 5.37e-91 . . . . 15960 1 58 no PDB 3BAH . "Crystal Structure Of K112n Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 5.07e-92 . . . . 15960 1 59 no PDB 3BAO . "Crystal Structure Of L26n Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 1.30e-91 . . . . 15960 1 60 no PDB 3BAQ . "Crystal Structure Of L26a Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 5.07e-92 . . . . 15960 1 61 no PDB 3BAU . "Crystal Structure Of K12vL26DD28A MUTANT OF HUMAN ACIDIC Fibroblast Growth Factor" . . . . . 100.00 146 97.74 97.74 1.47e-89 . . . . 15960 1 62 no PDB 3BAV . "Crystal Structure Of L26aD28N MUTANT OF HUMAN ACIDIC Fibroblast Growth Factor" . . . . . 100.00 146 98.50 99.25 2.44e-91 . . . . 15960 1 63 no PDB 3BB2 . "Crystal Structure Of L26dD28N MUTANT OF HUMAN ACIDIC Fibroblast Growth Factor" . . . . . 100.00 146 98.50 99.25 7.05e-91 . . . . 15960 1 64 no PDB 3CQA . "Crystal Structure Of Human Fibroblast Growth Factor-1 With Mutations Glu81ala And Lys101ala" . . . . . 100.00 144 98.50 98.50 2.17e-91 . . . . 15960 1 65 no PDB 3CRG . "Crystal Structure Of Human Fibroblast Growth Factor-1 With Mutations Glu81ala, Glu82asn And Lys101ala" . . . . . 100.00 146 97.74 97.74 1.69e-90 . . . . 15960 1 66 no PDB 3CRH . "Crystal Structure Of Human Fibroblast Growth Factor-1 With Mutations Glu81ser And Lys101ala" . . . . . 100.00 146 98.50 98.50 2.98e-91 . . . . 15960 1 67 no PDB 3CRI . "Crystal Structure Of Human Fibroblast Growth Factor-1 With Mutations Glu81ser, Glu82asn And Lys101ala" . . . . . 100.00 146 97.74 97.74 1.53e-90 . . . . 15960 1 68 no PDB 3CU1 . "Crystal Structure Of 2:2:2 Fgfr2d2:fgf1:sos Complex" . . . . . 97.74 131 100.00 100.00 4.95e-91 . . . . 15960 1 69 no PDB 3FGM . "Crystal Structure Of L44fC83TC117VF132W MUTANT OF HUMAN Acidic Fibroblast Growth Factor" . . . . . 100.00 146 96.99 97.74 4.57e-89 . . . . 15960 1 70 no PDB 3FJ8 . "Crystal Structure Of C117i Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 1.60e-91 . . . . 15960 1 71 no PDB 3FJ9 . "Crystal Structure Of F85w Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 100.00 8.47e-92 . . . . 15960 1 72 no PDB 3FJA . "Crystal Structure Of F132w Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 100.00 8.47e-92 . . . . 15960 1 73 no PDB 3FJB . "Crystal Structure Of V31i Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 100.00 1.88e-92 . . . . 15960 1 74 no PDB 3FJC . "Crystal Structure Of L44w Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 9.25e-92 . . . . 15960 1 75 no PDB 3FJD . "Crystal Structure Of L44fF132W MUTANT OF HUMAN ACIDIC Fibroblast Growth Factor" . . . . . 100.00 146 98.50 99.25 2.82e-91 . . . . 15960 1 76 no PDB 3FJE . "Crystal Structure Of C83s Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 1.31e-91 . . . . 15960 1 77 no PDB 3FJF . "Crystal Structure Of C83t Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 1.37e-91 . . . . 15960 1 78 no PDB 3FJH . "Crystal Structure Of C83a Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 9.45e-92 . . . . 15960 1 79 no PDB 3FJI . "Crystal Structure Of K12vC83IC117V MUTANT OF HUMAN ACIDIC Fibroblast Growth Factor" . . . . . 100.00 146 97.74 97.74 1.48e-89 . . . . 15960 1 80 no PDB 3FJJ . "Crystal Structure Of C83v Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 1.24e-91 . . . . 15960 1 81 no PDB 3FJK . "Crystal Structure Of A66c Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 1.05e-91 . . . . 15960 1 82 no PDB 3HAL . "Crystal Structure Of Rabbit Acidic Fibroblast Growth Factor" . . . . . 100.00 146 97.74 98.50 2.45e-90 . . . . 15960 1 83 no PDB 3HOM . "Crystal Structure Of Oxidized A66c Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 1.05e-91 . . . . 15960 1 84 no PDB 3JUT . "Acidic Fibroblast Growth Factor (Fgf-1) Complexed With Gentisic Acid" . . . . . 97.74 130 100.00 100.00 7.50e-91 . . . . 15960 1 85 no PDB 3K1X . "Acidic Fibroblast Growth Factor (Fgf-1) Complexed With Dobes" . . . . . 97.74 130 100.00 100.00 7.50e-91 . . . . 15960 1 86 no PDB 3OJ2 . "Crystal Structure Of Fgf1 Complexed With The Ectodomain Of Fgfr2b Harboring The A172f Pfeiffer Syndrome Mutation" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 87 no PDB 3OJM . "Crystal Structure Of Fgf1 Complexed With The Ectodomain Of Fgfr2b Harboring P253r Apert Mutation" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 88 no PDB 3OJV . "Crystal Structure Of Fgf1 Complexed With The Ectodomain Of Fgfr1c Exhibiting An Ordered Ligand Specificity-Determining Betac'-B" . . . . . 100.00 136 100.00 100.00 2.62e-93 . . . . 15960 1 89 no PDB 3UD7 . "Crystal Structure Analysis Of Fgf1-disaccharide(ni21) Complexes" . . . . . 100.00 141 100.00 100.00 5.11e-93 . . . . 15960 1 90 no PDB 3UD8 . "Crystal Structure Analysis Of Fgf1-disaccharide(ni22) Complex" . . . . . 100.00 141 100.00 100.00 5.11e-93 . . . . 15960 1 91 no PDB 3UD9 . "Crystal Structure Analysis Of Fgf1-disaccharide(ni23) Complex" . . . . . 100.00 141 100.00 100.00 5.11e-93 . . . . 15960 1 92 no PDB 3UDA . "Crystal Structure Analysis Of Fgf1-disaccharide(ni24) Complex" . . . . . 100.00 141 100.00 100.00 5.11e-93 . . . . 15960 1 93 no PDB 4J23 . "Low Resolution Crystal Structure Of The Fgfr2d2d3/fgf1/sr128545 Complex" . . . . . 100.00 138 100.00 100.00 4.06e-93 . . . . 15960 1 94 no PDB 4Q91 . "Crystal Structure Of C16a/k12v/c117v/p134v Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 96.99 96.99 1.62e-88 . . . . 15960 1 95 no PDB 4Q9G . "Crystal Structure Of K12v/c16s/c117v/p134v Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 96.99 96.99 2.20e-88 . . . . 15960 1 96 no PDB 4Q9P . "Crystal Structure Of C16t/k12v/c117v/p134v Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 96.99 96.99 2.15e-88 . . . . 15960 1 97 no PDB 4QAL . "Crystal Structure Of C117a Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 9.45e-92 . . . . 15960 1 98 no PDB 4QBC . "Crystal Structure Of C117t Mutant Of Human Acidic Fibroblast Growth Factor In Sodium Formate Buffer" . . . . . 100.00 146 99.25 99.25 1.37e-91 . . . . 15960 1 99 no PDB 4QBV . "Crystal Structure Of C117t Mutant Of Human Acidic Fibroblast Growth Factor In Sodium Citrate Buffer" . . . . . 100.00 146 99.25 99.25 1.24e-91 . . . . 15960 1 100 no PDB 4QC4 . "Crystal Structure Of C117s Mutant Of Human Acidic Fibroblast Growth Factor" . . . . . 100.00 146 99.25 99.25 1.31e-91 . . . . 15960 1 101 no DBJ BAC29035 . "unnamed protein product [Mus musculus]" . . . . . 100.00 155 96.99 97.74 9.72e-91 . . . . 15960 1 102 no DBJ BAF82451 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 154 99.25 99.25 1.13e-90 . . . . 15960 1 103 no DBJ BAG35227 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 104 no DBJ BAI46827 . "fibroblast growth factor 1 [synthetic construct]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 105 no EMBL CAA32448 . "unnamed protein product [Rattus norvegicus]" . . . . . 100.00 155 96.99 97.74 9.72e-91 . . . . 15960 1 106 no EMBL CAA36206 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 107 no EMBL CAA42869 . "acidic fibroblast growth factor [Sus scrofa]" . . . . . 97.74 152 97.69 98.46 8.25e-89 . . . . 15960 1 108 no EMBL CAA46661 . "acidic fibroblast growth factor [Homo sapiens]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 109 no EMBL CAI29610 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 214 100.00 100.00 1.91e-92 . . . . 15960 1 110 no GB AAA37618 . "acidic fibroblast growth factor [Mus musculus]" . . . . . 100.00 155 96.99 97.74 9.72e-91 . . . . 15960 1 111 no GB AAA52446 . "acidic fibroblast growth factor [Homo sapiens]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 112 no GB AAA52638 . "heparin-binding growth factor 1, partial [Homo sapiens]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 113 no GB AAA79245 . "beta-endothelial cell growth factor [Homo sapiens]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 114 no GB AAB29057 . "acidic fibroblast growth factor, partial [Homo sapiens]" . . . . . 99.25 154 100.00 100.00 1.73e-92 . . . . 15960 1 115 no PRF 1605206A . "acidic fibroblast growth factor" . . . . . 100.00 156 100.00 100.00 1.84e-93 . . . . 15960 1 116 no REF NP_000791 . "fibroblast growth factor 1 isoform 1 precursor [Homo sapiens]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 117 no REF NP_001127073 . "fibroblast growth factor 1 [Pongo abelii]" . . . . . 100.00 214 100.00 100.00 1.91e-92 . . . . 15960 1 118 no REF NP_001138364 . "fibroblast growth factor 1 isoform 1 precursor [Homo sapiens]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 119 no REF NP_001138406 . "fibroblast growth factor 1 isoform 1 precursor [Homo sapiens]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 120 no REF NP_001138407 . "fibroblast growth factor 1 isoform 1 precursor [Homo sapiens]" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 121 no SP P05230 . "RecName: Full=Fibroblast growth factor 1; Short=FGF-1; AltName: Full=Acidic fibroblast growth factor; Short=aFGF; AltName: Full" . . . . . 100.00 155 100.00 100.00 2.39e-93 . . . . 15960 1 122 no SP P20002 . "RecName: Full=Fibroblast growth factor 1; Short=FGF-1; AltName: Full=Acidic fibroblast growth factor; Short=aFGF; AltName: Full" . . . . . 97.74 152 97.69 98.46 8.25e-89 . . . . 15960 1 123 no SP P34004 . "RecName: Full=Fibroblast growth factor 1; Short=FGF-1; AltName: Full=Acidic fibroblast growth factor; Short=aFGF; AltName: Full" . . . . . 100.00 155 97.74 97.74 3.37e-91 . . . . 15960 1 124 no SP P61148 . "RecName: Full=Fibroblast growth factor 1; Short=FGF-1; AltName: Full=Acidic fibroblast growth factor; Short=aFGF; AltName: Full" . . . . . 100.00 155 96.99 97.74 9.72e-91 . . . . 15960 1 125 no SP P61149 . "RecName: Full=Fibroblast growth factor 1; Short=FGF-1; AltName: Full=Acidic fibroblast growth factor; Short=aFGF; AltName: Full" . . . . . 100.00 155 96.99 97.74 9.72e-91 . . . . 15960 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 . TYR . 15960 1 2 . LYS . 15960 1 3 . LYS . 15960 1 4 . PRO . 15960 1 5 . LYS . 15960 1 6 . LEU . 15960 1 7 . LEU . 15960 1 8 . TYR . 15960 1 9 . CYS . 15960 1 10 . SER . 15960 1 11 . ASN . 15960 1 12 . GLY . 15960 1 13 . GLY . 15960 1 14 . HIS . 15960 1 15 . PHE . 15960 1 16 . LEU . 15960 1 17 . ARG . 15960 1 18 . ILE . 15960 1 19 . LEU . 15960 1 20 . PRO . 15960 1 21 . ASP . 15960 1 22 . GLY . 15960 1 23 . THR . 15960 1 24 . VAL . 15960 1 25 . ASP . 15960 1 26 . GLY . 15960 1 27 . THR . 15960 1 28 . ARG . 15960 1 29 . ASP . 15960 1 30 . ARG . 15960 1 31 . SER . 15960 1 32 . ASP . 15960 1 33 . GLN . 15960 1 34 . HIS . 15960 1 35 . ILE . 15960 1 36 . GLN . 15960 1 37 . LEU . 15960 1 38 . GLN . 15960 1 39 . LEU . 15960 1 40 . SER . 15960 1 41 . ALA . 15960 1 42 . GLU . 15960 1 43 . SER . 15960 1 44 . VAL . 15960 1 45 . GLY . 15960 1 46 . GLU . 15960 1 47 . VAL . 15960 1 48 . TYR . 15960 1 49 . ILE . 15960 1 50 . LYS . 15960 1 51 . SER . 15960 1 52 . THR . 15960 1 53 . GLU . 15960 1 54 . THR . 15960 1 55 . GLY . 15960 1 56 . GLN . 15960 1 57 . TYR . 15960 1 58 . LEU . 15960 1 59 . ALA . 15960 1 60 . MET . 15960 1 61 . ASP . 15960 1 62 . THR . 15960 1 63 . ASP . 15960 1 64 . GLY . 15960 1 65 . LEU . 15960 1 66 . LEU . 15960 1 67 . TYR . 15960 1 68 . GLY . 15960 1 69 . SER . 15960 1 70 . GLN . 15960 1 71 . THR . 15960 1 72 . PRO . 15960 1 73 . ASN . 15960 1 74 . GLU . 15960 1 75 . GLU . 15960 1 76 . CYS . 15960 1 77 . LEU . 15960 1 78 . PHE . 15960 1 79 . LEU . 15960 1 80 . GLU . 15960 1 81 . ARG . 15960 1 82 . LEU . 15960 1 83 . GLU . 15960 1 84 . GLU . 15960 1 85 . ASN . 15960 1 86 . HIS . 15960 1 87 . TYR . 15960 1 88 . ASN . 15960 1 89 . THR . 15960 1 90 . TYR . 15960 1 91 . ILE . 15960 1 92 . SER . 15960 1 93 . LYS . 15960 1 94 . LYS . 15960 1 95 . HIS . 15960 1 96 . ALA . 15960 1 97 . GLU . 15960 1 98 . LYS . 15960 1 99 . ASN . 15960 1 100 . TRP . 15960 1 101 . PHE . 15960 1 102 . VAL . 15960 1 103 . GLY . 15960 1 104 . LEU . 15960 1 105 . LYS . 15960 1 106 . LYS . 15960 1 107 . ASN . 15960 1 108 . GLY . 15960 1 109 . SER . 15960 1 110 . CYS . 15960 1 111 . LYS . 15960 1 112 . ARG . 15960 1 113 . GLY . 15960 1 114 . PRO . 15960 1 115 . ARG . 15960 1 116 . THR . 15960 1 117 . HIS . 15960 1 118 . TYR . 15960 1 119 . GLY . 15960 1 120 . GLN . 15960 1 121 . LYS . 15960 1 122 . ALA . 15960 1 123 . ILE . 15960 1 124 . LEU . 15960 1 125 . PHE . 15960 1 126 . LEU . 15960 1 127 . PRO . 15960 1 128 . LEU . 15960 1 129 . PRO . 15960 1 130 . VAL . 15960 1 131 . SER . 15960 1 132 . SER . 15960 1 133 . ASP . 15960 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 . TYR 1 1 15960 1 . LYS 2 2 15960 1 . LYS 3 3 15960 1 . PRO 4 4 15960 1 . LYS 5 5 15960 1 . LEU 6 6 15960 1 . LEU 7 7 15960 1 . TYR 8 8 15960 1 . CYS 9 9 15960 1 . SER 10 10 15960 1 . ASN 11 11 15960 1 . GLY 12 12 15960 1 . GLY 13 13 15960 1 . HIS 14 14 15960 1 . PHE 15 15 15960 1 . LEU 16 16 15960 1 . ARG 17 17 15960 1 . ILE 18 18 15960 1 . LEU 19 19 15960 1 . PRO 20 20 15960 1 . ASP 21 21 15960 1 . GLY 22 22 15960 1 . THR 23 23 15960 1 . VAL 24 24 15960 1 . ASP 25 25 15960 1 . GLY 26 26 15960 1 . THR 27 27 15960 1 . ARG 28 28 15960 1 . ASP 29 29 15960 1 . ARG 30 30 15960 1 . SER 31 31 15960 1 . ASP 32 32 15960 1 . GLN 33 33 15960 1 . HIS 34 34 15960 1 . ILE 35 35 15960 1 . GLN 36 36 15960 1 . LEU 37 37 15960 1 . GLN 38 38 15960 1 . LEU 39 39 15960 1 . SER 40 40 15960 1 . ALA 41 41 15960 1 . GLU 42 42 15960 1 . SER 43 43 15960 1 . VAL 44 44 15960 1 . GLY 45 45 15960 1 . GLU 46 46 15960 1 . VAL 47 47 15960 1 . TYR 48 48 15960 1 . ILE 49 49 15960 1 . LYS 50 50 15960 1 . SER 51 51 15960 1 . THR 52 52 15960 1 . GLU 53 53 15960 1 . THR 54 54 15960 1 . GLY 55 55 15960 1 . GLN 56 56 15960 1 . TYR 57 57 15960 1 . LEU 58 58 15960 1 . ALA 59 59 15960 1 . MET 60 60 15960 1 . ASP 61 61 15960 1 . THR 62 62 15960 1 . ASP 63 63 15960 1 . GLY 64 64 15960 1 . LEU 65 65 15960 1 . LEU 66 66 15960 1 . TYR 67 67 15960 1 . GLY 68 68 15960 1 . SER 69 69 15960 1 . GLN 70 70 15960 1 . THR 71 71 15960 1 . PRO 72 72 15960 1 . ASN 73 73 15960 1 . GLU 74 74 15960 1 . GLU 75 75 15960 1 . CYS 76 76 15960 1 . LEU 77 77 15960 1 . PHE 78 78 15960 1 . LEU 79 79 15960 1 . GLU 80 80 15960 1 . ARG 81 81 15960 1 . LEU 82 82 15960 1 . GLU 83 83 15960 1 . GLU 84 84 15960 1 . ASN 85 85 15960 1 . HIS 86 86 15960 1 . TYR 87 87 15960 1 . ASN 88 88 15960 1 . THR 89 89 15960 1 . TYR 90 90 15960 1 . ILE 91 91 15960 1 . SER 92 92 15960 1 . LYS 93 93 15960 1 . LYS 94 94 15960 1 . HIS 95 95 15960 1 . ALA 96 96 15960 1 . GLU 97 97 15960 1 . LYS 98 98 15960 1 . ASN 99 99 15960 1 . TRP 100 100 15960 1 . PHE 101 101 15960 1 . VAL 102 102 15960 1 . GLY 103 103 15960 1 . LEU 104 104 15960 1 . LYS 105 105 15960 1 . LYS 106 106 15960 1 . ASN 107 107 15960 1 . GLY 108 108 15960 1 . SER 109 109 15960 1 . CYS 110 110 15960 1 . LYS 111 111 15960 1 . ARG 112 112 15960 1 . GLY 113 113 15960 1 . PRO 114 114 15960 1 . ARG 115 115 15960 1 . THR 116 116 15960 1 . HIS 117 117 15960 1 . TYR 118 118 15960 1 . GLY 119 119 15960 1 . GLN 120 120 15960 1 . LYS 121 121 15960 1 . ALA 122 122 15960 1 . ILE 123 123 15960 1 . LEU 124 124 15960 1 . PHE 125 125 15960 1 . LEU 126 126 15960 1 . PRO 127 127 15960 1 . LEU 128 128 15960 1 . PRO 129 129 15960 1 . VAL 130 130 15960 1 . SER 131 131 15960 1 . SER 132 132 15960 1 . ASP 133 133 15960 1 stop_ save_ save_IHP _Entity.Sf_category entity _Entity.Sf_framecode IHP _Entity.Entry_ID 15960 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name IHP _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID IHP _Entity.Nonpolymer_comp_label $chem_comp_IHP _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 660.035 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . IHP . 15960 2 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 15960 _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 $FGF-1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens hFGF-1 . . . . . . . . . . . . . . . . . . . . 15960 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 15960 _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 $FGF-1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET(20) . . . . . . 15960 1 2 2 $IHP . 'obtained from a vendor' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15960 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_IHP _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_IHP _Chem_comp.Entry_ID 15960 _Chem_comp.ID IHP _Chem_comp.Provenance . _Chem_comp.Name 'INOSITOL HEXAKISPHOSPHATE' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code IHP _Chem_comp.Ambiguous_flag . _Chem_comp.Initial_date . _Chem_comp.Modified_date . _Chem_comp.Release_status . _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code . _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code IHP _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'C6 H18 O24 P6' _Chem_comp.Formula_weight 660.035 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag . _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag . _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site . _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Fri Feb 15 19:26:33 2008 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID C1(C(C(C(C(C1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O SMILES 'OpenEye OEToolkits' 1.5.0 15960 IHP C1(C(C(C(C(C1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 15960 IHP InChI=1/C6H18O24P6/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24)/t1-,2-,3-,4+,5-,6- InChI InChI 1.01 15960 IHP O=P(OC1C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1OP(=O)(O)O)(O)O SMILES ACDLabs 10.04 15960 IHP O[P](O)(=O)O[C@@H]1[C@H](O[P](O)(O)=O)[C@H](O[P](O)(O)=O)[C@@H](O[P](O)(O)=O)[C@H](O[P](O)(O)=O)[C@H]1O[P](O)(O)=O SMILES_CANONICAL CACTVS 3.341 15960 IHP O[P](O)(=O)O[CH]1[CH](O[P](O)(O)=O)[CH](O[P](O)(O)=O)[CH](O[P](O)(O)=O)[CH](O[P](O)(O)=O)[CH]1O[P](O)(O)=O SMILES CACTVS 3.341 15960 IHP stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID '(1R,2S,3r,4R,5S,6s)-cyclohexane-1,2,3,4,5,6-hexayl hexakis[dihydrogen (phosphate)]' 'SYSTEMATIC NAME' ACDLabs 10.04 15960 IHP '(2,3,4,5,6-pentaphosphonooxycyclohexyl) dihydrogen phosphate' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 15960 IHP stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID C1 . C1 . . C . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP C2 . C2 . . C . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP C3 . C3 . . C . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP C4 . C4 . . C . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP C5 . C5 . . C . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP C6 . C6 . . C . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H1 . H1 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H2 . H2 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H3 . H3 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H31 . H31 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H32 . H32 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H33 . H33 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H34 . H34 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H35 . H35 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H36 . H36 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H4 . H4 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H41 . H41 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H42 . H42 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H43 . H43 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H44 . H44 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H45 . H45 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H46 . H46 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H5 . H5 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP H6 . H6 . . H . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O11 . O11 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O12 . O12 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O13 . O13 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O14 . O14 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O15 . O15 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O16 . O16 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O21 . O21 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O22 . O22 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O23 . O23 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O24 . O24 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O25 . O25 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O26 . O26 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O31 . O31 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O32 . O32 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O33 . O33 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O34 . O34 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O35 . O35 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O36 . O36 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O41 . O41 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O42 . O42 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O43 . O43 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O44 . O44 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O45 . O45 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP O46 . O46 . . O . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP P1 . P1 . . P . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP P2 . P2 . . P . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP P3 . P3 . . P . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP P4 . P4 . . P . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP P5 . P5 . . P . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP P6 . P6 . . P . N . 0 . . . . . . . . . . . . . . . . . . . . . 15960 IHP stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING C1 C2 . . . . 15960 IHP 2 . SING C1 C6 . . . . 15960 IHP 3 . SING C1 O11 . . . . 15960 IHP 4 . SING C1 H1 . . . . 15960 IHP 5 . SING C2 C3 . . . . 15960 IHP 6 . SING C2 O12 . . . . 15960 IHP 7 . SING C2 H2 . . . . 15960 IHP 8 . SING C3 C4 . . . . 15960 IHP 9 . SING C3 O13 . . . . 15960 IHP 10 . SING C3 H3 . . . . 15960 IHP 11 . SING C4 C5 . . . . 15960 IHP 12 . SING C4 O14 . . . . 15960 IHP 13 . SING C4 H4 . . . . 15960 IHP 14 . SING C5 C6 . . . . 15960 IHP 15 . SING C5 O15 . . . . 15960 IHP 16 . SING C5 H5 . . . . 15960 IHP 17 . SING C6 O16 . . . . 15960 IHP 18 . SING C6 H6 . . . . 15960 IHP 19 . SING O11 P1 . . . . 15960 IHP 20 . DOUB P1 O21 . . . . 15960 IHP 21 . SING P1 O31 . . . . 15960 IHP 22 . SING P1 O41 . . . . 15960 IHP 23 . SING O31 H31 . . . . 15960 IHP 24 . SING O41 H41 . . . . 15960 IHP 25 . SING O12 P2 . . . . 15960 IHP 26 . DOUB P2 O22 . . . . 15960 IHP 27 . SING P2 O32 . . . . 15960 IHP 28 . SING P2 O42 . . . . 15960 IHP 29 . SING O32 H32 . . . . 15960 IHP 30 . SING O42 H42 . . . . 15960 IHP 31 . SING O13 P3 . . . . 15960 IHP 32 . DOUB P3 O23 . . . . 15960 IHP 33 . SING P3 O33 . . . . 15960 IHP 34 . SING P3 O43 . . . . 15960 IHP 35 . SING O33 H33 . . . . 15960 IHP 36 . SING O43 H43 . . . . 15960 IHP 37 . SING O14 P4 . . . . 15960 IHP 38 . DOUB P4 O24 . . . . 15960 IHP 39 . SING P4 O34 . . . . 15960 IHP 40 . SING P4 O44 . . . . 15960 IHP 41 . SING O34 H34 . . . . 15960 IHP 42 . SING O44 H44 . . . . 15960 IHP 43 . SING O15 P5 . . . . 15960 IHP 44 . DOUB P5 O25 . . . . 15960 IHP 45 . SING P5 O35 . . . . 15960 IHP 46 . SING P5 O45 . . . . 15960 IHP 47 . SING O35 H35 . . . . 15960 IHP 48 . SING O45 H45 . . . . 15960 IHP 49 . SING O16 P6 . . . . 15960 IHP 50 . DOUB P6 O26 . . . . 15960 IHP 51 . SING P6 O36 . . . . 15960 IHP 52 . SING P6 O46 . . . . 15960 IHP 53 . SING O36 H36 . . . . 15960 IHP 54 . SING O46 H46 . . . . 15960 IHP stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15960 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.5 mM Conc FGF1-IP6 temperature 298 K. pH=6.8 ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% 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 FGF-1 '[U-100% 13C; U-100% 15N]' . . 1 $FGF-1 . . 1.5 . . mM . . . . 15960 1 2 'INOSITOL HEXAKISPHOSPHATE' 'natural abundance' . . 2 $IHP . . 1.5 . . mM . . . . 15960 1 3 'ammonium sulfate' 'natural abundance' . . . . . . 100 . . mM . . . . 15960 1 4 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 15960 1 5 H20 'natural abundance' . . . . . . 90 . . % . . . . 15960 1 6 D20 'natural abundance' . . . . . . 10 . . % . . . . 15960 1 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 15960 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 15960 1 pH 6.8 . pH 15960 1 pressure 1 . atm 15960 1 temperature 298 . K 15960 1 stop_ save_ ############################ # Computer software used # ############################ save_Aria _Software.Sf_category software _Software.Sf_framecode Aria _Software.Entry_ID 15960 _Software.ID 1 _Software.Name ARIA _Software.Version 1.1 _Software.Details 'ARIA 1.1 is using CNS 1.1' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Dr. Michael Nilges, Institut Pasteur' ; Unite de Bioinformatique Structurale, Institut Pasteur, 25-28 rue du Dr Roux, 75015 Paris, France ; nilges@pasteur.fr 15960 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Automated NOE assignment' 15960 1 'NMR structure calculation' 15960 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 15960 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15960 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 15960 _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 Avance . 600 . . . 15960 1 2 spectrometer_2 Bruker DRX . 600 . . . 15960 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 15960 _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 . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 1 6 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 1 7 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 1 9 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 1 10 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 1 11 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15960 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 15960 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 TSP 'methyl carbons' . . . . ppm 0 na indirect 1 . . . . . . . . . 15960 1 H 1 TSP 'methyl protons' . . . . ppm 0 na direct 1 . . . . . . . . . 15960 1 N 15 TSP 'methyl carbons' . . . . ppm 0 na indirect 1 . . . . . . . . . 15960 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_chemical_shift_set _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_set _Assigned_chem_shift_list.Entry_ID 15960 _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 'Derived from the file: /home/hanmin/FGF1/run39A2/data/15N/15N.ppm' _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' . . . 15960 1 2 '2D 1H-13C HSQC' . . . 15960 1 3 '3D CBCA(CO)NH' . . . 15960 1 4 '3D HNCO' . . . 15960 1 5 '3D HNCA' . . . 15960 1 6 '3D HBHA(CO)NH' . . . 15960 1 7 '3D HCCH-TOCSY' . . . 15960 1 8 '3D 1H-15N NOESY' . . . 15960 1 9 '3D 1H-13C NOESY' . . . 15960 1 10 '3D 1H-15N TOCSY' . . . 15960 1 11 '3D C(CO)NH' . . . 15960 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 TYR H H 1 8.29 0.0 . . . . . . 1 TYR H . 15960 1 2 . 1 1 1 1 TYR HA H 1 4.58 0.0 . . . . . . 1 TYR HA . 15960 1 3 . 1 1 1 1 TYR HB2 H 1 2.8 0.0 . . . . . . 1 TYR HB2 . 15960 1 4 . 1 1 1 1 TYR HB3 H 1 3.25 0.0 . . . . . . 1 TYR HB3 . 15960 1 5 . 1 1 1 1 TYR HD1 H 1 7.1 0.0 . . . . . . 1 TYR HD1 . 15960 1 6 . 1 1 1 1 TYR HD2 H 1 7.1 0.0 . . . . . . 1 TYR HD2 . 15960 1 7 . 1 1 1 1 TYR HE1 H 1 6.89 0.0 . . . . . . 1 TYR HE1 . 15960 1 8 . 1 1 1 1 TYR HE2 H 1 6.89 0.0 . . . . . . 1 TYR HE2 . 15960 1 9 . 1 1 1 1 TYR C C 13 174.19 0.0 . . . . . . 1 TYR C . 15960 1 10 . 1 1 1 1 TYR CA C 13 55.35 0.0 . . . . . . 1 TYR CA . 15960 1 11 . 1 1 1 1 TYR N N 15 120.3 0.0 . . . . . . 1 TYR N . 15960 1 12 . 1 1 2 2 LYS H H 1 8.26 0.0 . . . . . . 2 LYS H . 15960 1 13 . 1 1 2 2 LYS HA H 1 4.15 0.0 . . . . . . 2 LYS HA . 15960 1 14 . 1 1 2 2 LYS HB3 H 1 1.77 0.0 . . . . . . 2 LYS HB3 . 15960 1 15 . 1 1 2 2 LYS C C 13 174.3 0.0 . . . . . . 2 LYS C . 15960 1 16 . 1 1 2 2 LYS CA C 13 51.02 0.0 . . . . . . 2 LYS CA . 15960 1 17 . 1 1 2 2 LYS N N 15 120.28 0.0 . . . . . . 2 LYS N . 15960 1 18 . 1 1 3 3 LYS H H 1 7.96 0.0 . . . . . . 3 LYS H . 15960 1 19 . 1 1 3 3 LYS HA H 1 4.48 0.0 . . . . . . 3 LYS HA . 15960 1 20 . 1 1 3 3 LYS HB2 H 1 1.48 0.0 . . . . . . 3 LYS HB2 . 15960 1 21 . 1 1 3 3 LYS HB3 H 1 1.65 0.0 . . . . . . 3 LYS HB3 . 15960 1 22 . 1 1 3 3 LYS CA C 13 51.9 0.0 . . . . . . 3 LYS CA . 15960 1 23 . 1 1 3 3 LYS N N 15 119.59 0.0 . . . . . . 3 LYS N . 15960 1 24 . 1 1 4 4 PRO HA H 1 4.59 0.0 . . . . . . 4 PRO HA . 15960 1 25 . 1 1 4 4 PRO HB3 H 1 2.03 0.0 . . . . . . 4 PRO HB3 . 15960 1 26 . 1 1 4 4 PRO C C 13 172.3 0.0 . . . . . . 4 PRO C . 15960 1 27 . 1 1 4 4 PRO CA C 13 60.63 0.0 . . . . . . 4 PRO CA . 15960 1 28 . 1 1 4 4 PRO CB C 13 30.49 0.0 . . . . . . 4 PRO CB . 15960 1 29 . 1 1 5 5 LYS H H 1 9.34 0.0 . . . . . . 5 LYS H . 15960 1 30 . 1 1 5 5 LYS HA H 1 4.93 0.0 . . . . . . 5 LYS HA . 15960 1 31 . 1 1 5 5 LYS HB2 H 1 1.39 0.0 . . . . . . 5 LYS HB2 . 15960 1 32 . 1 1 5 5 LYS HB3 H 1 1.69 0.0 . . . . . . 5 LYS HB3 . 15960 1 33 . 1 1 5 5 LYS C C 13 171.71 0.0 . . . . . . 5 LYS C . 15960 1 34 . 1 1 5 5 LYS CA C 13 51.38 0.0 . . . . . . 5 LYS CA . 15960 1 35 . 1 1 5 5 LYS CB C 13 34.87 0.0 . . . . . . 5 LYS CB . 15960 1 36 . 1 1 5 5 LYS N N 15 118.82 0.0 . . . . . . 5 LYS N . 15960 1 37 . 1 1 6 6 LEU H H 1 8.93 0.0 . . . . . . 6 LEU H . 15960 1 38 . 1 1 6 6 LEU HA H 1 4.77 0.0 . . . . . . 6 LEU HA . 15960 1 39 . 1 1 6 6 LEU HB2 H 1 1.5 0.0 . . . . . . 6 LEU HB2 . 15960 1 40 . 1 1 6 6 LEU HB3 H 1 1.7 0.0 . . . . . . 6 LEU HB3 . 15960 1 41 . 1 1 6 6 LEU HD11 H 1 0.61 0.0 . . . . . . 6 LEU HD11 . 15960 1 42 . 1 1 6 6 LEU HD12 H 1 0.61 0.0 . . . . . . 6 LEU HD12 . 15960 1 43 . 1 1 6 6 LEU HD13 H 1 0.61 0.0 . . . . . . 6 LEU HD13 . 15960 1 44 . 1 1 6 6 LEU HD21 H 1 0.53 0.0 . . . . . . 6 LEU HD21 . 15960 1 45 . 1 1 6 6 LEU HD22 H 1 0.53 0.0 . . . . . . 6 LEU HD22 . 15960 1 46 . 1 1 6 6 LEU HD23 H 1 0.53 0.0 . . . . . . 6 LEU HD23 . 15960 1 47 . 1 1 6 6 LEU C C 13 174.68 0.0 . . . . . . 6 LEU C . 15960 1 48 . 1 1 6 6 LEU CA C 13 50.37 0.0 . . . . . . 6 LEU CA . 15960 1 49 . 1 1 6 6 LEU CB C 13 41.35 0.0 . . . . . . 6 LEU CB . 15960 1 50 . 1 1 6 6 LEU N N 15 117.17 0.0 . . . . . . 6 LEU N . 15960 1 51 . 1 1 7 7 LEU H H 1 10.29 0.0 . . . . . . 7 LEU H . 15960 1 52 . 1 1 7 7 LEU HA H 1 4.92 0.0 . . . . . . 7 LEU HA . 15960 1 53 . 1 1 7 7 LEU HB2 H 1 1.2 0.0 . . . . . . 7 LEU HB2 . 15960 1 54 . 1 1 7 7 LEU HB3 H 1 1.52 0.0 . . . . . . 7 LEU HB3 . 15960 1 55 . 1 1 7 7 LEU C C 13 172.37 0.0 . . . . . . 7 LEU C . 15960 1 56 . 1 1 7 7 LEU CA C 13 51.87 0.0 . . . . . . 7 LEU CA . 15960 1 57 . 1 1 7 7 LEU N N 15 124.62 0.0 . . . . . . 7 LEU N . 15960 1 58 . 1 1 8 8 TYR H H 1 8.47 0.0 . . . . . . 8 TYR H . 15960 1 59 . 1 1 8 8 TYR HA H 1 4.48 0.0 . . . . . . 8 TYR HA . 15960 1 60 . 1 1 8 8 TYR HB2 H 1 2.82 0.0 . . . . . . 8 TYR HB2 . 15960 1 61 . 1 1 8 8 TYR HB3 H 1 3.25 0.0 . . . . . . 8 TYR HB3 . 15960 1 62 . 1 1 8 8 TYR C C 13 171.37 0.0 . . . . . . 8 TYR C . 15960 1 63 . 1 1 8 8 TYR CA C 13 54.71 0.0 . . . . . . 8 TYR CA . 15960 1 64 . 1 1 8 8 TYR CB C 13 38.05 0.0 . . . . . . 8 TYR CB . 15960 1 65 . 1 1 8 8 TYR N N 15 125.3 0.0 . . . . . . 8 TYR N . 15960 1 66 . 1 1 9 9 CYS H H 1 9.11 0.0 . . . . . . 9 CYS H . 15960 1 67 . 1 1 9 9 CYS HA H 1 4.16 0.0 . . . . . . 9 CYS HA . 15960 1 68 . 1 1 9 9 CYS HB2 H 1 2.4 0.0 . . . . . . 9 CYS HB2 . 15960 1 69 . 1 1 9 9 CYS HB3 H 1 2.44 0.0 . . . . . . 9 CYS HB3 . 15960 1 70 . 1 1 9 9 CYS C C 13 172.48 0.0 . . . . . . 9 CYS C . 15960 1 71 . 1 1 9 9 CYS CA C 13 55.41 0.0 . . . . . . 9 CYS CA . 15960 1 72 . 1 1 9 9 CYS CB C 13 27.15 0.0 . . . . . . 9 CYS CB . 15960 1 73 . 1 1 9 9 CYS N N 15 129.53 0.0 . . . . . . 9 CYS N . 15960 1 74 . 1 1 10 10 SER H H 1 8.23 0.0 . . . . . . 10 SER H . 15960 1 75 . 1 1 10 10 SER HA H 1 3.8 0.0 . . . . . . 10 SER HA . 15960 1 76 . 1 1 10 10 SER HB3 H 1 3.78 0.0 . . . . . . 10 SER HB3 . 15960 1 77 . 1 1 10 10 SER C C 13 172.21 0.0 . . . . . . 10 SER C . 15960 1 78 . 1 1 10 10 SER CA C 13 57.77 0.0 . . . . . . 10 SER CA . 15960 1 79 . 1 1 10 10 SER CB C 13 61.82 0.0 . . . . . . 10 SER CB . 15960 1 80 . 1 1 10 10 SER N N 15 122.54 0.0 . . . . . . 10 SER N . 15960 1 81 . 1 1 11 11 ASN H H 1 7.44 0.0 . . . . . . 11 ASN H . 15960 1 82 . 1 1 11 11 ASN HA H 1 4.26 0.0 . . . . . . 11 ASN HA . 15960 1 83 . 1 1 11 11 ASN HB3 H 1 3.77 0.0 . . . . . . 11 ASN HB3 . 15960 1 84 . 1 1 11 11 ASN CA C 13 52.43 0.0 . . . . . . 11 ASN CA . 15960 1 85 . 1 1 11 11 ASN N N 15 119.69 0.0 . . . . . . 11 ASN N . 15960 1 86 . 1 1 12 12 GLY HA2 H 1 3.8 0.0 . . . . . . 12 GLY HA2 . 15960 1 87 . 1 1 12 12 GLY HA3 H 1 4.14 0.0 . . . . . . 12 GLY HA3 . 15960 1 88 . 1 1 12 12 GLY CA C 13 41.9 0.0 . . . . . . 12 GLY CA . 15960 1 89 . 1 1 13 13 GLY H H 1 7.08 0.0 . . . . . . 13 GLY H . 15960 1 90 . 1 1 13 13 GLY HA2 H 1 3.14 0.0 . . . . . . 13 GLY HA2 . 15960 1 91 . 1 1 13 13 GLY HA3 H 1 3.51 0.0 . . . . . . 13 GLY HA3 . 15960 1 92 . 1 1 13 13 GLY C C 13 170.44 0.0 . . . . . . 13 GLY C . 15960 1 93 . 1 1 13 13 GLY CA C 13 44.27 0.0 . . . . . . 13 GLY CA . 15960 1 94 . 1 1 13 13 GLY N N 15 109.03 0.0 . . . . . . 13 GLY N . 15960 1 95 . 1 1 14 14 HIS H H 1 6.37 0.0 . . . . . . 14 HIS H . 15960 1 96 . 1 1 14 14 HIS HA H 1 4.02 0.0 . . . . . . 14 HIS HA . 15960 1 97 . 1 1 14 14 HIS HB2 H 1 2.4 0.0 . . . . . . 14 HIS HB2 . 15960 1 98 . 1 1 14 14 HIS HB3 H 1 2.55 0.0 . . . . . . 14 HIS HB3 . 15960 1 99 . 1 1 14 14 HIS C C 13 171.4 0.0 . . . . . . 14 HIS C . 15960 1 100 . 1 1 14 14 HIS CA C 13 54.22 0.0 . . . . . . 14 HIS CA . 15960 1 101 . 1 1 14 14 HIS CB C 13 32.0 0.0 . . . . . . 14 HIS CB . 15960 1 102 . 1 1 14 14 HIS N N 15 113.51 0.0 . . . . . . 14 HIS N . 15960 1 103 . 1 1 15 15 PHE H H 1 9.27 0.0 . . . . . . 15 PHE H . 15960 1 104 . 1 1 15 15 PHE HA H 1 5.17 0.0 . . . . . . 15 PHE HA . 15960 1 105 . 1 1 15 15 PHE HB2 H 1 2.89 0.0 . . . . . . 15 PHE HB2 . 15960 1 106 . 1 1 15 15 PHE HB3 H 1 3.18 0.0 . . . . . . 15 PHE HB3 . 15960 1 107 . 1 1 15 15 PHE HE1 H 1 7.02 0.0 . . . . . . 15 PHE HE1 . 15960 1 108 . 1 1 15 15 PHE C C 13 173.7 0.0 . . . . . . 15 PHE C . 15960 1 109 . 1 1 15 15 PHE CA C 13 54.01 0.0 . . . . . . 15 PHE CA . 15960 1 110 . 1 1 15 15 PHE N N 15 119.85 0.0 . . . . . . 15 PHE N . 15960 1 111 . 1 1 16 16 LEU H H 1 8.46 0.0 . . . . . . 16 LEU H . 15960 1 112 . 1 1 16 16 LEU HA H 1 4.31 0.0 . . . . . . 16 LEU HA . 15960 1 113 . 1 1 16 16 LEU HB2 H 1 1.19 0.0 . . . . . . 16 LEU HB2 . 15960 1 114 . 1 1 16 16 LEU HB3 H 1 1.74 0.0 . . . . . . 16 LEU HB3 . 15960 1 115 . 1 1 16 16 LEU C C 13 171.72 0.0 . . . . . . 16 LEU C . 15960 1 116 . 1 1 16 16 LEU CA C 13 54.71 0.0 . . . . . . 16 LEU CA . 15960 1 117 . 1 1 16 16 LEU CB C 13 41.19 0.0 . . . . . . 16 LEU CB . 15960 1 118 . 1 1 16 16 LEU N N 15 124.8 0.0 . . . . . . 16 LEU N . 15960 1 119 . 1 1 17 17 ARG H H 1 9.33 0.0 . . . . . . 17 ARG H . 15960 1 120 . 1 1 17 17 ARG HA H 1 4.65 0.0 . . . . . . 17 ARG HA . 15960 1 121 . 1 1 17 17 ARG HB2 H 1 1.11 0.0 . . . . . . 17 ARG HB2 . 15960 1 122 . 1 1 17 17 ARG HB3 H 1 2.49 0.0 . . . . . . 17 ARG HB3 . 15960 1 123 . 1 1 17 17 ARG HG2 H 1 1.23 0.0 . . . . . . 17 ARG HG2 . 15960 1 124 . 1 1 17 17 ARG HG3 H 1 1.32 0.0 . . . . . . 17 ARG HG3 . 15960 1 125 . 1 1 17 17 ARG C C 13 171.26 0.0 . . . . . . 17 ARG C . 15960 1 126 . 1 1 17 17 ARG CA C 13 53.34 0.0 . . . . . . 17 ARG CA . 15960 1 127 . 1 1 17 17 ARG CB C 13 32.63 0.0 . . . . . . 17 ARG CB . 15960 1 128 . 1 1 17 17 ARG N N 15 126.67 0.0 . . . . . . 17 ARG N . 15960 1 129 . 1 1 18 18 ILE H H 1 6.92 0.0 . . . . . . 18 ILE H . 15960 1 130 . 1 1 18 18 ILE HA H 1 4.56 0.0 . . . . . . 18 ILE HA . 15960 1 131 . 1 1 18 18 ILE HB H 1 1.54 0.0 . . . . . . 18 ILE HB . 15960 1 132 . 1 1 18 18 ILE HG21 H 1 0.5 0.0 . . . . . . 18 ILE HG21 . 15960 1 133 . 1 1 18 18 ILE HG22 H 1 0.5 0.0 . . . . . . 18 ILE HG22 . 15960 1 134 . 1 1 18 18 ILE HG23 H 1 0.5 0.0 . . . . . . 18 ILE HG23 . 15960 1 135 . 1 1 18 18 ILE C C 13 173.74 0.0 . . . . . . 18 ILE C . 15960 1 136 . 1 1 18 18 ILE CA C 13 57.84 0.0 . . . . . . 18 ILE CA . 15960 1 137 . 1 1 18 18 ILE CB C 13 36.71 0.0 . . . . . . 18 ILE CB . 15960 1 138 . 1 1 18 18 ILE N N 15 120.67 0.0 . . . . . . 18 ILE N . 15960 1 139 . 1 1 19 19 LEU H H 1 8.9 0.0 . . . . . . 19 LEU H . 15960 1 140 . 1 1 19 19 LEU HA H 1 4.04 0.0 . . . . . . 19 LEU HA . 15960 1 141 . 1 1 19 19 LEU HB2 H 1 1.55 0.0 . . . . . . 19 LEU HB2 . 15960 1 142 . 1 1 19 19 LEU HB3 H 1 1.85 0.0 . . . . . . 19 LEU HB3 . 15960 1 143 . 1 1 19 19 LEU CA C 13 51.51 0.0 . . . . . . 19 LEU CA . 15960 1 144 . 1 1 19 19 LEU N N 15 128.0 0.0 . . . . . . 19 LEU N . 15960 1 145 . 1 1 20 20 PRO HA H 1 4.16 0.0 . . . . . . 20 PRO HA . 15960 1 146 . 1 1 20 20 PRO HB2 H 1 1.84 0.0 . . . . . . 20 PRO HB2 . 15960 1 147 . 1 1 20 20 PRO HB3 H 1 2.21 0.0 . . . . . . 20 PRO HB3 . 15960 1 148 . 1 1 20 20 PRO HD2 H 1 3.42 0.0 . . . . . . 20 PRO HD2 . 15960 1 149 . 1 1 20 20 PRO HG2 H 1 1.75 0.0 . . . . . . 20 PRO HG2 . 15960 1 150 . 1 1 20 20 PRO C C 13 173.93 0.0 . . . . . . 20 PRO C . 15960 1 151 . 1 1 20 20 PRO CA C 13 62.73 0.0 . . . . . . 20 PRO CA . 15960 1 152 . 1 1 20 20 PRO CB C 13 29.32 0.0 . . . . . . 20 PRO CB . 15960 1 153 . 1 1 21 21 ASP H H 1 7.38 0.0 . . . . . . 21 ASP H . 15960 1 154 . 1 1 21 21 ASP HA H 1 4.41 0.0 . . . . . . 21 ASP HA . 15960 1 155 . 1 1 21 21 ASP HB2 H 1 2.46 0.0 . . . . . . 21 ASP HB2 . 15960 1 156 . 1 1 21 21 ASP HB3 H 1 2.97 0.0 . . . . . . 21 ASP HB3 . 15960 1 157 . 1 1 21 21 ASP C C 13 174.61 0.0 . . . . . . 21 ASP C . 15960 1 158 . 1 1 21 21 ASP CA C 13 51.19 0.0 . . . . . . 21 ASP CA . 15960 1 159 . 1 1 21 21 ASP CB C 13 37.32 0.0 . . . . . . 21 ASP CB . 15960 1 160 . 1 1 21 21 ASP N N 15 113.77 0.0 . . . . . . 21 ASP N . 15960 1 161 . 1 1 22 22 GLY H H 1 8.37 0.0 . . . . . . 22 GLY H . 15960 1 162 . 1 1 22 22 GLY HA2 H 1 3.75 0.0 . . . . . . 22 GLY HA2 . 15960 1 163 . 1 1 22 22 GLY HA3 H 1 4.48 0.0 . . . . . . 22 GLY HA3 . 15960 1 164 . 1 1 22 22 GLY C C 13 172.57 0.0 . . . . . . 22 GLY C . 15960 1 165 . 1 1 22 22 GLY CA C 13 43.1 0.0 . . . . . . 22 GLY CA . 15960 1 166 . 1 1 22 22 GLY N N 15 108.91 0.0 . . . . . . 22 GLY N . 15960 1 167 . 1 1 23 23 THR H H 1 7.81 0.0 . . . . . . 23 THR H . 15960 1 168 . 1 1 23 23 THR HA H 1 4.37 0.0 . . . . . . 23 THR HA . 15960 1 169 . 1 1 23 23 THR HB H 1 4.1 0.0 . . . . . . 23 THR HB . 15960 1 170 . 1 1 23 23 THR HG21 H 1 1.04 0.0 . . . . . . 23 THR HG21 . 15960 1 171 . 1 1 23 23 THR HG22 H 1 1.04 0.0 . . . . . . 23 THR HG22 . 15960 1 172 . 1 1 23 23 THR HG23 H 1 1.04 0.0 . . . . . . 23 THR HG23 . 15960 1 173 . 1 1 23 23 THR C C 13 169.97 0.0 . . . . . . 23 THR C . 15960 1 174 . 1 1 23 23 THR CA C 13 61.05 0.0 . . . . . . 23 THR CA . 15960 1 175 . 1 1 23 23 THR CB C 13 67.45 0.0 . . . . . . 23 THR CB . 15960 1 176 . 1 1 23 23 THR N N 15 116.23 0.0 . . . . . . 23 THR N . 15960 1 177 . 1 1 24 24 VAL H H 1 7.89 0.0 . . . . . . 24 VAL H . 15960 1 178 . 1 1 24 24 VAL HA H 1 4.92 0.0 . . . . . . 24 VAL HA . 15960 1 179 . 1 1 24 24 VAL HB H 1 1.55 0.0 . . . . . . 24 VAL HB . 15960 1 180 . 1 1 24 24 VAL HG11 H 1 0.75 0.0 . . . . . . 24 VAL HG11 . 15960 1 181 . 1 1 24 24 VAL HG12 H 1 0.75 0.0 . . . . . . 24 VAL HG12 . 15960 1 182 . 1 1 24 24 VAL HG13 H 1 0.75 0.0 . . . . . . 24 VAL HG13 . 15960 1 183 . 1 1 24 24 VAL C C 13 171.65 0.0 . . . . . . 24 VAL C . 15960 1 184 . 1 1 24 24 VAL CA C 13 58.07 0.0 . . . . . . 24 VAL CA . 15960 1 185 . 1 1 24 24 VAL CB C 13 31.48 0.0 . . . . . . 24 VAL CB . 15960 1 186 . 1 1 24 24 VAL N N 15 123.01 0.0 . . . . . . 24 VAL N . 15960 1 187 . 1 1 25 25 ASP H H 1 9.01 0.0 . . . . . . 25 ASP H . 15960 1 188 . 1 1 25 25 ASP HA H 1 4.32 0.0 . . . . . . 25 ASP HA . 15960 1 189 . 1 1 25 25 ASP HB2 H 1 2.67 0.0 . . . . . . 25 ASP HB2 . 15960 1 190 . 1 1 25 25 ASP HB3 H 1 2.9 0.0 . . . . . . 25 ASP HB3 . 15960 1 191 . 1 1 25 25 ASP C C 13 170.12 0.0 . . . . . . 25 ASP C . 15960 1 192 . 1 1 25 25 ASP CA C 13 51.13 0.0 . . . . . . 25 ASP CA . 15960 1 193 . 1 1 25 25 ASP CB C 13 38.41 0.0 . . . . . . 25 ASP CB . 15960 1 194 . 1 1 25 25 ASP N N 15 130.89 0.0 . . . . . . 25 ASP N . 15960 1 195 . 1 1 26 26 GLY H H 1 7.93 0.0 . . . . . . 26 GLY H . 15960 1 196 . 1 1 26 26 GLY HA2 H 1 2.9 0.0 . . . . . . 26 GLY HA2 . 15960 1 197 . 1 1 26 26 GLY HA3 H 1 5.42 0.0 . . . . . . 26 GLY HA3 . 15960 1 198 . 1 1 26 26 GLY C C 13 169.98 0.0 . . . . . . 26 GLY C . 15960 1 199 . 1 1 26 26 GLY CA C 13 41.88 0.0 . . . . . . 26 GLY CA . 15960 1 200 . 1 1 26 26 GLY N N 15 102.1 0.0 . . . . . . 26 GLY N . 15960 1 201 . 1 1 27 27 THR H H 1 8.5 0.0 . . . . . . 27 THR H . 15960 1 202 . 1 1 27 27 THR HA H 1 5.06 0.0 . . . . . . 27 THR HA . 15960 1 203 . 1 1 27 27 THR HB H 1 3.88 0.0 . . . . . . 27 THR HB . 15960 1 204 . 1 1 27 27 THR HG21 H 1 1.2 0.0 . . . . . . 27 THR HG21 . 15960 1 205 . 1 1 27 27 THR HG22 H 1 1.2 0.0 . . . . . . 27 THR HG22 . 15960 1 206 . 1 1 27 27 THR HG23 H 1 1.2 0.0 . . . . . . 27 THR HG23 . 15960 1 207 . 1 1 27 27 THR C C 13 170.56 0.0 . . . . . . 27 THR C . 15960 1 208 . 1 1 27 27 THR CA C 13 56.82 0.0 . . . . . . 27 THR CA . 15960 1 209 . 1 1 27 27 THR CB C 13 67.21 0.0 . . . . . . 27 THR CB . 15960 1 210 . 1 1 27 27 THR N N 15 111.95 0.0 . . . . . . 27 THR N . 15960 1 211 . 1 1 28 28 ARG H H 1 8.95 0.0 . . . . . . 28 ARG H . 15960 1 212 . 1 1 28 28 ARG HA H 1 4.57 0.0 . . . . . . 28 ARG HA . 15960 1 213 . 1 1 28 28 ARG HB2 H 1 1.63 0.0 . . . . . . 28 ARG HB2 . 15960 1 214 . 1 1 28 28 ARG HB3 H 1 1.92 0.0 . . . . . . 28 ARG HB3 . 15960 1 215 . 1 1 28 28 ARG C C 13 172.34 0.0 . . . . . . 28 ARG C . 15960 1 216 . 1 1 28 28 ARG CA C 13 54.93 0.0 . . . . . . 28 ARG CA . 15960 1 217 . 1 1 28 28 ARG CB C 13 37.09 0.0 . . . . . . 28 ARG CB . 15960 1 218 . 1 1 28 28 ARG N N 15 127.05 0.0 . . . . . . 28 ARG N . 15960 1 219 . 1 1 29 29 ASP H H 1 8.32 0.0 . . . . . . 29 ASP H . 15960 1 220 . 1 1 29 29 ASP HA H 1 4.55 0.0 . . . . . . 29 ASP HA . 15960 1 221 . 1 1 29 29 ASP HB2 H 1 2.54 0.0 . . . . . . 29 ASP HB2 . 15960 1 222 . 1 1 29 29 ASP HB3 H 1 3.1 0.0 . . . . . . 29 ASP HB3 . 15960 1 223 . 1 1 29 29 ASP C C 13 173.04 0.0 . . . . . . 29 ASP C . 15960 1 224 . 1 1 29 29 ASP CA C 13 51.35 0.0 . . . . . . 29 ASP CA . 15960 1 225 . 1 1 29 29 ASP CB C 13 30.26 0.0 . . . . . . 29 ASP CB . 15960 1 226 . 1 1 29 29 ASP N N 15 120.65 0.0 . . . . . . 29 ASP N . 15960 1 227 . 1 1 30 30 ARG H H 1 8.28 0.0 . . . . . . 30 ARG H . 15960 1 228 . 1 1 30 30 ARG HA H 1 3.46 0.0 . . . . . . 30 ARG HA . 15960 1 229 . 1 1 30 30 ARG HB3 H 1 1.64 0.0 . . . . . . 30 ARG HB3 . 15960 1 230 . 1 1 30 30 ARG HD2 H 1 3.1 0.0 . . . . . . 30 ARG HD2 . 15960 1 231 . 1 1 30 30 ARG HG2 H 1 1.34 0.0 . . . . . . 30 ARG HG2 . 15960 1 232 . 1 1 30 30 ARG C C 13 173.5 0.0 . . . . . . 30 ARG C . 15960 1 233 . 1 1 30 30 ARG CA C 13 54.8 0.0 . . . . . . 30 ARG CA . 15960 1 234 . 1 1 30 30 ARG CB C 13 28.23 0.0 . . . . . . 30 ARG CB . 15960 1 235 . 1 1 30 30 ARG N N 15 125.87 0.0 . . . . . . 30 ARG N . 15960 1 236 . 1 1 31 31 SER H H 1 8.36 0.0 . . . . . . 31 SER H . 15960 1 237 . 1 1 31 31 SER HA H 1 4.27 0.0 . . . . . . 31 SER HA . 15960 1 238 . 1 1 31 31 SER HB2 H 1 3.73 0.0 . . . . . . 31 SER HB2 . 15960 1 239 . 1 1 31 31 SER HB3 H 1 3.89 0.0 . . . . . . 31 SER HB3 . 15960 1 240 . 1 1 31 31 SER C C 13 171.72 0.0 . . . . . . 31 SER C . 15960 1 241 . 1 1 31 31 SER CA C 13 55.91 0.0 . . . . . . 31 SER CA . 15960 1 242 . 1 1 31 31 SER CB C 13 61.75 0.0 . . . . . . 31 SER CB . 15960 1 243 . 1 1 31 31 SER N N 15 113.49 0.0 . . . . . . 31 SER N . 15960 1 244 . 1 1 32 32 ASP H H 1 7.07 0.0 . . . . . . 32 ASP H . 15960 1 245 . 1 1 32 32 ASP HA H 1 4.15 0.0 . . . . . . 32 ASP HA . 15960 1 246 . 1 1 32 32 ASP HB2 H 1 2.59 0.0 . . . . . . 32 ASP HB2 . 15960 1 247 . 1 1 32 32 ASP HB3 H 1 2.62 0.0 . . . . . . 32 ASP HB3 . 15960 1 248 . 1 1 32 32 ASP C C 13 174.71 0.0 . . . . . . 32 ASP C . 15960 1 249 . 1 1 32 32 ASP CA C 13 53.0 0.0 . . . . . . 32 ASP CA . 15960 1 250 . 1 1 32 32 ASP CB C 13 41.58 0.0 . . . . . . 32 ASP CB . 15960 1 251 . 1 1 32 32 ASP N N 15 124.65 0.0 . . . . . . 32 ASP N . 15960 1 252 . 1 1 33 33 GLN H H 1 8.85 0.0 . . . . . . 33 GLN H . 15960 1 253 . 1 1 33 33 GLN HA H 1 3.89 0.0 . . . . . . 33 GLN HA . 15960 1 254 . 1 1 33 33 GLN HB2 H 1 1.4 0.0 . . . . . . 33 GLN HB2 . 15960 1 255 . 1 1 33 33 GLN HB3 H 1 1.64 0.0 . . . . . . 33 GLN HB3 . 15960 1 256 . 1 1 33 33 GLN HE21 H 1 7.36 0.0 . . . . . . 33 GLN HE21 . 15960 1 257 . 1 1 33 33 GLN HE22 H 1 6.66 0.0 . . . . . . 33 GLN HE22 . 15960 1 258 . 1 1 33 33 GLN HG2 H 1 1.98 0.0 . . . . . . 33 GLN HG2 . 15960 1 259 . 1 1 33 33 GLN C C 13 175.2 0.0 . . . . . . 33 GLN C . 15960 1 260 . 1 1 33 33 GLN CA C 13 55.35 0.0 . . . . . . 33 GLN CA . 15960 1 261 . 1 1 33 33 GLN CB C 13 26.51 0.0 . . . . . . 33 GLN CB . 15960 1 262 . 1 1 33 33 GLN N N 15 125.05 0.0 . . . . . . 33 GLN N . 15960 1 263 . 1 1 33 33 GLN NE2 N 15 112.0 0.0 . . . . . . 33 GLN NE2 . 15960 1 264 . 1 1 34 34 HIS H H 1 9.65 0.0 . . . . . . 34 HIS H . 15960 1 265 . 1 1 34 34 HIS HA H 1 3.76 0.0 . . . . . . 34 HIS HA . 15960 1 266 . 1 1 34 34 HIS HB3 H 1 2.87 0.0 . . . . . . 34 HIS HB3 . 15960 1 267 . 1 1 34 34 HIS C C 13 172.47 0.0 . . . . . . 34 HIS C . 15960 1 268 . 1 1 34 34 HIS CA C 13 56.47 0.0 . . . . . . 34 HIS CA . 15960 1 269 . 1 1 34 34 HIS CB C 13 26.16 0.0 . . . . . . 34 HIS CB . 15960 1 270 . 1 1 34 34 HIS N N 15 117.24 0.0 . . . . . . 34 HIS N . 15960 1 271 . 1 1 35 35 ILE H H 1 6.68 0.0 . . . . . . 35 ILE H . 15960 1 272 . 1 1 35 35 ILE HA H 1 4.99 0.0 . . . . . . 35 ILE HA . 15960 1 273 . 1 1 35 35 ILE HB H 1 2.3 0.0 . . . . . . 35 ILE HB . 15960 1 274 . 1 1 35 35 ILE HD11 H 1 0.54 0.0 . . . . . . 35 ILE HD11 . 15960 1 275 . 1 1 35 35 ILE HD12 H 1 0.54 0.0 . . . . . . 35 ILE HD12 . 15960 1 276 . 1 1 35 35 ILE HD13 H 1 0.54 0.0 . . . . . . 35 ILE HD13 . 15960 1 277 . 1 1 35 35 ILE HG12 H 1 1.52 0.0 . . . . . . 35 ILE HG12 . 15960 1 278 . 1 1 35 35 ILE HG21 H 1 0.82 0.0 . . . . . . 35 ILE HG21 . 15960 1 279 . 1 1 35 35 ILE HG22 H 1 0.82 0.0 . . . . . . 35 ILE HG22 . 15960 1 280 . 1 1 35 35 ILE HG23 H 1 0.82 0.0 . . . . . . 35 ILE HG23 . 15960 1 281 . 1 1 35 35 ILE C C 13 172.36 0.0 . . . . . . 35 ILE C . 15960 1 282 . 1 1 35 35 ILE CA C 13 58.22 0.0 . . . . . . 35 ILE CA . 15960 1 283 . 1 1 35 35 ILE CB C 13 35.68 0.0 . . . . . . 35 ILE CB . 15960 1 284 . 1 1 35 35 ILE N N 15 108.33 0.0 . . . . . . 35 ILE N . 15960 1 285 . 1 1 36 36 GLN H H 1 6.94 0.0 . . . . . . 36 GLN H . 15960 1 286 . 1 1 36 36 GLN HA H 1 4.12 0.0 . . . . . . 36 GLN HA . 15960 1 287 . 1 1 36 36 GLN HB2 H 1 1.78 0.0 . . . . . . 36 GLN HB2 . 15960 1 288 . 1 1 36 36 GLN HB3 H 1 1.97 0.0 . . . . . . 36 GLN HB3 . 15960 1 289 . 1 1 36 36 GLN HE21 H 1 7.44 0.0 . . . . . . 36 GLN HE21 . 15960 1 290 . 1 1 36 36 GLN HE22 H 1 6.63 0.0 . . . . . . 36 GLN HE22 . 15960 1 291 . 1 1 36 36 GLN C C 13 172.7 0.0 . . . . . . 36 GLN C . 15960 1 292 . 1 1 36 36 GLN CA C 13 54.83 0.0 . . . . . . 36 GLN CA . 15960 1 293 . 1 1 36 36 GLN CB C 13 25.08 0.0 . . . . . . 36 GLN CB . 15960 1 294 . 1 1 36 36 GLN N N 15 119.36 0.0 . . . . . . 36 GLN N . 15960 1 295 . 1 1 36 36 GLN NE2 N 15 110.1 0.0 . . . . . . 36 GLN NE2 . 15960 1 296 . 1 1 37 37 LEU H H 1 9.07 0.0 . . . . . . 37 LEU H . 15960 1 297 . 1 1 37 37 LEU HA H 1 5.18 0.0 . . . . . . 37 LEU HA . 15960 1 298 . 1 1 37 37 LEU HB2 H 1 0.88 0.0 . . . . . . 37 LEU HB2 . 15960 1 299 . 1 1 37 37 LEU HB3 H 1 1.5 0.0 . . . . . . 37 LEU HB3 . 15960 1 300 . 1 1 37 37 LEU HD11 H 1 0.72 0.0 . . . . . . 37 LEU HD11 . 15960 1 301 . 1 1 37 37 LEU HD12 H 1 0.72 0.0 . . . . . . 37 LEU HD12 . 15960 1 302 . 1 1 37 37 LEU HD13 H 1 0.72 0.0 . . . . . . 37 LEU HD13 . 15960 1 303 . 1 1 37 37 LEU HD21 H 1 0.59 0.0 . . . . . . 37 LEU HD21 . 15960 1 304 . 1 1 37 37 LEU HD22 H 1 0.59 0.0 . . . . . . 37 LEU HD22 . 15960 1 305 . 1 1 37 37 LEU HD23 H 1 0.59 0.0 . . . . . . 37 LEU HD23 . 15960 1 306 . 1 1 37 37 LEU C C 13 172.88 0.0 . . . . . . 37 LEU C . 15960 1 307 . 1 1 37 37 LEU CA C 13 51.23 0.0 . . . . . . 37 LEU CA . 15960 1 308 . 1 1 37 37 LEU CB C 13 41.96 0.0 . . . . . . 37 LEU CB . 15960 1 309 . 1 1 37 37 LEU N N 15 127.61 0.0 . . . . . . 37 LEU N . 15960 1 310 . 1 1 38 38 GLN H H 1 9.58 0.0 . . . . . . 38 GLN H . 15960 1 311 . 1 1 38 38 GLN HA H 1 4.49 0.0 . . . . . . 38 GLN HA . 15960 1 312 . 1 1 38 38 GLN HB3 H 1 1.71 0.0 . . . . . . 38 GLN HB3 . 15960 1 313 . 1 1 38 38 GLN C C 13 172.67 0.0 . . . . . . 38 GLN C . 15960 1 314 . 1 1 38 38 GLN CA C 13 51.8 0.0 . . . . . . 38 GLN CA . 15960 1 315 . 1 1 38 38 GLN CB C 13 29.06 0.0 . . . . . . 38 GLN CB . 15960 1 316 . 1 1 38 38 GLN N N 15 120.57 0.0 . . . . . . 38 GLN N . 15960 1 317 . 1 1 39 39 LEU H H 1 8.92 0.0 . . . . . . 39 LEU H . 15960 1 318 . 1 1 39 39 LEU HA H 1 5.41 0.0 . . . . . . 39 LEU HA . 15960 1 319 . 1 1 39 39 LEU HB2 H 1 1.45 0.0 . . . . . . 39 LEU HB2 . 15960 1 320 . 1 1 39 39 LEU HB3 H 1 1.52 0.0 . . . . . . 39 LEU HB3 . 15960 1 321 . 1 1 39 39 LEU HD11 H 1 0.89 0.0 . . . . . . 39 LEU HD11 . 15960 1 322 . 1 1 39 39 LEU HD12 H 1 0.89 0.0 . . . . . . 39 LEU HD12 . 15960 1 323 . 1 1 39 39 LEU HD13 H 1 0.89 0.0 . . . . . . 39 LEU HD13 . 15960 1 324 . 1 1 39 39 LEU HD21 H 1 0.79 0.0 . . . . . . 39 LEU HD21 . 15960 1 325 . 1 1 39 39 LEU HD22 H 1 0.79 0.0 . . . . . . 39 LEU HD22 . 15960 1 326 . 1 1 39 39 LEU HD23 H 1 0.79 0.0 . . . . . . 39 LEU HD23 . 15960 1 327 . 1 1 39 39 LEU C C 13 174.62 0.0 . . . . . . 39 LEU C . 15960 1 328 . 1 1 39 39 LEU CA C 13 52.92 0.0 . . . . . . 39 LEU CA . 15960 1 329 . 1 1 39 39 LEU CB C 13 40.57 0.0 . . . . . . 39 LEU CB . 15960 1 330 . 1 1 39 39 LEU N N 15 131.66 0.0 . . . . . . 39 LEU N . 15960 1 331 . 1 1 40 40 SER H H 1 8.52 0.0 . . . . . . 40 SER H . 15960 1 332 . 1 1 40 40 SER HA H 1 4.55 0.0 . . . . . . 40 SER HA . 15960 1 333 . 1 1 40 40 SER HB3 H 1 3.73 0.0 . . . . . . 40 SER HB3 . 15960 1 334 . 1 1 40 40 SER C C 13 170.02 0.0 . . . . . . 40 SER C . 15960 1 335 . 1 1 40 40 SER CA C 13 54.8 0.0 . . . . . . 40 SER CA . 15960 1 336 . 1 1 40 40 SER CB C 13 62.88 0.0 . . . . . . 40 SER CB . 15960 1 337 . 1 1 40 40 SER N N 15 115.37 0.0 . . . . . . 40 SER N . 15960 1 338 . 1 1 41 41 ALA H H 1 8.35 0.0 . . . . . . 41 ALA H . 15960 1 339 . 1 1 41 41 ALA HA H 1 4.92 0.0 . . . . . . 41 ALA HA . 15960 1 340 . 1 1 41 41 ALA HB1 H 1 1.19 0.0 . . . . . . 41 ALA HB1 . 15960 1 341 . 1 1 41 41 ALA HB2 H 1 1.19 0.0 . . . . . . 41 ALA HB2 . 15960 1 342 . 1 1 41 41 ALA HB3 H 1 1.19 0.0 . . . . . . 41 ALA HB3 . 15960 1 343 . 1 1 41 41 ALA C C 13 175.39 0.0 . . . . . . 41 ALA C . 15960 1 344 . 1 1 41 41 ALA CA C 13 49.15 0.0 . . . . . . 41 ALA CA . 15960 1 345 . 1 1 41 41 ALA CB C 13 40.32 0.0 . . . . . . 41 ALA CB . 15960 1 346 . 1 1 41 41 ALA N N 15 125.25 0.0 . . . . . . 41 ALA N . 15960 1 347 . 1 1 42 42 GLU H H 1 8.5 0.0 . . . . . . 42 GLU H . 15960 1 348 . 1 1 42 42 GLU HA H 1 4.31 0.0 . . . . . . 42 GLU HA . 15960 1 349 . 1 1 42 42 GLU HB2 H 1 1.7 0.0 . . . . . . 42 GLU HB2 . 15960 1 350 . 1 1 42 42 GLU HB3 H 1 1.89 0.0 . . . . . . 42 GLU HB3 . 15960 1 351 . 1 1 42 42 GLU HG2 H 1 2.09 0.0 . . . . . . 42 GLU HG2 . 15960 1 352 . 1 1 42 42 GLU HG3 H 1 2.22 0.0 . . . . . . 42 GLU HG3 . 15960 1 353 . 1 1 42 42 GLU C C 13 174.01 0.0 . . . . . . 42 GLU C . 15960 1 354 . 1 1 42 42 GLU CA C 13 54.7 0.0 . . . . . . 42 GLU CA . 15960 1 355 . 1 1 42 42 GLU CB C 13 28.12 0.0 . . . . . . 42 GLU CB . 15960 1 356 . 1 1 42 42 GLU N N 15 125.01 0.0 . . . . . . 42 GLU N . 15960 1 357 . 1 1 43 43 SER H H 1 8.01 0.0 . . . . . . 43 SER H . 15960 1 358 . 1 1 43 43 SER HA H 1 4.4 0.0 . . . . . . 43 SER HA . 15960 1 359 . 1 1 43 43 SER HB2 H 1 3.59 0.0 . . . . . . 43 SER HB2 . 15960 1 360 . 1 1 43 43 SER HB3 H 1 3.71 0.0 . . . . . . 43 SER HB3 . 15960 1 361 . 1 1 43 43 SER C C 13 171.06 0.0 . . . . . . 43 SER C . 15960 1 362 . 1 1 43 43 SER CA C 13 54.94 0.0 . . . . . . 43 SER CA . 15960 1 363 . 1 1 43 43 SER CB C 13 61.63 0.0 . . . . . . 43 SER CB . 15960 1 364 . 1 1 43 43 SER N N 15 113.62 0.0 . . . . . . 43 SER N . 15960 1 365 . 1 1 44 44 VAL H H 1 8.11 0.0 . . . . . . 44 VAL H . 15960 1 366 . 1 1 44 44 VAL HA H 1 3.73 0.0 . . . . . . 44 VAL HA . 15960 1 367 . 1 1 44 44 VAL HB H 1 1.92 0.0 . . . . . . 44 VAL HB . 15960 1 368 . 1 1 44 44 VAL HG11 H 1 1.08 0.0 . . . . . . 44 VAL HG11 . 15960 1 369 . 1 1 44 44 VAL HG12 H 1 1.08 0.0 . . . . . . 44 VAL HG12 . 15960 1 370 . 1 1 44 44 VAL HG13 H 1 1.08 0.0 . . . . . . 44 VAL HG13 . 15960 1 371 . 1 1 44 44 VAL HG21 H 1 0.99 0.0 . . . . . . 44 VAL HG21 . 15960 1 372 . 1 1 44 44 VAL HG22 H 1 0.99 0.0 . . . . . . 44 VAL HG22 . 15960 1 373 . 1 1 44 44 VAL HG23 H 1 0.99 0.0 . . . . . . 44 VAL HG23 . 15960 1 374 . 1 1 44 44 VAL C C 13 175.59 0.0 . . . . . . 44 VAL C . 15960 1 375 . 1 1 44 44 VAL CA C 13 62.91 0.0 . . . . . . 44 VAL CA . 15960 1 376 . 1 1 44 44 VAL CB C 13 28.85 0.0 . . . . . . 44 VAL CB . 15960 1 377 . 1 1 44 44 VAL N N 15 120.94 0.0 . . . . . . 44 VAL N . 15960 1 378 . 1 1 45 45 GLY H H 1 8.83 0.0 . . . . . . 45 GLY H . 15960 1 379 . 1 1 45 45 GLY HA2 H 1 3.87 0.0 . . . . . . 45 GLY HA2 . 15960 1 380 . 1 1 45 45 GLY HA3 H 1 4.19 0.0 . . . . . . 45 GLY HA3 . 15960 1 381 . 1 1 45 45 GLY C C 13 173.68 0.0 . . . . . . 45 GLY C . 15960 1 382 . 1 1 45 45 GLY CA C 13 43.52 0.0 . . . . . . 45 GLY CA . 15960 1 383 . 1 1 45 45 GLY N N 15 115.41 0.0 . . . . . . 45 GLY N . 15960 1 384 . 1 1 46 46 GLU H H 1 7.97 0.0 . . . . . . 46 GLU H . 15960 1 385 . 1 1 46 46 GLU HA H 1 5.31 0.0 . . . . . . 46 GLU HA . 15960 1 386 . 1 1 46 46 GLU HB2 H 1 1.7 0.0 . . . . . . 46 GLU HB2 . 15960 1 387 . 1 1 46 46 GLU HB3 H 1 1.74 0.0 . . . . . . 46 GLU HB3 . 15960 1 388 . 1 1 46 46 GLU HG2 H 1 2.01 0.0 . . . . . . 46 GLU HG2 . 15960 1 389 . 1 1 46 46 GLU HG3 H 1 2.11 0.0 . . . . . . 46 GLU HG3 . 15960 1 390 . 1 1 46 46 GLU C C 13 173.55 0.0 . . . . . . 46 GLU C . 15960 1 391 . 1 1 46 46 GLU CA C 13 52.65 0.0 . . . . . . 46 GLU CA . 15960 1 392 . 1 1 46 46 GLU CB C 13 29.22 0.0 . . . . . . 46 GLU CB . 15960 1 393 . 1 1 46 46 GLU N N 15 121.11 0.0 . . . . . . 46 GLU N . 15960 1 394 . 1 1 47 47 VAL H H 1 9.55 0.0 . . . . . . 47 VAL H . 15960 1 395 . 1 1 47 47 VAL HA H 1 5.41 0.0 . . . . . . 47 VAL HA . 15960 1 396 . 1 1 47 47 VAL HB H 1 2.16 0.0 . . . . . . 47 VAL HB . 15960 1 397 . 1 1 47 47 VAL HG11 H 1 0.99 0.0 . . . . . . 47 VAL HG11 . 15960 1 398 . 1 1 47 47 VAL HG12 H 1 0.99 0.0 . . . . . . 47 VAL HG12 . 15960 1 399 . 1 1 47 47 VAL HG13 H 1 0.99 0.0 . . . . . . 47 VAL HG13 . 15960 1 400 . 1 1 47 47 VAL HG21 H 1 0.89 0.0 . . . . . . 47 VAL HG21 . 15960 1 401 . 1 1 47 47 VAL HG22 H 1 0.89 0.0 . . . . . . 47 VAL HG22 . 15960 1 402 . 1 1 47 47 VAL HG23 H 1 0.89 0.0 . . . . . . 47 VAL HG23 . 15960 1 403 . 1 1 47 47 VAL C C 13 173.03 0.0 . . . . . . 47 VAL C . 15960 1 404 . 1 1 47 47 VAL CA C 13 56.71 0.0 . . . . . . 47 VAL CA . 15960 1 405 . 1 1 47 47 VAL CB C 13 33.53 0.0 . . . . . . 47 VAL CB . 15960 1 406 . 1 1 47 47 VAL N N 15 116.03 0.0 . . . . . . 47 VAL N . 15960 1 407 . 1 1 48 48 TYR H H 1 8.41 0.0 . . . . . . 48 TYR H . 15960 1 408 . 1 1 48 48 TYR HA H 1 5.16 0.0 . . . . . . 48 TYR HA . 15960 1 409 . 1 1 48 48 TYR HB2 H 1 2.9 0.0 . . . . . . 48 TYR HB2 . 15960 1 410 . 1 1 48 48 TYR HB3 H 1 3.15 0.0 . . . . . . 48 TYR HB3 . 15960 1 411 . 1 1 48 48 TYR C C 13 173.46 0.0 . . . . . . 48 TYR C . 15960 1 412 . 1 1 48 48 TYR CA C 13 54.31 0.0 . . . . . . 48 TYR CA . 15960 1 413 . 1 1 48 48 TYR CB C 13 39.04 0.0 . . . . . . 48 TYR CB . 15960 1 414 . 1 1 48 48 TYR N N 15 117.3 0.0 . . . . . . 48 TYR N . 15960 1 415 . 1 1 49 49 ILE H H 1 10.52 0.0 . . . . . . 49 ILE H . 15960 1 416 . 1 1 49 49 ILE HA H 1 4.18 0.0 . . . . . . 49 ILE HA . 15960 1 417 . 1 1 49 49 ILE HB H 1 1.48 0.0 . . . . . . 49 ILE HB . 15960 1 418 . 1 1 49 49 ILE HD11 H 1 -0.22 0.0 . . . . . . 49 ILE HD11 . 15960 1 419 . 1 1 49 49 ILE HD12 H 1 -0.22 0.0 . . . . . . 49 ILE HD12 . 15960 1 420 . 1 1 49 49 ILE HD13 H 1 -0.22 0.0 . . . . . . 49 ILE HD13 . 15960 1 421 . 1 1 49 49 ILE HG12 H 1 1.38 0.0 . . . . . . 49 ILE HG12 . 15960 1 422 . 1 1 49 49 ILE HG21 H 1 0.47 0.0 . . . . . . 49 ILE HG21 . 15960 1 423 . 1 1 49 49 ILE HG22 H 1 0.47 0.0 . . . . . . 49 ILE HG22 . 15960 1 424 . 1 1 49 49 ILE HG23 H 1 0.47 0.0 . . . . . . 49 ILE HG23 . 15960 1 425 . 1 1 49 49 ILE C C 13 170.82 0.0 . . . . . . 49 ILE C . 15960 1 426 . 1 1 49 49 ILE CA C 13 59.64 0.0 . . . . . . 49 ILE CA . 15960 1 427 . 1 1 49 49 ILE N N 15 122.88 0.0 . . . . . . 49 ILE N . 15960 1 428 . 1 1 50 50 LYS H H 1 8.45 0.0 . . . . . . 50 LYS H . 15960 1 429 . 1 1 50 50 LYS HA H 1 4.85 0.0 . . . . . . 50 LYS HA . 15960 1 430 . 1 1 50 50 LYS HB2 H 1 0.98 0.0 . . . . . . 50 LYS HB2 . 15960 1 431 . 1 1 50 50 LYS HB3 H 1 1.21 0.0 . . . . . . 50 LYS HB3 . 15960 1 432 . 1 1 50 50 LYS HD2 H 1 1.17 0.0 . . . . . . 50 LYS HD2 . 15960 1 433 . 1 1 50 50 LYS HE2 H 1 2.5 0.0 . . . . . . 50 LYS HE2 . 15960 1 434 . 1 1 50 50 LYS HE3 H 1 2.6 0.0 . . . . . . 50 LYS HE3 . 15960 1 435 . 1 1 50 50 LYS HG2 H 1 0.26 0.0 . . . . . . 50 LYS HG2 . 15960 1 436 . 1 1 50 50 LYS HG3 H 1 0.66 0.0 . . . . . . 50 LYS HG3 . 15960 1 437 . 1 1 50 50 LYS C C 13 173.78 0.0 . . . . . . 50 LYS C . 15960 1 438 . 1 1 50 50 LYS CA C 13 51.06 0.0 . . . . . . 50 LYS CA . 15960 1 439 . 1 1 50 50 LYS CB C 13 34.77 0.0 . . . . . . 50 LYS CB . 15960 1 440 . 1 1 50 50 LYS N N 15 125.7 0.0 . . . . . . 50 LYS N . 15960 1 441 . 1 1 51 51 SER H H 1 8.9 0.0 . . . . . . 51 SER H . 15960 1 442 . 1 1 51 51 SER HA H 1 4.54 0.0 . . . . . . 51 SER HA . 15960 1 443 . 1 1 51 51 SER HB3 H 1 3.76 0.0 . . . . . . 51 SER HB3 . 15960 1 444 . 1 1 51 51 SER C C 13 175.0 0.0 . . . . . . 51 SER C . 15960 1 445 . 1 1 51 51 SER CA C 13 54.89 0.0 . . . . . . 51 SER CA . 15960 1 446 . 1 1 51 51 SER CB C 13 61.05 0.0 . . . . . . 51 SER CB . 15960 1 447 . 1 1 51 51 SER N N 15 117.47 0.0 . . . . . . 51 SER N . 15960 1 448 . 1 1 52 52 THR H H 1 8.33 0.0 . . . . . . 52 THR H . 15960 1 449 . 1 1 52 52 THR HA H 1 3.85 0.0 . . . . . . 52 THR HA . 15960 1 450 . 1 1 52 52 THR HB H 1 4.06 0.0 . . . . . . 52 THR HB . 15960 1 451 . 1 1 52 52 THR HG21 H 1 1.15 0.0 . . . . . . 52 THR HG21 . 15960 1 452 . 1 1 52 52 THR HG22 H 1 1.15 0.0 . . . . . . 52 THR HG22 . 15960 1 453 . 1 1 52 52 THR HG23 H 1 1.15 0.0 . . . . . . 52 THR HG23 . 15960 1 454 . 1 1 52 52 THR C C 13 173.81 0.0 . . . . . . 52 THR C . 15960 1 455 . 1 1 52 52 THR CA C 13 62.94 0.0 . . . . . . 52 THR CA . 15960 1 456 . 1 1 52 52 THR CB C 13 65.53 0.0 . . . . . . 52 THR CB . 15960 1 457 . 1 1 52 52 THR N N 15 123.31 0.0 . . . . . . 52 THR N . 15960 1 458 . 1 1 53 53 GLU H H 1 8.41 0.0 . . . . . . 53 GLU H . 15960 1 459 . 1 1 53 53 GLU HA H 1 4.18 0.0 . . . . . . 53 GLU HA . 15960 1 460 . 1 1 53 53 GLU HB2 H 1 1.75 0.0 . . . . . . 53 GLU HB2 . 15960 1 461 . 1 1 53 53 GLU HB3 H 1 2.02 0.0 . . . . . . 53 GLU HB3 . 15960 1 462 . 1 1 53 53 GLU C C 13 175.35 0.0 . . . . . . 53 GLU C . 15960 1 463 . 1 1 53 53 GLU CA C 13 55.9 0.0 . . . . . . 53 GLU CA . 15960 1 464 . 1 1 53 53 GLU CB C 13 28.25 0.0 . . . . . . 53 GLU CB . 15960 1 465 . 1 1 53 53 GLU N N 15 121.72 0.0 . . . . . . 53 GLU N . 15960 1 466 . 1 1 54 54 THR H H 1 7.69 0.0 . . . . . . 54 THR H . 15960 1 467 . 1 1 54 54 THR HA H 1 4.56 0.0 . . . . . . 54 THR HA . 15960 1 468 . 1 1 54 54 THR HB H 1 4.42 0.0 . . . . . . 54 THR HB . 15960 1 469 . 1 1 54 54 THR HG21 H 1 1.26 0.0 . . . . . . 54 THR HG21 . 15960 1 470 . 1 1 54 54 THR HG22 H 1 1.26 0.0 . . . . . . 54 THR HG22 . 15960 1 471 . 1 1 54 54 THR HG23 H 1 1.26 0.0 . . . . . . 54 THR HG23 . 15960 1 472 . 1 1 54 54 THR C C 13 173.89 0.0 . . . . . . 54 THR C . 15960 1 473 . 1 1 54 54 THR CA C 13 58.58 0.0 . . . . . . 54 THR CA . 15960 1 474 . 1 1 54 54 THR CB C 13 69.06 0.0 . . . . . . 54 THR CB . 15960 1 475 . 1 1 54 54 THR N N 15 102.55 0.0 . . . . . . 54 THR N . 15960 1 476 . 1 1 55 55 GLY H H 1 7.67 0.0 . . . . . . 55 GLY H . 15960 1 477 . 1 1 55 55 GLY HA2 H 1 3.46 0.0 . . . . . . 55 GLY HA2 . 15960 1 478 . 1 1 55 55 GLY HA3 H 1 4.02 0.0 . . . . . . 55 GLY HA3 . 15960 1 479 . 1 1 55 55 GLY C C 13 170.61 0.0 . . . . . . 55 GLY C . 15960 1 480 . 1 1 55 55 GLY CA C 13 43.49 0.0 . . . . . . 55 GLY CA . 15960 1 481 . 1 1 55 55 GLY N N 15 110.6 0.0 . . . . . . 55 GLY N . 15960 1 482 . 1 1 56 56 GLN H H 1 7.13 0.0 . . . . . . 56 GLN H . 15960 1 483 . 1 1 56 56 GLN HA H 1 4.2 0.0 . . . . . . 56 GLN HA . 15960 1 484 . 1 1 56 56 GLN HE21 H 1 7.02 0.0 . . . . . . 56 GLN HE21 . 15960 1 485 . 1 1 56 56 GLN HE22 H 1 6.38 0.0 . . . . . . 56 GLN HE22 . 15960 1 486 . 1 1 56 56 GLN C C 13 172.01 0.0 . . . . . . 56 GLN C . 15960 1 487 . 1 1 56 56 GLN CA C 13 53.86 0.0 . . . . . . 56 GLN CA . 15960 1 488 . 1 1 56 56 GLN CB C 13 30.27 0.0 . . . . . . 56 GLN CB . 15960 1 489 . 1 1 56 56 GLN N N 15 115.39 0.0 . . . . . . 56 GLN N . 15960 1 490 . 1 1 56 56 GLN NE2 N 15 106.6 0.0 . . . . . . 56 GLN NE2 . 15960 1 491 . 1 1 57 57 TYR H H 1 9.25 0.0 . . . . . . 57 TYR H . 15960 1 492 . 1 1 57 57 TYR HA H 1 4.72 0.0 . . . . . . 57 TYR HA . 15960 1 493 . 1 1 57 57 TYR HB2 H 1 2.7 0.0 . . . . . . 57 TYR HB2 . 15960 1 494 . 1 1 57 57 TYR HB3 H 1 2.99 0.0 . . . . . . 57 TYR HB3 . 15960 1 495 . 1 1 57 57 TYR C C 13 173.82 0.0 . . . . . . 57 TYR C . 15960 1 496 . 1 1 57 57 TYR CA C 13 54.67 0.0 . . . . . . 57 TYR CA . 15960 1 497 . 1 1 57 57 TYR CB C 13 38.58 0.0 . . . . . . 57 TYR CB . 15960 1 498 . 1 1 57 57 TYR N N 15 119.1 0.0 . . . . . . 57 TYR N . 15960 1 499 . 1 1 58 58 LEU H H 1 9.06 0.0 . . . . . . 58 LEU H . 15960 1 500 . 1 1 58 58 LEU HA H 1 4.01 0.0 . . . . . . 58 LEU HA . 15960 1 501 . 1 1 58 58 LEU HB2 H 1 0.91 0.0 . . . . . . 58 LEU HB2 . 15960 1 502 . 1 1 58 58 LEU HB3 H 1 1.77 0.0 . . . . . . 58 LEU HB3 . 15960 1 503 . 1 1 58 58 LEU HD11 H 1 0.2 0.0 . . . . . . 58 LEU HD11 . 15960 1 504 . 1 1 58 58 LEU HD12 H 1 0.2 0.0 . . . . . . 58 LEU HD12 . 15960 1 505 . 1 1 58 58 LEU HD13 H 1 0.2 0.0 . . . . . . 58 LEU HD13 . 15960 1 506 . 1 1 58 58 LEU HG H 1 1.64 0.0 . . . . . . 58 LEU HG . 15960 1 507 . 1 1 58 58 LEU C C 13 172.4 0.0 . . . . . . 58 LEU C . 15960 1 508 . 1 1 58 58 LEU CA C 13 53.29 0.0 . . . . . . 58 LEU CA . 15960 1 509 . 1 1 58 58 LEU CB C 13 40.35 0.0 . . . . . . 58 LEU CB . 15960 1 510 . 1 1 58 58 LEU N N 15 123.4 0.0 . . . . . . 58 LEU N . 15960 1 511 . 1 1 59 59 ALA H H 1 8.59 0.0 . . . . . . 59 ALA H . 15960 1 512 . 1 1 59 59 ALA HA H 1 4.99 0.0 . . . . . . 59 ALA HA . 15960 1 513 . 1 1 59 59 ALA HB1 H 1 0.5 0.0 . . . . . . 59 ALA HB1 . 15960 1 514 . 1 1 59 59 ALA HB2 H 1 0.5 0.0 . . . . . . 59 ALA HB2 . 15960 1 515 . 1 1 59 59 ALA HB3 H 1 0.5 0.0 . . . . . . 59 ALA HB3 . 15960 1 516 . 1 1 59 59 ALA C C 13 172.62 0.0 . . . . . . 59 ALA C . 15960 1 517 . 1 1 59 59 ALA CA C 13 48.5 0.0 . . . . . . 59 ALA CA . 15960 1 518 . 1 1 59 59 ALA CB C 13 21.16 0.0 . . . . . . 59 ALA CB . 15960 1 519 . 1 1 59 59 ALA N N 15 126.6 0.0 . . . . . . 59 ALA N . 15960 1 520 . 1 1 60 60 MET H H 1 7.53 0.0 . . . . . . 60 MET H . 15960 1 521 . 1 1 60 60 MET HA H 1 5.45 0.0 . . . . . . 60 MET HA . 15960 1 522 . 1 1 60 60 MET HB2 H 1 2.07 0.0 . . . . . . 60 MET HB2 . 15960 1 523 . 1 1 60 60 MET HB3 H 1 2.34 0.0 . . . . . . 60 MET HB3 . 15960 1 524 . 1 1 60 60 MET C C 13 173.7 0.0 . . . . . . 60 MET C . 15960 1 525 . 1 1 60 60 MET CA C 13 52.14 0.0 . . . . . . 60 MET CA . 15960 1 526 . 1 1 60 60 MET CB C 13 34.98 0.0 . . . . . . 60 MET CB . 15960 1 527 . 1 1 60 60 MET N N 15 116.57 0.0 . . . . . . 60 MET N . 15960 1 528 . 1 1 61 61 ASP H H 1 9.22 0.0 . . . . . . 61 ASP H . 15960 1 529 . 1 1 61 61 ASP HA H 1 4.94 0.0 . . . . . . 61 ASP HA . 15960 1 530 . 1 1 61 61 ASP HB2 H 1 2.74 0.0 . . . . . . 61 ASP HB2 . 15960 1 531 . 1 1 61 61 ASP HB3 H 1 3.48 0.0 . . . . . . 61 ASP HB3 . 15960 1 532 . 1 1 61 61 ASP C C 13 175.94 0.0 . . . . . . 61 ASP C . 15960 1 533 . 1 1 61 61 ASP CA C 13 51.33 0.0 . . . . . . 61 ASP CA . 15960 1 534 . 1 1 61 61 ASP CB C 13 39.29 0.0 . . . . . . 61 ASP CB . 15960 1 535 . 1 1 61 61 ASP N N 15 128.18 0.0 . . . . . . 61 ASP N . 15960 1 536 . 1 1 62 62 THR H H 1 7.98 0.0 . . . . . . 62 THR H . 15960 1 537 . 1 1 62 62 THR HA H 1 4.02 0.0 . . . . . . 62 THR HA . 15960 1 538 . 1 1 62 62 THR HB H 1 4.36 0.0 . . . . . . 62 THR HB . 15960 1 539 . 1 1 62 62 THR HG21 H 1 1.32 0.0 . . . . . . 62 THR HG21 . 15960 1 540 . 1 1 62 62 THR HG22 H 1 1.32 0.0 . . . . . . 62 THR HG22 . 15960 1 541 . 1 1 62 62 THR HG23 H 1 1.32 0.0 . . . . . . 62 THR HG23 . 15960 1 542 . 1 1 62 62 THR C C 13 172.45 0.0 . . . . . . 62 THR C . 15960 1 543 . 1 1 62 62 THR CA C 13 62.73 0.0 . . . . . . 62 THR CA . 15960 1 544 . 1 1 62 62 THR CB C 13 66.89 0.0 . . . . . . 62 THR CB . 15960 1 545 . 1 1 62 62 THR N N 15 107.75 0.0 . . . . . . 62 THR N . 15960 1 546 . 1 1 63 63 ASP H H 1 8.28 0.0 . . . . . . 63 ASP H . 15960 1 547 . 1 1 63 63 ASP HA H 1 4.85 0.0 . . . . . . 63 ASP HA . 15960 1 548 . 1 1 63 63 ASP HB3 H 1 2.62 0.0 . . . . . . 63 ASP HB3 . 15960 1 549 . 1 1 63 63 ASP C C 13 173.83 0.0 . . . . . . 63 ASP C . 15960 1 550 . 1 1 63 63 ASP CA C 13 51.95 0.0 . . . . . . 63 ASP CA . 15960 1 551 . 1 1 63 63 ASP CB C 13 39.8 0.0 . . . . . . 63 ASP CB . 15960 1 552 . 1 1 63 63 ASP N N 15 119.24 0.0 . . . . . . 63 ASP N . 15960 1 553 . 1 1 64 64 GLY H H 1 8.26 0.0 . . . . . . 64 GLY H . 15960 1 554 . 1 1 64 64 GLY HA2 H 1 3.19 0.0 . . . . . . 64 GLY HA2 . 15960 1 555 . 1 1 64 64 GLY HA3 H 1 3.48 0.0 . . . . . . 64 GLY HA3 . 15960 1 556 . 1 1 64 64 GLY C C 13 171.32 0.0 . . . . . . 64 GLY C . 15960 1 557 . 1 1 64 64 GLY CA C 13 42.89 0.0 . . . . . . 64 GLY CA . 15960 1 558 . 1 1 64 64 GLY N N 15 109.31 0.0 . . . . . . 64 GLY N . 15960 1 559 . 1 1 65 65 LEU H H 1 8.54 0.0 . . . . . . 65 LEU H . 15960 1 560 . 1 1 65 65 LEU HA H 1 4.62 0.0 . . . . . . 65 LEU HA . 15960 1 561 . 1 1 65 65 LEU HB2 H 1 1.54 0.0 . . . . . . 65 LEU HB2 . 15960 1 562 . 1 1 65 65 LEU HB3 H 1 2.06 0.0 . . . . . . 65 LEU HB3 . 15960 1 563 . 1 1 65 65 LEU HD11 H 1 0.8 0.0 . . . . . . 65 LEU HD11 . 15960 1 564 . 1 1 65 65 LEU HD12 H 1 0.8 0.0 . . . . . . 65 LEU HD12 . 15960 1 565 . 1 1 65 65 LEU HD13 H 1 0.8 0.0 . . . . . . 65 LEU HD13 . 15960 1 566 . 1 1 65 65 LEU HG H 1 1.764 0.0 . . . . . . 65 LEU HG . 15960 1 567 . 1 1 65 65 LEU C C 13 177.22 0.0 . . . . . . 65 LEU C . 15960 1 568 . 1 1 65 65 LEU CA C 13 51.95 0.0 . . . . . . 65 LEU CA . 15960 1 569 . 1 1 65 65 LEU N N 15 123.81 0.0 . . . . . . 65 LEU N . 15960 1 570 . 1 1 66 66 LEU H H 1 7.5 0.0 . . . . . . 66 LEU H . 15960 1 571 . 1 1 66 66 LEU HA H 1 5.58 0.0 . . . . . . 66 LEU HA . 15960 1 572 . 1 1 66 66 LEU HB2 H 1 1.29 0.0 . . . . . . 66 LEU HB2 . 15960 1 573 . 1 1 66 66 LEU HB3 H 1 1.95 0.0 . . . . . . 66 LEU HB3 . 15960 1 574 . 1 1 66 66 LEU HD11 H 1 1.42 0.0 . . . . . . 66 LEU HD11 . 15960 1 575 . 1 1 66 66 LEU HD12 H 1 1.42 0.0 . . . . . . 66 LEU HD12 . 15960 1 576 . 1 1 66 66 LEU HD13 H 1 1.42 0.0 . . . . . . 66 LEU HD13 . 15960 1 577 . 1 1 66 66 LEU HD21 H 1 1.02 0.0 . . . . . . 66 LEU HD21 . 15960 1 578 . 1 1 66 66 LEU HD22 H 1 1.02 0.0 . . . . . . 66 LEU HD22 . 15960 1 579 . 1 1 66 66 LEU HD23 H 1 1.02 0.0 . . . . . . 66 LEU HD23 . 15960 1 580 . 1 1 66 66 LEU HG H 1 2.13 0.0 . . . . . . 66 LEU HG . 15960 1 581 . 1 1 66 66 LEU C C 13 174.65 0.0 . . . . . . 66 LEU C . 15960 1 582 . 1 1 66 66 LEU CA C 13 51.51 0.0 . . . . . . 66 LEU CA . 15960 1 583 . 1 1 66 66 LEU CB C 13 40.26 0.0 . . . . . . 66 LEU CB . 15960 1 584 . 1 1 66 66 LEU N N 15 123.85 0.0 . . . . . . 66 LEU N . 15960 1 585 . 1 1 67 67 TYR H H 1 9.25 0.0 . . . . . . 67 TYR H . 15960 1 586 . 1 1 67 67 TYR HA H 1 4.86 0.0 . . . . . . 67 TYR HA . 15960 1 587 . 1 1 67 67 TYR HB3 H 1 2.97 0.0 . . . . . . 67 TYR HB3 . 15960 1 588 . 1 1 67 67 TYR HD1 H 1 7.04 0.0 . . . . . . 67 TYR HD1 . 15960 1 589 . 1 1 67 67 TYR HD2 H 1 7.04 0.0 . . . . . . 67 TYR HD2 . 15960 1 590 . 1 1 67 67 TYR HE1 H 1 6.44 0.0 . . . . . . 67 TYR HE1 . 15960 1 591 . 1 1 67 67 TYR HE2 H 1 6.44 0.0 . . . . . . 67 TYR HE2 . 15960 1 592 . 1 1 67 67 TYR C C 13 169.51 0.0 . . . . . . 67 TYR C . 15960 1 593 . 1 1 67 67 TYR CA C 13 54.02 0.0 . . . . . . 67 TYR CA . 15960 1 594 . 1 1 67 67 TYR CB C 13 38.82 0.0 . . . . . . 67 TYR CB . 15960 1 595 . 1 1 67 67 TYR N N 15 120.45 0.0 . . . . . . 67 TYR N . 15960 1 596 . 1 1 68 68 GLY H H 1 8.79 0.0 . . . . . . 68 GLY H . 15960 1 597 . 1 1 68 68 GLY HA2 H 1 2.98 0.0 . . . . . . 68 GLY HA2 . 15960 1 598 . 1 1 68 68 GLY HA3 H 1 4.55 0.0 . . . . . . 68 GLY HA3 . 15960 1 599 . 1 1 68 68 GLY C C 13 170.58 0.0 . . . . . . 68 GLY C . 15960 1 600 . 1 1 68 68 GLY CA C 13 41.36 0.0 . . . . . . 68 GLY CA . 15960 1 601 . 1 1 68 68 GLY N N 15 105.17 0.0 . . . . . . 68 GLY N . 15960 1 602 . 1 1 69 69 SER H H 1 9.61 0.0 . . . . . . 69 SER H . 15960 1 603 . 1 1 69 69 SER HA H 1 4.86 0.0 . . . . . . 69 SER HA . 15960 1 604 . 1 1 69 69 SER HB2 H 1 3.42 0.0 . . . . . . 69 SER HB2 . 15960 1 605 . 1 1 69 69 SER HB3 H 1 3.79 0.0 . . . . . . 69 SER HB3 . 15960 1 606 . 1 1 69 69 SER C C 13 174.25 0.0 . . . . . . 69 SER C . 15960 1 607 . 1 1 69 69 SER CA C 13 53.59 0.0 . . . . . . 69 SER CA . 15960 1 608 . 1 1 69 69 SER CB C 13 63.03 0.0 . . . . . . 69 SER CB . 15960 1 609 . 1 1 69 69 SER N N 15 119.63 0.0 . . . . . . 69 SER N . 15960 1 610 . 1 1 70 70 GLN H H 1 9.3 0.0 . . . . . . 70 GLN H . 15960 1 611 . 1 1 70 70 GLN HA H 1 4.19 0.0 . . . . . . 70 GLN HA . 15960 1 612 . 1 1 70 70 GLN HB2 H 1 2.08 0.0 . . . . . . 70 GLN HB2 . 15960 1 613 . 1 1 70 70 GLN HB3 H 1 2.22 0.0 . . . . . . 70 GLN HB3 . 15960 1 614 . 1 1 70 70 GLN HE21 H 1 7.36 0.0 . . . . . . 70 GLN HE21 . 15960 1 615 . 1 1 70 70 GLN HE22 H 1 6.86 0.0 . . . . . . 70 GLN HE22 . 15960 1 616 . 1 1 70 70 GLN C C 13 173.24 0.0 . . . . . . 70 GLN C . 15960 1 617 . 1 1 70 70 GLN CA C 13 56.05 0.0 . . . . . . 70 GLN CA . 15960 1 618 . 1 1 70 70 GLN CB C 13 31.75 0.0 . . . . . . 70 GLN CB . 15960 1 619 . 1 1 70 70 GLN N N 15 126.95 0.0 . . . . . . 70 GLN N . 15960 1 620 . 1 1 70 70 GLN NE2 N 15 112.2 0.0 . . . . . . 70 GLN NE2 . 15960 1 621 . 1 1 71 71 THR H H 1 7.52 0.0 . . . . . . 71 THR H . 15960 1 622 . 1 1 71 71 THR HA H 1 4.71 0.0 . . . . . . 71 THR HA . 15960 1 623 . 1 1 71 71 THR HG21 H 1 1.1 0.0 . . . . . . 71 THR HG21 . 15960 1 624 . 1 1 71 71 THR HG22 H 1 1.1 0.0 . . . . . . 71 THR HG22 . 15960 1 625 . 1 1 71 71 THR HG23 H 1 1.1 0.0 . . . . . . 71 THR HG23 . 15960 1 626 . 1 1 71 71 THR CA C 13 55.2 0.0 . . . . . . 71 THR CA . 15960 1 627 . 1 1 71 71 THR N N 15 107.86 0.0 . . . . . . 71 THR N . 15960 1 628 . 1 1 72 72 PRO HA H 1 4.06 0.0 . . . . . . 72 PRO HA . 15960 1 629 . 1 1 72 72 PRO HB2 H 1 0.2 0.0 . . . . . . 72 PRO HB2 . 15960 1 630 . 1 1 72 72 PRO HB3 H 1 1.17 0.0 . . . . . . 72 PRO HB3 . 15960 1 631 . 1 1 72 72 PRO HD2 H 1 3.35 0.0 . . . . . . 72 PRO HD2 . 15960 1 632 . 1 1 72 72 PRO HD3 H 1 3.47 0.0 . . . . . . 72 PRO HD3 . 15960 1 633 . 1 1 72 72 PRO C C 13 172.95 0.0 . . . . . . 72 PRO C . 15960 1 634 . 1 1 72 72 PRO CA C 13 59.97 0.0 . . . . . . 72 PRO CA . 15960 1 635 . 1 1 72 72 PRO CB C 13 26.64 0.0 . . . . . . 72 PRO CB . 15960 1 636 . 1 1 73 73 ASN H H 1 7.32 0.0 . . . . . . 73 ASN H . 15960 1 637 . 1 1 73 73 ASN HA H 1 4.64 0.0 . . . . . . 73 ASN HA . 15960 1 638 . 1 1 73 73 ASN HB2 H 1 2.9 0.0 . . . . . . 73 ASN HB2 . 15960 1 639 . 1 1 73 73 ASN HB3 H 1 3.08 0.0 . . . . . . 73 ASN HB3 . 15960 1 640 . 1 1 73 73 ASN CA C 13 49.98 0.0 . . . . . . 73 ASN CA . 15960 1 641 . 1 1 73 73 ASN N N 15 118.76 0.0 . . . . . . 73 ASN N . 15960 1 642 . 1 1 74 74 GLU H H 1 9.03 0.0 . . . . . . 74 GLU H . 15960 1 643 . 1 1 74 74 GLU HA H 1 4.02 0.0 . . . . . . 74 GLU HA . 15960 1 644 . 1 1 74 74 GLU HB2 H 1 1.93 0.0 . . . . . . 74 GLU HB2 . 15960 1 645 . 1 1 74 74 GLU HB3 H 1 2.03 0.0 . . . . . . 74 GLU HB3 . 15960 1 646 . 1 1 74 74 GLU C C 13 176.34 0.0 . . . . . . 74 GLU C . 15960 1 647 . 1 1 74 74 GLU CA C 13 57.1 0.0 . . . . . . 74 GLU CA . 15960 1 648 . 1 1 74 74 GLU CB C 13 26.86 0.0 . . . . . . 74 GLU CB . 15960 1 649 . 1 1 75 75 GLU H H 1 8.55 0.0 . . . . . . 75 GLU H . 15960 1 650 . 1 1 75 75 GLU HA H 1 4.07 0.0 . . . . . . 75 GLU HA . 15960 1 651 . 1 1 75 75 GLU HB2 H 1 2.33 0.0 . . . . . . 75 GLU HB2 . 15960 1 652 . 1 1 75 75 GLU HB3 H 1 2.5 0.0 . . . . . . 75 GLU HB3 . 15960 1 653 . 1 1 75 75 GLU C C 13 173.8 0.0 . . . . . . 75 GLU C . 15960 1 654 . 1 1 75 75 GLU CA C 13 56.13 0.0 . . . . . . 75 GLU CA . 15960 1 655 . 1 1 75 75 GLU CB C 13 25.82 0.0 . . . . . . 75 GLU CB . 15960 1 656 . 1 1 75 75 GLU N N 15 118.96 0.0 . . . . . . 75 GLU N . 15960 1 657 . 1 1 76 76 CYS H H 1 7.72 0.0 . . . . . . 76 CYS H . 15960 1 658 . 1 1 76 76 CYS HA H 1 5.31 0.0 . . . . . . 76 CYS HA . 15960 1 659 . 1 1 76 76 CYS HB2 H 1 3.2 0.0 . . . . . . 76 CYS HB2 . 15960 1 660 . 1 1 76 76 CYS HB3 H 1 3.61 0.0 . . . . . . 76 CYS HB3 . 15960 1 661 . 1 1 76 76 CYS C C 13 170.93 0.0 . . . . . . 76 CYS C . 15960 1 662 . 1 1 76 76 CYS CA C 13 55.53 0.0 . . . . . . 76 CYS CA . 15960 1 663 . 1 1 76 76 CYS CB C 13 25.77 0.0 . . . . . . 76 CYS CB . 15960 1 664 . 1 1 76 76 CYS N N 15 113.26 0.0 . . . . . . 76 CYS N . 15960 1 665 . 1 1 77 77 LEU H H 1 6.23 0.0 . . . . . . 77 LEU H . 15960 1 666 . 1 1 77 77 LEU HA H 1 4.43 0.0 . . . . . . 77 LEU HA . 15960 1 667 . 1 1 77 77 LEU HB2 H 1 1.03 0.0 . . . . . . 77 LEU HB2 . 15960 1 668 . 1 1 77 77 LEU HB3 H 1 1.3 0.0 . . . . . . 77 LEU HB3 . 15960 1 669 . 1 1 77 77 LEU HD11 H 1 0.65 0.0 . . . . . . 77 LEU HD11 . 15960 1 670 . 1 1 77 77 LEU HD12 H 1 0.65 0.0 . . . . . . 77 LEU HD12 . 15960 1 671 . 1 1 77 77 LEU HD13 H 1 0.65 0.0 . . . . . . 77 LEU HD13 . 15960 1 672 . 1 1 77 77 LEU HD21 H 1 0.38 0.0 . . . . . . 77 LEU HD21 . 15960 1 673 . 1 1 77 77 LEU HD22 H 1 0.38 0.0 . . . . . . 77 LEU HD22 . 15960 1 674 . 1 1 77 77 LEU HD23 H 1 0.38 0.0 . . . . . . 77 LEU HD23 . 15960 1 675 . 1 1 77 77 LEU HG H 1 1.27 0.0 . . . . . . 77 LEU HG . 15960 1 676 . 1 1 77 77 LEU C C 13 173.85 0.0 . . . . . . 77 LEU C . 15960 1 677 . 1 1 77 77 LEU CA C 13 51.76 0.0 . . . . . . 77 LEU CA . 15960 1 678 . 1 1 77 77 LEU CB C 13 42.14 0.0 . . . . . . 77 LEU CB . 15960 1 679 . 1 1 77 77 LEU N N 15 117.8 0.0 . . . . . . 77 LEU N . 15960 1 680 . 1 1 78 78 PHE H H 1 9.11 0.0 . . . . . . 78 PHE H . 15960 1 681 . 1 1 78 78 PHE HA H 1 5.01 0.0 . . . . . . 78 PHE HA . 15960 1 682 . 1 1 78 78 PHE HB2 H 1 2.67 0.0 . . . . . . 78 PHE HB2 . 15960 1 683 . 1 1 78 78 PHE HB3 H 1 2.82 0.0 . . . . . . 78 PHE HB3 . 15960 1 684 . 1 1 78 78 PHE C C 13 171.94 0.0 . . . . . . 78 PHE C . 15960 1 685 . 1 1 78 78 PHE CA C 13 54.82 0.0 . . . . . . 78 PHE CA . 15960 1 686 . 1 1 78 78 PHE CB C 13 40.42 0.0 . . . . . . 78 PHE CB . 15960 1 687 . 1 1 78 78 PHE N N 15 122.18 0.0 . . . . . . 78 PHE N . 15960 1 688 . 1 1 79 79 LEU H H 1 9.95 0.0 . . . . . . 79 LEU H . 15960 1 689 . 1 1 79 79 LEU HA H 1 5.08 0.0 . . . . . . 79 LEU HA . 15960 1 690 . 1 1 79 79 LEU HB2 H 1 1.34 0.0 . . . . . . 79 LEU HB2 . 15960 1 691 . 1 1 79 79 LEU HB3 H 1 1.78 0.0 . . . . . . 79 LEU HB3 . 15960 1 692 . 1 1 79 79 LEU HD11 H 1 0.87 0.0 . . . . . . 79 LEU HD11 . 15960 1 693 . 1 1 79 79 LEU HD12 H 1 0.87 0.0 . . . . . . 79 LEU HD12 . 15960 1 694 . 1 1 79 79 LEU HD13 H 1 0.87 0.0 . . . . . . 79 LEU HD13 . 15960 1 695 . 1 1 79 79 LEU HG H 1 1.51 0.0 . . . . . . 79 LEU HG . 15960 1 696 . 1 1 79 79 LEU C C 13 173.7 0.0 . . . . . . 79 LEU C . 15960 1 697 . 1 1 79 79 LEU CA C 13 51.03 0.0 . . . . . . 79 LEU CA . 15960 1 698 . 1 1 79 79 LEU CB C 13 38.56 0.0 . . . . . . 79 LEU CB . 15960 1 699 . 1 1 79 79 LEU N N 15 121.78 0.0 . . . . . . 79 LEU N . 15960 1 700 . 1 1 80 80 GLU H H 1 8.18 0.0 . . . . . . 80 GLU H . 15960 1 701 . 1 1 80 80 GLU HA H 1 4.73 0.0 . . . . . . 80 GLU HA . 15960 1 702 . 1 1 80 80 GLU HB2 H 1 1.8 0.0 . . . . . . 80 GLU HB2 . 15960 1 703 . 1 1 80 80 GLU HB3 H 1 1.91 0.0 . . . . . . 80 GLU HB3 . 15960 1 704 . 1 1 80 80 GLU C C 13 173.41 0.0 . . . . . . 80 GLU C . 15960 1 705 . 1 1 80 80 GLU CA C 13 52.37 0.0 . . . . . . 80 GLU CA . 15960 1 706 . 1 1 80 80 GLU CB C 13 30.91 0.0 . . . . . . 80 GLU CB . 15960 1 707 . 1 1 80 80 GLU N N 15 125.88 0.0 . . . . . . 80 GLU N . 15960 1 708 . 1 1 81 81 ARG H H 1 8.81 0.0 . . . . . . 81 ARG H . 15960 1 709 . 1 1 81 81 ARG HA H 1 4.59 0.0 . . . . . . 81 ARG HA . 15960 1 710 . 1 1 81 81 ARG HB2 H 1 1.71 0.0 . . . . . . 81 ARG HB2 . 15960 1 711 . 1 1 81 81 ARG HB3 H 1 1.73 0.0 . . . . . . 81 ARG HB3 . 15960 1 712 . 1 1 81 81 ARG HD2 H 1 3.21 0.0 . . . . . . 81 ARG HD2 . 15960 1 713 . 1 1 81 81 ARG HG2 H 1 1.5 0.0 . . . . . . 81 ARG HG2 . 15960 1 714 . 1 1 81 81 ARG C C 13 172.23 0.0 . . . . . . 81 ARG C . 15960 1 715 . 1 1 81 81 ARG CA C 13 51.13 0.0 . . . . . . 81 ARG CA . 15960 1 716 . 1 1 81 81 ARG CB C 13 30.25 0.0 . . . . . . 81 ARG CB . 15960 1 717 . 1 1 81 81 ARG N N 15 129.58 0.0 . . . . . . 81 ARG N . 15960 1 718 . 1 1 82 82 LEU H H 1 8.32 0.0 . . . . . . 82 LEU H . 15960 1 719 . 1 1 82 82 LEU HA H 1 4.75 0.0 . . . . . . 82 LEU HA . 15960 1 720 . 1 1 82 82 LEU HB2 H 1 1.37 0.0 . . . . . . 82 LEU HB2 . 15960 1 721 . 1 1 82 82 LEU HB3 H 1 1.62 0.0 . . . . . . 82 LEU HB3 . 15960 1 722 . 1 1 82 82 LEU HD11 H 1 0.86 0.0 . . . . . . 82 LEU HD11 . 15960 1 723 . 1 1 82 82 LEU HD12 H 1 0.86 0.0 . . . . . . 82 LEU HD12 . 15960 1 724 . 1 1 82 82 LEU HD13 H 1 0.86 0.0 . . . . . . 82 LEU HD13 . 15960 1 725 . 1 1 82 82 LEU HG H 1 1.64 0.0 . . . . . . 82 LEU HG . 15960 1 726 . 1 1 82 82 LEU C C 13 174.56 0.0 . . . . . . 82 LEU C . 15960 1 727 . 1 1 82 82 LEU CA C 13 52.75 0.0 . . . . . . 82 LEU CA . 15960 1 728 . 1 1 82 82 LEU CB C 13 40.21 0.0 . . . . . . 82 LEU CB . 15960 1 729 . 1 1 82 82 LEU N N 15 125.76 0.0 . . . . . . 82 LEU N . 15960 1 730 . 1 1 83 83 GLU H H 1 9.09 0.0 . . . . . . 83 GLU H . 15960 1 731 . 1 1 83 83 GLU HA H 1 4.6 0.0 . . . . . . 83 GLU HA . 15960 1 732 . 1 1 83 83 GLU HB3 H 1 2.12 0.0 . . . . . . 83 GLU HB3 . 15960 1 733 . 1 1 83 83 GLU CA C 13 52.13 0.0 . . . . . . 83 GLU CA . 15960 1 734 . 1 1 83 83 GLU CB C 13 30.3 0.0 . . . . . . 83 GLU CB . 15960 1 735 . 1 1 83 83 GLU N N 15 125.69 0.0 . . . . . . 83 GLU N . 15960 1 736 . 1 1 84 84 GLU H H 1 8.72 0.0 . . . . . . 84 GLU H . 15960 1 737 . 1 1 84 84 GLU HA H 1 3.99 0.0 . . . . . . 84 GLU HA . 15960 1 738 . 1 1 84 84 GLU HB3 H 1 2.0 0.0 . . . . . . 84 GLU HB3 . 15960 1 739 . 1 1 84 84 GLU CA C 13 55.47 0.0 . . . . . . 84 GLU CA . 15960 1 740 . 1 1 84 84 GLU CB C 13 27.26 0.0 . . . . . . 84 GLU CB . 15960 1 741 . 1 1 84 84 GLU N N 15 119.73 0.0 . . . . . . 84 GLU N . 15960 1 742 . 1 1 85 85 ASN H H 1 8.46 0.0 . . . . . . 85 ASN H . 15960 1 743 . 1 1 85 85 ASN HA H 1 4.21 0.0 . . . . . . 85 ASN HA . 15960 1 744 . 1 1 85 85 ASN HB2 H 1 2.9 0.0 . . . . . . 85 ASN HB2 . 15960 1 745 . 1 1 85 85 ASN HB3 H 1 2.94 0.0 . . . . . . 85 ASN HB3 . 15960 1 746 . 1 1 85 85 ASN C C 13 172.13 0.0 . . . . . . 85 ASN C . 15960 1 747 . 1 1 85 85 ASN CA C 13 51.87 0.0 . . . . . . 85 ASN CA . 15960 1 748 . 1 1 85 85 ASN CB C 13 35.12 0.0 . . . . . . 85 ASN CB . 15960 1 749 . 1 1 85 85 ASN N N 15 114.47 0.0 . . . . . . 85 ASN N . 15960 1 750 . 1 1 86 86 HIS H H 1 8.08 0.0 . . . . . . 86 HIS H . 15960 1 751 . 1 1 86 86 HIS HA H 1 4.14 0.0 . . . . . . 86 HIS HA . 15960 1 752 . 1 1 86 86 HIS HB2 H 1 3.14 0.0 . . . . . . 86 HIS HB2 . 15960 1 753 . 1 1 86 86 HIS HB3 H 1 3.28 0.0 . . . . . . 86 HIS HB3 . 15960 1 754 . 1 1 86 86 HIS C C 13 171.13 0.0 . . . . . . 86 HIS C . 15960 1 755 . 1 1 86 86 HIS CA C 13 55.25 0.0 . . . . . . 86 HIS CA . 15960 1 756 . 1 1 86 86 HIS CB C 13 25.25 0.0 . . . . . . 86 HIS CB . 15960 1 757 . 1 1 86 86 HIS N N 15 108.39 0.0 . . . . . . 86 HIS N . 15960 1 758 . 1 1 87 87 TYR H H 1 7.56 0.0 . . . . . . 87 TYR H . 15960 1 759 . 1 1 87 87 TYR HA H 1 4.74 0.0 . . . . . . 87 TYR HA . 15960 1 760 . 1 1 87 87 TYR HB3 H 1 2.99 0.0 . . . . . . 87 TYR HB3 . 15960 1 761 . 1 1 87 87 TYR C C 13 171.98 0.0 . . . . . . 87 TYR C . 15960 1 762 . 1 1 87 87 TYR CA C 13 55.96 0.0 . . . . . . 87 TYR CA . 15960 1 763 . 1 1 87 87 TYR CB C 13 38.63 0.0 . . . . . . 87 TYR CB . 15960 1 764 . 1 1 87 87 TYR N N 15 117.6 0.0 . . . . . . 87 TYR N . 15960 1 765 . 1 1 88 88 ASN H H 1 9.82 0.0 . . . . . . 88 ASN H . 15960 1 766 . 1 1 88 88 ASN HA H 1 5.75 0.0 . . . . . . 88 ASN HA . 15960 1 767 . 1 1 88 88 ASN HB2 H 1 2.31 0.0 . . . . . . 88 ASN HB2 . 15960 1 768 . 1 1 88 88 ASN HB3 H 1 2.54 0.0 . . . . . . 88 ASN HB3 . 15960 1 769 . 1 1 88 88 ASN HD21 H 1 6.72 0.0 . . . . . . 88 ASN HD21 . 15960 1 770 . 1 1 88 88 ASN HD22 H 1 6.5 0.0 . . . . . . 88 ASN HD22 . 15960 1 771 . 1 1 88 88 ASN C C 13 172.65 0.0 . . . . . . 88 ASN C . 15960 1 772 . 1 1 88 88 ASN CA C 13 49.9 0.0 . . . . . . 88 ASN CA . 15960 1 773 . 1 1 88 88 ASN CB C 13 40.4 0.0 . . . . . . 88 ASN CB . 15960 1 774 . 1 1 88 88 ASN N N 15 118.37 0.0 . . . . . . 88 ASN N . 15960 1 775 . 1 1 88 88 ASN ND2 N 15 106.93 0.0 . . . . . . 88 ASN ND2 . 15960 1 776 . 1 1 89 89 THR H H 1 8.4 0.0 . . . . . . 89 THR H . 15960 1 777 . 1 1 89 89 THR HA H 1 5.02 0.0 . . . . . . 89 THR HA . 15960 1 778 . 1 1 89 89 THR HB H 1 4.45 0.0 . . . . . . 89 THR HB . 15960 1 779 . 1 1 89 89 THR HG21 H 1 1.31 0.0 . . . . . . 89 THR HG21 . 15960 1 780 . 1 1 89 89 THR HG22 H 1 1.31 0.0 . . . . . . 89 THR HG22 . 15960 1 781 . 1 1 89 89 THR HG23 H 1 1.31 0.0 . . . . . . 89 THR HG23 . 15960 1 782 . 1 1 89 89 THR C C 13 170.6 0.0 . . . . . . 89 THR C . 15960 1 783 . 1 1 89 89 THR CA C 13 57.38 0.0 . . . . . . 89 THR CA . 15960 1 784 . 1 1 89 89 THR CB C 13 70.87 0.0 . . . . . . 89 THR CB . 15960 1 785 . 1 1 89 89 THR N N 15 108.3 0.0 . . . . . . 89 THR N . 15960 1 786 . 1 1 90 90 TYR H H 1 10.33 0.0 . . . . . . 90 TYR H . 15960 1 787 . 1 1 90 90 TYR HA H 1 5.32 0.0 . . . . . . 90 TYR HA . 15960 1 788 . 1 1 90 90 TYR HB3 H 1 2.36 0.0 . . . . . . 90 TYR HB3 . 15960 1 789 . 1 1 90 90 TYR HD1 H 1 6.47 0.0 . . . . . . 90 TYR HD1 . 15960 1 790 . 1 1 90 90 TYR HD2 H 1 6.47 0.0 . . . . . . 90 TYR HD2 . 15960 1 791 . 1 1 90 90 TYR HE1 H 1 6.58 0.0 . . . . . . 90 TYR HE1 . 15960 1 792 . 1 1 90 90 TYR HE2 H 1 6.58 0.0 . . . . . . 90 TYR HE2 . 15960 1 793 . 1 1 90 90 TYR C C 13 172.35 0.0 . . . . . . 90 TYR C . 15960 1 794 . 1 1 90 90 TYR CA C 13 55.23 0.0 . . . . . . 90 TYR CA . 15960 1 795 . 1 1 90 90 TYR CB C 13 47.11 0.0 . . . . . . 90 TYR CB . 15960 1 796 . 1 1 90 90 TYR N N 15 119.01 0.0 . . . . . . 90 TYR N . 15960 1 797 . 1 1 91 91 ILE H H 1 8.68 0.0 . . . . . . 91 ILE H . 15960 1 798 . 1 1 91 91 ILE HA H 1 4.54 0.0 . . . . . . 91 ILE HA . 15960 1 799 . 1 1 91 91 ILE HD11 H 1 0.54 0.0 . . . . . . 91 ILE HD11 . 15960 1 800 . 1 1 91 91 ILE HD12 H 1 0.54 0.0 . . . . . . 91 ILE HD12 . 15960 1 801 . 1 1 91 91 ILE HD13 H 1 0.54 0.0 . . . . . . 91 ILE HD13 . 15960 1 802 . 1 1 91 91 ILE HG21 H 1 0.63 0.0 . . . . . . 91 ILE HG21 . 15960 1 803 . 1 1 91 91 ILE HG22 H 1 0.63 0.0 . . . . . . 91 ILE HG22 . 15960 1 804 . 1 1 91 91 ILE HG23 H 1 0.63 0.0 . . . . . . 91 ILE HG23 . 15960 1 805 . 1 1 91 91 ILE C C 13 172.92 0.0 . . . . . . 91 ILE C . 15960 1 806 . 1 1 91 91 ILE CA C 13 57.08 0.0 . . . . . . 91 ILE CA . 15960 1 807 . 1 1 91 91 ILE CB C 13 39.27 0.0 . . . . . . 91 ILE CB . 15960 1 808 . 1 1 91 91 ILE N N 15 122.19 0.0 . . . . . . 91 ILE N . 15960 1 809 . 1 1 92 92 SER H H 1 8.2 0.0 . . . . . . 92 SER H . 15960 1 810 . 1 1 92 92 SER HA H 1 4.37 0.0 . . . . . . 92 SER HA . 15960 1 811 . 1 1 92 92 SER HB3 H 1 3.85 0.0 . . . . . . 92 SER HB3 . 15960 1 812 . 1 1 92 92 SER C C 13 172.86 0.0 . . . . . . 92 SER C . 15960 1 813 . 1 1 92 92 SER CA C 13 56.25 0.0 . . . . . . 92 SER CA . 15960 1 814 . 1 1 92 92 SER CB C 13 62.04 0.0 . . . . . . 92 SER CB . 15960 1 815 . 1 1 92 92 SER N N 15 120.01 0.0 . . . . . . 92 SER N . 15960 1 816 . 1 1 93 93 LYS H H 1 7.95 0.0 . . . . . . 93 LYS H . 15960 1 817 . 1 1 93 93 LYS HA H 1 3.67 0.0 . . . . . . 93 LYS HA . 15960 1 818 . 1 1 93 93 LYS HB2 H 1 1.08 0.0 . . . . . . 93 LYS HB2 . 15960 1 819 . 1 1 93 93 LYS HB3 H 1 1.62 0.0 . . . . . . 93 LYS HB3 . 15960 1 820 . 1 1 93 93 LYS HG2 H 1 1.22 0.0 . . . . . . 93 LYS HG2 . 15960 1 821 . 1 1 93 93 LYS C C 13 177.05 0.0 . . . . . . 93 LYS C . 15960 1 822 . 1 1 93 93 LYS CA C 13 57.93 0.0 . . . . . . 93 LYS CA . 15960 1 823 . 1 1 93 93 LYS CB C 13 30.77 0.0 . . . . . . 93 LYS CB . 15960 1 824 . 1 1 93 93 LYS N N 15 129.79 0.0 . . . . . . 93 LYS N . 15960 1 825 . 1 1 94 94 LYS H H 1 8.64 0.0 . . . . . . 94 LYS H . 15960 1 826 . 1 1 94 94 LYS HA H 1 3.7 0.0 . . . . . . 94 LYS HA . 15960 1 827 . 1 1 94 94 LYS HB2 H 1 1.22 0.0 . . . . . . 94 LYS HB2 . 15960 1 828 . 1 1 94 94 LYS HB3 H 1 1.31 0.0 . . . . . . 94 LYS HB3 . 15960 1 829 . 1 1 94 94 LYS HG2 H 1 0.77 0.0 . . . . . . 94 LYS HG2 . 15960 1 830 . 1 1 94 94 LYS HG3 H 1 0.99 0.0 . . . . . . 94 LYS HG3 . 15960 1 831 . 1 1 94 94 LYS C C 13 174.83 0.0 . . . . . . 94 LYS C . 15960 1 832 . 1 1 94 94 LYS CA C 13 56.07 0.0 . . . . . . 94 LYS CA . 15960 1 833 . 1 1 94 94 LYS CB C 13 30.15 0.0 . . . . . . 94 LYS CB . 15960 1 834 . 1 1 94 94 LYS N N 15 120.23 0.0 . . . . . . 94 LYS N . 15960 1 835 . 1 1 95 95 HIS H H 1 7.29 0.0 . . . . . . 95 HIS H . 15960 1 836 . 1 1 95 95 HIS HA H 1 4.49 0.0 . . . . . . 95 HIS HA . 15960 1 837 . 1 1 95 95 HIS HB3 H 1 2.43 0.0 . . . . . . 95 HIS HB3 . 15960 1 838 . 1 1 95 95 HIS C C 13 174.25 0.0 . . . . . . 95 HIS C . 15960 1 839 . 1 1 95 95 HIS CA C 13 51.46 0.0 . . . . . . 95 HIS CA . 15960 1 840 . 1 1 95 95 HIS CB C 13 27.8 0.0 . . . . . . 95 HIS CB . 15960 1 841 . 1 1 95 95 HIS N N 15 114.78 0.0 . . . . . . 95 HIS N . 15960 1 842 . 1 1 96 96 ALA H H 1 7.11 0.0 . . . . . . 96 ALA H . 15960 1 843 . 1 1 96 96 ALA HA H 1 3.71 0.0 . . . . . . 96 ALA HA . 15960 1 844 . 1 1 96 96 ALA HB1 H 1 1.34 0.0 . . . . . . 96 ALA HB1 . 15960 1 845 . 1 1 96 96 ALA HB2 H 1 1.34 0.0 . . . . . . 96 ALA HB2 . 15960 1 846 . 1 1 96 96 ALA HB3 H 1 1.34 0.0 . . . . . . 96 ALA HB3 . 15960 1 847 . 1 1 96 96 ALA C C 13 178.59 0.0 . . . . . . 96 ALA C . 15960 1 848 . 1 1 96 96 ALA CA C 13 53.83 0.0 . . . . . . 96 ALA CA . 15960 1 849 . 1 1 96 96 ALA CB C 13 16.43 0.0 . . . . . . 96 ALA CB . 15960 1 850 . 1 1 96 96 ALA N N 15 125.16 0.0 . . . . . . 96 ALA N . 15960 1 851 . 1 1 97 97 GLU H H 1 8.83 0.0 . . . . . . 97 GLU H . 15960 1 852 . 1 1 97 97 GLU HA H 1 3.94 0.0 . . . . . . 97 GLU HA . 15960 1 853 . 1 1 97 97 GLU HB3 H 1 1.85 0.0 . . . . . . 97 GLU HB3 . 15960 1 854 . 1 1 97 97 GLU HG2 H 1 2.17 0.0 . . . . . . 97 GLU HG2 . 15960 1 855 . 1 1 97 97 GLU HG3 H 1 2.29 0.0 . . . . . . 97 GLU HG3 . 15960 1 856 . 1 1 97 97 GLU C C 13 174.84 0.0 . . . . . . 97 GLU C . 15960 1 857 . 1 1 97 97 GLU CA C 13 56.01 0.0 . . . . . . 97 GLU CA . 15960 1 858 . 1 1 97 97 GLU CB C 13 26.13 0.0 . . . . . . 97 GLU CB . 15960 1 859 . 1 1 97 97 GLU N N 15 117.4 0.0 . . . . . . 97 GLU N . 15960 1 860 . 1 1 98 98 LYS H H 1 7.23 0.0 . . . . . . 98 LYS H . 15960 1 861 . 1 1 98 98 LYS HA H 1 4.07 0.0 . . . . . . 98 LYS HA . 15960 1 862 . 1 1 98 98 LYS HB2 H 1 0.57 0.0 . . . . . . 98 LYS HB2 . 15960 1 863 . 1 1 98 98 LYS HB3 H 1 0.99 0.0 . . . . . . 98 LYS HB3 . 15960 1 864 . 1 1 98 98 LYS HG2 H 1 0.96 0.0 . . . . . . 98 LYS HG2 . 15960 1 865 . 1 1 98 98 LYS C C 13 173.47 0.0 . . . . . . 98 LYS C . 15960 1 866 . 1 1 98 98 LYS CA C 13 53.04 0.0 . . . . . . 98 LYS CA . 15960 1 867 . 1 1 98 98 LYS CB C 13 29.26 0.0 . . . . . . 98 LYS CB . 15960 1 868 . 1 1 98 98 LYS N N 15 116.27 0.0 . . . . . . 98 LYS N . 15960 1 869 . 1 1 99 99 ASN H H 1 7.82 0.0 . . . . . . 99 ASN H . 15960 1 870 . 1 1 99 99 ASN HA H 1 3.65 0.0 . . . . . . 99 ASN HA . 15960 1 871 . 1 1 99 99 ASN HB2 H 1 2.77 0.0 . . . . . . 99 ASN HB2 . 15960 1 872 . 1 1 99 99 ASN HB3 H 1 2.92 0.0 . . . . . . 99 ASN HB3 . 15960 1 873 . 1 1 99 99 ASN HD21 H 1 7.4 0.0 . . . . . . 99 ASN HD21 . 15960 1 874 . 1 1 99 99 ASN HD22 H 1 6.47 0.0 . . . . . . 99 ASN HD22 . 15960 1 875 . 1 1 99 99 ASN C C 13 170.42 0.0 . . . . . . 99 ASN C . 15960 1 876 . 1 1 99 99 ASN CA C 13 52.11 0.0 . . . . . . 99 ASN CA . 15960 1 877 . 1 1 99 99 ASN CB C 13 35.08 0.0 . . . . . . 99 ASN CB . 15960 1 878 . 1 1 99 99 ASN N N 15 113.04 0.0 . . . . . . 99 ASN N . 15960 1 879 . 1 1 99 99 ASN ND2 N 15 112.85 0.0 . . . . . . 99 ASN ND2 . 15960 1 880 . 1 1 100 100 TRP H H 1 6.31 0.0 . . . . . . 100 TRP H . 15960 1 881 . 1 1 100 100 TRP HA H 1 4.77 0.0 . . . . . . 100 TRP HA . 15960 1 882 . 1 1 100 100 TRP HB2 H 1 2.79 0.0 . . . . . . 100 TRP HB2 . 15960 1 883 . 1 1 100 100 TRP HB3 H 1 3.02 0.0 . . . . . . 100 TRP HB3 . 15960 1 884 . 1 1 100 100 TRP C C 13 171.49 0.0 . . . . . . 100 TRP C . 15960 1 885 . 1 1 100 100 TRP CA C 13 52.85 0.0 . . . . . . 100 TRP CA . 15960 1 886 . 1 1 100 100 TRP CB C 13 28.18 0.0 . . . . . . 100 TRP CB . 15960 1 887 . 1 1 100 100 TRP N N 15 115.84 0.0 . . . . . . 100 TRP N . 15960 1 888 . 1 1 101 101 PHE H H 1 8.17 0.0 . . . . . . 101 PHE H . 15960 1 889 . 1 1 101 101 PHE HA H 1 5.26 0.0 . . . . . . 101 PHE HA . 15960 1 890 . 1 1 101 101 PHE HB2 H 1 2.59 0.0 . . . . . . 101 PHE HB2 . 15960 1 891 . 1 1 101 101 PHE HB3 H 1 3.3 0.0 . . . . . . 101 PHE HB3 . 15960 1 892 . 1 1 101 101 PHE C C 13 174.81 0.0 . . . . . . 101 PHE C . 15960 1 893 . 1 1 101 101 PHE CA C 13 55.18 0.0 . . . . . . 101 PHE CA . 15960 1 894 . 1 1 101 101 PHE CB C 13 39.46 0.0 . . . . . . 101 PHE CB . 15960 1 895 . 1 1 101 101 PHE N N 15 123.64 0.0 . . . . . . 101 PHE N . 15960 1 896 . 1 1 102 102 VAL H H 1 8.35 0.0 . . . . . . 102 VAL H . 15960 1 897 . 1 1 102 102 VAL HA H 1 3.91 0.0 . . . . . . 102 VAL HA . 15960 1 898 . 1 1 102 102 VAL HB H 1 1.89 0.0 . . . . . . 102 VAL HB . 15960 1 899 . 1 1 102 102 VAL HG11 H 1 0.55 0.0 . . . . . . 102 VAL HG11 . 15960 1 900 . 1 1 102 102 VAL HG12 H 1 0.55 0.0 . . . . . . 102 VAL HG12 . 15960 1 901 . 1 1 102 102 VAL HG13 H 1 0.55 0.0 . . . . . . 102 VAL HG13 . 15960 1 902 . 1 1 102 102 VAL C C 13 174.41 0.0 . . . . . . 102 VAL C . 15960 1 903 . 1 1 102 102 VAL CA C 13 60.63 0.0 . . . . . . 102 VAL CA . 15960 1 904 . 1 1 102 102 VAL CB C 13 30.39 0.0 . . . . . . 102 VAL CB . 15960 1 905 . 1 1 102 102 VAL N N 15 119.55 0.0 . . . . . . 102 VAL N . 15960 1 906 . 1 1 103 103 GLY H H 1 8.79 0.0 . . . . . . 103 GLY H . 15960 1 907 . 1 1 103 103 GLY HA2 H 1 2.98 0.0 . . . . . . 103 GLY HA2 . 15960 1 908 . 1 1 103 103 GLY HA3 H 1 5.15 0.0 . . . . . . 103 GLY HA3 . 15960 1 909 . 1 1 103 103 GLY C C 13 169.61 0.0 . . . . . . 103 GLY C . 15960 1 910 . 1 1 103 103 GLY CA C 13 43.84 0.0 . . . . . . 103 GLY CA . 15960 1 911 . 1 1 103 103 GLY N N 15 113.1 0.0 . . . . . . 103 GLY N . 15960 1 912 . 1 1 104 104 LEU H H 1 8.13 0.0 . . . . . . 104 LEU H . 15960 1 913 . 1 1 104 104 LEU HA H 1 4.8 0.0 . . . . . . 104 LEU HA . 15960 1 914 . 1 1 104 104 LEU HB2 H 1 1.02 0.0 . . . . . . 104 LEU HB2 . 15960 1 915 . 1 1 104 104 LEU HB3 H 1 2.1 0.0 . . . . . . 104 LEU HB3 . 15960 1 916 . 1 1 104 104 LEU HD11 H 1 0.79 0.0 . . . . . . 104 LEU HD11 . 15960 1 917 . 1 1 104 104 LEU HD12 H 1 0.79 0.0 . . . . . . 104 LEU HD12 . 15960 1 918 . 1 1 104 104 LEU HD13 H 1 0.79 0.0 . . . . . . 104 LEU HD13 . 15960 1 919 . 1 1 104 104 LEU HD21 H 1 0.63 0.0 . . . . . . 104 LEU HD21 . 15960 1 920 . 1 1 104 104 LEU HD22 H 1 0.63 0.0 . . . . . . 104 LEU HD22 . 15960 1 921 . 1 1 104 104 LEU HD23 H 1 0.63 0.0 . . . . . . 104 LEU HD23 . 15960 1 922 . 1 1 104 104 LEU HG H 1 1.6 0.0 . . . . . . 104 LEU HG . 15960 1 923 . 1 1 104 104 LEU C C 13 173.87 0.0 . . . . . . 104 LEU C . 15960 1 924 . 1 1 104 104 LEU CA C 13 51.6 0.0 . . . . . . 104 LEU CA . 15960 1 925 . 1 1 104 104 LEU CB C 13 43.72 0.0 . . . . . . 104 LEU CB . 15960 1 926 . 1 1 104 104 LEU N N 15 118.9 0.0 . . . . . . 104 LEU N . 15960 1 927 . 1 1 105 105 LYS H H 1 8.79 0.0 . . . . . . 105 LYS H . 15960 1 928 . 1 1 105 105 LYS HA H 1 3.79 0.0 . . . . . . 105 LYS HA . 15960 1 929 . 1 1 105 105 LYS HB2 H 1 1.61 0.0 . . . . . . 105 LYS HB2 . 15960 1 930 . 1 1 105 105 LYS HB3 H 1 1.96 0.0 . . . . . . 105 LYS HB3 . 15960 1 931 . 1 1 105 105 LYS HD2 H 1 1.47 0.0 . . . . . . 105 LYS HD2 . 15960 1 932 . 1 1 105 105 LYS HD3 H 1 1.66 0.0 . . . . . . 105 LYS HD3 . 15960 1 933 . 1 1 105 105 LYS HE2 H 1 3.07 0.0 . . . . . . 105 LYS HE2 . 15960 1 934 . 1 1 105 105 LYS CA C 13 53.99 0.0 . . . . . . 105 LYS CA . 15960 1 935 . 1 1 105 105 LYS N N 15 119.61 0.0 . . . . . . 105 LYS N . 15960 1 936 . 1 1 106 106 LYS H H 1 9.37 0.0 . . . . . . 106 LYS H . 15960 1 937 . 1 1 106 106 LYS HA H 1 3.55 0.0 . . . . . . 106 LYS HA . 15960 1 938 . 1 1 106 106 LYS HB2 H 1 1.57 0.0 . . . . . . 106 LYS HB2 . 15960 1 939 . 1 1 106 106 LYS HB3 H 1 1.61 0.0 . . . . . . 106 LYS HB3 . 15960 1 940 . 1 1 106 106 LYS HG2 H 1 1.55 0.0 . . . . . . 106 LYS HG2 . 15960 1 941 . 1 1 106 106 LYS C C 13 175.2 0.0 . . . . . . 106 LYS C . 15960 1 942 . 1 1 106 106 LYS CA C 13 58.39 0.0 . . . . . . 106 LYS CA . 15960 1 943 . 1 1 106 106 LYS CB C 13 28.6 0.0 . . . . . . 106 LYS CB . 15960 1 944 . 1 1 106 106 LYS N N 15 121.59 0.0 . . . . . . 106 LYS N . 15960 1 945 . 1 1 107 107 ASN H H 1 7.58 0.0 . . . . . . 107 ASN H . 15960 1 946 . 1 1 107 107 ASN HA H 1 4.48 0.0 . . . . . . 107 ASN HA . 15960 1 947 . 1 1 107 107 ASN HB2 H 1 2.69 0.0 . . . . . . 107 ASN HB2 . 15960 1 948 . 1 1 107 107 ASN HB3 H 1 3.19 0.0 . . . . . . 107 ASN HB3 . 15960 1 949 . 1 1 107 107 ASN C C 13 174.72 0.0 . . . . . . 107 ASN C . 15960 1 950 . 1 1 107 107 ASN CA C 13 49.57 0.0 . . . . . . 107 ASN CA . 15960 1 951 . 1 1 107 107 ASN CB C 13 34.68 0.0 . . . . . . 107 ASN CB . 15960 1 952 . 1 1 107 107 ASN N N 15 112.28 0.0 . . . . . . 107 ASN N . 15960 1 953 . 1 1 108 108 GLY H H 1 7.44 0.0 . . . . . . 108 GLY H . 15960 1 954 . 1 1 108 108 GLY HA2 H 1 3.05 0.0 . . . . . . 108 GLY HA2 . 15960 1 955 . 1 1 108 108 GLY HA3 H 1 3.63 0.0 . . . . . . 108 GLY HA3 . 15960 1 956 . 1 1 108 108 GLY C C 13 169.72 0.0 . . . . . . 108 GLY C . 15960 1 957 . 1 1 108 108 GLY CA C 13 42.03 0.0 . . . . . . 108 GLY CA . 15960 1 958 . 1 1 108 108 GLY N N 15 109.23 0.0 . . . . . . 108 GLY N . 15960 1 959 . 1 1 109 109 SER H H 1 7.52 0.0 . . . . . . 109 SER H . 15960 1 960 . 1 1 109 109 SER HA H 1 4.66 0.0 . . . . . . 109 SER HA . 15960 1 961 . 1 1 109 109 SER HB3 H 1 3.8 0.0 . . . . . . 109 SER HB3 . 15960 1 962 . 1 1 109 109 SER C C 13 174.61 0.0 . . . . . . 109 SER C . 15960 1 963 . 1 1 109 109 SER CA C 13 55.42 0.0 . . . . . . 109 SER CA . 15960 1 964 . 1 1 109 109 SER CB C 13 62.37 0.0 . . . . . . 109 SER CB . 15960 1 965 . 1 1 109 109 SER N N 15 112.78 0.0 . . . . . . 109 SER N . 15960 1 966 . 1 1 110 110 CYS H H 1 9.07 0.0 . . . . . . 110 CYS H . 15960 1 967 . 1 1 110 110 CYS HA H 1 4.63 0.0 . . . . . . 110 CYS HA . 15960 1 968 . 1 1 110 110 CYS HB2 H 1 2.89 0.0 . . . . . . 110 CYS HB2 . 15960 1 969 . 1 1 110 110 CYS HB3 H 1 3.79 0.0 . . . . . . 110 CYS HB3 . 15960 1 970 . 1 1 110 110 CYS C C 13 171.7 0.0 . . . . . . 110 CYS C . 15960 1 971 . 1 1 110 110 CYS CA C 13 57.35 0.0 . . . . . . 110 CYS CA . 15960 1 972 . 1 1 110 110 CYS N N 15 118.84 0.0 . . . . . . 110 CYS N . 15960 1 973 . 1 1 111 111 LYS HA H 1 4.27 0.0 . . . . . . 111 LYS HA . 15960 1 974 . 1 1 111 111 LYS HB2 H 1 1.2 0.0 . . . . . . 111 LYS HB2 . 15960 1 975 . 1 1 111 111 LYS HB3 H 1 1.43 0.0 . . . . . . 111 LYS HB3 . 15960 1 976 . 1 1 111 111 LYS HD2 H 1 1.39 0.0 . . . . . . 111 LYS HD2 . 15960 1 977 . 1 1 111 111 LYS HG2 H 1 0.98 0.0 . . . . . . 111 LYS HG2 . 15960 1 978 . 1 1 111 111 LYS C C 13 173.81 0.0 . . . . . . 111 LYS C . 15960 1 979 . 1 1 111 111 LYS CA C 13 52.01 0.0 . . . . . . 111 LYS CA . 15960 1 980 . 1 1 111 111 LYS CB C 13 31.5 0.0 . . . . . . 111 LYS CB . 15960 1 981 . 1 1 112 112 ARG H H 1 8.39 0.0 . . . . . . 112 ARG H . 15960 1 982 . 1 1 112 112 ARG HA H 1 4.48 0.0 . . . . . . 112 ARG HA . 15960 1 983 . 1 1 112 112 ARG HB2 H 1 1.42 0.0 . . . . . . 112 ARG HB2 . 15960 1 984 . 1 1 112 112 ARG HB3 H 1 1.78 0.0 . . . . . . 112 ARG HB3 . 15960 1 985 . 1 1 112 112 ARG HD2 H 1 3.02 0.0 . . . . . . 112 ARG HD2 . 15960 1 986 . 1 1 112 112 ARG HG2 H 1 1.65 0.0 . . . . . . 112 ARG HG2 . 15960 1 987 . 1 1 112 112 ARG C C 13 175.67 0.0 . . . . . . 112 ARG C . 15960 1 988 . 1 1 112 112 ARG CA C 13 52.78 0.0 . . . . . . 112 ARG CA . 15960 1 989 . 1 1 112 112 ARG CB C 13 29.02 0.0 . . . . . . 112 ARG CB . 15960 1 990 . 1 1 112 112 ARG N N 15 122.33 0.0 . . . . . . 112 ARG N . 15960 1 991 . 1 1 113 113 GLY H H 1 9.86 0.0 . . . . . . 113 GLY H . 15960 1 992 . 1 1 113 113 GLY HA2 H 1 3.06 0.0 . . . . . . 113 GLY HA2 . 15960 1 993 . 1 1 113 113 GLY HA3 H 1 3.66 0.0 . . . . . . 113 GLY HA3 . 15960 1 994 . 1 1 113 113 GLY CA C 13 45.7 0.0 . . . . . . 113 GLY CA . 15960 1 995 . 1 1 113 113 GLY N N 15 109.23 0.0 . . . . . . 113 GLY N . 15960 1 996 . 1 1 114 114 PRO HA H 1 4.35 0.0 . . . . . . 114 PRO HA . 15960 1 997 . 1 1 114 114 PRO HB2 H 1 1.9 0.0 . . . . . . 114 PRO HB2 . 15960 1 998 . 1 1 114 114 PRO HB3 H 1 2.22 0.0 . . . . . . 114 PRO HB3 . 15960 1 999 . 1 1 114 114 PRO HD2 H 1 4.34 0.0 . . . . . . 114 PRO HD2 . 15960 1 1000 . 1 1 114 114 PRO HG2 H 1 1.51 0.0 . . . . . . 114 PRO HG2 . 15960 1 1001 . 1 1 114 114 PRO CA C 13 60.52 0.0 . . . . . . 114 PRO CA . 15960 1 1002 . 1 1 114 114 PRO CB C 13 30.39 0.0 . . . . . . 114 PRO CB . 15960 1 1003 . 1 1 115 115 ARG H H 1 8.11 0.0 . . . . . . 115 ARG H . 15960 1 1004 . 1 1 115 115 ARG HA H 1 4.52 0.0 . . . . . . 115 ARG HA . 15960 1 1005 . 1 1 115 115 ARG HB2 H 1 1.89 0.0 . . . . . . 115 ARG HB2 . 15960 1 1006 . 1 1 115 115 ARG HB3 H 1 2.91 0.0 . . . . . . 115 ARG HB3 . 15960 1 1007 . 1 1 115 115 ARG HD2 H 1 3.01 0.0 . . . . . . 115 ARG HD2 . 15960 1 1008 . 1 1 115 115 ARG HD3 H 1 3.15 0.0 . . . . . . 115 ARG HD3 . 15960 1 1009 . 1 1 115 115 ARG C C 13 174.32 0.0 . . . . . . 115 ARG C . 15960 1 1010 . 1 1 115 115 ARG CA C 13 50.36 0.0 . . . . . . 115 ARG CA . 15960 1 1011 . 1 1 115 115 ARG N N 15 112.76 0.0 . . . . . . 115 ARG N . 15960 1 1012 . 1 1 116 116 THR H H 1 7.7 0.0 . . . . . . 116 THR H . 15960 1 1013 . 1 1 116 116 THR HA H 1 5.39 0.0 . . . . . . 116 THR HA . 15960 1 1014 . 1 1 116 116 THR HB H 1 4.01 0.0 . . . . . . 116 THR HB . 15960 1 1015 . 1 1 116 116 THR HG21 H 1 1.02 0.0 . . . . . . 116 THR HG21 . 15960 1 1016 . 1 1 116 116 THR HG22 H 1 1.02 0.0 . . . . . . 116 THR HG22 . 15960 1 1017 . 1 1 116 116 THR HG23 H 1 1.02 0.0 . . . . . . 116 THR HG23 . 15960 1 1018 . 1 1 116 116 THR C C 13 172.76 0.0 . . . . . . 116 THR C . 15960 1 1019 . 1 1 116 116 THR CA C 13 57.7 0.0 . . . . . . 116 THR CA . 15960 1 1020 . 1 1 116 116 THR CB C 13 70.21 0.0 . . . . . . 116 THR CB . 15960 1 1021 . 1 1 116 116 THR N N 15 111.58 0.0 . . . . . . 116 THR N . 15960 1 1022 . 1 1 117 117 HIS H H 1 7.46 0.0 . . . . . . 117 HIS H . 15960 1 1023 . 1 1 117 117 HIS HA H 1 4.85 0.0 . . . . . . 117 HIS HA . 15960 1 1024 . 1 1 117 117 HIS HB2 H 1 3.58 0.0 . . . . . . 117 HIS HB2 . 15960 1 1025 . 1 1 117 117 HIS C C 13 170.19 0.0 . . . . . . 117 HIS C . 15960 1 1026 . 1 1 117 117 HIS CA C 13 52.92 0.0 . . . . . . 117 HIS CA . 15960 1 1027 . 1 1 117 117 HIS CB C 13 28.18 0.0 . . . . . . 117 HIS CB . 15960 1 1028 . 1 1 117 117 HIS N N 15 112.6 0.0 . . . . . . 117 HIS N . 15960 1 1029 . 1 1 118 118 TYR H H 1 9.06 0.0 . . . . . . 118 TYR H . 15960 1 1030 . 1 1 118 118 TYR HA H 1 3.78 0.0 . . . . . . 118 TYR HA . 15960 1 1031 . 1 1 118 118 TYR HB2 H 1 2.61 0.0 . . . . . . 118 TYR HB2 . 15960 1 1032 . 1 1 118 118 TYR HB3 H 1 2.64 0.0 . . . . . . 118 TYR HB3 . 15960 1 1033 . 1 1 118 118 TYR C C 13 174.24 0.0 . . . . . . 118 TYR C . 15960 1 1034 . 1 1 118 118 TYR CA C 13 58.68 0.0 . . . . . . 118 TYR CA . 15960 1 1035 . 1 1 118 118 TYR CB C 13 35.71 0.0 . . . . . . 118 TYR CB . 15960 1 1036 . 1 1 118 118 TYR N N 15 120.98 0.0 . . . . . . 118 TYR N . 15960 1 1037 . 1 1 119 119 GLY H H 1 7.93 0.0 . . . . . . 119 GLY H . 15960 1 1038 . 1 1 119 119 GLY HA2 H 1 4.32 0.0 . . . . . . 119 GLY HA2 . 15960 1 1039 . 1 1 119 119 GLY HA3 H 1 3.12 0.0 . . . . . . 119 GLY HA3 . 15960 1 1040 . 1 1 119 119 GLY C C 13 172.8 0.0 . . . . . . 119 GLY C . 15960 1 1041 . 1 1 119 119 GLY CA C 13 42.33 0.0 . . . . . . 119 GLY CA . 15960 1 1042 . 1 1 119 119 GLY N N 15 116.55 0.0 . . . . . . 119 GLY N . 15960 1 1043 . 1 1 120 120 GLN H H 1 6.97 0.0 . . . . . . 120 GLN H . 15960 1 1044 . 1 1 120 120 GLN HA H 1 4.06 0.0 . . . . . . 120 GLN HA . 15960 1 1045 . 1 1 120 120 GLN HB2 H 1 1.73 0.0 . . . . . . 120 GLN HB2 . 15960 1 1046 . 1 1 120 120 GLN HB3 H 1 1.93 0.0 . . . . . . 120 GLN HB3 . 15960 1 1047 . 1 1 120 120 GLN C C 13 174.98 0.0 . . . . . . 120 GLN C . 15960 1 1048 . 1 1 120 120 GLN CA C 13 53.0 0.0 . . . . . . 120 GLN CA . 15960 1 1049 . 1 1 120 120 GLN CB C 13 27.28 0.0 . . . . . . 120 GLN CB . 15960 1 1050 . 1 1 120 120 GLN N N 15 118.29 0.0 . . . . . . 120 GLN N . 15960 1 1051 . 1 1 121 121 LYS H H 1 8.16 0.0 . . . . . . 121 LYS H . 15960 1 1052 . 1 1 121 121 LYS HA H 1 3.69 0.0 . . . . . . 121 LYS HA . 15960 1 1053 . 1 1 121 121 LYS HB2 H 1 1.3 0.0 . . . . . . 121 LYS HB2 . 15960 1 1054 . 1 1 121 121 LYS HB3 H 1 1.38 0.0 . . . . . . 121 LYS HB3 . 15960 1 1055 . 1 1 121 121 LYS HD2 H 1 1.39 0.0 . . . . . . 121 LYS HD2 . 15960 1 1056 . 1 1 121 121 LYS HE2 H 1 2.83 0.0 . . . . . . 121 LYS HE2 . 15960 1 1057 . 1 1 121 121 LYS HG2 H 1 1.65 0.0 . . . . . . 121 LYS HG2 . 15960 1 1058 . 1 1 121 121 LYS C C 13 176.55 0.0 . . . . . . 121 LYS C . 15960 1 1059 . 1 1 121 121 LYS CA C 13 56.39 0.0 . . . . . . 121 LYS CA . 15960 1 1060 . 1 1 121 121 LYS CB C 13 29.4 0.0 . . . . . . 121 LYS CB . 15960 1 1061 . 1 1 121 121 LYS N N 15 122.71 0.0 . . . . . . 121 LYS N . 15960 1 1062 . 1 1 122 122 ALA H H 1 8.12 0.0 . . . . . . 122 ALA H . 15960 1 1063 . 1 1 122 122 ALA HA H 1 3.74 0.0 . . . . . . 122 ALA HA . 15960 1 1064 . 1 1 122 122 ALA HB1 H 1 0.98 0.0 . . . . . . 122 ALA HB1 . 15960 1 1065 . 1 1 122 122 ALA HB2 H 1 0.98 0.0 . . . . . . 122 ALA HB2 . 15960 1 1066 . 1 1 122 122 ALA HB3 H 1 0.98 0.0 . . . . . . 122 ALA HB3 . 15960 1 1067 . 1 1 122 122 ALA C C 13 172.53 0.0 . . . . . . 122 ALA C . 15960 1 1068 . 1 1 122 122 ALA CA C 13 52.18 0.0 . . . . . . 122 ALA CA . 15960 1 1069 . 1 1 122 122 ALA CB C 13 19.67 0.0 . . . . . . 122 ALA CB . 15960 1 1070 . 1 1 122 122 ALA N N 15 116.61 0.0 . . . . . . 122 ALA N . 15960 1 1071 . 1 1 123 123 ILE H H 1 5.74 0.0 . . . . . . 123 ILE H . 15960 1 1072 . 1 1 123 123 ILE HA H 1 5.0 0.0 . . . . . . 123 ILE HA . 15960 1 1073 . 1 1 123 123 ILE HB H 1 2.12 0.0 . . . . . . 123 ILE HB . 15960 1 1074 . 1 1 123 123 ILE HG12 H 1 0.88 0.0 . . . . . . 123 ILE HG12 . 15960 1 1075 . 1 1 123 123 ILE HG13 H 1 0.99 0.0 . . . . . . 123 ILE HG13 . 15960 1 1076 . 1 1 123 123 ILE HG21 H 1 0.51 0.0 . . . . . . 123 ILE HG21 . 15960 1 1077 . 1 1 123 123 ILE HG22 H 1 0.51 0.0 . . . . . . 123 ILE HG22 . 15960 1 1078 . 1 1 123 123 ILE HG23 H 1 0.51 0.0 . . . . . . 123 ILE HG23 . 15960 1 1079 . 1 1 123 123 ILE C C 13 172.55 0.0 . . . . . . 123 ILE C . 15960 1 1080 . 1 1 123 123 ILE CA C 13 57.26 0.0 . . . . . . 123 ILE CA . 15960 1 1081 . 1 1 123 123 ILE CB C 13 35.24 0.0 . . . . . . 123 ILE CB . 15960 1 1082 . 1 1 123 123 ILE N N 15 101.13 0.0 . . . . . . 123 ILE N . 15960 1 1083 . 1 1 124 124 LEU H H 1 6.75 0.0 . . . . . . 124 LEU H . 15960 1 1084 . 1 1 124 124 LEU HA H 1 4.5 0.0 . . . . . . 124 LEU HA . 15960 1 1085 . 1 1 124 124 LEU HB3 H 1 1.47 0.0 . . . . . . 124 LEU HB3 . 15960 1 1086 . 1 1 124 124 LEU C C 13 173.51 0.0 . . . . . . 124 LEU C . 15960 1 1087 . 1 1 124 124 LEU CA C 13 51.39 0.0 . . . . . . 124 LEU CA . 15960 1 1088 . 1 1 124 124 LEU CB C 13 39.46 0.0 . . . . . . 124 LEU CB . 15960 1 1089 . 1 1 124 124 LEU N N 15 121.3 0.0 . . . . . . 124 LEU N . 15960 1 1090 . 1 1 125 125 PHE H H 1 9.32 0.0 . . . . . . 125 PHE H . 15960 1 1091 . 1 1 125 125 PHE HA H 1 5.44 0.0 . . . . . . 125 PHE HA . 15960 1 1092 . 1 1 125 125 PHE HB2 H 1 2.68 0.0 . . . . . . 125 PHE HB2 . 15960 1 1093 . 1 1 125 125 PHE HB3 H 1 3.04 0.0 . . . . . . 125 PHE HB3 . 15960 1 1094 . 1 1 125 125 PHE C C 13 172.71 0.0 . . . . . . 125 PHE C . 15960 1 1095 . 1 1 125 125 PHE CA C 13 54.56 0.0 . . . . . . 125 PHE CA . 15960 1 1096 . 1 1 125 125 PHE CB C 13 41.46 0.0 . . . . . . 125 PHE CB . 15960 1 1097 . 1 1 125 125 PHE N N 15 121.5 0.0 . . . . . . 125 PHE N . 15960 1 1098 . 1 1 126 126 LEU H H 1 9.92 0.0 . . . . . . 126 LEU H . 15960 1 1099 . 1 1 126 126 LEU HA H 1 5.12 0.0 . . . . . . 126 LEU HA . 15960 1 1100 . 1 1 126 126 LEU HB2 H 1 1.26 0.0 . . . . . . 126 LEU HB2 . 15960 1 1101 . 1 1 126 126 LEU HB3 H 1 1.83 0.0 . . . . . . 126 LEU HB3 . 15960 1 1102 . 1 1 126 126 LEU HD11 H 1 0.76 0.0 . . . . . . 126 LEU HD11 . 15960 1 1103 . 1 1 126 126 LEU HD12 H 1 0.76 0.0 . . . . . . 126 LEU HD12 . 15960 1 1104 . 1 1 126 126 LEU HD13 H 1 0.76 0.0 . . . . . . 126 LEU HD13 . 15960 1 1105 . 1 1 126 126 LEU HD21 H 1 0.73 0.0 . . . . . . 126 LEU HD21 . 15960 1 1106 . 1 1 126 126 LEU HD22 H 1 0.73 0.0 . . . . . . 126 LEU HD22 . 15960 1 1107 . 1 1 126 126 LEU HD23 H 1 0.73 0.0 . . . . . . 126 LEU HD23 . 15960 1 1108 . 1 1 126 126 LEU CA C 13 48.74 0.0 . . . . . . 126 LEU CA . 15960 1 1109 . 1 1 126 126 LEU N N 15 125.7 0.0 . . . . . . 126 LEU N . 15960 1 1110 . 1 1 127 127 PRO HA H 1 5.45 0.0 . . . . . . 127 PRO HA . 15960 1 1111 . 1 1 127 127 PRO HB3 H 1 1.92 0.0 . . . . . . 127 PRO HB3 . 15960 1 1112 . 1 1 127 127 PRO C C 13 174.55 0.0 . . . . . . 127 PRO C . 15960 1 1113 . 1 1 127 127 PRO CA C 13 54.56 0.0 . . . . . . 127 PRO CA . 15960 1 1114 . 1 1 127 127 PRO CB C 13 28.65 0.0 . . . . . . 127 PRO CB . 15960 1 1115 . 1 1 128 128 LEU H H 1 9.68 0.0 . . . . . . 128 LEU H . 15960 1 1116 . 1 1 128 128 LEU HA H 1 4.89 0.0 . . . . . . 128 LEU HA . 15960 1 1117 . 1 1 128 128 LEU HB3 H 1 1.62 0.0 . . . . . . 128 LEU HB3 . 15960 1 1118 . 1 1 128 128 LEU HD11 H 1 0.9 0.0 . . . . . . 128 LEU HD11 . 15960 1 1119 . 1 1 128 128 LEU HD12 H 1 0.9 0.0 . . . . . . 128 LEU HD12 . 15960 1 1120 . 1 1 128 128 LEU HD13 H 1 0.9 0.0 . . . . . . 128 LEU HD13 . 15960 1 1121 . 1 1 128 128 LEU C C 13 175.96 0.0 . . . . . . 128 LEU C . 15960 1 1122 . 1 1 128 128 LEU CA C 13 49.51 0.0 . . . . . . 128 LEU CA . 15960 1 1123 . 1 1 128 128 LEU N N 15 129.11 0.0 . . . . . . 128 LEU N . 15960 1 1124 . 1 1 129 129 PRO HA H 1 4.58 0.0 . . . . . . 129 PRO HA . 15960 1 1125 . 1 1 129 129 PRO HB3 H 1 2.23 0.0 . . . . . . 129 PRO HB3 . 15960 1 1126 . 1 1 129 129 PRO HD2 H 1 3.62 0.0 . . . . . . 129 PRO HD2 . 15960 1 1127 . 1 1 129 129 PRO HD3 H 1 3.87 0.0 . . . . . . 129 PRO HD3 . 15960 1 1128 . 1 1 129 129 PRO HG3 H 1 2.04 0.0 . . . . . . 129 PRO HG3 . 15960 1 1129 . 1 1 129 129 PRO C C 13 174.4 0.0 . . . . . . 129 PRO C . 15960 1 1130 . 1 1 129 129 PRO CA C 13 58.87 0.0 . . . . . . 129 PRO CA . 15960 1 1131 . 1 1 129 129 PRO CB C 13 29.8 0.0 . . . . . . 129 PRO CB . 15960 1 1132 . 1 1 130 130 VAL H H 1 8.0 0.0 . . . . . . 130 VAL H . 15960 1 1133 . 1 1 130 130 VAL HA H 1 3.67 0.0 . . . . . . 130 VAL HA . 15960 1 1134 . 1 1 130 130 VAL HB H 1 1.86 0.0 . . . . . . 130 VAL HB . 15960 1 1135 . 1 1 130 130 VAL HG11 H 1 0.84 0.0 . . . . . . 130 VAL HG11 . 15960 1 1136 . 1 1 130 130 VAL HG12 H 1 0.84 0.0 . . . . . . 130 VAL HG12 . 15960 1 1137 . 1 1 130 130 VAL HG13 H 1 0.84 0.0 . . . . . . 130 VAL HG13 . 15960 1 1138 . 1 1 130 130 VAL C C 13 174.12 0.0 . . . . . . 130 VAL C . 15960 1 1139 . 1 1 130 130 VAL CA C 13 61.41 0.0 . . . . . . 130 VAL CA . 15960 1 1140 . 1 1 130 130 VAL CB C 13 29.28 0.0 . . . . . . 130 VAL CB . 15960 1 1141 . 1 1 130 130 VAL N N 15 118.01 0.0 . . . . . . 130 VAL N . 15960 1 1142 . 1 1 131 131 SER H H 1 7.84 0.0 . . . . . . 131 SER H . 15960 1 1143 . 1 1 131 131 SER HA H 1 4.44 0.0 . . . . . . 131 SER HA . 15960 1 1144 . 1 1 131 131 SER HB2 H 1 3.64 0.0 . . . . . . 131 SER HB2 . 15960 1 1145 . 1 1 131 131 SER HB3 H 1 3.75 0.0 . . . . . . 131 SER HB3 . 15960 1 1146 . 1 1 131 131 SER C C 13 171.67 0.0 . . . . . . 131 SER C . 15960 1 1147 . 1 1 131 131 SER CA C 13 55.18 0.0 . . . . . . 131 SER CA . 15960 1 1148 . 1 1 131 131 SER CB C 13 62.0 0.0 . . . . . . 131 SER CB . 15960 1 1149 . 1 1 131 131 SER N N 15 115.66 0.0 . . . . . . 131 SER N . 15960 1 1150 . 1 1 132 132 SER H H 1 8.4 0.0 . . . . . . 132 SER H . 15960 1 1151 . 1 1 132 132 SER HA H 1 4.35 0.0 . . . . . . 132 SER HA . 15960 1 1152 . 1 1 132 132 SER HB2 H 1 3.72 0.0 . . . . . . 132 SER HB2 . 15960 1 1153 . 1 1 132 132 SER HB3 H 1 3.76 0.0 . . . . . . 132 SER HB3 . 15960 1 1154 . 1 1 132 132 SER C C 13 170.99 0.0 . . . . . . 132 SER C . 15960 1 1155 . 1 1 132 132 SER CA C 13 55.18 0.0 . . . . . . 132 SER CA . 15960 1 1156 . 1 1 132 132 SER CB C 13 61.78 0.0 . . . . . . 132 SER CB . 15960 1 1157 . 1 1 132 132 SER N N 15 117.8 0.0 . . . . . . 132 SER N . 15960 1 1158 . 1 1 133 133 ASP H H 1 7.91 0.0 . . . . . . 133 ASP H . 15960 1 1159 . 1 1 133 133 ASP HA H 1 4.28 0.0 . . . . . . 133 ASP HA . 15960 1 1160 . 1 1 133 133 ASP HB2 H 1 2.43 0.0 . . . . . . 133 ASP HB2 . 15960 1 1161 . 1 1 133 133 ASP HB3 H 1 2.54 0.0 . . . . . . 133 ASP HB3 . 15960 1 1162 . 1 1 133 133 ASP CA C 13 53.6 0.0 . . . . . . 133 ASP CA . 15960 1 1163 . 1 1 133 133 ASP N N 15 127.2 0.0 . . . . . . 133 ASP N . 15960 1 stop_ save_