data_4402 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4402 _Entry.Title ; 1H, 13C and 15N chemical shift assignment of human prion protein hPrP(23-230) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 1999-09-14 _Entry.Accession_date 1999-09-14 _Entry.Last_release_date 2000-02-01 _Entry.Original_release_date 2000-02-01 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Aizhuo Liu . . . 4402 2 Roland Riek . . . 4402 3 Gerhard Wider . . . 4402 4 Christine 'von Schroetter' . . . 4402 5 Ralph Zahn . . . 4402 6 Kurt Wuthrich . . . 4402 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4402 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 600 4402 '15N chemical shifts' 246 4402 '1H chemical shifts' 1311 4402 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 . . 2000-02-01 1999-09-14 original author . 4402 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4402 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 20087216 _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'NMR Solution Structure of the Human Prion Protein.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U. S. A.' _Citation.Journal_name_full . _Citation.Journal_volume 97 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 145 _Citation.Page_last 150 _Citation.Year 2000 _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 Ralph Zahn . . . 4402 1 2 Aizhuo Liu . . . 4402 1 3 Thorsten Luhrs . . . 4402 1 4 Roland Riek . . . 4402 1 5 Christine 'von Schroetter' . . . 4402 1 6 Francisco 'Lopez Garcia' . . . 4402 1 7 Martin Billeter . . . 4402 1 8 Luigi Calzolai . . . 4402 1 9 Gerhard Wider . . . 4402 1 10 Kurt Wuthrich . . . 4402 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'carbonyl carbon homonuclear isotropic mixing' 4402 1 'flexible polypeptide chains' 4402 1 'human prion protein' 4402 1 'sequential NMR assignment' 4402 1 'triple resonance experiments' 4402 1 stop_ save_ save_ref_1 _Citation.Sf_category citations _Citation.Sf_framecode ref_1 _Citation.Entry_ID 4402 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 9280297 _Citation.Full_citation ; Recombinant full-length murine prion protein, mPrP(23-231): purification and spectroscopic characterization. FEBS Lett. 1997 Aug 18;413(2):277-81. ; _Citation.Title 'Recombinant full-length murine prion protein, mPrP(23-231): purification and spectroscopic characterization.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'FEBS Lett.' _Citation.Journal_name_full 'FEBS letters' _Citation.Journal_volume 413 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0014-5793 _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 277 _Citation.Page_last 281 _Citation.Year 1997 _Citation.Details ; The cellular prion protein of the mouse, mPrP(C), consists of 208 amino acids (residues 23-231). It contains a carboxy-terminal domain, mPrP(121-231), which represents an autonomous folding unit with three alpha-helices and a two-stranded antiparallel beta-sheet. We expressed the complete amino acid sequence of the prion protein, mPrP(23-231), in the cytoplasm of Escherichia coli. mPrP(23-231) was solubilized from inclusion bodies by 8 M urea, oxidatively refolded and purified to homogeneity by conventional chromatographic techniques. Comparison of near-UV circular dichroism, fluorescence and one-dimensional 1H-NMR spectra of mPrP(23-231) and mPrP(121-231) shows that the amino-terminal segment 23-120, which includes the five characteristic octapeptide repeats, does not contribute measurably to the manifestation of three-dimensional structure as detected by these techniques, indicating that the residues 121-231 might be the only polypeptide segment of PrP(C) with a defined three-dimensional structure. ; 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 S Hornemann S. . . 4402 2 2 C Korth C. . . 4402 2 3 B Oesch B. . . 4402 2 4 R Riek R. . . 4402 2 5 G Wider G. . . 4402 2 6 K Wuthrich K. . . 4402 2 7 R Glockshuber R. . . 4402 2 stop_ save_ save_ref_2 _Citation.Sf_category citations _Citation.Sf_framecode ref_2 _Citation.Entry_ID 4402 _Citation.ID 3 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 8700211 _Citation.Full_citation ; NMR structure of the mouse prion protein domain PrP(121-321). Nature. 1996 Jul 11;382(6587):180-2. ; _Citation.Title 'NMR structure of the mouse prion protein domain PrP(121-321).' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Nature _Citation.Journal_name_full Nature _Citation.Journal_volume 382 _Citation.Journal_issue 6587 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0028-0836 _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 180 _Citation.Page_last 182 _Citation.Year 1996 _Citation.Details ; The 'protein only' hypothesis states that a modified form of normal prion protein triggers infectious neurodegenerative diseases, such as bovine spongiform encephalopathy (BSE), or Creutzfeldt-Jakob disease (CJD) in humans. Prion proteins are thought to exist in two different conformations: the 'benign' PrPcform, and the infectious 'scrapie form', PrPsc. Knowledge of the three-dimensional structure of PrPc is essential for understanding the transition to PrPsc. The nuclear magnetic resonance (NMR) structure of the autonomously folding PrP domain comprising residues 121-231 (ref. 6) contains a two-stranded antiparallel beta-sheet and three alpha-helices. This domain contains most of the point-mutation sites that have been linked, in human PrP, to the occurrence of familial prion diseases. The NMR structure shows that these mutations occur within, or directly adjacent to, regular secondary structures. The presence of a beta-sheet in PrP(121-231) is in contrast with model predictions of an all-helical structure of PrPc (ref. 8), and may be important for the initiation of the transition from PrPc to PrPsc. ; 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 R Riek R. . . 4402 3 2 S Hornemann S. . . 4402 3 3 G Wider G. . . 4402 3 4 M Billeter M. . . 4402 3 5 R Glockshuber R. . . 4402 3 6 K Wuthrich K. . . 4402 3 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_hPrP(23-230) _Assembly.Sf_category assembly _Assembly.Sf_framecode system_hPrP(23-230) _Assembly.Entry_ID 4402 _Assembly.ID 1 _Assembly.Name 'human prion protein hPrP(23-230)' _Assembly.BMRB_code . _Assembly.Number_of_components . _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 'fully oxidized' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4402 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 hPrP(23-230) 1 $hPrP(23-230) . . . native . . . . . 4402 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 hPrP(23-230) 1 CYS 159 159 SG . 1 hPrP(23-230) 1 CYS 194 194 SG 1 hPrP(23-230) 179 CYS SG 1 hPrP(23-230) 214 CYS SG 4402 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID hPrP(23-230) abbreviation 4402 1 'human prion protein hPrP(23-230)' system 4402 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'involved in prion disease' 4402 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_hPrP(23-230) _Entity.Sf_category entity _Entity.Sf_framecode hPrP(23-230) _Entity.Entry_ID 4402 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'human prion protein' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSKKRPKPGGWNTGGSRYPG QGSPGGNRYPPQGGGGWGQP HGGGWGQPHGGGWGQPHGGG WGQPHGGGWGQGGGTHSQWN KPSKPKTNMKHMAGAAAAGA VVGGLGGYMLGSAMSRPIIH FGSDYEDRYYRENMHRYPNQ VYYRPMDEYSNQNNFVHDCV NITIKQHTVTTTTKGENFTE TDVKMMERVVEQMCITQYER ESQAYYQRGS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 210 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'fully oxidized' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'The N-terminal two residues (GS) are a cloning artefact.' _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 16743 . "HuPrP(90-231 M129 Q212P)" . . . . . 67.14 148 99.29 99.29 6.27e-98 . . . . 4402 1 2 no BMRB 16757 . PrP^(91-231) . . . . . 67.14 145 97.87 100.00 1.84e-97 . . . . 4402 1 3 no BMRB 17714 . HuPrP . . . . . 67.14 147 99.29 100.00 2.56e-99 . . . . 4402 1 4 no BMRB 17756 . hPrP(121-230) . . . . . 52.38 113 100.00 100.00 1.03e-75 . . . . 4402 1 5 no BMRB 17757 . hPrP(121-230) . . . . . 52.38 113 98.18 98.18 1.52e-72 . . . . 4402 1 6 no BMRB 17780 . Hpp_E219K . . . . . 67.14 142 99.29 100.00 4.36e-99 . . . . 4402 1 7 no BMRB 18426 . entity . . . . . 67.14 142 100.00 100.00 1.10e-99 . . . . 4402 1 8 no BMRB 18550 . V210I . . . . . 67.14 147 99.29 100.00 2.56e-99 . . . . 4402 1 9 no BMRB 19268 . MAJOR_PRION_PROTEIN . . . . . 69.05 146 97.24 97.93 6.84e-99 . . . . 4402 1 10 no BMRB 4379 . "human prion protein" . . . . . 53.33 112 99.11 100.00 7.61e-77 . . . . 4402 1 11 no BMRB 4434 . "human prion protein" . . . . . 68.10 143 99.30 99.30 5.60e-100 . . . . 4402 1 12 no BMRB 4620 . "prion protein" . . . . . 53.33 112 98.21 100.00 2.03e-76 . . . . 4402 1 13 no BMRB 4641 . "PRION PROTEIN" . . . . . 69.05 146 97.24 97.93 8.69e-99 . . . . 4402 1 14 no BMRB 4736 . "human prion protein" . . . . . 53.33 112 98.21 100.00 3.81e-76 . . . . 4402 1 15 no PDB 1FKC . "Human Prion Protein (Mutant E200k) Fragment 90-231" . . . . . 67.14 142 99.29 100.00 4.36e-99 . . . . 4402 1 16 no PDB 1FO7 . "Human Prion Protein Mutant E200k Fragment 90-231" . . . . . 67.14 142 99.29 100.00 4.36e-99 . . . . 4402 1 17 no PDB 1H0L . "Human Prion Protein 121-230 M166c/e221c" . . . . . 52.86 112 97.30 98.20 6.29e-74 . . . . 4402 1 18 no PDB 1I4M . "Crystal Structure Of The Human Prion Protein Reveals A Mechanism For Oligomerization" . . . . . 51.43 108 100.00 100.00 2.15e-74 . . . . 4402 1 19 no PDB 1QLX . "Human Prion Protein" . . . . . 100.00 210 100.00 100.00 9.22e-149 . . . . 4402 1 20 no PDB 1QLZ . "Human Prion Protein" . . . . . 100.00 210 100.00 100.00 9.22e-149 . . . . 4402 1 21 no PDB 1QM0 . "Human Prion Protein Fragment 90-230" . . . . . 68.10 143 99.30 99.30 5.60e-100 . . . . 4402 1 22 no PDB 1QM1 . "Human Prion Protein Fragment 90-230" . . . . . 68.10 143 99.30 99.30 5.60e-100 . . . . 4402 1 23 no PDB 1QM2 . "Human Prion Protein Fragment 121-230" . . . . . 53.33 112 99.11 100.00 7.61e-77 . . . . 4402 1 24 no PDB 1QM3 . "Human Prion Protein Fragment 121-230" . . . . . 53.33 112 99.11 100.00 7.61e-77 . . . . 4402 1 25 no PDB 2KUN . "Three Dimensional Structure Of Huprp(90-231 M129 Q212p)" . . . . . 67.14 148 99.29 99.29 6.27e-98 . . . . 4402 1 26 no PDB 2LEJ . "Human Prion Protein Mutant Huprp(90-231, M129, V210i)" . . . . . 67.14 147 99.29 100.00 2.56e-99 . . . . 4402 1 27 no PDB 2LFT . "Human Prion Protein With E219k Protective Polymorphism" . . . . . 67.14 142 99.29 100.00 4.36e-99 . . . . 4402 1 28 no PDB 2LSB . "Solution-State Nmr Structure Of The Human Prion Protein" . . . . . 67.14 142 100.00 100.00 1.10e-99 . . . . 4402 1 29 no PDB 2LV1 . "Solution-state Nmr Structure Of Prion Protein Mutant V210i At Neutral Ph" . . . . . 67.14 147 99.29 100.00 2.56e-99 . . . . 4402 1 30 no PDB 2M8T . "Solution Nmr Structure Of The V209m Variant Of The Human Prion Protein (residues 90-231)" . . . . . 69.05 146 97.24 97.93 6.84e-99 . . . . 4402 1 31 no PDB 2W9E . "Structure Of Icsm 18 (Anti-Prp Therapeutic Antibody) Fab Fragment Complexed With Human Prp Fragment 119-231" . . . . . 53.33 113 100.00 100.00 2.30e-77 . . . . 4402 1 32 no PDB 3HAF . "Human Prion Protein Variant V129 Domain Swapped Dimer" . . . . . 67.14 142 99.29 100.00 4.75e-99 . . . . 4402 1 33 no PDB 3HEQ . "Human Prion Protein Variant D178n With M129" . . . . . 67.14 142 99.29 100.00 6.45e-99 . . . . 4402 1 34 no PDB 3HER . "Human Prion Protein Variant F198s With V129" . . . . . 67.14 142 98.58 99.29 1.16e-97 . . . . 4402 1 35 no PDB 3HES . "Human Prion Protein Variant F198s With M129" . . . . . 67.14 142 99.29 99.29 2.47e-98 . . . . 4402 1 36 no PDB 3HJ5 . "Human Prion Protein Variant V129 Domain Swapped Dimer" . . . . . 67.14 142 99.29 100.00 4.75e-99 . . . . 4402 1 37 no PDB 3HJX . "Human Prion Protein Variant D178n With V129" . . . . . 50.00 106 98.10 100.00 4.73e-71 . . . . 4402 1 38 no PDB 4DGI . "Structure Of Pom1 Fab Fragment Complexed With Human Prpc Fragment 120- 230" . . . . . 52.86 111 100.00 100.00 9.48e-77 . . . . 4402 1 39 no PDB 4KML . "Probing The N-terminal Beta-sheet Conversion In The Crystal Structure Of The Full-length Human Prion Protein Bound To A Nanobod" . . . . . 100.00 241 99.05 99.05 5.08e-147 . . . . 4402 1 40 no PDB 4N9O . "Probing The N-terminal Beta-sheet Conversion In The Crystal Structure Of The Human Prion Protein Bound To A Nanobody" . . . . . 67.14 142 100.00 100.00 1.10e-99 . . . . 4402 1 41 no DBJ BAA00011 . "prion protein [Homo sapiens]" . . . . . 99.52 245 99.04 99.04 1.25e-145 . . . . 4402 1 42 no DBJ BAF62360 . "prion protein, transcript variant 2 [Pan troglodytes verus]" . . . . . 99.52 253 98.56 99.52 8.48e-147 . . . . 4402 1 43 no DBJ BAG32276 . "prion [Homo sapiens]" . . . . . 99.52 253 99.52 99.52 6.36e-148 . . . . 4402 1 44 no DBJ BAG32277 . "prion [Homo sapiens]" . . . . . 99.52 253 99.04 99.52 2.33e-147 . . . . 4402 1 45 no DBJ BAG32278 . "alternatively spliced variant form of prion [Homo sapiens]" . . . . . 93.81 230 98.98 98.98 2.12e-137 . . . . 4402 1 46 no EMBL CAG46836 . "PRNP [Homo sapiens]" . . . . . 99.52 253 98.56 99.04 1.45e-145 . . . . 4402 1 47 no EMBL CAG46869 . "PRNP [Homo sapiens]" . . . . . 99.52 253 99.04 99.52 2.33e-147 . . . . 4402 1 48 no EMBL CAH92912 . "hypothetical protein [Pongo abelii]" . . . . . 99.52 253 97.61 99.52 2.25e-145 . . . . 4402 1 49 no GB AAA19664 . "prion protein [Homo sapiens]" . . . . . 99.52 245 99.04 99.04 1.25e-145 . . . . 4402 1 50 no GB AAA60182 . "prion protein [Homo sapiens]" . . . . . 99.52 253 99.52 99.52 6.36e-148 . . . . 4402 1 51 no GB AAA68632 . "major prion protein precursor [Pan troglodytes]" . . . . . 99.52 253 98.56 99.52 8.48e-147 . . . . 4402 1 52 no GB AAA68633 . "major prion protein precursor [Gorilla gorilla]" . . . . . 99.52 253 99.04 99.52 2.75e-147 . . . . 4402 1 53 no GB AAB59443 . "prion protein, partial [Homo sapiens]" . . . . . 99.52 233 99.52 99.52 1.10e-147 . . . . 4402 1 54 no REF NP_000302 . "major prion protein preproprotein [Homo sapiens]" . . . . . 99.52 253 99.52 99.52 6.36e-148 . . . . 4402 1 55 no REF NP_001009093 . "major prion protein preproprotein [Pan troglodytes]" . . . . . 99.52 253 98.56 99.52 8.48e-147 . . . . 4402 1 56 no REF NP_001073590 . "major prion protein preproprotein [Homo sapiens]" . . . . . 99.52 253 99.52 99.52 6.36e-148 . . . . 4402 1 57 no REF NP_001073591 . "major prion protein preproprotein [Homo sapiens]" . . . . . 99.52 253 99.52 99.52 6.36e-148 . . . . 4402 1 58 no REF NP_001073592 . "major prion protein preproprotein [Homo sapiens]" . . . . . 99.52 253 99.52 99.52 6.36e-148 . . . . 4402 1 59 no SP P04156 . "RecName: Full=Major prion protein; Short=PrP; AltName: Full=ASCR; AltName: Full=PrP27-30; AltName: Full=PrP33-35C; AltName: CD_" . . . . . 99.52 253 99.52 99.52 6.36e-148 . . . . 4402 1 60 no SP P40252 . "RecName: Full=Major prion protein; Short=PrP; AltName: Full=PrP27-30; AltName: Full=PrP33-35C; AltName: CD_antigen=CD230; Flags" . . . . . 99.52 253 99.04 99.52 2.26e-147 . . . . 4402 1 61 no SP P40256 . "RecName: Full=Major prion protein; Short=PrP; AltName: Full=PrP27-30; AltName: Full=PrP33-35C; AltName: CD_antigen=CD230; Flags" . . . . . 99.52 253 97.61 99.52 2.25e-145 . . . . 4402 1 62 no SP P61766 . "RecName: Full=Major prion protein; Short=PrP; AltName: Full=PrP27-30; AltName: Full=PrP33-35C; AltName: CD_antigen=CD230; Flags" . . . . . 99.52 253 98.56 99.52 8.48e-147 . . . . 4402 1 63 no SP P61767 . "RecName: Full=Major prion protein; Short=PrP; AltName: Full=PrP27-30; AltName: Full=PrP33-35C; AltName: CD_antigen=CD230; Flags" . . . . . 99.52 253 98.56 99.52 8.48e-147 . . . . 4402 1 64 no TPE CAJ43808 . "TPA: prion protein PrP [Pongo abelii]" . . . . . 99.52 253 97.61 99.52 2.25e-145 . . . . 4402 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID hPrP(23-230) abbreviation 4402 1 'human prion protein' common 4402 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 21 GLY . 4402 1 2 22 SER . 4402 1 3 23 LYS . 4402 1 4 24 LYS . 4402 1 5 25 ARG . 4402 1 6 26 PRO . 4402 1 7 27 LYS . 4402 1 8 28 PRO . 4402 1 9 29 GLY . 4402 1 10 30 GLY . 4402 1 11 31 TRP . 4402 1 12 32 ASN . 4402 1 13 33 THR . 4402 1 14 34 GLY . 4402 1 15 35 GLY . 4402 1 16 36 SER . 4402 1 17 37 ARG . 4402 1 18 38 TYR . 4402 1 19 39 PRO . 4402 1 20 40 GLY . 4402 1 21 41 GLN . 4402 1 22 42 GLY . 4402 1 23 43 SER . 4402 1 24 44 PRO . 4402 1 25 45 GLY . 4402 1 26 46 GLY . 4402 1 27 47 ASN . 4402 1 28 48 ARG . 4402 1 29 49 TYR . 4402 1 30 50 PRO . 4402 1 31 51 PRO . 4402 1 32 52 GLN . 4402 1 33 53 GLY . 4402 1 34 54 GLY . 4402 1 35 55 GLY . 4402 1 36 56 GLY . 4402 1 37 57 TRP . 4402 1 38 58 GLY . 4402 1 39 59 GLN . 4402 1 40 60 PRO . 4402 1 41 61 HIS . 4402 1 42 62 GLY . 4402 1 43 63 GLY . 4402 1 44 64 GLY . 4402 1 45 65 TRP . 4402 1 46 66 GLY . 4402 1 47 67 GLN . 4402 1 48 68 PRO . 4402 1 49 69 HIS . 4402 1 50 70 GLY . 4402 1 51 71 GLY . 4402 1 52 72 GLY . 4402 1 53 73 TRP . 4402 1 54 74 GLY . 4402 1 55 75 GLN . 4402 1 56 76 PRO . 4402 1 57 77 HIS . 4402 1 58 78 GLY . 4402 1 59 79 GLY . 4402 1 60 80 GLY . 4402 1 61 81 TRP . 4402 1 62 82 GLY . 4402 1 63 83 GLN . 4402 1 64 84 PRO . 4402 1 65 85 HIS . 4402 1 66 86 GLY . 4402 1 67 87 GLY . 4402 1 68 88 GLY . 4402 1 69 89 TRP . 4402 1 70 90 GLY . 4402 1 71 91 GLN . 4402 1 72 92 GLY . 4402 1 73 93 GLY . 4402 1 74 94 GLY . 4402 1 75 95 THR . 4402 1 76 96 HIS . 4402 1 77 97 SER . 4402 1 78 98 GLN . 4402 1 79 99 TRP . 4402 1 80 100 ASN . 4402 1 81 101 LYS . 4402 1 82 102 PRO . 4402 1 83 103 SER . 4402 1 84 104 LYS . 4402 1 85 105 PRO . 4402 1 86 106 LYS . 4402 1 87 107 THR . 4402 1 88 108 ASN . 4402 1 89 109 MET . 4402 1 90 110 LYS . 4402 1 91 111 HIS . 4402 1 92 112 MET . 4402 1 93 113 ALA . 4402 1 94 114 GLY . 4402 1 95 115 ALA . 4402 1 96 116 ALA . 4402 1 97 117 ALA . 4402 1 98 118 ALA . 4402 1 99 119 GLY . 4402 1 100 120 ALA . 4402 1 101 121 VAL . 4402 1 102 122 VAL . 4402 1 103 123 GLY . 4402 1 104 124 GLY . 4402 1 105 125 LEU . 4402 1 106 126 GLY . 4402 1 107 127 GLY . 4402 1 108 128 TYR . 4402 1 109 129 MET . 4402 1 110 130 LEU . 4402 1 111 131 GLY . 4402 1 112 132 SER . 4402 1 113 133 ALA . 4402 1 114 134 MET . 4402 1 115 135 SER . 4402 1 116 136 ARG . 4402 1 117 137 PRO . 4402 1 118 138 ILE . 4402 1 119 139 ILE . 4402 1 120 140 HIS . 4402 1 121 141 PHE . 4402 1 122 142 GLY . 4402 1 123 143 SER . 4402 1 124 144 ASP . 4402 1 125 145 TYR . 4402 1 126 146 GLU . 4402 1 127 147 ASP . 4402 1 128 148 ARG . 4402 1 129 149 TYR . 4402 1 130 150 TYR . 4402 1 131 151 ARG . 4402 1 132 152 GLU . 4402 1 133 153 ASN . 4402 1 134 154 MET . 4402 1 135 155 HIS . 4402 1 136 156 ARG . 4402 1 137 157 TYR . 4402 1 138 158 PRO . 4402 1 139 159 ASN . 4402 1 140 160 GLN . 4402 1 141 161 VAL . 4402 1 142 162 TYR . 4402 1 143 163 TYR . 4402 1 144 164 ARG . 4402 1 145 165 PRO . 4402 1 146 166 MET . 4402 1 147 167 ASP . 4402 1 148 168 GLU . 4402 1 149 169 TYR . 4402 1 150 170 SER . 4402 1 151 171 ASN . 4402 1 152 172 GLN . 4402 1 153 173 ASN . 4402 1 154 174 ASN . 4402 1 155 175 PHE . 4402 1 156 176 VAL . 4402 1 157 177 HIS . 4402 1 158 178 ASP . 4402 1 159 179 CYS . 4402 1 160 180 VAL . 4402 1 161 181 ASN . 4402 1 162 182 ILE . 4402 1 163 183 THR . 4402 1 164 184 ILE . 4402 1 165 185 LYS . 4402 1 166 186 GLN . 4402 1 167 187 HIS . 4402 1 168 188 THR . 4402 1 169 189 VAL . 4402 1 170 190 THR . 4402 1 171 191 THR . 4402 1 172 192 THR . 4402 1 173 193 THR . 4402 1 174 194 LYS . 4402 1 175 195 GLY . 4402 1 176 196 GLU . 4402 1 177 197 ASN . 4402 1 178 198 PHE . 4402 1 179 199 THR . 4402 1 180 200 GLU . 4402 1 181 201 THR . 4402 1 182 202 ASP . 4402 1 183 203 VAL . 4402 1 184 204 LYS . 4402 1 185 205 MET . 4402 1 186 206 MET . 4402 1 187 207 GLU . 4402 1 188 208 ARG . 4402 1 189 209 VAL . 4402 1 190 210 VAL . 4402 1 191 211 GLU . 4402 1 192 212 GLN . 4402 1 193 213 MET . 4402 1 194 214 CYS . 4402 1 195 215 ILE . 4402 1 196 216 THR . 4402 1 197 217 GLN . 4402 1 198 218 TYR . 4402 1 199 219 GLU . 4402 1 200 220 ARG . 4402 1 201 221 GLU . 4402 1 202 222 SER . 4402 1 203 223 GLN . 4402 1 204 224 ALA . 4402 1 205 225 TYR . 4402 1 206 226 TYR . 4402 1 207 227 GLN . 4402 1 208 228 ARG . 4402 1 209 229 GLY . 4402 1 210 230 SER . 4402 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 4402 1 . SER 2 2 4402 1 . LYS 3 3 4402 1 . LYS 4 4 4402 1 . ARG 5 5 4402 1 . PRO 6 6 4402 1 . LYS 7 7 4402 1 . PRO 8 8 4402 1 . GLY 9 9 4402 1 . GLY 10 10 4402 1 . TRP 11 11 4402 1 . ASN 12 12 4402 1 . THR 13 13 4402 1 . GLY 14 14 4402 1 . GLY 15 15 4402 1 . SER 16 16 4402 1 . ARG 17 17 4402 1 . TYR 18 18 4402 1 . PRO 19 19 4402 1 . GLY 20 20 4402 1 . GLN 21 21 4402 1 . GLY 22 22 4402 1 . SER 23 23 4402 1 . PRO 24 24 4402 1 . GLY 25 25 4402 1 . GLY 26 26 4402 1 . ASN 27 27 4402 1 . ARG 28 28 4402 1 . TYR 29 29 4402 1 . PRO 30 30 4402 1 . PRO 31 31 4402 1 . GLN 32 32 4402 1 . GLY 33 33 4402 1 . GLY 34 34 4402 1 . GLY 35 35 4402 1 . GLY 36 36 4402 1 . TRP 37 37 4402 1 . GLY 38 38 4402 1 . GLN 39 39 4402 1 . PRO 40 40 4402 1 . HIS 41 41 4402 1 . GLY 42 42 4402 1 . GLY 43 43 4402 1 . GLY 44 44 4402 1 . TRP 45 45 4402 1 . GLY 46 46 4402 1 . GLN 47 47 4402 1 . PRO 48 48 4402 1 . HIS 49 49 4402 1 . GLY 50 50 4402 1 . GLY 51 51 4402 1 . GLY 52 52 4402 1 . TRP 53 53 4402 1 . GLY 54 54 4402 1 . GLN 55 55 4402 1 . PRO 56 56 4402 1 . HIS 57 57 4402 1 . GLY 58 58 4402 1 . GLY 59 59 4402 1 . GLY 60 60 4402 1 . TRP 61 61 4402 1 . GLY 62 62 4402 1 . GLN 63 63 4402 1 . PRO 64 64 4402 1 . HIS 65 65 4402 1 . GLY 66 66 4402 1 . GLY 67 67 4402 1 . GLY 68 68 4402 1 . TRP 69 69 4402 1 . GLY 70 70 4402 1 . GLN 71 71 4402 1 . GLY 72 72 4402 1 . GLY 73 73 4402 1 . GLY 74 74 4402 1 . THR 75 75 4402 1 . HIS 76 76 4402 1 . SER 77 77 4402 1 . GLN 78 78 4402 1 . TRP 79 79 4402 1 . ASN 80 80 4402 1 . LYS 81 81 4402 1 . PRO 82 82 4402 1 . SER 83 83 4402 1 . LYS 84 84 4402 1 . PRO 85 85 4402 1 . LYS 86 86 4402 1 . THR 87 87 4402 1 . ASN 88 88 4402 1 . MET 89 89 4402 1 . LYS 90 90 4402 1 . HIS 91 91 4402 1 . MET 92 92 4402 1 . ALA 93 93 4402 1 . GLY 94 94 4402 1 . ALA 95 95 4402 1 . ALA 96 96 4402 1 . ALA 97 97 4402 1 . ALA 98 98 4402 1 . GLY 99 99 4402 1 . ALA 100 100 4402 1 . VAL 101 101 4402 1 . VAL 102 102 4402 1 . GLY 103 103 4402 1 . GLY 104 104 4402 1 . LEU 105 105 4402 1 . GLY 106 106 4402 1 . GLY 107 107 4402 1 . TYR 108 108 4402 1 . MET 109 109 4402 1 . LEU 110 110 4402 1 . GLY 111 111 4402 1 . SER 112 112 4402 1 . ALA 113 113 4402 1 . MET 114 114 4402 1 . SER 115 115 4402 1 . ARG 116 116 4402 1 . PRO 117 117 4402 1 . ILE 118 118 4402 1 . ILE 119 119 4402 1 . HIS 120 120 4402 1 . PHE 121 121 4402 1 . GLY 122 122 4402 1 . SER 123 123 4402 1 . ASP 124 124 4402 1 . TYR 125 125 4402 1 . GLU 126 126 4402 1 . ASP 127 127 4402 1 . ARG 128 128 4402 1 . TYR 129 129 4402 1 . TYR 130 130 4402 1 . ARG 131 131 4402 1 . GLU 132 132 4402 1 . ASN 133 133 4402 1 . MET 134 134 4402 1 . HIS 135 135 4402 1 . ARG 136 136 4402 1 . TYR 137 137 4402 1 . PRO 138 138 4402 1 . ASN 139 139 4402 1 . GLN 140 140 4402 1 . VAL 141 141 4402 1 . TYR 142 142 4402 1 . TYR 143 143 4402 1 . ARG 144 144 4402 1 . PRO 145 145 4402 1 . MET 146 146 4402 1 . ASP 147 147 4402 1 . GLU 148 148 4402 1 . TYR 149 149 4402 1 . SER 150 150 4402 1 . ASN 151 151 4402 1 . GLN 152 152 4402 1 . ASN 153 153 4402 1 . ASN 154 154 4402 1 . PHE 155 155 4402 1 . VAL 156 156 4402 1 . HIS 157 157 4402 1 . ASP 158 158 4402 1 . CYS 159 159 4402 1 . VAL 160 160 4402 1 . ASN 161 161 4402 1 . ILE 162 162 4402 1 . THR 163 163 4402 1 . ILE 164 164 4402 1 . LYS 165 165 4402 1 . GLN 166 166 4402 1 . HIS 167 167 4402 1 . THR 168 168 4402 1 . VAL 169 169 4402 1 . THR 170 170 4402 1 . THR 171 171 4402 1 . THR 172 172 4402 1 . THR 173 173 4402 1 . LYS 174 174 4402 1 . GLY 175 175 4402 1 . GLU 176 176 4402 1 . ASN 177 177 4402 1 . PHE 178 178 4402 1 . THR 179 179 4402 1 . GLU 180 180 4402 1 . THR 181 181 4402 1 . ASP 182 182 4402 1 . VAL 183 183 4402 1 . LYS 184 184 4402 1 . MET 185 185 4402 1 . MET 186 186 4402 1 . GLU 187 187 4402 1 . ARG 188 188 4402 1 . VAL 189 189 4402 1 . VAL 190 190 4402 1 . GLU 191 191 4402 1 . GLN 192 192 4402 1 . MET 193 193 4402 1 . CYS 194 194 4402 1 . ILE 195 195 4402 1 . THR 196 196 4402 1 . GLN 197 197 4402 1 . TYR 198 198 4402 1 . GLU 199 199 4402 1 . ARG 200 200 4402 1 . GLU 201 201 4402 1 . SER 202 202 4402 1 . GLN 203 203 4402 1 . ALA 204 204 4402 1 . TYR 205 205 4402 1 . TYR 206 206 4402 1 . GLN 207 207 4402 1 . ARG 208 208 4402 1 . GLY 209 209 4402 1 . SER 210 210 4402 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 4402 _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 $hPrP(23-230) . 9606 . . 'homo sapiens' human . . Eukaryota metazoa homo sapiens . . . . . . . . . . . . . . . . . . . . . 4402 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 4402 _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 $hPrP(23-230) . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4402 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 4402 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'human prion protein' '[U-13C; U-15N]' . . 1 $hPrP(23-230) . . 1 . . mM . . . . 4402 1 stop_ save_ ####################### # Sample conditions # ####################### save_Ex-cond1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond1 _Sample_condition_list.Entry_ID 4402 _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' 0.01 . M 4402 1 pH 4.5 0.1 n/a 4402 1 temperature 293 1 K 4402 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 4402 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 4402 _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 NMR_spectrometer Bruker DRX . 600 . . . 4402 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 4402 _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 HNCA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4402 1 2 ct-HNCA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4402 1 3 HNCACB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4402 1 4 CBCA(CO)NNH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4402 1 5 HN(COCA)NNH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4402 1 6 (H)N(CO-TOCSY)NH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4402 1 7 (H)CA(CO-TOCSY)NH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4402 1 8 (H)CBCA(CO-TOCSY)NH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4402 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 4402 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name HNCA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 4402 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name ct-HNCA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 4402 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HNCACB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 4402 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name CBCA(CO)NNH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 4402 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name HN(COCA)NNH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 4402 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name (H)N(CO-TOCSY)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 4402 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name (H)CA(CO-TOCSY)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 4402 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name (H)CBCA(CO-TOCSY)NH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 4402 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 4402 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 4402 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 4402 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_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_1 _Assigned_chem_shift_list.Entry_ID 4402 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 HNCA . . . 4402 1 2 ct-HNCA . . . 4402 1 3 HNCACB . . . 4402 1 4 CBCA(CO)NNH . . . 4402 1 5 HN(COCA)NNH . . . 4402 1 6 (H)N(CO-TOCSY)NH . . . 4402 1 7 (H)CA(CO-TOCSY)NH . . . 4402 1 8 (H)CBCA(CO-TOCSY)NH . . . 4402 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 GLY CA C 13 43.1 . . 1 . . . . . . . . 4402 1 2 . 1 1 1 1 GLY HA2 H 1 3.86 . . 1 . . . . . . . . 4402 1 3 . 1 1 1 1 GLY HA3 H 1 3.86 . . 1 . . . . . . . . 4402 1 4 . 1 1 2 2 SER N N 15 115.7 . . 1 . . . . . . . . 4402 1 5 . 1 1 2 2 SER H H 1 8.65 . . 1 . . . . . . . . 4402 1 6 . 1 1 2 2 SER CA C 13 58.3 . . 1 . . . . . . . . 4402 1 7 . 1 1 2 2 SER HA H 1 4.48 . . 1 . . . . . . . . 4402 1 8 . 1 1 2 2 SER CB C 13 64.2 . . 1 . . . . . . . . 4402 1 9 . 1 1 2 2 SER HB2 H 1 3.83 . . 1 . . . . . . . . 4402 1 10 . 1 1 2 2 SER HB3 H 1 3.83 . . 1 . . . . . . . . 4402 1 11 . 1 1 3 3 LYS N N 15 123.8 . . 1 . . . . . . . . 4402 1 12 . 1 1 3 3 LYS H H 1 8.52 . . 1 . . . . . . . . 4402 1 13 . 1 1 3 3 LYS CA C 13 56.2 . . 1 . . . . . . . . 4402 1 14 . 1 1 3 3 LYS HA H 1 4.29 . . 1 . . . . . . . . 4402 1 15 . 1 1 3 3 LYS CB C 13 32.7 . . 1 . . . . . . . . 4402 1 16 . 1 1 3 3 LYS HB2 H 1 1.78 . . 2 . . . . . . . . 4402 1 17 . 1 1 3 3 LYS HB3 H 1 1.67 . . 2 . . . . . . . . 4402 1 18 . 1 1 3 3 LYS CG C 13 24.4 . . 1 . . . . . . . . 4402 1 19 . 1 1 3 3 LYS HG2 H 1 1.41 . . 1 . . . . . . . . 4402 1 20 . 1 1 3 3 LYS HG3 H 1 1.41 . . 1 . . . . . . . . 4402 1 21 . 1 1 3 3 LYS CD C 13 28.8 . . 1 . . . . . . . . 4402 1 22 . 1 1 3 3 LYS HD2 H 1 1.64 . . 1 . . . . . . . . 4402 1 23 . 1 1 3 3 LYS HD3 H 1 1.64 . . 1 . . . . . . . . 4402 1 24 . 1 1 3 3 LYS CE C 13 41.9 . . 1 . . . . . . . . 4402 1 25 . 1 1 3 3 LYS HE2 H 1 2.96 . . 1 . . . . . . . . 4402 1 26 . 1 1 3 3 LYS HE3 H 1 2.96 . . 1 . . . . . . . . 4402 1 27 . 1 1 4 4 LYS N N 15 123.4 . . 1 . . . . . . . . 4402 1 28 . 1 1 4 4 LYS H H 1 8.38 . . 1 . . . . . . . . 4402 1 29 . 1 1 4 4 LYS CA C 13 56.2 . . 1 . . . . . . . . 4402 1 30 . 1 1 4 4 LYS HA H 1 4.24 . . 1 . . . . . . . . 4402 1 31 . 1 1 4 4 LYS CB C 13 32.8 . . 1 . . . . . . . . 4402 1 32 . 1 1 4 4 LYS HB2 H 1 1.72 . . 2 . . . . . . . . 4402 1 33 . 1 1 4 4 LYS HB3 H 1 1.61 . . 2 . . . . . . . . 4402 1 34 . 1 1 4 4 LYS CG C 13 24.4 . . 1 . . . . . . . . 4402 1 35 . 1 1 4 4 LYS HG2 H 1 1.34 . . 1 . . . . . . . . 4402 1 36 . 1 1 4 4 LYS HG3 H 1 1.34 . . 1 . . . . . . . . 4402 1 37 . 1 1 4 4 LYS CD C 13 28.5 . . 1 . . . . . . . . 4402 1 38 . 1 1 4 4 LYS HD2 H 1 1.38 . . 1 . . . . . . . . 4402 1 39 . 1 1 4 4 LYS HD3 H 1 1.38 . . 1 . . . . . . . . 4402 1 40 . 1 1 4 4 LYS CE C 13 41.8 . . 1 . . . . . . . . 4402 1 41 . 1 1 4 4 LYS HE2 H 1 2.92 . . 1 . . . . . . . . 4402 1 42 . 1 1 4 4 LYS HE3 H 1 2.92 . . 1 . . . . . . . . 4402 1 43 . 1 1 5 5 ARG N N 15 124.5 . . 1 . . . . . . . . 4402 1 44 . 1 1 5 5 ARG H H 1 8.47 . . 1 . . . . . . . . 4402 1 45 . 1 1 5 5 ARG CA C 13 53.7 . . 1 . . . . . . . . 4402 1 46 . 1 1 5 5 ARG HA H 1 4.59 . . 1 . . . . . . . . 4402 1 47 . 1 1 5 5 ARG CB C 13 30.1 . . 1 . . . . . . . . 4402 1 48 . 1 1 5 5 ARG HB2 H 1 1.80 . . 1 . . . . . . . . 4402 1 49 . 1 1 5 5 ARG HB3 H 1 1.80 . . 1 . . . . . . . . 4402 1 50 . 1 1 5 5 ARG CG C 13 26.8 . . 1 . . . . . . . . 4402 1 51 . 1 1 5 5 ARG HG2 H 1 1.66 . . 1 . . . . . . . . 4402 1 52 . 1 1 5 5 ARG HG3 H 1 1.66 . . 1 . . . . . . . . 4402 1 53 . 1 1 5 5 ARG CD C 13 43.3 . . 1 . . . . . . . . 4402 1 54 . 1 1 5 5 ARG HD2 H 1 3.18 . . 1 . . . . . . . . 4402 1 55 . 1 1 5 5 ARG HD3 H 1 3.18 . . 1 . . . . . . . . 4402 1 56 . 1 1 5 5 ARG NE N 15 84.7 . . 1 . . . . . . . . 4402 1 57 . 1 1 5 5 ARG HE H 1 7.17 . . 1 . . . . . . . . 4402 1 58 . 1 1 6 6 PRO N N 15 116.9 . . 1 . . . . . . . . 4402 1 59 . 1 1 6 6 PRO CD C 13 50.6 . . 1 . . . . . . . . 4402 1 60 . 1 1 6 6 PRO CA C 13 62.7 . . 1 . . . . . . . . 4402 1 61 . 1 1 6 6 PRO HA H 1 4.38 . . 1 . . . . . . . . 4402 1 62 . 1 1 6 6 PRO CB C 13 31.8 . . 1 . . . . . . . . 4402 1 63 . 1 1 6 6 PRO HB2 H 1 2.22 . . 2 . . . . . . . . 4402 1 64 . 1 1 6 6 PRO HB3 H 1 1.82 . . 2 . . . . . . . . 4402 1 65 . 1 1 6 6 PRO CG C 13 27.2 . . 1 . . . . . . . . 4402 1 66 . 1 1 6 6 PRO HG2 H 1 1.94 . . 1 . . . . . . . . 4402 1 67 . 1 1 6 6 PRO HG3 H 1 1.94 . . 1 . . . . . . . . 4402 1 68 . 1 1 6 6 PRO HD2 H 1 3.75 . . 2 . . . . . . . . 4402 1 69 . 1 1 6 6 PRO HD3 H 1 3.58 . . 2 . . . . . . . . 4402 1 70 . 1 1 7 7 LYS N N 15 122.9 . . 1 . . . . . . . . 4402 1 71 . 1 1 7 7 LYS H H 1 8.39 . . 1 . . . . . . . . 4402 1 72 . 1 1 7 7 LYS CA C 13 54.0 . . 1 . . . . . . . . 4402 1 73 . 1 1 7 7 LYS HA H 1 4.52 . . 1 . . . . . . . . 4402 1 74 . 1 1 7 7 LYS CB C 13 32.3 . . 1 . . . . . . . . 4402 1 75 . 1 1 7 7 LYS HB2 H 1 1.72 . . 2 . . . . . . . . 4402 1 76 . 1 1 7 7 LYS HB3 H 1 1.69 . . 2 . . . . . . . . 4402 1 77 . 1 1 7 7 LYS CG C 13 24.5 . . 1 . . . . . . . . 4402 1 78 . 1 1 7 7 LYS HG2 H 1 1.39 . . 1 . . . . . . . . 4402 1 79 . 1 1 7 7 LYS HG3 H 1 1.39 . . 1 . . . . . . . . 4402 1 80 . 1 1 7 7 LYS CD C 13 29.2 . . 1 . . . . . . . . 4402 1 81 . 1 1 7 7 LYS HD2 H 1 1.56 . . 1 . . . . . . . . 4402 1 82 . 1 1 7 7 LYS HD3 H 1 1.56 . . 1 . . . . . . . . 4402 1 83 . 1 1 7 7 LYS CE C 13 41.8 . . 1 . . . . . . . . 4402 1 84 . 1 1 7 7 LYS HE2 H 1 2.89 . . 1 . . . . . . . . 4402 1 85 . 1 1 7 7 LYS HE3 H 1 2.89 . . 1 . . . . . . . . 4402 1 86 . 1 1 8 8 PRO N N 15 117.7 . . 1 . . . . . . . . 4402 1 87 . 1 1 8 8 PRO CD C 13 50.4 . . 1 . . . . . . . . 4402 1 88 . 1 1 8 8 PRO CA C 13 63.3 . . 1 . . . . . . . . 4402 1 89 . 1 1 8 8 PRO HA H 1 4.38 . . 1 . . . . . . . . 4402 1 90 . 1 1 8 8 PRO CB C 13 31.8 . . 1 . . . . . . . . 4402 1 91 . 1 1 8 8 PRO HB2 H 1 2.25 . . 2 . . . . . . . . 4402 1 92 . 1 1 8 8 PRO HB3 H 1 1.88 . . 2 . . . . . . . . 4402 1 93 . 1 1 8 8 PRO CG C 13 26.9 . . 1 . . . . . . . . 4402 1 94 . 1 1 8 8 PRO HG2 H 1 1.95 . . 1 . . . . . . . . 4402 1 95 . 1 1 8 8 PRO HG3 H 1 1.95 . . 1 . . . . . . . . 4402 1 96 . 1 1 8 8 PRO HD2 H 1 3.80 . . 2 . . . . . . . . 4402 1 97 . 1 1 8 8 PRO HD3 H 1 3.58 . . 2 . . . . . . . . 4402 1 98 . 1 1 9 9 GLY N N 15 109.5 . . 1 . . . . . . . . 4402 1 99 . 1 1 9 9 GLY H H 1 8.43 . . 1 . . . . . . . . 4402 1 100 . 1 1 9 9 GLY CA C 13 45.1 . . 1 . . . . . . . . 4402 1 101 . 1 1 9 9 GLY HA2 H 1 3.85 . . 1 . . . . . . . . 4402 1 102 . 1 1 9 9 GLY HA3 H 1 3.85 . . 1 . . . . . . . . 4402 1 103 . 1 1 10 10 GLY N N 15 108.7 . . 1 . . . . . . . . 4402 1 104 . 1 1 10 10 GLY H H 1 8.23 . . 1 . . . . . . . . 4402 1 105 . 1 1 10 10 GLY CA C 13 44.9 . . 1 . . . . . . . . 4402 1 106 . 1 1 10 10 GLY HA2 H 1 3.86 . . 1 . . . . . . . . 4402 1 107 . 1 1 10 10 GLY HA3 H 1 3.86 . . 1 . . . . . . . . 4402 1 108 . 1 1 11 11 TRP N N 15 120.7 . . 1 . . . . . . . . 4402 1 109 . 1 1 11 11 TRP H H 1 8.05 . . 1 . . . . . . . . 4402 1 110 . 1 1 11 11 TRP CA C 13 57.3 . . 1 . . . . . . . . 4402 1 111 . 1 1 11 11 TRP HA H 1 4.59 . . 1 . . . . . . . . 4402 1 112 . 1 1 11 11 TRP CB C 13 29.1 . . 1 . . . . . . . . 4402 1 113 . 1 1 11 11 TRP HB2 H 1 3.22 . . 1 . . . . . . . . 4402 1 114 . 1 1 11 11 TRP HB3 H 1 3.22 . . 1 . . . . . . . . 4402 1 115 . 1 1 11 11 TRP CD1 C 13 127.0 . . 1 . . . . . . . . 4402 1 116 . 1 1 11 11 TRP HD1 H 1 7.19 . . 1 . . . . . . . . 4402 1 117 . 1 1 11 11 TRP NE1 N 15 129.2 . . 1 . . . . . . . . 4402 1 118 . 1 1 11 11 TRP HE1 H 1 10.08 . . 1 . . . . . . . . 4402 1 119 . 1 1 11 11 TRP CE3 C 13 120.7 . . 1 . . . . . . . . 4402 1 120 . 1 1 11 11 TRP HE3 H 1 7.55 . . 1 . . . . . . . . 4402 1 121 . 1 1 11 11 TRP HZ2 H 1 7.41 . . 1 . . . . . . . . 4402 1 122 . 1 1 12 12 ASN N N 15 120.5 . . 1 . . . . . . . . 4402 1 123 . 1 1 12 12 ASN H H 1 8.26 . . 1 . . . . . . . . 4402 1 124 . 1 1 12 12 ASN CA C 13 52.8 . . 1 . . . . . . . . 4402 1 125 . 1 1 12 12 ASN HA H 1 4.62 . . 1 . . . . . . . . 4402 1 126 . 1 1 12 12 ASN CB C 13 38.3 . . 1 . . . . . . . . 4402 1 127 . 1 1 12 12 ASN HB2 H 1 2.57 . . 2 . . . . . . . . 4402 1 128 . 1 1 12 12 ASN HB3 H 1 2.43 . . 2 . . . . . . . . 4402 1 129 . 1 1 12 12 ASN ND2 N 15 112.5 . . 1 . . . . . . . . 4402 1 130 . 1 1 12 12 ASN HD21 H 1 7.44 . . 2 . . . . . . . . 4402 1 131 . 1 1 12 12 ASN HD22 H 1 6.81 . . 2 . . . . . . . . 4402 1 132 . 1 1 13 13 THR N N 15 113.6 . . 1 . . . . . . . . 4402 1 133 . 1 1 13 13 THR H H 1 8.02 . . 1 . . . . . . . . 4402 1 134 . 1 1 13 13 THR CA C 13 61.6 . . 1 . . . . . . . . 4402 1 135 . 1 1 13 13 THR HA H 1 4.24 . . 1 . . . . . . . . 4402 1 136 . 1 1 13 13 THR CB C 13 70.0 . . 1 . . . . . . . . 4402 1 137 . 1 1 13 13 THR HB H 1 4.20 . . 1 . . . . . . . . 4402 1 138 . 1 1 13 13 THR HG21 H 1 1.11 . . 1 . . . . . . . . 4402 1 139 . 1 1 13 13 THR HG22 H 1 1.11 . . 1 . . . . . . . . 4402 1 140 . 1 1 13 13 THR HG23 H 1 1.11 . . 1 . . . . . . . . 4402 1 141 . 1 1 13 13 THR CG2 C 13 21.0 . . 1 . . . . . . . . 4402 1 142 . 1 1 14 14 GLY N N 15 111.0 . . 1 . . . . . . . . 4402 1 143 . 1 1 14 14 GLY H H 1 8.41 . . 1 . . . . . . . . 4402 1 144 . 1 1 14 14 GLY CA C 13 45.3 . . 1 . . . . . . . . 4402 1 145 . 1 1 14 14 GLY HA2 H 1 3.94 . . 1 . . . . . . . . 4402 1 146 . 1 1 14 14 GLY HA3 H 1 3.94 . . 1 . . . . . . . . 4402 1 147 . 1 1 15 15 GLY N N 15 108.8 . . 1 . . . . . . . . 4402 1 148 . 1 1 15 15 GLY H H 1 8.24 . . 1 . . . . . . . . 4402 1 149 . 1 1 15 15 GLY CA C 13 44.9 . . 1 . . . . . . . . 4402 1 150 . 1 1 15 15 GLY HA2 H 1 3.92 . . 1 . . . . . . . . 4402 1 151 . 1 1 15 15 GLY HA3 H 1 3.92 . . 1 . . . . . . . . 4402 1 152 . 1 1 16 16 SER N N 15 115.6 . . 1 . . . . . . . . 4402 1 153 . 1 1 16 16 SER H H 1 8.20 . . 1 . . . . . . . . 4402 1 154 . 1 1 16 16 SER CA C 13 58.2 . . 1 . . . . . . . . 4402 1 155 . 1 1 16 16 SER HA H 1 4.37 . . 1 . . . . . . . . 4402 1 156 . 1 1 16 16 SER CB C 13 63.8 . . 1 . . . . . . . . 4402 1 157 . 1 1 16 16 SER HB2 H 1 3.75 . . 1 . . . . . . . . 4402 1 158 . 1 1 16 16 SER HB3 H 1 3.75 . . 1 . . . . . . . . 4402 1 159 . 1 1 17 17 ARG N N 15 122.7 . . 1 . . . . . . . . 4402 1 160 . 1 1 17 17 ARG H H 1 8.29 . . 1 . . . . . . . . 4402 1 161 . 1 1 17 17 ARG CA C 13 55.8 . . 1 . . . . . . . . 4402 1 162 . 1 1 17 17 ARG HA H 1 4.24 . . 1 . . . . . . . . 4402 1 163 . 1 1 17 17 ARG CB C 13 30.6 . . 1 . . . . . . . . 4402 1 164 . 1 1 17 17 ARG HB2 H 1 1.61 . . 2 . . . . . . . . 4402 1 165 . 1 1 17 17 ARG HB3 H 1 1.58 . . 2 . . . . . . . . 4402 1 166 . 1 1 17 17 ARG CG C 13 26.6 . . 1 . . . . . . . . 4402 1 167 . 1 1 17 17 ARG HG2 H 1 1.42 . . 2 . . . . . . . . 4402 1 168 . 1 1 17 17 ARG HG3 H 1 1.38 . . 2 . . . . . . . . 4402 1 169 . 1 1 17 17 ARG CD C 13 43.0 . . 1 . . . . . . . . 4402 1 170 . 1 1 17 17 ARG HD2 H 1 3.03 . . 1 . . . . . . . . 4402 1 171 . 1 1 17 17 ARG HD3 H 1 3.03 . . 1 . . . . . . . . 4402 1 172 . 1 1 17 17 ARG NE N 15 84.7 . . 1 . . . . . . . . 4402 1 173 . 1 1 17 17 ARG HE H 1 7.09 . . 1 . . . . . . . . 4402 1 174 . 1 1 18 18 TYR N N 15 121.5 . . 1 . . . . . . . . 4402 1 175 . 1 1 18 18 TYR H H 1 8.11 . . 1 . . . . . . . . 4402 1 176 . 1 1 18 18 TYR CA C 13 55.1 . . 1 . . . . . . . . 4402 1 177 . 1 1 18 18 TYR HA H 1 4.81 . . 1 . . . . . . . . 4402 1 178 . 1 1 18 18 TYR CB C 13 38.1 . . 1 . . . . . . . . 4402 1 179 . 1 1 18 18 TYR HB2 H 1 2.99 . . 2 . . . . . . . . 4402 1 180 . 1 1 18 18 TYR HB3 H 1 2.79 . . 2 . . . . . . . . 4402 1 181 . 1 1 18 18 TYR CD1 C 13 133.5 . . 1 . . . . . . . . 4402 1 182 . 1 1 18 18 TYR HD1 H 1 7.11 . . 1 . . . . . . . . 4402 1 183 . 1 1 18 18 TYR HD2 H 1 7.11 . . 1 . . . . . . . . 4402 1 184 . 1 1 18 18 TYR CE1 C 13 117.9 . . 1 . . . . . . . . 4402 1 185 . 1 1 18 18 TYR HE1 H 1 6.80 . . 1 . . . . . . . . 4402 1 186 . 1 1 18 18 TYR HE2 H 1 6.80 . . 1 . . . . . . . . 4402 1 187 . 1 1 19 19 PRO N N 15 117.3 . . 1 . . . . . . . . 4402 1 188 . 1 1 19 19 PRO CD C 13 50.5 . . 1 . . . . . . . . 4402 1 189 . 1 1 19 19 PRO CA C 13 63.5 . . 1 . . . . . . . . 4402 1 190 . 1 1 19 19 PRO HA H 1 4.33 . . 1 . . . . . . . . 4402 1 191 . 1 1 19 19 PRO CB C 13 31.7 . . 1 . . . . . . . . 4402 1 192 . 1 1 19 19 PRO HB2 H 1 2.19 . . 2 . . . . . . . . 4402 1 193 . 1 1 19 19 PRO HB3 H 1 1.88 . . 2 . . . . . . . . 4402 1 194 . 1 1 19 19 PRO CG C 13 26.6 . . 1 . . . . . . . . 4402 1 195 . 1 1 19 19 PRO HG2 H 1 1.91 . . 1 . . . . . . . . 4402 1 196 . 1 1 19 19 PRO HG3 H 1 1.91 . . 1 . . . . . . . . 4402 1 197 . 1 1 19 19 PRO HD2 H 1 3.70 . . 2 . . . . . . . . 4402 1 198 . 1 1 19 19 PRO HD3 H 1 3.49 . . 2 . . . . . . . . 4402 1 199 . 1 1 20 20 GLY N N 15 109.2 . . 1 . . . . . . . . 4402 1 200 . 1 1 20 20 GLY H H 1 8.16 . . 1 . . . . . . . . 4402 1 201 . 1 1 20 20 GLY CA C 13 44.9 . . 1 . . . . . . . . 4402 1 202 . 1 1 20 20 GLY HA2 H 1 3.88 . . 1 . . . . . . . . 4402 1 203 . 1 1 20 20 GLY HA3 H 1 3.88 . . 1 . . . . . . . . 4402 1 204 . 1 1 21 21 GLN N N 15 119.9 . . 1 . . . . . . . . 4402 1 205 . 1 1 21 21 GLN H H 1 8.15 . . 1 . . . . . . . . 4402 1 206 . 1 1 21 21 GLN CA C 13 56.0 . . 1 . . . . . . . . 4402 1 207 . 1 1 21 21 GLN HA H 1 4.26 . . 1 . . . . . . . . 4402 1 208 . 1 1 21 21 GLN CB C 13 29.4 . . 1 . . . . . . . . 4402 1 209 . 1 1 21 21 GLN HB2 H 1 2.04 . . 2 . . . . . . . . 4402 1 210 . 1 1 21 21 GLN HB3 H 1 1.86 . . 2 . . . . . . . . 4402 1 211 . 1 1 21 21 GLN CG C 13 33.6 . . 1 . . . . . . . . 4402 1 212 . 1 1 21 21 GLN HG2 H 1 2.28 . . 1 . . . . . . . . 4402 1 213 . 1 1 21 21 GLN HG3 H 1 2.28 . . 1 . . . . . . . . 4402 1 214 . 1 1 21 21 GLN NE2 N 15 112.1 . . 1 . . . . . . . . 4402 1 215 . 1 1 21 21 GLN HE21 H 1 7.47 . . 2 . . . . . . . . 4402 1 216 . 1 1 21 21 GLN HE22 H 1 6.81 . . 2 . . . . . . . . 4402 1 217 . 1 1 22 22 GLY N N 15 110.5 . . 1 . . . . . . . . 4402 1 218 . 1 1 22 22 GLY H H 1 8.50 . . 1 . . . . . . . . 4402 1 219 . 1 1 22 22 GLY CA C 13 44.7 . . 1 . . . . . . . . 4402 1 220 . 1 1 22 22 GLY HA2 H 1 3.93 . . 1 . . . . . . . . 4402 1 221 . 1 1 22 22 GLY HA3 H 1 3.93 . . 1 . . . . . . . . 4402 1 222 . 1 1 23 23 SER N N 15 116.6 . . 1 . . . . . . . . 4402 1 223 . 1 1 23 23 SER H H 1 8.20 . . 1 . . . . . . . . 4402 1 224 . 1 1 23 23 SER CA C 13 56.1 . . 1 . . . . . . . . 4402 1 225 . 1 1 23 23 SER HA H 1 4.71 . . 1 . . . . . . . . 4402 1 226 . 1 1 23 23 SER CB C 13 63.0 . . 1 . . . . . . . . 4402 1 227 . 1 1 23 23 SER HB2 H 1 3.78 . . 1 . . . . . . . . 4402 1 228 . 1 1 23 23 SER HB3 H 1 3.78 . . 1 . . . . . . . . 4402 1 229 . 1 1 24 24 PRO N N 15 118.4 . . 1 . . . . . . . . 4402 1 230 . 1 1 24 24 PRO CD C 13 50.5 . . 1 . . . . . . . . 4402 1 231 . 1 1 24 24 PRO CA C 13 63.6 . . 1 . . . . . . . . 4402 1 232 . 1 1 24 24 PRO HA H 1 4.36 . . 1 . . . . . . . . 4402 1 233 . 1 1 24 24 PRO CB C 13 31.8 . . 1 . . . . . . . . 4402 1 234 . 1 1 24 24 PRO HB2 H 1 2.20 . . 2 . . . . . . . . 4402 1 235 . 1 1 24 24 PRO HB3 H 1 1.89 . . 2 . . . . . . . . 4402 1 236 . 1 1 24 24 PRO CG C 13 26.6 . . 1 . . . . . . . . 4402 1 237 . 1 1 24 24 PRO HG2 H 1 1.91 . . 1 . . . . . . . . 4402 1 238 . 1 1 24 24 PRO HG3 H 1 1.91 . . 1 . . . . . . . . 4402 1 239 . 1 1 24 24 PRO HD2 H 1 3.71 . . 2 . . . . . . . . 4402 1 240 . 1 1 24 24 PRO HD3 H 1 3.65 . . 2 . . . . . . . . 4402 1 241 . 1 1 25 25 GLY N N 15 109.3 . . 1 . . . . . . . . 4402 1 242 . 1 1 25 25 GLY H H 1 8.43 . . 1 . . . . . . . . 4402 1 243 . 1 1 25 25 GLY CA C 13 45.0 . . 1 . . . . . . . . 4402 1 244 . 1 1 25 25 GLY HA2 H 1 3.90 . . 1 . . . . . . . . 4402 1 245 . 1 1 25 25 GLY HA3 H 1 3.90 . . 1 . . . . . . . . 4402 1 246 . 1 1 26 26 GLY N N 15 108.5 . . 1 . . . . . . . . 4402 1 247 . 1 1 26 26 GLY H H 1 8.18 . . 1 . . . . . . . . 4402 1 248 . 1 1 26 26 GLY CA C 13 45.0 . . 1 . . . . . . . . 4402 1 249 . 1 1 26 26 GLY HA2 H 1 3.89 . . 1 . . . . . . . . 4402 1 250 . 1 1 26 26 GLY HA3 H 1 3.89 . . 1 . . . . . . . . 4402 1 251 . 1 1 27 27 ASN N N 15 118.6 . . 1 . . . . . . . . 4402 1 252 . 1 1 27 27 ASN H H 1 8.31 . . 1 . . . . . . . . 4402 1 253 . 1 1 27 27 ASN CA C 13 53.0 . . 1 . . . . . . . . 4402 1 254 . 1 1 27 27 ASN HA H 1 4.57 . . 1 . . . . . . . . 4402 1 255 . 1 1 27 27 ASN CB C 13 38.8 . . 1 . . . . . . . . 4402 1 256 . 1 1 27 27 ASN HB2 H 1 2.64 . . 1 . . . . . . . . 4402 1 257 . 1 1 27 27 ASN HB3 H 1 2.64 . . 1 . . . . . . . . 4402 1 258 . 1 1 27 27 ASN ND2 N 15 112.7 . . 1 . . . . . . . . 4402 1 259 . 1 1 27 27 ASN HD21 H 1 7.51 . . 2 . . . . . . . . 4402 1 260 . 1 1 27 27 ASN HD22 H 1 6.88 . . 2 . . . . . . . . 4402 1 261 . 1 1 28 28 ARG N N 15 121.2 . . 1 . . . . . . . . 4402 1 262 . 1 1 28 28 ARG H H 1 8.20 . . 1 . . . . . . . . 4402 1 263 . 1 1 28 28 ARG CA C 13 55.8 . . 1 . . . . . . . . 4402 1 264 . 1 1 28 28 ARG HA H 1 4.18 . . 1 . . . . . . . . 4402 1 265 . 1 1 28 28 ARG CB C 13 30.5 . . 1 . . . . . . . . 4402 1 266 . 1 1 28 28 ARG HB2 H 1 1.58 . . 2 . . . . . . . . 4402 1 267 . 1 1 28 28 ARG HB3 H 1 1.57 . . 2 . . . . . . . . 4402 1 268 . 1 1 28 28 ARG CG C 13 26.4 . . 1 . . . . . . . . 4402 1 269 . 1 1 28 28 ARG HG2 H 1 1.40 . . 2 . . . . . . . . 4402 1 270 . 1 1 28 28 ARG HG3 H 1 1.35 . . 2 . . . . . . . . 4402 1 271 . 1 1 28 28 ARG CD C 13 43.1 . . 1 . . . . . . . . 4402 1 272 . 1 1 28 28 ARG HD2 H 1 3.03 . . 1 . . . . . . . . 4402 1 273 . 1 1 28 28 ARG HD3 H 1 3.03 . . 1 . . . . . . . . 4402 1 274 . 1 1 28 28 ARG NE N 15 84.6 . . 1 . . . . . . . . 4402 1 275 . 1 1 28 28 ARG HE H 1 7.06 . . 1 . . . . . . . . 4402 1 276 . 1 1 29 29 TYR N N 15 121.2 . . 1 . . . . . . . . 4402 1 277 . 1 1 29 29 TYR H H 1 8.10 . . 1 . . . . . . . . 4402 1 278 . 1 1 29 29 TYR CA C 13 55.1 . . 1 . . . . . . . . 4402 1 279 . 1 1 29 29 TYR HA H 1 4.81 . . 1 . . . . . . . . 4402 1 280 . 1 1 29 29 TYR CB C 13 38.0 . . 1 . . . . . . . . 4402 1 281 . 1 1 29 29 TYR HB2 H 1 3.01 . . 2 . . . . . . . . 4402 1 282 . 1 1 29 29 TYR HB3 H 1 2.72 . . 2 . . . . . . . . 4402 1 283 . 1 1 29 29 TYR CD1 C 13 133.4 . . 1 . . . . . . . . 4402 1 284 . 1 1 29 29 TYR HD1 H 1 7.11 . . 1 . . . . . . . . 4402 1 285 . 1 1 29 29 TYR HD2 H 1 7.11 . . 1 . . . . . . . . 4402 1 286 . 1 1 29 29 TYR CE1 C 13 118.1 . . 1 . . . . . . . . 4402 1 287 . 1 1 29 29 TYR HE1 H 1 6.80 . . 1 . . . . . . . . 4402 1 288 . 1 1 29 29 TYR HE2 H 1 6.80 . . 1 . . . . . . . . 4402 1 289 . 1 1 30 30 PRO N N 15 115.2 . . 1 . . . . . . . . 4402 1 290 . 1 1 30 30 PRO HA H 1 4.27 . . 1 . . . . . . . . 4402 1 291 . 1 1 30 30 PRO HD2 H 1 3.66 . . 2 . . . . . . . . 4402 1 292 . 1 1 30 30 PRO HD3 H 1 3.51 . . 2 . . . . . . . . 4402 1 293 . 1 1 31 31 PRO N N 15 115.2 . . 1 . . . . . . . . 4402 1 294 . 1 1 31 31 PRO CD C 13 50.3 . . 1 . . . . . . . . 4402 1 295 . 1 1 31 31 PRO CA C 13 63.2 . . 1 . . . . . . . . 4402 1 296 . 1 1 31 31 PRO HA H 1 4.36 . . 1 . . . . . . . . 4402 1 297 . 1 1 31 31 PRO CB C 13 31.6 . . 1 . . . . . . . . 4402 1 298 . 1 1 31 31 PRO HB2 H 1 2.19 . . 2 . . . . . . . . 4402 1 299 . 1 1 31 31 PRO HB3 H 1 1.82 . . 2 . . . . . . . . 4402 1 300 . 1 1 31 31 PRO CG C 13 27.3 . . 1 . . . . . . . . 4402 1 301 . 1 1 31 31 PRO HG2 H 1 1.92 . . 1 . . . . . . . . 4402 1 302 . 1 1 31 31 PRO HG3 H 1 1.92 . . 1 . . . . . . . . 4402 1 303 . 1 1 31 31 PRO HD2 H 1 3.68 . . 2 . . . . . . . . 4402 1 304 . 1 1 31 31 PRO HD3 H 1 3.51 . . 2 . . . . . . . . 4402 1 305 . 1 1 32 32 GLN N N 15 120.3 . . 1 . . . . . . . . 4402 1 306 . 1 1 32 32 GLN H H 1 8.50 . . 1 . . . . . . . . 4402 1 307 . 1 1 32 32 GLN CA C 13 55.5 . . 1 . . . . . . . . 4402 1 308 . 1 1 32 32 GLN HA H 1 4.24 . . 1 . . . . . . . . 4402 1 309 . 1 1 32 32 GLN CB C 13 29.0 . . 1 . . . . . . . . 4402 1 310 . 1 1 32 32 GLN HB2 H 1 2.03 . . 2 . . . . . . . . 4402 1 311 . 1 1 32 32 GLN HB3 H 1 1.90 . . 2 . . . . . . . . 4402 1 312 . 1 1 32 32 GLN CG C 13 33.5 . . 1 . . . . . . . . 4402 1 313 . 1 1 32 32 GLN HG2 H 1 2.31 . . 1 . . . . . . . . 4402 1 314 . 1 1 32 32 GLN HG3 H 1 2.31 . . 1 . . . . . . . . 4402 1 315 . 1 1 32 32 GLN NE2 N 15 112.5 . . 1 . . . . . . . . 4402 1 316 . 1 1 32 32 GLN HE21 H 1 7.47 . . 2 . . . . . . . . 4402 1 317 . 1 1 32 32 GLN HE22 H 1 6.84 . . 2 . . . . . . . . 4402 1 318 . 1 1 33 33 GLY N N 15 110.1 . . 1 . . . . . . . . 4402 1 319 . 1 1 33 33 GLY H H 1 8.40 . . 1 . . . . . . . . 4402 1 320 . 1 1 33 33 GLY CA C 13 45.1 . . 1 . . . . . . . . 4402 1 321 . 1 1 33 33 GLY HA2 H 1 3.90 . . 1 . . . . . . . . 4402 1 322 . 1 1 33 33 GLY HA3 H 1 3.90 . . 1 . . . . . . . . 4402 1 323 . 1 1 34 34 GLY N N 15 108.6 . . 1 . . . . . . . . 4402 1 324 . 1 1 34 34 GLY H H 1 8.25 . . 1 . . . . . . . . 4402 1 325 . 1 1 34 34 GLY CA C 13 44.8 . . 1 . . . . . . . . 4402 1 326 . 1 1 34 34 GLY HA2 H 1 3.84 . . 1 . . . . . . . . 4402 1 327 . 1 1 34 34 GLY HA3 H 1 3.84 . . 1 . . . . . . . . 4402 1 328 . 1 1 35 35 GLY N N 15 108.4 . . 1 . . . . . . . . 4402 1 329 . 1 1 35 35 GLY H H 1 8.24 . . 1 . . . . . . . . 4402 1 330 . 1 1 35 35 GLY CA C 13 45.1 . . 1 . . . . . . . . 4402 1 331 . 1 1 35 35 GLY HA2 H 1 3.85 . . 1 . . . . . . . . 4402 1 332 . 1 1 35 35 GLY HA3 H 1 3.85 . . 1 . . . . . . . . 4402 1 333 . 1 1 36 36 GLY N N 15 108.5 . . 1 . . . . . . . . 4402 1 334 . 1 1 36 36 GLY H H 1 8.17 . . 1 . . . . . . . . 4402 1 335 . 1 1 36 36 GLY CA C 13 44.8 . . 1 . . . . . . . . 4402 1 336 . 1 1 36 36 GLY HA2 H 1 3.86 . . 1 . . . . . . . . 4402 1 337 . 1 1 36 36 GLY HA3 H 1 3.86 . . 1 . . . . . . . . 4402 1 338 . 1 1 37 37 TRP N N 15 120.8 . . 1 . . . . . . . . 4402 1 339 . 1 1 37 37 TRP H H 1 8.03 . . 1 . . . . . . . . 4402 1 340 . 1 1 37 37 TRP CA C 13 57.4 . . 1 . . . . . . . . 4402 1 341 . 1 1 37 37 TRP HA H 1 4.56 . . 1 . . . . . . . . 4402 1 342 . 1 1 37 37 TRP CB C 13 29.3 . . 1 . . . . . . . . 4402 1 343 . 1 1 37 37 TRP HB2 H 1 3.26 . . 2 . . . . . . . . 4402 1 344 . 1 1 37 37 TRP HB3 H 1 3.14 . . 2 . . . . . . . . 4402 1 345 . 1 1 37 37 TRP CD1 C 13 127.1 . . 1 . . . . . . . . 4402 1 346 . 1 1 37 37 TRP HD1 H 1 7.17 . . 1 . . . . . . . . 4402 1 347 . 1 1 37 37 TRP NE1 N 15 129.2 . . 1 . . . . . . . . 4402 1 348 . 1 1 37 37 TRP HE1 H 1 10.04 . . 1 . . . . . . . . 4402 1 349 . 1 1 37 37 TRP CE3 C 13 120.7 . . 1 . . . . . . . . 4402 1 350 . 1 1 37 37 TRP HE3 H 1 7.51 . . 1 . . . . . . . . 4402 1 351 . 1 1 37 37 TRP HZ2 H 1 7.37 . . 1 . . . . . . . . 4402 1 352 . 1 1 38 38 GLY N N 15 110.5 . . 1 . . . . . . . . 4402 1 353 . 1 1 38 38 GLY H H 1 8.28 . . 1 . . . . . . . . 4402 1 354 . 1 1 38 38 GLY CA C 13 44.8 . . 1 . . . . . . . . 4402 1 355 . 1 1 38 38 GLY HA2 H 1 3.74 . . 1 . . . . . . . . 4402 1 356 . 1 1 38 38 GLY HA3 H 1 3.74 . . 1 . . . . . . . . 4402 1 357 . 1 1 39 39 GLN N N 15 120.2 . . 1 . . . . . . . . 4402 1 358 . 1 1 39 39 GLN H H 1 7.98 . . 1 . . . . . . . . 4402 1 359 . 1 1 39 39 GLN CA C 13 53.2 . . 1 . . . . . . . . 4402 1 360 . 1 1 39 39 GLN HA H 1 4.47 . . 1 . . . . . . . . 4402 1 361 . 1 1 39 39 GLN CB C 13 28.6 . . 1 . . . . . . . . 4402 1 362 . 1 1 39 39 GLN HB2 H 1 1.79 . . 2 . . . . . . . . 4402 1 363 . 1 1 39 39 GLN HB3 H 1 1.60 . . 2 . . . . . . . . 4402 1 364 . 1 1 39 39 GLN CG C 13 33.2 . . 1 . . . . . . . . 4402 1 365 . 1 1 39 39 GLN HG2 H 1 2.24 . . 1 . . . . . . . . 4402 1 366 . 1 1 39 39 GLN HG3 H 1 2.24 . . 1 . . . . . . . . 4402 1 367 . 1 1 39 39 GLN NE2 N 15 112.1 . . 1 . . . . . . . . 4402 1 368 . 1 1 39 39 GLN HE21 H 1 7.46 . . 2 . . . . . . . . 4402 1 369 . 1 1 39 39 GLN HE22 H 1 6.82 . . 2 . . . . . . . . 4402 1 370 . 1 1 40 40 PRO N N 15 116.8 . . 5 . . . . . . . . 4402 1 371 . 1 1 40 40 PRO CD C 13 50.3 . . 5 . . . . . . . . 4402 1 372 . 1 1 40 40 PRO CA C 13 63.1 . . 5 . . . . . . . . 4402 1 373 . 1 1 40 40 PRO HA H 1 4.21 . . 5 . . . . . . . . 4402 1 374 . 1 1 40 40 PRO CB C 13 31.6 . . 5 . . . . . . . . 4402 1 375 . 1 1 40 40 PRO HB2 H 1 2.06 . . 5 . . . . . . . . 4402 1 376 . 1 1 40 40 PRO HB3 H 1 1.67 . . 5 . . . . . . . . 4402 1 377 . 1 1 40 40 PRO CG C 13 27.0 . . 5 . . . . . . . . 4402 1 378 . 1 1 40 40 PRO HG2 H 1 1.82 . . 5 . . . . . . . . 4402 1 379 . 1 1 40 40 PRO HG3 H 1 1.82 . . 5 . . . . . . . . 4402 1 380 . 1 1 40 40 PRO HD2 H 1 3.63 . . 5 . . . . . . . . 4402 1 381 . 1 1 40 40 PRO HD3 H 1 3.49 . . 5 . . . . . . . . 4402 1 382 . 1 1 41 41 HIS N N 15 118.2 . . 5 . . . . . . . . 4402 1 383 . 1 1 41 41 HIS H H 1 8.49 . . 5 . . . . . . . . 4402 1 384 . 1 1 41 41 HIS CA C 13 54.9 . . 5 . . . . . . . . 4402 1 385 . 1 1 41 41 HIS HA H 1 4.58 . . 5 . . . . . . . . 4402 1 386 . 1 1 41 41 HIS CB C 13 28.9 . . 5 . . . . . . . . 4402 1 387 . 1 1 41 41 HIS HB2 H 1 3.11 . . 5 . . . . . . . . 4402 1 388 . 1 1 41 41 HIS HB3 H 1 3.06 . . 5 . . . . . . . . 4402 1 389 . 1 1 41 41 HIS CD2 C 13 119.6 . . 5 . . . . . . . . 4402 1 390 . 1 1 41 41 HIS HD2 H 1 7.12 . . 5 . . . . . . . . 4402 1 391 . 1 1 42 42 GLY N N 15 110.1 . . 5 . . . . . . . . 4402 1 392 . 1 1 42 42 GLY H H 1 8.40 . . 5 . . . . . . . . 4402 1 393 . 1 1 42 42 GLY CA C 13 44.8 . . 5 . . . . . . . . 4402 1 394 . 1 1 42 42 GLY HA2 H 1 3.91 . . 5 . . . . . . . . 4402 1 395 . 1 1 42 42 GLY HA3 H 1 3.91 . . 5 . . . . . . . . 4402 1 396 . 1 1 43 43 GLY N N 15 108.5 . . 5 . . . . . . . . 4402 1 397 . 1 1 43 43 GLY H H 1 8.27 . . 5 . . . . . . . . 4402 1 398 . 1 1 43 43 GLY CA C 13 44.9 . . 5 . . . . . . . . 4402 1 399 . 1 1 43 43 GLY HA2 H 1 3.85 . . 5 . . . . . . . . 4402 1 400 . 1 1 43 43 GLY HA3 H 1 3.85 . . 5 . . . . . . . . 4402 1 401 . 1 1 44 44 GLY N N 15 108.7 . . 5 . . . . . . . . 4402 1 402 . 1 1 44 44 GLY H H 1 8.25 . . 5 . . . . . . . . 4402 1 403 . 1 1 44 44 GLY CA C 13 44.7 . . 5 . . . . . . . . 4402 1 404 . 1 1 44 44 GLY HA2 H 1 3.80 . . 5 . . . . . . . . 4402 1 405 . 1 1 44 44 GLY HA3 H 1 3.80 . . 5 . . . . . . . . 4402 1 406 . 1 1 45 45 TRP N N 15 120.9 . . 5 . . . . . . . . 4402 1 407 . 1 1 45 45 TRP H H 1 8.00 . . 5 . . . . . . . . 4402 1 408 . 1 1 45 45 TRP CA C 13 57.5 . . 5 . . . . . . . . 4402 1 409 . 1 1 45 45 TRP HA H 1 4.54 . . 5 . . . . . . . . 4402 1 410 . 1 1 45 45 TRP CB C 13 29.4 . . 5 . . . . . . . . 4402 1 411 . 1 1 45 45 TRP HB2 H 1 3.22 . . 5 . . . . . . . . 4402 1 412 . 1 1 45 45 TRP HB3 H 1 3.15 . . 5 . . . . . . . . 4402 1 413 . 1 1 45 45 TRP CD1 C 13 127.1 . . 5 . . . . . . . . 4402 1 414 . 1 1 45 45 TRP HD1 H 1 7.16 . . 5 . . . . . . . . 4402 1 415 . 1 1 45 45 TRP NE1 N 15 129.2 . . 5 . . . . . . . . 4402 1 416 . 1 1 45 45 TRP HE1 H 1 10.04 . . 5 . . . . . . . . 4402 1 417 . 1 1 45 45 TRP CE3 C 13 120.7 . . 5 . . . . . . . . 4402 1 418 . 1 1 45 45 TRP HE3 H 1 7.51 . . 5 . . . . . . . . 4402 1 419 . 1 1 45 45 TRP HZ2 H 1 7.37 . . 5 . . . . . . . . 4402 1 420 . 1 1 46 46 GLY N N 15 110.9 . . 5 . . . . . . . . 4402 1 421 . 1 1 46 46 GLY H H 1 8.26 . . 5 . . . . . . . . 4402 1 422 . 1 1 46 46 GLY CA C 13 44.8 . . 5 . . . . . . . . 4402 1 423 . 1 1 46 46 GLY HA2 H 1 3.74 . . 5 . . . . . . . . 4402 1 424 . 1 1 46 46 GLY HA3 H 1 3.74 . . 5 . . . . . . . . 4402 1 425 . 1 1 47 47 GLN N N 15 120.2 . . 5 . . . . . . . . 4402 1 426 . 1 1 47 47 GLN H H 1 7.96 . . 5 . . . . . . . . 4402 1 427 . 1 1 47 47 GLN CA C 13 53.2 . . 5 . . . . . . . . 4402 1 428 . 1 1 47 47 GLN HA H 1 4.47 . . 5 . . . . . . . . 4402 1 429 . 1 1 47 47 GLN CB C 13 28.6 . . 5 . . . . . . . . 4402 1 430 . 1 1 47 47 GLN HB2 H 1 1.79 . . 5 . . . . . . . . 4402 1 431 . 1 1 47 47 GLN HB3 H 1 1.60 . . 5 . . . . . . . . 4402 1 432 . 1 1 47 47 GLN CG C 13 33.2 . . 5 . . . . . . . . 4402 1 433 . 1 1 47 47 GLN HG2 H 1 2.24 . . 5 . . . . . . . . 4402 1 434 . 1 1 47 47 GLN HG3 H 1 2.24 . . 5 . . . . . . . . 4402 1 435 . 1 1 47 47 GLN NE2 N 15 112.4 . . 5 . . . . . . . . 4402 1 436 . 1 1 47 47 GLN HE21 H 1 7.47 . . 5 . . . . . . . . 4402 1 437 . 1 1 47 47 GLN HE22 H 1 6.84 . . 5 . . . . . . . . 4402 1 438 . 1 1 48 48 PRO N N 15 116.8 . . 5 . . . . . . . . 4402 1 439 . 1 1 48 48 PRO CD C 13 50.5 . . 5 . . . . . . . . 4402 1 440 . 1 1 48 48 PRO CA C 13 63.2 . . 5 . . . . . . . . 4402 1 441 . 1 1 48 48 PRO HA H 1 4.21 . . 5 . . . . . . . . 4402 1 442 . 1 1 48 48 PRO CB C 13 31.7 . . 5 . . . . . . . . 4402 1 443 . 1 1 48 48 PRO HB2 H 1 2.06 . . 5 . . . . . . . . 4402 1 444 . 1 1 48 48 PRO HB3 H 1 1.66 . . 5 . . . . . . . . 4402 1 445 . 1 1 48 48 PRO CG C 13 26.9 . . 5 . . . . . . . . 4402 1 446 . 1 1 48 48 PRO HG2 H 1 1.83 . . 5 . . . . . . . . 4402 1 447 . 1 1 48 48 PRO HG3 H 1 1.83 . . 5 . . . . . . . . 4402 1 448 . 1 1 48 48 PRO HD2 H 1 3.64 . . 5 . . . . . . . . 4402 1 449 . 1 1 48 48 PRO HD3 H 1 3.51 . . 5 . . . . . . . . 4402 1 450 . 1 1 49 49 HIS N N 15 118.3 . . 5 . . . . . . . . 4402 1 451 . 1 1 49 49 HIS H H 1 8.52 . . 5 . . . . . . . . 4402 1 452 . 1 1 49 49 HIS CA C 13 55.1 . . 5 . . . . . . . . 4402 1 453 . 1 1 49 49 HIS HA H 1 4.57 . . 5 . . . . . . . . 4402 1 454 . 1 1 49 49 HIS CB C 13 28.8 . . 5 . . . . . . . . 4402 1 455 . 1 1 49 49 HIS HB2 H 1 3.10 . . 5 . . . . . . . . 4402 1 456 . 1 1 49 49 HIS HB3 H 1 3.05 . . 5 . . . . . . . . 4402 1 457 . 1 1 49 49 HIS CD2 C 13 119.9 . . 5 . . . . . . . . 4402 1 458 . 1 1 49 49 HIS HD2 H 1 7.12 . . 5 . . . . . . . . 4402 1 459 . 1 1 50 50 GLY N N 15 110.1 . . 5 . . . . . . . . 4402 1 460 . 1 1 50 50 GLY H H 1 8.40 . . 5 . . . . . . . . 4402 1 461 . 1 1 50 50 GLY CA C 13 44.7 . . 5 . . . . . . . . 4402 1 462 . 1 1 50 50 GLY HA2 H 1 3.91 . . 5 . . . . . . . . 4402 1 463 . 1 1 50 50 GLY HA3 H 1 3.91 . . 5 . . . . . . . . 4402 1 464 . 1 1 51 51 GLY N N 15 108.5 . . 5 . . . . . . . . 4402 1 465 . 1 1 51 51 GLY H H 1 8.28 . . 5 . . . . . . . . 4402 1 466 . 1 1 51 51 GLY CA C 13 45.0 . . 5 . . . . . . . . 4402 1 467 . 1 1 51 51 GLY HA2 H 1 3.85 . . 5 . . . . . . . . 4402 1 468 . 1 1 51 51 GLY HA3 H 1 3.85 . . 5 . . . . . . . . 4402 1 469 . 1 1 52 52 GLY N N 15 108.7 . . 5 . . . . . . . . 4402 1 470 . 1 1 52 52 GLY H H 1 8.23 . . 5 . . . . . . . . 4402 1 471 . 1 1 52 52 GLY CA C 13 44.9 . . 5 . . . . . . . . 4402 1 472 . 1 1 52 52 GLY HA2 H 1 3.80 . . 5 . . . . . . . . 4402 1 473 . 1 1 52 52 GLY HA3 H 1 3.80 . . 5 . . . . . . . . 4402 1 474 . 1 1 53 53 TRP N N 15 120.9 . . 5 . . . . . . . . 4402 1 475 . 1 1 53 53 TRP H H 1 8.02 . . 5 . . . . . . . . 4402 1 476 . 1 1 53 53 TRP CA C 13 57.5 . . 5 . . . . . . . . 4402 1 477 . 1 1 53 53 TRP HA H 1 4.53 . . 5 . . . . . . . . 4402 1 478 . 1 1 53 53 TRP CB C 13 29.3 . . 5 . . . . . . . . 4402 1 479 . 1 1 53 53 TRP HB2 H 1 3.22 . . 5 . . . . . . . . 4402 1 480 . 1 1 53 53 TRP HB3 H 1 3.14 . . 5 . . . . . . . . 4402 1 481 . 1 1 53 53 TRP CD1 C 13 127.1 . . 5 . . . . . . . . 4402 1 482 . 1 1 53 53 TRP HD1 H 1 7.16 . . 5 . . . . . . . . 4402 1 483 . 1 1 53 53 TRP NE1 N 15 129.2 . . 5 . . . . . . . . 4402 1 484 . 1 1 53 53 TRP HE1 H 1 10.04 . . 5 . . . . . . . . 4402 1 485 . 1 1 53 53 TRP CE3 C 13 120.7 . . 5 . . . . . . . . 4402 1 486 . 1 1 53 53 TRP HE3 H 1 7.51 . . 5 . . . . . . . . 4402 1 487 . 1 1 53 53 TRP HZ2 H 1 7.37 . . 5 . . . . . . . . 4402 1 488 . 1 1 54 54 GLY N N 15 110.9 . . 5 . . . . . . . . 4402 1 489 . 1 1 54 54 GLY H H 1 8.25 . . 5 . . . . . . . . 4402 1 490 . 1 1 54 54 GLY CA C 13 44.8 . . 5 . . . . . . . . 4402 1 491 . 1 1 54 54 GLY HA2 H 1 3.74 . . 5 . . . . . . . . 4402 1 492 . 1 1 54 54 GLY HA3 H 1 3.74 . . 5 . . . . . . . . 4402 1 493 . 1 1 55 55 GLN N N 15 120.2 . . 5 . . . . . . . . 4402 1 494 . 1 1 55 55 GLN H H 1 7.97 . . 5 . . . . . . . . 4402 1 495 . 1 1 55 55 GLN CA C 13 53.2 . . 5 . . . . . . . . 4402 1 496 . 1 1 55 55 GLN HA H 1 4.47 . . 5 . . . . . . . . 4402 1 497 . 1 1 55 55 GLN CB C 13 28.6 . . 5 . . . . . . . . 4402 1 498 . 1 1 55 55 GLN HB2 H 1 1.79 . . 5 . . . . . . . . 4402 1 499 . 1 1 55 55 GLN HB3 H 1 1.60 . . 5 . . . . . . . . 4402 1 500 . 1 1 55 55 GLN CG C 13 33.2 . . 5 . . . . . . . . 4402 1 501 . 1 1 55 55 GLN HG2 H 1 2.24 . . 5 . . . . . . . . 4402 1 502 . 1 1 55 55 GLN HG3 H 1 2.24 . . 5 . . . . . . . . 4402 1 503 . 1 1 55 55 GLN NE2 N 15 112.4 . . 5 . . . . . . . . 4402 1 504 . 1 1 55 55 GLN HE21 H 1 7.47 . . 5 . . . . . . . . 4402 1 505 . 1 1 55 55 GLN HE22 H 1 6.84 . . 5 . . . . . . . . 4402 1 506 . 1 1 56 56 PRO N N 15 116.8 . . 5 . . . . . . . . 4402 1 507 . 1 1 56 56 PRO CD C 13 50.3 . . 5 . . . . . . . . 4402 1 508 . 1 1 56 56 PRO CA C 13 63.3 . . 5 . . . . . . . . 4402 1 509 . 1 1 56 56 PRO HA H 1 4.20 . . 5 . . . . . . . . 4402 1 510 . 1 1 56 56 PRO CB C 13 31.7 . . 5 . . . . . . . . 4402 1 511 . 1 1 56 56 PRO HB2 H 1 2.06 . . 5 . . . . . . . . 4402 1 512 . 1 1 56 56 PRO HB3 H 1 1.67 . . 5 . . . . . . . . 4402 1 513 . 1 1 56 56 PRO CG C 13 27.0 . . 5 . . . . . . . . 4402 1 514 . 1 1 56 56 PRO HG2 H 1 1.83 . . 5 . . . . . . . . 4402 1 515 . 1 1 56 56 PRO HG3 H 1 1.83 . . 5 . . . . . . . . 4402 1 516 . 1 1 56 56 PRO HD2 H 1 3.63 . . 5 . . . . . . . . 4402 1 517 . 1 1 56 56 PRO HD3 H 1 3.49 . . 5 . . . . . . . . 4402 1 518 . 1 1 57 57 HIS N N 15 118.3 . . 5 . . . . . . . . 4402 1 519 . 1 1 57 57 HIS H H 1 8.52 . . 5 . . . . . . . . 4402 1 520 . 1 1 57 57 HIS CA C 13 55.1 . . 5 . . . . . . . . 4402 1 521 . 1 1 57 57 HIS HA H 1 4.58 . . 5 . . . . . . . . 4402 1 522 . 1 1 57 57 HIS CB C 13 28.8 . . 5 . . . . . . . . 4402 1 523 . 1 1 57 57 HIS HB2 H 1 3.10 . . 5 . . . . . . . . 4402 1 524 . 1 1 57 57 HIS HB3 H 1 3.04 . . 5 . . . . . . . . 4402 1 525 . 1 1 57 57 HIS CD2 C 13 119.9 . . 5 . . . . . . . . 4402 1 526 . 1 1 57 57 HIS HD2 H 1 7.12 . . 5 . . . . . . . . 4402 1 527 . 1 1 58 58 GLY N N 15 110.1 . . 5 . . . . . . . . 4402 1 528 . 1 1 58 58 GLY H H 1 8.40 . . 5 . . . . . . . . 4402 1 529 . 1 1 58 58 GLY CA C 13 45.0 . . 5 . . . . . . . . 4402 1 530 . 1 1 58 58 GLY HA2 H 1 3.91 . . 5 . . . . . . . . 4402 1 531 . 1 1 58 58 GLY HA3 H 1 3.91 . . 5 . . . . . . . . 4402 1 532 . 1 1 59 59 GLY N N 15 108.5 . . 5 . . . . . . . . 4402 1 533 . 1 1 59 59 GLY H H 1 8.27 . . 5 . . . . . . . . 4402 1 534 . 1 1 59 59 GLY CA C 13 45.0 . . 5 . . . . . . . . 4402 1 535 . 1 1 59 59 GLY HA2 H 1 3.86 . . 5 . . . . . . . . 4402 1 536 . 1 1 59 59 GLY HA3 H 1 3.86 . . 5 . . . . . . . . 4402 1 537 . 1 1 60 60 GLY N N 15 108.7 . . 5 . . . . . . . . 4402 1 538 . 1 1 60 60 GLY H H 1 8.20 . . 5 . . . . . . . . 4402 1 539 . 1 1 60 60 GLY CA C 13 44.8 . . 5 . . . . . . . . 4402 1 540 . 1 1 60 60 GLY HA2 H 1 3.79 . . 5 . . . . . . . . 4402 1 541 . 1 1 60 60 GLY HA3 H 1 3.79 . . 5 . . . . . . . . 4402 1 542 . 1 1 61 61 TRP N N 15 120.8 . . 5 . . . . . . . . 4402 1 543 . 1 1 61 61 TRP H H 1 8.03 . . 5 . . . . . . . . 4402 1 544 . 1 1 61 61 TRP CA C 13 57.5 . . 5 . . . . . . . . 4402 1 545 . 1 1 61 61 TRP HA H 1 4.54 . . 5 . . . . . . . . 4402 1 546 . 1 1 61 61 TRP CB C 13 29.4 . . 5 . . . . . . . . 4402 1 547 . 1 1 61 61 TRP HB2 H 1 3.22 . . 5 . . . . . . . . 4402 1 548 . 1 1 61 61 TRP HB3 H 1 3.14 . . 5 . . . . . . . . 4402 1 549 . 1 1 61 61 TRP CD1 C 13 127.1 . . 5 . . . . . . . . 4402 1 550 . 1 1 61 61 TRP HD1 H 1 7.16 . . 5 . . . . . . . . 4402 1 551 . 1 1 61 61 TRP NE1 N 15 129.2 . . 5 . . . . . . . . 4402 1 552 . 1 1 61 61 TRP HE1 H 1 10.04 . . 5 . . . . . . . . 4402 1 553 . 1 1 61 61 TRP CE3 C 13 120.7 . . 5 . . . . . . . . 4402 1 554 . 1 1 61 61 TRP HE3 H 1 7.51 . . 5 . . . . . . . . 4402 1 555 . 1 1 61 61 TRP HZ2 H 1 7.37 . . 5 . . . . . . . . 4402 1 556 . 1 1 62 62 GLY N N 15 110.9 . . 5 . . . . . . . . 4402 1 557 . 1 1 62 62 GLY H H 1 8.28 . . 5 . . . . . . . . 4402 1 558 . 1 1 62 62 GLY CA C 13 44.9 . . 5 . . . . . . . . 4402 1 559 . 1 1 62 62 GLY HA2 H 1 3.73 . . 5 . . . . . . . . 4402 1 560 . 1 1 62 62 GLY HA3 H 1 3.73 . . 5 . . . . . . . . 4402 1 561 . 1 1 63 63 GLN N N 15 120.2 . . 5 . . . . . . . . 4402 1 562 . 1 1 63 63 GLN H H 1 7.96 . . 5 . . . . . . . . 4402 1 563 . 1 1 63 63 GLN CA C 13 53.2 . . 5 . . . . . . . . 4402 1 564 . 1 1 63 63 GLN HA H 1 4.47 . . 5 . . . . . . . . 4402 1 565 . 1 1 63 63 GLN CB C 13 28.6 . . 5 . . . . . . . . 4402 1 566 . 1 1 63 63 GLN HB2 H 1 1.79 . . 5 . . . . . . . . 4402 1 567 . 1 1 63 63 GLN HB3 H 1 1.60 . . 5 . . . . . . . . 4402 1 568 . 1 1 63 63 GLN CG C 13 33.2 . . 5 . . . . . . . . 4402 1 569 . 1 1 63 63 GLN HG2 H 1 2.24 . . 5 . . . . . . . . 4402 1 570 . 1 1 63 63 GLN HG3 H 1 2.24 . . 5 . . . . . . . . 4402 1 571 . 1 1 63 63 GLN NE2 N 15 112.1 . . 5 . . . . . . . . 4402 1 572 . 1 1 63 63 GLN HE21 H 1 7.46 . . 5 . . . . . . . . 4402 1 573 . 1 1 63 63 GLN HE22 H 1 6.81 . . 5 . . . . . . . . 4402 1 574 . 1 1 64 64 PRO N N 15 116.8 . . 5 . . . . . . . . 4402 1 575 . 1 1 64 64 PRO CD C 13 50.4 . . 5 . . . . . . . . 4402 1 576 . 1 1 64 64 PRO CA C 13 63.3 . . 5 . . . . . . . . 4402 1 577 . 1 1 64 64 PRO HA H 1 4.20 . . 5 . . . . . . . . 4402 1 578 . 1 1 64 64 PRO CB C 13 31.6 . . 5 . . . . . . . . 4402 1 579 . 1 1 64 64 PRO HB2 H 1 2.07 . . 5 . . . . . . . . 4402 1 580 . 1 1 64 64 PRO HB3 H 1 1.66 . . 5 . . . . . . . . 4402 1 581 . 1 1 64 64 PRO CG C 13 27.0 . . 5 . . . . . . . . 4402 1 582 . 1 1 64 64 PRO HG2 H 1 1.83 . . 5 . . . . . . . . 4402 1 583 . 1 1 64 64 PRO HG3 H 1 1.83 . . 5 . . . . . . . . 4402 1 584 . 1 1 64 64 PRO HD2 H 1 3.63 . . 5 . . . . . . . . 4402 1 585 . 1 1 64 64 PRO HD3 H 1 3.50 . . 5 . . . . . . . . 4402 1 586 . 1 1 65 65 HIS N N 15 118.4 . . 5 . . . . . . . . 4402 1 587 . 1 1 65 65 HIS H H 1 8.53 . . 5 . . . . . . . . 4402 1 588 . 1 1 65 65 HIS CA C 13 55.0 . . 5 . . . . . . . . 4402 1 589 . 1 1 65 65 HIS HA H 1 4.57 . . 5 . . . . . . . . 4402 1 590 . 1 1 65 65 HIS CB C 13 28.9 . . 5 . . . . . . . . 4402 1 591 . 1 1 65 65 HIS HB2 H 1 3.11 . . 5 . . . . . . . . 4402 1 592 . 1 1 65 65 HIS HB3 H 1 3.05 . . 5 . . . . . . . . 4402 1 593 . 1 1 65 65 HIS CD2 C 13 119.6 . . 5 . . . . . . . . 4402 1 594 . 1 1 65 65 HIS HD2 H 1 7.12 . . 5 . . . . . . . . 4402 1 595 . 1 1 66 66 GLY N N 15 110.1 . . 5 . . . . . . . . 4402 1 596 . 1 1 66 66 GLY H H 1 8.39 . . 5 . . . . . . . . 4402 1 597 . 1 1 66 66 GLY CA C 13 44.9 . . 5 . . . . . . . . 4402 1 598 . 1 1 66 66 GLY HA2 H 1 3.91 . . 5 . . . . . . . . 4402 1 599 . 1 1 66 66 GLY HA3 H 1 3.91 . . 5 . . . . . . . . 4402 1 600 . 1 1 67 67 GLY N N 15 108.5 . . 1 . . . . . . . . 4402 1 601 . 1 1 67 67 GLY H H 1 8.27 . . 1 . . . . . . . . 4402 1 602 . 1 1 67 67 GLY CA C 13 45.1 . . 1 . . . . . . . . 4402 1 603 . 1 1 67 67 GLY HA2 H 1 3.84 . . 1 . . . . . . . . 4402 1 604 . 1 1 67 67 GLY HA3 H 1 3.84 . . 1 . . . . . . . . 4402 1 605 . 1 1 68 68 GLY N N 15 108.6 . . 1 . . . . . . . . 4402 1 606 . 1 1 68 68 GLY H H 1 8.25 . . 1 . . . . . . . . 4402 1 607 . 1 1 68 68 GLY CA C 13 44.9 . . 1 . . . . . . . . 4402 1 608 . 1 1 68 68 GLY HA2 H 1 3.94 . . 2 . . . . . . . . 4402 1 609 . 1 1 68 68 GLY HA3 H 1 3.86 . . 2 . . . . . . . . 4402 1 610 . 1 1 69 69 TRP N N 15 121.0 . . 1 . . . . . . . . 4402 1 611 . 1 1 69 69 TRP H H 1 8.05 . . 1 . . . . . . . . 4402 1 612 . 1 1 69 69 TRP CA C 13 57.5 . . 1 . . . . . . . . 4402 1 613 . 1 1 69 69 TRP HA H 1 4.55 . . 1 . . . . . . . . 4402 1 614 . 1 1 69 69 TRP CB C 13 29.4 . . 1 . . . . . . . . 4402 1 615 . 1 1 69 69 TRP HB2 H 1 3.22 . . 2 . . . . . . . . 4402 1 616 . 1 1 69 69 TRP HB3 H 1 3.15 . . 2 . . . . . . . . 4402 1 617 . 1 1 69 69 TRP CD1 C 13 126.8 . . 1 . . . . . . . . 4402 1 618 . 1 1 69 69 TRP HD1 H 1 7.19 . . 1 . . . . . . . . 4402 1 619 . 1 1 69 69 TRP NE1 N 15 129.2 . . 1 . . . . . . . . 4402 1 620 . 1 1 69 69 TRP HE1 H 1 10.03 . . 1 . . . . . . . . 4402 1 621 . 1 1 69 69 TRP CE3 C 13 120.7 . . 1 . . . . . . . . 4402 1 622 . 1 1 69 69 TRP HE3 H 1 7.55 . . 1 . . . . . . . . 4402 1 623 . 1 1 69 69 TRP HZ2 H 1 7.37 . . 1 . . . . . . . . 4402 1 624 . 1 1 70 70 GLY N N 15 111.0 . . 1 . . . . . . . . 4402 1 625 . 1 1 70 70 GLY H H 1 8.30 . . 1 . . . . . . . . 4402 1 626 . 1 1 70 70 GLY CA C 13 45.3 . . 1 . . . . . . . . 4402 1 627 . 1 1 70 70 GLY HA2 H 1 3.79 . . 2 . . . . . . . . 4402 1 628 . 1 1 70 70 GLY HA3 H 1 3.71 . . 2 . . . . . . . . 4402 1 629 . 1 1 71 71 GLN N N 15 119.6 . . 1 . . . . . . . . 4402 1 630 . 1 1 71 71 GLN H H 1 8.12 . . 1 . . . . . . . . 4402 1 631 . 1 1 71 71 GLN CA C 13 55.6 . . 1 . . . . . . . . 4402 1 632 . 1 1 71 71 GLN HA H 1 4.25 . . 1 . . . . . . . . 4402 1 633 . 1 1 71 71 GLN CB C 13 29.4 . . 1 . . . . . . . . 4402 1 634 . 1 1 71 71 GLN HB2 H 1 2.07 . . 2 . . . . . . . . 4402 1 635 . 1 1 71 71 GLN HB3 H 1 1.86 . . 2 . . . . . . . . 4402 1 636 . 1 1 71 71 GLN CG C 13 33.5 . . 1 . . . . . . . . 4402 1 637 . 1 1 71 71 GLN HG2 H 1 2.24 . . 1 . . . . . . . . 4402 1 638 . 1 1 71 71 GLN HG3 H 1 2.24 . . 1 . . . . . . . . 4402 1 639 . 1 1 71 71 GLN NE2 N 15 112.1 . . 1 . . . . . . . . 4402 1 640 . 1 1 71 71 GLN HE21 H 1 7.49 . . 2 . . . . . . . . 4402 1 641 . 1 1 71 71 GLN HE22 H 1 6.81 . . 2 . . . . . . . . 4402 1 642 . 1 1 72 72 GLY N N 15 110.0 . . 1 . . . . . . . . 4402 1 643 . 1 1 72 72 GLY H H 1 8.47 . . 1 . . . . . . . . 4402 1 644 . 1 1 72 72 GLY CA C 13 45.2 . . 1 . . . . . . . . 4402 1 645 . 1 1 72 72 GLY HA2 H 1 3.91 . . 1 . . . . . . . . 4402 1 646 . 1 1 72 72 GLY HA3 H 1 3.91 . . 1 . . . . . . . . 4402 1 647 . 1 1 73 73 GLY N N 15 108.7 . . 1 . . . . . . . . 4402 1 648 . 1 1 73 73 GLY H H 1 8.28 . . 1 . . . . . . . . 4402 1 649 . 1 1 73 73 GLY CA C 13 44.9 . . 1 . . . . . . . . 4402 1 650 . 1 1 73 73 GLY HA2 H 1 3.89 . . 1 . . . . . . . . 4402 1 651 . 1 1 73 73 GLY HA3 H 1 3.89 . . 1 . . . . . . . . 4402 1 652 . 1 1 74 74 GLY N N 15 108.8 . . 1 . . . . . . . . 4402 1 653 . 1 1 74 74 GLY H H 1 8.29 . . 1 . . . . . . . . 4402 1 654 . 1 1 74 74 GLY CA C 13 44.8 . . 1 . . . . . . . . 4402 1 655 . 1 1 74 74 GLY HA2 H 1 3.91 . . 1 . . . . . . . . 4402 1 656 . 1 1 74 74 GLY HA3 H 1 3.91 . . 1 . . . . . . . . 4402 1 657 . 1 1 75 75 THR N N 15 113.4 . . 1 . . . . . . . . 4402 1 658 . 1 1 75 75 THR H H 1 8.09 . . 1 . . . . . . . . 4402 1 659 . 1 1 75 75 THR CA C 13 61.7 . . 1 . . . . . . . . 4402 1 660 . 1 1 75 75 THR HA H 1 4.22 . . 1 . . . . . . . . 4402 1 661 . 1 1 75 75 THR CB C 13 70.0 . . 1 . . . . . . . . 4402 1 662 . 1 1 75 75 THR HB H 1 4.12 . . 1 . . . . . . . . 4402 1 663 . 1 1 75 75 THR HG21 H 1 1.09 . . 1 . . . . . . . . 4402 1 664 . 1 1 75 75 THR HG22 H 1 1.09 . . 1 . . . . . . . . 4402 1 665 . 1 1 75 75 THR HG23 H 1 1.09 . . 1 . . . . . . . . 4402 1 666 . 1 1 75 75 THR CG2 C 13 21.1 . . 1 . . . . . . . . 4402 1 667 . 1 1 76 76 HIS N N 15 120.5 . . 1 . . . . . . . . 4402 1 668 . 1 1 76 76 HIS H H 1 8.54 . . 1 . . . . . . . . 4402 1 669 . 1 1 76 76 HIS CA C 13 55.1 . . 1 . . . . . . . . 4402 1 670 . 1 1 76 76 HIS HA H 1 4.66 . . 1 . . . . . . . . 4402 1 671 . 1 1 76 76 HIS CB C 13 28.9 . . 1 . . . . . . . . 4402 1 672 . 1 1 76 76 HIS HB2 H 1 3.16 . . 2 . . . . . . . . 4402 1 673 . 1 1 76 76 HIS HB3 H 1 3.05 . . 2 . . . . . . . . 4402 1 674 . 1 1 76 76 HIS CD2 C 13 120.1 . . 1 . . . . . . . . 4402 1 675 . 1 1 76 76 HIS HD2 H 1 7.16 . . 1 . . . . . . . . 4402 1 676 . 1 1 77 77 SER N N 15 116.9 . . 1 . . . . . . . . 4402 1 677 . 1 1 77 77 SER H H 1 8.28 . . 1 . . . . . . . . 4402 1 678 . 1 1 77 77 SER CA C 13 58.4 . . 1 . . . . . . . . 4402 1 679 . 1 1 77 77 SER HA H 1 4.34 . . 1 . . . . . . . . 4402 1 680 . 1 1 77 77 SER CB C 13 63.4 . . 1 . . . . . . . . 4402 1 681 . 1 1 77 77 SER HB2 H 1 3.77 . . 2 . . . . . . . . 4402 1 682 . 1 1 77 77 SER HB3 H 1 3.73 . . 2 . . . . . . . . 4402 1 683 . 1 1 78 78 GLN N N 15 122.1 . . 1 . . . . . . . . 4402 1 684 . 1 1 78 78 GLN H H 1 8.46 . . 1 . . . . . . . . 4402 1 685 . 1 1 78 78 GLN CA C 13 55.9 . . 1 . . . . . . . . 4402 1 686 . 1 1 78 78 GLN HA H 1 4.24 . . 1 . . . . . . . . 4402 1 687 . 1 1 78 78 GLN CB C 13 29.0 . . 1 . . . . . . . . 4402 1 688 . 1 1 78 78 GLN HB2 H 1 1.91 . . 1 . . . . . . . . 4402 1 689 . 1 1 78 78 GLN HB3 H 1 1.91 . . 1 . . . . . . . . 4402 1 690 . 1 1 78 78 GLN CG C 13 33.4 . . 1 . . . . . . . . 4402 1 691 . 1 1 78 78 GLN HG2 H 1 2.10 . . 1 . . . . . . . . 4402 1 692 . 1 1 78 78 GLN HG3 H 1 2.10 . . 1 . . . . . . . . 4402 1 693 . 1 1 78 78 GLN NE2 N 15 112.2 . . 1 . . . . . . . . 4402 1 694 . 1 1 78 78 GLN HE21 H 1 7.39 . . 2 . . . . . . . . 4402 1 695 . 1 1 78 78 GLN HE22 H 1 6.82 . . 2 . . . . . . . . 4402 1 696 . 1 1 79 79 TRP N N 15 121.8 . . 1 . . . . . . . . 4402 1 697 . 1 1 79 79 TRP H H 1 8.11 . . 1 . . . . . . . . 4402 1 698 . 1 1 79 79 TRP CA C 13 57.0 . . 1 . . . . . . . . 4402 1 699 . 1 1 79 79 TRP HA H 1 4.62 . . 1 . . . . . . . . 4402 1 700 . 1 1 79 79 TRP CB C 13 29.3 . . 1 . . . . . . . . 4402 1 701 . 1 1 79 79 TRP HB2 H 1 3.23 . . 2 . . . . . . . . 4402 1 702 . 1 1 79 79 TRP HB3 H 1 3.14 . . 2 . . . . . . . . 4402 1 703 . 1 1 79 79 TRP CD1 C 13 127.1 . . 1 . . . . . . . . 4402 1 704 . 1 1 79 79 TRP HD1 H 1 7.23 . . 1 . . . . . . . . 4402 1 705 . 1 1 79 79 TRP NE1 N 15 129.5 . . 1 . . . . . . . . 4402 1 706 . 1 1 79 79 TRP HE1 H 1 10.13 . . 1 . . . . . . . . 4402 1 707 . 1 1 79 79 TRP CE3 C 13 120.9 . . 1 . . . . . . . . 4402 1 708 . 1 1 79 79 TRP HE3 H 1 7.58 . . 1 . . . . . . . . 4402 1 709 . 1 1 79 79 TRP HZ2 H 1 7.45 . . 1 . . . . . . . . 4402 1 710 . 1 1 80 80 ASN N N 15 120.7 . . 1 . . . . . . . . 4402 1 711 . 1 1 80 80 ASN H H 1 8.10 . . 1 . . . . . . . . 4402 1 712 . 1 1 80 80 ASN CA C 13 52.7 . . 1 . . . . . . . . 4402 1 713 . 1 1 80 80 ASN HA H 1 4.57 . . 1 . . . . . . . . 4402 1 714 . 1 1 80 80 ASN CB C 13 38.7 . . 1 . . . . . . . . 4402 1 715 . 1 1 80 80 ASN HB2 H 1 2.51 . . 1 . . . . . . . . 4402 1 716 . 1 1 80 80 ASN HB3 H 1 2.51 . . 1 . . . . . . . . 4402 1 717 . 1 1 80 80 ASN ND2 N 15 112.5 . . 1 . . . . . . . . 4402 1 718 . 1 1 80 80 ASN HD21 H 1 7.45 . . 2 . . . . . . . . 4402 1 719 . 1 1 80 80 ASN HD22 H 1 6.82 . . 2 . . . . . . . . 4402 1 720 . 1 1 81 81 LYS N N 15 122.7 . . 1 . . . . . . . . 4402 1 721 . 1 1 81 81 LYS H H 1 8.00 . . 1 . . . . . . . . 4402 1 722 . 1 1 81 81 LYS CA C 13 53.9 . . 1 . . . . . . . . 4402 1 723 . 1 1 81 81 LYS HA H 1 4.39 . . 1 . . . . . . . . 4402 1 724 . 1 1 81 81 LYS CB C 13 32.3 . . 1 . . . . . . . . 4402 1 725 . 1 1 81 81 LYS HB2 H 1 1.73 . . 2 . . . . . . . . 4402 1 726 . 1 1 81 81 LYS HB3 H 1 1.60 . . 2 . . . . . . . . 4402 1 727 . 1 1 81 81 LYS CG C 13 24.2 . . 1 . . . . . . . . 4402 1 728 . 1 1 81 81 LYS HG2 H 1 1.34 . . 1 . . . . . . . . 4402 1 729 . 1 1 81 81 LYS HG3 H 1 1.34 . . 1 . . . . . . . . 4402 1 730 . 1 1 81 81 LYS CD C 13 29.2 . . 1 . . . . . . . . 4402 1 731 . 1 1 81 81 LYS HD2 H 1 1.57 . . 1 . . . . . . . . 4402 1 732 . 1 1 81 81 LYS HD3 H 1 1.57 . . 1 . . . . . . . . 4402 1 733 . 1 1 81 81 LYS CE C 13 41.8 . . 1 . . . . . . . . 4402 1 734 . 1 1 81 81 LYS HE2 H 1 2.91 . . 1 . . . . . . . . 4402 1 735 . 1 1 81 81 LYS HE3 H 1 2.91 . . 1 . . . . . . . . 4402 1 736 . 1 1 82 82 PRO N N 15 117.3 . . 1 . . . . . . . . 4402 1 737 . 1 1 82 82 PRO CD C 13 50.5 . . 1 . . . . . . . . 4402 1 738 . 1 1 82 82 PRO CA C 13 63.1 . . 1 . . . . . . . . 4402 1 739 . 1 1 82 82 PRO HA H 1 4.38 . . 1 . . . . . . . . 4402 1 740 . 1 1 82 82 PRO CB C 13 31.9 . . 1 . . . . . . . . 4402 1 741 . 1 1 82 82 PRO HB2 H 1 2.23 . . 2 . . . . . . . . 4402 1 742 . 1 1 82 82 PRO HB3 H 1 1.86 . . 2 . . . . . . . . 4402 1 743 . 1 1 82 82 PRO CG C 13 27.1 . . 1 . . . . . . . . 4402 1 744 . 1 1 82 82 PRO HG2 H 1 1.98 . . 1 . . . . . . . . 4402 1 745 . 1 1 82 82 PRO HG3 H 1 1.98 . . 1 . . . . . . . . 4402 1 746 . 1 1 82 82 PRO HD2 H 1 3.65 . . 2 . . . . . . . . 4402 1 747 . 1 1 82 82 PRO HD3 H 1 3.15 . . 2 . . . . . . . . 4402 1 748 . 1 1 83 83 SER N N 15 117.0 . . 1 . . . . . . . . 4402 1 749 . 1 1 83 83 SER H H 1 8.43 . . 1 . . . . . . . . 4402 1 750 . 1 1 83 83 SER CA C 13 57.8 . . 1 . . . . . . . . 4402 1 751 . 1 1 83 83 SER HA H 1 4.41 . . 1 . . . . . . . . 4402 1 752 . 1 1 83 83 SER CB C 13 63.6 . . 1 . . . . . . . . 4402 1 753 . 1 1 83 83 SER HB2 H 1 3.79 . . 1 . . . . . . . . 4402 1 754 . 1 1 83 83 SER HB3 H 1 3.79 . . 1 . . . . . . . . 4402 1 755 . 1 1 84 84 LYS N N 15 124.2 . . 1 . . . . . . . . 4402 1 756 . 1 1 84 84 LYS H H 1 8.34 . . 1 . . . . . . . . 4402 1 757 . 1 1 84 84 LYS CA C 13 54.0 . . 1 . . . . . . . . 4402 1 758 . 1 1 84 84 LYS HA H 1 4.58 . . 1 . . . . . . . . 4402 1 759 . 1 1 84 84 LYS CB C 13 32.5 . . 1 . . . . . . . . 4402 1 760 . 1 1 84 84 LYS HB2 H 1 1.78 . . 2 . . . . . . . . 4402 1 761 . 1 1 84 84 LYS HB3 H 1 1.68 . . 2 . . . . . . . . 4402 1 762 . 1 1 84 84 LYS CG C 13 24.3 . . 1 . . . . . . . . 4402 1 763 . 1 1 84 84 LYS HG2 H 1 1.44 . . 1 . . . . . . . . 4402 1 764 . 1 1 84 84 LYS HG3 H 1 1.44 . . 1 . . . . . . . . 4402 1 765 . 1 1 84 84 LYS CD C 13 29.2 . . 1 . . . . . . . . 4402 1 766 . 1 1 84 84 LYS HD2 H 1 1.65 . . 1 . . . . . . . . 4402 1 767 . 1 1 84 84 LYS HD3 H 1 1.65 . . 1 . . . . . . . . 4402 1 768 . 1 1 84 84 LYS CE C 13 41.8 . . 1 . . . . . . . . 4402 1 769 . 1 1 84 84 LYS HE2 H 1 2.96 . . 1 . . . . . . . . 4402 1 770 . 1 1 84 84 LYS HE3 H 1 2.96 . . 1 . . . . . . . . 4402 1 771 . 1 1 85 85 PRO N N 15 117.3 . . 1 . . . . . . . . 4402 1 772 . 1 1 85 85 PRO CD C 13 50.5 . . 1 . . . . . . . . 4402 1 773 . 1 1 85 85 PRO CA C 13 62.9 . . 1 . . . . . . . . 4402 1 774 . 1 1 85 85 PRO HA H 1 4.37 . . 1 . . . . . . . . 4402 1 775 . 1 1 85 85 PRO CB C 13 31.8 . . 1 . . . . . . . . 4402 1 776 . 1 1 85 85 PRO HB2 H 1 2.24 . . 2 . . . . . . . . 4402 1 777 . 1 1 85 85 PRO HB3 H 1 1.83 . . 2 . . . . . . . . 4402 1 778 . 1 1 85 85 PRO CG C 13 27.2 . . 1 . . . . . . . . 4402 1 779 . 1 1 85 85 PRO HG2 H 1 1.95 . . 1 . . . . . . . . 4402 1 780 . 1 1 85 85 PRO HG3 H 1 1.95 . . 1 . . . . . . . . 4402 1 781 . 1 1 85 85 PRO HD2 H 1 3.79 . . 2 . . . . . . . . 4402 1 782 . 1 1 85 85 PRO HD3 H 1 3.58 . . 2 . . . . . . . . 4402 1 783 . 1 1 86 86 LYS N N 15 122.1 . . 1 . . . . . . . . 4402 1 784 . 1 1 86 86 LYS H H 1 8.52 . . 1 . . . . . . . . 4402 1 785 . 1 1 86 86 LYS CA C 13 56.3 . . 1 . . . . . . . . 4402 1 786 . 1 1 86 86 LYS HA H 1 4.29 . . 1 . . . . . . . . 4402 1 787 . 1 1 86 86 LYS CB C 13 32.8 . . 1 . . . . . . . . 4402 1 788 . 1 1 86 86 LYS HB2 H 1 1.80 . . 2 . . . . . . . . 4402 1 789 . 1 1 86 86 LYS HB3 H 1 1.75 . . 2 . . . . . . . . 4402 1 790 . 1 1 86 86 LYS CG C 13 24.6 . . 1 . . . . . . . . 4402 1 791 . 1 1 86 86 LYS HG2 H 1 1.43 . . 1 . . . . . . . . 4402 1 792 . 1 1 86 86 LYS HG3 H 1 1.43 . . 1 . . . . . . . . 4402 1 793 . 1 1 86 86 LYS CD C 13 29.2 . . 1 . . . . . . . . 4402 1 794 . 1 1 86 86 LYS HD2 H 1 1.66 . . 1 . . . . . . . . 4402 1 795 . 1 1 86 86 LYS HD3 H 1 1.66 . . 1 . . . . . . . . 4402 1 796 . 1 1 86 86 LYS CE C 13 41.9 . . 1 . . . . . . . . 4402 1 797 . 1 1 86 86 LYS HE2 H 1 2.97 . . 1 . . . . . . . . 4402 1 798 . 1 1 86 86 LYS HE3 H 1 2.97 . . 1 . . . . . . . . 4402 1 799 . 1 1 87 87 THR N N 15 115.3 . . 1 . . . . . . . . 4402 1 800 . 1 1 87 87 THR H H 1 8.14 . . 1 . . . . . . . . 4402 1 801 . 1 1 87 87 THR CA C 13 61.3 . . 1 . . . . . . . . 4402 1 802 . 1 1 87 87 THR HA H 1 4.29 . . 1 . . . . . . . . 4402 1 803 . 1 1 87 87 THR CB C 13 69.9 . . 1 . . . . . . . . 4402 1 804 . 1 1 87 87 THR HB H 1 4.16 . . 1 . . . . . . . . 4402 1 805 . 1 1 87 87 THR HG21 H 1 1.12 . . 1 . . . . . . . . 4402 1 806 . 1 1 87 87 THR HG22 H 1 1.12 . . 1 . . . . . . . . 4402 1 807 . 1 1 87 87 THR HG23 H 1 1.12 . . 1 . . . . . . . . 4402 1 808 . 1 1 87 87 THR CG2 C 13 21.3 . . 1 . . . . . . . . 4402 1 809 . 1 1 88 88 ASN N N 15 121.3 . . 1 . . . . . . . . 4402 1 810 . 1 1 88 88 ASN H H 1 8.54 . . 1 . . . . . . . . 4402 1 811 . 1 1 88 88 ASN CA C 13 52.9 . . 1 . . . . . . . . 4402 1 812 . 1 1 88 88 ASN HA H 1 4.66 . . 1 . . . . . . . . 4402 1 813 . 1 1 88 88 ASN CB C 13 38.5 . . 1 . . . . . . . . 4402 1 814 . 1 1 88 88 ASN HB2 H 1 2.80 . . 2 . . . . . . . . 4402 1 815 . 1 1 88 88 ASN HB3 H 1 2.73 . . 2 . . . . . . . . 4402 1 816 . 1 1 88 88 ASN ND2 N 15 112.5 . . 1 . . . . . . . . 4402 1 817 . 1 1 88 88 ASN HD21 H 1 7.60 . . 2 . . . . . . . . 4402 1 818 . 1 1 88 88 ASN HD22 H 1 6.89 . . 2 . . . . . . . . 4402 1 819 . 1 1 89 89 MET N N 15 121.3 . . 1 . . . . . . . . 4402 1 820 . 1 1 89 89 MET H H 1 8.35 . . 1 . . . . . . . . 4402 1 821 . 1 1 89 89 MET CA C 13 55.4 . . 1 . . . . . . . . 4402 1 822 . 1 1 89 89 MET HA H 1 4.41 . . 1 . . . . . . . . 4402 1 823 . 1 1 89 89 MET CB C 13 32.6 . . 1 . . . . . . . . 4402 1 824 . 1 1 89 89 MET HB2 H 1 1.99 . . 2 . . . . . . . . 4402 1 825 . 1 1 89 89 MET HB3 H 1 1.93 . . 2 . . . . . . . . 4402 1 826 . 1 1 89 89 MET CG C 13 32.2 . . 1 . . . . . . . . 4402 1 827 . 1 1 89 89 MET HG2 H 1 2.50 . . 2 . . . . . . . . 4402 1 828 . 1 1 89 89 MET HG3 H 1 2.47 . . 2 . . . . . . . . 4402 1 829 . 1 1 90 90 LYS N N 15 122.2 . . 1 . . . . . . . . 4402 1 830 . 1 1 90 90 LYS H H 1 8.30 . . 1 . . . . . . . . 4402 1 831 . 1 1 90 90 LYS CA C 13 56.2 . . 1 . . . . . . . . 4402 1 832 . 1 1 90 90 LYS HA H 1 4.20 . . 1 . . . . . . . . 4402 1 833 . 1 1 90 90 LYS CB C 13 32.6 . . 1 . . . . . . . . 4402 1 834 . 1 1 90 90 LYS HB2 H 1 1.68 . . 1 . . . . . . . . 4402 1 835 . 1 1 90 90 LYS HB3 H 1 1.68 . . 1 . . . . . . . . 4402 1 836 . 1 1 90 90 LYS CG C 13 24.5 . . 1 . . . . . . . . 4402 1 837 . 1 1 90 90 LYS HG2 H 1 1.32 . . 1 . . . . . . . . 4402 1 838 . 1 1 90 90 LYS HG3 H 1 1.32 . . 1 . . . . . . . . 4402 1 839 . 1 1 90 90 LYS CD C 13 28.7 . . 1 . . . . . . . . 4402 1 840 . 1 1 90 90 LYS HD2 H 1 1.62 . . 1 . . . . . . . . 4402 1 841 . 1 1 90 90 LYS HD3 H 1 1.62 . . 1 . . . . . . . . 4402 1 842 . 1 1 90 90 LYS CE C 13 41.9 . . 1 . . . . . . . . 4402 1 843 . 1 1 90 90 LYS HE2 H 1 2.94 . . 1 . . . . . . . . 4402 1 844 . 1 1 90 90 LYS HE3 H 1 2.94 . . 1 . . . . . . . . 4402 1 845 . 1 1 91 91 HIS N N 15 119.8 . . 1 . . . . . . . . 4402 1 846 . 1 1 91 91 HIS H H 1 8.52 . . 1 . . . . . . . . 4402 1 847 . 1 1 91 91 HIS CA C 13 55.1 . . 1 . . . . . . . . 4402 1 848 . 1 1 91 91 HIS HA H 1 4.57 . . 1 . . . . . . . . 4402 1 849 . 1 1 91 91 HIS CB C 13 28.9 . . 1 . . . . . . . . 4402 1 850 . 1 1 91 91 HIS HB2 H 1 3.09 . . 1 . . . . . . . . 4402 1 851 . 1 1 91 91 HIS HB3 H 1 3.09 . . 1 . . . . . . . . 4402 1 852 . 1 1 91 91 HIS CD2 C 13 120.1 . . 1 . . . . . . . . 4402 1 853 . 1 1 91 91 HIS HD2 H 1 7.13 . . 1 . . . . . . . . 4402 1 854 . 1 1 92 92 MET N N 15 122.8 . . 1 . . . . . . . . 4402 1 855 . 1 1 92 92 MET H H 1 8.43 . . 1 . . . . . . . . 4402 1 856 . 1 1 92 92 MET CA C 13 54.9 . . 1 . . . . . . . . 4402 1 857 . 1 1 92 92 MET HA H 1 4.44 . . 1 . . . . . . . . 4402 1 858 . 1 1 92 92 MET CB C 13 32.8 . . 1 . . . . . . . . 4402 1 859 . 1 1 92 92 MET HB2 H 1 2.02 . . 1 . . . . . . . . 4402 1 860 . 1 1 92 92 MET HB3 H 1 2.02 . . 1 . . . . . . . . 4402 1 861 . 1 1 92 92 MET CG C 13 31.5 . . 1 . . . . . . . . 4402 1 862 . 1 1 92 92 MET HG2 H 1 2.52 . . 2 . . . . . . . . 4402 1 863 . 1 1 92 92 MET HG3 H 1 2.47 . . 2 . . . . . . . . 4402 1 864 . 1 1 93 93 ALA N N 15 125.8 . . 1 . . . . . . . . 4402 1 865 . 1 1 93 93 ALA H H 1 8.44 . . 1 . . . . . . . . 4402 1 866 . 1 1 93 93 ALA CA C 13 52.6 . . 1 . . . . . . . . 4402 1 867 . 1 1 93 93 ALA HA H 1 4.28 . . 1 . . . . . . . . 4402 1 868 . 1 1 93 93 ALA HB1 H 1 1.36 . . 1 . . . . . . . . 4402 1 869 . 1 1 93 93 ALA HB2 H 1 1.36 . . 1 . . . . . . . . 4402 1 870 . 1 1 93 93 ALA HB3 H 1 1.36 . . 1 . . . . . . . . 4402 1 871 . 1 1 93 93 ALA CB C 13 19.0 . . 1 . . . . . . . . 4402 1 872 . 1 1 94 94 GLY N N 15 108.6 . . 1 . . . . . . . . 4402 1 873 . 1 1 94 94 GLY H H 1 8.40 . . 1 . . . . . . . . 4402 1 874 . 1 1 94 94 GLY CA C 13 44.9 . . 1 . . . . . . . . 4402 1 875 . 1 1 94 94 GLY HA2 H 1 3.90 . . 1 . . . . . . . . 4402 1 876 . 1 1 94 94 GLY HA3 H 1 3.90 . . 1 . . . . . . . . 4402 1 877 . 1 1 95 95 ALA N N 15 123.9 . . 1 . . . . . . . . 4402 1 878 . 1 1 95 95 ALA H H 1 8.15 . . 1 . . . . . . . . 4402 1 879 . 1 1 95 95 ALA CA C 13 52.4 . . 1 . . . . . . . . 4402 1 880 . 1 1 95 95 ALA HA H 1 4.25 . . 1 . . . . . . . . 4402 1 881 . 1 1 95 95 ALA HB1 H 1 1.33 . . 1 . . . . . . . . 4402 1 882 . 1 1 95 95 ALA HB2 H 1 1.33 . . 1 . . . . . . . . 4402 1 883 . 1 1 95 95 ALA HB3 H 1 1.33 . . 1 . . . . . . . . 4402 1 884 . 1 1 95 95 ALA CB C 13 19.0 . . 1 . . . . . . . . 4402 1 885 . 1 1 96 96 ALA N N 15 123.2 . . 1 . . . . . . . . 4402 1 886 . 1 1 96 96 ALA H H 1 8.29 . . 1 . . . . . . . . 4402 1 887 . 1 1 96 96 ALA CA C 13 52.4 . . 1 . . . . . . . . 4402 1 888 . 1 1 96 96 ALA HA H 1 4.24 . . 1 . . . . . . . . 4402 1 889 . 1 1 96 96 ALA HB1 H 1 1.33 . . 1 . . . . . . . . 4402 1 890 . 1 1 96 96 ALA HB2 H 1 1.33 . . 1 . . . . . . . . 4402 1 891 . 1 1 96 96 ALA HB3 H 1 1.33 . . 1 . . . . . . . . 4402 1 892 . 1 1 96 96 ALA CB C 13 18.8 . . 1 . . . . . . . . 4402 1 893 . 1 1 97 97 ALA N N 15 123.3 . . 1 . . . . . . . . 4402 1 894 . 1 1 97 97 ALA H H 1 8.20 . . 1 . . . . . . . . 4402 1 895 . 1 1 97 97 ALA CA C 13 52.3 . . 1 . . . . . . . . 4402 1 896 . 1 1 97 97 ALA HA H 1 4.24 . . 1 . . . . . . . . 4402 1 897 . 1 1 97 97 ALA HB1 H 1 1.33 . . 1 . . . . . . . . 4402 1 898 . 1 1 97 97 ALA HB2 H 1 1.33 . . 1 . . . . . . . . 4402 1 899 . 1 1 97 97 ALA HB3 H 1 1.33 . . 1 . . . . . . . . 4402 1 900 . 1 1 97 97 ALA CB C 13 18.8 . . 1 . . . . . . . . 4402 1 901 . 1 1 98 98 ALA N N 15 123.3 . . 1 . . . . . . . . 4402 1 902 . 1 1 98 98 ALA H H 1 8.24 . . 1 . . . . . . . . 4402 1 903 . 1 1 98 98 ALA CA C 13 52.3 . . 1 . . . . . . . . 4402 1 904 . 1 1 98 98 ALA HA H 1 4.26 . . 1 . . . . . . . . 4402 1 905 . 1 1 98 98 ALA HB1 H 1 1.34 . . 1 . . . . . . . . 4402 1 906 . 1 1 98 98 ALA HB2 H 1 1.34 . . 1 . . . . . . . . 4402 1 907 . 1 1 98 98 ALA HB3 H 1 1.34 . . 1 . . . . . . . . 4402 1 908 . 1 1 98 98 ALA CB C 13 18.8 . . 1 . . . . . . . . 4402 1 909 . 1 1 99 99 GLY N N 15 108.0 . . 1 . . . . . . . . 4402 1 910 . 1 1 99 99 GLY H H 1 8.27 . . 1 . . . . . . . . 4402 1 911 . 1 1 99 99 GLY CA C 13 45.1 . . 1 . . . . . . . . 4402 1 912 . 1 1 99 99 GLY HA2 H 1 3.91 . . 1 . . . . . . . . 4402 1 913 . 1 1 99 99 GLY HA3 H 1 3.91 . . 1 . . . . . . . . 4402 1 914 . 1 1 100 100 ALA N N 15 123.5 . . 1 . . . . . . . . 4402 1 915 . 1 1 100 100 ALA H H 1 8.07 . . 1 . . . . . . . . 4402 1 916 . 1 1 100 100 ALA CA C 13 52.2 . . 1 . . . . . . . . 4402 1 917 . 1 1 100 100 ALA HA H 1 4.34 . . 1 . . . . . . . . 4402 1 918 . 1 1 100 100 ALA HB1 H 1 1.32 . . 1 . . . . . . . . 4402 1 919 . 1 1 100 100 ALA HB2 H 1 1.32 . . 1 . . . . . . . . 4402 1 920 . 1 1 100 100 ALA HB3 H 1 1.32 . . 1 . . . . . . . . 4402 1 921 . 1 1 100 100 ALA CB C 13 19.2 . . 1 . . . . . . . . 4402 1 922 . 1 1 101 101 VAL N N 15 119.7 . . 1 . . . . . . . . 4402 1 923 . 1 1 101 101 VAL H H 1 8.14 . . 1 . . . . . . . . 4402 1 924 . 1 1 101 101 VAL CA C 13 61.9 . . 1 . . . . . . . . 4402 1 925 . 1 1 101 101 VAL HA H 1 4.12 . . 1 . . . . . . . . 4402 1 926 . 1 1 101 101 VAL CB C 13 32.4 . . 1 . . . . . . . . 4402 1 927 . 1 1 101 101 VAL HB H 1 1.99 . . 1 . . . . . . . . 4402 1 928 . 1 1 101 101 VAL CG1 C 13 20.7 . . 1 . . . . . . . . 4402 1 929 . 1 1 101 101 VAL HG11 H 1 0.88 . . 1 . . . . . . . . 4402 1 930 . 1 1 101 101 VAL HG12 H 1 0.88 . . 1 . . . . . . . . 4402 1 931 . 1 1 101 101 VAL HG13 H 1 0.88 . . 1 . . . . . . . . 4402 1 932 . 1 1 101 101 VAL CG2 C 13 21.1 . . 1 . . . . . . . . 4402 1 933 . 1 1 101 101 VAL HG21 H 1 0.84 . . 1 . . . . . . . . 4402 1 934 . 1 1 101 101 VAL HG22 H 1 0.84 . . 1 . . . . . . . . 4402 1 935 . 1 1 101 101 VAL HG23 H 1 0.84 . . 1 . . . . . . . . 4402 1 936 . 1 1 102 102 VAL N N 15 124.9 . . 1 . . . . . . . . 4402 1 937 . 1 1 102 102 VAL H H 1 8.28 . . 1 . . . . . . . . 4402 1 938 . 1 1 102 102 VAL CA C 13 62.2 . . 1 . . . . . . . . 4402 1 939 . 1 1 102 102 VAL HA H 1 4.07 . . 1 . . . . . . . . 4402 1 940 . 1 1 102 102 VAL CB C 13 32.4 . . 1 . . . . . . . . 4402 1 941 . 1 1 102 102 VAL HB H 1 1.99 . . 1 . . . . . . . . 4402 1 942 . 1 1 102 102 VAL CG1 C 13 20.6 . . 1 . . . . . . . . 4402 1 943 . 1 1 102 102 VAL HG11 H 1 0.88 . . 1 . . . . . . . . 4402 1 944 . 1 1 102 102 VAL HG12 H 1 0.88 . . 1 . . . . . . . . 4402 1 945 . 1 1 102 102 VAL HG13 H 1 0.88 . . 1 . . . . . . . . 4402 1 946 . 1 1 102 102 VAL CG2 C 13 20.8 . . 1 . . . . . . . . 4402 1 947 . 1 1 102 102 VAL HG21 H 1 0.87 . . 1 . . . . . . . . 4402 1 948 . 1 1 102 102 VAL HG22 H 1 0.87 . . 1 . . . . . . . . 4402 1 949 . 1 1 102 102 VAL HG23 H 1 0.87 . . 1 . . . . . . . . 4402 1 950 . 1 1 103 103 GLY N N 15 113.2 . . 1 . . . . . . . . 4402 1 951 . 1 1 103 103 GLY H H 1 8.58 . . 1 . . . . . . . . 4402 1 952 . 1 1 103 103 GLY CA C 13 45.2 . . 1 . . . . . . . . 4402 1 953 . 1 1 103 103 GLY HA2 H 1 3.92 . . 1 . . . . . . . . 4402 1 954 . 1 1 103 103 GLY HA3 H 1 3.92 . . 1 . . . . . . . . 4402 1 955 . 1 1 104 104 GLY N N 15 108.2 . . 1 . . . . . . . . 4402 1 956 . 1 1 104 104 GLY H H 1 8.27 . . 1 . . . . . . . . 4402 1 957 . 1 1 104 104 GLY CA C 13 45.2 . . 1 . . . . . . . . 4402 1 958 . 1 1 104 104 GLY HA2 H 1 3.93 . . 1 . . . . . . . . 4402 1 959 . 1 1 104 104 GLY HA3 H 1 3.93 . . 1 . . . . . . . . 4402 1 960 . 1 1 105 105 LEU N N 15 121.8 . . 1 . . . . . . . . 4402 1 961 . 1 1 105 105 LEU H H 1 8.21 . . 1 . . . . . . . . 4402 1 962 . 1 1 105 105 LEU CA C 13 54.6 . . 1 . . . . . . . . 4402 1 963 . 1 1 105 105 LEU HA H 1 4.35 . . 1 . . . . . . . . 4402 1 964 . 1 1 105 105 LEU CB C 13 42.3 . . 1 . . . . . . . . 4402 1 965 . 1 1 105 105 LEU HB2 H 1 1.53 . . 2 . . . . . . . . 4402 1 966 . 1 1 105 105 LEU HB3 H 1 1.60 . . 2 . . . . . . . . 4402 1 967 . 1 1 105 105 LEU CG C 13 26.8 . . 1 . . . . . . . . 4402 1 968 . 1 1 105 105 LEU HG H 1 1.49 . . 1 . . . . . . . . 4402 1 969 . 1 1 105 105 LEU HD11 H 1 0.68 . . 2 . . . . . . . . 4402 1 970 . 1 1 105 105 LEU HD12 H 1 0.68 . . 2 . . . . . . . . 4402 1 971 . 1 1 105 105 LEU HD13 H 1 0.68 . . 2 . . . . . . . . 4402 1 972 . 1 1 105 105 LEU HD21 H 1 0.57 . . 2 . . . . . . . . 4402 1 973 . 1 1 105 105 LEU HD22 H 1 0.57 . . 2 . . . . . . . . 4402 1 974 . 1 1 105 105 LEU HD23 H 1 0.57 . . 2 . . . . . . . . 4402 1 975 . 1 1 105 105 LEU CD1 C 13 24.5 . . 1 . . . . . . . . 4402 1 976 . 1 1 105 105 LEU CD2 C 13 23.4 . . 1 . . . . . . . . 4402 1 977 . 1 1 106 106 GLY N N 15 109.8 . . 1 . . . . . . . . 4402 1 978 . 1 1 106 106 GLY H H 1 8.51 . . 1 . . . . . . . . 4402 1 979 . 1 1 106 106 GLY CA C 13 46.0 . . 1 . . . . . . . . 4402 1 980 . 1 1 106 106 GLY HA2 H 1 3.82 . . 2 . . . . . . . . 4402 1 981 . 1 1 106 106 GLY HA3 H 1 3.92 . . 2 . . . . . . . . 4402 1 982 . 1 1 107 107 GLY N N 15 109.0 . . 1 . . . . . . . . 4402 1 983 . 1 1 107 107 GLY H H 1 8.32 . . 1 . . . . . . . . 4402 1 984 . 1 1 107 107 GLY CA C 13 44.8 . . 1 . . . . . . . . 4402 1 985 . 1 1 107 107 GLY HA2 H 1 3.71 . . 2 . . . . . . . . 4402 1 986 . 1 1 107 107 GLY HA3 H 1 3.89 . . 2 . . . . . . . . 4402 1 987 . 1 1 108 108 TYR N N 15 117.5 . . 1 . . . . . . . . 4402 1 988 . 1 1 108 108 TYR H H 1 7.73 . . 1 . . . . . . . . 4402 1 989 . 1 1 108 108 TYR CA C 13 57.6 . . 1 . . . . . . . . 4402 1 990 . 1 1 108 108 TYR HA H 1 4.50 . . 1 . . . . . . . . 4402 1 991 . 1 1 108 108 TYR CB C 13 40.0 . . 1 . . . . . . . . 4402 1 992 . 1 1 108 108 TYR HB2 H 1 2.79 . . 2 . . . . . . . . 4402 1 993 . 1 1 108 108 TYR HB3 H 1 2.86 . . 2 . . . . . . . . 4402 1 994 . 1 1 108 108 TYR HD1 H 1 6.80 . . 1 . . . . . . . . 4402 1 995 . 1 1 108 108 TYR HD2 H 1 6.80 . . 1 . . . . . . . . 4402 1 996 . 1 1 108 108 TYR HE1 H 1 6.64 . . 1 . . . . . . . . 4402 1 997 . 1 1 108 108 TYR HE2 H 1 6.64 . . 1 . . . . . . . . 4402 1 998 . 1 1 108 108 TYR CD1 C 13 132.8 . . 1 . . . . . . . . 4402 1 999 . 1 1 108 108 TYR CE1 C 13 118.1 . . 1 . . . . . . . . 4402 1 1000 . 1 1 109 109 MET N N 15 120.8 . . 1 . . . . . . . . 4402 1 1001 . 1 1 109 109 MET H H 1 9.00 . . 1 . . . . . . . . 4402 1 1002 . 1 1 109 109 MET CA C 13 53.4 . . 1 . . . . . . . . 4402 1 1003 . 1 1 109 109 MET HA H 1 4.53 . . 1 . . . . . . . . 4402 1 1004 . 1 1 109 109 MET CB C 13 34.5 . . 1 . . . . . . . . 4402 1 1005 . 1 1 109 109 MET HB2 H 1 0.89 . . 2 . . . . . . . . 4402 1 1006 . 1 1 109 109 MET HB3 H 1 1.55 . . 2 . . . . . . . . 4402 1 1007 . 1 1 109 109 MET CG C 13 31.9 . . 1 . . . . . . . . 4402 1 1008 . 1 1 109 109 MET HG2 H 1 2.20 . . 1 . . . . . . . . 4402 1 1009 . 1 1 109 109 MET HG3 H 1 2.20 . . 1 . . . . . . . . 4402 1 1010 . 1 1 109 109 MET HE1 H 1 1.97 . . 1 . . . . . . . . 4402 1 1011 . 1 1 109 109 MET HE2 H 1 1.97 . . 1 . . . . . . . . 4402 1 1012 . 1 1 109 109 MET HE3 H 1 1.97 . . 1 . . . . . . . . 4402 1 1013 . 1 1 109 109 MET CE C 13 17.0 . . 1 . . . . . . . . 4402 1 1014 . 1 1 110 110 LEU N N 15 121.4 . . 1 . . . . . . . . 4402 1 1015 . 1 1 110 110 LEU H H 1 8.10 . . 1 . . . . . . . . 4402 1 1016 . 1 1 110 110 LEU CA C 13 53.1 . . 1 . . . . . . . . 4402 1 1017 . 1 1 110 110 LEU HA H 1 4.46 . . 1 . . . . . . . . 4402 1 1018 . 1 1 110 110 LEU CB C 13 43.4 . . 1 . . . . . . . . 4402 1 1019 . 1 1 110 110 LEU HB2 H 1 0.95 . . 2 . . . . . . . . 4402 1 1020 . 1 1 110 110 LEU HB3 H 1 1.59 . . 2 . . . . . . . . 4402 1 1021 . 1 1 110 110 LEU CG C 13 25.9 . . 1 . . . . . . . . 4402 1 1022 . 1 1 110 110 LEU HG H 1 1.36 . . 1 . . . . . . . . 4402 1 1023 . 1 1 110 110 LEU HD11 H 1 -0.03 . . 2 . . . . . . . . 4402 1 1024 . 1 1 110 110 LEU HD12 H 1 -0.03 . . 2 . . . . . . . . 4402 1 1025 . 1 1 110 110 LEU HD13 H 1 -0.03 . . 2 . . . . . . . . 4402 1 1026 . 1 1 110 110 LEU HD21 H 1 0.60 . . 2 . . . . . . . . 4402 1 1027 . 1 1 110 110 LEU HD22 H 1 0.60 . . 2 . . . . . . . . 4402 1 1028 . 1 1 110 110 LEU HD23 H 1 0.60 . . 2 . . . . . . . . 4402 1 1029 . 1 1 110 110 LEU CD1 C 13 21.5 . . 1 . . . . . . . . 4402 1 1030 . 1 1 110 110 LEU CD2 C 13 25.6 . . 1 . . . . . . . . 4402 1 1031 . 1 1 111 111 GLY N N 15 115.0 . . 1 . . . . . . . . 4402 1 1032 . 1 1 111 111 GLY H H 1 9.34 . . 1 . . . . . . . . 4402 1 1033 . 1 1 111 111 GLY CA C 13 44.7 . . 1 . . . . . . . . 4402 1 1034 . 1 1 111 111 GLY HA2 H 1 4.01 . . 2 . . . . . . . . 4402 1 1035 . 1 1 111 111 GLY HA3 H 1 4.41 . . 2 . . . . . . . . 4402 1 1036 . 1 1 112 112 SER N N 15 113.6 . . 1 . . . . . . . . 4402 1 1037 . 1 1 112 112 SER H H 1 8.39 . . 1 . . . . . . . . 4402 1 1038 . 1 1 112 112 SER CA C 13 58.3 . . 1 . . . . . . . . 4402 1 1039 . 1 1 112 112 SER HA H 1 4.39 . . 1 . . . . . . . . 4402 1 1040 . 1 1 112 112 SER CB C 13 63.8 . . 1 . . . . . . . . 4402 1 1041 . 1 1 112 112 SER HB2 H 1 3.96 . . 2 . . . . . . . . 4402 1 1042 . 1 1 112 112 SER HB3 H 1 3.90 . . 2 . . . . . . . . 4402 1 1043 . 1 1 113 113 ALA N N 15 125.6 . . 1 . . . . . . . . 4402 1 1044 . 1 1 113 113 ALA H H 1 8.79 . . 1 . . . . . . . . 4402 1 1045 . 1 1 113 113 ALA CA C 13 52.7 . . 1 . . . . . . . . 4402 1 1046 . 1 1 113 113 ALA HA H 1 4.43 . . 1 . . . . . . . . 4402 1 1047 . 1 1 113 113 ALA HB1 H 1 1.26 . . 1 . . . . . . . . 4402 1 1048 . 1 1 113 113 ALA HB2 H 1 1.26 . . 1 . . . . . . . . 4402 1 1049 . 1 1 113 113 ALA HB3 H 1 1.26 . . 1 . . . . . . . . 4402 1 1050 . 1 1 113 113 ALA CB C 13 18.3 . . 1 . . . . . . . . 4402 1 1051 . 1 1 114 114 MET N N 15 120.7 . . 1 . . . . . . . . 4402 1 1052 . 1 1 114 114 MET H H 1 8.71 . . 1 . . . . . . . . 4402 1 1053 . 1 1 114 114 MET CA C 13 53.7 . . 1 . . . . . . . . 4402 1 1054 . 1 1 114 114 MET HA H 1 4.73 . . 1 . . . . . . . . 4402 1 1055 . 1 1 114 114 MET CB C 13 36.7 . . 1 . . . . . . . . 4402 1 1056 . 1 1 114 114 MET HB2 H 1 1.99 . . 1 . . . . . . . . 4402 1 1057 . 1 1 114 114 MET HB3 H 1 1.99 . . 1 . . . . . . . . 4402 1 1058 . 1 1 114 114 MET CG C 13 30.9 . . 1 . . . . . . . . 4402 1 1059 . 1 1 114 114 MET HG2 H 1 2.44 . . 2 . . . . . . . . 4402 1 1060 . 1 1 114 114 MET HG3 H 1 2.38 . . 2 . . . . . . . . 4402 1 1061 . 1 1 114 114 MET HE1 H 1 2.14 . . 1 . . . . . . . . 4402 1 1062 . 1 1 114 114 MET HE2 H 1 2.14 . . 1 . . . . . . . . 4402 1 1063 . 1 1 114 114 MET HE3 H 1 2.14 . . 1 . . . . . . . . 4402 1 1064 . 1 1 114 114 MET CE C 13 17.5 . . 1 . . . . . . . . 4402 1 1065 . 1 1 115 115 SER N N 15 116.2 . . 1 . . . . . . . . 4402 1 1066 . 1 1 115 115 SER H H 1 8.44 . . 1 . . . . . . . . 4402 1 1067 . 1 1 115 115 SER CA C 13 58.4 . . 1 . . . . . . . . 4402 1 1068 . 1 1 115 115 SER HA H 1 4.34 . . 1 . . . . . . . . 4402 1 1069 . 1 1 115 115 SER CB C 13 62.8 . . 1 . . . . . . . . 4402 1 1070 . 1 1 115 115 SER HB2 H 1 3.81 . . 2 . . . . . . . . 4402 1 1071 . 1 1 115 115 SER HB3 H 1 3.73 . . 2 . . . . . . . . 4402 1 1072 . 1 1 116 116 ARG N N 15 126.6 . . 1 . . . . . . . . 4402 1 1073 . 1 1 116 116 ARG H H 1 8.66 . . 1 . . . . . . . . 4402 1 1074 . 1 1 116 116 ARG CA C 13 54.6 . . 1 . . . . . . . . 4402 1 1075 . 1 1 116 116 ARG HA H 1 4.39 . . 1 . . . . . . . . 4402 1 1076 . 1 1 116 116 ARG CB C 13 29.3 . . 1 . . . . . . . . 4402 1 1077 . 1 1 116 116 ARG HB2 H 1 1.72 . . 1 . . . . . . . . 4402 1 1078 . 1 1 116 116 ARG HB3 H 1 1.72 . . 1 . . . . . . . . 4402 1 1079 . 1 1 116 116 ARG CG C 13 28.7 . . 1 . . . . . . . . 4402 1 1080 . 1 1 116 116 ARG HG2 H 1 1.85 . . 2 . . . . . . . . 4402 1 1081 . 1 1 116 116 ARG HG3 H 1 1.80 . . 2 . . . . . . . . 4402 1 1082 . 1 1 116 116 ARG CD C 13 43.9 . . 1 . . . . . . . . 4402 1 1083 . 1 1 116 116 ARG HD2 H 1 3.11 . . 2 . . . . . . . . 4402 1 1084 . 1 1 116 116 ARG HD3 H 1 3.05 . . 2 . . . . . . . . 4402 1 1085 . 1 1 116 116 ARG NE N 15 85.7 . . 1 . . . . . . . . 4402 1 1086 . 1 1 116 116 ARG HE H 1 6.72 . . 1 . . . . . . . . 4402 1 1087 . 1 1 117 117 PRO CD C 13 50.4 . . 1 . . . . . . . . 4402 1 1088 . 1 1 117 117 PRO CA C 13 62.1 . . 1 . . . . . . . . 4402 1 1089 . 1 1 117 117 PRO HA H 1 4.41 . . 1 . . . . . . . . 4402 1 1090 . 1 1 117 117 PRO CB C 13 32.2 . . 1 . . . . . . . . 4402 1 1091 . 1 1 117 117 PRO HB2 H 1 1.74 . . 2 . . . . . . . . 4402 1 1092 . 1 1 117 117 PRO HB3 H 1 2.24 . . 2 . . . . . . . . 4402 1 1093 . 1 1 117 117 PRO CG C 13 27.3 . . 1 . . . . . . . . 4402 1 1094 . 1 1 117 117 PRO HG2 H 1 1.95 . . 2 . . . . . . . . 4402 1 1095 . 1 1 117 117 PRO HG3 H 1 2.02 . . 2 . . . . . . . . 4402 1 1096 . 1 1 117 117 PRO HD2 H 1 3.60 . . 2 . . . . . . . . 4402 1 1097 . 1 1 117 117 PRO HD3 H 1 3.91 . . 2 . . . . . . . . 4402 1 1098 . 1 1 118 118 ILE N N 15 122.5 . . 1 . . . . . . . . 4402 1 1099 . 1 1 118 118 ILE H H 1 8.65 . . 1 . . . . . . . . 4402 1 1100 . 1 1 118 118 ILE CA C 13 60.7 . . 1 . . . . . . . . 4402 1 1101 . 1 1 118 118 ILE HA H 1 4.13 . . 1 . . . . . . . . 4402 1 1102 . 1 1 118 118 ILE CB C 13 36.1 . . 1 . . . . . . . . 4402 1 1103 . 1 1 118 118 ILE HB H 1 1.89 . . 1 . . . . . . . . 4402 1 1104 . 1 1 118 118 ILE HG21 H 1 0.71 . . 1 . . . . . . . . 4402 1 1105 . 1 1 118 118 ILE HG22 H 1 0.71 . . 1 . . . . . . . . 4402 1 1106 . 1 1 118 118 ILE HG23 H 1 0.71 . . 1 . . . . . . . . 4402 1 1107 . 1 1 118 118 ILE CG2 C 13 17.2 . . 1 . . . . . . . . 4402 1 1108 . 1 1 118 118 ILE CG1 C 13 27.0 . . 1 . . . . . . . . 4402 1 1109 . 1 1 118 118 ILE HG12 H 1 1.57 . . 2 . . . . . . . . 4402 1 1110 . 1 1 118 118 ILE HG13 H 1 1.38 . . 2 . . . . . . . . 4402 1 1111 . 1 1 118 118 ILE HD11 H 1 0.88 . . 1 . . . . . . . . 4402 1 1112 . 1 1 118 118 ILE HD12 H 1 0.88 . . 1 . . . . . . . . 4402 1 1113 . 1 1 118 118 ILE HD13 H 1 0.88 . . 1 . . . . . . . . 4402 1 1114 . 1 1 118 118 ILE CD1 C 13 11.1 . . 1 . . . . . . . . 4402 1 1115 . 1 1 119 119 ILE N N 15 126.9 . . 1 . . . . . . . . 4402 1 1116 . 1 1 119 119 ILE H H 1 6.46 . . 1 . . . . . . . . 4402 1 1117 . 1 1 119 119 ILE CA C 13 58.6 . . 1 . . . . . . . . 4402 1 1118 . 1 1 119 119 ILE HA H 1 3.90 . . 1 . . . . . . . . 4402 1 1119 . 1 1 119 119 ILE CB C 13 39.2 . . 1 . . . . . . . . 4402 1 1120 . 1 1 119 119 ILE HB H 1 0.82 . . 1 . . . . . . . . 4402 1 1121 . 1 1 119 119 ILE HG21 H 1 -0.07 . . 1 . . . . . . . . 4402 1 1122 . 1 1 119 119 ILE HG22 H 1 -0.07 . . 1 . . . . . . . . 4402 1 1123 . 1 1 119 119 ILE HG23 H 1 -0.07 . . 1 . . . . . . . . 4402 1 1124 . 1 1 119 119 ILE CG2 C 13 17.0 . . 1 . . . . . . . . 4402 1 1125 . 1 1 119 119 ILE CG1 C 13 26.5 . . 1 . . . . . . . . 4402 1 1126 . 1 1 119 119 ILE HG12 H 1 0.90 . . 2 . . . . . . . . 4402 1 1127 . 1 1 119 119 ILE HG13 H 1 0.76 . . 2 . . . . . . . . 4402 1 1128 . 1 1 119 119 ILE HD11 H 1 0.46 . . 1 . . . . . . . . 4402 1 1129 . 1 1 119 119 ILE HD12 H 1 0.46 . . 1 . . . . . . . . 4402 1 1130 . 1 1 119 119 ILE HD13 H 1 0.46 . . 1 . . . . . . . . 4402 1 1131 . 1 1 119 119 ILE CD1 C 13 12.5 . . 1 . . . . . . . . 4402 1 1132 . 1 1 120 120 HIS N N 15 122.1 . . 1 . . . . . . . . 4402 1 1133 . 1 1 120 120 HIS H H 1 8.25 . . 1 . . . . . . . . 4402 1 1134 . 1 1 120 120 HIS CA C 13 53.8 . . 1 . . . . . . . . 4402 1 1135 . 1 1 120 120 HIS HA H 1 4.90 . . 1 . . . . . . . . 4402 1 1136 . 1 1 120 120 HIS CB C 13 29.3 . . 1 . . . . . . . . 4402 1 1137 . 1 1 120 120 HIS HB2 H 1 2.92 . . 2 . . . . . . . . 4402 1 1138 . 1 1 120 120 HIS HB3 H 1 3.29 . . 2 . . . . . . . . 4402 1 1139 . 1 1 120 120 HIS CD2 C 13 119.6 . . 1 . . . . . . . . 4402 1 1140 . 1 1 120 120 HIS CE1 C 13 136.0 . . 1 . . . . . . . . 4402 1 1141 . 1 1 120 120 HIS HD2 H 1 7.21 . . 1 . . . . . . . . 4402 1 1142 . 1 1 120 120 HIS HE1 H 1 8.57 . . 1 . . . . . . . . 4402 1 1143 . 1 1 121 121 PHE N N 15 124.0 . . 1 . . . . . . . . 4402 1 1144 . 1 1 121 121 PHE H H 1 10.21 . . 1 . . . . . . . . 4402 1 1145 . 1 1 121 121 PHE CA C 13 59.1 . . 1 . . . . . . . . 4402 1 1146 . 1 1 121 121 PHE HA H 1 4.34 . . 1 . . . . . . . . 4402 1 1147 . 1 1 121 121 PHE CB C 13 41.1 . . 1 . . . . . . . . 4402 1 1148 . 1 1 121 121 PHE HB2 H 1 3.32 . . 2 . . . . . . . . 4402 1 1149 . 1 1 121 121 PHE HB3 H 1 2.80 . . 2 . . . . . . . . 4402 1 1150 . 1 1 121 121 PHE HD1 H 1 7.31 . . 1 . . . . . . . . 4402 1 1151 . 1 1 121 121 PHE HD2 H 1 7.31 . . 1 . . . . . . . . 4402 1 1152 . 1 1 121 121 PHE HE1 H 1 6.86 . . 1 . . . . . . . . 4402 1 1153 . 1 1 121 121 PHE HE2 H 1 6.86 . . 1 . . . . . . . . 4402 1 1154 . 1 1 121 121 PHE CD1 C 13 131.9 . . 1 . . . . . . . . 4402 1 1155 . 1 1 121 121 PHE CE1 C 13 131.2 . . 1 . . . . . . . . 4402 1 1156 . 1 1 121 121 PHE CZ C 13 128.8 . . 1 . . . . . . . . 4402 1 1157 . 1 1 121 121 PHE HZ H 1 6.72 . . 1 . . . . . . . . 4402 1 1158 . 1 1 122 122 GLY N N 15 108.6 . . 1 . . . . . . . . 4402 1 1159 . 1 1 122 122 GLY H H 1 9.01 . . 1 . . . . . . . . 4402 1 1160 . 1 1 122 122 GLY CA C 13 45.6 . . 1 . . . . . . . . 4402 1 1161 . 1 1 122 122 GLY HA2 H 1 3.80 . . 2 . . . . . . . . 4402 1 1162 . 1 1 122 122 GLY HA3 H 1 4.16 . . 2 . . . . . . . . 4402 1 1163 . 1 1 123 123 SER N N 15 111.7 . . 1 . . . . . . . . 4402 1 1164 . 1 1 123 123 SER H H 1 7.29 . . 1 . . . . . . . . 4402 1 1165 . 1 1 123 123 SER CA C 13 56.4 . . 1 . . . . . . . . 4402 1 1166 . 1 1 123 123 SER HA H 1 4.78 . . 1 . . . . . . . . 4402 1 1167 . 1 1 123 123 SER CB C 13 65.7 . . 1 . . . . . . . . 4402 1 1168 . 1 1 123 123 SER HB2 H 1 3.89 . . 2 . . . . . . . . 4402 1 1169 . 1 1 123 123 SER HB3 H 1 4.11 . . 2 . . . . . . . . 4402 1 1170 . 1 1 124 124 ASP N N 15 124.7 . . 1 . . . . . . . . 4402 1 1171 . 1 1 124 124 ASP H H 1 9.06 . . 1 . . . . . . . . 4402 1 1172 . 1 1 124 124 ASP CA C 13 57.5 . . 1 . . . . . . . . 4402 1 1173 . 1 1 124 124 ASP HA H 1 4.49 . . 1 . . . . . . . . 4402 1 1174 . 1 1 124 124 ASP CB C 13 40.4 . . 1 . . . . . . . . 4402 1 1175 . 1 1 124 124 ASP HB2 H 1 2.74 . . 1 . . . . . . . . 4402 1 1176 . 1 1 124 124 ASP HB3 H 1 2.74 . . 1 . . . . . . . . 4402 1 1177 . 1 1 125 125 TYR N N 15 118.9 . . 1 . . . . . . . . 4402 1 1178 . 1 1 125 125 TYR H H 1 8.58 . . 1 . . . . . . . . 4402 1 1179 . 1 1 125 125 TYR CA C 13 61.2 . . 1 . . . . . . . . 4402 1 1180 . 1 1 125 125 TYR HA H 1 4.18 . . 1 . . . . . . . . 4402 1 1181 . 1 1 125 125 TYR CB C 13 38.0 . . 1 . . . . . . . . 4402 1 1182 . 1 1 125 125 TYR HB2 H 1 3.24 . . 2 . . . . . . . . 4402 1 1183 . 1 1 125 125 TYR HB3 H 1 2.83 . . 2 . . . . . . . . 4402 1 1184 . 1 1 125 125 TYR HD1 H 1 7.04 . . 1 . . . . . . . . 4402 1 1185 . 1 1 125 125 TYR HD2 H 1 7.04 . . 1 . . . . . . . . 4402 1 1186 . 1 1 125 125 TYR HE1 H 1 6.75 . . 1 . . . . . . . . 4402 1 1187 . 1 1 125 125 TYR HE2 H 1 6.75 . . 1 . . . . . . . . 4402 1 1188 . 1 1 125 125 TYR CD1 C 13 133.2 . . 1 . . . . . . . . 4402 1 1189 . 1 1 125 125 TYR CE1 C 13 117.8 . . 1 . . . . . . . . 4402 1 1190 . 1 1 126 126 GLU N N 15 119.0 . . 1 . . . . . . . . 4402 1 1191 . 1 1 126 126 GLU H H 1 7.72 . . 1 . . . . . . . . 4402 1 1192 . 1 1 126 126 GLU CA C 13 59.5 . . 1 . . . . . . . . 4402 1 1193 . 1 1 126 126 GLU HA H 1 3.58 . . 1 . . . . . . . . 4402 1 1194 . 1 1 126 126 GLU CB C 13 29.7 . . 1 . . . . . . . . 4402 1 1195 . 1 1 126 126 GLU HB2 H 1 1.95 . . 2 . . . . . . . . 4402 1 1196 . 1 1 126 126 GLU HB3 H 1 1.55 . . 2 . . . . . . . . 4402 1 1197 . 1 1 126 126 GLU CG C 13 37.2 . . 1 . . . . . . . . 4402 1 1198 . 1 1 126 126 GLU HG2 H 1 2.26 . . 2 . . . . . . . . 4402 1 1199 . 1 1 126 126 GLU HG3 H 1 1.91 . . 2 . . . . . . . . 4402 1 1200 . 1 1 127 127 ASP N N 15 119.7 . . 1 . . . . . . . . 4402 1 1201 . 1 1 127 127 ASP H H 1 8.21 . . 1 . . . . . . . . 4402 1 1202 . 1 1 127 127 ASP CA C 13 58.2 . . 1 . . . . . . . . 4402 1 1203 . 1 1 127 127 ASP HA H 1 4.65 . . 1 . . . . . . . . 4402 1 1204 . 1 1 127 127 ASP CB C 13 40.1 . . 1 . . . . . . . . 4402 1 1205 . 1 1 127 127 ASP HB2 H 1 2.87 . . 2 . . . . . . . . 4402 1 1206 . 1 1 127 127 ASP HB3 H 1 3.03 . . 2 . . . . . . . . 4402 1 1207 . 1 1 128 128 ARG N N 15 120.5 . . 1 . . . . . . . . 4402 1 1208 . 1 1 128 128 ARG H H 1 8.22 . . 1 . . . . . . . . 4402 1 1209 . 1 1 128 128 ARG CA C 13 59.4 . . 1 . . . . . . . . 4402 1 1210 . 1 1 128 128 ARG HA H 1 3.99 . . 1 . . . . . . . . 4402 1 1211 . 1 1 128 128 ARG CB C 13 29.7 . . 1 . . . . . . . . 4402 1 1212 . 1 1 128 128 ARG HB2 H 1 1.89 . . 1 . . . . . . . . 4402 1 1213 . 1 1 128 128 ARG HB3 H 1 1.89 . . 1 . . . . . . . . 4402 1 1214 . 1 1 128 128 ARG CG C 13 27.6 . . 1 . . . . . . . . 4402 1 1215 . 1 1 128 128 ARG HG2 H 1 1.74 . . 2 . . . . . . . . 4402 1 1216 . 1 1 128 128 ARG HG3 H 1 1.52 . . 2 . . . . . . . . 4402 1 1217 . 1 1 128 128 ARG CD C 13 43.4 . . 1 . . . . . . . . 4402 1 1218 . 1 1 128 128 ARG HD2 H 1 3.21 . . 2 . . . . . . . . 4402 1 1219 . 1 1 128 128 ARG HD3 H 1 3.18 . . 2 . . . . . . . . 4402 1 1220 . 1 1 128 128 ARG NE N 15 85.1 . . 1 . . . . . . . . 4402 1 1221 . 1 1 128 128 ARG HE H 1 7.46 . . 1 . . . . . . . . 4402 1 1222 . 1 1 129 129 TYR N N 15 121.4 . . 1 . . . . . . . . 4402 1 1223 . 1 1 129 129 TYR H H 1 8.30 . . 1 . . . . . . . . 4402 1 1224 . 1 1 129 129 TYR CA C 13 62.0 . . 1 . . . . . . . . 4402 1 1225 . 1 1 129 129 TYR HA H 1 3.81 . . 1 . . . . . . . . 4402 1 1226 . 1 1 129 129 TYR CB C 13 38.1 . . 1 . . . . . . . . 4402 1 1227 . 1 1 129 129 TYR HB2 H 1 2.59 . . 2 . . . . . . . . 4402 1 1228 . 1 1 129 129 TYR HB3 H 1 2.88 . . 2 . . . . . . . . 4402 1 1229 . 1 1 129 129 TYR HD1 H 1 6.92 . . 1 . . . . . . . . 4402 1 1230 . 1 1 129 129 TYR HD2 H 1 6.92 . . 1 . . . . . . . . 4402 1 1231 . 1 1 129 129 TYR HE1 H 1 6.75 . . 1 . . . . . . . . 4402 1 1232 . 1 1 129 129 TYR HE2 H 1 6.75 . . 1 . . . . . . . . 4402 1 1233 . 1 1 129 129 TYR CD1 C 13 133.2 . . 1 . . . . . . . . 4402 1 1234 . 1 1 129 129 TYR CE1 C 13 118.2 . . 1 . . . . . . . . 4402 1 1235 . 1 1 130 130 TYR N N 15 120.6 . . 1 . . . . . . . . 4402 1 1236 . 1 1 130 130 TYR H H 1 8.96 . . 1 . . . . . . . . 4402 1 1237 . 1 1 130 130 TYR CA C 13 62.5 . . 1 . . . . . . . . 4402 1 1238 . 1 1 130 130 TYR HA H 1 4.11 . . 1 . . . . . . . . 4402 1 1239 . 1 1 130 130 TYR CB C 13 38.0 . . 1 . . . . . . . . 4402 1 1240 . 1 1 130 130 TYR HB2 H 1 3.52 . . 2 . . . . . . . . 4402 1 1241 . 1 1 130 130 TYR HB3 H 1 3.25 . . 2 . . . . . . . . 4402 1 1242 . 1 1 130 130 TYR HD1 H 1 7.52 . . 1 . . . . . . . . 4402 1 1243 . 1 1 130 130 TYR HD2 H 1 7.52 . . 1 . . . . . . . . 4402 1 1244 . 1 1 130 130 TYR HE1 H 1 6.99 . . 1 . . . . . . . . 4402 1 1245 . 1 1 130 130 TYR HE2 H 1 6.99 . . 1 . . . . . . . . 4402 1 1246 . 1 1 130 130 TYR CD1 C 13 133.5 . . 1 . . . . . . . . 4402 1 1247 . 1 1 130 130 TYR CE1 C 13 118.3 . . 1 . . . . . . . . 4402 1 1248 . 1 1 131 131 ARG N N 15 117.9 . . 1 . . . . . . . . 4402 1 1249 . 1 1 131 131 ARG H H 1 7.99 . . 1 . . . . . . . . 4402 1 1250 . 1 1 131 131 ARG CA C 13 59.7 . . 1 . . . . . . . . 4402 1 1251 . 1 1 131 131 ARG HA H 1 3.91 . . 1 . . . . . . . . 4402 1 1252 . 1 1 131 131 ARG CB C 13 29.6 . . 1 . . . . . . . . 4402 1 1253 . 1 1 131 131 ARG HB2 H 1 2.05 . . 2 . . . . . . . . 4402 1 1254 . 1 1 131 131 ARG HB3 H 1 1.95 . . 2 . . . . . . . . 4402 1 1255 . 1 1 131 131 ARG CG C 13 28.1 . . 1 . . . . . . . . 4402 1 1256 . 1 1 131 131 ARG HG2 H 1 2.00 . . 2 . . . . . . . . 4402 1 1257 . 1 1 131 131 ARG HG3 H 1 1.72 . . 2 . . . . . . . . 4402 1 1258 . 1 1 131 131 ARG CD C 13 43.1 . . 1 . . . . . . . . 4402 1 1259 . 1 1 131 131 ARG HD2 H 1 3.27 . . 2 . . . . . . . . 4402 1 1260 . 1 1 131 131 ARG HD3 H 1 3.37 . . 2 . . . . . . . . 4402 1 1261 . 1 1 131 131 ARG NE N 15 84.2 . . 1 . . . . . . . . 4402 1 1262 . 1 1 131 131 ARG HE H 1 7.48 . . 1 . . . . . . . . 4402 1 1263 . 1 1 132 132 GLU N N 15 116.5 . . 1 . . . . . . . . 4402 1 1264 . 1 1 132 132 GLU H H 1 8.06 . . 1 . . . . . . . . 4402 1 1265 . 1 1 132 132 GLU CA C 13 57.8 . . 1 . . . . . . . . 4402 1 1266 . 1 1 132 132 GLU HA H 1 4.06 . . 1 . . . . . . . . 4402 1 1267 . 1 1 132 132 GLU CB C 13 29.3 . . 1 . . . . . . . . 4402 1 1268 . 1 1 132 132 GLU HB2 H 1 1.88 . . 1 . . . . . . . . 4402 1 1269 . 1 1 132 132 GLU HB3 H 1 1.88 . . 1 . . . . . . . . 4402 1 1270 . 1 1 132 132 GLU CG C 13 35.6 . . 1 . . . . . . . . 4402 1 1271 . 1 1 132 132 GLU HG2 H 1 2.23 . . 2 . . . . . . . . 4402 1 1272 . 1 1 132 132 GLU HG3 H 1 2.42 . . 2 . . . . . . . . 4402 1 1273 . 1 1 133 133 ASN N N 15 114.7 . . 1 . . . . . . . . 4402 1 1274 . 1 1 133 133 ASN H H 1 7.61 . . 1 . . . . . . . . 4402 1 1275 . 1 1 133 133 ASN CA C 13 54.9 . . 1 . . . . . . . . 4402 1 1276 . 1 1 133 133 ASN HA H 1 4.27 . . 1 . . . . . . . . 4402 1 1277 . 1 1 133 133 ASN CB C 13 40.8 . . 1 . . . . . . . . 4402 1 1278 . 1 1 133 133 ASN HB2 H 1 2.13 . . 1 . . . . . . . . 4402 1 1279 . 1 1 133 133 ASN HB3 H 1 2.13 . . 1 . . . . . . . . 4402 1 1280 . 1 1 133 133 ASN ND2 N 15 117.1 . . 1 . . . . . . . . 4402 1 1281 . 1 1 133 133 ASN HD21 H 1 6.68 . . 2 . . . . . . . . 4402 1 1282 . 1 1 133 133 ASN HD22 H 1 6.59 . . 2 . . . . . . . . 4402 1 1283 . 1 1 134 134 MET N N 15 119.7 . . 1 . . . . . . . . 4402 1 1284 . 1 1 134 134 MET H H 1 8.12 . . 1 . . . . . . . . 4402 1 1285 . 1 1 134 134 MET CA C 13 59.1 . . 1 . . . . . . . . 4402 1 1286 . 1 1 134 134 MET HA H 1 3.42 . . 1 . . . . . . . . 4402 1 1287 . 1 1 134 134 MET CB C 13 30.5 . . 1 . . . . . . . . 4402 1 1288 . 1 1 134 134 MET HB2 H 1 1.65 . . 2 . . . . . . . . 4402 1 1289 . 1 1 134 134 MET HB3 H 1 1.31 . . 2 . . . . . . . . 4402 1 1290 . 1 1 134 134 MET CG C 13 30.4 . . 1 . . . . . . . . 4402 1 1291 . 1 1 134 134 MET HG2 H 1 2.52 . . 2 . . . . . . . . 4402 1 1292 . 1 1 134 134 MET HG3 H 1 2.13 . . 2 . . . . . . . . 4402 1 1293 . 1 1 134 134 MET HE1 H 1 2.00 . . 1 . . . . . . . . 4402 1 1294 . 1 1 134 134 MET HE2 H 1 2.00 . . 1 . . . . . . . . 4402 1 1295 . 1 1 134 134 MET HE3 H 1 2.00 . . 1 . . . . . . . . 4402 1 1296 . 1 1 134 134 MET CE C 13 17.5 . . 1 . . . . . . . . 4402 1 1297 . 1 1 135 135 HIS N N 15 115.1 . . 1 . . . . . . . . 4402 1 1298 . 1 1 135 135 HIS H H 1 8.08 . . 1 . . . . . . . . 4402 1 1299 . 1 1 135 135 HIS CA C 13 57.4 . . 1 . . . . . . . . 4402 1 1300 . 1 1 135 135 HIS HA H 1 4.21 . . 1 . . . . . . . . 4402 1 1301 . 1 1 135 135 HIS CB C 13 27.1 . . 1 . . . . . . . . 4402 1 1302 . 1 1 135 135 HIS HB2 H 1 3.06 . . 2 . . . . . . . . 4402 1 1303 . 1 1 135 135 HIS HB3 H 1 3.30 . . 2 . . . . . . . . 4402 1 1304 . 1 1 135 135 HIS CD2 C 13 120.3 . . 1 . . . . . . . . 4402 1 1305 . 1 1 135 135 HIS HD2 H 1 7.35 . . 1 . . . . . . . . 4402 1 1306 . 1 1 136 136 ARG N N 15 118.0 . . 1 . . . . . . . . 4402 1 1307 . 1 1 136 136 ARG H H 1 7.62 . . 1 . . . . . . . . 4402 1 1308 . 1 1 136 136 ARG CA C 13 56.0 . . 1 . . . . . . . . 4402 1 1309 . 1 1 136 136 ARG HA H 1 4.12 . . 1 . . . . . . . . 4402 1 1310 . 1 1 136 136 ARG CB C 13 30.3 . . 1 . . . . . . . . 4402 1 1311 . 1 1 136 136 ARG HB2 H 1 1.39 . . 2 . . . . . . . . 4402 1 1312 . 1 1 136 136 ARG HB3 H 1 2.10 . . 2 . . . . . . . . 4402 1 1313 . 1 1 136 136 ARG CG C 13 27.2 . . 1 . . . . . . . . 4402 1 1314 . 1 1 136 136 ARG HG2 H 1 1.36 . . 2 . . . . . . . . 4402 1 1315 . 1 1 136 136 ARG HG3 H 1 0.33 . . 2 . . . . . . . . 4402 1 1316 . 1 1 136 136 ARG CD C 13 43.9 . . 1 . . . . . . . . 4402 1 1317 . 1 1 136 136 ARG HD2 H 1 3.23 . . 2 . . . . . . . . 4402 1 1318 . 1 1 136 136 ARG HD3 H 1 3.08 . . 2 . . . . . . . . 4402 1 1319 . 1 1 136 136 ARG NE N 15 84.1 . . 1 . . . . . . . . 4402 1 1320 . 1 1 136 136 ARG HE H 1 7.36 . . 1 . . . . . . . . 4402 1 1321 . 1 1 137 137 TYR N N 15 121.0 . . 1 . . . . . . . . 4402 1 1322 . 1 1 137 137 TYR H H 1 7.48 . . 1 . . . . . . . . 4402 1 1323 . 1 1 137 137 TYR CA C 13 52.4 . . 1 . . . . . . . . 4402 1 1324 . 1 1 137 137 TYR HA H 1 5.00 . . 1 . . . . . . . . 4402 1 1325 . 1 1 137 137 TYR CB C 13 34.7 . . 1 . . . . . . . . 4402 1 1326 . 1 1 137 137 TYR HB2 H 1 3.10 . . 1 . . . . . . . . 4402 1 1327 . 1 1 137 137 TYR HB3 H 1 3.10 . . 1 . . . . . . . . 4402 1 1328 . 1 1 137 137 TYR HD1 H 1 6.86 . . 1 . . . . . . . . 4402 1 1329 . 1 1 137 137 TYR HD2 H 1 6.86 . . 1 . . . . . . . . 4402 1 1330 . 1 1 137 137 TYR HE1 H 1 6.54 . . 1 . . . . . . . . 4402 1 1331 . 1 1 137 137 TYR HE2 H 1 6.54 . . 1 . . . . . . . . 4402 1 1332 . 1 1 137 137 TYR CD1 C 13 131.1 . . 1 . . . . . . . . 4402 1 1333 . 1 1 137 137 TYR CE1 C 13 117.0 . . 1 . . . . . . . . 4402 1 1334 . 1 1 138 138 PRO CD C 13 49.9 . . 1 . . . . . . . . 4402 1 1335 . 1 1 138 138 PRO CA C 13 63.3 . . 1 . . . . . . . . 4402 1 1336 . 1 1 138 138 PRO HA H 1 4.40 . . 1 . . . . . . . . 4402 1 1337 . 1 1 138 138 PRO CB C 13 32.2 . . 1 . . . . . . . . 4402 1 1338 . 1 1 138 138 PRO HB2 H 1 1.68 . . 2 . . . . . . . . 4402 1 1339 . 1 1 138 138 PRO HB3 H 1 2.44 . . 2 . . . . . . . . 4402 1 1340 . 1 1 138 138 PRO CG C 13 27.2 . . 1 . . . . . . . . 4402 1 1341 . 1 1 138 138 PRO HG2 H 1 1.54 . . 2 . . . . . . . . 4402 1 1342 . 1 1 138 138 PRO HG3 H 1 1.29 . . 2 . . . . . . . . 4402 1 1343 . 1 1 138 138 PRO HD2 H 1 3.11 . . 2 . . . . . . . . 4402 1 1344 . 1 1 138 138 PRO HD3 H 1 3.30 . . 2 . . . . . . . . 4402 1 1345 . 1 1 139 139 ASN N N 15 116.3 . . 1 . . . . . . . . 4402 1 1346 . 1 1 139 139 ASN H H 1 8.55 . . 1 . . . . . . . . 4402 1 1347 . 1 1 139 139 ASN CA C 13 51.6 . . 1 . . . . . . . . 4402 1 1348 . 1 1 139 139 ASN HA H 1 4.71 . . 1 . . . . . . . . 4402 1 1349 . 1 1 139 139 ASN CB C 13 38.1 . . 1 . . . . . . . . 4402 1 1350 . 1 1 139 139 ASN HB2 H 1 2.42 . . 2 . . . . . . . . 4402 1 1351 . 1 1 139 139 ASN HB3 H 1 3.66 . . 2 . . . . . . . . 4402 1 1352 . 1 1 139 139 ASN ND2 N 15 109.2 . . 1 . . . . . . . . 4402 1 1353 . 1 1 139 139 ASN HD21 H 1 7.47 . . 2 . . . . . . . . 4402 1 1354 . 1 1 139 139 ASN HD22 H 1 6.77 . . 2 . . . . . . . . 4402 1 1355 . 1 1 140 140 GLN N N 15 113.8 . . 1 . . . . . . . . 4402 1 1356 . 1 1 140 140 GLN H H 1 7.27 . . 1 . . . . . . . . 4402 1 1357 . 1 1 140 140 GLN CA C 13 53.9 . . 1 . . . . . . . . 4402 1 1358 . 1 1 140 140 GLN HA H 1 4.52 . . 1 . . . . . . . . 4402 1 1359 . 1 1 140 140 GLN CB C 13 33.3 . . 1 . . . . . . . . 4402 1 1360 . 1 1 140 140 GLN HB2 H 1 1.69 . . 2 . . . . . . . . 4402 1 1361 . 1 1 140 140 GLN HB3 H 1 1.97 . . 2 . . . . . . . . 4402 1 1362 . 1 1 140 140 GLN CG C 13 33.8 . . 1 . . . . . . . . 4402 1 1363 . 1 1 140 140 GLN HG2 H 1 2.14 . . 2 . . . . . . . . 4402 1 1364 . 1 1 140 140 GLN HG3 H 1 2.01 . . 2 . . . . . . . . 4402 1 1365 . 1 1 140 140 GLN NE2 N 15 112.7 . . 1 . . . . . . . . 4402 1 1366 . 1 1 140 140 GLN HE21 H 1 7.92 . . 2 . . . . . . . . 4402 1 1367 . 1 1 140 140 GLN HE22 H 1 6.98 . . 2 . . . . . . . . 4402 1 1368 . 1 1 141 141 VAL N N 15 112.8 . . 1 . . . . . . . . 4402 1 1369 . 1 1 141 141 VAL H H 1 8.52 . . 1 . . . . . . . . 4402 1 1370 . 1 1 141 141 VAL CA C 13 58.5 . . 1 . . . . . . . . 4402 1 1371 . 1 1 141 141 VAL HA H 1 4.90 . . 1 . . . . . . . . 4402 1 1372 . 1 1 141 141 VAL CB C 13 33.8 . . 1 . . . . . . . . 4402 1 1373 . 1 1 141 141 VAL HB H 1 2.60 . . 1 . . . . . . . . 4402 1 1374 . 1 1 141 141 VAL HG11 H 1 0.94 . . 2 . . . . . . . . 4402 1 1375 . 1 1 141 141 VAL HG12 H 1 0.94 . . 2 . . . . . . . . 4402 1 1376 . 1 1 141 141 VAL HG13 H 1 0.94 . . 2 . . . . . . . . 4402 1 1377 . 1 1 141 141 VAL HG21 H 1 0.75 . . 2 . . . . . . . . 4402 1 1378 . 1 1 141 141 VAL HG22 H 1 0.75 . . 2 . . . . . . . . 4402 1 1379 . 1 1 141 141 VAL HG23 H 1 0.75 . . 2 . . . . . . . . 4402 1 1380 . 1 1 141 141 VAL CG1 C 13 23.5 . . 1 . . . . . . . . 4402 1 1381 . 1 1 141 141 VAL CG2 C 13 18.3 . . 1 . . . . . . . . 4402 1 1382 . 1 1 142 142 TYR N N 15 121.2 . . 1 . . . . . . . . 4402 1 1383 . 1 1 142 142 TYR H H 1 8.46 . . 1 . . . . . . . . 4402 1 1384 . 1 1 142 142 TYR CA C 13 56.7 . . 1 . . . . . . . . 4402 1 1385 . 1 1 142 142 TYR HA H 1 5.52 . . 1 . . . . . . . . 4402 1 1386 . 1 1 142 142 TYR CB C 13 41.9 . . 1 . . . . . . . . 4402 1 1387 . 1 1 142 142 TYR HB2 H 1 2.54 . . 2 . . . . . . . . 4402 1 1388 . 1 1 142 142 TYR HB3 H 1 2.58 . . 2 . . . . . . . . 4402 1 1389 . 1 1 142 142 TYR HD1 H 1 6.89 . . 1 . . . . . . . . 4402 1 1390 . 1 1 142 142 TYR HD2 H 1 6.89 . . 1 . . . . . . . . 4402 1 1391 . 1 1 142 142 TYR HE1 H 1 6.74 . . 1 . . . . . . . . 4402 1 1392 . 1 1 142 142 TYR HE2 H 1 6.74 . . 1 . . . . . . . . 4402 1 1393 . 1 1 142 142 TYR CD1 C 13 132.9 . . 1 . . . . . . . . 4402 1 1394 . 1 1 142 142 TYR CE1 C 13 118.2 . . 1 . . . . . . . . 4402 1 1395 . 1 1 143 143 TYR N N 15 111.1 . . 1 . . . . . . . . 4402 1 1396 . 1 1 143 143 TYR H H 1 8.59 . . 1 . . . . . . . . 4402 1 1397 . 1 1 143 143 TYR CA C 13 55.3 . . 1 . . . . . . . . 4402 1 1398 . 1 1 143 143 TYR HA H 1 4.76 . . 1 . . . . . . . . 4402 1 1399 . 1 1 143 143 TYR CB C 13 40.2 . . 1 . . . . . . . . 4402 1 1400 . 1 1 143 143 TYR HB2 H 1 2.73 . . 2 . . . . . . . . 4402 1 1401 . 1 1 143 143 TYR HB3 H 1 2.60 . . 2 . . . . . . . . 4402 1 1402 . 1 1 143 143 TYR HD1 H 1 7.00 . . 1 . . . . . . . . 4402 1 1403 . 1 1 143 143 TYR HD2 H 1 7.00 . . 1 . . . . . . . . 4402 1 1404 . 1 1 143 143 TYR HE1 H 1 6.44 . . 1 . . . . . . . . 4402 1 1405 . 1 1 143 143 TYR HE2 H 1 6.44 . . 1 . . . . . . . . 4402 1 1406 . 1 1 143 143 TYR CD1 C 13 133.9 . . 1 . . . . . . . . 4402 1 1407 . 1 1 143 143 TYR CE1 C 13 117.6 . . 1 . . . . . . . . 4402 1 1408 . 1 1 144 144 ARG N N 15 121.0 . . 1 . . . . . . . . 4402 1 1409 . 1 1 144 144 ARG H H 1 8.02 . . 1 . . . . . . . . 4402 1 1410 . 1 1 144 144 ARG CA C 13 52.7 . . 1 . . . . . . . . 4402 1 1411 . 1 1 144 144 ARG HA H 1 4.61 . . 1 . . . . . . . . 4402 1 1412 . 1 1 144 144 ARG CB C 13 30.0 . . 1 . . . . . . . . 4402 1 1413 . 1 1 144 144 ARG HB2 H 1 1.62 . . 1 . . . . . . . . 4402 1 1414 . 1 1 144 144 ARG HB3 H 1 1.62 . . 1 . . . . . . . . 4402 1 1415 . 1 1 144 144 ARG CG C 13 27.3 . . 1 . . . . . . . . 4402 1 1416 . 1 1 144 144 ARG HG2 H 1 1.14 . . 1 . . . . . . . . 4402 1 1417 . 1 1 144 144 ARG HG3 H 1 1.14 . . 1 . . . . . . . . 4402 1 1418 . 1 1 144 144 ARG CD C 13 43.1 . . 1 . . . . . . . . 4402 1 1419 . 1 1 144 144 ARG HD2 H 1 2.85 . . 1 . . . . . . . . 4402 1 1420 . 1 1 144 144 ARG HD3 H 1 2.85 . . 1 . . . . . . . . 4402 1 1421 . 1 1 144 144 ARG NE N 15 84.9 . . 1 . . . . . . . . 4402 1 1422 . 1 1 144 144 ARG HE H 1 6.94 . . 1 . . . . . . . . 4402 1 1423 . 1 1 145 145 PRO CD C 13 50.4 . . 1 . . . . . . . . 4402 1 1424 . 1 1 145 145 PRO CA C 13 63.0 . . 1 . . . . . . . . 4402 1 1425 . 1 1 145 145 PRO HA H 1 4.51 . . 1 . . . . . . . . 4402 1 1426 . 1 1 145 145 PRO CB C 13 32.4 . . 1 . . . . . . . . 4402 1 1427 . 1 1 145 145 PRO HB2 H 1 2.46 . . 2 . . . . . . . . 4402 1 1428 . 1 1 145 145 PRO HB3 H 1 1.92 . . 2 . . . . . . . . 4402 1 1429 . 1 1 145 145 PRO CG C 13 28.0 . . 1 . . . . . . . . 4402 1 1430 . 1 1 145 145 PRO HG2 H 1 2.07 . . 2 . . . . . . . . 4402 1 1431 . 1 1 145 145 PRO HG3 H 1 1.91 . . 2 . . . . . . . . 4402 1 1432 . 1 1 145 145 PRO HD2 H 1 3.51 . . 2 . . . . . . . . 4402 1 1433 . 1 1 145 145 PRO HD3 H 1 3.61 . . 2 . . . . . . . . 4402 1 1434 . 1 1 146 146 MET N N 15 120.6 . . 1 . . . . . . . . 4402 1 1435 . 1 1 146 146 MET H H 1 8.87 . . 1 . . . . . . . . 4402 1 1436 . 1 1 146 146 MET CA C 13 57.6 . . 1 . . . . . . . . 4402 1 1437 . 1 1 146 146 MET HA H 1 4.43 . . 1 . . . . . . . . 4402 1 1438 . 1 1 146 146 MET CB C 13 32.1 . . 1 . . . . . . . . 4402 1 1439 . 1 1 146 146 MET HB2 H 1 2.32 . . 1 . . . . . . . . 4402 1 1440 . 1 1 146 146 MET HB3 H 1 2.32 . . 1 . . . . . . . . 4402 1 1441 . 1 1 146 146 MET CG C 13 32.8 . . 1 . . . . . . . . 4402 1 1442 . 1 1 146 146 MET HG2 H 1 1.84 . . 2 . . . . . . . . 4402 1 1443 . 1 1 146 146 MET HG3 H 1 1.75 . . 2 . . . . . . . . 4402 1 1444 . 1 1 146 146 MET HE1 H 1 1.59 . . 1 . . . . . . . . 4402 1 1445 . 1 1 146 146 MET HE2 H 1 1.59 . . 1 . . . . . . . . 4402 1 1446 . 1 1 146 146 MET HE3 H 1 1.59 . . 1 . . . . . . . . 4402 1 1447 . 1 1 146 146 MET CE C 13 17.0 . . 1 . . . . . . . . 4402 1 1448 . 1 1 147 147 ASP N N 15 118.6 . . 1 . . . . . . . . 4402 1 1449 . 1 1 147 147 ASP H H 1 8.44 . . 1 . . . . . . . . 4402 1 1450 . 1 1 147 147 ASP CA C 13 54.1 . . 1 . . . . . . . . 4402 1 1451 . 1 1 147 147 ASP HA H 1 4.51 . . 1 . . . . . . . . 4402 1 1452 . 1 1 147 147 ASP CB C 13 39.5 . . 1 . . . . . . . . 4402 1 1453 . 1 1 147 147 ASP HB2 H 1 2.95 . . 2 . . . . . . . . 4402 1 1454 . 1 1 147 147 ASP HB3 H 1 2.71 . . 2 . . . . . . . . 4402 1 1455 . 1 1 148 148 GLU N N 15 117.3 . . 1 . . . . . . . . 4402 1 1456 . 1 1 148 148 GLU H H 1 8.36 . . 1 . . . . . . . . 4402 1 1457 . 1 1 148 148 GLU CA C 13 54.9 . . 1 . . . . . . . . 4402 1 1458 . 1 1 148 148 GLU HA H 1 4.52 . . 1 . . . . . . . . 4402 1 1459 . 1 1 148 148 GLU CB C 13 28.8 . . 1 . . . . . . . . 4402 1 1460 . 1 1 148 148 GLU HB2 H 1 3.01 . . 2 . . . . . . . . 4402 1 1461 . 1 1 148 148 GLU HB3 H 1 2.92 . . 2 . . . . . . . . 4402 1 1462 . 1 1 149 149 TYR HD1 H 1 7.14 . . 1 . . . . . . . . 4402 1 1463 . 1 1 149 149 TYR HD2 H 1 7.14 . . 1 . . . . . . . . 4402 1 1464 . 1 1 149 149 TYR HE1 H 1 6.86 . . 1 . . . . . . . . 4402 1 1465 . 1 1 149 149 TYR HE2 H 1 6.86 . . 1 . . . . . . . . 4402 1 1466 . 1 1 149 149 TYR CD1 C 13 133.3 . . 1 . . . . . . . . 4402 1 1467 . 1 1 149 149 TYR CE1 C 13 118.5 . . 1 . . . . . . . . 4402 1 1468 . 1 1 150 150 SER CA C 13 58.8 . . 1 . . . . . . . . 4402 1 1469 . 1 1 150 150 SER HA H 1 4.55 . . 1 . . . . . . . . 4402 1 1470 . 1 1 150 150 SER CB C 13 63.9 . . 1 . . . . . . . . 4402 1 1471 . 1 1 150 150 SER HB2 H 1 3.92 . . 2 . . . . . . . . 4402 1 1472 . 1 1 150 150 SER HB3 H 1 3.90 . . 2 . . . . . . . . 4402 1 1473 . 1 1 151 151 ASN CA C 13 52.1 . . 1 . . . . . . . . 4402 1 1474 . 1 1 151 151 ASN HA H 1 4.75 . . 1 . . . . . . . . 4402 1 1475 . 1 1 151 151 ASN CB C 13 39.7 . . 1 . . . . . . . . 4402 1 1476 . 1 1 151 151 ASN HB2 H 1 3.10 . . 2 . . . . . . . . 4402 1 1477 . 1 1 151 151 ASN HB3 H 1 3.02 . . 2 . . . . . . . . 4402 1 1478 . 1 1 151 151 ASN ND2 N 15 113.2 . . 1 . . . . . . . . 4402 1 1479 . 1 1 151 151 ASN HD21 H 1 7.54 . . 2 . . . . . . . . 4402 1 1480 . 1 1 151 151 ASN HD22 H 1 6.72 . . 2 . . . . . . . . 4402 1 1481 . 1 1 152 152 GLN N N 15 120.3 . . 1 . . . . . . . . 4402 1 1482 . 1 1 152 152 GLN H H 1 8.67 . . 1 . . . . . . . . 4402 1 1483 . 1 1 152 152 GLN CA C 13 59.2 . . 1 . . . . . . . . 4402 1 1484 . 1 1 152 152 GLN HA H 1 2.93 . . 1 . . . . . . . . 4402 1 1485 . 1 1 152 152 GLN CB C 13 28.9 . . 1 . . . . . . . . 4402 1 1486 . 1 1 152 152 GLN HB2 H 1 1.65 . . 2 . . . . . . . . 4402 1 1487 . 1 1 152 152 GLN HB3 H 1 1.58 . . 2 . . . . . . . . 4402 1 1488 . 1 1 152 152 GLN CG C 13 33.2 . . 1 . . . . . . . . 4402 1 1489 . 1 1 152 152 GLN HG2 H 1 1.45 . . 2 . . . . . . . . 4402 1 1490 . 1 1 152 152 GLN HG3 H 1 1.14 . . 2 . . . . . . . . 4402 1 1491 . 1 1 152 152 GLN NE2 N 15 111.8 . . 1 . . . . . . . . 4402 1 1492 . 1 1 152 152 GLN HE21 H 1 7.46 . . 2 . . . . . . . . 4402 1 1493 . 1 1 152 152 GLN HE22 H 1 6.78 . . 2 . . . . . . . . 4402 1 1494 . 1 1 153 153 ASN N N 15 117.1 . . 1 . . . . . . . . 4402 1 1495 . 1 1 153 153 ASN H H 1 8.38 . . 1 . . . . . . . . 4402 1 1496 . 1 1 153 153 ASN CA C 13 56.3 . . 1 . . . . . . . . 4402 1 1497 . 1 1 153 153 ASN HA H 1 4.23 . . 1 . . . . . . . . 4402 1 1498 . 1 1 153 153 ASN CB C 13 37.8 . . 1 . . . . . . . . 4402 1 1499 . 1 1 153 153 ASN HB2 H 1 2.65 . . 2 . . . . . . . . 4402 1 1500 . 1 1 153 153 ASN HB3 H 1 2.73 . . 2 . . . . . . . . 4402 1 1501 . 1 1 153 153 ASN ND2 N 15 112.9 . . 1 . . . . . . . . 4402 1 1502 . 1 1 153 153 ASN HD21 H 1 7.58 . . 2 . . . . . . . . 4402 1 1503 . 1 1 153 153 ASN HD22 H 1 6.95 . . 2 . . . . . . . . 4402 1 1504 . 1 1 154 154 ASN N N 15 118.6 . . 1 . . . . . . . . 4402 1 1505 . 1 1 154 154 ASN H H 1 8.64 . . 1 . . . . . . . . 4402 1 1506 . 1 1 154 154 ASN CA C 13 55.7 . . 1 . . . . . . . . 4402 1 1507 . 1 1 154 154 ASN HA H 1 4.55 . . 1 . . . . . . . . 4402 1 1508 . 1 1 154 154 ASN CB C 13 37.8 . . 1 . . . . . . . . 4402 1 1509 . 1 1 154 154 ASN HB2 H 1 2.91 . . 2 . . . . . . . . 4402 1 1510 . 1 1 154 154 ASN HB3 H 1 3.05 . . 2 . . . . . . . . 4402 1 1511 . 1 1 154 154 ASN ND2 N 15 112.2 . . 1 . . . . . . . . 4402 1 1512 . 1 1 154 154 ASN HD21 H 1 7.46 . . 2 . . . . . . . . 4402 1 1513 . 1 1 154 154 ASN HD22 H 1 6.81 . . 2 . . . . . . . . 4402 1 1514 . 1 1 155 155 PHE HD1 H 1 7.64 . . 1 . . . . . . . . 4402 1 1515 . 1 1 155 155 PHE HD2 H 1 7.64 . . 1 . . . . . . . . 4402 1 1516 . 1 1 155 155 PHE HE1 H 1 6.63 . . 1 . . . . . . . . 4402 1 1517 . 1 1 155 155 PHE HE2 H 1 6.63 . . 1 . . . . . . . . 4402 1 1518 . 1 1 155 155 PHE CD1 C 13 131.7 . . 1 . . . . . . . . 4402 1 1519 . 1 1 155 155 PHE CE1 C 13 128.9 . . 1 . . . . . . . . 4402 1 1520 . 1 1 156 156 VAL N N 15 120.3 . . 1 . . . . . . . . 4402 1 1521 . 1 1 156 156 VAL H H 1 8.94 . . 1 . . . . . . . . 4402 1 1522 . 1 1 156 156 VAL CA C 13 67.6 . . 1 . . . . . . . . 4402 1 1523 . 1 1 156 156 VAL HA H 1 3.50 . . 1 . . . . . . . . 4402 1 1524 . 1 1 156 156 VAL CB C 13 31.9 . . 1 . . . . . . . . 4402 1 1525 . 1 1 156 156 VAL HB H 1 2.21 . . 1 . . . . . . . . 4402 1 1526 . 1 1 156 156 VAL HG11 H 1 1.02 . . 2 . . . . . . . . 4402 1 1527 . 1 1 156 156 VAL HG12 H 1 1.02 . . 2 . . . . . . . . 4402 1 1528 . 1 1 156 156 VAL HG13 H 1 1.02 . . 2 . . . . . . . . 4402 1 1529 . 1 1 156 156 VAL HG21 H 1 1.06 . . 2 . . . . . . . . 4402 1 1530 . 1 1 156 156 VAL HG22 H 1 1.06 . . 2 . . . . . . . . 4402 1 1531 . 1 1 156 156 VAL HG23 H 1 1.06 . . 2 . . . . . . . . 4402 1 1532 . 1 1 156 156 VAL CG1 C 13 21.5 . . 1 . . . . . . . . 4402 1 1533 . 1 1 156 156 VAL CG2 C 13 24.5 . . 1 . . . . . . . . 4402 1 1534 . 1 1 157 157 HIS N N 15 116.7 . . 1 . . . . . . . . 4402 1 1535 . 1 1 157 157 HIS H H 1 8.36 . . 1 . . . . . . . . 4402 1 1536 . 1 1 157 157 HIS CA C 13 59.1 . . 1 . . . . . . . . 4402 1 1537 . 1 1 157 157 HIS HA H 1 4.30 . . 1 . . . . . . . . 4402 1 1538 . 1 1 157 157 HIS CB C 13 28.1 . . 1 . . . . . . . . 4402 1 1539 . 1 1 157 157 HIS HB2 H 1 3.32 . . 2 . . . . . . . . 4402 1 1540 . 1 1 157 157 HIS HB3 H 1 3.37 . . 2 . . . . . . . . 4402 1 1541 . 1 1 157 157 HIS CD2 C 13 120.1 . . 1 . . . . . . . . 4402 1 1542 . 1 1 157 157 HIS CE1 C 13 136.0 . . 1 . . . . . . . . 4402 1 1543 . 1 1 157 157 HIS HD2 H 1 7.37 . . 1 . . . . . . . . 4402 1 1544 . 1 1 157 157 HIS HE1 H 1 8.62 . . 1 . . . . . . . . 4402 1 1545 . 1 1 158 158 ASP N N 15 118.6 . . 1 . . . . . . . . 4402 1 1546 . 1 1 158 158 ASP H H 1 7.73 . . 1 . . . . . . . . 4402 1 1547 . 1 1 158 158 ASP CA C 13 57.2 . . 1 . . . . . . . . 4402 1 1548 . 1 1 158 158 ASP HA H 1 4.53 . . 1 . . . . . . . . 4402 1 1549 . 1 1 158 158 ASP CB C 13 41.1 . . 1 . . . . . . . . 4402 1 1550 . 1 1 158 158 ASP HB2 H 1 2.96 . . 2 . . . . . . . . 4402 1 1551 . 1 1 158 158 ASP HB3 H 1 2.85 . . 2 . . . . . . . . 4402 1 1552 . 1 1 159 159 CYS N N 15 119.2 . . 1 . . . . . . . . 4402 1 1553 . 1 1 159 159 CYS H H 1 8.07 . . 1 . . . . . . . . 4402 1 1554 . 1 1 159 159 CYS CA C 13 58.5 . . 1 . . . . . . . . 4402 1 1555 . 1 1 159 159 CYS HA H 1 4.72 . . 1 . . . . . . . . 4402 1 1556 . 1 1 159 159 CYS CB C 13 40.2 . . 1 . . . . . . . . 4402 1 1557 . 1 1 159 159 CYS HB2 H 1 2.96 . . 2 . . . . . . . . 4402 1 1558 . 1 1 159 159 CYS HB3 H 1 3.35 . . 2 . . . . . . . . 4402 1 1559 . 1 1 160 160 VAL N N 15 124.8 . . 1 . . . . . . . . 4402 1 1560 . 1 1 160 160 VAL H H 1 9.13 . . 1 . . . . . . . . 4402 1 1561 . 1 1 160 160 VAL CA C 13 66.2 . . 1 . . . . . . . . 4402 1 1562 . 1 1 160 160 VAL HA H 1 3.62 . . 1 . . . . . . . . 4402 1 1563 . 1 1 160 160 VAL CB C 13 31.9 . . 1 . . . . . . . . 4402 1 1564 . 1 1 160 160 VAL HB H 1 2.16 . . 1 . . . . . . . . 4402 1 1565 . 1 1 160 160 VAL HG11 H 1 0.95 . . 2 . . . . . . . . 4402 1 1566 . 1 1 160 160 VAL HG12 H 1 0.95 . . 2 . . . . . . . . 4402 1 1567 . 1 1 160 160 VAL HG13 H 1 0.95 . . 2 . . . . . . . . 4402 1 1568 . 1 1 160 160 VAL HG21 H 1 1.07 . . 2 . . . . . . . . 4402 1 1569 . 1 1 160 160 VAL HG22 H 1 1.07 . . 2 . . . . . . . . 4402 1 1570 . 1 1 160 160 VAL HG23 H 1 1.07 . . 2 . . . . . . . . 4402 1 1571 . 1 1 160 160 VAL CG1 C 13 21.8 . . 1 . . . . . . . . 4402 1 1572 . 1 1 160 160 VAL CG2 C 13 23.4 . . 1 . . . . . . . . 4402 1 1573 . 1 1 161 161 ASN N N 15 116.4 . . 1 . . . . . . . . 4402 1 1574 . 1 1 161 161 ASN H H 1 7.66 . . 1 . . . . . . . . 4402 1 1575 . 1 1 161 161 ASN CA C 13 56.4 . . 1 . . . . . . . . 4402 1 1576 . 1 1 161 161 ASN HA H 1 4.30 . . 1 . . . . . . . . 4402 1 1577 . 1 1 161 161 ASN CB C 13 38.6 . . 1 . . . . . . . . 4402 1 1578 . 1 1 161 161 ASN HB2 H 1 2.85 . . 2 . . . . . . . . 4402 1 1579 . 1 1 161 161 ASN HB3 H 1 2.77 . . 2 . . . . . . . . 4402 1 1580 . 1 1 161 161 ASN ND2 N 15 112.0 . . 1 . . . . . . . . 4402 1 1581 . 1 1 161 161 ASN HD21 H 1 7.65 . . 2 . . . . . . . . 4402 1 1582 . 1 1 161 161 ASN HD22 H 1 6.78 . . 2 . . . . . . . . 4402 1 1583 . 1 1 162 162 ILE N N 15 118.7 . . 1 . . . . . . . . 4402 1 1584 . 1 1 162 162 ILE H H 1 8.70 . . 1 . . . . . . . . 4402 1 1585 . 1 1 162 162 ILE CA C 13 62.0 . . 1 . . . . . . . . 4402 1 1586 . 1 1 162 162 ILE HA H 1 3.74 . . 1 . . . . . . . . 4402 1 1587 . 1 1 162 162 ILE CB C 13 36.5 . . 1 . . . . . . . . 4402 1 1588 . 1 1 162 162 ILE HB H 1 1.56 . . 1 . . . . . . . . 4402 1 1589 . 1 1 162 162 ILE HG21 H 1 0.27 . . 1 . . . . . . . . 4402 1 1590 . 1 1 162 162 ILE HG22 H 1 0.27 . . 1 . . . . . . . . 4402 1 1591 . 1 1 162 162 ILE HG23 H 1 0.27 . . 1 . . . . . . . . 4402 1 1592 . 1 1 162 162 ILE CG2 C 13 18.3 . . 1 . . . . . . . . 4402 1 1593 . 1 1 162 162 ILE CG1 C 13 27.4 . . 1 . . . . . . . . 4402 1 1594 . 1 1 162 162 ILE HG12 H 1 0.87 . . 2 . . . . . . . . 4402 1 1595 . 1 1 162 162 ILE HG13 H 1 0.83 . . 2 . . . . . . . . 4402 1 1596 . 1 1 162 162 ILE HD11 H 1 0.40 . . 1 . . . . . . . . 4402 1 1597 . 1 1 162 162 ILE HD12 H 1 0.40 . . 1 . . . . . . . . 4402 1 1598 . 1 1 162 162 ILE HD13 H 1 0.40 . . 1 . . . . . . . . 4402 1 1599 . 1 1 162 162 ILE CD1 C 13 11.4 . . 1 . . . . . . . . 4402 1 1600 . 1 1 163 163 THR N N 15 118.3 . . 1 . . . . . . . . 4402 1 1601 . 1 1 163 163 THR H H 1 8.16 . . 1 . . . . . . . . 4402 1 1602 . 1 1 163 163 THR CA C 13 68.5 . . 1 . . . . . . . . 4402 1 1603 . 1 1 163 163 THR HA H 1 4.04 . . 1 . . . . . . . . 4402 1 1604 . 1 1 163 163 THR CB C 13 67.9 . . 1 . . . . . . . . 4402 1 1605 . 1 1 163 163 THR HB H 1 4.47 . . 1 . . . . . . . . 4402 1 1606 . 1 1 163 163 THR HG21 H 1 1.47 . . 1 . . . . . . . . 4402 1 1607 . 1 1 163 163 THR HG22 H 1 1.47 . . 1 . . . . . . . . 4402 1 1608 . 1 1 163 163 THR HG23 H 1 1.47 . . 1 . . . . . . . . 4402 1 1609 . 1 1 163 163 THR HG1 H 1 6.31 . . 1 . . . . . . . . 4402 1 1610 . 1 1 163 163 THR CG2 C 13 22.0 . . 1 . . . . . . . . 4402 1 1611 . 1 1 164 164 ILE N N 15 120.8 . . 1 . . . . . . . . 4402 1 1612 . 1 1 164 164 ILE H H 1 8.52 . . 1 . . . . . . . . 4402 1 1613 . 1 1 164 164 ILE CA C 13 65.5 . . 1 . . . . . . . . 4402 1 1614 . 1 1 164 164 ILE HA H 1 3.69 . . 1 . . . . . . . . 4402 1 1615 . 1 1 164 164 ILE CB C 13 36.7 . . 1 . . . . . . . . 4402 1 1616 . 1 1 164 164 ILE HB H 1 2.08 . . 1 . . . . . . . . 4402 1 1617 . 1 1 164 164 ILE HG21 H 1 0.86 . . 1 . . . . . . . . 4402 1 1618 . 1 1 164 164 ILE HG22 H 1 0.86 . . 1 . . . . . . . . 4402 1 1619 . 1 1 164 164 ILE HG23 H 1 0.86 . . 1 . . . . . . . . 4402 1 1620 . 1 1 164 164 ILE CG2 C 13 16.7 . . 1 . . . . . . . . 4402 1 1621 . 1 1 164 164 ILE CG1 C 13 29.6 . . 1 . . . . . . . . 4402 1 1622 . 1 1 164 164 ILE HG12 H 1 1.81 . . 2 . . . . . . . . 4402 1 1623 . 1 1 164 164 ILE HG13 H 1 1.20 . . 2 . . . . . . . . 4402 1 1624 . 1 1 164 164 ILE HD11 H 1 0.75 . . 1 . . . . . . . . 4402 1 1625 . 1 1 164 164 ILE HD12 H 1 0.75 . . 1 . . . . . . . . 4402 1 1626 . 1 1 164 164 ILE HD13 H 1 0.75 . . 1 . . . . . . . . 4402 1 1627 . 1 1 164 164 ILE CD1 C 13 12.8 . . 1 . . . . . . . . 4402 1 1628 . 1 1 165 165 LYS N N 15 122.8 . . 1 . . . . . . . . 4402 1 1629 . 1 1 165 165 LYS H H 1 8.03 . . 1 . . . . . . . . 4402 1 1630 . 1 1 165 165 LYS CA C 13 59.6 . . 1 . . . . . . . . 4402 1 1631 . 1 1 165 165 LYS HA H 1 4.04 . . 1 . . . . . . . . 4402 1 1632 . 1 1 165 165 LYS CB C 13 32.1 . . 1 . . . . . . . . 4402 1 1633 . 1 1 165 165 LYS HB2 H 1 1.92 . . 2 . . . . . . . . 4402 1 1634 . 1 1 165 165 LYS HB3 H 1 1.85 . . 2 . . . . . . . . 4402 1 1635 . 1 1 165 165 LYS CG C 13 24.7 . . 1 . . . . . . . . 4402 1 1636 . 1 1 165 165 LYS HG2 H 1 1.46 . . 2 . . . . . . . . 4402 1 1637 . 1 1 165 165 LYS HG3 H 1 1.37 . . 2 . . . . . . . . 4402 1 1638 . 1 1 165 165 LYS CD C 13 28.9 . . 1 . . . . . . . . 4402 1 1639 . 1 1 165 165 LYS HD2 H 1 1.59 . . 1 . . . . . . . . 4402 1 1640 . 1 1 165 165 LYS HD3 H 1 1.59 . . 1 . . . . . . . . 4402 1 1641 . 1 1 165 165 LYS CE C 13 41.7 . . 1 . . . . . . . . 4402 1 1642 . 1 1 165 165 LYS HE2 H 1 2.89 . . 1 . . . . . . . . 4402 1 1643 . 1 1 165 165 LYS HE3 H 1 2.89 . . 1 . . . . . . . . 4402 1 1644 . 1 1 166 166 GLN N N 15 116.4 . . 1 . . . . . . . . 4402 1 1645 . 1 1 166 166 GLN H H 1 8.35 . . 1 . . . . . . . . 4402 1 1646 . 1 1 166 166 GLN CA C 13 57.5 . . 1 . . . . . . . . 4402 1 1647 . 1 1 166 166 GLN HA H 1 4.01 . . 1 . . . . . . . . 4402 1 1648 . 1 1 166 166 GLN CB C 13 28.8 . . 1 . . . . . . . . 4402 1 1649 . 1 1 166 166 GLN HB2 H 1 1.86 . . 2 . . . . . . . . 4402 1 1650 . 1 1 166 166 GLN HB3 H 1 1.97 . . 2 . . . . . . . . 4402 1 1651 . 1 1 166 166 GLN CG C 13 33.3 . . 1 . . . . . . . . 4402 1 1652 . 1 1 166 166 GLN HG2 H 1 2.07 . . 2 . . . . . . . . 4402 1 1653 . 1 1 166 166 GLN HG3 H 1 1.58 . . 2 . . . . . . . . 4402 1 1654 . 1 1 166 166 GLN NE2 N 15 110.1 . . 1 . . . . . . . . 4402 1 1655 . 1 1 166 166 GLN HE21 H 1 6.76 . . 2 . . . . . . . . 4402 1 1656 . 1 1 166 166 GLN HE22 H 1 6.70 . . 2 . . . . . . . . 4402 1 1657 . 1 1 167 167 HIS N N 15 117.8 . . 1 . . . . . . . . 4402 1 1658 . 1 1 167 167 HIS H H 1 8.13 . . 1 . . . . . . . . 4402 1 1659 . 1 1 167 167 HIS CA C 13 58.5 . . 1 . . . . . . . . 4402 1 1660 . 1 1 167 167 HIS HA H 1 4.58 . . 1 . . . . . . . . 4402 1 1661 . 1 1 167 167 HIS CB C 13 29.7 . . 1 . . . . . . . . 4402 1 1662 . 1 1 167 167 HIS HB2 H 1 3.32 . . 2 . . . . . . . . 4402 1 1663 . 1 1 167 167 HIS HB3 H 1 3.27 . . 2 . . . . . . . . 4402 1 1664 . 1 1 167 167 HIS CD2 C 13 118.8 . . 1 . . . . . . . . 4402 1 1665 . 1 1 167 167 HIS HD2 H 1 7.29 . . 1 . . . . . . . . 4402 1 1666 . 1 1 168 168 THR N N 15 113.7 . . 1 . . . . . . . . 4402 1 1667 . 1 1 168 168 THR H H 1 8.22 . . 1 . . . . . . . . 4402 1 1668 . 1 1 168 168 THR CA C 13 65.1 . . 1 . . . . . . . . 4402 1 1669 . 1 1 168 168 THR HA H 1 4.18 . . 1 . . . . . . . . 4402 1 1670 . 1 1 168 168 THR CB C 13 69.0 . . 1 . . . . . . . . 4402 1 1671 . 1 1 168 168 THR HB H 1 4.40 . . 1 . . . . . . . . 4402 1 1672 . 1 1 168 168 THR HG21 H 1 1.22 . . 1 . . . . . . . . 4402 1 1673 . 1 1 168 168 THR HG22 H 1 1.22 . . 1 . . . . . . . . 4402 1 1674 . 1 1 168 168 THR HG23 H 1 1.22 . . 1 . . . . . . . . 4402 1 1675 . 1 1 168 168 THR CG2 C 13 21.2 . . 1 . . . . . . . . 4402 1 1676 . 1 1 169 169 VAL N N 15 122.1 . . 1 . . . . . . . . 4402 1 1677 . 1 1 169 169 VAL H H 1 7.99 . . 1 . . . . . . . . 4402 1 1678 . 1 1 169 169 VAL CA C 13 64.8 . . 1 . . . . . . . . 4402 1 1679 . 1 1 169 169 VAL HA H 1 3.99 . . 1 . . . . . . . . 4402 1 1680 . 1 1 169 169 VAL CB C 13 31.9 . . 1 . . . . . . . . 4402 1 1681 . 1 1 169 169 VAL HB H 1 2.20 . . 1 . . . . . . . . 4402 1 1682 . 1 1 169 169 VAL HG11 H 1 0.94 . . 2 . . . . . . . . 4402 1 1683 . 1 1 169 169 VAL HG12 H 1 0.94 . . 2 . . . . . . . . 4402 1 1684 . 1 1 169 169 VAL HG13 H 1 0.94 . . 2 . . . . . . . . 4402 1 1685 . 1 1 169 169 VAL HG21 H 1 1.01 . . 2 . . . . . . . . 4402 1 1686 . 1 1 169 169 VAL HG22 H 1 1.01 . . 2 . . . . . . . . 4402 1 1687 . 1 1 169 169 VAL HG23 H 1 1.01 . . 2 . . . . . . . . 4402 1 1688 . 1 1 169 169 VAL CG1 C 13 20.9 . . 1 . . . . . . . . 4402 1 1689 . 1 1 169 169 VAL CG2 C 13 21.4 . . 1 . . . . . . . . 4402 1 1690 . 1 1 170 170 THR N N 15 115.2 . . 1 . . . . . . . . 4402 1 1691 . 1 1 170 170 THR H H 1 8.07 . . 1 . . . . . . . . 4402 1 1692 . 1 1 170 170 THR CA C 13 63.9 . . 1 . . . . . . . . 4402 1 1693 . 1 1 170 170 THR HA H 1 4.22 . . 1 . . . . . . . . 4402 1 1694 . 1 1 170 170 THR CB C 13 69.0 . . 1 . . . . . . . . 4402 1 1695 . 1 1 170 170 THR HB H 1 4.26 . . 1 . . . . . . . . 4402 1 1696 . 1 1 170 170 THR HG21 H 1 1.26 . . 1 . . . . . . . . 4402 1 1697 . 1 1 170 170 THR HG22 H 1 1.26 . . 1 . . . . . . . . 4402 1 1698 . 1 1 170 170 THR HG23 H 1 1.26 . . 1 . . . . . . . . 4402 1 1699 . 1 1 170 170 THR CG2 C 13 21.5 . . 1 . . . . . . . . 4402 1 1700 . 1 1 171 171 THR N N 15 114.9 . . 1 . . . . . . . . 4402 1 1701 . 1 1 171 171 THR H H 1 8.00 . . 1 . . . . . . . . 4402 1 1702 . 1 1 171 171 THR CA C 13 63.7 . . 1 . . . . . . . . 4402 1 1703 . 1 1 171 171 THR HA H 1 4.20 . . 1 . . . . . . . . 4402 1 1704 . 1 1 171 171 THR CB C 13 68.9 . . 1 . . . . . . . . 4402 1 1705 . 1 1 171 171 THR HB H 1 4.16 . . 1 . . . . . . . . 4402 1 1706 . 1 1 171 171 THR HG21 H 1 1.01 . . 1 . . . . . . . . 4402 1 1707 . 1 1 171 171 THR HG22 H 1 1.01 . . 1 . . . . . . . . 4402 1 1708 . 1 1 171 171 THR HG23 H 1 1.01 . . 1 . . . . . . . . 4402 1 1709 . 1 1 171 171 THR CG2 C 13 21.4 . . 1 . . . . . . . . 4402 1 1710 . 1 1 172 172 THR N N 15 116.6 . . 1 . . . . . . . . 4402 1 1711 . 1 1 172 172 THR H H 1 8.18 . . 1 . . . . . . . . 4402 1 1712 . 1 1 172 172 THR CA C 13 63.9 . . 1 . . . . . . . . 4402 1 1713 . 1 1 172 172 THR HA H 1 4.38 . . 1 . . . . . . . . 4402 1 1714 . 1 1 172 172 THR CB C 13 69.0 . . 1 . . . . . . . . 4402 1 1715 . 1 1 172 172 THR HB H 1 4.35 . . 1 . . . . . . . . 4402 1 1716 . 1 1 172 172 THR HG21 H 1 1.27 . . 1 . . . . . . . . 4402 1 1717 . 1 1 172 172 THR HG22 H 1 1.27 . . 1 . . . . . . . . 4402 1 1718 . 1 1 172 172 THR HG23 H 1 1.27 . . 1 . . . . . . . . 4402 1 1719 . 1 1 172 172 THR CG2 C 13 21.5 . . 1 . . . . . . . . 4402 1 1720 . 1 1 173 173 THR N N 15 116.1 . . 1 . . . . . . . . 4402 1 1721 . 1 1 173 173 THR H H 1 7.93 . . 1 . . . . . . . . 4402 1 1722 . 1 1 173 173 THR CA C 13 63.6 . . 1 . . . . . . . . 4402 1 1723 . 1 1 173 173 THR HA H 1 4.23 . . 1 . . . . . . . . 4402 1 1724 . 1 1 173 173 THR CB C 13 69.0 . . 1 . . . . . . . . 4402 1 1725 . 1 1 173 173 THR HB H 1 4.28 . . 1 . . . . . . . . 4402 1 1726 . 1 1 173 173 THR HG21 H 1 1.25 . . 1 . . . . . . . . 4402 1 1727 . 1 1 173 173 THR HG22 H 1 1.25 . . 1 . . . . . . . . 4402 1 1728 . 1 1 173 173 THR HG23 H 1 1.25 . . 1 . . . . . . . . 4402 1 1729 . 1 1 173 173 THR CG2 C 13 21.5 . . 1 . . . . . . . . 4402 1 1730 . 1 1 174 174 LYS N N 15 121.3 . . 1 . . . . . . . . 4402 1 1731 . 1 1 174 174 LYS H H 1 7.86 . . 1 . . . . . . . . 4402 1 1732 . 1 1 174 174 LYS CA C 13 56.3 . . 1 . . . . . . . . 4402 1 1733 . 1 1 174 174 LYS HA H 1 4.33 . . 1 . . . . . . . . 4402 1 1734 . 1 1 174 174 LYS CB C 13 32.2 . . 1 . . . . . . . . 4402 1 1735 . 1 1 174 174 LYS HB2 H 1 1.82 . . 2 . . . . . . . . 4402 1 1736 . 1 1 174 174 LYS HB3 H 1 1.94 . . 2 . . . . . . . . 4402 1 1737 . 1 1 174 174 LYS CG C 13 24.9 . . 1 . . . . . . . . 4402 1 1738 . 1 1 174 174 LYS HG2 H 1 1.43 . . 2 . . . . . . . . 4402 1 1739 . 1 1 174 174 LYS HG3 H 1 1.49 . . 2 . . . . . . . . 4402 1 1740 . 1 1 174 174 LYS CD C 13 28.9 . . 1 . . . . . . . . 4402 1 1741 . 1 1 174 174 LYS HD2 H 1 1.65 . . 1 . . . . . . . . 4402 1 1742 . 1 1 174 174 LYS HD3 H 1 1.65 . . 1 . . . . . . . . 4402 1 1743 . 1 1 174 174 LYS CE C 13 41.7 . . 1 . . . . . . . . 4402 1 1744 . 1 1 174 174 LYS HE2 H 1 2.96 . . 1 . . . . . . . . 4402 1 1745 . 1 1 174 174 LYS HE3 H 1 2.96 . . 1 . . . . . . . . 4402 1 1746 . 1 1 175 175 GLY N N 15 109.1 . . 1 . . . . . . . . 4402 1 1747 . 1 1 175 175 GLY H H 1 8.13 . . 1 . . . . . . . . 4402 1 1748 . 1 1 175 175 GLY CA C 13 45.4 . . 1 . . . . . . . . 4402 1 1749 . 1 1 175 175 GLY HA2 H 1 4.05 . . 2 . . . . . . . . 4402 1 1750 . 1 1 175 175 GLY HA3 H 1 3.83 . . 2 . . . . . . . . 4402 1 1751 . 1 1 176 176 GLU N N 15 120.0 . . 1 . . . . . . . . 4402 1 1752 . 1 1 176 176 GLU H H 1 7.72 . . 1 . . . . . . . . 4402 1 1753 . 1 1 176 176 GLU CA C 13 55.6 . . 1 . . . . . . . . 4402 1 1754 . 1 1 176 176 GLU HA H 1 4.24 . . 1 . . . . . . . . 4402 1 1755 . 1 1 176 176 GLU CB C 13 30.5 . . 1 . . . . . . . . 4402 1 1756 . 1 1 176 176 GLU HB2 H 1 1.65 . . 1 . . . . . . . . 4402 1 1757 . 1 1 176 176 GLU HB3 H 1 1.65 . . 1 . . . . . . . . 4402 1 1758 . 1 1 176 176 GLU CG C 13 35.3 . . 1 . . . . . . . . 4402 1 1759 . 1 1 176 176 GLU HG2 H 1 2.10 . . 1 . . . . . . . . 4402 1 1760 . 1 1 176 176 GLU HG3 H 1 2.10 . . 1 . . . . . . . . 4402 1 1761 . 1 1 177 177 ASN N N 15 119.7 . . 1 . . . . . . . . 4402 1 1762 . 1 1 177 177 ASN H H 1 8.45 . . 1 . . . . . . . . 4402 1 1763 . 1 1 177 177 ASN CA C 13 52.7 . . 1 . . . . . . . . 4402 1 1764 . 1 1 177 177 ASN HA H 1 4.65 . . 1 . . . . . . . . 4402 1 1765 . 1 1 177 177 ASN CB C 13 40.0 . . 1 . . . . . . . . 4402 1 1766 . 1 1 177 177 ASN HB2 H 1 2.68 . . 2 . . . . . . . . 4402 1 1767 . 1 1 177 177 ASN HB3 H 1 2.60 . . 2 . . . . . . . . 4402 1 1768 . 1 1 177 177 ASN ND2 N 15 113.0 . . 1 . . . . . . . . 4402 1 1769 . 1 1 177 177 ASN HD21 H 1 7.53 . . 2 . . . . . . . . 4402 1 1770 . 1 1 177 177 ASN HD22 H 1 6.82 . . 2 . . . . . . . . 4402 1 1771 . 1 1 178 178 PHE N N 15 121.9 . . 1 . . . . . . . . 4402 1 1772 . 1 1 178 178 PHE H H 1 8.66 . . 1 . . . . . . . . 4402 1 1773 . 1 1 178 178 PHE CA C 13 56.5 . . 1 . . . . . . . . 4402 1 1774 . 1 1 178 178 PHE HA H 1 5.26 . . 1 . . . . . . . . 4402 1 1775 . 1 1 178 178 PHE CB C 13 39.9 . . 1 . . . . . . . . 4402 1 1776 . 1 1 178 178 PHE HB2 H 1 2.96 . . 2 . . . . . . . . 4402 1 1777 . 1 1 178 178 PHE HB3 H 1 3.14 . . 2 . . . . . . . . 4402 1 1778 . 1 1 178 178 PHE HD1 H 1 7.34 . . 1 . . . . . . . . 4402 1 1779 . 1 1 178 178 PHE HD2 H 1 7.34 . . 1 . . . . . . . . 4402 1 1780 . 1 1 178 178 PHE HE1 H 1 7.44 . . 1 . . . . . . . . 4402 1 1781 . 1 1 178 178 PHE HE2 H 1 7.44 . . 1 . . . . . . . . 4402 1 1782 . 1 1 178 178 PHE CD1 C 13 131.4 . . 1 . . . . . . . . 4402 1 1783 . 1 1 178 178 PHE CE1 C 13 129.9 . . 1 . . . . . . . . 4402 1 1784 . 1 1 179 179 THR N N 15 116.3 . . 1 . . . . . . . . 4402 1 1785 . 1 1 179 179 THR H H 1 9.49 . . 1 . . . . . . . . 4402 1 1786 . 1 1 179 179 THR CA C 13 60.3 . . 1 . . . . . . . . 4402 1 1787 . 1 1 179 179 THR HA H 1 4.61 . . 1 . . . . . . . . 4402 1 1788 . 1 1 179 179 THR CB C 13 71.9 . . 1 . . . . . . . . 4402 1 1789 . 1 1 179 179 THR HB H 1 4.80 . . 1 . . . . . . . . 4402 1 1790 . 1 1 179 179 THR HG21 H 1 1.41 . . 1 . . . . . . . . 4402 1 1791 . 1 1 179 179 THR HG22 H 1 1.41 . . 1 . . . . . . . . 4402 1 1792 . 1 1 179 179 THR HG23 H 1 1.41 . . 1 . . . . . . . . 4402 1 1793 . 1 1 179 179 THR CG2 C 13 21.5 . . 1 . . . . . . . . 4402 1 1794 . 1 1 180 180 GLU N N 15 120.0 . . 1 . . . . . . . . 4402 1 1795 . 1 1 180 180 GLU H H 1 9.11 . . 1 . . . . . . . . 4402 1 1796 . 1 1 180 180 GLU CA C 13 59.4 . . 1 . . . . . . . . 4402 1 1797 . 1 1 180 180 GLU HA H 1 4.07 . . 1 . . . . . . . . 4402 1 1798 . 1 1 180 180 GLU CB C 13 28.5 . . 1 . . . . . . . . 4402 1 1799 . 1 1 180 180 GLU HB2 H 1 2.12 . . 2 . . . . . . . . 4402 1 1800 . 1 1 180 180 GLU HB3 H 1 2.06 . . 2 . . . . . . . . 4402 1 1801 . 1 1 180 180 GLU CG C 13 35.2 . . 1 . . . . . . . . 4402 1 1802 . 1 1 180 180 GLU HG2 H 1 2.36 . . 2 . . . . . . . . 4402 1 1803 . 1 1 180 180 GLU HG3 H 1 2.42 . . 2 . . . . . . . . 4402 1 1804 . 1 1 181 181 THR N N 15 116.3 . . 1 . . . . . . . . 4402 1 1805 . 1 1 181 181 THR H H 1 7.95 . . 1 . . . . . . . . 4402 1 1806 . 1 1 181 181 THR CA C 13 66.6 . . 1 . . . . . . . . 4402 1 1807 . 1 1 181 181 THR HA H 1 3.77 . . 1 . . . . . . . . 4402 1 1808 . 1 1 181 181 THR CB C 13 68.4 . . 1 . . . . . . . . 4402 1 1809 . 1 1 181 181 THR HB H 1 3.70 . . 1 . . . . . . . . 4402 1 1810 . 1 1 181 181 THR HG21 H 1 0.70 . . 1 . . . . . . . . 4402 1 1811 . 1 1 181 181 THR HG22 H 1 0.70 . . 1 . . . . . . . . 4402 1 1812 . 1 1 181 181 THR HG23 H 1 0.70 . . 1 . . . . . . . . 4402 1 1813 . 1 1 181 181 THR CG2 C 13 20.9 . . 1 . . . . . . . . 4402 1 1814 . 1 1 182 182 ASP N N 15 120.1 . . 1 . . . . . . . . 4402 1 1815 . 1 1 182 182 ASP H H 1 7.49 . . 1 . . . . . . . . 4402 1 1816 . 1 1 182 182 ASP CA C 13 57.7 . . 1 . . . . . . . . 4402 1 1817 . 1 1 182 182 ASP HA H 1 4.57 . . 1 . . . . . . . . 4402 1 1818 . 1 1 182 182 ASP CB C 13 41.4 . . 1 . . . . . . . . 4402 1 1819 . 1 1 182 182 ASP HB2 H 1 3.32 . . 2 . . . . . . . . 4402 1 1820 . 1 1 182 182 ASP HB3 H 1 2.56 . . 2 . . . . . . . . 4402 1 1821 . 1 1 183 183 VAL N N 15 119.7 . . 1 . . . . . . . . 4402 1 1822 . 1 1 183 183 VAL H H 1 8.23 . . 1 . . . . . . . . 4402 1 1823 . 1 1 183 183 VAL CA C 13 67.6 . . 1 . . . . . . . . 4402 1 1824 . 1 1 183 183 VAL HA H 1 3.29 . . 1 . . . . . . . . 4402 1 1825 . 1 1 183 183 VAL CB C 13 31.4 . . 1 . . . . . . . . 4402 1 1826 . 1 1 183 183 VAL HB H 1 2.11 . . 1 . . . . . . . . 4402 1 1827 . 1 1 183 183 VAL HG11 H 1 0.88 . . 2 . . . . . . . . 4402 1 1828 . 1 1 183 183 VAL HG12 H 1 0.88 . . 2 . . . . . . . . 4402 1 1829 . 1 1 183 183 VAL HG13 H 1 0.88 . . 2 . . . . . . . . 4402 1 1830 . 1 1 183 183 VAL HG21 H 1 0.98 . . 2 . . . . . . . . 4402 1 1831 . 1 1 183 183 VAL HG22 H 1 0.98 . . 2 . . . . . . . . 4402 1 1832 . 1 1 183 183 VAL HG23 H 1 0.98 . . 2 . . . . . . . . 4402 1 1833 . 1 1 183 183 VAL CG1 C 13 21.0 . . 1 . . . . . . . . 4402 1 1834 . 1 1 183 183 VAL CG2 C 13 22.6 . . 1 . . . . . . . . 4402 1 1835 . 1 1 184 184 LYS N N 15 119.2 . . 1 . . . . . . . . 4402 1 1836 . 1 1 184 184 LYS H H 1 7.74 . . 1 . . . . . . . . 4402 1 1837 . 1 1 184 184 LYS CA C 13 59.1 . . 1 . . . . . . . . 4402 1 1838 . 1 1 184 184 LYS HA H 1 4.05 . . 1 . . . . . . . . 4402 1 1839 . 1 1 184 184 LYS CB C 13 31.9 . . 1 . . . . . . . . 4402 1 1840 . 1 1 184 184 LYS HB2 H 1 1.92 . . 2 . . . . . . . . 4402 1 1841 . 1 1 184 184 LYS HB3 H 1 1.91 . . 2 . . . . . . . . 4402 1 1842 . 1 1 184 184 LYS CG C 13 25.0 . . 1 . . . . . . . . 4402 1 1843 . 1 1 184 184 LYS HG2 H 1 1.43 . . 2 . . . . . . . . 4402 1 1844 . 1 1 184 184 LYS HG3 H 1 1.66 . . 2 . . . . . . . . 4402 1 1845 . 1 1 184 184 LYS CD C 13 28.9 . . 1 . . . . . . . . 4402 1 1846 . 1 1 184 184 LYS HD2 H 1 1.67 . . 1 . . . . . . . . 4402 1 1847 . 1 1 184 184 LYS HD3 H 1 1.67 . . 1 . . . . . . . . 4402 1 1848 . 1 1 184 184 LYS CE C 13 41.7 . . 1 . . . . . . . . 4402 1 1849 . 1 1 184 184 LYS HE2 H 1 2.91 . . 1 . . . . . . . . 4402 1 1850 . 1 1 184 184 LYS HE3 H 1 2.91 . . 1 . . . . . . . . 4402 1 1851 . 1 1 185 185 MET N N 15 118.7 . . 1 . . . . . . . . 4402 1 1852 . 1 1 185 185 MET H H 1 8.22 . . 1 . . . . . . . . 4402 1 1853 . 1 1 185 185 MET CA C 13 60.0 . . 1 . . . . . . . . 4402 1 1854 . 1 1 185 185 MET HA H 1 4.13 . . 1 . . . . . . . . 4402 1 1855 . 1 1 185 185 MET CB C 13 32.3 . . 1 . . . . . . . . 4402 1 1856 . 1 1 185 185 MET HB2 H 1 2.30 . . 2 . . . . . . . . 4402 1 1857 . 1 1 185 185 MET HB3 H 1 1.95 . . 2 . . . . . . . . 4402 1 1858 . 1 1 185 185 MET CG C 13 34.0 . . 1 . . . . . . . . 4402 1 1859 . 1 1 185 185 MET HG2 H 1 2.14 . . 2 . . . . . . . . 4402 1 1860 . 1 1 185 185 MET HG3 H 1 2.93 . . 2 . . . . . . . . 4402 1 1861 . 1 1 185 185 MET HE1 H 1 1.46 . . 1 . . . . . . . . 4402 1 1862 . 1 1 185 185 MET HE2 H 1 1.46 . . 1 . . . . . . . . 4402 1 1863 . 1 1 185 185 MET HE3 H 1 1.46 . . 1 . . . . . . . . 4402 1 1864 . 1 1 185 185 MET CE C 13 18.1 . . 1 . . . . . . . . 4402 1 1865 . 1 1 186 186 MET N N 15 118.5 . . 1 . . . . . . . . 4402 1 1866 . 1 1 186 186 MET H H 1 8.75 . . 1 . . . . . . . . 4402 1 1867 . 1 1 186 186 MET CA C 13 59.5 . . 1 . . . . . . . . 4402 1 1868 . 1 1 186 186 MET HA H 1 3.56 . . 1 . . . . . . . . 4402 1 1869 . 1 1 186 186 MET CB C 13 33.2 . . 1 . . . . . . . . 4402 1 1870 . 1 1 186 186 MET HB2 H 1 1.91 . . 2 . . . . . . . . 4402 1 1871 . 1 1 186 186 MET HB3 H 1 1.67 . . 2 . . . . . . . . 4402 1 1872 . 1 1 186 186 MET CG C 13 32.2 . . 1 . . . . . . . . 4402 1 1873 . 1 1 186 186 MET HG2 H 1 1.66 . . 2 . . . . . . . . 4402 1 1874 . 1 1 186 186 MET HG3 H 1 1.93 . . 2 . . . . . . . . 4402 1 1875 . 1 1 186 186 MET HE1 H 1 1.38 . . 1 . . . . . . . . 4402 1 1876 . 1 1 186 186 MET HE2 H 1 1.38 . . 1 . . . . . . . . 4402 1 1877 . 1 1 186 186 MET HE3 H 1 1.38 . . 1 . . . . . . . . 4402 1 1878 . 1 1 186 186 MET CE C 13 15.9 . . 1 . . . . . . . . 4402 1 1879 . 1 1 187 187 GLU N N 15 118.5 . . 1 . . . . . . . . 4402 1 1880 . 1 1 187 187 GLU H H 1 8.41 . . 1 . . . . . . . . 4402 1 1881 . 1 1 187 187 GLU CA C 13 60.3 . . 1 . . . . . . . . 4402 1 1882 . 1 1 187 187 GLU HA H 1 3.66 . . 1 . . . . . . . . 4402 1 1883 . 1 1 187 187 GLU CB C 13 27.9 . . 1 . . . . . . . . 4402 1 1884 . 1 1 187 187 GLU HB2 H 1 2.04 . . 2 . . . . . . . . 4402 1 1885 . 1 1 187 187 GLU HB3 H 1 2.22 . . 2 . . . . . . . . 4402 1 1886 . 1 1 187 187 GLU CG C 13 35.0 . . 1 . . . . . . . . 4402 1 1887 . 1 1 187 187 GLU HG2 H 1 2.21 . . 2 . . . . . . . . 4402 1 1888 . 1 1 187 187 GLU HG3 H 1 2.56 . . 2 . . . . . . . . 4402 1 1889 . 1 1 188 188 ARG N N 15 117.1 . . 1 . . . . . . . . 4402 1 1890 . 1 1 188 188 ARG H H 1 7.31 . . 1 . . . . . . . . 4402 1 1891 . 1 1 188 188 ARG CA C 13 58.2 . . 1 . . . . . . . . 4402 1 1892 . 1 1 188 188 ARG HA H 1 4.19 . . 1 . . . . . . . . 4402 1 1893 . 1 1 188 188 ARG CB C 13 29.8 . . 1 . . . . . . . . 4402 1 1894 . 1 1 188 188 ARG HB2 H 1 2.09 . . 2 . . . . . . . . 4402 1 1895 . 1 1 188 188 ARG HB3 H 1 1.94 . . 2 . . . . . . . . 4402 1 1896 . 1 1 188 188 ARG CG C 13 26.8 . . 1 . . . . . . . . 4402 1 1897 . 1 1 188 188 ARG HG2 H 1 1.75 . . 2 . . . . . . . . 4402 1 1898 . 1 1 188 188 ARG HG3 H 1 1.83 . . 2 . . . . . . . . 4402 1 1899 . 1 1 188 188 ARG CD C 13 42.3 . . 1 . . . . . . . . 4402 1 1900 . 1 1 188 188 ARG HD2 H 1 3.24 . . 2 . . . . . . . . 4402 1 1901 . 1 1 188 188 ARG HD3 H 1 3.14 . . 2 . . . . . . . . 4402 1 1902 . 1 1 188 188 ARG NE N 15 83.3 . . 1 . . . . . . . . 4402 1 1903 . 1 1 188 188 ARG HE H 1 7.27 . . 1 . . . . . . . . 4402 1 1904 . 1 1 189 189 VAL N N 15 119.2 . . 1 . . . . . . . . 4402 1 1905 . 1 1 189 189 VAL H H 1 8.27 . . 1 . . . . . . . . 4402 1 1906 . 1 1 189 189 VAL CA C 13 65.6 . . 1 . . . . . . . . 4402 1 1907 . 1 1 189 189 VAL HA H 1 3.79 . . 1 . . . . . . . . 4402 1 1908 . 1 1 189 189 VAL CB C 13 32.1 . . 1 . . . . . . . . 4402 1 1909 . 1 1 189 189 VAL HB H 1 2.33 . . 1 . . . . . . . . 4402 1 1910 . 1 1 189 189 VAL HG11 H 1 1.27 . . 2 . . . . . . . . 4402 1 1911 . 1 1 189 189 VAL HG12 H 1 1.27 . . 2 . . . . . . . . 4402 1 1912 . 1 1 189 189 VAL HG13 H 1 1.27 . . 2 . . . . . . . . 4402 1 1913 . 1 1 189 189 VAL HG21 H 1 1.31 . . 2 . . . . . . . . 4402 1 1914 . 1 1 189 189 VAL HG22 H 1 1.31 . . 2 . . . . . . . . 4402 1 1915 . 1 1 189 189 VAL HG23 H 1 1.31 . . 2 . . . . . . . . 4402 1 1916 . 1 1 189 189 VAL CG1 C 13 20.8 . . 1 . . . . . . . . 4402 1 1917 . 1 1 189 189 VAL CG2 C 13 23.9 . . 1 . . . . . . . . 4402 1 1918 . 1 1 190 190 VAL N N 15 121.3 . . 1 . . . . . . . . 4402 1 1919 . 1 1 190 190 VAL H H 1 9.05 . . 1 . . . . . . . . 4402 1 1920 . 1 1 190 190 VAL CA C 13 66.0 . . 1 . . . . . . . . 4402 1 1921 . 1 1 190 190 VAL HA H 1 3.63 . . 1 . . . . . . . . 4402 1 1922 . 1 1 190 190 VAL CB C 13 31.0 . . 1 . . . . . . . . 4402 1 1923 . 1 1 190 190 VAL HB H 1 2.26 . . 1 . . . . . . . . 4402 1 1924 . 1 1 190 190 VAL HG11 H 1 1.21 . . 2 . . . . . . . . 4402 1 1925 . 1 1 190 190 VAL HG12 H 1 1.21 . . 2 . . . . . . . . 4402 1 1926 . 1 1 190 190 VAL HG13 H 1 1.21 . . 2 . . . . . . . . 4402 1 1927 . 1 1 190 190 VAL HG21 H 1 0.94 . . 2 . . . . . . . . 4402 1 1928 . 1 1 190 190 VAL HG22 H 1 0.94 . . 2 . . . . . . . . 4402 1 1929 . 1 1 190 190 VAL HG23 H 1 0.94 . . 2 . . . . . . . . 4402 1 1930 . 1 1 190 190 VAL CG1 C 13 24.5 . . 1 . . . . . . . . 4402 1 1931 . 1 1 190 190 VAL CG2 C 13 24.1 . . 1 . . . . . . . . 4402 1 1932 . 1 1 191 191 GLU N N 15 120.5 . . 1 . . . . . . . . 4402 1 1933 . 1 1 191 191 GLU H H 1 8.06 . . 1 . . . . . . . . 4402 1 1934 . 1 1 191 191 GLU CA C 13 60.8 . . 1 . . . . . . . . 4402 1 1935 . 1 1 191 191 GLU HA H 1 3.59 . . 1 . . . . . . . . 4402 1 1936 . 1 1 191 191 GLU CB C 13 28.8 . . 1 . . . . . . . . 4402 1 1937 . 1 1 191 191 GLU HB2 H 1 2.15 . . 2 . . . . . . . . 4402 1 1938 . 1 1 191 191 GLU HB3 H 1 2.21 . . 2 . . . . . . . . 4402 1 1939 . 1 1 191 191 GLU CG C 13 35.5 . . 1 . . . . . . . . 4402 1 1940 . 1 1 191 191 GLU HG2 H 1 2.15 . . 1 . . . . . . . . 4402 1 1941 . 1 1 191 191 GLU HG3 H 1 2.15 . . 1 . . . . . . . . 4402 1 1942 . 1 1 192 192 GLN N N 15 114.8 . . 1 . . . . . . . . 4402 1 1943 . 1 1 192 192 GLN H H 1 7.18 . . 1 . . . . . . . . 4402 1 1944 . 1 1 192 192 GLN CA C 13 58.7 . . 1 . . . . . . . . 4402 1 1945 . 1 1 192 192 GLN HA H 1 3.97 . . 1 . . . . . . . . 4402 1 1946 . 1 1 192 192 GLN CB C 13 27.7 . . 1 . . . . . . . . 4402 1 1947 . 1 1 192 192 GLN HB2 H 1 2.12 . . 2 . . . . . . . . 4402 1 1948 . 1 1 192 192 GLN HB3 H 1 2.20 . . 2 . . . . . . . . 4402 1 1949 . 1 1 192 192 GLN CG C 13 33.6 . . 1 . . . . . . . . 4402 1 1950 . 1 1 192 192 GLN HG2 H 1 2.44 . . 2 . . . . . . . . 4402 1 1951 . 1 1 192 192 GLN HG3 H 1 2.42 . . 2 . . . . . . . . 4402 1 1952 . 1 1 192 192 GLN NE2 N 15 113.1 . . 1 . . . . . . . . 4402 1 1953 . 1 1 192 192 GLN HE21 H 1 7.54 . . 2 . . . . . . . . 4402 1 1954 . 1 1 192 192 GLN HE22 H 1 6.89 . . 2 . . . . . . . . 4402 1 1955 . 1 1 193 193 MET N N 15 119.4 . . 1 . . . . . . . . 4402 1 1956 . 1 1 193 193 MET H H 1 8.27 . . 1 . . . . . . . . 4402 1 1957 . 1 1 193 193 MET CA C 13 59.7 . . 1 . . . . . . . . 4402 1 1958 . 1 1 193 193 MET HA H 1 4.15 . . 1 . . . . . . . . 4402 1 1959 . 1 1 193 193 MET CB C 13 34.1 . . 1 . . . . . . . . 4402 1 1960 . 1 1 193 193 MET HB2 H 1 2.15 . . 1 . . . . . . . . 4402 1 1961 . 1 1 193 193 MET HB3 H 1 2.15 . . 1 . . . . . . . . 4402 1 1962 . 1 1 193 193 MET CG C 13 32.2 . . 1 . . . . . . . . 4402 1 1963 . 1 1 193 193 MET HG2 H 1 2.48 . . 2 . . . . . . . . 4402 1 1964 . 1 1 193 193 MET HG3 H 1 2.82 . . 2 . . . . . . . . 4402 1 1965 . 1 1 193 193 MET HE1 H 1 1.88 . . 1 . . . . . . . . 4402 1 1966 . 1 1 193 193 MET HE2 H 1 1.88 . . 1 . . . . . . . . 4402 1 1967 . 1 1 193 193 MET HE3 H 1 1.88 . . 1 . . . . . . . . 4402 1 1968 . 1 1 193 193 MET CE C 13 16.4 . . 1 . . . . . . . . 4402 1 1969 . 1 1 194 194 CYS N N 15 119.4 . . 1 . . . . . . . . 4402 1 1970 . 1 1 194 194 CYS H H 1 9.20 . . 1 . . . . . . . . 4402 1 1971 . 1 1 194 194 CYS CA C 13 59.7 . . 1 . . . . . . . . 4402 1 1972 . 1 1 194 194 CYS HA H 1 4.41 . . 1 . . . . . . . . 4402 1 1973 . 1 1 194 194 CYS CB C 13 41.7 . . 1 . . . . . . . . 4402 1 1974 . 1 1 194 194 CYS HB2 H 1 2.88 . . 2 . . . . . . . . 4402 1 1975 . 1 1 194 194 CYS HB3 H 1 3.51 . . 2 . . . . . . . . 4402 1 1976 . 1 1 195 195 ILE N N 15 123.8 . . 1 . . . . . . . . 4402 1 1977 . 1 1 195 195 ILE H H 1 8.25 . . 1 . . . . . . . . 4402 1 1978 . 1 1 195 195 ILE CA C 13 66.4 . . 1 . . . . . . . . 4402 1 1979 . 1 1 195 195 ILE HA H 1 3.57 . . 1 . . . . . . . . 4402 1 1980 . 1 1 195 195 ILE CB C 13 37.8 . . 1 . . . . . . . . 4402 1 1981 . 1 1 195 195 ILE HB H 1 2.01 . . 1 . . . . . . . . 4402 1 1982 . 1 1 195 195 ILE HG21 H 1 0.88 . . 1 . . . . . . . . 4402 1 1983 . 1 1 195 195 ILE HG22 H 1 0.88 . . 1 . . . . . . . . 4402 1 1984 . 1 1 195 195 ILE HG23 H 1 0.88 . . 1 . . . . . . . . 4402 1 1985 . 1 1 195 195 ILE CG2 C 13 17.0 . . 1 . . . . . . . . 4402 1 1986 . 1 1 195 195 ILE CG1 C 13 30.7 . . 1 . . . . . . . . 4402 1 1987 . 1 1 195 195 ILE HG12 H 1 1.97 . . 2 . . . . . . . . 4402 1 1988 . 1 1 195 195 ILE HG13 H 1 0.83 . . 2 . . . . . . . . 4402 1 1989 . 1 1 195 195 ILE HD11 H 1 0.83 . . 1 . . . . . . . . 4402 1 1990 . 1 1 195 195 ILE HD12 H 1 0.83 . . 1 . . . . . . . . 4402 1 1991 . 1 1 195 195 ILE HD13 H 1 0.83 . . 1 . . . . . . . . 4402 1 1992 . 1 1 195 195 ILE CD1 C 13 13.9 . . 1 . . . . . . . . 4402 1 1993 . 1 1 196 196 THR N N 15 118.6 . . 1 . . . . . . . . 4402 1 1994 . 1 1 196 196 THR H H 1 8.11 . . 1 . . . . . . . . 4402 1 1995 . 1 1 196 196 THR CA C 13 66.7 . . 1 . . . . . . . . 4402 1 1996 . 1 1 196 196 THR HA H 1 3.93 . . 1 . . . . . . . . 4402 1 1997 . 1 1 196 196 THR CB C 13 68.0 . . 1 . . . . . . . . 4402 1 1998 . 1 1 196 196 THR HB H 1 4.31 . . 1 . . . . . . . . 4402 1 1999 . 1 1 196 196 THR HG21 H 1 1.22 . . 1 . . . . . . . . 4402 1 2000 . 1 1 196 196 THR HG22 H 1 1.22 . . 1 . . . . . . . . 4402 1 2001 . 1 1 196 196 THR HG23 H 1 1.22 . . 1 . . . . . . . . 4402 1 2002 . 1 1 196 196 THR CG2 C 13 21.8 . . 1 . . . . . . . . 4402 1 2003 . 1 1 197 197 GLN N N 15 122.4 . . 1 . . . . . . . . 4402 1 2004 . 1 1 197 197 GLN H H 1 8.76 . . 1 . . . . . . . . 4402 1 2005 . 1 1 197 197 GLN CA C 13 58.3 . . 1 . . . . . . . . 4402 1 2006 . 1 1 197 197 GLN HA H 1 3.63 . . 1 . . . . . . . . 4402 1 2007 . 1 1 197 197 GLN CB C 13 27.9 . . 1 . . . . . . . . 4402 1 2008 . 1 1 197 197 GLN HB2 H 1 2.28 . . 2 . . . . . . . . 4402 1 2009 . 1 1 197 197 GLN HB3 H 1 2.08 . . 2 . . . . . . . . 4402 1 2010 . 1 1 197 197 GLN CG C 13 32.8 . . 1 . . . . . . . . 4402 1 2011 . 1 1 197 197 GLN HG2 H 1 1.74 . . 2 . . . . . . . . 4402 1 2012 . 1 1 197 197 GLN HG3 H 1 1.70 . . 2 . . . . . . . . 4402 1 2013 . 1 1 197 197 GLN NE2 N 15 115.7 . . 1 . . . . . . . . 4402 1 2014 . 1 1 197 197 GLN HE21 H 1 7.31 . . 2 . . . . . . . . 4402 1 2015 . 1 1 197 197 GLN HE22 H 1 6.73 . . 2 . . . . . . . . 4402 1 2016 . 1 1 198 198 TYR N N 15 121.3 . . 1 . . . . . . . . 4402 1 2017 . 1 1 198 198 TYR H H 1 8.54 . . 1 . . . . . . . . 4402 1 2018 . 1 1 198 198 TYR CA C 13 62.0 . . 1 . . . . . . . . 4402 1 2019 . 1 1 198 198 TYR HA H 1 2.95 . . 1 . . . . . . . . 4402 1 2020 . 1 1 198 198 TYR CB C 13 36.9 . . 1 . . . . . . . . 4402 1 2021 . 1 1 198 198 TYR HB2 H 1 3.09 . . 2 . . . . . . . . 4402 1 2022 . 1 1 198 198 TYR HB3 H 1 2.72 . . 2 . . . . . . . . 4402 1 2023 . 1 1 198 198 TYR HD1 H 1 6.20 . . 1 . . . . . . . . 4402 1 2024 . 1 1 198 198 TYR HD2 H 1 6.20 . . 1 . . . . . . . . 4402 1 2025 . 1 1 198 198 TYR HE1 H 1 6.55 . . 1 . . . . . . . . 4402 1 2026 . 1 1 198 198 TYR HE2 H 1 6.55 . . 1 . . . . . . . . 4402 1 2027 . 1 1 198 198 TYR CD1 C 13 132.6 . . 1 . . . . . . . . 4402 1 2028 . 1 1 198 198 TYR CE1 C 13 117.7 . . 1 . . . . . . . . 4402 1 2029 . 1 1 199 199 GLU N N 15 120.6 . . 1 . . . . . . . . 4402 1 2030 . 1 1 199 199 GLU H H 1 8.27 . . 1 . . . . . . . . 4402 1 2031 . 1 1 199 199 GLU CA C 13 59.1 . . 1 . . . . . . . . 4402 1 2032 . 1 1 199 199 GLU HA H 1 3.74 . . 1 . . . . . . . . 4402 1 2033 . 1 1 199 199 GLU CB C 13 27.9 . . 1 . . . . . . . . 4402 1 2034 . 1 1 199 199 GLU HB2 H 1 2.35 . . 2 . . . . . . . . 4402 1 2035 . 1 1 199 199 GLU HB3 H 1 2.06 . . 2 . . . . . . . . 4402 1 2036 . 1 1 199 199 GLU CG C 13 34.6 . . 1 . . . . . . . . 4402 1 2037 . 1 1 199 199 GLU HG2 H 1 2.41 . . 2 . . . . . . . . 4402 1 2038 . 1 1 199 199 GLU HG3 H 1 2.63 . . 2 . . . . . . . . 4402 1 2039 . 1 1 200 200 ARG N N 15 119.2 . . 1 . . . . . . . . 4402 1 2040 . 1 1 200 200 ARG H H 1 7.97 . . 1 . . . . . . . . 4402 1 2041 . 1 1 200 200 ARG CA C 13 59.0 . . 1 . . . . . . . . 4402 1 2042 . 1 1 200 200 ARG HA H 1 4.05 . . 1 . . . . . . . . 4402 1 2043 . 1 1 200 200 ARG CB C 13 30.0 . . 1 . . . . . . . . 4402 1 2044 . 1 1 200 200 ARG HB2 H 1 1.80 . . 2 . . . . . . . . 4402 1 2045 . 1 1 200 200 ARG HB3 H 1 1.94 . . 2 . . . . . . . . 4402 1 2046 . 1 1 200 200 ARG CG C 13 26.8 . . 1 . . . . . . . . 4402 1 2047 . 1 1 200 200 ARG HG2 H 1 1.59 . . 2 . . . . . . . . 4402 1 2048 . 1 1 200 200 ARG HG3 H 1 1.83 . . 2 . . . . . . . . 4402 1 2049 . 1 1 200 200 ARG CD C 13 43.9 . . 1 . . . . . . . . 4402 1 2050 . 1 1 200 200 ARG HD2 H 1 2.90 . . 2 . . . . . . . . 4402 1 2051 . 1 1 200 200 ARG HD3 H 1 3.06 . . 2 . . . . . . . . 4402 1 2052 . 1 1 200 200 ARG NE N 15 84.1 . . 1 . . . . . . . . 4402 1 2053 . 1 1 200 200 ARG HE H 1 7.23 . . 1 . . . . . . . . 4402 1 2054 . 1 1 201 201 GLU N N 15 118.8 . . 1 . . . . . . . . 4402 1 2055 . 1 1 201 201 GLU H H 1 8.36 . . 1 . . . . . . . . 4402 1 2056 . 1 1 201 201 GLU CA C 13 57.6 . . 1 . . . . . . . . 4402 1 2057 . 1 1 201 201 GLU HA H 1 4.03 . . 1 . . . . . . . . 4402 1 2058 . 1 1 201 201 GLU CB C 13 28.9 . . 1 . . . . . . . . 4402 1 2059 . 1 1 201 201 GLU HB2 H 1 1.68 . . 1 . . . . . . . . 4402 1 2060 . 1 1 201 201 GLU HB3 H 1 1.68 . . 1 . . . . . . . . 4402 1 2061 . 1 1 201 201 GLU CG C 13 35.7 . . 1 . . . . . . . . 4402 1 2062 . 1 1 201 201 GLU HG2 H 1 2.22 . . 2 . . . . . . . . 4402 1 2063 . 1 1 201 201 GLU HG3 H 1 2.40 . . 2 . . . . . . . . 4402 1 2064 . 1 1 202 202 SER N N 15 115.7 . . 1 . . . . . . . . 4402 1 2065 . 1 1 202 202 SER H H 1 8.39 . . 1 . . . . . . . . 4402 1 2066 . 1 1 202 202 SER CA C 13 61.0 . . 1 . . . . . . . . 4402 1 2067 . 1 1 202 202 SER HA H 1 3.90 . . 1 . . . . . . . . 4402 1 2068 . 1 1 202 202 SER CB C 13 62.3 . . 1 . . . . . . . . 4402 1 2069 . 1 1 202 202 SER HB2 H 1 3.40 . . 2 . . . . . . . . 4402 1 2070 . 1 1 202 202 SER HB3 H 1 3.61 . . 2 . . . . . . . . 4402 1 2071 . 1 1 203 203 GLN N N 15 120.3 . . 1 . . . . . . . . 4402 1 2072 . 1 1 203 203 GLN H H 1 7.61 . . 1 . . . . . . . . 4402 1 2073 . 1 1 203 203 GLN CA C 13 57.9 . . 1 . . . . . . . . 4402 1 2074 . 1 1 203 203 GLN HA H 1 4.10 . . 1 . . . . . . . . 4402 1 2075 . 1 1 203 203 GLN CB C 13 28.1 . . 1 . . . . . . . . 4402 1 2076 . 1 1 203 203 GLN HB2 H 1 2.09 . . 1 . . . . . . . . 4402 1 2077 . 1 1 203 203 GLN HB3 H 1 2.09 . . 1 . . . . . . . . 4402 1 2078 . 1 1 203 203 GLN CG C 13 33.7 . . 1 . . . . . . . . 4402 1 2079 . 1 1 203 203 GLN HG2 H 1 2.46 . . 2 . . . . . . . . 4402 1 2080 . 1 1 203 203 GLN HG3 H 1 2.36 . . 2 . . . . . . . . 4402 1 2081 . 1 1 203 203 GLN NE2 N 15 111.8 . . 1 . . . . . . . . 4402 1 2082 . 1 1 203 203 GLN HE21 H 1 7.45 . . 2 . . . . . . . . 4402 1 2083 . 1 1 203 203 GLN HE22 H 1 6.79 . . 2 . . . . . . . . 4402 1 2084 . 1 1 204 204 ALA N N 15 120.8 . . 1 . . . . . . . . 4402 1 2085 . 1 1 204 204 ALA H H 1 7.51 . . 1 . . . . . . . . 4402 1 2086 . 1 1 204 204 ALA CA C 13 53.8 . . 1 . . . . . . . . 4402 1 2087 . 1 1 204 204 ALA HA H 1 4.16 . . 1 . . . . . . . . 4402 1 2088 . 1 1 204 204 ALA HB1 H 1 1.38 . . 1 . . . . . . . . 4402 1 2089 . 1 1 204 204 ALA HB2 H 1 1.38 . . 1 . . . . . . . . 4402 1 2090 . 1 1 204 204 ALA HB3 H 1 1.38 . . 1 . . . . . . . . 4402 1 2091 . 1 1 204 204 ALA CB C 13 18.4 . . 1 . . . . . . . . 4402 1 2092 . 1 1 205 205 TYR N N 15 119.1 . . 1 . . . . . . . . 4402 1 2093 . 1 1 205 205 TYR H H 1 8.02 . . 1 . . . . . . . . 4402 1 2094 . 1 1 205 205 TYR CA C 13 60.0 . . 1 . . . . . . . . 4402 1 2095 . 1 1 205 205 TYR HA H 1 4.17 . . 1 . . . . . . . . 4402 1 2096 . 1 1 205 205 TYR CB C 13 38.9 . . 1 . . . . . . . . 4402 1 2097 . 1 1 205 205 TYR HB2 H 1 2.98 . . 2 . . . . . . . . 4402 1 2098 . 1 1 205 205 TYR HB3 H 1 2.79 . . 2 . . . . . . . . 4402 1 2099 . 1 1 205 205 TYR HD1 H 1 6.66 . . 1 . . . . . . . . 4402 1 2100 . 1 1 205 205 TYR HD2 H 1 6.66 . . 1 . . . . . . . . 4402 1 2101 . 1 1 205 205 TYR HE1 H 1 6.76 . . 1 . . . . . . . . 4402 1 2102 . 1 1 205 205 TYR HE2 H 1 6.76 . . 1 . . . . . . . . 4402 1 2103 . 1 1 205 205 TYR CD1 C 13 133.0 . . 1 . . . . . . . . 4402 1 2104 . 1 1 205 205 TYR CE1 C 13 117.7 . . 1 . . . . . . . . 4402 1 2105 . 1 1 206 206 TYR N N 15 118.0 . . 1 . . . . . . . . 4402 1 2106 . 1 1 206 206 TYR H H 1 7.91 . . 1 . . . . . . . . 4402 1 2107 . 1 1 206 206 TYR CA C 13 58.9 . . 1 . . . . . . . . 4402 1 2108 . 1 1 206 206 TYR HA H 1 4.36 . . 1 . . . . . . . . 4402 1 2109 . 1 1 206 206 TYR CB C 13 38.0 . . 1 . . . . . . . . 4402 1 2110 . 1 1 206 206 TYR HB2 H 1 2.90 . . 2 . . . . . . . . 4402 1 2111 . 1 1 206 206 TYR HB3 H 1 3.11 . . 2 . . . . . . . . 4402 1 2112 . 1 1 206 206 TYR HD1 H 1 7.15 . . 1 . . . . . . . . 4402 1 2113 . 1 1 206 206 TYR HD2 H 1 7.15 . . 1 . . . . . . . . 4402 1 2114 . 1 1 206 206 TYR HE1 H 1 6.82 . . 1 . . . . . . . . 4402 1 2115 . 1 1 206 206 TYR HE2 H 1 6.82 . . 1 . . . . . . . . 4402 1 2116 . 1 1 206 206 TYR CD1 C 13 133.2 . . 1 . . . . . . . . 4402 1 2117 . 1 1 206 206 TYR CE1 C 13 117.9 . . 1 . . . . . . . . 4402 1 2118 . 1 1 207 207 GLN N N 15 119.6 . . 1 . . . . . . . . 4402 1 2119 . 1 1 207 207 GLN H H 1 7.85 . . 1 . . . . . . . . 4402 1 2120 . 1 1 207 207 GLN CA C 13 55.8 . . 1 . . . . . . . . 4402 1 2121 . 1 1 207 207 GLN HA H 1 4.22 . . 1 . . . . . . . . 4402 1 2122 . 1 1 207 207 GLN CB C 13 28.6 . . 1 . . . . . . . . 4402 1 2123 . 1 1 207 207 GLN HB2 H 1 2.02 . . 2 . . . . . . . . 4402 1 2124 . 1 1 207 207 GLN HB3 H 1 2.10 . . 2 . . . . . . . . 4402 1 2125 . 1 1 207 207 GLN CG C 13 33.7 . . 1 . . . . . . . . 4402 1 2126 . 1 1 207 207 GLN HG2 H 1 2.34 . . 1 . . . . . . . . 4402 1 2127 . 1 1 207 207 GLN HG3 H 1 2.34 . . 1 . . . . . . . . 4402 1 2128 . 1 1 207 207 GLN NE2 N 15 111.8 . . 1 . . . . . . . . 4402 1 2129 . 1 1 207 207 GLN HE21 H 1 7.45 . . 2 . . . . . . . . 4402 1 2130 . 1 1 207 207 GLN HE22 H 1 6.79 . . 2 . . . . . . . . 4402 1 2131 . 1 1 208 208 ARG N N 15 120.9 . . 1 . . . . . . . . 4402 1 2132 . 1 1 208 208 ARG H H 1 7.97 . . 1 . . . . . . . . 4402 1 2133 . 1 1 208 208 ARG CA C 13 56.2 . . 1 . . . . . . . . 4402 1 2134 . 1 1 208 208 ARG HA H 1 4.26 . . 1 . . . . . . . . 4402 1 2135 . 1 1 208 208 ARG CB C 13 30.7 . . 1 . . . . . . . . 4402 1 2136 . 1 1 208 208 ARG HB2 H 1 1.81 . . 2 . . . . . . . . 4402 1 2137 . 1 1 208 208 ARG HB3 H 1 1.83 . . 2 . . . . . . . . 4402 1 2138 . 1 1 208 208 ARG CG C 13 26.9 . . 1 . . . . . . . . 4402 1 2139 . 1 1 208 208 ARG HG2 H 1 1.66 . . 2 . . . . . . . . 4402 1 2140 . 1 1 208 208 ARG HG3 H 1 1.60 . . 2 . . . . . . . . 4402 1 2141 . 1 1 208 208 ARG CD C 13 43.1 . . 1 . . . . . . . . 4402 1 2142 . 1 1 208 208 ARG HD2 H 1 3.12 . . 1 . . . . . . . . 4402 1 2143 . 1 1 208 208 ARG HD3 H 1 3.12 . . 1 . . . . . . . . 4402 1 2144 . 1 1 208 208 ARG NE N 15 84.5 . . 1 . . . . . . . . 4402 1 2145 . 1 1 208 208 ARG HE H 1 7.14 . . 1 . . . . . . . . 4402 1 2146 . 1 1 209 209 GLY N N 15 109.9 . . 1 . . . . . . . . 4402 1 2147 . 1 1 209 209 GLY H H 1 8.29 . . 1 . . . . . . . . 4402 1 2148 . 1 1 209 209 GLY CA C 13 45.0 . . 1 . . . . . . . . 4402 1 2149 . 1 1 209 209 GLY HA2 H 1 3.94 . . 1 . . . . . . . . 4402 1 2150 . 1 1 209 209 GLY HA3 H 1 3.94 . . 1 . . . . . . . . 4402 1 2151 . 1 1 210 210 SER N N 15 120.7 . . 1 . . . . . . . . 4402 1 2152 . 1 1 210 210 SER H H 1 7.84 . . 1 . . . . . . . . 4402 1 2153 . 1 1 210 210 SER CA C 13 58.3 . . 1 . . . . . . . . 4402 1 2154 . 1 1 210 210 SER HA H 1 4.49 . . 1 . . . . . . . . 4402 1 2155 . 1 1 210 210 SER CB C 13 63.6 . . 1 . . . . . . . . 4402 1 2156 . 1 1 210 210 SER HB2 H 1 3.88 . . 1 . . . . . . . . 4402 1 2157 . 1 1 210 210 SER HB3 H 1 3.88 . . 1 . . . . . . . . 4402 1 stop_ save_