data_19554 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19554 _Entry.Title ; Domain 2 of E. coli ribosomal protein S1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-10-12 _Entry.Accession_date 2013-10-12 _Entry.Last_release_date 2014-04-14 _Entry.Original_release_date 2014-04-14 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Pierre GIRAUD . . . 19554 2 Jean-Bernard CRECHET . . . 19554 3 Francois BONTEMS . . . 19554 4 Marc UZAN . . . 19554 5 Christina SIZUN . . . 19554 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 19554 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Ecole Polytechnique' . 19554 2 . 'Institut Jacques Monod' . 19554 3 . 'Institut de Chimie des Substances Naturelles, CNRS' . 19554 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'gram-negative bacteria' . 19554 'ribosomal proteins' . 19554 'ribosome binding' . 19554 S1 . 19554 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19554 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 668 19554 '15N chemical shifts' 174 19554 '1H chemical shifts' 1088 19554 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 . . 2014-04-14 2013-10-12 original author . 19554 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 19550 'Domain 1 of E. coli ribosomal protein S1' 19554 PDB 2KHI 'NMR structure of the domain 4 of the E. coli ribosomal protein S1' 19554 PDB 2KHJ 'NMR structure of the domain 6 of the E. coli ribosomal protein S1' 19554 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19554 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24682851 _Citation.Full_citation . _Citation.Title 'Resonance assignment of the ribosome binding domain of E. coli ribosomal protein S1.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2014 _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 Pierre Giraud . . . 19554 1 2 Jean-Bernard Crechet . . . 19554 1 3 Marc Uzan . . . 19554 1 4 Francois Bontems . . . 19554 1 5 Christina Sizun . . . 19554 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19554 _Assembly.ID 1 _Assembly.Name 'Domain 2 of E. coli ribosomal protein S1' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 S1F12 1 $S1F12 A . yes native no no . . . 19554 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_S1F12 _Entity.Sf_category entity _Entity.Sf_framecode S1F12 _Entity.Entry_ID 19554 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name S1F12 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSHMTESFAQLFEESLKEIE TRPGSIVRGVVVAIDKDVVL VDAGLKSESAIPAEQFKNAQ GELEIQVGDEVDVALDAVED GFGETLLSREKAKRHEAWIT LEKAYEDAETVTGVINGKVK GGFTVELNGIRAFLPGSLVD VRPVRDTLHLEGKELEFKVI KLDQKRNNVVVSRRAVIESE NS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'This sequence contains the two first domains of S1 separated by a flexible linker and an extended flexible N-terminal region' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 182 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'Domain 1 and Domain 2 containing fragment of E. coli ribosomal protein S1' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10462.053 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP P0AG67 . S1 . . . . . . . . . . . . . . 19554 1 2 no BMRB 19550 . S1F1 . . . . . 50.55 96 98.91 98.91 1.59e-53 . . . . 19554 1 3 no PDB 2MFI . "Domain 1 Of E. Coli Ribosomal Protein S1" . . . . . 50.55 96 98.91 98.91 1.59e-53 . . . . 19554 1 4 no PDB 2MFL . "Domain 2 Of E. Coli Ribosomal Protein S1" . . . . . 100.00 182 100.00 100.00 6.47e-124 . . . . 19554 1 5 no PDB 4Q7J . "Complex Structure Of Viral Rna Polymerase" . . . . . 98.35 281 100.00 100.00 3.26e-119 . . . . 19554 1 6 no PDB 4R71 . "Structure Of The Qbeta Holoenzyme Complex In The P1211 Crystal Form" . . . . . 93.41 171 100.00 100.00 2.74e-114 . . . . 19554 1 7 no DBJ BAA35655 . "30S ribosomal subunit protein S1 [Escherichia coli str. K12 substr. W3110]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 8 no DBJ BAB34417 . "30S ribosomal subunit protein S1 [Escherichia coli O157:H7 str. Sakai]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 9 no DBJ BAG76494 . "30S ribosomal protein S1 [Escherichia coli SE11]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 10 no DBJ BAH62634 . "30S ribosomal protein S1 [Klebsiella pneumoniae subsp. pneumoniae NTUH-K2044]" . . . . . 98.35 557 100.00 100.00 9.61e-116 . . . . 19554 1 11 no DBJ BAI24353 . "30S ribosomal subunit protein S1 [Escherichia coli O26:H11 str. 11368]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 12 no EMBL CAA23630 . "unnamed protein product [Escherichia coli]" . . . . . 98.35 556 100.00 100.00 6.07e-116 . . . . 19554 1 13 no EMBL CAA23644 . "S1 ribosomal protein [Escherichia coli]" . . . . . 98.35 556 100.00 100.00 6.07e-116 . . . . 19554 1 14 no EMBL CAD05381 . "30S ribosomal protein S1 [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 98.35 557 100.00 100.00 7.66e-116 . . . . 19554 1 15 no EMBL CAO97188 . "30S ribosomal protein S1 [Erwinia tasmaniensis Et1/99]" . . . . . 98.35 557 98.32 98.88 1.63e-113 . . . . 19554 1 16 no EMBL CAP75381 . "30S ribosomal protein S1 [Escherichia coli LF82]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 17 no GB AAC73997 . "30S ribosomal subunit protein S1 [Escherichia coli str. K-12 substr. MG1655]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 18 no GB AAG55396 . "30S ribosomal subunit protein S1 [Escherichia coli O157:H7 str. EDL933]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 19 no GB AAL19915 . "30S ribosomal subunit protein S1 [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 98.35 557 100.00 100.00 7.66e-116 . . . . 19554 1 20 no GB AAN42537 . "30S ribosomal subunit protein S1 [Shigella flexneri 2a str. 301]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 21 no GB AAN79519 . "30S ribosomal protein S1 [Escherichia coli CFT073]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 22 no PIR AC0614 . "30S ribosomal protein S1 [imported] - Salmonella enterica subsp. enterica serovar Typhi (strain CT18)" . . . . . 98.35 557 100.00 100.00 7.66e-116 . . . . 19554 1 23 no PRF 0804233A . "protein S1" . . . . . 98.35 557 99.44 100.00 5.02e-115 . . . . 19554 1 24 no REF NP_309021 . "30S ribosomal protein S1 [Escherichia coli O157:H7 str. Sakai]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 25 no REF NP_415431 . "30S ribosomal subunit protein S1 [Escherichia coli str. K-12 substr. MG1655]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 26 no REF NP_455468 . "30S ribosomal protein S1 [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 98.35 557 100.00 100.00 7.66e-116 . . . . 19554 1 27 no REF NP_459956 . "30S ribosomal protein S1 [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 98.35 557 100.00 100.00 7.66e-116 . . . . 19554 1 28 no REF NP_706830 . "30S ribosomal protein S1 [Shigella flexneri 2a str. 301]" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 29 no SP P0AG67 . "RecName: Full=30S ribosomal protein S1; AltName: Full=Bacteriophage Q beta RNA-directed RNA polymerase subunit I" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 30 no SP P0AG68 . "RecName: Full=30S ribosomal protein S1" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 31 no SP P0AG69 . "RecName: Full=30S ribosomal protein S1" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 32 no SP P0AG70 . "RecName: Full=30S ribosomal protein S1" . . . . . 98.35 557 100.00 100.00 8.18e-116 . . . . 19554 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -2 GLY . 19554 1 2 -1 SER . 19554 1 3 0 HIS . 19554 1 4 1 MET . 19554 1 5 2 THR . 19554 1 6 3 GLU . 19554 1 7 4 SER . 19554 1 8 5 PHE . 19554 1 9 6 ALA . 19554 1 10 7 GLN . 19554 1 11 8 LEU . 19554 1 12 9 PHE . 19554 1 13 10 GLU . 19554 1 14 11 GLU . 19554 1 15 12 SER . 19554 1 16 13 LEU . 19554 1 17 14 LYS . 19554 1 18 15 GLU . 19554 1 19 16 ILE . 19554 1 20 17 GLU . 19554 1 21 18 THR . 19554 1 22 19 ARG . 19554 1 23 20 PRO . 19554 1 24 21 GLY . 19554 1 25 22 SER . 19554 1 26 23 ILE . 19554 1 27 24 VAL . 19554 1 28 25 ARG . 19554 1 29 26 GLY . 19554 1 30 27 VAL . 19554 1 31 28 VAL . 19554 1 32 29 VAL . 19554 1 33 30 ALA . 19554 1 34 31 ILE . 19554 1 35 32 ASP . 19554 1 36 33 LYS . 19554 1 37 34 ASP . 19554 1 38 35 VAL . 19554 1 39 36 VAL . 19554 1 40 37 LEU . 19554 1 41 38 VAL . 19554 1 42 39 ASP . 19554 1 43 40 ALA . 19554 1 44 41 GLY . 19554 1 45 42 LEU . 19554 1 46 43 LYS . 19554 1 47 44 SER . 19554 1 48 45 GLU . 19554 1 49 46 SER . 19554 1 50 47 ALA . 19554 1 51 48 ILE . 19554 1 52 49 PRO . 19554 1 53 50 ALA . 19554 1 54 51 GLU . 19554 1 55 52 GLN . 19554 1 56 53 PHE . 19554 1 57 54 LYS . 19554 1 58 55 ASN . 19554 1 59 56 ALA . 19554 1 60 57 GLN . 19554 1 61 58 GLY . 19554 1 62 59 GLU . 19554 1 63 60 LEU . 19554 1 64 61 GLU . 19554 1 65 62 ILE . 19554 1 66 63 GLN . 19554 1 67 64 VAL . 19554 1 68 65 GLY . 19554 1 69 66 ASP . 19554 1 70 67 GLU . 19554 1 71 68 VAL . 19554 1 72 69 ASP . 19554 1 73 70 VAL . 19554 1 74 71 ALA . 19554 1 75 72 LEU . 19554 1 76 73 ASP . 19554 1 77 74 ALA . 19554 1 78 75 VAL . 19554 1 79 76 GLU . 19554 1 80 77 ASP . 19554 1 81 78 GLY . 19554 1 82 79 PHE . 19554 1 83 80 GLY . 19554 1 84 81 GLU . 19554 1 85 82 THR . 19554 1 86 83 LEU . 19554 1 87 84 LEU . 19554 1 88 85 SER . 19554 1 89 86 ARG . 19554 1 90 87 GLU . 19554 1 91 88 LYS . 19554 1 92 89 ALA . 19554 1 93 90 LYS . 19554 1 94 91 ARG . 19554 1 95 92 HIS . 19554 1 96 93 GLU . 19554 1 97 94 ALA . 19554 1 98 95 TRP . 19554 1 99 96 ILE . 19554 1 100 97 THR . 19554 1 101 98 LEU . 19554 1 102 99 GLU . 19554 1 103 100 LYS . 19554 1 104 101 ALA . 19554 1 105 102 TYR . 19554 1 106 103 GLU . 19554 1 107 104 ASP . 19554 1 108 105 ALA . 19554 1 109 106 GLU . 19554 1 110 107 THR . 19554 1 111 108 VAL . 19554 1 112 109 THR . 19554 1 113 110 GLY . 19554 1 114 111 VAL . 19554 1 115 112 ILE . 19554 1 116 113 ASN . 19554 1 117 114 GLY . 19554 1 118 115 LYS . 19554 1 119 116 VAL . 19554 1 120 117 LYS . 19554 1 121 118 GLY . 19554 1 122 119 GLY . 19554 1 123 120 PHE . 19554 1 124 121 THR . 19554 1 125 122 VAL . 19554 1 126 123 GLU . 19554 1 127 124 LEU . 19554 1 128 125 ASN . 19554 1 129 126 GLY . 19554 1 130 127 ILE . 19554 1 131 128 ARG . 19554 1 132 129 ALA . 19554 1 133 130 PHE . 19554 1 134 131 LEU . 19554 1 135 132 PRO . 19554 1 136 133 GLY . 19554 1 137 134 SER . 19554 1 138 135 LEU . 19554 1 139 136 VAL . 19554 1 140 137 ASP . 19554 1 141 138 VAL . 19554 1 142 139 ARG . 19554 1 143 140 PRO . 19554 1 144 141 VAL . 19554 1 145 142 ARG . 19554 1 146 143 ASP . 19554 1 147 144 THR . 19554 1 148 145 LEU . 19554 1 149 146 HIS . 19554 1 150 147 LEU . 19554 1 151 148 GLU . 19554 1 152 149 GLY . 19554 1 153 150 LYS . 19554 1 154 151 GLU . 19554 1 155 152 LEU . 19554 1 156 153 GLU . 19554 1 157 154 PHE . 19554 1 158 155 LYS . 19554 1 159 156 VAL . 19554 1 160 157 ILE . 19554 1 161 158 LYS . 19554 1 162 159 LEU . 19554 1 163 160 ASP . 19554 1 164 161 GLN . 19554 1 165 162 LYS . 19554 1 166 163 ARG . 19554 1 167 164 ASN . 19554 1 168 165 ASN . 19554 1 169 166 VAL . 19554 1 170 167 VAL . 19554 1 171 168 VAL . 19554 1 172 169 SER . 19554 1 173 170 ARG . 19554 1 174 171 ARG . 19554 1 175 172 ALA . 19554 1 176 173 VAL . 19554 1 177 174 ILE . 19554 1 178 175 GLU . 19554 1 179 176 SER . 19554 1 180 177 GLU . 19554 1 181 178 ASN . 19554 1 182 179 SER . 19554 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 19554 1 . SER 2 2 19554 1 . HIS 3 3 19554 1 . MET 4 4 19554 1 . THR 5 5 19554 1 . GLU 6 6 19554 1 . SER 7 7 19554 1 . PHE 8 8 19554 1 . ALA 9 9 19554 1 . GLN 10 10 19554 1 . LEU 11 11 19554 1 . PHE 12 12 19554 1 . GLU 13 13 19554 1 . GLU 14 14 19554 1 . SER 15 15 19554 1 . LEU 16 16 19554 1 . LYS 17 17 19554 1 . GLU 18 18 19554 1 . ILE 19 19 19554 1 . GLU 20 20 19554 1 . THR 21 21 19554 1 . ARG 22 22 19554 1 . PRO 23 23 19554 1 . GLY 24 24 19554 1 . SER 25 25 19554 1 . ILE 26 26 19554 1 . VAL 27 27 19554 1 . ARG 28 28 19554 1 . GLY 29 29 19554 1 . VAL 30 30 19554 1 . VAL 31 31 19554 1 . VAL 32 32 19554 1 . ALA 33 33 19554 1 . ILE 34 34 19554 1 . ASP 35 35 19554 1 . LYS 36 36 19554 1 . ASP 37 37 19554 1 . VAL 38 38 19554 1 . VAL 39 39 19554 1 . LEU 40 40 19554 1 . VAL 41 41 19554 1 . ASP 42 42 19554 1 . ALA 43 43 19554 1 . GLY 44 44 19554 1 . LEU 45 45 19554 1 . LYS 46 46 19554 1 . SER 47 47 19554 1 . GLU 48 48 19554 1 . SER 49 49 19554 1 . ALA 50 50 19554 1 . ILE 51 51 19554 1 . PRO 52 52 19554 1 . ALA 53 53 19554 1 . GLU 54 54 19554 1 . GLN 55 55 19554 1 . PHE 56 56 19554 1 . LYS 57 57 19554 1 . ASN 58 58 19554 1 . ALA 59 59 19554 1 . GLN 60 60 19554 1 . GLY 61 61 19554 1 . GLU 62 62 19554 1 . LEU 63 63 19554 1 . GLU 64 64 19554 1 . ILE 65 65 19554 1 . GLN 66 66 19554 1 . VAL 67 67 19554 1 . GLY 68 68 19554 1 . ASP 69 69 19554 1 . GLU 70 70 19554 1 . VAL 71 71 19554 1 . ASP 72 72 19554 1 . VAL 73 73 19554 1 . ALA 74 74 19554 1 . LEU 75 75 19554 1 . ASP 76 76 19554 1 . ALA 77 77 19554 1 . VAL 78 78 19554 1 . GLU 79 79 19554 1 . ASP 80 80 19554 1 . GLY 81 81 19554 1 . PHE 82 82 19554 1 . GLY 83 83 19554 1 . GLU 84 84 19554 1 . THR 85 85 19554 1 . LEU 86 86 19554 1 . LEU 87 87 19554 1 . SER 88 88 19554 1 . ARG 89 89 19554 1 . GLU 90 90 19554 1 . LYS 91 91 19554 1 . ALA 92 92 19554 1 . LYS 93 93 19554 1 . ARG 94 94 19554 1 . HIS 95 95 19554 1 . GLU 96 96 19554 1 . ALA 97 97 19554 1 . TRP 98 98 19554 1 . ILE 99 99 19554 1 . THR 100 100 19554 1 . LEU 101 101 19554 1 . GLU 102 102 19554 1 . LYS 103 103 19554 1 . ALA 104 104 19554 1 . TYR 105 105 19554 1 . GLU 106 106 19554 1 . ASP 107 107 19554 1 . ALA 108 108 19554 1 . GLU 109 109 19554 1 . THR 110 110 19554 1 . VAL 111 111 19554 1 . THR 112 112 19554 1 . GLY 113 113 19554 1 . VAL 114 114 19554 1 . ILE 115 115 19554 1 . ASN 116 116 19554 1 . GLY 117 117 19554 1 . LYS 118 118 19554 1 . VAL 119 119 19554 1 . LYS 120 120 19554 1 . GLY 121 121 19554 1 . GLY 122 122 19554 1 . PHE 123 123 19554 1 . THR 124 124 19554 1 . VAL 125 125 19554 1 . GLU 126 126 19554 1 . LEU 127 127 19554 1 . ASN 128 128 19554 1 . GLY 129 129 19554 1 . ILE 130 130 19554 1 . ARG 131 131 19554 1 . ALA 132 132 19554 1 . PHE 133 133 19554 1 . LEU 134 134 19554 1 . PRO 135 135 19554 1 . GLY 136 136 19554 1 . SER 137 137 19554 1 . LEU 138 138 19554 1 . VAL 139 139 19554 1 . ASP 140 140 19554 1 . VAL 141 141 19554 1 . ARG 142 142 19554 1 . PRO 143 143 19554 1 . VAL 144 144 19554 1 . ARG 145 145 19554 1 . ASP 146 146 19554 1 . THR 147 147 19554 1 . LEU 148 148 19554 1 . HIS 149 149 19554 1 . LEU 150 150 19554 1 . GLU 151 151 19554 1 . GLY 152 152 19554 1 . LYS 153 153 19554 1 . GLU 154 154 19554 1 . LEU 155 155 19554 1 . GLU 156 156 19554 1 . PHE 157 157 19554 1 . LYS 158 158 19554 1 . VAL 159 159 19554 1 . ILE 160 160 19554 1 . LYS 161 161 19554 1 . LEU 162 162 19554 1 . ASP 163 163 19554 1 . GLN 164 164 19554 1 . LYS 165 165 19554 1 . ARG 166 166 19554 1 . ASN 167 167 19554 1 . ASN 168 168 19554 1 . VAL 169 169 19554 1 . VAL 170 170 19554 1 . VAL 171 171 19554 1 . SER 172 172 19554 1 . ARG 173 173 19554 1 . ARG 174 174 19554 1 . ALA 175 175 19554 1 . VAL 176 176 19554 1 . ILE 177 177 19554 1 . GLU 178 178 19554 1 . SER 179 179 19554 1 . GLU 180 180 19554 1 . ASN 181 181 19554 1 . SER 182 182 19554 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 19554 _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 $S1F12 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli K12 . . . . . . . . . . . . . . . . . . . . 19554 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 19554 _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 $S1F12 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET15b . . . . . . 19554 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_S1F12-15N13C2H _Sample.Sf_category sample _Sample.Sf_framecode S1F12-15N13C2H _Sample.Entry_ID 19554 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 S1F12 '[U-99% 13C; U-99% 15N; U-80% 2H]' . . 1 $S1F12 . . 0.25 . . mM 0.025 . . . 19554 1 2 'sodium phosphate' 'natural abundance' . . . . . . 25.0 . . mM 1.0 . . . 19554 1 3 'sodium chloride' 'natural abundance' . . . . . . 200.0 . . mM 2.0 . . . 19554 1 4 H2O 'natural abundance' . . . . . . 93 . . % . . . . 19554 1 5 D2O '[U-100% 2H]' . . . . . . 7 . . % . . . . 19554 1 stop_ save_ save_S1F12-15N13C-H2O _Sample.Sf_category sample _Sample.Sf_framecode S1F12-15N13C-H2O _Sample.Entry_ID 19554 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 S1F12 '[U-99% 13C; U-99% 15N]' . . 1 $S1F12 . . 0.2 . . mM 0.02 . . . 19554 2 2 'potassium phosphate' 'natural abundance' . . . . . . 50.0 . . mM 1.0 . . . 19554 2 3 'potassium chloride' 'natural abundance' . . . . . . 200.0 . . mM 2.0 . . . 19554 2 4 H2O 'natural abundance' . . . . . . 93 . . % . . . . 19554 2 5 D2O '[U-100% 2H]' . . . . . . 7 . . % . . . . 19554 2 stop_ save_ save_S1F12-15N13C-D2O _Sample.Sf_category sample _Sample.Sf_framecode S1F12-15N13C-D2O _Sample.Entry_ID 19554 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 S1F12 '[U-99% 13C; U-99% 15N]' . . 1 $S1F12 . . 0.2 . . mM 0.02 . . . 19554 3 2 'potassium phosphate' 'natural abundance' . . . . . . 50.0 . . mM 1.0 . . . 19554 3 3 'potassium chloride' 'natural abundance' . . . . . . 200.0 . . mM 2.0 . . . 19554 3 4 D2O '[U-100% 2H]' . . . . . . 100 . . % . . . . 19554 3 stop_ save_ ####################### # Sample conditions # ####################### save_Condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Condition_1 _Sample_condition_list.Entry_ID 19554 _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' 0.200 0.01 M 19554 1 pH 6.800 0.10 pH 19554 1 pressure 1.000 0.01 atm 19554 1 temperature 293.000 0.50 K 19554 1 stop_ save_ ############################ # Computer software used # ############################ save_CcpNmr_Analysis _Software.Sf_category software _Software.Sf_framecode CcpNmr_Analysis _Software.Entry_ID 19554 _Software.ID 1 _Software.Name 'CCPNmr ANALYSIS' _Software.Version 2.2 _Software.Details 'The CCPN NMR assignment and data analysis application' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN 'Department of Biochemistry, Cambridge CB2 1GA, UK' http://www.ccpn.ac.uk 19554 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Spectrum analysis' 19554 1 'Spectrum display' 19554 1 stop_ save_ save_TopSpin _Software.Sf_category software _Software.Sf_framecode TopSpin _Software.Entry_ID 19554 _Software.ID 2 _Software.Name TOPSPIN _Software.Version 3.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 19554 2 'Herrmann, G?ntert and W?thrich' 'LAS, Tokei-Kaikan BLD.1F 1-11-5 Ueno,Taito, Tokyo 110-0005, Japan' http://www.las.jp/english/products/cyana.html 19554 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Spectrum processing' 19554 2 'Structure calculation' 19554 2 stop_ save_ save_nmrPipe _Software.Sf_category software _Software.Sf_framecode nmrPipe _Software.Entry_ID 19554 _Software.ID 3 _Software.Name NMRPipe _Software.Version any _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . http://spin.niddk.nih.gov/NMRPipe/ 19554 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Spectrum processing' 19554 3 stop_ save_ save_talos+ _Software.Sf_category software _Software.Sf_framecode talos+ _Software.Entry_ID 19554 _Software.ID 4 _Software.Name TALOS+ _Software.Version any _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . http://spin.niddk.nih.gov/NMRPipe/ 19554 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Dihedral angles' 19554 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 19554 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 950 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 19554 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 19554 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 19554 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 950 . . . 19554 1 2 spectrometer_2 Bruker Avance . 600 . . . 19554 1 3 spectrometer_3 Bruker Avance . 800 . . . 19554 1 stop_ save_ save_CRP_950 _NMR_spectrometer_probe.Sf_category NMR_spectrometer_probe _NMR_spectrometer_probe.Sf_framecode CRP_950 _NMR_spectrometer_probe.Entry_ID 19554 _NMR_spectrometer_probe.ID 1 _NMR_spectrometer_probe.Details . _NMR_spectrometer_probe.Manufacturer Bruker _NMR_spectrometer_probe.Model 'CP TCI 950' _NMR_spectrometer_probe.Serial_number . _NMR_spectrometer_probe.Diameter . _NMR_spectrometer_probe.Rotor_length . _NMR_spectrometer_probe.Rotor_composition . _NMR_spectrometer_probe.Internal_volume . _NMR_spectrometer_probe.Spacer_present . loop_ _NMR_probe.Type _NMR_probe.Entry_ID _NMR_probe.NMR_spectrometer_probe_ID liquid 19554 1 stop_ save_ save_CRP_600 _NMR_spectrometer_probe.Sf_category NMR_spectrometer_probe _NMR_spectrometer_probe.Sf_framecode CRP_600 _NMR_spectrometer_probe.Entry_ID 19554 _NMR_spectrometer_probe.ID 2 _NMR_spectrometer_probe.Details . _NMR_spectrometer_probe.Manufacturer Bruker _NMR_spectrometer_probe.Model 'CP TCI 600' _NMR_spectrometer_probe.Serial_number . _NMR_spectrometer_probe.Diameter . _NMR_spectrometer_probe.Rotor_length . _NMR_spectrometer_probe.Rotor_composition . _NMR_spectrometer_probe.Internal_volume . _NMR_spectrometer_probe.Spacer_present . loop_ _NMR_probe.Type _NMR_probe.Entry_ID _NMR_probe.NMR_spectrometer_probe_ID liquid 19554 2 stop_ save_ save_CRP_800 _NMR_spectrometer_probe.Sf_category NMR_spectrometer_probe _NMR_spectrometer_probe.Sf_framecode CRP_800 _NMR_spectrometer_probe.Entry_ID 19554 _NMR_spectrometer_probe.ID 3 _NMR_spectrometer_probe.Details . _NMR_spectrometer_probe.Manufacturer bruker _NMR_spectrometer_probe.Model 'CP TCI 800' _NMR_spectrometer_probe.Serial_number . _NMR_spectrometer_probe.Diameter . _NMR_spectrometer_probe.Rotor_length . _NMR_spectrometer_probe.Rotor_composition . _NMR_spectrometer_probe.Internal_volume . _NMR_spectrometer_probe.Spacer_present . loop_ _NMR_probe.Type _NMR_probe.Entry_ID _NMR_probe.NMR_spectrometer_probe_ID liquid 19554 3 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 19554 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $S1F12-15N13C2H isotropic . . 1 $Condition_1 . . . 2 $spectrometer_2 2 $CRP_600 . . . . . . . . . . . . . . 19554 1 2 '3D HNCA' no . . . . . . . . . . 1 $S1F12-15N13C2H isotropic . . 1 $Condition_1 . . . 2 $spectrometer_2 2 $CRP_600 . . . . . . . . . . . . . . 19554 1 3 '3D HN(CO)CA' no . . . . . . . . . . 1 $S1F12-15N13C2H isotropic . . 1 $Condition_1 . . . 2 $spectrometer_2 2 $CRP_600 . . . . . . . . . . . . . . 19554 1 4 '3D HNCACB' no . . . . . . . . . . 1 $S1F12-15N13C2H isotropic . . 1 $Condition_1 . . . 2 $spectrometer_2 2 $CRP_600 . . . . . . . . . . . . . . 19554 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $S1F12-15N13C2H isotropic . . 1 $Condition_1 . . . 2 $spectrometer_2 2 $CRP_600 . . . . . . . . . . . . . . 19554 1 6 '3D HNCO' no . . . . . . . . . . 1 $S1F12-15N13C2H isotropic . . 1 $Condition_1 . . . 2 $spectrometer_2 2 $CRP_600 . . . . . . . . . . . . . . 19554 1 7 '3D HN(CA)CO' no . . . . . . . . . . 1 $S1F12-15N13C2H isotropic . . 1 $Condition_1 . . . 2 $spectrometer_2 2 $CRP_600 . . . . . . . . . . . . . . 19554 1 8 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $S1F12-15N13C-H2O isotropic . . 1 $Condition_1 . . . 1 $spectrometer_1 1 $CRP_950 . . . . . . . . . . . . . . 19554 1 9 '3D HBHA(CO)NH' no . . . . . . . . . . 2 $S1F12-15N13C-H2O isotropic . . 1 $Condition_1 . . . 2 $spectrometer_2 2 $CRP_600 . . . . . . . . . . . . . . 19554 1 10 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $S1F12-15N13C-H2O isotropic . . 1 $Condition_1 . . . 1 $spectrometer_1 1 $CRP_950 . . . . . . . . . . . . . . 19554 1 11 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $S1F12-15N13C-D2O isotropic . . 1 $Condition_1 . . . 1 $spectrometer_1 1 $CRP_950 . . . . . . . . . . . . . . 19554 1 12 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $S1F12-15N13C-D2O isotropic . . 1 $Condition_1 . . . 1 $spectrometer_1 1 $CRP_950 . . . . . . . . . . . . . . 19554 1 13 '3D HCCH-TOCSY aromatic' no . . . . . . . . . . 3 $S1F12-15N13C-D2O isotropic . . 1 $Condition_1 . . . 1 $spectrometer_1 1 $CRP_950 . . . . . . . . . . . . . . 19554 1 14 '3D CCH-TOCSY' no . . . . . . . . . . 3 $S1F12-15N13C-D2O isotropic . . 1 $Condition_1 . . . 1 $spectrometer_1 1 $CRP_950 . . . . . . . . . . . . . . 19554 1 15 '2D 1H-1H TOCSY' no . . . . . . . . . . 3 $S1F12-15N13C-D2O isotropic . . 1 $Condition_1 . . . 3 $spectrometer_3 3 $CRP_800 . . . . . . . . . . . . . . 19554 1 16 '2D 1H-1H NOESY' no . . . . . . . . . . 3 $S1F12-15N13C-D2O isotropic . . 1 $Condition_1 . . . 1 $spectrometer_1 1 $CRP_950 . . . . . . . . . . . . . . 19554 1 17 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $S1F12-15N13C-D2O isotropic . . 1 $Condition_1 . . . 1 $spectrometer_1 1 $CRP_950 . . . . . . . . . . . . . . 19554 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 19554 _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 0.00 na indirect 0.251449530 . . . . . . . . . 19554 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 19554 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 19554 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 19554 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '3D HNCA' 1 $S1F12-15N13C2H isotropic 19554 1 3 '3D HN(CO)CA' 1 $S1F12-15N13C2H isotropic 19554 1 4 '3D HNCACB' 1 $S1F12-15N13C2H isotropic 19554 1 5 '3D CBCA(CO)NH' 1 $S1F12-15N13C2H isotropic 19554 1 6 '3D HNCO' 1 $S1F12-15N13C2H isotropic 19554 1 7 '3D HN(CA)CO' 1 $S1F12-15N13C2H isotropic 19554 1 8 '2D 1H-15N HSQC' 2 $S1F12-15N13C-H2O isotropic 19554 1 9 '3D HBHA(CO)NH' 2 $S1F12-15N13C-H2O isotropic 19554 1 10 '3D 1H-15N NOESY' 2 $S1F12-15N13C-H2O isotropic 19554 1 11 '2D 1H-13C HSQC' 3 $S1F12-15N13C-D2O isotropic 19554 1 12 '3D HCCH-TOCSY' 3 $S1F12-15N13C-D2O isotropic 19554 1 13 '3D HCCH-TOCSY aromatic' 3 $S1F12-15N13C-D2O isotropic 19554 1 14 '3D CCH-TOCSY' 3 $S1F12-15N13C-D2O isotropic 19554 1 15 '2D 1H-1H TOCSY' 3 $S1F12-15N13C-D2O isotropic 19554 1 16 '2D 1H-1H NOESY' 3 $S1F12-15N13C-D2O isotropic 19554 1 17 '3D 1H-13C NOESY' 3 $S1F12-15N13C-D2O isotropic 19554 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 3 3 HIS H H 1 8.33 0.02 . 1 . . . . 0 HIS H . 19554 1 2 . 1 1 3 3 HIS HA H 1 4.12 0.02 . 1 . . . . 0 HIS HA . 19554 1 3 . 1 1 3 3 HIS C C 13 175.98 0.25 . 1 . . . . 0 HIS C . 19554 1 4 . 1 1 3 3 HIS N N 15 121.49 0.15 . 1 . . . . 0 HIS N . 19554 1 5 . 1 1 4 4 MET H H 1 8.52 0.02 . 1 . . . . 1 MET H . 19554 1 6 . 1 1 4 4 MET HA H 1 4.38 0.02 . 1 . . . . 1 MET HA . 19554 1 7 . 1 1 4 4 MET HB2 H 1 1.88 0.02 . 2 . . . . 1 MET HB2 . 19554 1 8 . 1 1 4 4 MET HB3 H 1 1.97 0.02 . 2 . . . . 1 MET HB3 . 19554 1 9 . 1 1 4 4 MET HG2 H 1 2.36 0.02 . 2 . . . . 1 MET HG2 . 19554 1 10 . 1 1 4 4 MET HG3 H 1 2.42 0.02 . 2 . . . . 1 MET HG3 . 19554 1 11 . 1 1 4 4 MET HE1 H 1 1.95 0.02 . 1 . . . . 1 MET HE1 . 19554 1 12 . 1 1 4 4 MET HE2 H 1 1.95 0.02 . 1 . . . . 1 MET HE2 . 19554 1 13 . 1 1 4 4 MET HE3 H 1 1.95 0.02 . 1 . . . . 1 MET HE3 . 19554 1 14 . 1 1 4 4 MET C C 13 176.27 0.25 . 1 . . . . 1 MET C . 19554 1 15 . 1 1 4 4 MET CA C 13 55.57 0.25 . 1 . . . . 1 MET CA . 19554 1 16 . 1 1 4 4 MET CB C 13 32.69 0.25 . 1 . . . . 1 MET CB . 19554 1 17 . 1 1 4 4 MET CG C 13 31.79 0.25 . 1 . . . . 1 MET CG . 19554 1 18 . 1 1 4 4 MET CE C 13 16.82 0.25 . 1 . . . . 1 MET CE . 19554 1 19 . 1 1 4 4 MET N N 15 124.69 0.15 . 1 . . . . 1 MET N . 19554 1 20 . 1 1 5 5 THR H H 1 8.10 0.02 . 1 . . . . 2 THR H . 19554 1 21 . 1 1 5 5 THR HA H 1 4.18 0.02 . 1 . . . . 2 THR HA . 19554 1 22 . 1 1 5 5 THR HB H 1 4.14 0.02 . 1 . . . . 2 THR HB . 19554 1 23 . 1 1 5 5 THR HG21 H 1 1.09 0.02 . 1 . . . . 2 THR HG21 . 19554 1 24 . 1 1 5 5 THR HG22 H 1 1.09 0.02 . 1 . . . . 2 THR HG22 . 19554 1 25 . 1 1 5 5 THR HG23 H 1 1.09 0.02 . 1 . . . . 2 THR HG23 . 19554 1 26 . 1 1 5 5 THR C C 13 174.68 0.25 . 1 . . . . 2 THR C . 19554 1 27 . 1 1 5 5 THR CA C 13 61.95 0.25 . 1 . . . . 2 THR CA . 19554 1 28 . 1 1 5 5 THR CB C 13 69.52 0.25 . 1 . . . . 2 THR CB . 19554 1 29 . 1 1 5 5 THR CG2 C 13 21.57 0.25 . 1 . . . . 2 THR CG2 . 19554 1 30 . 1 1 5 5 THR N N 15 115.24 0.15 . 1 . . . . 2 THR N . 19554 1 31 . 1 1 6 6 GLU H H 1 8.38 0.02 . 1 . . . . 3 GLU H . 19554 1 32 . 1 1 6 6 GLU HA H 1 4.14 0.02 . 1 . . . . 3 GLU HA . 19554 1 33 . 1 1 6 6 GLU HB2 H 1 1.82 0.02 . 2 . . . . 3 GLU HB2 . 19554 1 34 . 1 1 6 6 GLU HB3 H 1 1.94 0.02 . 2 . . . . 3 GLU HB3 . 19554 1 35 . 1 1 6 6 GLU HG2 H 1 2.11 0.02 . 1 . . . . 3 GLU HG2 . 19554 1 36 . 1 1 6 6 GLU HG3 H 1 2.11 0.02 . 1 . . . . 3 GLU HG3 . 19554 1 37 . 1 1 6 6 GLU C C 13 176.58 0.25 . 1 . . . . 3 GLU C . 19554 1 38 . 1 1 6 6 GLU CA C 13 56.60 0.25 . 1 . . . . 3 GLU CA . 19554 1 39 . 1 1 6 6 GLU CB C 13 30.04 0.25 . 1 . . . . 3 GLU CB . 19554 1 40 . 1 1 6 6 GLU CG C 13 36.31 0.25 . 1 . . . . 3 GLU CG . 19554 1 41 . 1 1 6 6 GLU N N 15 123.19 0.15 . 1 . . . . 3 GLU N . 19554 1 42 . 1 1 7 7 SER H H 1 8.18 0.02 . 1 . . . . 4 SER H . 19554 1 43 . 1 1 7 7 SER HA H 1 4.39 0.02 . 1 . . . . 4 SER HA . 19554 1 44 . 1 1 7 7 SER HB2 H 1 3.71 0.02 . 2 . . . . 4 SER HB2 . 19554 1 45 . 1 1 7 7 SER HB3 H 1 3.67 0.02 . 2 . . . . 4 SER HB3 . 19554 1 46 . 1 1 7 7 SER C C 13 174.58 0.25 . 1 . . . . 4 SER C . 19554 1 47 . 1 1 7 7 SER CA C 13 58.05 0.25 . 1 . . . . 4 SER CA . 19554 1 48 . 1 1 7 7 SER CB C 13 63.72 0.25 . 1 . . . . 4 SER CB . 19554 1 49 . 1 1 7 7 SER N N 15 116.25 0.15 . 1 . . . . 4 SER N . 19554 1 50 . 1 1 8 8 PHE H H 1 8.12 0.02 . 1 . . . . 5 PHE H . 19554 1 51 . 1 1 8 8 PHE HA H 1 4.43 0.02 . 1 . . . . 5 PHE HA . 19554 1 52 . 1 1 8 8 PHE HB2 H 1 3.05 0.02 . 2 . . . . 5 PHE HB2 . 19554 1 53 . 1 1 8 8 PHE HB3 H 1 2.94 0.02 . 2 . . . . 5 PHE HB3 . 19554 1 54 . 1 1 8 8 PHE HD1 H 1 7.13 0.02 . 3 . . . . 5 PHE HD1 . 19554 1 55 . 1 1 8 8 PHE HD2 H 1 7.13 0.02 . 3 . . . . 5 PHE HD2 . 19554 1 56 . 1 1 8 8 PHE HE1 H 1 7.20 0.02 . 3 . . . . 5 PHE HE1 . 19554 1 57 . 1 1 8 8 PHE HE2 H 1 7.20 0.02 . 3 . . . . 5 PHE HE2 . 19554 1 58 . 1 1 8 8 PHE C C 13 175.83 0.25 . 1 . . . . 5 PHE C . 19554 1 59 . 1 1 8 8 PHE CA C 13 58.22 0.25 . 1 . . . . 5 PHE CA . 19554 1 60 . 1 1 8 8 PHE CB C 13 39.12 0.25 . 1 . . . . 5 PHE CB . 19554 1 61 . 1 1 8 8 PHE N N 15 122.11 0.15 . 1 . . . . 5 PHE N . 19554 1 62 . 1 1 9 9 ALA H H 1 8.07 0.02 . 1 . . . . 6 ALA H . 19554 1 63 . 1 1 9 9 ALA HA H 1 4.09 0.02 . 1 . . . . 6 ALA HA . 19554 1 64 . 1 1 9 9 ALA HB1 H 1 1.25 0.02 . 1 . . . . 6 ALA HB1 . 19554 1 65 . 1 1 9 9 ALA HB2 H 1 1.25 0.02 . 1 . . . . 6 ALA HB2 . 19554 1 66 . 1 1 9 9 ALA HB3 H 1 1.25 0.02 . 1 . . . . 6 ALA HB3 . 19554 1 67 . 1 1 9 9 ALA C C 13 177.95 0.25 . 1 . . . . 6 ALA C . 19554 1 68 . 1 1 9 9 ALA CA C 13 53.06 0.25 . 1 . . . . 6 ALA CA . 19554 1 69 . 1 1 9 9 ALA CB C 13 18.84 0.25 . 1 . . . . 6 ALA CB . 19554 1 70 . 1 1 9 9 ALA N N 15 124.00 0.15 . 1 . . . . 6 ALA N . 19554 1 71 . 1 1 10 10 GLN H H 1 8.03 0.02 . 1 . . . . 7 GLN H . 19554 1 72 . 1 1 10 10 GLN HA H 1 4.10 0.02 . 1 . . . . 7 GLN HA . 19554 1 73 . 1 1 10 10 GLN HB2 H 1 1.91 0.02 . 2 . . . . 7 GLN HB2 . 19554 1 74 . 1 1 10 10 GLN HB3 H 1 1.87 0.02 . 2 . . . . 7 GLN HB3 . 19554 1 75 . 1 1 10 10 GLN HG2 H 1 2.21 0.02 . 2 . . . . 7 GLN HG2 . 19554 1 76 . 1 1 10 10 GLN HG3 H 1 2.19 0.02 . 2 . . . . 7 GLN HG3 . 19554 1 77 . 1 1 10 10 GLN HE21 H 1 7.46 0.02 . 1 . . . . 7 GLN HE21 . 19554 1 78 . 1 1 10 10 GLN HE22 H 1 6.76 0.02 . 1 . . . . 7 GLN HE22 . 19554 1 79 . 1 1 10 10 GLN C C 13 176.24 0.25 . 1 . . . . 7 GLN C . 19554 1 80 . 1 1 10 10 GLN CA C 13 56.26 0.25 . 1 . . . . 7 GLN CA . 19554 1 81 . 1 1 10 10 GLN CB C 13 29.02 0.25 . 1 . . . . 7 GLN CB . 19554 1 82 . 1 1 10 10 GLN CG C 13 33.70 0.25 . 1 . . . . 7 GLN CG . 19554 1 83 . 1 1 10 10 GLN N N 15 118.64 0.15 . 1 . . . . 7 GLN N . 19554 1 84 . 1 1 10 10 GLN NE2 N 15 112.42 0.15 . 1 . . . . 7 GLN NE2 . 19554 1 85 . 1 1 11 11 LEU H H 1 7.96 0.02 . 1 . . . . 8 LEU H . 19554 1 86 . 1 1 11 11 LEU HA H 1 4.10 0.02 . 1 . . . . 8 LEU HA . 19554 1 87 . 1 1 11 11 LEU HB2 H 1 1.31 0.02 . 2 . . . . 8 LEU HB2 . 19554 1 88 . 1 1 11 11 LEU HB3 H 1 1.43 0.02 . 2 . . . . 8 LEU HB3 . 19554 1 89 . 1 1 11 11 LEU HD11 H 1 0.76 0.02 . 2 . . . . 8 LEU HD11 . 19554 1 90 . 1 1 11 11 LEU HD12 H 1 0.76 0.02 . 2 . . . . 8 LEU HD12 . 19554 1 91 . 1 1 11 11 LEU HD13 H 1 0.76 0.02 . 2 . . . . 8 LEU HD13 . 19554 1 92 . 1 1 11 11 LEU HD21 H 1 0.70 0.02 . 2 . . . . 8 LEU HD21 . 19554 1 93 . 1 1 11 11 LEU HD22 H 1 0.70 0.02 . 2 . . . . 8 LEU HD22 . 19554 1 94 . 1 1 11 11 LEU HD23 H 1 0.70 0.02 . 2 . . . . 8 LEU HD23 . 19554 1 95 . 1 1 11 11 LEU C C 13 177.55 0.25 . 1 . . . . 8 LEU C . 19554 1 96 . 1 1 11 11 LEU CA C 13 55.66 0.25 . 1 . . . . 8 LEU CA . 19554 1 97 . 1 1 11 11 LEU CB C 13 42.28 0.25 . 1 . . . . 8 LEU CB . 19554 1 98 . 1 1 11 11 LEU CG C 13 26.77 0.25 . 1 . . . . 8 LEU CG . 19554 1 99 . 1 1 11 11 LEU CD1 C 13 24.96 0.25 . 2 . . . . 8 LEU CD1 . 19554 1 100 . 1 1 11 11 LEU CD2 C 13 23.28 0.25 . 2 . . . . 8 LEU CD2 . 19554 1 101 . 1 1 11 11 LEU N N 15 122.27 0.15 . 1 . . . . 8 LEU N . 19554 1 102 . 1 1 12 12 PHE H H 1 8.12 0.02 . 1 . . . . 9 PHE H . 19554 1 103 . 1 1 12 12 PHE HA H 1 4.42 0.02 . 1 . . . . 9 PHE HA . 19554 1 104 . 1 1 12 12 PHE HB2 H 1 2.86 0.02 . 2 . . . . 9 PHE HB2 . 19554 1 105 . 1 1 12 12 PHE HB3 H 1 3.02 0.02 . 2 . . . . 9 PHE HB3 . 19554 1 106 . 1 1 12 12 PHE HD1 H 1 7.09 0.02 . 3 . . . . 9 PHE HD1 . 19554 1 107 . 1 1 12 12 PHE HD2 H 1 7.09 0.02 . 3 . . . . 9 PHE HD2 . 19554 1 108 . 1 1 12 12 PHE HE1 H 1 7.18 0.02 . 3 . . . . 9 PHE HE1 . 19554 1 109 . 1 1 12 12 PHE HE2 H 1 7.18 0.02 . 3 . . . . 9 PHE HE2 . 19554 1 110 . 1 1 12 12 PHE C C 13 176.07 0.25 . 1 . . . . 9 PHE C . 19554 1 111 . 1 1 12 12 PHE CA C 13 58.24 0.25 . 1 . . . . 9 PHE CA . 19554 1 112 . 1 1 12 12 PHE CB C 13 39.23 0.25 . 1 . . . . 9 PHE CB . 19554 1 113 . 1 1 12 12 PHE N N 15 120.29 0.15 . 1 . . . . 9 PHE N . 19554 1 114 . 1 1 13 13 GLU H H 1 8.15 0.02 . 1 . . . . 10 GLU H . 19554 1 115 . 1 1 13 13 GLU HA H 1 4.04 0.02 . 1 . . . . 10 GLU HA . 19554 1 116 . 1 1 13 13 GLU HB2 H 1 1.91 0.02 . 2 . . . . 10 GLU HB2 . 19554 1 117 . 1 1 13 13 GLU HB3 H 1 1.84 0.02 . 2 . . . . 10 GLU HB3 . 19554 1 118 . 1 1 13 13 GLU HG2 H 1 2.12 0.02 . 1 . . . . 10 GLU HG2 . 19554 1 119 . 1 1 13 13 GLU C C 13 176.96 0.25 . 1 . . . . 10 GLU C . 19554 1 120 . 1 1 13 13 GLU CA C 13 56.90 0.25 . 1 . . . . 10 GLU CA . 19554 1 121 . 1 1 13 13 GLU CB C 13 29.68 0.25 . 1 . . . . 10 GLU CB . 19554 1 122 . 1 1 13 13 GLU N N 15 121.66 0.15 . 1 . . . . 10 GLU N . 19554 1 123 . 1 1 14 14 GLU H H 1 8.17 0.02 . 1 . . . . 11 GLU H . 19554 1 124 . 1 1 14 14 GLU HA H 1 4.18 0.02 . 1 . . . . 11 GLU HA . 19554 1 125 . 1 1 14 14 GLU N N 15 122.51 0.15 . 1 . . . . 11 GLU N . 19554 1 126 . 1 1 15 15 SER HA H 1 4.26 0.02 . 1 . . . . 12 SER HA . 19554 1 127 . 1 1 15 15 SER HB2 H 1 3.73 0.02 . 2 . . . . 12 SER HB2 . 19554 1 128 . 1 1 15 15 SER HB3 H 1 3.68 0.02 . 2 . . . . 12 SER HB3 . 19554 1 129 . 1 1 15 15 SER C C 13 174.84 0.25 . 1 . . . . 12 SER C . 19554 1 130 . 1 1 15 15 SER CA C 13 58.37 0.25 . 1 . . . . 12 SER CA . 19554 1 131 . 1 1 15 15 SER CB C 13 63.45 0.25 . 1 . . . . 12 SER CB . 19554 1 132 . 1 1 16 16 LEU H H 1 7.95 0.02 . 1 . . . . 13 LEU H . 19554 1 133 . 1 1 16 16 LEU HA H 1 4.15 0.02 . 1 . . . . 13 LEU HA . 19554 1 134 . 1 1 16 16 LEU HB2 H 1 1.51 0.02 . 2 . . . . 13 LEU HB2 . 19554 1 135 . 1 1 16 16 LEU HB3 H 1 1.44 0.02 . 2 . . . . 13 LEU HB3 . 19554 1 136 . 1 1 16 16 LEU HD11 H 1 0.74 0.02 . 1 . . . . 13 LEU HD11 . 19554 1 137 . 1 1 16 16 LEU HD12 H 1 0.74 0.02 . 1 . . . . 13 LEU HD12 . 19554 1 138 . 1 1 16 16 LEU HD13 H 1 0.74 0.02 . 1 . . . . 13 LEU HD13 . 19554 1 139 . 1 1 16 16 LEU C C 13 177.56 0.25 . 1 . . . . 13 LEU C . 19554 1 140 . 1 1 16 16 LEU CA C 13 55.51 0.25 . 1 . . . . 13 LEU CA . 19554 1 141 . 1 1 16 16 LEU CB C 13 42.19 0.25 . 1 . . . . 13 LEU CB . 19554 1 142 . 1 1 16 16 LEU CG C 13 26.94 0.25 . 1 . . . . 13 LEU CG . 19554 1 143 . 1 1 16 16 LEU CD1 C 13 23.57 0.25 . 2 . . . . 13 LEU CD1 . 19554 1 144 . 1 1 16 16 LEU CD2 C 13 24.99 0.25 . 2 . . . . 13 LEU CD2 . 19554 1 145 . 1 1 16 16 LEU N N 15 123.28 0.15 . 1 . . . . 13 LEU N . 19554 1 146 . 1 1 17 17 LYS H H 1 7.93 0.02 . 1 . . . . 14 LYS H . 19554 1 147 . 1 1 17 17 LYS HA H 1 4.13 0.02 . 1 . . . . 14 LYS HA . 19554 1 148 . 1 1 17 17 LYS HB2 H 1 1.72 0.02 . 2 . . . . 14 LYS HB2 . 19554 1 149 . 1 1 17 17 LYS HB3 H 1 1.66 0.02 . 2 . . . . 14 LYS HB3 . 19554 1 150 . 1 1 17 17 LYS HG2 H 1 1.30 0.02 . 2 . . . . 14 LYS HG2 . 19554 1 151 . 1 1 17 17 LYS HG3 H 1 1.36 0.02 . 2 . . . . 14 LYS HG3 . 19554 1 152 . 1 1 17 17 LYS HE3 H 1 2.87 0.02 . 1 . . . . 14 LYS HE3 . 19554 1 153 . 1 1 17 17 LYS C C 13 176.74 0.25 . 1 . . . . 14 LYS C . 19554 1 154 . 1 1 17 17 LYS CA C 13 56.82 0.25 . 1 . . . . 14 LYS CA . 19554 1 155 . 1 1 17 17 LYS CB C 13 32.78 0.25 . 1 . . . . 14 LYS CB . 19554 1 156 . 1 1 17 17 LYS CG C 13 24.67 0.25 . 1 . . . . 14 LYS CG . 19554 1 157 . 1 1 17 17 LYS CD C 13 29.00 0.25 . 1 . . . . 14 LYS CD . 19554 1 158 . 1 1 17 17 LYS CE C 13 41.90 0.25 . 1 . . . . 14 LYS CE . 19554 1 159 . 1 1 17 17 LYS N N 15 120.90 0.15 . 1 . . . . 14 LYS N . 19554 1 160 . 1 1 18 18 GLU H H 1 8.13 0.02 . 1 . . . . 15 GLU H . 19554 1 161 . 1 1 18 18 GLU HA H 1 4.16 0.02 . 1 . . . . 15 GLU HA . 19554 1 162 . 1 1 18 18 GLU C C 13 176.49 0.25 . 1 . . . . 15 GLU C . 19554 1 163 . 1 1 18 18 GLU CA C 13 56.90 0.25 . 1 . . . . 15 GLU CA . 19554 1 164 . 1 1 18 18 GLU CB C 13 29.45 0.25 . 1 . . . . 15 GLU CB . 19554 1 165 . 1 1 18 18 GLU CG C 13 36.31 0.25 . 1 . . . . 15 GLU CG . 19554 1 166 . 1 1 18 18 GLU N N 15 121.14 0.15 . 1 . . . . 15 GLU N . 19554 1 167 . 1 1 19 19 ILE H H 1 8.01 0.02 . 1 . . . . 16 ILE H . 19554 1 168 . 1 1 19 19 ILE HA H 1 4.00 0.02 . 1 . . . . 16 ILE HA . 19554 1 169 . 1 1 19 19 ILE HB H 1 1.75 0.02 . 1 . . . . 16 ILE HB . 19554 1 170 . 1 1 19 19 ILE HG12 H 1 1.07 0.02 . 2 . . . . 16 ILE HG12 . 19554 1 171 . 1 1 19 19 ILE HG13 H 1 1.37 0.02 . 2 . . . . 16 ILE HG13 . 19554 1 172 . 1 1 19 19 ILE HG21 H 1 0.78 0.02 . 1 . . . . 16 ILE HG21 . 19554 1 173 . 1 1 19 19 ILE HG22 H 1 0.78 0.02 . 1 . . . . 16 ILE HG22 . 19554 1 174 . 1 1 19 19 ILE HG23 H 1 0.78 0.02 . 1 . . . . 16 ILE HG23 . 19554 1 175 . 1 1 19 19 ILE HD11 H 1 0.73 0.02 . 1 . . . . 16 ILE HD11 . 19554 1 176 . 1 1 19 19 ILE HD12 H 1 0.73 0.02 . 1 . . . . 16 ILE HD12 . 19554 1 177 . 1 1 19 19 ILE HD13 H 1 0.73 0.02 . 1 . . . . 16 ILE HD13 . 19554 1 178 . 1 1 19 19 ILE C C 13 175.69 0.25 . 1 . . . . 16 ILE C . 19554 1 179 . 1 1 19 19 ILE CA C 13 61.20 0.25 . 1 . . . . 16 ILE CA . 19554 1 180 . 1 1 19 19 ILE CB C 13 38.62 0.25 . 1 . . . . 16 ILE CB . 19554 1 181 . 1 1 19 19 ILE CG1 C 13 27.27 0.25 . 1 . . . . 16 ILE CG1 . 19554 1 182 . 1 1 19 19 ILE CG2 C 13 17.45 0.25 . 1 . . . . 16 ILE CG2 . 19554 1 183 . 1 1 19 19 ILE CD1 C 13 13.01 0.25 . 1 . . . . 16 ILE CD1 . 19554 1 184 . 1 1 19 19 ILE N N 15 120.71 0.15 . 1 . . . . 16 ILE N . 19554 1 185 . 1 1 20 20 GLU H H 1 8.30 0.02 . 1 . . . . 17 GLU H . 19554 1 186 . 1 1 20 20 GLU HA H 1 4.21 0.02 . 1 . . . . 17 GLU HA . 19554 1 187 . 1 1 20 20 GLU HB2 H 1 1.89 0.02 . 2 . . . . 17 GLU HB2 . 19554 1 188 . 1 1 20 20 GLU HB3 H 1 1.91 0.02 . 2 . . . . 17 GLU HB3 . 19554 1 189 . 1 1 20 20 GLU HG2 H 1 2.15 0.02 . 1 . . . . 17 GLU HG2 . 19554 1 190 . 1 1 20 20 GLU C C 13 176.39 0.25 . 1 . . . . 17 GLU C . 19554 1 191 . 1 1 20 20 GLU CA C 13 56.52 0.25 . 1 . . . . 17 GLU CA . 19554 1 192 . 1 1 20 20 GLU CB C 13 29.59 0.25 . 1 . . . . 17 GLU CB . 19554 1 193 . 1 1 20 20 GLU CG C 13 36.32 0.25 . 1 . . . . 17 GLU CG . 19554 1 194 . 1 1 20 20 GLU N N 15 124.38 0.15 . 1 . . . . 17 GLU N . 19554 1 195 . 1 1 21 21 THR H H 1 8.06 0.02 . 1 . . . . 18 THR H . 19554 1 196 . 1 1 21 21 THR HA H 1 4.20 0.02 . 1 . . . . 18 THR HA . 19554 1 197 . 1 1 21 21 THR HB H 1 4.04 0.02 . 1 . . . . 18 THR HB . 19554 1 198 . 1 1 21 21 THR HG21 H 1 1.06 0.02 . 1 . . . . 18 THR HG21 . 19554 1 199 . 1 1 21 21 THR HG22 H 1 1.06 0.02 . 1 . . . . 18 THR HG22 . 19554 1 200 . 1 1 21 21 THR HG23 H 1 1.06 0.02 . 1 . . . . 18 THR HG23 . 19554 1 201 . 1 1 21 21 THR C C 13 174.20 0.25 . 1 . . . . 18 THR C . 19554 1 202 . 1 1 21 21 THR CA C 13 61.56 0.25 . 1 . . . . 18 THR CA . 19554 1 203 . 1 1 21 21 THR CB C 13 69.61 0.25 . 1 . . . . 18 THR CB . 19554 1 204 . 1 1 21 21 THR CG2 C 13 21.58 0.25 . 1 . . . . 18 THR CG2 . 19554 1 205 . 1 1 21 21 THR N N 15 115.78 0.15 . 1 . . . . 18 THR N . 19554 1 206 . 1 1 22 22 ARG H H 1 8.33 0.02 . 1 . . . . 19 ARG H . 19554 1 207 . 1 1 22 22 ARG HA H 1 4.52 0.02 . 1 . . . . 19 ARG HA . 19554 1 208 . 1 1 22 22 ARG HB2 H 1 1.63 0.02 . 2 . . . . 19 ARG HB2 . 19554 1 209 . 1 1 22 22 ARG HB3 H 1 1.73 0.02 . 2 . . . . 19 ARG HB3 . 19554 1 210 . 1 1 22 22 ARG HG2 H 1 1.54 0.02 . 2 . . . . 19 ARG HG2 . 19554 1 211 . 1 1 22 22 ARG HG3 H 1 1.55 0.02 . 2 . . . . 19 ARG HG3 . 19554 1 212 . 1 1 22 22 ARG HD2 H 1 3.07 0.02 . 1 . . . . 19 ARG HD2 . 19554 1 213 . 1 1 22 22 ARG HD3 H 1 3.07 0.02 . 1 . . . . 19 ARG HD3 . 19554 1 214 . 1 1 22 22 ARG C C 13 174.15 0.25 . 1 . . . . 19 ARG C . 19554 1 215 . 1 1 22 22 ARG CA C 13 53.86 0.25 . 1 . . . . 19 ARG CA . 19554 1 216 . 1 1 22 22 ARG CB C 13 30.10 0.25 . 1 . . . . 19 ARG CB . 19554 1 217 . 1 1 22 22 ARG CG C 13 26.73 0.25 . 1 . . . . 19 ARG CG . 19554 1 218 . 1 1 22 22 ARG CD C 13 43.17 0.25 . 1 . . . . 19 ARG CD . 19554 1 219 . 1 1 22 22 ARG N N 15 124.80 0.15 . 1 . . . . 19 ARG N . 19554 1 220 . 1 1 23 23 PRO HA H 1 4.31 0.02 . 1 . . . . 20 PRO HA . 19554 1 221 . 1 1 23 23 PRO HB2 H 1 1.82 0.02 . 2 . . . . 20 PRO HB2 . 19554 1 222 . 1 1 23 23 PRO HB3 H 1 2.19 0.02 . 2 . . . . 20 PRO HB3 . 19554 1 223 . 1 1 23 23 PRO HG2 H 1 1.88 0.02 . 2 . . . . 20 PRO HG2 . 19554 1 224 . 1 1 23 23 PRO HG3 H 1 1.95 0.02 . 2 . . . . 20 PRO HG3 . 19554 1 225 . 1 1 23 23 PRO HD2 H 1 3.71 0.02 . 2 . . . . 20 PRO HD2 . 19554 1 226 . 1 1 23 23 PRO HD3 H 1 3.52 0.02 . 2 . . . . 20 PRO HD3 . 19554 1 227 . 1 1 23 23 PRO C C 13 177.35 0.25 . 1 . . . . 20 PRO C . 19554 1 228 . 1 1 23 23 PRO CA C 13 63.38 0.25 . 1 . . . . 20 PRO CA . 19554 1 229 . 1 1 23 23 PRO CB C 13 32.01 0.25 . 1 . . . . 20 PRO CB . 19554 1 230 . 1 1 23 23 PRO CG C 13 27.36 0.25 . 1 . . . . 20 PRO CG . 19554 1 231 . 1 1 23 23 PRO CD C 13 50.56 0.25 . 1 . . . . 20 PRO CD . 19554 1 232 . 1 1 24 24 GLY H H 1 8.47 0.02 . 1 . . . . 21 GLY H . 19554 1 233 . 1 1 24 24 GLY HA2 H 1 3.86 0.02 . 1 . . . . 21 GLY HA2 . 19554 1 234 . 1 1 24 24 GLY HA3 H 1 3.86 0.02 . 1 . . . . 21 GLY HA3 . 19554 1 235 . 1 1 24 24 GLY C C 13 174.04 0.25 . 1 . . . . 21 GLY C . 19554 1 236 . 1 1 24 24 GLY CA C 13 45.11 0.25 . 1 . . . . 21 GLY CA . 19554 1 237 . 1 1 24 24 GLY N N 15 109.79 0.15 . 1 . . . . 21 GLY N . 19554 1 238 . 1 1 25 25 SER H H 1 8.10 0.02 . 1 . . . . 22 SER H . 19554 1 239 . 1 1 25 25 SER HA H 1 4.38 0.02 . 1 . . . . 22 SER HA . 19554 1 240 . 1 1 25 25 SER HB2 H 1 3.75 0.02 . 2 . . . . 22 SER HB2 . 19554 1 241 . 1 1 25 25 SER HB3 H 1 3.74 0.02 . 2 . . . . 22 SER HB3 . 19554 1 242 . 1 1 25 25 SER C C 13 173.11 0.25 . 1 . . . . 22 SER C . 19554 1 243 . 1 1 25 25 SER CA C 13 58.35 0.25 . 1 . . . . 22 SER CA . 19554 1 244 . 1 1 25 25 SER CB C 13 63.85 0.25 . 1 . . . . 22 SER CB . 19554 1 245 . 1 1 25 25 SER N N 15 115.12 0.15 . 1 . . . . 22 SER N . 19554 1 246 . 1 1 26 26 ILE H H 1 7.95 0.02 . 1 . . . . 23 ILE H . 19554 1 247 . 1 1 26 26 ILE HA H 1 4.67 0.02 . 1 . . . . 23 ILE HA . 19554 1 248 . 1 1 26 26 ILE HB H 1 1.61 0.02 . 1 . . . . 23 ILE HB . 19554 1 249 . 1 1 26 26 ILE HG12 H 1 0.98 0.02 . 2 . . . . 23 ILE HG12 . 19554 1 250 . 1 1 26 26 ILE HG13 H 1 1.33 0.02 . 2 . . . . 23 ILE HG13 . 19554 1 251 . 1 1 26 26 ILE HG21 H 1 0.64 0.02 . 1 . . . . 23 ILE HG21 . 19554 1 252 . 1 1 26 26 ILE HG22 H 1 0.64 0.02 . 1 . . . . 23 ILE HG22 . 19554 1 253 . 1 1 26 26 ILE HG23 H 1 0.64 0.02 . 1 . . . . 23 ILE HG23 . 19554 1 254 . 1 1 26 26 ILE HD11 H 1 0.63 0.02 . 1 . . . . 23 ILE HD11 . 19554 1 255 . 1 1 26 26 ILE HD12 H 1 0.63 0.02 . 1 . . . . 23 ILE HD12 . 19554 1 256 . 1 1 26 26 ILE HD13 H 1 0.63 0.02 . 1 . . . . 23 ILE HD13 . 19554 1 257 . 1 1 26 26 ILE C C 13 176.00 0.25 . 1 . . . . 23 ILE C . 19554 1 258 . 1 1 26 26 ILE CA C 13 59.64 0.25 . 1 . . . . 23 ILE CA . 19554 1 259 . 1 1 26 26 ILE CB C 13 39.31 0.25 . 1 . . . . 23 ILE CB . 19554 1 260 . 1 1 26 26 ILE CG1 C 13 27.14 0.25 . 1 . . . . 23 ILE CG1 . 19554 1 261 . 1 1 26 26 ILE CG2 C 13 17.70 0.25 . 1 . . . . 23 ILE CG2 . 19554 1 262 . 1 1 26 26 ILE CD1 C 13 12.21 0.25 . 1 . . . . 23 ILE CD1 . 19554 1 263 . 1 1 26 26 ILE N N 15 122.51 0.15 . 1 . . . . 23 ILE N . 19554 1 264 . 1 1 27 27 VAL H H 1 8.94 0.02 . 1 . . . . 24 VAL H . 19554 1 265 . 1 1 27 27 VAL HA H 1 4.45 0.02 . 1 . . . . 24 VAL HA . 19554 1 266 . 1 1 27 27 VAL HB H 1 2.03 0.02 . 1 . . . . 24 VAL HB . 19554 1 267 . 1 1 27 27 VAL HG11 H 1 0.75 0.02 . 2 . . . . 24 VAL HG11 . 19554 1 268 . 1 1 27 27 VAL HG12 H 1 0.75 0.02 . 2 . . . . 24 VAL HG12 . 19554 1 269 . 1 1 27 27 VAL HG13 H 1 0.75 0.02 . 2 . . . . 24 VAL HG13 . 19554 1 270 . 1 1 27 27 VAL HG21 H 1 0.78 0.02 . 2 . . . . 24 VAL HG21 . 19554 1 271 . 1 1 27 27 VAL HG22 H 1 0.78 0.02 . 2 . . . . 24 VAL HG22 . 19554 1 272 . 1 1 27 27 VAL HG23 H 1 0.78 0.02 . 2 . . . . 24 VAL HG23 . 19554 1 273 . 1 1 27 27 VAL C C 13 173.38 0.25 . 1 . . . . 24 VAL C . 19554 1 274 . 1 1 27 27 VAL CA C 13 59.48 0.25 . 1 . . . . 24 VAL CA . 19554 1 275 . 1 1 27 27 VAL CB C 13 34.95 0.25 . 1 . . . . 24 VAL CB . 19554 1 276 . 1 1 27 27 VAL CG1 C 13 19.85 0.25 . 2 . . . . 24 VAL CG1 . 19554 1 277 . 1 1 27 27 VAL CG2 C 13 21.44 0.25 . 2 . . . . 24 VAL CG2 . 19554 1 278 . 1 1 27 27 VAL N N 15 123.65 0.15 . 1 . . . . 24 VAL N . 19554 1 279 . 1 1 28 28 ARG H H 1 8.19 0.02 . 1 . . . . 25 ARG H . 19554 1 280 . 1 1 28 28 ARG HA H 1 5.03 0.02 . 1 . . . . 25 ARG HA . 19554 1 281 . 1 1 28 28 ARG HB2 H 1 1.70 0.02 . 2 . . . . 25 ARG HB2 . 19554 1 282 . 1 1 28 28 ARG HB3 H 1 1.60 0.02 . 2 . . . . 25 ARG HB3 . 19554 1 283 . 1 1 28 28 ARG HD2 H 1 3.03 0.02 . 1 . . . . 25 ARG HD2 . 19554 1 284 . 1 1 28 28 ARG C C 13 176.19 0.25 . 1 . . . . 25 ARG C . 19554 1 285 . 1 1 28 28 ARG CA C 13 54.22 0.25 . 1 . . . . 25 ARG CA . 19554 1 286 . 1 1 28 28 ARG CB C 13 30.70 0.25 . 1 . . . . 25 ARG CB . 19554 1 287 . 1 1 28 28 ARG CG C 13 26.50 0.25 . 1 . . . . 25 ARG CG . 19554 1 288 . 1 1 28 28 ARG CD C 13 42.77 0.25 . 1 . . . . 25 ARG CD . 19554 1 289 . 1 1 28 28 ARG N N 15 123.42 0.15 . 1 . . . . 25 ARG N . 19554 1 290 . 1 1 29 29 GLY H H 1 8.89 0.02 . 1 . . . . 26 GLY H . 19554 1 291 . 1 1 29 29 GLY HA2 H 1 3.17 0.02 . 2 . . . . 26 GLY HA2 . 19554 1 292 . 1 1 29 29 GLY HA3 H 1 4.67 0.02 . 2 . . . . 26 GLY HA3 . 19554 1 293 . 1 1 29 29 GLY C C 13 171.10 0.25 . 1 . . . . 26 GLY C . 19554 1 294 . 1 1 29 29 GLY CA C 13 43.93 0.25 . 1 . . . . 26 GLY CA . 19554 1 295 . 1 1 29 29 GLY N N 15 111.49 0.15 . 1 . . . . 26 GLY N . 19554 1 296 . 1 1 30 30 VAL H H 1 7.75 0.02 . 1 . . . . 27 VAL H . 19554 1 297 . 1 1 30 30 VAL HA H 1 4.79 0.02 . 1 . . . . 27 VAL HA . 19554 1 298 . 1 1 30 30 VAL HB H 1 1.79 0.02 . 1 . . . . 27 VAL HB . 19554 1 299 . 1 1 30 30 VAL HG11 H 1 0.74 0.02 . 2 . . . . 27 VAL HG11 . 19554 1 300 . 1 1 30 30 VAL HG12 H 1 0.74 0.02 . 2 . . . . 27 VAL HG12 . 19554 1 301 . 1 1 30 30 VAL HG13 H 1 0.74 0.02 . 2 . . . . 27 VAL HG13 . 19554 1 302 . 1 1 30 30 VAL HG21 H 1 0.82 0.02 . 2 . . . . 27 VAL HG21 . 19554 1 303 . 1 1 30 30 VAL HG22 H 1 0.82 0.02 . 2 . . . . 27 VAL HG22 . 19554 1 304 . 1 1 30 30 VAL HG23 H 1 0.82 0.02 . 2 . . . . 27 VAL HG23 . 19554 1 305 . 1 1 30 30 VAL C C 13 175.67 0.25 . 1 . . . . 27 VAL C . 19554 1 306 . 1 1 30 30 VAL CA C 13 59.72 0.25 . 1 . . . . 27 VAL CA . 19554 1 307 . 1 1 30 30 VAL CB C 13 35.04 0.25 . 1 . . . . 27 VAL CB . 19554 1 308 . 1 1 30 30 VAL CG1 C 13 20.68 0.25 . 2 . . . . 27 VAL CG1 . 19554 1 309 . 1 1 30 30 VAL CG2 C 13 21.49 0.25 . 2 . . . . 27 VAL CG2 . 19554 1 310 . 1 1 30 30 VAL N N 15 117.64 0.15 . 1 . . . . 27 VAL N . 19554 1 311 . 1 1 31 31 VAL H H 1 8.89 0.02 . 1 . . . . 28 VAL H . 19554 1 312 . 1 1 31 31 VAL HA H 1 3.78 0.02 . 1 . . . . 28 VAL HA . 19554 1 313 . 1 1 31 31 VAL HB H 1 2.08 0.02 . 1 . . . . 28 VAL HB . 19554 1 314 . 1 1 31 31 VAL HG11 H 1 0.58 0.02 . 2 . . . . 28 VAL HG11 . 19554 1 315 . 1 1 31 31 VAL HG12 H 1 0.58 0.02 . 2 . . . . 28 VAL HG12 . 19554 1 316 . 1 1 31 31 VAL HG13 H 1 0.58 0.02 . 2 . . . . 28 VAL HG13 . 19554 1 317 . 1 1 31 31 VAL HG21 H 1 0.54 0.02 . 2 . . . . 28 VAL HG21 . 19554 1 318 . 1 1 31 31 VAL HG22 H 1 0.54 0.02 . 2 . . . . 28 VAL HG22 . 19554 1 319 . 1 1 31 31 VAL HG23 H 1 0.54 0.02 . 2 . . . . 28 VAL HG23 . 19554 1 320 . 1 1 31 31 VAL C C 13 176.99 0.25 . 1 . . . . 28 VAL C . 19554 1 321 . 1 1 31 31 VAL CA C 13 63.89 0.25 . 1 . . . . 28 VAL CA . 19554 1 322 . 1 1 31 31 VAL CB C 13 31.50 0.25 . 1 . . . . 28 VAL CB . 19554 1 323 . 1 1 31 31 VAL CG1 C 13 22.15 0.25 . 2 . . . . 28 VAL CG1 . 19554 1 324 . 1 1 31 31 VAL CG2 C 13 22.17 0.25 . 2 . . . . 28 VAL CG2 . 19554 1 325 . 1 1 31 31 VAL N N 15 126.69 0.15 . 1 . . . . 28 VAL N . 19554 1 326 . 1 1 32 32 VAL H H 1 9.18 0.02 . 1 . . . . 29 VAL H . 19554 1 327 . 1 1 32 32 VAL HA H 1 4.31 0.02 . 1 . . . . 29 VAL HA . 19554 1 328 . 1 1 32 32 VAL HB H 1 1.98 0.02 . 1 . . . . 29 VAL HB . 19554 1 329 . 1 1 32 32 VAL HG11 H 1 0.75 0.02 . 2 . . . . 29 VAL HG11 . 19554 1 330 . 1 1 32 32 VAL HG12 H 1 0.75 0.02 . 2 . . . . 29 VAL HG12 . 19554 1 331 . 1 1 32 32 VAL HG13 H 1 0.75 0.02 . 2 . . . . 29 VAL HG13 . 19554 1 332 . 1 1 32 32 VAL HG21 H 1 0.89 0.02 . 2 . . . . 29 VAL HG21 . 19554 1 333 . 1 1 32 32 VAL HG22 H 1 0.89 0.02 . 2 . . . . 29 VAL HG22 . 19554 1 334 . 1 1 32 32 VAL HG23 H 1 0.89 0.02 . 2 . . . . 29 VAL HG23 . 19554 1 335 . 1 1 32 32 VAL C C 13 175.62 0.25 . 1 . . . . 29 VAL C . 19554 1 336 . 1 1 32 32 VAL CA C 13 62.17 0.25 . 1 . . . . 29 VAL CA . 19554 1 337 . 1 1 32 32 VAL CB C 13 33.20 0.25 . 1 . . . . 29 VAL CB . 19554 1 338 . 1 1 32 32 VAL CG1 C 13 19.96 0.25 . 2 . . . . 29 VAL CG1 . 19554 1 339 . 1 1 32 32 VAL CG2 C 13 21.67 0.25 . 2 . . . . 29 VAL CG2 . 19554 1 340 . 1 1 32 32 VAL N N 15 126.29 0.15 . 1 . . . . 29 VAL N . 19554 1 341 . 1 1 33 33 ALA H H 1 7.65 0.02 . 1 . . . . 30 ALA H . 19554 1 342 . 1 1 33 33 ALA HA H 1 4.32 0.02 . 1 . . . . 30 ALA HA . 19554 1 343 . 1 1 33 33 ALA HB1 H 1 1.29 0.02 . 1 . . . . 30 ALA HB1 . 19554 1 344 . 1 1 33 33 ALA HB2 H 1 1.29 0.02 . 1 . . . . 30 ALA HB2 . 19554 1 345 . 1 1 33 33 ALA HB3 H 1 1.29 0.02 . 1 . . . . 30 ALA HB3 . 19554 1 346 . 1 1 33 33 ALA C C 13 174.35 0.25 . 1 . . . . 30 ALA C . 19554 1 347 . 1 1 33 33 ALA CA C 13 52.39 0.25 . 1 . . . . 30 ALA CA . 19554 1 348 . 1 1 33 33 ALA CB C 13 21.91 0.25 . 1 . . . . 30 ALA CB . 19554 1 349 . 1 1 33 33 ALA N N 15 121.33 0.15 . 1 . . . . 30 ALA N . 19554 1 350 . 1 1 34 34 ILE H H 1 8.46 0.02 . 1 . . . . 31 ILE H . 19554 1 351 . 1 1 34 34 ILE HA H 1 4.27 0.02 . 1 . . . . 31 ILE HA . 19554 1 352 . 1 1 34 34 ILE HB H 1 1.44 0.02 . 1 . . . . 31 ILE HB . 19554 1 353 . 1 1 34 34 ILE HG12 H 1 1.17 0.02 . 2 . . . . 31 ILE HG12 . 19554 1 354 . 1 1 34 34 ILE HG13 H 1 0.65 0.02 . 2 . . . . 31 ILE HG13 . 19554 1 355 . 1 1 34 34 ILE HG21 H 1 0.65 0.02 . 1 . . . . 31 ILE HG21 . 19554 1 356 . 1 1 34 34 ILE HG22 H 1 0.65 0.02 . 1 . . . . 31 ILE HG22 . 19554 1 357 . 1 1 34 34 ILE HG23 H 1 0.65 0.02 . 1 . . . . 31 ILE HG23 . 19554 1 358 . 1 1 34 34 ILE HD11 H 1 0.58 0.02 . 1 . . . . 31 ILE HD11 . 19554 1 359 . 1 1 34 34 ILE HD12 H 1 0.58 0.02 . 1 . . . . 31 ILE HD12 . 19554 1 360 . 1 1 34 34 ILE HD13 H 1 0.58 0.02 . 1 . . . . 31 ILE HD13 . 19554 1 361 . 1 1 34 34 ILE C C 13 174.34 0.25 . 1 . . . . 31 ILE C . 19554 1 362 . 1 1 34 34 ILE CA C 13 61.52 0.25 . 1 . . . . 31 ILE CA . 19554 1 363 . 1 1 34 34 ILE CB C 13 41.19 0.25 . 1 . . . . 31 ILE CB . 19554 1 364 . 1 1 34 34 ILE CG1 C 13 27.96 0.25 . 1 . . . . 31 ILE CG1 . 19554 1 365 . 1 1 34 34 ILE CG2 C 13 17.58 0.25 . 1 . . . . 31 ILE CG2 . 19554 1 366 . 1 1 34 34 ILE CD1 C 13 14.65 0.25 . 1 . . . . 31 ILE CD1 . 19554 1 367 . 1 1 34 34 ILE N N 15 120.33 0.15 . 1 . . . . 31 ILE N . 19554 1 368 . 1 1 35 35 ASP H H 1 8.51 0.02 . 1 . . . . 32 ASP H . 19554 1 369 . 1 1 35 35 ASP HA H 1 4.72 0.02 . 1 . . . . 32 ASP HA . 19554 1 370 . 1 1 35 35 ASP HB2 H 1 2.63 0.02 . 2 . . . . 32 ASP HB2 . 19554 1 371 . 1 1 35 35 ASP HB3 H 1 2.57 0.02 . 2 . . . . 32 ASP HB3 . 19554 1 372 . 1 1 35 35 ASP C C 13 174.69 0.25 . 1 . . . . 32 ASP C . 19554 1 373 . 1 1 35 35 ASP CA C 13 52.63 0.25 . 1 . . . . 32 ASP CA . 19554 1 374 . 1 1 35 35 ASP CB C 13 42.84 0.25 . 1 . . . . 32 ASP CB . 19554 1 375 . 1 1 35 35 ASP N N 15 128.17 0.15 . 1 . . . . 32 ASP N . 19554 1 376 . 1 1 36 36 LYS H H 1 8.44 0.02 . 1 . . . . 33 LYS H . 19554 1 377 . 1 1 36 36 LYS HA H 1 3.75 0.02 . 1 . . . . 33 LYS HA . 19554 1 378 . 1 1 36 36 LYS HB2 H 1 1.79 0.02 . 2 . . . . 33 LYS HB2 . 19554 1 379 . 1 1 36 36 LYS HB3 H 1 1.69 0.02 . 2 . . . . 33 LYS HB3 . 19554 1 380 . 1 1 36 36 LYS HG2 H 1 1.30 0.02 . 2 . . . . 33 LYS HG2 . 19554 1 381 . 1 1 36 36 LYS HG3 H 1 1.36 0.02 . 2 . . . . 33 LYS HG3 . 19554 1 382 . 1 1 36 36 LYS HD2 H 1 1.60 0.02 . 2 . . . . 33 LYS HD2 . 19554 1 383 . 1 1 36 36 LYS HD3 H 1 1.57 0.02 . 2 . . . . 33 LYS HD3 . 19554 1 384 . 1 1 36 36 LYS HE2 H 1 2.91 0.02 . 2 . . . . 33 LYS HE2 . 19554 1 385 . 1 1 36 36 LYS HE3 H 1 2.85 0.02 . 2 . . . . 33 LYS HE3 . 19554 1 386 . 1 1 36 36 LYS C C 13 175.88 0.25 . 1 . . . . 33 LYS C . 19554 1 387 . 1 1 36 36 LYS CA C 13 58.70 0.25 . 1 . . . . 33 LYS CA . 19554 1 388 . 1 1 36 36 LYS CB C 13 31.10 0.25 . 1 . . . . 33 LYS CB . 19554 1 389 . 1 1 36 36 LYS CG C 13 24.49 0.25 . 1 . . . . 33 LYS CG . 19554 1 390 . 1 1 36 36 LYS CD C 13 28.83 0.25 . 1 . . . . 33 LYS CD . 19554 1 391 . 1 1 36 36 LYS CE C 13 41.70 0.25 . 1 . . . . 33 LYS CE . 19554 1 392 . 1 1 36 36 LYS N N 15 118.54 0.15 . 1 . . . . 33 LYS N . 19554 1 393 . 1 1 37 37 ASP H H 1 8.61 0.02 . 1 . . . . 34 ASP H . 19554 1 394 . 1 1 37 37 ASP HA H 1 4.68 0.02 . 1 . . . . 34 ASP HA . 19554 1 395 . 1 1 37 37 ASP HB2 H 1 2.73 0.02 . 2 . . . . 34 ASP HB2 . 19554 1 396 . 1 1 37 37 ASP HB3 H 1 2.63 0.02 . 2 . . . . 34 ASP HB3 . 19554 1 397 . 1 1 37 37 ASP C C 13 176.51 0.25 . 1 . . . . 34 ASP C . 19554 1 398 . 1 1 37 37 ASP CA C 13 55.07 0.25 . 1 . . . . 34 ASP CA . 19554 1 399 . 1 1 37 37 ASP CB C 13 42.00 0.25 . 1 . . . . 34 ASP CB . 19554 1 400 . 1 1 37 37 ASP N N 15 116.09 0.15 . 1 . . . . 34 ASP N . 19554 1 401 . 1 1 38 38 VAL H H 1 8.10 0.02 . 1 . . . . 35 VAL H . 19554 1 402 . 1 1 38 38 VAL HA H 1 4.55 0.02 . 1 . . . . 35 VAL HA . 19554 1 403 . 1 1 38 38 VAL HB H 1 1.81 0.02 . 1 . . . . 35 VAL HB . 19554 1 404 . 1 1 38 38 VAL HG11 H 1 0.74 0.02 . 2 . . . . 35 VAL HG11 . 19554 1 405 . 1 1 38 38 VAL HG12 H 1 0.74 0.02 . 2 . . . . 35 VAL HG12 . 19554 1 406 . 1 1 38 38 VAL HG13 H 1 0.74 0.02 . 2 . . . . 35 VAL HG13 . 19554 1 407 . 1 1 38 38 VAL HG21 H 1 0.69 0.02 . 2 . . . . 35 VAL HG21 . 19554 1 408 . 1 1 38 38 VAL HG22 H 1 0.69 0.02 . 2 . . . . 35 VAL HG22 . 19554 1 409 . 1 1 38 38 VAL HG23 H 1 0.69 0.02 . 2 . . . . 35 VAL HG23 . 19554 1 410 . 1 1 38 38 VAL C C 13 172.77 0.25 . 1 . . . . 35 VAL C . 19554 1 411 . 1 1 38 38 VAL CA C 13 61.10 0.25 . 1 . . . . 35 VAL CA . 19554 1 412 . 1 1 38 38 VAL CB C 13 36.11 0.25 . 1 . . . . 35 VAL CB . 19554 1 413 . 1 1 38 38 VAL CG1 C 13 20.56 0.25 . 2 . . . . 35 VAL CG1 . 19554 1 414 . 1 1 38 38 VAL CG2 C 13 21.74 0.25 . 2 . . . . 35 VAL CG2 . 19554 1 415 . 1 1 38 38 VAL N N 15 120.83 0.15 . 1 . . . . 35 VAL N . 19554 1 416 . 1 1 39 39 VAL H H 1 9.04 0.02 . 1 . . . . 36 VAL H . 19554 1 417 . 1 1 39 39 VAL HA H 1 4.18 0.02 . 1 . . . . 36 VAL HA . 19554 1 418 . 1 1 39 39 VAL HG11 H 1 0.69 0.02 . 2 . . . . 36 VAL HG11 . 19554 1 419 . 1 1 39 39 VAL HG12 H 1 0.69 0.02 . 2 . . . . 36 VAL HG12 . 19554 1 420 . 1 1 39 39 VAL HG13 H 1 0.69 0.02 . 2 . . . . 36 VAL HG13 . 19554 1 421 . 1 1 39 39 VAL HG21 H 1 0.44 0.02 . 2 . . . . 36 VAL HG21 . 19554 1 422 . 1 1 39 39 VAL HG22 H 1 0.44 0.02 . 2 . . . . 36 VAL HG22 . 19554 1 423 . 1 1 39 39 VAL HG23 H 1 0.44 0.02 . 2 . . . . 36 VAL HG23 . 19554 1 424 . 1 1 39 39 VAL C C 13 174.14 0.25 . 1 . . . . 36 VAL C . 19554 1 425 . 1 1 39 39 VAL CA C 13 61.02 0.25 . 1 . . . . 36 VAL CA . 19554 1 426 . 1 1 39 39 VAL CB C 13 33.61 0.25 . 1 . . . . 36 VAL CB . 19554 1 427 . 1 1 39 39 VAL CG2 C 13 21.79 0.25 . 1 . . . . 36 VAL CG2 . 19554 1 428 . 1 1 39 39 VAL N N 15 125.49 0.15 . 1 . . . . 36 VAL N . 19554 1 429 . 1 1 40 40 LEU H H 1 8.68 0.02 . 1 . . . . 37 LEU H . 19554 1 430 . 1 1 40 40 LEU HA H 1 5.07 0.02 . 1 . . . . 37 LEU HA . 19554 1 431 . 1 1 40 40 LEU HB2 H 1 1.50 0.02 . 2 . . . . 37 LEU HB2 . 19554 1 432 . 1 1 40 40 LEU HB3 H 1 1.13 0.02 . 2 . . . . 37 LEU HB3 . 19554 1 433 . 1 1 40 40 LEU HG H 1 1.34 0.02 . 1 . . . . 37 LEU HG . 19554 1 434 . 1 1 40 40 LEU HD11 H 1 0.65 0.02 . 2 . . . . 37 LEU HD11 . 19554 1 435 . 1 1 40 40 LEU HD12 H 1 0.65 0.02 . 2 . . . . 37 LEU HD12 . 19554 1 436 . 1 1 40 40 LEU HD13 H 1 0.65 0.02 . 2 . . . . 37 LEU HD13 . 19554 1 437 . 1 1 40 40 LEU HD21 H 1 0.67 0.02 . 2 . . . . 37 LEU HD21 . 19554 1 438 . 1 1 40 40 LEU HD22 H 1 0.67 0.02 . 2 . . . . 37 LEU HD22 . 19554 1 439 . 1 1 40 40 LEU HD23 H 1 0.67 0.02 . 2 . . . . 37 LEU HD23 . 19554 1 440 . 1 1 40 40 LEU C C 13 176.61 0.25 . 1 . . . . 37 LEU C . 19554 1 441 . 1 1 40 40 LEU CA C 13 53.29 0.25 . 1 . . . . 37 LEU CA . 19554 1 442 . 1 1 40 40 LEU CB C 13 43.28 0.25 . 1 . . . . 37 LEU CB . 19554 1 443 . 1 1 40 40 LEU CG C 13 27.11 0.25 . 1 . . . . 37 LEU CG . 19554 1 444 . 1 1 40 40 LEU CD1 C 13 23.75 0.25 . 2 . . . . 37 LEU CD1 . 19554 1 445 . 1 1 40 40 LEU CD2 C 13 24.41 0.25 . 2 . . . . 37 LEU CD2 . 19554 1 446 . 1 1 40 40 LEU N N 15 127.38 0.15 . 1 . . . . 37 LEU N . 19554 1 447 . 1 1 41 41 VAL H H 1 9.11 0.02 . 1 . . . . 38 VAL H . 19554 1 448 . 1 1 41 41 VAL HA H 1 4.65 0.02 . 1 . . . . 38 VAL HA . 19554 1 449 . 1 1 41 41 VAL HB H 1 1.66 0.02 . 1 . . . . 38 VAL HB . 19554 1 450 . 1 1 41 41 VAL HG11 H 1 0.51 0.02 . 2 . . . . 38 VAL HG11 . 19554 1 451 . 1 1 41 41 VAL HG12 H 1 0.51 0.02 . 2 . . . . 38 VAL HG12 . 19554 1 452 . 1 1 41 41 VAL HG13 H 1 0.51 0.02 . 2 . . . . 38 VAL HG13 . 19554 1 453 . 1 1 41 41 VAL HG21 H 1 0.66 0.02 . 2 . . . . 38 VAL HG21 . 19554 1 454 . 1 1 41 41 VAL HG22 H 1 0.66 0.02 . 2 . . . . 38 VAL HG22 . 19554 1 455 . 1 1 41 41 VAL HG23 H 1 0.66 0.02 . 2 . . . . 38 VAL HG23 . 19554 1 456 . 1 1 41 41 VAL C C 13 174.48 0.25 . 1 . . . . 38 VAL C . 19554 1 457 . 1 1 41 41 VAL CA C 13 59.79 0.25 . 1 . . . . 38 VAL CA . 19554 1 458 . 1 1 41 41 VAL CB C 13 35.40 0.25 . 1 . . . . 38 VAL CB . 19554 1 459 . 1 1 41 41 VAL CG1 C 13 21.07 0.25 . 2 . . . . 38 VAL CG1 . 19554 1 460 . 1 1 41 41 VAL CG2 C 13 21.84 0.25 . 2 . . . . 38 VAL CG2 . 19554 1 461 . 1 1 41 41 VAL N N 15 123.21 0.15 . 1 . . . . 38 VAL N . 19554 1 462 . 1 1 42 42 ASP H H 1 9.13 0.02 . 1 . . . . 39 ASP H . 19554 1 463 . 1 1 42 42 ASP HA H 1 4.86 0.02 . 1 . . . . 39 ASP HA . 19554 1 464 . 1 1 42 42 ASP HB2 H 1 2.83 0.02 . 2 . . . . 39 ASP HB2 . 19554 1 465 . 1 1 42 42 ASP HB3 H 1 2.44 0.02 . 2 . . . . 39 ASP HB3 . 19554 1 466 . 1 1 42 42 ASP C C 13 175.67 0.25 . 1 . . . . 39 ASP C . 19554 1 467 . 1 1 42 42 ASP CA C 13 52.62 0.25 . 1 . . . . 39 ASP CA . 19554 1 468 . 1 1 42 42 ASP CB C 13 41.03 0.25 . 1 . . . . 39 ASP CB . 19554 1 469 . 1 1 42 42 ASP N N 15 124.79 0.15 . 1 . . . . 39 ASP N . 19554 1 470 . 1 1 43 43 ALA H H 1 9.20 0.02 . 1 . . . . 40 ALA H . 19554 1 471 . 1 1 43 43 ALA HA H 1 4.73 0.02 . 1 . . . . 40 ALA HA . 19554 1 472 . 1 1 43 43 ALA HB1 H 1 1.13 0.02 . 1 . . . . 40 ALA HB1 . 19554 1 473 . 1 1 43 43 ALA HB2 H 1 1.13 0.02 . 1 . . . . 40 ALA HB2 . 19554 1 474 . 1 1 43 43 ALA HB3 H 1 1.13 0.02 . 1 . . . . 40 ALA HB3 . 19554 1 475 . 1 1 43 43 ALA C C 13 176.40 0.25 . 1 . . . . 40 ALA C . 19554 1 476 . 1 1 43 43 ALA CA C 13 50.24 0.25 . 1 . . . . 40 ALA CA . 19554 1 477 . 1 1 43 43 ALA CB C 13 19.27 0.25 . 1 . . . . 40 ALA CB . 19554 1 478 . 1 1 43 43 ALA N N 15 131.94 0.15 . 1 . . . . 40 ALA N . 19554 1 479 . 1 1 44 44 GLY H H 1 8.47 0.02 . 1 . . . . 41 GLY H . 19554 1 480 . 1 1 44 44 GLY HA2 H 1 3.73 0.02 . 2 . . . . 41 GLY HA2 . 19554 1 481 . 1 1 44 44 GLY HA3 H 1 4.00 0.02 . 2 . . . . 41 GLY HA3 . 19554 1 482 . 1 1 44 44 GLY C C 13 174.97 0.25 . 1 . . . . 41 GLY C . 19554 1 483 . 1 1 44 44 GLY CA C 13 45.74 0.25 . 1 . . . . 41 GLY CA . 19554 1 484 . 1 1 44 44 GLY N N 15 106.93 0.15 . 1 . . . . 41 GLY N . 19554 1 485 . 1 1 45 45 LEU H H 1 7.52 0.02 . 1 . . . . 42 LEU H . 19554 1 486 . 1 1 45 45 LEU HA H 1 4.48 0.02 . 1 . . . . 42 LEU HA . 19554 1 487 . 1 1 45 45 LEU HB2 H 1 1.69 0.02 . 2 . . . . 42 LEU HB2 . 19554 1 488 . 1 1 45 45 LEU HB3 H 1 1.90 0.02 . 2 . . . . 42 LEU HB3 . 19554 1 489 . 1 1 45 45 LEU HG H 1 1.41 0.02 . 1 . . . . 42 LEU HG . 19554 1 490 . 1 1 45 45 LEU HD11 H 1 0.79 0.02 . 2 . . . . 42 LEU HD11 . 19554 1 491 . 1 1 45 45 LEU HD12 H 1 0.79 0.02 . 2 . . . . 42 LEU HD12 . 19554 1 492 . 1 1 45 45 LEU HD13 H 1 0.79 0.02 . 2 . . . . 42 LEU HD13 . 19554 1 493 . 1 1 45 45 LEU HD21 H 1 0.72 0.02 . 2 . . . . 42 LEU HD21 . 19554 1 494 . 1 1 45 45 LEU HD22 H 1 0.72 0.02 . 2 . . . . 42 LEU HD22 . 19554 1 495 . 1 1 45 45 LEU HD23 H 1 0.72 0.02 . 2 . . . . 42 LEU HD23 . 19554 1 496 . 1 1 45 45 LEU C C 13 177.17 0.25 . 1 . . . . 42 LEU C . 19554 1 497 . 1 1 45 45 LEU CA C 13 53.97 0.25 . 1 . . . . 42 LEU CA . 19554 1 498 . 1 1 45 45 LEU CB C 13 40.96 0.25 . 1 . . . . 42 LEU CB . 19554 1 499 . 1 1 45 45 LEU CG C 13 27.39 0.25 . 1 . . . . 42 LEU CG . 19554 1 500 . 1 1 45 45 LEU CD1 C 13 25.51 0.25 . 2 . . . . 42 LEU CD1 . 19554 1 501 . 1 1 45 45 LEU CD2 C 13 22.52 0.25 . 2 . . . . 42 LEU CD2 . 19554 1 502 . 1 1 45 45 LEU N N 15 119.15 0.15 . 1 . . . . 42 LEU N . 19554 1 503 . 1 1 46 46 LYS H H 1 8.36 0.02 . 1 . . . . 43 LYS H . 19554 1 504 . 1 1 46 46 LYS HA H 1 3.90 0.02 . 1 . . . . 43 LYS HA . 19554 1 505 . 1 1 46 46 LYS HB2 H 1 1.69 0.02 . 2 . . . . 43 LYS HB2 . 19554 1 506 . 1 1 46 46 LYS HB3 H 1 1.79 0.02 . 2 . . . . 43 LYS HB3 . 19554 1 507 . 1 1 46 46 LYS HG2 H 1 1.37 0.02 . 2 . . . . 43 LYS HG2 . 19554 1 508 . 1 1 46 46 LYS HG3 H 1 1.34 0.02 . 2 . . . . 43 LYS HG3 . 19554 1 509 . 1 1 46 46 LYS HD2 H 1 1.57 0.02 . 2 . . . . 43 LYS HD2 . 19554 1 510 . 1 1 46 46 LYS HD3 H 1 1.57 0.02 . 2 . . . . 43 LYS HD3 . 19554 1 511 . 1 1 46 46 LYS HE3 H 1 2.88 0.02 . 1 . . . . 43 LYS HE3 . 19554 1 512 . 1 1 46 46 LYS C C 13 176.42 0.25 . 1 . . . . 43 LYS C . 19554 1 513 . 1 1 46 46 LYS CA C 13 58.63 0.25 . 1 . . . . 43 LYS CA . 19554 1 514 . 1 1 46 46 LYS CB C 13 31.69 0.25 . 1 . . . . 43 LYS CB . 19554 1 515 . 1 1 46 46 LYS CG C 13 24.75 0.25 . 1 . . . . 43 LYS CG . 19554 1 516 . 1 1 46 46 LYS CD C 13 28.80 0.25 . 1 . . . . 43 LYS CD . 19554 1 517 . 1 1 46 46 LYS CE C 13 41.74 0.25 . 1 . . . . 43 LYS CE . 19554 1 518 . 1 1 46 46 LYS N N 15 119.01 0.15 . 1 . . . . 43 LYS N . 19554 1 519 . 1 1 47 47 SER H H 1 7.41 0.02 . 1 . . . . 44 SER H . 19554 1 520 . 1 1 47 47 SER HA H 1 4.48 0.02 . 1 . . . . 44 SER HA . 19554 1 521 . 1 1 47 47 SER HB2 H 1 3.62 0.02 . 2 . . . . 44 SER HB2 . 19554 1 522 . 1 1 47 47 SER HB3 H 1 3.66 0.02 . 2 . . . . 44 SER HB3 . 19554 1 523 . 1 1 47 47 SER C C 13 173.65 0.25 . 1 . . . . 44 SER C . 19554 1 524 . 1 1 47 47 SER CA C 13 56.37 0.25 . 1 . . . . 44 SER CA . 19554 1 525 . 1 1 47 47 SER CB C 13 64.94 0.25 . 1 . . . . 44 SER CB . 19554 1 526 . 1 1 47 47 SER N N 15 110.68 0.15 . 1 . . . . 44 SER N . 19554 1 527 . 1 1 48 48 GLU H H 1 8.83 0.02 . 1 . . . . 45 GLU H . 19554 1 528 . 1 1 48 48 GLU HA H 1 4.30 0.02 . 1 . . . . 45 GLU HA . 19554 1 529 . 1 1 48 48 GLU HB2 H 1 1.78 0.02 . 2 . . . . 45 GLU HB2 . 19554 1 530 . 1 1 48 48 GLU HB3 H 1 1.64 0.02 . 2 . . . . 45 GLU HB3 . 19554 1 531 . 1 1 48 48 GLU HG2 H 1 2.12 0.02 . 2 . . . . 45 GLU HG2 . 19554 1 532 . 1 1 48 48 GLU HG3 H 1 2.08 0.02 . 2 . . . . 45 GLU HG3 . 19554 1 533 . 1 1 48 48 GLU C C 13 176.52 0.25 . 1 . . . . 45 GLU C . 19554 1 534 . 1 1 48 48 GLU CA C 13 57.80 0.25 . 1 . . . . 45 GLU CA . 19554 1 535 . 1 1 48 48 GLU CB C 13 29.77 0.25 . 1 . . . . 45 GLU CB . 19554 1 536 . 1 1 48 48 GLU CG C 13 36.63 0.25 . 1 . . . . 45 GLU CG . 19554 1 537 . 1 1 48 48 GLU N N 15 122.64 0.15 . 1 . . . . 45 GLU N . 19554 1 538 . 1 1 49 49 SER H H 1 8.99 0.02 . 1 . . . . 46 SER H . 19554 1 539 . 1 1 49 49 SER HA H 1 4.54 0.02 . 1 . . . . 46 SER HA . 19554 1 540 . 1 1 49 49 SER HB2 H 1 3.48 0.02 . 2 . . . . 46 SER HB2 . 19554 1 541 . 1 1 49 49 SER HB3 H 1 3.67 0.02 . 2 . . . . 46 SER HB3 . 19554 1 542 . 1 1 49 49 SER C C 13 172.15 0.25 . 1 . . . . 46 SER C . 19554 1 543 . 1 1 49 49 SER CA C 13 58.37 0.25 . 1 . . . . 46 SER CA . 19554 1 544 . 1 1 49 49 SER CB C 13 64.46 0.25 . 1 . . . . 46 SER CB . 19554 1 545 . 1 1 49 49 SER N N 15 119.33 0.15 . 1 . . . . 46 SER N . 19554 1 546 . 1 1 50 50 ALA H H 1 8.53 0.02 . 1 . . . . 47 ALA H . 19554 1 547 . 1 1 50 50 ALA HA H 1 4.82 0.02 . 1 . . . . 47 ALA HA . 19554 1 548 . 1 1 50 50 ALA HB1 H 1 1.13 0.02 . 1 . . . . 47 ALA HB1 . 19554 1 549 . 1 1 50 50 ALA HB2 H 1 1.13 0.02 . 1 . . . . 47 ALA HB2 . 19554 1 550 . 1 1 50 50 ALA HB3 H 1 1.13 0.02 . 1 . . . . 47 ALA HB3 . 19554 1 551 . 1 1 50 50 ALA C C 13 176.19 0.25 . 1 . . . . 47 ALA C . 19554 1 552 . 1 1 50 50 ALA CA C 13 50.93 0.25 . 1 . . . . 47 ALA CA . 19554 1 553 . 1 1 50 50 ALA CB C 13 19.50 0.25 . 1 . . . . 47 ALA CB . 19554 1 554 . 1 1 50 50 ALA N N 15 128.62 0.15 . 1 . . . . 47 ALA N . 19554 1 555 . 1 1 51 51 ILE H H 1 9.19 0.02 . 1 . . . . 48 ILE H . 19554 1 556 . 1 1 51 51 ILE HA H 1 4.65 0.02 . 1 . . . . 48 ILE HA . 19554 1 557 . 1 1 51 51 ILE HB H 1 1.90 0.02 . 1 . . . . 48 ILE HB . 19554 1 558 . 1 1 51 51 ILE HG12 H 1 1.20 0.02 . 1 . . . . 48 ILE HG12 . 19554 1 559 . 1 1 51 51 ILE HG21 H 1 0.91 0.02 . 1 . . . . 48 ILE HG21 . 19554 1 560 . 1 1 51 51 ILE HG22 H 1 0.91 0.02 . 1 . . . . 48 ILE HG22 . 19554 1 561 . 1 1 51 51 ILE HG23 H 1 0.91 0.02 . 1 . . . . 48 ILE HG23 . 19554 1 562 . 1 1 51 51 ILE HD11 H 1 0.66 0.02 . 1 . . . . 48 ILE HD11 . 19554 1 563 . 1 1 51 51 ILE HD12 H 1 0.66 0.02 . 1 . . . . 48 ILE HD12 . 19554 1 564 . 1 1 51 51 ILE HD13 H 1 0.66 0.02 . 1 . . . . 48 ILE HD13 . 19554 1 565 . 1 1 51 51 ILE CA C 13 57.37 0.25 . 1 . . . . 48 ILE CA . 19554 1 566 . 1 1 51 51 ILE CB C 13 40.82 0.25 . 1 . . . . 48 ILE CB . 19554 1 567 . 1 1 51 51 ILE CG1 C 13 27.10 0.25 . 1 . . . . 48 ILE CG1 . 19554 1 568 . 1 1 51 51 ILE CG2 C 13 17.58 0.25 . 1 . . . . 48 ILE CG2 . 19554 1 569 . 1 1 51 51 ILE CD1 C 13 13.00 0.25 . 1 . . . . 48 ILE CD1 . 19554 1 570 . 1 1 51 51 ILE N N 15 125.71 0.15 . 1 . . . . 48 ILE N . 19554 1 571 . 1 1 52 52 PRO HA H 1 4.44 0.02 . 1 . . . . 49 PRO HA . 19554 1 572 . 1 1 52 52 PRO HG2 H 1 2.07 0.02 . 1 . . . . 49 PRO HG2 . 19554 1 573 . 1 1 52 52 PRO HD2 H 1 3.81 0.02 . 2 . . . . 49 PRO HD2 . 19554 1 574 . 1 1 52 52 PRO HD3 H 1 3.55 0.02 . 2 . . . . 49 PRO HD3 . 19554 1 575 . 1 1 52 52 PRO C C 13 177.67 0.25 . 1 . . . . 49 PRO C . 19554 1 576 . 1 1 52 52 PRO CA C 13 63.85 0.25 . 1 . . . . 49 PRO CA . 19554 1 577 . 1 1 52 52 PRO CB C 13 32.49 0.25 . 1 . . . . 49 PRO CB . 19554 1 578 . 1 1 52 52 PRO CG C 13 28.01 0.25 . 1 . . . . 49 PRO CG . 19554 1 579 . 1 1 52 52 PRO CD C 13 51.06 0.25 . 1 . . . . 49 PRO CD . 19554 1 580 . 1 1 53 53 ALA H H 1 8.22 0.02 . 1 . . . . 50 ALA H . 19554 1 581 . 1 1 53 53 ALA HA H 1 3.97 0.02 . 1 . . . . 50 ALA HA . 19554 1 582 . 1 1 53 53 ALA HB1 H 1 1.18 0.02 . 1 . . . . 50 ALA HB1 . 19554 1 583 . 1 1 53 53 ALA HB2 H 1 1.18 0.02 . 1 . . . . 50 ALA HB2 . 19554 1 584 . 1 1 53 53 ALA HB3 H 1 1.18 0.02 . 1 . . . . 50 ALA HB3 . 19554 1 585 . 1 1 53 53 ALA C C 13 178.92 0.25 . 1 . . . . 50 ALA C . 19554 1 586 . 1 1 53 53 ALA CA C 13 54.77 0.25 . 1 . . . . 50 ALA CA . 19554 1 587 . 1 1 53 53 ALA CB C 13 17.92 0.25 . 1 . . . . 50 ALA CB . 19554 1 588 . 1 1 53 53 ALA N N 15 125.73 0.15 . 1 . . . . 50 ALA N . 19554 1 589 . 1 1 54 54 GLU H H 1 8.56 0.02 . 1 . . . . 51 GLU H . 19554 1 590 . 1 1 54 54 GLU HA H 1 3.69 0.02 . 1 . . . . 51 GLU HA . 19554 1 591 . 1 1 54 54 GLU HB2 H 1 1.92 0.02 . 2 . . . . 51 GLU HB2 . 19554 1 592 . 1 1 54 54 GLU HB3 H 1 2.04 0.02 . 2 . . . . 51 GLU HB3 . 19554 1 593 . 1 1 54 54 GLU HG2 H 1 2.22 0.02 . 2 . . . . 51 GLU HG2 . 19554 1 594 . 1 1 54 54 GLU HG3 H 1 2.16 0.02 . 2 . . . . 51 GLU HG3 . 19554 1 595 . 1 1 54 54 GLU C C 13 177.85 0.25 . 1 . . . . 51 GLU C . 19554 1 596 . 1 1 54 54 GLU CA C 13 58.99 0.25 . 1 . . . . 51 GLU CA . 19554 1 597 . 1 1 54 54 GLU CB C 13 29.12 0.25 . 1 . . . . 51 GLU CB . 19554 1 598 . 1 1 54 54 GLU CG C 13 35.42 0.25 . 1 . . . . 51 GLU CG . 19554 1 599 . 1 1 54 54 GLU N N 15 115.15 0.15 . 1 . . . . 51 GLU N . 19554 1 600 . 1 1 55 55 GLN H H 1 7.44 0.02 . 1 . . . . 52 GLN H . 19554 1 601 . 1 1 55 55 GLN HA H 1 3.88 0.02 . 1 . . . . 52 GLN HA . 19554 1 602 . 1 1 55 55 GLN HB3 H 1 1.55 0.02 . 1 . . . . 52 GLN HB3 . 19554 1 603 . 1 1 55 55 GLN HG3 H 1 1.92 0.02 . 1 . . . . 52 GLN HG3 . 19554 1 604 . 1 1 55 55 GLN C C 13 175.84 0.25 . 1 . . . . 52 GLN C . 19554 1 605 . 1 1 55 55 GLN CA C 13 57.46 0.25 . 1 . . . . 52 GLN CA . 19554 1 606 . 1 1 55 55 GLN CB C 13 27.89 0.25 . 1 . . . . 52 GLN CB . 19554 1 607 . 1 1 55 55 GLN CG C 13 33.60 0.25 . 1 . . . . 52 GLN CG . 19554 1 608 . 1 1 55 55 GLN N N 15 115.78 0.15 . 1 . . . . 52 GLN N . 19554 1 609 . 1 1 56 56 PHE H H 1 7.84 0.02 . 1 . . . . 53 PHE H . 19554 1 610 . 1 1 56 56 PHE HA H 1 4.69 0.02 . 1 . . . . 53 PHE HA . 19554 1 611 . 1 1 56 56 PHE HD1 H 1 7.13 0.02 . 3 . . . . 53 PHE HD1 . 19554 1 612 . 1 1 56 56 PHE HD2 H 1 7.13 0.02 . 3 . . . . 53 PHE HD2 . 19554 1 613 . 1 1 56 56 PHE HE1 H 1 7.04 0.02 . 3 . . . . 53 PHE HE1 . 19554 1 614 . 1 1 56 56 PHE HE2 H 1 7.04 0.02 . 3 . . . . 53 PHE HE2 . 19554 1 615 . 1 1 56 56 PHE HZ H 1 6.87 0.02 . 1 . . . . 53 PHE HZ . 19554 1 616 . 1 1 56 56 PHE C C 13 174.78 0.25 . 1 . . . . 53 PHE C . 19554 1 617 . 1 1 56 56 PHE CA C 13 56.68 0.25 . 1 . . . . 53 PHE CA . 19554 1 618 . 1 1 56 56 PHE CB C 13 40.23 0.25 . 1 . . . . 53 PHE CB . 19554 1 619 . 1 1 56 56 PHE N N 15 115.82 0.15 . 1 . . . . 53 PHE N . 19554 1 620 . 1 1 57 57 LYS H H 1 7.01 0.02 . 1 . . . . 54 LYS H . 19554 1 621 . 1 1 57 57 LYS HA H 1 4.67 0.02 . 1 . . . . 54 LYS HA . 19554 1 622 . 1 1 57 57 LYS HB2 H 1 1.49 0.02 . 2 . . . . 54 LYS HB2 . 19554 1 623 . 1 1 57 57 LYS HB3 H 1 1.65 0.02 . 2 . . . . 54 LYS HB3 . 19554 1 624 . 1 1 57 57 LYS HG3 H 1 0.87 0.02 . 1 . . . . 54 LYS HG3 . 19554 1 625 . 1 1 57 57 LYS HD2 H 1 1.44 0.02 . 1 . . . . 54 LYS HD2 . 19554 1 626 . 1 1 57 57 LYS HE2 H 1 2.50 0.02 . 2 . . . . 54 LYS HE2 . 19554 1 627 . 1 1 57 57 LYS HE3 H 1 2.72 0.02 . 2 . . . . 54 LYS HE3 . 19554 1 628 . 1 1 57 57 LYS C C 13 176.79 0.25 . 1 . . . . 54 LYS C . 19554 1 629 . 1 1 57 57 LYS CA C 13 55.82 0.25 . 1 . . . . 54 LYS CA . 19554 1 630 . 1 1 57 57 LYS CB C 13 34.93 0.25 . 1 . . . . 54 LYS CB . 19554 1 631 . 1 1 57 57 LYS CG C 13 26.46 0.25 . 1 . . . . 54 LYS CG . 19554 1 632 . 1 1 57 57 LYS CE C 13 41.94 0.25 . 1 . . . . 54 LYS CE . 19554 1 633 . 1 1 57 57 LYS N N 15 119.72 0.15 . 1 . . . . 54 LYS N . 19554 1 634 . 1 1 58 58 ASN H H 1 8.53 0.02 . 1 . . . . 55 ASN H . 19554 1 635 . 1 1 58 58 ASN HA H 1 4.66 0.02 . 1 . . . . 55 ASN HA . 19554 1 636 . 1 1 58 58 ASN HB2 H 1 2.92 0.02 . 2 . . . . 55 ASN HB2 . 19554 1 637 . 1 1 58 58 ASN HB3 H 1 3.44 0.02 . 2 . . . . 55 ASN HB3 . 19554 1 638 . 1 1 58 58 ASN HD21 H 1 7.88 0.02 . 1 . . . . 55 ASN HD21 . 19554 1 639 . 1 1 58 58 ASN HD22 H 1 7.34 0.02 . 1 . . . . 55 ASN HD22 . 19554 1 640 . 1 1 58 58 ASN C C 13 177.67 0.25 . 1 . . . . 55 ASN C . 19554 1 641 . 1 1 58 58 ASN CA C 13 50.67 0.25 . 1 . . . . 55 ASN CA . 19554 1 642 . 1 1 58 58 ASN CB C 13 38.57 0.25 . 1 . . . . 55 ASN CB . 19554 1 643 . 1 1 58 58 ASN N N 15 120.17 0.15 . 1 . . . . 55 ASN N . 19554 1 644 . 1 1 58 58 ASN ND2 N 15 112.80 0.15 . 1 . . . . 55 ASN ND2 . 19554 1 645 . 1 1 59 59 ALA H H 1 8.43 0.02 . 1 . . . . 56 ALA H . 19554 1 646 . 1 1 59 59 ALA HA H 1 4.03 0.02 . 1 . . . . 56 ALA HA . 19554 1 647 . 1 1 59 59 ALA HB1 H 1 1.34 0.02 . 1 . . . . 56 ALA HB1 . 19554 1 648 . 1 1 59 59 ALA HB2 H 1 1.34 0.02 . 1 . . . . 56 ALA HB2 . 19554 1 649 . 1 1 59 59 ALA HB3 H 1 1.34 0.02 . 1 . . . . 56 ALA HB3 . 19554 1 650 . 1 1 59 59 ALA C C 13 178.59 0.25 . 1 . . . . 56 ALA C . 19554 1 651 . 1 1 59 59 ALA CA C 13 54.54 0.25 . 1 . . . . 56 ALA CA . 19554 1 652 . 1 1 59 59 ALA CB C 13 17.98 0.25 . 1 . . . . 56 ALA CB . 19554 1 653 . 1 1 59 59 ALA N N 15 120.74 0.15 . 1 . . . . 56 ALA N . 19554 1 654 . 1 1 60 60 GLN H H 1 7.58 0.02 . 1 . . . . 57 GLN H . 19554 1 655 . 1 1 60 60 GLN HA H 1 4.30 0.02 . 1 . . . . 57 GLN HA . 19554 1 656 . 1 1 60 60 GLN HB2 H 1 2.21 0.02 . 2 . . . . 57 GLN HB2 . 19554 1 657 . 1 1 60 60 GLN HB3 H 1 1.95 0.02 . 2 . . . . 57 GLN HB3 . 19554 1 658 . 1 1 60 60 GLN HG2 H 1 2.33 0.02 . 2 . . . . 57 GLN HG2 . 19554 1 659 . 1 1 60 60 GLN HG3 H 1 2.20 0.02 . 2 . . . . 57 GLN HG3 . 19554 1 660 . 1 1 60 60 GLN HE21 H 1 7.43 0.02 . 1 . . . . 57 GLN HE21 . 19554 1 661 . 1 1 60 60 GLN HE22 H 1 6.72 0.02 . 1 . . . . 57 GLN HE22 . 19554 1 662 . 1 1 60 60 GLN C C 13 176.13 0.25 . 1 . . . . 57 GLN C . 19554 1 663 . 1 1 60 60 GLN CA C 13 55.73 0.25 . 1 . . . . 57 GLN CA . 19554 1 664 . 1 1 60 60 GLN CB C 13 28.54 0.25 . 1 . . . . 57 GLN CB . 19554 1 665 . 1 1 60 60 GLN CG C 13 34.74 0.25 . 1 . . . . 57 GLN CG . 19554 1 666 . 1 1 60 60 GLN N N 15 114.92 0.15 . 1 . . . . 57 GLN N . 19554 1 667 . 1 1 60 60 GLN NE2 N 15 112.05 0.15 . 1 . . . . 57 GLN NE2 . 19554 1 668 . 1 1 61 61 GLY H H 1 8.16 0.02 . 1 . . . . 58 GLY H . 19554 1 669 . 1 1 61 61 GLY HA2 H 1 4.12 0.02 . 2 . . . . 58 GLY HA2 . 19554 1 670 . 1 1 61 61 GLY HA3 H 1 3.56 0.02 . 2 . . . . 58 GLY HA3 . 19554 1 671 . 1 1 61 61 GLY C C 13 173.66 0.25 . 1 . . . . 58 GLY C . 19554 1 672 . 1 1 61 61 GLY CA C 13 45.42 0.25 . 1 . . . . 58 GLY CA . 19554 1 673 . 1 1 61 61 GLY N N 15 107.93 0.15 . 1 . . . . 58 GLY N . 19554 1 674 . 1 1 62 62 GLU H H 1 7.72 0.02 . 1 . . . . 59 GLU H . 19554 1 675 . 1 1 62 62 GLU HA H 1 4.33 0.02 . 1 . . . . 59 GLU HA . 19554 1 676 . 1 1 62 62 GLU HB2 H 1 1.86 0.02 . 2 . . . . 59 GLU HB2 . 19554 1 677 . 1 1 62 62 GLU HB3 H 1 1.81 0.02 . 2 . . . . 59 GLU HB3 . 19554 1 678 . 1 1 62 62 GLU HG2 H 1 2.00 0.02 . 2 . . . . 59 GLU HG2 . 19554 1 679 . 1 1 62 62 GLU HG3 H 1 2.08 0.02 . 2 . . . . 59 GLU HG3 . 19554 1 680 . 1 1 62 62 GLU C C 13 175.84 0.25 . 1 . . . . 59 GLU C . 19554 1 681 . 1 1 62 62 GLU CA C 13 54.31 0.25 . 1 . . . . 59 GLU CA . 19554 1 682 . 1 1 62 62 GLU CB C 13 30.74 0.25 . 1 . . . . 59 GLU CB . 19554 1 683 . 1 1 62 62 GLU CG C 13 35.69 0.25 . 1 . . . . 59 GLU CG . 19554 1 684 . 1 1 62 62 GLU N N 15 119.72 0.15 . 1 . . . . 59 GLU N . 19554 1 685 . 1 1 63 63 LEU H H 1 8.71 0.02 . 1 . . . . 60 LEU H . 19554 1 686 . 1 1 63 63 LEU HA H 1 4.29 0.02 . 1 . . . . 60 LEU HA . 19554 1 687 . 1 1 63 63 LEU HB3 H 1 1.51 0.02 . 1 . . . . 60 LEU HB3 . 19554 1 688 . 1 1 63 63 LEU HG H 1 1.56 0.02 . 1 . . . . 60 LEU HG . 19554 1 689 . 1 1 63 63 LEU HD11 H 1 0.76 0.02 . 2 . . . . 60 LEU HD11 . 19554 1 690 . 1 1 63 63 LEU HD12 H 1 0.76 0.02 . 2 . . . . 60 LEU HD12 . 19554 1 691 . 1 1 63 63 LEU HD13 H 1 0.76 0.02 . 2 . . . . 60 LEU HD13 . 19554 1 692 . 1 1 63 63 LEU HD21 H 1 0.75 0.02 . 2 . . . . 60 LEU HD21 . 19554 1 693 . 1 1 63 63 LEU HD22 H 1 0.75 0.02 . 2 . . . . 60 LEU HD22 . 19554 1 694 . 1 1 63 63 LEU HD23 H 1 0.75 0.02 . 2 . . . . 60 LEU HD23 . 19554 1 695 . 1 1 63 63 LEU C C 13 177.68 0.25 . 1 . . . . 60 LEU C . 19554 1 696 . 1 1 63 63 LEU CA C 13 55.14 0.25 . 1 . . . . 60 LEU CA . 19554 1 697 . 1 1 63 63 LEU CB C 13 43.05 0.25 . 1 . . . . 60 LEU CB . 19554 1 698 . 1 1 63 63 LEU CG C 13 27.73 0.25 . 1 . . . . 60 LEU CG . 19554 1 699 . 1 1 63 63 LEU CD1 C 13 25.49 0.25 . 2 . . . . 60 LEU CD1 . 19554 1 700 . 1 1 63 63 LEU CD2 C 13 25.30 0.25 . 2 . . . . 60 LEU CD2 . 19554 1 701 . 1 1 63 63 LEU N N 15 123.06 0.15 . 1 . . . . 60 LEU N . 19554 1 702 . 1 1 64 64 GLU H H 1 8.81 0.02 . 1 . . . . 61 GLU H . 19554 1 703 . 1 1 64 64 GLU HA H 1 4.39 0.02 . 1 . . . . 61 GLU HA . 19554 1 704 . 1 1 64 64 GLU HB2 H 1 1.86 0.02 . 2 . . . . 61 GLU HB2 . 19554 1 705 . 1 1 64 64 GLU HB3 H 1 2.13 0.02 . 2 . . . . 61 GLU HB3 . 19554 1 706 . 1 1 64 64 GLU HG2 H 1 2.21 0.02 . 2 . . . . 61 GLU HG2 . 19554 1 707 . 1 1 64 64 GLU HG3 H 1 2.08 0.02 . 2 . . . . 61 GLU HG3 . 19554 1 708 . 1 1 64 64 GLU C C 13 175.52 0.25 . 1 . . . . 61 GLU C . 19554 1 709 . 1 1 64 64 GLU CA C 13 55.78 0.25 . 1 . . . . 61 GLU CA . 19554 1 710 . 1 1 64 64 GLU CB C 13 30.24 0.25 . 1 . . . . 61 GLU CB . 19554 1 711 . 1 1 64 64 GLU CG C 13 36.72 0.25 . 1 . . . . 61 GLU CG . 19554 1 712 . 1 1 64 64 GLU N N 15 123.55 0.15 . 1 . . . . 61 GLU N . 19554 1 713 . 1 1 65 65 ILE H H 1 6.78 0.02 . 1 . . . . 62 ILE H . 19554 1 714 . 1 1 65 65 ILE HA H 1 4.42 0.02 . 1 . . . . 62 ILE HA . 19554 1 715 . 1 1 65 65 ILE HB H 1 1.53 0.02 . 1 . . . . 62 ILE HB . 19554 1 716 . 1 1 65 65 ILE HG12 H 1 0.68 0.02 . 2 . . . . 62 ILE HG12 . 19554 1 717 . 1 1 65 65 ILE HG13 H 1 1.20 0.02 . 2 . . . . 62 ILE HG13 . 19554 1 718 . 1 1 65 65 ILE HG21 H 1 0.64 0.02 . 1 . . . . 62 ILE HG21 . 19554 1 719 . 1 1 65 65 ILE HG22 H 1 0.64 0.02 . 1 . . . . 62 ILE HG22 . 19554 1 720 . 1 1 65 65 ILE HG23 H 1 0.64 0.02 . 1 . . . . 62 ILE HG23 . 19554 1 721 . 1 1 65 65 ILE HD11 H 1 0.29 0.02 . 1 . . . . 62 ILE HD11 . 19554 1 722 . 1 1 65 65 ILE HD12 H 1 0.29 0.02 . 1 . . . . 62 ILE HD12 . 19554 1 723 . 1 1 65 65 ILE HD13 H 1 0.29 0.02 . 1 . . . . 62 ILE HD13 . 19554 1 724 . 1 1 65 65 ILE C C 13 172.66 0.25 . 1 . . . . 62 ILE C . 19554 1 725 . 1 1 65 65 ILE CA C 13 58.94 0.25 . 1 . . . . 62 ILE CA . 19554 1 726 . 1 1 65 65 ILE CB C 13 41.90 0.25 . 1 . . . . 62 ILE CB . 19554 1 727 . 1 1 65 65 ILE CG1 C 13 27.04 0.25 . 1 . . . . 62 ILE CG1 . 19554 1 728 . 1 1 65 65 ILE CG2 C 13 18.40 0.25 . 1 . . . . 62 ILE CG2 . 19554 1 729 . 1 1 65 65 ILE CD1 C 13 14.93 0.25 . 1 . . . . 62 ILE CD1 . 19554 1 730 . 1 1 65 65 ILE N N 15 113.60 0.15 . 1 . . . . 62 ILE N . 19554 1 731 . 1 1 66 66 GLN H H 1 8.37 0.02 . 1 . . . . 63 GLN H . 19554 1 732 . 1 1 66 66 GLN HA H 1 4.37 0.02 . 1 . . . . 63 GLN HA . 19554 1 733 . 1 1 66 66 GLN HB2 H 1 1.71 0.02 . 2 . . . . 63 GLN HB2 . 19554 1 734 . 1 1 66 66 GLN HB3 H 1 1.88 0.02 . 2 . . . . 63 GLN HB3 . 19554 1 735 . 1 1 66 66 GLN HG2 H 1 2.13 0.02 . 2 . . . . 63 GLN HG2 . 19554 1 736 . 1 1 66 66 GLN HG3 H 1 2.19 0.02 . 2 . . . . 63 GLN HG3 . 19554 1 737 . 1 1 66 66 GLN HE21 H 1 6.64 0.02 . 1 . . . . 63 GLN HE21 . 19554 1 738 . 1 1 66 66 GLN HE22 H 1 7.58 0.02 . 1 . . . . 63 GLN HE22 . 19554 1 739 . 1 1 66 66 GLN C C 13 175.17 0.25 . 1 . . . . 63 GLN C . 19554 1 740 . 1 1 66 66 GLN CA C 13 53.16 0.25 . 1 . . . . 63 GLN CA . 19554 1 741 . 1 1 66 66 GLN CB C 13 32.80 0.25 . 1 . . . . 63 GLN CB . 19554 1 742 . 1 1 66 66 GLN CG C 13 33.29 0.25 . 1 . . . . 63 GLN CG . 19554 1 743 . 1 1 66 66 GLN N N 15 119.37 0.15 . 1 . . . . 63 GLN N . 19554 1 744 . 1 1 66 66 GLN NE2 N 15 112.89 0.15 . 1 . . . . 63 GLN NE2 . 19554 1 745 . 1 1 67 67 VAL H H 1 8.37 0.02 . 1 . . . . 64 VAL H . 19554 1 746 . 1 1 67 67 VAL HA H 1 3.09 0.02 . 1 . . . . 64 VAL HA . 19554 1 747 . 1 1 67 67 VAL HB H 1 1.75 0.02 . 1 . . . . 64 VAL HB . 19554 1 748 . 1 1 67 67 VAL HG11 H 1 0.77 0.02 . 2 . . . . 64 VAL HG11 . 19554 1 749 . 1 1 67 67 VAL HG12 H 1 0.77 0.02 . 2 . . . . 64 VAL HG12 . 19554 1 750 . 1 1 67 67 VAL HG13 H 1 0.77 0.02 . 2 . . . . 64 VAL HG13 . 19554 1 751 . 1 1 67 67 VAL HG21 H 1 0.79 0.02 . 2 . . . . 64 VAL HG21 . 19554 1 752 . 1 1 67 67 VAL HG22 H 1 0.79 0.02 . 2 . . . . 64 VAL HG22 . 19554 1 753 . 1 1 67 67 VAL HG23 H 1 0.79 0.02 . 2 . . . . 64 VAL HG23 . 19554 1 754 . 1 1 67 67 VAL C C 13 177.19 0.25 . 1 . . . . 64 VAL C . 19554 1 755 . 1 1 67 67 VAL CA C 13 65.59 0.25 . 1 . . . . 64 VAL CA . 19554 1 756 . 1 1 67 67 VAL CB C 13 31.02 0.25 . 1 . . . . 64 VAL CB . 19554 1 757 . 1 1 67 67 VAL CG1 C 13 21.23 0.25 . 2 . . . . 64 VAL CG1 . 19554 1 758 . 1 1 67 67 VAL CG2 C 13 22.61 0.25 . 2 . . . . 64 VAL CG2 . 19554 1 759 . 1 1 67 67 VAL N N 15 120.76 0.15 . 1 . . . . 64 VAL N . 19554 1 760 . 1 1 68 68 GLY H H 1 8.87 0.02 . 1 . . . . 65 GLY H . 19554 1 761 . 1 1 68 68 GLY HA2 H 1 3.36 0.02 . 2 . . . . 65 GLY HA2 . 19554 1 762 . 1 1 68 68 GLY HA3 H 1 4.36 0.02 . 2 . . . . 65 GLY HA3 . 19554 1 763 . 1 1 68 68 GLY C C 13 174.19 0.25 . 1 . . . . 65 GLY C . 19554 1 764 . 1 1 68 68 GLY CA C 13 44.38 0.25 . 1 . . . . 65 GLY CA . 19554 1 765 . 1 1 68 68 GLY N N 15 116.75 0.15 . 1 . . . . 65 GLY N . 19554 1 766 . 1 1 69 69 ASP H H 1 7.80 0.02 . 1 . . . . 66 ASP H . 19554 1 767 . 1 1 69 69 ASP HA H 1 4.48 0.02 . 1 . . . . 66 ASP HA . 19554 1 768 . 1 1 69 69 ASP HB2 H 1 2.46 0.02 . 2 . . . . 66 ASP HB2 . 19554 1 769 . 1 1 69 69 ASP HB3 H 1 2.65 0.02 . 2 . . . . 66 ASP HB3 . 19554 1 770 . 1 1 69 69 ASP C C 13 175.24 0.25 . 1 . . . . 66 ASP C . 19554 1 771 . 1 1 69 69 ASP CA C 13 54.73 0.25 . 1 . . . . 66 ASP CA . 19554 1 772 . 1 1 69 69 ASP CB C 13 40.93 0.25 . 1 . . . . 66 ASP CB . 19554 1 773 . 1 1 69 69 ASP N N 15 121.36 0.15 . 1 . . . . 66 ASP N . 19554 1 774 . 1 1 70 70 GLU H H 1 8.32 0.02 . 1 . . . . 67 GLU H . 19554 1 775 . 1 1 70 70 GLU HA H 1 5.13 0.02 . 1 . . . . 67 GLU HA . 19554 1 776 . 1 1 70 70 GLU HB2 H 1 1.82 0.02 . 2 . . . . 67 GLU HB2 . 19554 1 777 . 1 1 70 70 GLU HB3 H 1 1.77 0.02 . 2 . . . . 67 GLU HB3 . 19554 1 778 . 1 1 70 70 GLU HG2 H 1 2.24 0.02 . 2 . . . . 67 GLU HG2 . 19554 1 779 . 1 1 70 70 GLU HG3 H 1 1.99 0.02 . 2 . . . . 67 GLU HG3 . 19554 1 780 . 1 1 70 70 GLU C C 13 176.50 0.25 . 1 . . . . 67 GLU C . 19554 1 781 . 1 1 70 70 GLU CA C 13 54.99 0.25 . 1 . . . . 67 GLU CA . 19554 1 782 . 1 1 70 70 GLU CB C 13 31.19 0.25 . 1 . . . . 67 GLU CB . 19554 1 783 . 1 1 70 70 GLU CG C 13 36.99 0.25 . 1 . . . . 67 GLU CG . 19554 1 784 . 1 1 70 70 GLU N N 15 119.51 0.15 . 1 . . . . 67 GLU N . 19554 1 785 . 1 1 71 71 VAL H H 1 8.68 0.02 . 1 . . . . 68 VAL H . 19554 1 786 . 1 1 71 71 VAL HA H 1 4.51 0.02 . 1 . . . . 68 VAL HA . 19554 1 787 . 1 1 71 71 VAL HB H 1 2.00 0.02 . 1 . . . . 68 VAL HB . 19554 1 788 . 1 1 71 71 VAL HG11 H 1 0.48 0.02 . 2 . . . . 68 VAL HG11 . 19554 1 789 . 1 1 71 71 VAL HG12 H 1 0.48 0.02 . 2 . . . . 68 VAL HG12 . 19554 1 790 . 1 1 71 71 VAL HG13 H 1 0.48 0.02 . 2 . . . . 68 VAL HG13 . 19554 1 791 . 1 1 71 71 VAL HG21 H 1 0.58 0.02 . 2 . . . . 68 VAL HG21 . 19554 1 792 . 1 1 71 71 VAL HG22 H 1 0.58 0.02 . 2 . . . . 68 VAL HG22 . 19554 1 793 . 1 1 71 71 VAL HG23 H 1 0.58 0.02 . 2 . . . . 68 VAL HG23 . 19554 1 794 . 1 1 71 71 VAL CA C 13 58.83 0.25 . 1 . . . . 68 VAL CA . 19554 1 795 . 1 1 71 71 VAL CB C 13 35.82 0.25 . 1 . . . . 68 VAL CB . 19554 1 796 . 1 1 71 71 VAL CG1 C 13 19.07 0.25 . 2 . . . . 68 VAL CG1 . 19554 1 797 . 1 1 71 71 VAL CG2 C 13 22.25 0.25 . 2 . . . . 68 VAL CG2 . 19554 1 798 . 1 1 71 71 VAL N N 15 116.48 0.15 . 1 . . . . 68 VAL N . 19554 1 799 . 1 1 72 72 ASP HA H 1 5.12 0.02 . 1 . . . . 69 ASP HA . 19554 1 800 . 1 1 72 72 ASP HB2 H 1 2.25 0.02 . 2 . . . . 69 ASP HB2 . 19554 1 801 . 1 1 72 72 ASP HB3 H 1 2.43 0.02 . 2 . . . . 69 ASP HB3 . 19554 1 802 . 1 1 72 72 ASP CA C 13 53.79 0.25 . 1 . . . . 69 ASP CA . 19554 1 803 . 1 1 72 72 ASP CB C 13 41.68 0.25 . 1 . . . . 69 ASP CB . 19554 1 804 . 1 1 73 73 VAL H H 1 9.07 0.02 . 1 . . . . 70 VAL H . 19554 1 805 . 1 1 73 73 VAL HA H 1 4.24 0.02 . 1 . . . . 70 VAL HA . 19554 1 806 . 1 1 73 73 VAL HB H 1 1.85 0.02 . 1 . . . . 70 VAL HB . 19554 1 807 . 1 1 73 73 VAL HG11 H 1 0.69 0.02 . 2 . . . . 70 VAL HG11 . 19554 1 808 . 1 1 73 73 VAL HG12 H 1 0.69 0.02 . 2 . . . . 70 VAL HG12 . 19554 1 809 . 1 1 73 73 VAL HG13 H 1 0.69 0.02 . 2 . . . . 70 VAL HG13 . 19554 1 810 . 1 1 73 73 VAL HG21 H 1 0.72 0.02 . 2 . . . . 70 VAL HG21 . 19554 1 811 . 1 1 73 73 VAL HG22 H 1 0.72 0.02 . 2 . . . . 70 VAL HG22 . 19554 1 812 . 1 1 73 73 VAL HG23 H 1 0.72 0.02 . 2 . . . . 70 VAL HG23 . 19554 1 813 . 1 1 73 73 VAL CA C 13 60.09 0.25 . 1 . . . . 70 VAL CA . 19554 1 814 . 1 1 73 73 VAL CB C 13 34.77 0.25 . 1 . . . . 70 VAL CB . 19554 1 815 . 1 1 73 73 VAL CG1 C 13 20.79 0.25 . 2 . . . . 70 VAL CG1 . 19554 1 816 . 1 1 73 73 VAL CG2 C 13 21.66 0.25 . 2 . . . . 70 VAL CG2 . 19554 1 817 . 1 1 73 73 VAL N N 15 120.66 0.15 . 1 . . . . 70 VAL N . 19554 1 818 . 1 1 74 74 ALA H H 1 8.47 0.02 . 1 . . . . 71 ALA H . 19554 1 819 . 1 1 74 74 ALA HA H 1 4.64 0.02 . 1 . . . . 71 ALA HA . 19554 1 820 . 1 1 74 74 ALA HB1 H 1 1.22 0.02 . 1 . . . . 71 ALA HB1 . 19554 1 821 . 1 1 74 74 ALA HB2 H 1 1.22 0.02 . 1 . . . . 71 ALA HB2 . 19554 1 822 . 1 1 74 74 ALA HB3 H 1 1.22 0.02 . 1 . . . . 71 ALA HB3 . 19554 1 823 . 1 1 74 74 ALA C C 13 177.38 0.25 . 1 . . . . 71 ALA C . 19554 1 824 . 1 1 74 74 ALA CA C 13 50.81 0.25 . 1 . . . . 71 ALA CA . 19554 1 825 . 1 1 74 74 ALA CB C 13 18.96 0.25 . 1 . . . . 71 ALA CB . 19554 1 826 . 1 1 74 74 ALA N N 15 127.65 0.15 . 1 . . . . 71 ALA N . 19554 1 827 . 1 1 75 75 LEU H H 1 8.39 0.02 . 1 . . . . 72 LEU H . 19554 1 828 . 1 1 75 75 LEU HA H 1 4.18 0.02 . 1 . . . . 72 LEU HA . 19554 1 829 . 1 1 75 75 LEU HB2 H 1 1.50 0.02 . 2 . . . . 72 LEU HB2 . 19554 1 830 . 1 1 75 75 LEU HB3 H 1 1.45 0.02 . 2 . . . . 72 LEU HB3 . 19554 1 831 . 1 1 75 75 LEU HD11 H 1 0.70 0.02 . 1 . . . . 72 LEU HD11 . 19554 1 832 . 1 1 75 75 LEU HD12 H 1 0.70 0.02 . 1 . . . . 72 LEU HD12 . 19554 1 833 . 1 1 75 75 LEU HD13 H 1 0.70 0.02 . 1 . . . . 72 LEU HD13 . 19554 1 834 . 1 1 75 75 LEU CA C 13 55.20 0.25 . 1 . . . . 72 LEU CA . 19554 1 835 . 1 1 75 75 LEU CB C 13 42.77 0.25 . 1 . . . . 72 LEU CB . 19554 1 836 . 1 1 75 75 LEU N N 15 124.33 0.15 . 1 . . . . 72 LEU N . 19554 1 837 . 1 1 76 76 ASP HA H 1 4.34 0.02 . 1 . . . . 73 ASP HA . 19554 1 838 . 1 1 76 76 ASP HB3 H 1 2.56 0.02 . 1 . . . . 73 ASP HB3 . 19554 1 839 . 1 1 76 76 ASP CA C 13 54.80 0.25 . 1 . . . . 73 ASP CA . 19554 1 840 . 1 1 76 76 ASP CB C 13 42.01 0.25 . 1 . . . . 73 ASP CB . 19554 1 841 . 1 1 77 77 ALA H H 1 7.91 0.02 . 1 . . . . 74 ALA H . 19554 1 842 . 1 1 77 77 ALA HA H 1 4.25 0.02 . 1 . . . . 74 ALA HA . 19554 1 843 . 1 1 77 77 ALA HB1 H 1 1.28 0.02 . 1 . . . . 74 ALA HB1 . 19554 1 844 . 1 1 77 77 ALA HB2 H 1 1.28 0.02 . 1 . . . . 74 ALA HB2 . 19554 1 845 . 1 1 77 77 ALA HB3 H 1 1.28 0.02 . 1 . . . . 74 ALA HB3 . 19554 1 846 . 1 1 77 77 ALA CA C 13 52.18 0.25 . 1 . . . . 74 ALA CA . 19554 1 847 . 1 1 77 77 ALA CB C 13 19.20 0.25 . 1 . . . . 74 ALA CB . 19554 1 848 . 1 1 77 77 ALA N N 15 122.62 0.15 . 1 . . . . 74 ALA N . 19554 1 849 . 1 1 78 78 VAL H H 1 7.84 0.02 . 1 . . . . 75 VAL H . 19554 1 850 . 1 1 78 78 VAL HA H 1 3.96 0.02 . 1 . . . . 75 VAL HA . 19554 1 851 . 1 1 78 78 VAL HB H 1 2.00 0.02 . 1 . . . . 75 VAL HB . 19554 1 852 . 1 1 78 78 VAL HG11 H 1 0.80 0.02 . 2 . . . . 75 VAL HG11 . 19554 1 853 . 1 1 78 78 VAL HG12 H 1 0.80 0.02 . 2 . . . . 75 VAL HG12 . 19554 1 854 . 1 1 78 78 VAL HG13 H 1 0.80 0.02 . 2 . . . . 75 VAL HG13 . 19554 1 855 . 1 1 78 78 VAL HG21 H 1 0.81 0.02 . 2 . . . . 75 VAL HG21 . 19554 1 856 . 1 1 78 78 VAL HG22 H 1 0.81 0.02 . 2 . . . . 75 VAL HG22 . 19554 1 857 . 1 1 78 78 VAL HG23 H 1 0.81 0.02 . 2 . . . . 75 VAL HG23 . 19554 1 858 . 1 1 78 78 VAL C C 13 176.46 0.25 . 1 . . . . 75 VAL C . 19554 1 859 . 1 1 78 78 VAL CA C 13 62.26 0.25 . 1 . . . . 75 VAL CA . 19554 1 860 . 1 1 78 78 VAL CB C 13 32.64 0.25 . 1 . . . . 75 VAL CB . 19554 1 861 . 1 1 78 78 VAL CG1 C 13 20.68 0.25 . 2 . . . . 75 VAL CG1 . 19554 1 862 . 1 1 78 78 VAL CG2 C 13 21.25 0.25 . 2 . . . . 75 VAL CG2 . 19554 1 863 . 1 1 78 78 VAL N N 15 118.41 0.15 . 1 . . . . 75 VAL N . 19554 1 864 . 1 1 79 79 GLU H H 1 8.38 0.02 . 1 . . . . 76 GLU H . 19554 1 865 . 1 1 79 79 GLU HA H 1 4.14 0.02 . 1 . . . . 76 GLU HA . 19554 1 866 . 1 1 79 79 GLU HB2 H 1 1.94 0.02 . 2 . . . . 76 GLU HB2 . 19554 1 867 . 1 1 79 79 GLU HB3 H 1 1.81 0.02 . 2 . . . . 76 GLU HB3 . 19554 1 868 . 1 1 79 79 GLU HG2 H 1 2.13 0.02 . 1 . . . . 76 GLU HG2 . 19554 1 869 . 1 1 79 79 GLU HG3 H 1 2.13 0.02 . 1 . . . . 76 GLU HG3 . 19554 1 870 . 1 1 79 79 GLU C C 13 176.41 0.25 . 1 . . . . 76 GLU C . 19554 1 871 . 1 1 79 79 GLU CA C 13 56.91 0.25 . 1 . . . . 76 GLU CA . 19554 1 872 . 1 1 79 79 GLU CB C 13 29.89 0.25 . 1 . . . . 76 GLU CB . 19554 1 873 . 1 1 79 79 GLU CG C 13 36.35 0.25 . 1 . . . . 76 GLU CG . 19554 1 874 . 1 1 79 79 GLU N N 15 123.87 0.15 . 1 . . . . 76 GLU N . 19554 1 875 . 1 1 80 80 ASP H H 1 8.27 0.02 . 1 . . . . 77 ASP H . 19554 1 876 . 1 1 80 80 ASP HA H 1 4.44 0.02 . 1 . . . . 77 ASP HA . 19554 1 877 . 1 1 80 80 ASP HB2 H 1 2.58 0.02 . 2 . . . . 77 ASP HB2 . 19554 1 878 . 1 1 80 80 ASP HB3 H 1 2.56 0.02 . 2 . . . . 77 ASP HB3 . 19554 1 879 . 1 1 80 80 ASP C C 13 176.86 0.25 . 1 . . . . 77 ASP C . 19554 1 880 . 1 1 80 80 ASP CA C 13 54.52 0.25 . 1 . . . . 77 ASP CA . 19554 1 881 . 1 1 80 80 ASP CB C 13 41.08 0.25 . 1 . . . . 77 ASP CB . 19554 1 882 . 1 1 80 80 ASP N N 15 121.30 0.15 . 1 . . . . 77 ASP N . 19554 1 883 . 1 1 81 81 GLY H H 1 8.18 0.02 . 1 . . . . 78 GLY H . 19554 1 884 . 1 1 81 81 GLY HA2 H 1 3.77 0.02 . 2 . . . . 78 GLY HA2 . 19554 1 885 . 1 1 81 81 GLY HA3 H 1 3.78 0.02 . 2 . . . . 78 GLY HA3 . 19554 1 886 . 1 1 81 81 GLY C C 13 174.46 0.25 . 1 . . . . 78 GLY C . 19554 1 887 . 1 1 81 81 GLY CA C 13 45.54 0.25 . 1 . . . . 78 GLY CA . 19554 1 888 . 1 1 81 81 GLY N N 15 108.55 0.15 . 1 . . . . 78 GLY N . 19554 1 889 . 1 1 82 82 PHE H H 1 8.08 0.02 . 1 . . . . 79 PHE H . 19554 1 890 . 1 1 82 82 PHE HA H 1 4.49 0.02 . 1 . . . . 79 PHE HA . 19554 1 891 . 1 1 82 82 PHE HB2 H 1 2.98 0.02 . 2 . . . . 79 PHE HB2 . 19554 1 892 . 1 1 82 82 PHE HB3 H 1 3.10 0.02 . 2 . . . . 79 PHE HB3 . 19554 1 893 . 1 1 82 82 PHE HD1 H 1 7.15 0.02 . 3 . . . . 79 PHE HD1 . 19554 1 894 . 1 1 82 82 PHE HD2 H 1 7.15 0.02 . 3 . . . . 79 PHE HD2 . 19554 1 895 . 1 1 82 82 PHE HE1 H 1 7.22 0.02 . 3 . . . . 79 PHE HE1 . 19554 1 896 . 1 1 82 82 PHE HE2 H 1 7.22 0.02 . 3 . . . . 79 PHE HE2 . 19554 1 897 . 1 1 82 82 PHE HZ H 1 7.02 0.02 . 1 . . . . 79 PHE HZ . 19554 1 898 . 1 1 82 82 PHE C C 13 176.52 0.25 . 1 . . . . 79 PHE C . 19554 1 899 . 1 1 82 82 PHE CA C 13 58.22 0.25 . 1 . . . . 79 PHE CA . 19554 1 900 . 1 1 82 82 PHE CB C 13 39.41 0.25 . 1 . . . . 79 PHE CB . 19554 1 901 . 1 1 82 82 PHE N N 15 120.13 0.15 . 1 . . . . 79 PHE N . 19554 1 902 . 1 1 83 83 GLY H H 1 8.32 0.02 . 1 . . . . 80 GLY H . 19554 1 903 . 1 1 83 83 GLY HA2 H 1 3.83 0.02 . 2 . . . . 80 GLY HA2 . 19554 1 904 . 1 1 83 83 GLY HA3 H 1 3.74 0.02 . 2 . . . . 80 GLY HA3 . 19554 1 905 . 1 1 83 83 GLY C C 13 174.29 0.25 . 1 . . . . 80 GLY C . 19554 1 906 . 1 1 83 83 GLY CA C 13 45.33 0.25 . 1 . . . . 80 GLY CA . 19554 1 907 . 1 1 83 83 GLY N N 15 110.02 0.15 . 1 . . . . 80 GLY N . 19554 1 908 . 1 1 84 84 GLU H H 1 8.17 0.02 . 1 . . . . 81 GLU H . 19554 1 909 . 1 1 84 84 GLU HA H 1 4.20 0.02 . 1 . . . . 81 GLU HA . 19554 1 910 . 1 1 84 84 GLU HB2 H 1 1.88 0.02 . 2 . . . . 81 GLU HB2 . 19554 1 911 . 1 1 84 84 GLU HB3 H 1 1.94 0.02 . 2 . . . . 81 GLU HB3 . 19554 1 912 . 1 1 84 84 GLU HG2 H 1 2.12 0.02 . 2 . . . . 81 GLU HG2 . 19554 1 913 . 1 1 84 84 GLU HG3 H 1 2.18 0.02 . 2 . . . . 81 GLU HG3 . 19554 1 914 . 1 1 84 84 GLU C C 13 177.14 0.25 . 1 . . . . 81 GLU C . 19554 1 915 . 1 1 84 84 GLU CA C 13 56.90 0.25 . 1 . . . . 81 GLU CA . 19554 1 916 . 1 1 84 84 GLU CB C 13 29.52 0.25 . 1 . . . . 81 GLU CB . 19554 1 917 . 1 1 84 84 GLU CG C 13 36.30 0.25 . 1 . . . . 81 GLU CG . 19554 1 918 . 1 1 84 84 GLU N N 15 120.56 0.15 . 1 . . . . 81 GLU N . 19554 1 919 . 1 1 85 85 THR H H 1 8.19 0.02 . 1 . . . . 82 THR H . 19554 1 920 . 1 1 85 85 THR HA H 1 4.21 0.02 . 1 . . . . 82 THR HA . 19554 1 921 . 1 1 85 85 THR HB H 1 4.21 0.02 . 1 . . . . 82 THR HB . 19554 1 922 . 1 1 85 85 THR HG21 H 1 1.11 0.02 . 1 . . . . 82 THR HG21 . 19554 1 923 . 1 1 85 85 THR HG22 H 1 1.11 0.02 . 1 . . . . 82 THR HG22 . 19554 1 924 . 1 1 85 85 THR HG23 H 1 1.11 0.02 . 1 . . . . 82 THR HG23 . 19554 1 925 . 1 1 85 85 THR CA C 13 62.20 0.25 . 1 . . . . 82 THR CA . 19554 1 926 . 1 1 85 85 THR CB C 13 69.61 0.25 . 1 . . . . 82 THR CB . 19554 1 927 . 1 1 85 85 THR CG2 C 13 21.57 0.25 . 1 . . . . 82 THR CG2 . 19554 1 928 . 1 1 85 85 THR N N 15 114.98 0.15 . 1 . . . . 82 THR N . 19554 1 929 . 1 1 92 92 ALA HA H 1 4.16 0.02 . 1 . . . A 89 ALA HA . 19554 1 930 . 1 1 92 92 ALA HB1 H 1 1.42 0.02 . 1 . . . A 89 ALA HB1 . 19554 1 931 . 1 1 92 92 ALA HB2 H 1 1.42 0.02 . 1 . . . A 89 ALA HB2 . 19554 1 932 . 1 1 92 92 ALA HB3 H 1 1.42 0.02 . 1 . . . A 89 ALA HB3 . 19554 1 933 . 1 1 92 92 ALA C C 13 179.72 0.25 . 1 . . . A 89 ALA C . 19554 1 934 . 1 1 92 92 ALA CA C 13 54.49 0.25 . 1 . . . A 89 ALA CA . 19554 1 935 . 1 1 92 92 ALA CB C 13 18.22 0.25 . 1 . . . A 89 ALA CB . 19554 1 936 . 1 1 93 93 LYS H H 1 7.98 0.02 . 1 . . . A 90 LYS H . 19554 1 937 . 1 1 93 93 LYS C C 13 179.09 0.25 . 1 . . . A 90 LYS C . 19554 1 938 . 1 1 93 93 LYS N N 15 119.50 0.15 . 1 . . . A 90 LYS N . 19554 1 939 . 1 1 94 94 ARG H H 1 8.01 0.02 . 1 . . . A 91 ARG H . 19554 1 940 . 1 1 94 94 ARG HA H 1 4.15 0.02 . 1 . . . A 91 ARG HA . 19554 1 941 . 1 1 94 94 ARG HB2 H 1 1.86 0.02 . 2 . . . A 91 ARG HB2 . 19554 1 942 . 1 1 94 94 ARG HB3 H 1 1.91 0.02 . 2 . . . A 91 ARG HB3 . 19554 1 943 . 1 1 94 94 ARG HG2 H 1 1.70 0.02 . 2 . . . A 91 ARG HG2 . 19554 1 944 . 1 1 94 94 ARG HG3 H 1 1.65 0.02 . 2 . . . A 91 ARG HG3 . 19554 1 945 . 1 1 94 94 ARG HD2 H 1 3.14 0.02 . 2 . . . A 91 ARG HD2 . 19554 1 946 . 1 1 94 94 ARG HD3 H 1 3.15 0.02 . 2 . . . A 91 ARG HD3 . 19554 1 947 . 1 1 94 94 ARG CA C 13 58.30 0.25 . 1 . . . A 91 ARG CA . 19554 1 948 . 1 1 94 94 ARG CB C 13 30.02 0.25 . 1 . . . A 91 ARG CB . 19554 1 949 . 1 1 94 94 ARG CG C 13 27.63 0.25 . 1 . . . A 91 ARG CG . 19554 1 950 . 1 1 94 94 ARG CD C 13 43.09 0.25 . 1 . . . A 91 ARG CD . 19554 1 951 . 1 1 94 94 ARG N N 15 120.51 0.15 . 1 . . . A 91 ARG N . 19554 1 952 . 1 1 95 95 HIS HA H 1 4.12 0.02 . 1 . . . A 92 HIS HA . 19554 1 953 . 1 1 95 95 HIS HB2 H 1 3.01 0.02 . 2 . . . A 92 HIS HB2 . 19554 1 954 . 1 1 95 95 HIS HB3 H 1 3.09 0.02 . 2 . . . A 92 HIS HB3 . 19554 1 955 . 1 1 95 95 HIS HD2 H 1 7.57 0.02 . 1 . . . A 92 HIS HD2 . 19554 1 956 . 1 1 95 95 HIS HE1 H 1 7.87 0.02 . 1 . . . A 92 HIS HE1 . 19554 1 957 . 1 1 95 95 HIS C C 13 177.36 0.25 . 1 . . . A 92 HIS C . 19554 1 958 . 1 1 95 95 HIS CB C 13 29.87 0.25 . 1 . . . A 92 HIS CB . 19554 1 959 . 1 1 95 95 HIS CE1 C 13 136.95 0.25 . 1 . . . A 92 HIS CE1 . 19554 1 960 . 1 1 96 96 GLU H H 1 8.19 0.02 . 1 . . . A 93 GLU H . 19554 1 961 . 1 1 96 96 GLU HA H 1 3.90 0.02 . 1 . . . A 93 GLU HA . 19554 1 962 . 1 1 96 96 GLU HB2 H 1 2.03 0.02 . 1 . . . A 93 GLU HB2 . 19554 1 963 . 1 1 96 96 GLU HG2 H 1 2.35 0.02 . 2 . . . A 93 GLU HG2 . 19554 1 964 . 1 1 96 96 GLU HG3 H 1 2.26 0.02 . 2 . . . A 93 GLU HG3 . 19554 1 965 . 1 1 96 96 GLU C C 13 178.74 0.25 . 1 . . . A 93 GLU C . 19554 1 966 . 1 1 96 96 GLU CA C 13 59.16 0.25 . 1 . . . A 93 GLU CA . 19554 1 967 . 1 1 96 96 GLU CB C 13 28.96 0.25 . 1 . . . A 93 GLU CB . 19554 1 968 . 1 1 96 96 GLU CG C 13 36.24 0.25 . 1 . . . A 93 GLU CG . 19554 1 969 . 1 1 96 96 GLU N N 15 118.47 0.15 . 1 . . . A 93 GLU N . 19554 1 970 . 1 1 97 97 ALA H H 1 8.09 0.02 . 1 . . . A 94 ALA H . 19554 1 971 . 1 1 97 97 ALA HA H 1 4.07 0.02 . 1 . . . A 94 ALA HA . 19554 1 972 . 1 1 97 97 ALA HB1 H 1 1.44 0.02 . 1 . . . A 94 ALA HB1 . 19554 1 973 . 1 1 97 97 ALA HB2 H 1 1.44 0.02 . 1 . . . A 94 ALA HB2 . 19554 1 974 . 1 1 97 97 ALA HB3 H 1 1.44 0.02 . 1 . . . A 94 ALA HB3 . 19554 1 975 . 1 1 97 97 ALA C C 13 180.33 0.25 . 1 . . . A 94 ALA C . 19554 1 976 . 1 1 97 97 ALA CA C 13 54.94 0.25 . 1 . . . A 94 ALA CA . 19554 1 977 . 1 1 97 97 ALA CB C 13 18.25 0.25 . 1 . . . A 94 ALA CB . 19554 1 978 . 1 1 97 97 ALA N N 15 123.08 0.15 . 1 . . . A 94 ALA N . 19554 1 979 . 1 1 98 98 TRP H H 1 8.06 0.02 . 1 . . . A 95 TRP H . 19554 1 980 . 1 1 98 98 TRP HA H 1 4.04 0.02 . 1 . . . A 95 TRP HA . 19554 1 981 . 1 1 98 98 TRP HB2 H 1 3.22 0.02 . 2 . . . A 95 TRP HB2 . 19554 1 982 . 1 1 98 98 TRP HB3 H 1 3.18 0.02 . 2 . . . A 95 TRP HB3 . 19554 1 983 . 1 1 98 98 TRP HD1 H 1 7.11 0.02 . 1 . . . A 95 TRP HD1 . 19554 1 984 . 1 1 98 98 TRP HE1 H 1 10.05 0.02 . 1 . . . A 95 TRP HE1 . 19554 1 985 . 1 1 98 98 TRP HE3 H 1 7.39 0.02 . 1 . . . A 95 TRP HE3 . 19554 1 986 . 1 1 98 98 TRP HZ2 H 1 7.34 0.02 . 1 . . . A 95 TRP HZ2 . 19554 1 987 . 1 1 98 98 TRP HZ3 H 1 6.62 0.02 . 1 . . . A 95 TRP HZ3 . 19554 1 988 . 1 1 98 98 TRP HH2 H 1 6.69 0.02 . 1 . . . A 95 TRP HH2 . 19554 1 989 . 1 1 98 98 TRP C C 13 178.59 0.25 . 1 . . . A 95 TRP C . 19554 1 990 . 1 1 98 98 TRP CA C 13 61.00 0.25 . 1 . . . A 95 TRP CA . 19554 1 991 . 1 1 98 98 TRP CB C 13 29.16 0.25 . 1 . . . A 95 TRP CB . 19554 1 992 . 1 1 98 98 TRP CD1 C 13 126.81 0.25 . 1 . . . A 95 TRP CD1 . 19554 1 993 . 1 1 98 98 TRP CE3 C 13 121.00 0.25 . 1 . . . A 95 TRP CE3 . 19554 1 994 . 1 1 98 98 TRP CZ2 C 13 114.26 0.25 . 1 . . . A 95 TRP CZ2 . 19554 1 995 . 1 1 98 98 TRP CZ3 C 13 124.70 0.25 . 1 . . . A 95 TRP CZ3 . 19554 1 996 . 1 1 98 98 TRP CH2 C 13 124.47 0.25 . 1 . . . A 95 TRP CH2 . 19554 1 997 . 1 1 98 98 TRP N N 15 119.19 0.15 . 1 . . . A 95 TRP N . 19554 1 998 . 1 1 98 98 TRP NE1 N 15 128.37 0.15 . 1 . . . A 95 TRP NE1 . 19554 1 999 . 1 1 99 99 ILE H H 1 7.85 0.02 . 1 . . . A 96 ILE H . 19554 1 1000 . 1 1 99 99 ILE HA H 1 3.81 0.02 . 1 . . . A 96 ILE HA . 19554 1 1001 . 1 1 99 99 ILE HB H 1 1.94 0.02 . 1 . . . A 96 ILE HB . 19554 1 1002 . 1 1 99 99 ILE HG12 H 1 1.11 0.02 . 2 . . . A 96 ILE HG12 . 19554 1 1003 . 1 1 99 99 ILE HG13 H 1 1.42 0.02 . 2 . . . A 96 ILE HG13 . 19554 1 1004 . 1 1 99 99 ILE HG21 H 1 0.84 0.02 . 1 . . . A 96 ILE HG21 . 19554 1 1005 . 1 1 99 99 ILE HG22 H 1 0.84 0.02 . 1 . . . A 96 ILE HG22 . 19554 1 1006 . 1 1 99 99 ILE HG23 H 1 0.84 0.02 . 1 . . . A 96 ILE HG23 . 19554 1 1007 . 1 1 99 99 ILE HD11 H 1 0.69 0.02 . 1 . . . A 96 ILE HD11 . 19554 1 1008 . 1 1 99 99 ILE HD12 H 1 0.69 0.02 . 1 . . . A 96 ILE HD12 . 19554 1 1009 . 1 1 99 99 ILE HD13 H 1 0.69 0.02 . 1 . . . A 96 ILE HD13 . 19554 1 1010 . 1 1 99 99 ILE C C 13 179.30 0.25 . 1 . . . A 96 ILE C . 19554 1 1011 . 1 1 99 99 ILE CA C 13 64.54 0.25 . 1 . . . A 96 ILE CA . 19554 1 1012 . 1 1 99 99 ILE CB C 13 37.13 0.25 . 1 . . . A 96 ILE CB . 19554 1 1013 . 1 1 99 99 ILE CG1 C 13 28.27 0.25 . 1 . . . A 96 ILE CG1 . 19554 1 1014 . 1 1 99 99 ILE CG2 C 13 17.33 0.25 . 1 . . . A 96 ILE CG2 . 19554 1 1015 . 1 1 99 99 ILE CD1 C 13 12.46 0.25 . 1 . . . A 96 ILE CD1 . 19554 1 1016 . 1 1 99 99 ILE N N 15 119.57 0.15 . 1 . . . A 96 ILE N . 19554 1 1017 . 1 1 100 100 THR H H 1 7.90 0.02 . 1 . . . A 97 THR H . 19554 1 1018 . 1 1 100 100 THR HA H 1 3.83 0.02 . 1 . . . A 97 THR HA . 19554 1 1019 . 1 1 100 100 THR HB H 1 4.19 0.02 . 1 . . . A 97 THR HB . 19554 1 1020 . 1 1 100 100 THR HG21 H 1 1.13 0.02 . 1 . . . A 97 THR HG21 . 19554 1 1021 . 1 1 100 100 THR HG22 H 1 1.13 0.02 . 1 . . . A 97 THR HG22 . 19554 1 1022 . 1 1 100 100 THR HG23 H 1 1.13 0.02 . 1 . . . A 97 THR HG23 . 19554 1 1023 . 1 1 100 100 THR C C 13 177.08 0.25 . 1 . . . A 97 THR C . 19554 1 1024 . 1 1 100 100 THR CA C 13 66.43 0.25 . 1 . . . A 97 THR CA . 19554 1 1025 . 1 1 100 100 THR CB C 13 68.45 0.25 . 1 . . . A 97 THR CB . 19554 1 1026 . 1 1 100 100 THR CG2 C 13 21.59 0.25 . 1 . . . A 97 THR CG2 . 19554 1 1027 . 1 1 100 100 THR N N 15 117.03 0.15 . 1 . . . A 97 THR N . 19554 1 1028 . 1 1 101 101 LEU H H 1 7.83 0.02 . 1 . . . A 98 LEU H . 19554 1 1029 . 1 1 101 101 LEU HA H 1 3.93 0.02 . 1 . . . A 98 LEU HA . 19554 1 1030 . 1 1 101 101 LEU HB2 H 1 1.60 0.02 . 2 . . . A 98 LEU HB2 . 19554 1 1031 . 1 1 101 101 LEU HB3 H 1 1.59 0.02 . 2 . . . A 98 LEU HB3 . 19554 1 1032 . 1 1 101 101 LEU HG H 1 1.17 0.02 . 1 . . . A 98 LEU HG . 19554 1 1033 . 1 1 101 101 LEU HD11 H 1 0.50 0.02 . 2 . . . A 98 LEU HD11 . 19554 1 1034 . 1 1 101 101 LEU HD12 H 1 0.50 0.02 . 2 . . . A 98 LEU HD12 . 19554 1 1035 . 1 1 101 101 LEU HD13 H 1 0.50 0.02 . 2 . . . A 98 LEU HD13 . 19554 1 1036 . 1 1 101 101 LEU HD21 H 1 0.47 0.02 . 2 . . . A 98 LEU HD21 . 19554 1 1037 . 1 1 101 101 LEU HD22 H 1 0.47 0.02 . 2 . . . A 98 LEU HD22 . 19554 1 1038 . 1 1 101 101 LEU HD23 H 1 0.47 0.02 . 2 . . . A 98 LEU HD23 . 19554 1 1039 . 1 1 101 101 LEU C C 13 178.16 0.25 . 1 . . . A 98 LEU C . 19554 1 1040 . 1 1 101 101 LEU CA C 13 57.73 0.25 . 1 . . . A 98 LEU CA . 19554 1 1041 . 1 1 101 101 LEU CB C 13 41.54 0.25 . 1 . . . A 98 LEU CB . 19554 1 1042 . 1 1 101 101 LEU CD1 C 13 23.98 0.25 . 2 . . . A 98 LEU CD1 . 19554 1 1043 . 1 1 101 101 LEU CD2 C 13 25.93 0.25 . 2 . . . A 98 LEU CD2 . 19554 1 1044 . 1 1 101 101 LEU N N 15 123.11 0.15 . 1 . . . A 98 LEU N . 19554 1 1045 . 1 1 102 102 GLU H H 1 8.56 0.02 . 1 . . . A 99 GLU H . 19554 1 1046 . 1 1 102 102 GLU HA H 1 3.88 0.02 . 1 . . . A 99 GLU HA . 19554 1 1047 . 1 1 102 102 GLU HB2 H 1 2.10 0.02 . 2 . . . A 99 GLU HB2 . 19554 1 1048 . 1 1 102 102 GLU HB3 H 1 2.21 0.02 . 2 . . . A 99 GLU HB3 . 19554 1 1049 . 1 1 102 102 GLU HG2 H 1 2.21 0.02 . 2 . . . A 99 GLU HG2 . 19554 1 1050 . 1 1 102 102 GLU HG3 H 1 2.36 0.02 . 2 . . . A 99 GLU HG3 . 19554 1 1051 . 1 1 102 102 GLU C C 13 179.01 0.25 . 1 . . . A 99 GLU C . 19554 1 1052 . 1 1 102 102 GLU CA C 13 59.92 0.25 . 1 . . . A 99 GLU CA . 19554 1 1053 . 1 1 102 102 GLU CB C 13 29.35 0.25 . 1 . . . A 99 GLU CB . 19554 1 1054 . 1 1 102 102 GLU CG C 13 36.45 0.25 . 1 . . . A 99 GLU CG . 19554 1 1055 . 1 1 102 102 GLU N N 15 120.52 0.15 . 1 . . . A 99 GLU N . 19554 1 1056 . 1 1 103 103 LYS H H 1 7.80 0.02 . 1 . . . A 100 LYS H . 19554 1 1057 . 1 1 103 103 LYS HA H 1 4.03 0.02 . 1 . . . A 100 LYS HA . 19554 1 1058 . 1 1 103 103 LYS HB2 H 1 1.78 0.02 . 2 . . . A 100 LYS HB2 . 19554 1 1059 . 1 1 103 103 LYS HB3 H 1 1.85 0.02 . 2 . . . A 100 LYS HB3 . 19554 1 1060 . 1 1 103 103 LYS HG2 H 1 1.34 0.02 . 2 . . . A 100 LYS HG2 . 19554 1 1061 . 1 1 103 103 LYS HG3 H 1 1.38 0.02 . 2 . . . A 100 LYS HG3 . 19554 1 1062 . 1 1 103 103 LYS HD2 H 1 1.61 0.02 . 2 . . . A 100 LYS HD2 . 19554 1 1063 . 1 1 103 103 LYS HD3 H 1 1.63 0.02 . 2 . . . A 100 LYS HD3 . 19554 1 1064 . 1 1 103 103 LYS HE2 H 1 2.85 0.02 . 2 . . . A 100 LYS HE2 . 19554 1 1065 . 1 1 103 103 LYS HE3 H 1 2.85 0.02 . 2 . . . A 100 LYS HE3 . 19554 1 1066 . 1 1 103 103 LYS C C 13 177.87 0.25 . 1 . . . A 100 LYS C . 19554 1 1067 . 1 1 103 103 LYS CA C 13 58.57 0.25 . 1 . . . A 100 LYS CA . 19554 1 1068 . 1 1 103 103 LYS CB C 13 31.72 0.25 . 1 . . . A 100 LYS CB . 19554 1 1069 . 1 1 103 103 LYS CG C 13 24.67 0.25 . 1 . . . A 100 LYS CG . 19554 1 1070 . 1 1 103 103 LYS CD C 13 28.90 0.25 . 1 . . . A 100 LYS CD . 19554 1 1071 . 1 1 103 103 LYS CE C 13 41.86 0.25 . 1 . . . A 100 LYS CE . 19554 1 1072 . 1 1 103 103 LYS N N 15 119.95 0.15 . 1 . . . A 100 LYS N . 19554 1 1073 . 1 1 104 104 ALA H H 1 7.80 0.02 . 1 . . . A 101 ALA H . 19554 1 1074 . 1 1 104 104 ALA HA H 1 4.02 0.02 . 1 . . . A 101 ALA HA . 19554 1 1075 . 1 1 104 104 ALA HB1 H 1 1.37 0.02 . 1 . . . A 101 ALA HB1 . 19554 1 1076 . 1 1 104 104 ALA HB2 H 1 1.37 0.02 . 1 . . . A 101 ALA HB2 . 19554 1 1077 . 1 1 104 104 ALA HB3 H 1 1.37 0.02 . 1 . . . A 101 ALA HB3 . 19554 1 1078 . 1 1 104 104 ALA C C 13 180.99 0.25 . 1 . . . A 101 ALA C . 19554 1 1079 . 1 1 104 104 ALA CA C 13 55.12 0.25 . 1 . . . A 101 ALA CA . 19554 1 1080 . 1 1 104 104 ALA CB C 13 17.58 0.25 . 1 . . . A 101 ALA CB . 19554 1 1081 . 1 1 104 104 ALA N N 15 120.69 0.15 . 1 . . . A 101 ALA N . 19554 1 1082 . 1 1 105 105 TYR H H 1 8.58 0.02 . 1 . . . A 102 TYR H . 19554 1 1083 . 1 1 105 105 TYR HA H 1 4.32 0.02 . 1 . . . A 102 TYR HA . 19554 1 1084 . 1 1 105 105 TYR HB2 H 1 3.19 0.02 . 2 . . . A 102 TYR HB2 . 19554 1 1085 . 1 1 105 105 TYR HB3 H 1 2.90 0.02 . 2 . . . A 102 TYR HB3 . 19554 1 1086 . 1 1 105 105 TYR HD1 H 1 7.03 0.02 . 3 . . . A 102 TYR HD1 . 19554 1 1087 . 1 1 105 105 TYR HD2 H 1 7.03 0.02 . 3 . . . A 102 TYR HD2 . 19554 1 1088 . 1 1 105 105 TYR HE1 H 1 6.69 0.02 . 3 . . . A 102 TYR HE1 . 19554 1 1089 . 1 1 105 105 TYR HE2 H 1 6.69 0.02 . 3 . . . A 102 TYR HE2 . 19554 1 1090 . 1 1 105 105 TYR C C 13 178.59 0.25 . 1 . . . A 102 TYR C . 19554 1 1091 . 1 1 105 105 TYR CA C 13 59.81 0.25 . 1 . . . A 102 TYR CA . 19554 1 1092 . 1 1 105 105 TYR CB C 13 38.69 0.25 . 1 . . . A 102 TYR CB . 19554 1 1093 . 1 1 105 105 TYR CD1 C 13 133.39 0.25 . 3 . . . A 102 TYR CD1 . 19554 1 1094 . 1 1 105 105 TYR CD2 C 13 133.39 0.25 . 3 . . . A 102 TYR CD2 . 19554 1 1095 . 1 1 105 105 TYR CE1 C 13 118.33 0.25 . 3 . . . A 102 TYR CE1 . 19554 1 1096 . 1 1 105 105 TYR CE2 C 13 118.33 0.25 . 3 . . . A 102 TYR CE2 . 19554 1 1097 . 1 1 105 105 TYR N N 15 118.44 0.15 . 1 . . . A 102 TYR N . 19554 1 1098 . 1 1 106 106 GLU H H 1 8.29 0.02 . 1 . . . A 103 GLU H . 19554 1 1099 . 1 1 106 106 GLU HA H 1 3.59 0.02 . 1 . . . A 103 GLU HA . 19554 1 1100 . 1 1 106 106 GLU HB2 H 1 2.07 0.02 . 2 . . . A 103 GLU HB2 . 19554 1 1101 . 1 1 106 106 GLU HB3 H 1 2.00 0.02 . 2 . . . A 103 GLU HB3 . 19554 1 1102 . 1 1 106 106 GLU HG2 H 1 2.29 0.02 . 2 . . . A 103 GLU HG2 . 19554 1 1103 . 1 1 106 106 GLU HG3 H 1 2.42 0.02 . 2 . . . A 103 GLU HG3 . 19554 1 1104 . 1 1 106 106 GLU C C 13 178.10 0.25 . 1 . . . A 103 GLU C . 19554 1 1105 . 1 1 106 106 GLU CA C 13 59.08 0.25 . 1 . . . A 103 GLU CA . 19554 1 1106 . 1 1 106 106 GLU CB C 13 29.42 0.25 . 1 . . . A 103 GLU CB . 19554 1 1107 . 1 1 106 106 GLU CG C 13 35.99 0.25 . 1 . . . A 103 GLU CG . 19554 1 1108 . 1 1 106 106 GLU N N 15 120.86 0.15 . 1 . . . A 103 GLU N . 19554 1 1109 . 1 1 107 107 ASP H H 1 8.12 0.02 . 1 . . . A 104 ASP H . 19554 1 1110 . 1 1 107 107 ASP HA H 1 4.61 0.02 . 1 . . . A 104 ASP HA . 19554 1 1111 . 1 1 107 107 ASP HB2 H 1 2.47 0.02 . 2 . . . A 104 ASP HB2 . 19554 1 1112 . 1 1 107 107 ASP HB3 H 1 2.76 0.02 . 2 . . . A 104 ASP HB3 . 19554 1 1113 . 1 1 107 107 ASP C C 13 174.97 0.25 . 1 . . . A 104 ASP C . 19554 1 1114 . 1 1 107 107 ASP CA C 13 54.12 0.25 . 1 . . . A 104 ASP CA . 19554 1 1115 . 1 1 107 107 ASP CB C 13 40.48 0.25 . 1 . . . A 104 ASP CB . 19554 1 1116 . 1 1 107 107 ASP N N 15 116.12 0.15 . 1 . . . A 104 ASP N . 19554 1 1117 . 1 1 108 108 ALA H H 1 7.71 0.02 . 1 . . . A 105 ALA H . 19554 1 1118 . 1 1 108 108 ALA HA H 1 4.15 0.02 . 1 . . . A 105 ALA HA . 19554 1 1119 . 1 1 108 108 ALA HB1 H 1 1.28 0.02 . 1 . . . A 105 ALA HB1 . 19554 1 1120 . 1 1 108 108 ALA HB2 H 1 1.28 0.02 . 1 . . . A 105 ALA HB2 . 19554 1 1121 . 1 1 108 108 ALA HB3 H 1 1.28 0.02 . 1 . . . A 105 ALA HB3 . 19554 1 1122 . 1 1 108 108 ALA C C 13 177.13 0.25 . 1 . . . A 105 ALA C . 19554 1 1123 . 1 1 108 108 ALA CA C 13 52.64 0.25 . 1 . . . A 105 ALA CA . 19554 1 1124 . 1 1 108 108 ALA CB C 13 16.30 0.25 . 1 . . . A 105 ALA CB . 19554 1 1125 . 1 1 108 108 ALA N N 15 123.33 0.15 . 1 . . . A 105 ALA N . 19554 1 1126 . 1 1 109 109 GLU H H 1 8.44 0.02 . 1 . . . A 106 GLU H . 19554 1 1127 . 1 1 109 109 GLU HA H 1 4.30 0.02 . 1 . . . A 106 GLU HA . 19554 1 1128 . 1 1 109 109 GLU HB2 H 1 1.97 0.02 . 2 . . . A 106 GLU HB2 . 19554 1 1129 . 1 1 109 109 GLU HB3 H 1 1.69 0.02 . 2 . . . A 106 GLU HB3 . 19554 1 1130 . 1 1 109 109 GLU HG2 H 1 2.17 0.02 . 2 . . . A 106 GLU HG2 . 19554 1 1131 . 1 1 109 109 GLU HG3 H 1 2.25 0.02 . 2 . . . A 106 GLU HG3 . 19554 1 1132 . 1 1 109 109 GLU C C 13 176.73 0.25 . 1 . . . A 106 GLU C . 19554 1 1133 . 1 1 109 109 GLU CA C 13 55.44 0.25 . 1 . . . A 106 GLU CA . 19554 1 1134 . 1 1 109 109 GLU CB C 13 31.76 0.25 . 1 . . . A 106 GLU CB . 19554 1 1135 . 1 1 109 109 GLU CG C 13 36.21 0.25 . 1 . . . A 106 GLU CG . 19554 1 1136 . 1 1 109 109 GLU N N 15 118.95 0.15 . 1 . . . A 106 GLU N . 19554 1 1137 . 1 1 110 110 THR H H 1 8.74 0.02 . 1 . . . A 107 THR H . 19554 1 1138 . 1 1 110 110 THR HA H 1 4.55 0.02 . 1 . . . A 107 THR HA . 19554 1 1139 . 1 1 110 110 THR HB H 1 3.98 0.02 . 1 . . . A 107 THR HB . 19554 1 1140 . 1 1 110 110 THR HG21 H 1 1.09 0.02 . 1 . . . A 107 THR HG21 . 19554 1 1141 . 1 1 110 110 THR HG22 H 1 1.09 0.02 . 1 . . . A 107 THR HG22 . 19554 1 1142 . 1 1 110 110 THR HG23 H 1 1.09 0.02 . 1 . . . A 107 THR HG23 . 19554 1 1143 . 1 1 110 110 THR C C 13 174.25 0.25 . 1 . . . A 107 THR C . 19554 1 1144 . 1 1 110 110 THR CA C 13 62.36 0.25 . 1 . . . A 107 THR CA . 19554 1 1145 . 1 1 110 110 THR CB C 13 69.39 0.25 . 1 . . . A 107 THR CB . 19554 1 1146 . 1 1 110 110 THR CG2 C 13 23.55 0.25 . 1 . . . A 107 THR CG2 . 19554 1 1147 . 1 1 110 110 THR N N 15 118.78 0.15 . 1 . . . A 107 THR N . 19554 1 1148 . 1 1 111 111 VAL H H 1 9.04 0.02 . 1 . . . A 108 VAL H . 19554 1 1149 . 1 1 111 111 VAL HA H 1 4.63 0.02 . 1 . . . A 108 VAL HA . 19554 1 1150 . 1 1 111 111 VAL HB H 1 2.00 0.02 . 1 . . . A 108 VAL HB . 19554 1 1151 . 1 1 111 111 VAL HG11 H 1 0.70 0.02 . 2 . . . A 108 VAL HG11 . 19554 1 1152 . 1 1 111 111 VAL HG12 H 1 0.70 0.02 . 2 . . . A 108 VAL HG12 . 19554 1 1153 . 1 1 111 111 VAL HG13 H 1 0.70 0.02 . 2 . . . A 108 VAL HG13 . 19554 1 1154 . 1 1 111 111 VAL HG21 H 1 0.54 0.02 . 2 . . . A 108 VAL HG21 . 19554 1 1155 . 1 1 111 111 VAL HG22 H 1 0.54 0.02 . 2 . . . A 108 VAL HG22 . 19554 1 1156 . 1 1 111 111 VAL HG23 H 1 0.54 0.02 . 2 . . . A 108 VAL HG23 . 19554 1 1157 . 1 1 111 111 VAL C C 13 174.44 0.25 . 1 . . . A 108 VAL C . 19554 1 1158 . 1 1 111 111 VAL CA C 13 59.00 0.25 . 1 . . . A 108 VAL CA . 19554 1 1159 . 1 1 111 111 VAL CB C 13 34.65 0.25 . 1 . . . A 108 VAL CB . 19554 1 1160 . 1 1 111 111 VAL CG1 C 13 21.80 0.25 . 2 . . . A 108 VAL CG1 . 19554 1 1161 . 1 1 111 111 VAL CG2 C 13 19.36 0.25 . 2 . . . A 108 VAL CG2 . 19554 1 1162 . 1 1 111 111 VAL N N 15 120.54 0.15 . 1 . . . A 108 VAL N . 19554 1 1163 . 1 1 112 112 THR H H 1 8.17 0.02 . 1 . . . A 109 THR H . 19554 1 1164 . 1 1 112 112 THR HA H 1 5.38 0.02 . 1 . . . A 109 THR HA . 19554 1 1165 . 1 1 112 112 THR HB H 1 3.88 0.02 . 1 . . . A 109 THR HB . 19554 1 1166 . 1 1 112 112 THR HG21 H 1 1.00 0.02 . 1 . . . A 109 THR HG21 . 19554 1 1167 . 1 1 112 112 THR HG22 H 1 1.00 0.02 . 1 . . . A 109 THR HG22 . 19554 1 1168 . 1 1 112 112 THR HG23 H 1 1.00 0.02 . 1 . . . A 109 THR HG23 . 19554 1 1169 . 1 1 112 112 THR C C 13 174.58 0.25 . 1 . . . A 109 THR C . 19554 1 1170 . 1 1 112 112 THR CA C 13 60.41 0.25 . 1 . . . A 109 THR CA . 19554 1 1171 . 1 1 112 112 THR CB C 13 70.61 0.25 . 1 . . . A 109 THR CB . 19554 1 1172 . 1 1 112 112 THR CG2 C 13 21.75 0.25 . 1 . . . A 109 THR CG2 . 19554 1 1173 . 1 1 112 112 THR N N 15 115.10 0.15 . 1 . . . A 109 THR N . 19554 1 1174 . 1 1 113 113 GLY H H 1 8.78 0.02 . 1 . . . A 110 GLY H . 19554 1 1175 . 1 1 113 113 GLY HA2 H 1 4.66 0.02 . 2 . . . A 110 GLY HA2 . 19554 1 1176 . 1 1 113 113 GLY HA3 H 1 3.63 0.02 . 2 . . . A 110 GLY HA3 . 19554 1 1177 . 1 1 113 113 GLY C C 13 170.81 0.25 . 1 . . . A 110 GLY C . 19554 1 1178 . 1 1 113 113 GLY CA C 13 45.38 0.25 . 1 . . . A 110 GLY CA . 19554 1 1179 . 1 1 113 113 GLY N N 15 108.58 0.15 . 1 . . . A 110 GLY N . 19554 1 1180 . 1 1 114 114 VAL H H 1 7.81 0.02 . 1 . . . A 111 VAL H . 19554 1 1181 . 1 1 114 114 VAL HA H 1 4.78 0.02 . 1 . . . A 111 VAL HA . 19554 1 1182 . 1 1 114 114 VAL HB H 1 1.82 0.02 . 1 . . . A 111 VAL HB . 19554 1 1183 . 1 1 114 114 VAL HG11 H 1 0.77 0.02 . 2 . . . A 111 VAL HG11 . 19554 1 1184 . 1 1 114 114 VAL HG12 H 1 0.77 0.02 . 2 . . . A 111 VAL HG12 . 19554 1 1185 . 1 1 114 114 VAL HG13 H 1 0.77 0.02 . 2 . . . A 111 VAL HG13 . 19554 1 1186 . 1 1 114 114 VAL HG21 H 1 0.71 0.02 . 2 . . . A 111 VAL HG21 . 19554 1 1187 . 1 1 114 114 VAL HG22 H 1 0.71 0.02 . 2 . . . A 111 VAL HG22 . 19554 1 1188 . 1 1 114 114 VAL HG23 H 1 0.71 0.02 . 2 . . . A 111 VAL HG23 . 19554 1 1189 . 1 1 114 114 VAL C C 13 176.06 0.25 . 1 . . . A 111 VAL C . 19554 1 1190 . 1 1 114 114 VAL CA C 13 59.77 0.25 . 1 . . . A 111 VAL CA . 19554 1 1191 . 1 1 114 114 VAL CB C 13 35.75 0.25 . 1 . . . A 111 VAL CB . 19554 1 1192 . 1 1 114 114 VAL CG1 C 13 20.79 0.25 . 2 . . . A 111 VAL CG1 . 19554 1 1193 . 1 1 114 114 VAL CG2 C 13 20.70 0.25 . 2 . . . A 111 VAL CG2 . 19554 1 1194 . 1 1 114 114 VAL N N 15 116.93 0.15 . 1 . . . A 111 VAL N . 19554 1 1195 . 1 1 115 115 ILE H H 1 9.24 0.02 . 1 . . . A 112 ILE H . 19554 1 1196 . 1 1 115 115 ILE HA H 1 4.23 0.02 . 1 . . . A 112 ILE HA . 19554 1 1197 . 1 1 115 115 ILE HB H 1 1.87 0.02 . 1 . . . A 112 ILE HB . 19554 1 1198 . 1 1 115 115 ILE HG12 H 1 1.70 0.02 . 2 . . . A 112 ILE HG12 . 19554 1 1199 . 1 1 115 115 ILE HG13 H 1 0.83 0.02 . 2 . . . A 112 ILE HG13 . 19554 1 1200 . 1 1 115 115 ILE HG21 H 1 0.86 0.02 . 1 . . . A 112 ILE HG21 . 19554 1 1201 . 1 1 115 115 ILE HG22 H 1 0.86 0.02 . 1 . . . A 112 ILE HG22 . 19554 1 1202 . 1 1 115 115 ILE HG23 H 1 0.86 0.02 . 1 . . . A 112 ILE HG23 . 19554 1 1203 . 1 1 115 115 ILE HD11 H 1 0.40 0.02 . 1 . . . A 112 ILE HD11 . 19554 1 1204 . 1 1 115 115 ILE HD12 H 1 0.40 0.02 . 1 . . . A 112 ILE HD12 . 19554 1 1205 . 1 1 115 115 ILE HD13 H 1 0.40 0.02 . 1 . . . A 112 ILE HD13 . 19554 1 1206 . 1 1 115 115 ILE C C 13 176.18 0.25 . 1 . . . A 112 ILE C . 19554 1 1207 . 1 1 115 115 ILE CA C 13 62.22 0.25 . 1 . . . A 112 ILE CA . 19554 1 1208 . 1 1 115 115 ILE CB C 13 37.48 0.25 . 1 . . . A 112 ILE CB . 19554 1 1209 . 1 1 115 115 ILE CG1 C 13 28.54 0.25 . 1 . . . A 112 ILE CG1 . 19554 1 1210 . 1 1 115 115 ILE CG2 C 13 17.66 0.25 . 1 . . . A 112 ILE CG2 . 19554 1 1211 . 1 1 115 115 ILE CD1 C 13 13.42 0.25 . 1 . . . A 112 ILE CD1 . 19554 1 1212 . 1 1 115 115 ILE N N 15 127.06 0.15 . 1 . . . A 112 ILE N . 19554 1 1213 . 1 1 116 116 ASN H H 1 9.01 0.02 . 1 . . . A 113 ASN H . 19554 1 1214 . 1 1 116 116 ASN HA H 1 4.94 0.02 . 1 . . . A 113 ASN HA . 19554 1 1215 . 1 1 116 116 ASN HB2 H 1 2.73 0.02 . 2 . . . A 113 ASN HB2 . 19554 1 1216 . 1 1 116 116 ASN HB3 H 1 2.51 0.02 . 2 . . . A 113 ASN HB3 . 19554 1 1217 . 1 1 116 116 ASN HD21 H 1 6.54 0.02 . 1 . . . A 113 ASN HD21 . 19554 1 1218 . 1 1 116 116 ASN HD22 H 1 7.52 0.02 . 1 . . . A 113 ASN HD22 . 19554 1 1219 . 1 1 116 116 ASN C C 13 175.02 0.25 . 1 . . . A 113 ASN C . 19554 1 1220 . 1 1 116 116 ASN CA C 13 52.29 0.25 . 1 . . . A 113 ASN CA . 19554 1 1221 . 1 1 116 116 ASN CB C 13 39.58 0.25 . 1 . . . A 113 ASN CB . 19554 1 1222 . 1 1 116 116 ASN N N 15 127.51 0.15 . 1 . . . A 113 ASN N . 19554 1 1223 . 1 1 116 116 ASN ND2 N 15 110.09 0.15 . 1 . . . A 113 ASN ND2 . 19554 1 1224 . 1 1 117 117 GLY H H 1 7.62 0.02 . 1 . . . A 114 GLY H . 19554 1 1225 . 1 1 117 117 GLY HA2 H 1 4.04 0.02 . 2 . . . A 114 GLY HA2 . 19554 1 1226 . 1 1 117 117 GLY HA3 H 1 4.11 0.02 . 2 . . . A 114 GLY HA3 . 19554 1 1227 . 1 1 117 117 GLY C C 13 171.36 0.25 . 1 . . . A 114 GLY C . 19554 1 1228 . 1 1 117 117 GLY CA C 13 45.52 0.25 . 1 . . . A 114 GLY CA . 19554 1 1229 . 1 1 117 117 GLY N N 15 107.15 0.15 . 1 . . . A 114 GLY N . 19554 1 1230 . 1 1 118 118 LYS H H 1 8.55 0.02 . 1 . . . A 115 LYS H . 19554 1 1231 . 1 1 118 118 LYS HA H 1 4.59 0.02 . 1 . . . A 115 LYS HA . 19554 1 1232 . 1 1 118 118 LYS HB2 H 1 1.57 0.02 . 2 . . . A 115 LYS HB2 . 19554 1 1233 . 1 1 118 118 LYS HB3 H 1 1.69 0.02 . 2 . . . A 115 LYS HB3 . 19554 1 1234 . 1 1 118 118 LYS HG2 H 1 1.46 0.02 . 2 . . . A 115 LYS HG2 . 19554 1 1235 . 1 1 118 118 LYS HG3 H 1 1.20 0.02 . 2 . . . A 115 LYS HG3 . 19554 1 1236 . 1 1 118 118 LYS HE3 H 1 2.81 0.02 . 1 . . . A 115 LYS HE3 . 19554 1 1237 . 1 1 118 118 LYS C C 13 175.95 0.25 . 1 . . . A 115 LYS C . 19554 1 1238 . 1 1 118 118 LYS CA C 13 55.94 0.25 . 1 . . . A 115 LYS CA . 19554 1 1239 . 1 1 118 118 LYS CB C 13 34.04 0.25 . 1 . . . A 115 LYS CB . 19554 1 1240 . 1 1 118 118 LYS CG C 13 24.81 0.25 . 1 . . . A 115 LYS CG . 19554 1 1241 . 1 1 118 118 LYS CD C 13 29.08 0.25 . 1 . . . A 115 LYS CD . 19554 1 1242 . 1 1 118 118 LYS CE C 13 41.91 0.25 . 1 . . . A 115 LYS CE . 19554 1 1243 . 1 1 118 118 LYS N N 15 121.67 0.15 . 1 . . . A 115 LYS N . 19554 1 1244 . 1 1 119 119 VAL H H 1 8.07 0.02 . 1 . . . A 116 VAL H . 19554 1 1245 . 1 1 119 119 VAL HA H 1 4.47 0.02 . 1 . . . A 116 VAL HA . 19554 1 1246 . 1 1 119 119 VAL HB H 1 2.15 0.02 . 1 . . . A 116 VAL HB . 19554 1 1247 . 1 1 119 119 VAL HG11 H 1 0.55 0.02 . 2 . . . A 116 VAL HG11 . 19554 1 1248 . 1 1 119 119 VAL HG12 H 1 0.55 0.02 . 2 . . . A 116 VAL HG12 . 19554 1 1249 . 1 1 119 119 VAL HG13 H 1 0.55 0.02 . 2 . . . A 116 VAL HG13 . 19554 1 1250 . 1 1 119 119 VAL HG21 H 1 0.73 0.02 . 2 . . . A 116 VAL HG21 . 19554 1 1251 . 1 1 119 119 VAL HG22 H 1 0.73 0.02 . 2 . . . A 116 VAL HG22 . 19554 1 1252 . 1 1 119 119 VAL HG23 H 1 0.73 0.02 . 2 . . . A 116 VAL HG23 . 19554 1 1253 . 1 1 119 119 VAL C C 13 175.11 0.25 . 1 . . . A 116 VAL C . 19554 1 1254 . 1 1 119 119 VAL CA C 13 59.03 0.25 . 1 . . . A 116 VAL CA . 19554 1 1255 . 1 1 119 119 VAL CB C 13 35.50 0.25 . 1 . . . A 116 VAL CB . 19554 1 1256 . 1 1 119 119 VAL CG1 C 13 18.44 0.25 . 2 . . . A 116 VAL CG1 . 19554 1 1257 . 1 1 119 119 VAL CG2 C 13 22.27 0.25 . 2 . . . A 116 VAL CG2 . 19554 1 1258 . 1 1 119 119 VAL N N 15 118.75 0.15 . 1 . . . A 116 VAL N . 19554 1 1259 . 1 1 120 120 LYS H H 1 8.25 0.02 . 1 . . . A 117 LYS H . 19554 1 1260 . 1 1 120 120 LYS HA H 1 3.93 0.02 . 1 . . . A 117 LYS HA . 19554 1 1261 . 1 1 120 120 LYS HB2 H 1 1.57 0.02 . 2 . . . A 117 LYS HB2 . 19554 1 1262 . 1 1 120 120 LYS HB3 H 1 1.62 0.02 . 2 . . . A 117 LYS HB3 . 19554 1 1263 . 1 1 120 120 LYS HD2 H 1 1.56 0.02 . 2 . . . A 117 LYS HD2 . 19554 1 1264 . 1 1 120 120 LYS HD3 H 1 1.58 0.02 . 2 . . . A 117 LYS HD3 . 19554 1 1265 . 1 1 120 120 LYS HE3 H 1 2.91 0.02 . 1 . . . A 117 LYS HE3 . 19554 1 1266 . 1 1 120 120 LYS C C 13 177.97 0.25 . 1 . . . A 117 LYS C . 19554 1 1267 . 1 1 120 120 LYS CA C 13 58.67 0.25 . 1 . . . A 117 LYS CA . 19554 1 1268 . 1 1 120 120 LYS CB C 13 30.94 0.25 . 1 . . . A 117 LYS CB . 19554 1 1269 . 1 1 120 120 LYS CG C 13 24.73 0.25 . 1 . . . A 117 LYS CG . 19554 1 1270 . 1 1 120 120 LYS CD C 13 28.99 0.25 . 1 . . . A 117 LYS CD . 19554 1 1271 . 1 1 120 120 LYS CE C 13 41.86 0.25 . 1 . . . A 117 LYS CE . 19554 1 1272 . 1 1 120 120 LYS N N 15 122.52 0.15 . 1 . . . A 117 LYS N . 19554 1 1273 . 1 1 121 121 GLY H H 1 8.82 0.02 . 1 . . . A 118 GLY H . 19554 1 1274 . 1 1 121 121 GLY HA2 H 1 4.27 0.02 . 2 . . . A 118 GLY HA2 . 19554 1 1275 . 1 1 121 121 GLY HA3 H 1 3.85 0.02 . 2 . . . A 118 GLY HA3 . 19554 1 1276 . 1 1 121 121 GLY C C 13 175.54 0.25 . 1 . . . A 118 GLY C . 19554 1 1277 . 1 1 121 121 GLY CA C 13 45.20 0.25 . 1 . . . A 118 GLY CA . 19554 1 1278 . 1 1 121 121 GLY N N 15 113.44 0.15 . 1 . . . A 118 GLY N . 19554 1 1279 . 1 1 122 122 GLY H H 1 7.93 0.02 . 1 . . . A 119 GLY H . 19554 1 1280 . 1 1 122 122 GLY HA2 H 1 3.35 0.02 . 2 . . . A 119 GLY HA2 . 19554 1 1281 . 1 1 122 122 GLY HA3 H 1 4.47 0.02 . 2 . . . A 119 GLY HA3 . 19554 1 1282 . 1 1 122 122 GLY C C 13 170.53 0.25 . 1 . . . A 119 GLY C . 19554 1 1283 . 1 1 122 122 GLY CA C 13 46.84 0.25 . 1 . . . A 119 GLY CA . 19554 1 1284 . 1 1 122 122 GLY N N 15 109.13 0.15 . 1 . . . A 119 GLY N . 19554 1 1285 . 1 1 123 123 PHE H H 1 8.82 0.02 . 1 . . . A 120 PHE H . 19554 1 1286 . 1 1 123 123 PHE HA H 1 5.27 0.02 . 1 . . . A 120 PHE HA . 19554 1 1287 . 1 1 123 123 PHE HB2 H 1 3.31 0.02 . 2 . . . A 120 PHE HB2 . 19554 1 1288 . 1 1 123 123 PHE HB3 H 1 2.47 0.02 . 2 . . . A 120 PHE HB3 . 19554 1 1289 . 1 1 123 123 PHE HD1 H 1 6.96 0.02 . 3 . . . A 120 PHE HD1 . 19554 1 1290 . 1 1 123 123 PHE HD2 H 1 6.96 0.02 . 3 . . . A 120 PHE HD2 . 19554 1 1291 . 1 1 123 123 PHE HE1 H 1 7.26 0.02 . 3 . . . A 120 PHE HE1 . 19554 1 1292 . 1 1 123 123 PHE HE2 H 1 7.26 0.02 . 3 . . . A 120 PHE HE2 . 19554 1 1293 . 1 1 123 123 PHE HZ H 1 6.96 0.02 . 1 . . . A 120 PHE HZ . 19554 1 1294 . 1 1 123 123 PHE C C 13 174.26 0.25 . 1 . . . A 120 PHE C . 19554 1 1295 . 1 1 123 123 PHE CA C 13 56.34 0.25 . 1 . . . A 120 PHE CA . 19554 1 1296 . 1 1 123 123 PHE CB C 13 43.73 0.25 . 1 . . . A 120 PHE CB . 19554 1 1297 . 1 1 123 123 PHE N N 15 123.37 0.15 . 1 . . . A 120 PHE N . 19554 1 1298 . 1 1 124 124 THR H H 1 8.67 0.02 . 1 . . . A 121 THR H . 19554 1 1299 . 1 1 124 124 THR HA H 1 5.00 0.02 . 1 . . . A 121 THR HA . 19554 1 1300 . 1 1 124 124 THR HB H 1 4.02 0.02 . 1 . . . A 121 THR HB . 19554 1 1301 . 1 1 124 124 THR HG21 H 1 1.09 0.02 . 1 . . . A 121 THR HG21 . 19554 1 1302 . 1 1 124 124 THR HG22 H 1 1.09 0.02 . 1 . . . A 121 THR HG22 . 19554 1 1303 . 1 1 124 124 THR HG23 H 1 1.09 0.02 . 1 . . . A 121 THR HG23 . 19554 1 1304 . 1 1 124 124 THR C C 13 173.78 0.25 . 1 . . . A 121 THR C . 19554 1 1305 . 1 1 124 124 THR CA C 13 60.50 0.25 . 1 . . . A 121 THR CA . 19554 1 1306 . 1 1 124 124 THR CB C 13 69.91 0.25 . 1 . . . A 121 THR CB . 19554 1 1307 . 1 1 124 124 THR CG2 C 13 22.29 0.25 . 1 . . . A 121 THR CG2 . 19554 1 1308 . 1 1 124 124 THR N N 15 114.67 0.15 . 1 . . . A 121 THR N . 19554 1 1309 . 1 1 125 125 VAL H H 1 8.56 0.02 . 1 . . . A 122 VAL H . 19554 1 1310 . 1 1 125 125 VAL HA H 1 4.60 0.02 . 1 . . . A 122 VAL HA . 19554 1 1311 . 1 1 125 125 VAL HB H 1 1.10 0.02 . 1 . . . A 122 VAL HB . 19554 1 1312 . 1 1 125 125 VAL HG11 H 1 0.07 0.02 . 2 . . . A 122 VAL HG11 . 19554 1 1313 . 1 1 125 125 VAL HG12 H 1 0.07 0.02 . 2 . . . A 122 VAL HG12 . 19554 1 1314 . 1 1 125 125 VAL HG13 H 1 0.07 0.02 . 2 . . . A 122 VAL HG13 . 19554 1 1315 . 1 1 125 125 VAL HG21 H 1 0.31 0.02 . 2 . . . A 122 VAL HG21 . 19554 1 1316 . 1 1 125 125 VAL HG22 H 1 0.31 0.02 . 2 . . . A 122 VAL HG22 . 19554 1 1317 . 1 1 125 125 VAL HG23 H 1 0.31 0.02 . 2 . . . A 122 VAL HG23 . 19554 1 1318 . 1 1 125 125 VAL C C 13 174.24 0.25 . 1 . . . A 122 VAL C . 19554 1 1319 . 1 1 125 125 VAL CA C 13 59.30 0.25 . 1 . . . A 122 VAL CA . 19554 1 1320 . 1 1 125 125 VAL CB C 13 35.86 0.25 . 1 . . . A 122 VAL CB . 19554 1 1321 . 1 1 125 125 VAL CG1 C 13 21.42 0.25 . 2 . . . A 122 VAL CG1 . 19554 1 1322 . 1 1 125 125 VAL CG2 C 13 23.20 0.25 . 2 . . . A 122 VAL CG2 . 19554 1 1323 . 1 1 125 125 VAL N N 15 124.34 0.15 . 1 . . . A 122 VAL N . 19554 1 1324 . 1 1 126 126 GLU H H 1 8.95 0.02 . 1 . . . A 123 GLU H . 19554 1 1325 . 1 1 126 126 GLU HA H 1 4.61 0.02 . 1 . . . A 123 GLU HA . 19554 1 1326 . 1 1 126 126 GLU HB2 H 1 1.80 0.02 . 2 . . . A 123 GLU HB2 . 19554 1 1327 . 1 1 126 126 GLU HB3 H 1 1.86 0.02 . 2 . . . A 123 GLU HB3 . 19554 1 1328 . 1 1 126 126 GLU HG2 H 1 1.99 0.02 . 2 . . . A 123 GLU HG2 . 19554 1 1329 . 1 1 126 126 GLU HG3 H 1 1.98 0.02 . 2 . . . A 123 GLU HG3 . 19554 1 1330 . 1 1 126 126 GLU C C 13 175.84 0.25 . 1 . . . A 123 GLU C . 19554 1 1331 . 1 1 126 126 GLU CA C 13 55.16 0.25 . 1 . . . A 123 GLU CA . 19554 1 1332 . 1 1 126 126 GLU CB C 13 30.91 0.25 . 1 . . . A 123 GLU CB . 19554 1 1333 . 1 1 126 126 GLU CG C 13 36.20 0.25 . 1 . . . A 123 GLU CG . 19554 1 1334 . 1 1 126 126 GLU N N 15 126.95 0.15 . 1 . . . A 123 GLU N . 19554 1 1335 . 1 1 127 127 LEU H H 1 8.94 0.02 . 1 . . . A 124 LEU H . 19554 1 1336 . 1 1 127 127 LEU HA H 1 4.66 0.02 . 1 . . . A 124 LEU HA . 19554 1 1337 . 1 1 127 127 LEU HB2 H 1 1.29 0.02 . 2 . . . A 124 LEU HB2 . 19554 1 1338 . 1 1 127 127 LEU HB3 H 1 1.41 0.02 . 2 . . . A 124 LEU HB3 . 19554 1 1339 . 1 1 127 127 LEU HG H 1 1.15 0.02 . 1 . . . A 124 LEU HG . 19554 1 1340 . 1 1 127 127 LEU HD11 H 1 0.36 0.02 . 2 . . . A 124 LEU HD11 . 19554 1 1341 . 1 1 127 127 LEU HD12 H 1 0.36 0.02 . 2 . . . A 124 LEU HD12 . 19554 1 1342 . 1 1 127 127 LEU HD13 H 1 0.36 0.02 . 2 . . . A 124 LEU HD13 . 19554 1 1343 . 1 1 127 127 LEU HD21 H 1 0.37 0.02 . 2 . . . A 124 LEU HD21 . 19554 1 1344 . 1 1 127 127 LEU HD22 H 1 0.37 0.02 . 2 . . . A 124 LEU HD22 . 19554 1 1345 . 1 1 127 127 LEU HD23 H 1 0.37 0.02 . 2 . . . A 124 LEU HD23 . 19554 1 1346 . 1 1 127 127 LEU C C 13 175.35 0.25 . 1 . . . A 124 LEU C . 19554 1 1347 . 1 1 127 127 LEU CA C 13 53.20 0.25 . 1 . . . A 124 LEU CA . 19554 1 1348 . 1 1 127 127 LEU CB C 13 42.19 0.25 . 1 . . . A 124 LEU CB . 19554 1 1349 . 1 1 127 127 LEU CG C 13 26.26 0.25 . 1 . . . A 124 LEU CG . 19554 1 1350 . 1 1 127 127 LEU CD1 C 13 27.26 0.25 . 2 . . . A 124 LEU CD1 . 19554 1 1351 . 1 1 127 127 LEU CD2 C 13 25.28 0.25 . 2 . . . A 124 LEU CD2 . 19554 1 1352 . 1 1 127 127 LEU N N 15 129.58 0.15 . 1 . . . A 124 LEU N . 19554 1 1353 . 1 1 128 128 ASN H H 1 8.95 0.02 . 1 . . . A 125 ASN H . 19554 1 1354 . 1 1 128 128 ASN HA H 1 4.19 0.02 . 1 . . . A 125 ASN HA . 19554 1 1355 . 1 1 128 128 ASN HB2 H 1 2.50 0.02 . 2 . . . A 125 ASN HB2 . 19554 1 1356 . 1 1 128 128 ASN HB3 H 1 2.95 0.02 . 2 . . . A 125 ASN HB3 . 19554 1 1357 . 1 1 128 128 ASN HD21 H 1 6.79 0.02 . 1 . . . A 125 ASN HD21 . 19554 1 1358 . 1 1 128 128 ASN HD22 H 1 7.37 0.02 . 1 . . . A 125 ASN HD22 . 19554 1 1359 . 1 1 128 128 ASN C C 13 174.69 0.25 . 1 . . . A 125 ASN C . 19554 1 1360 . 1 1 128 128 ASN CA C 13 53.88 0.25 . 1 . . . A 125 ASN CA . 19554 1 1361 . 1 1 128 128 ASN CB C 13 37.25 0.25 . 1 . . . A 125 ASN CB . 19554 1 1362 . 1 1 128 128 ASN N N 15 121.88 0.15 . 1 . . . A 125 ASN N . 19554 1 1363 . 1 1 128 128 ASN ND2 N 15 111.35 0.15 . 1 . . . A 125 ASN ND2 . 19554 1 1364 . 1 1 129 129 GLY H H 1 8.07 0.02 . 1 . . . A 126 GLY H . 19554 1 1365 . 1 1 129 129 GLY HA2 H 1 3.44 0.02 . 2 . . . A 126 GLY HA2 . 19554 1 1366 . 1 1 129 129 GLY HA3 H 1 4.04 0.02 . 2 . . . A 126 GLY HA3 . 19554 1 1367 . 1 1 129 129 GLY C C 13 173.68 0.25 . 1 . . . A 126 GLY C . 19554 1 1368 . 1 1 129 129 GLY CA C 13 44.88 0.25 . 1 . . . A 126 GLY CA . 19554 1 1369 . 1 1 129 129 GLY N N 15 103.14 0.15 . 1 . . . A 126 GLY N . 19554 1 1370 . 1 1 130 130 ILE H H 1 7.38 0.02 . 1 . . . A 127 ILE H . 19554 1 1371 . 1 1 130 130 ILE HA H 1 3.97 0.02 . 1 . . . A 127 ILE HA . 19554 1 1372 . 1 1 130 130 ILE HB H 1 1.56 0.02 . 1 . . . A 127 ILE HB . 19554 1 1373 . 1 1 130 130 ILE HG12 H 1 0.93 0.02 . 2 . . . A 127 ILE HG12 . 19554 1 1374 . 1 1 130 130 ILE HG13 H 1 0.63 0.02 . 2 . . . A 127 ILE HG13 . 19554 1 1375 . 1 1 130 130 ILE HG21 H 1 0.34 0.02 . 1 . . . A 127 ILE HG21 . 19554 1 1376 . 1 1 130 130 ILE HG22 H 1 0.34 0.02 . 1 . . . A 127 ILE HG22 . 19554 1 1377 . 1 1 130 130 ILE HG23 H 1 0.34 0.02 . 1 . . . A 127 ILE HG23 . 19554 1 1378 . 1 1 130 130 ILE HD11 H 1 -0.03 0.02 . 1 . . . A 127 ILE HD11 . 19554 1 1379 . 1 1 130 130 ILE HD12 H 1 -0.03 0.02 . 1 . . . A 127 ILE HD12 . 19554 1 1380 . 1 1 130 130 ILE HD13 H 1 -0.03 0.02 . 1 . . . A 127 ILE HD13 . 19554 1 1381 . 1 1 130 130 ILE C C 13 174.37 0.25 . 1 . . . A 127 ILE C . 19554 1 1382 . 1 1 130 130 ILE CA C 13 59.53 0.25 . 1 . . . A 127 ILE CA . 19554 1 1383 . 1 1 130 130 ILE CB C 13 38.97 0.25 . 1 . . . A 127 ILE CB . 19554 1 1384 . 1 1 130 130 ILE CG1 C 13 27.82 0.25 . 1 . . . A 127 ILE CG1 . 19554 1 1385 . 1 1 130 130 ILE CG2 C 13 17.24 0.25 . 1 . . . A 127 ILE CG2 . 19554 1 1386 . 1 1 130 130 ILE CD1 C 13 11.62 0.25 . 1 . . . A 127 ILE CD1 . 19554 1 1387 . 1 1 130 130 ILE N N 15 122.12 0.15 . 1 . . . A 127 ILE N . 19554 1 1388 . 1 1 131 131 ARG H H 1 8.17 0.02 . 1 . . . A 128 ARG H . 19554 1 1389 . 1 1 131 131 ARG HA H 1 4.64 0.02 . 1 . . . A 128 ARG HA . 19554 1 1390 . 1 1 131 131 ARG HB3 H 1 1.67 0.02 . 1 . . . A 128 ARG HB3 . 19554 1 1391 . 1 1 131 131 ARG HG2 H 1 1.56 0.02 . 2 . . . A 128 ARG HG2 . 19554 1 1392 . 1 1 131 131 ARG HG3 H 1 1.45 0.02 . 2 . . . A 128 ARG HG3 . 19554 1 1393 . 1 1 131 131 ARG HD2 H 1 3.07 0.02 . 1 . . . A 128 ARG HD2 . 19554 1 1394 . 1 1 131 131 ARG HD3 H 1 3.07 0.02 . 1 . . . A 128 ARG HD3 . 19554 1 1395 . 1 1 131 131 ARG C C 13 174.72 0.25 . 1 . . . A 128 ARG C . 19554 1 1396 . 1 1 131 131 ARG CA C 13 55.65 0.25 . 1 . . . A 128 ARG CA . 19554 1 1397 . 1 1 131 131 ARG CB C 13 31.00 0.25 . 1 . . . A 128 ARG CB . 19554 1 1398 . 1 1 131 131 ARG CG C 13 27.64 0.25 . 1 . . . A 128 ARG CG . 19554 1 1399 . 1 1 131 131 ARG CD C 13 43.41 0.25 . 1 . . . A 128 ARG CD . 19554 1 1400 . 1 1 131 131 ARG N N 15 126.63 0.15 . 1 . . . A 128 ARG N . 19554 1 1401 . 1 1 132 132 ALA H H 1 9.24 0.02 . 1 . . . A 129 ALA H . 19554 1 1402 . 1 1 132 132 ALA HA H 1 4.85 0.02 . 1 . . . A 129 ALA HA . 19554 1 1403 . 1 1 132 132 ALA HB1 H 1 0.84 0.02 . 1 . . . A 129 ALA HB1 . 19554 1 1404 . 1 1 132 132 ALA HB2 H 1 0.84 0.02 . 1 . . . A 129 ALA HB2 . 19554 1 1405 . 1 1 132 132 ALA HB3 H 1 0.84 0.02 . 1 . . . A 129 ALA HB3 . 19554 1 1406 . 1 1 132 132 ALA C C 13 174.97 0.25 . 1 . . . A 129 ALA C . 19554 1 1407 . 1 1 132 132 ALA CA C 13 49.66 0.25 . 1 . . . A 129 ALA CA . 19554 1 1408 . 1 1 132 132 ALA CB C 13 24.39 0.25 . 1 . . . A 129 ALA CB . 19554 1 1409 . 1 1 132 132 ALA N N 15 127.32 0.15 . 1 . . . A 129 ALA N . 19554 1 1410 . 1 1 133 133 PHE H H 1 8.66 0.02 . 1 . . . A 130 PHE H . 19554 1 1411 . 1 1 133 133 PHE HA H 1 5.16 0.02 . 1 . . . A 130 PHE HA . 19554 1 1412 . 1 1 133 133 PHE HB2 H 1 3.06 0.02 . 2 . . . A 130 PHE HB2 . 19554 1 1413 . 1 1 133 133 PHE HB3 H 1 2.82 0.02 . 2 . . . A 130 PHE HB3 . 19554 1 1414 . 1 1 133 133 PHE HD1 H 1 7.03 0.02 . 3 . . . A 130 PHE HD1 . 19554 1 1415 . 1 1 133 133 PHE HD2 H 1 7.03 0.02 . 3 . . . A 130 PHE HD2 . 19554 1 1416 . 1 1 133 133 PHE HE1 H 1 7.00 0.02 . 3 . . . A 130 PHE HE1 . 19554 1 1417 . 1 1 133 133 PHE HE2 H 1 7.00 0.02 . 3 . . . A 130 PHE HE2 . 19554 1 1418 . 1 1 133 133 PHE HZ H 1 6.71 0.02 . 1 . . . A 130 PHE HZ . 19554 1 1419 . 1 1 133 133 PHE C C 13 172.43 0.25 . 1 . . . A 130 PHE C . 19554 1 1420 . 1 1 133 133 PHE CA C 13 55.00 0.25 . 1 . . . A 130 PHE CA . 19554 1 1421 . 1 1 133 133 PHE CB C 13 42.40 0.25 . 1 . . . A 130 PHE CB . 19554 1 1422 . 1 1 133 133 PHE N N 15 121.06 0.15 . 1 . . . A 130 PHE N . 19554 1 1423 . 1 1 134 134 LEU H H 1 8.55 0.02 . 1 . . . A 131 LEU H . 19554 1 1424 . 1 1 134 134 LEU HA H 1 4.98 0.02 . 1 . . . A 131 LEU HA . 19554 1 1425 . 1 1 134 134 LEU HD11 H 1 0.68 0.02 . 2 . . . A 131 LEU HD11 . 19554 1 1426 . 1 1 134 134 LEU HD12 H 1 0.68 0.02 . 2 . . . A 131 LEU HD12 . 19554 1 1427 . 1 1 134 134 LEU HD13 H 1 0.68 0.02 . 2 . . . A 131 LEU HD13 . 19554 1 1428 . 1 1 134 134 LEU HD21 H 1 0.67 0.02 . 2 . . . A 131 LEU HD21 . 19554 1 1429 . 1 1 134 134 LEU HD22 H 1 0.67 0.02 . 2 . . . A 131 LEU HD22 . 19554 1 1430 . 1 1 134 134 LEU HD23 H 1 0.67 0.02 . 2 . . . A 131 LEU HD23 . 19554 1 1431 . 1 1 134 134 LEU CA C 13 49.67 0.25 . 1 . . . A 131 LEU CA . 19554 1 1432 . 1 1 134 134 LEU CB C 13 44.33 0.25 . 1 . . . A 131 LEU CB . 19554 1 1433 . 1 1 134 134 LEU CD1 C 13 26.75 0.25 . 2 . . . A 131 LEU CD1 . 19554 1 1434 . 1 1 134 134 LEU CD2 C 13 26.05 0.25 . 2 . . . A 131 LEU CD2 . 19554 1 1435 . 1 1 134 134 LEU N N 15 130.25 0.15 . 1 . . . A 131 LEU N . 19554 1 1436 . 1 1 135 135 PRO HA H 1 4.00 0.02 . 1 . . . A 132 PRO HA . 19554 1 1437 . 1 1 135 135 PRO C C 13 179.38 0.25 . 1 . . . A 132 PRO C . 19554 1 1438 . 1 1 135 135 PRO CA C 13 62.16 0.25 . 1 . . . A 132 PRO CA . 19554 1 1439 . 1 1 136 136 GLY H H 1 9.14 0.02 . 1 . . . A 133 GLY H . 19554 1 1440 . 1 1 136 136 GLY HA2 H 1 4.05 0.02 . 2 . . . A 133 GLY HA2 . 19554 1 1441 . 1 1 136 136 GLY HA3 H 1 3.75 0.02 . 2 . . . A 133 GLY HA3 . 19554 1 1442 . 1 1 136 136 GLY C C 13 175.59 0.25 . 1 . . . A 133 GLY C . 19554 1 1443 . 1 1 136 136 GLY CA C 13 47.53 0.25 . 1 . . . A 133 GLY CA . 19554 1 1444 . 1 1 136 136 GLY N N 15 111.47 0.15 . 1 . . . A 133 GLY N . 19554 1 1445 . 1 1 137 137 SER HA H 1 4.35 0.02 . 1 . . . A 134 SER HA . 19554 1 1446 . 1 1 137 137 SER HB2 H 1 3.90 0.02 . 2 . . . A 134 SER HB2 . 19554 1 1447 . 1 1 137 137 SER HB3 H 1 3.84 0.02 . 2 . . . A 134 SER HB3 . 19554 1 1448 . 1 1 137 137 SER C C 13 175.28 0.25 . 1 . . . A 134 SER C . 19554 1 1449 . 1 1 137 137 SER CA C 13 59.21 0.25 . 1 . . . A 134 SER CA . 19554 1 1450 . 1 1 137 137 SER CB C 13 62.73 0.25 . 1 . . . A 134 SER CB . 19554 1 1451 . 1 1 138 138 LEU H H 1 8.03 0.02 . 1 . . . A 135 LEU H . 19554 1 1452 . 1 1 138 138 LEU HA H 1 4.58 0.02 . 1 . . . A 135 LEU HA . 19554 1 1453 . 1 1 138 138 LEU C C 13 177.50 0.25 . 1 . . . A 135 LEU C . 19554 1 1454 . 1 1 138 138 LEU CA C 13 53.77 0.25 . 1 . . . A 135 LEU CA . 19554 1 1455 . 1 1 138 138 LEU N N 15 118.77 0.15 . 1 . . . A 135 LEU N . 19554 1 1456 . 1 1 139 139 VAL H H 1 7.55 0.02 . 1 . . . A 136 VAL H . 19554 1 1457 . 1 1 139 139 VAL HA H 1 3.61 0.02 . 1 . . . A 136 VAL HA . 19554 1 1458 . 1 1 139 139 VAL HB H 1 2.04 0.02 . 1 . . . A 136 VAL HB . 19554 1 1459 . 1 1 139 139 VAL HG11 H 1 0.78 0.02 . 2 . . . A 136 VAL HG11 . 19554 1 1460 . 1 1 139 139 VAL HG12 H 1 0.78 0.02 . 2 . . . A 136 VAL HG12 . 19554 1 1461 . 1 1 139 139 VAL HG13 H 1 0.78 0.02 . 2 . . . A 136 VAL HG13 . 19554 1 1462 . 1 1 139 139 VAL HG21 H 1 0.96 0.02 . 2 . . . A 136 VAL HG21 . 19554 1 1463 . 1 1 139 139 VAL HG22 H 1 0.96 0.02 . 2 . . . A 136 VAL HG22 . 19554 1 1464 . 1 1 139 139 VAL HG23 H 1 0.96 0.02 . 2 . . . A 136 VAL HG23 . 19554 1 1465 . 1 1 139 139 VAL C C 13 173.15 0.25 . 1 . . . A 136 VAL C . 19554 1 1466 . 1 1 139 139 VAL CA C 13 65.22 0.25 . 1 . . . A 136 VAL CA . 19554 1 1467 . 1 1 139 139 VAL CB C 13 32.02 0.25 . 1 . . . A 136 VAL CB . 19554 1 1468 . 1 1 139 139 VAL CG1 C 13 21.77 0.25 . 2 . . . A 136 VAL CG1 . 19554 1 1469 . 1 1 139 139 VAL CG2 C 13 23.02 0.25 . 2 . . . A 136 VAL CG2 . 19554 1 1470 . 1 1 139 139 VAL N N 15 123.08 0.15 . 1 . . . A 136 VAL N . 19554 1 1471 . 1 1 140 140 ASP H H 1 7.94 0.02 . 1 . . . A 137 ASP H . 19554 1 1472 . 1 1 140 140 ASP HA H 1 4.34 0.02 . 1 . . . A 137 ASP HA . 19554 1 1473 . 1 1 140 140 ASP HB2 H 1 2.26 0.02 . 2 . . . A 137 ASP HB2 . 19554 1 1474 . 1 1 140 140 ASP HB3 H 1 2.94 0.02 . 2 . . . A 137 ASP HB3 . 19554 1 1475 . 1 1 140 140 ASP C C 13 174.84 0.25 . 1 . . . A 137 ASP C . 19554 1 1476 . 1 1 140 140 ASP CA C 13 52.07 0.25 . 1 . . . A 137 ASP CA . 19554 1 1477 . 1 1 140 140 ASP CB C 13 44.46 0.25 . 1 . . . A 137 ASP CB . 19554 1 1478 . 1 1 140 140 ASP N N 15 117.30 0.15 . 1 . . . A 137 ASP N . 19554 1 1479 . 1 1 141 141 VAL H H 1 10.00 0.02 . 1 . . . A 138 VAL H . 19554 1 1480 . 1 1 141 141 VAL HA H 1 4.14 0.02 . 1 . . . A 138 VAL HA . 19554 1 1481 . 1 1 141 141 VAL HB H 1 2.01 0.02 . 1 . . . A 138 VAL HB . 19554 1 1482 . 1 1 141 141 VAL HG11 H 1 0.85 0.02 . 2 . . . A 138 VAL HG11 . 19554 1 1483 . 1 1 141 141 VAL HG12 H 1 0.85 0.02 . 2 . . . A 138 VAL HG12 . 19554 1 1484 . 1 1 141 141 VAL HG13 H 1 0.85 0.02 . 2 . . . A 138 VAL HG13 . 19554 1 1485 . 1 1 141 141 VAL HG21 H 1 0.84 0.02 . 2 . . . A 138 VAL HG21 . 19554 1 1486 . 1 1 141 141 VAL HG22 H 1 0.84 0.02 . 2 . . . A 138 VAL HG22 . 19554 1 1487 . 1 1 141 141 VAL HG23 H 1 0.84 0.02 . 2 . . . A 138 VAL HG23 . 19554 1 1488 . 1 1 141 141 VAL CA C 13 61.19 0.25 . 1 . . . A 138 VAL CA . 19554 1 1489 . 1 1 141 141 VAL CB C 13 33.33 0.25 . 1 . . . A 138 VAL CB . 19554 1 1490 . 1 1 141 141 VAL CG1 C 13 20.55 0.25 . 2 . . . A 138 VAL CG1 . 19554 1 1491 . 1 1 141 141 VAL CG2 C 13 21.80 0.25 . 2 . . . A 138 VAL CG2 . 19554 1 1492 . 1 1 141 141 VAL N N 15 116.75 0.15 . 1 . . . A 138 VAL N . 19554 1 1493 . 1 1 143 143 PRO HA H 1 4.51 0.02 . 1 . . . A 140 PRO HA . 19554 1 1494 . 1 1 143 143 PRO HD2 H 1 3.49 0.02 . 2 . . . A 140 PRO HD2 . 19554 1 1495 . 1 1 143 143 PRO HD3 H 1 3.69 0.02 . 2 . . . A 140 PRO HD3 . 19554 1 1496 . 1 1 143 143 PRO C C 13 175.86 0.25 . 1 . . . A 140 PRO C . 19554 1 1497 . 1 1 143 143 PRO CD C 13 50.50 0.25 . 1 . . . A 140 PRO CD . 19554 1 1498 . 1 1 144 144 VAL H H 1 8.11 0.02 . 1 . . . A 141 VAL H . 19554 1 1499 . 1 1 144 144 VAL HA H 1 3.90 0.02 . 1 . . . A 141 VAL HA . 19554 1 1500 . 1 1 144 144 VAL HB H 1 2.19 0.02 . 1 . . . A 141 VAL HB . 19554 1 1501 . 1 1 144 144 VAL HG11 H 1 0.82 0.02 . 2 . . . A 141 VAL HG11 . 19554 1 1502 . 1 1 144 144 VAL HG12 H 1 0.82 0.02 . 2 . . . A 141 VAL HG12 . 19554 1 1503 . 1 1 144 144 VAL HG13 H 1 0.82 0.02 . 2 . . . A 141 VAL HG13 . 19554 1 1504 . 1 1 144 144 VAL HG21 H 1 0.86 0.02 . 2 . . . A 141 VAL HG21 . 19554 1 1505 . 1 1 144 144 VAL HG22 H 1 0.86 0.02 . 2 . . . A 141 VAL HG22 . 19554 1 1506 . 1 1 144 144 VAL HG23 H 1 0.86 0.02 . 2 . . . A 141 VAL HG23 . 19554 1 1507 . 1 1 144 144 VAL C C 13 175.12 0.25 . 1 . . . A 141 VAL C . 19554 1 1508 . 1 1 144 144 VAL CA C 13 62.72 0.25 . 1 . . . A 141 VAL CA . 19554 1 1509 . 1 1 144 144 VAL CB C 13 31.87 0.25 . 1 . . . A 141 VAL CB . 19554 1 1510 . 1 1 144 144 VAL CG1 C 13 19.44 0.25 . 2 . . . A 141 VAL CG1 . 19554 1 1511 . 1 1 144 144 VAL CG2 C 13 22.12 0.25 . 2 . . . A 141 VAL CG2 . 19554 1 1512 . 1 1 144 144 VAL N N 15 124.91 0.15 . 1 . . . A 141 VAL N . 19554 1 1513 . 1 1 145 145 ARG H H 1 7.44 0.02 . 1 . . . A 142 ARG H . 19554 1 1514 . 1 1 145 145 ARG HA H 1 4.62 0.02 . 1 . . . A 142 ARG HA . 19554 1 1515 . 1 1 145 145 ARG HB2 H 1 1.57 0.02 . 2 . . . A 142 ARG HB2 . 19554 1 1516 . 1 1 145 145 ARG HB3 H 1 1.73 0.02 . 2 . . . A 142 ARG HB3 . 19554 1 1517 . 1 1 145 145 ARG HG2 H 1 1.44 0.02 . 2 . . . A 142 ARG HG2 . 19554 1 1518 . 1 1 145 145 ARG HG3 H 1 1.53 0.02 . 2 . . . A 142 ARG HG3 . 19554 1 1519 . 1 1 145 145 ARG HD2 H 1 3.08 0.02 . 2 . . . A 142 ARG HD2 . 19554 1 1520 . 1 1 145 145 ARG HD3 H 1 3.09 0.02 . 2 . . . A 142 ARG HD3 . 19554 1 1521 . 1 1 145 145 ARG C C 13 173.52 0.25 . 1 . . . A 142 ARG C . 19554 1 1522 . 1 1 145 145 ARG CA C 13 53.02 0.25 . 1 . . . A 142 ARG CA . 19554 1 1523 . 1 1 145 145 ARG CB C 13 30.48 0.25 . 1 . . . A 142 ARG CB . 19554 1 1524 . 1 1 145 145 ARG CG C 13 26.42 0.25 . 1 . . . A 142 ARG CG . 19554 1 1525 . 1 1 145 145 ARG CD C 13 42.90 0.25 . 1 . . . A 142 ARG CD . 19554 1 1526 . 1 1 145 145 ARG N N 15 119.73 0.15 . 1 . . . A 142 ARG N . 19554 1 1527 . 1 1 146 146 ASP H H 1 7.88 0.02 . 1 . . . A 143 ASP H . 19554 1 1528 . 1 1 146 146 ASP HA H 1 4.67 0.02 . 1 . . . A 143 ASP HA . 19554 1 1529 . 1 1 146 146 ASP HB2 H 1 2.61 0.02 . 2 . . . A 143 ASP HB2 . 19554 1 1530 . 1 1 146 146 ASP HB3 H 1 2.70 0.02 . 2 . . . A 143 ASP HB3 . 19554 1 1531 . 1 1 146 146 ASP C C 13 175.97 0.25 . 1 . . . A 143 ASP C . 19554 1 1532 . 1 1 146 146 ASP CA C 13 54.03 0.25 . 1 . . . A 143 ASP CA . 19554 1 1533 . 1 1 146 146 ASP CB C 13 41.73 0.25 . 1 . . . A 143 ASP CB . 19554 1 1534 . 1 1 146 146 ASP N N 15 119.78 0.15 . 1 . . . A 143 ASP N . 19554 1 1535 . 1 1 147 147 THR H H 1 8.03 0.02 . 1 . . . A 144 THR H . 19554 1 1536 . 1 1 147 147 THR HA H 1 4.11 0.02 . 1 . . . A 144 THR HA . 19554 1 1537 . 1 1 147 147 THR HB H 1 4.29 0.02 . 1 . . . A 144 THR HB . 19554 1 1538 . 1 1 147 147 THR HG21 H 1 0.94 0.02 . 1 . . . A 144 THR HG21 . 19554 1 1539 . 1 1 147 147 THR HG22 H 1 0.94 0.02 . 1 . . . A 144 THR HG22 . 19554 1 1540 . 1 1 147 147 THR HG23 H 1 0.94 0.02 . 1 . . . A 144 THR HG23 . 19554 1 1541 . 1 1 147 147 THR C C 13 175.73 0.25 . 1 . . . A 144 THR C . 19554 1 1542 . 1 1 147 147 THR CA C 13 61.52 0.25 . 1 . . . A 144 THR CA . 19554 1 1543 . 1 1 147 147 THR CB C 13 68.61 0.25 . 1 . . . A 144 THR CB . 19554 1 1544 . 1 1 147 147 THR CG2 C 13 21.70 0.25 . 1 . . . A 144 THR CG2 . 19554 1 1545 . 1 1 147 147 THR N N 15 110.06 0.15 . 1 . . . A 144 THR N . 19554 1 1546 . 1 1 148 148 LEU H H 1 8.05 0.02 . 1 . . . A 145 LEU H . 19554 1 1547 . 1 1 148 148 LEU HA H 1 4.70 0.02 . 1 . . . A 145 LEU HA . 19554 1 1548 . 1 1 148 148 LEU HB2 H 1 1.47 0.02 . 2 . . . A 145 LEU HB2 . 19554 1 1549 . 1 1 148 148 LEU HB3 H 1 1.60 0.02 . 2 . . . A 145 LEU HB3 . 19554 1 1550 . 1 1 148 148 LEU HD11 H 1 0.77 0.02 . 2 . . . A 145 LEU HD11 . 19554 1 1551 . 1 1 148 148 LEU HD12 H 1 0.77 0.02 . 2 . . . A 145 LEU HD12 . 19554 1 1552 . 1 1 148 148 LEU HD13 H 1 0.77 0.02 . 2 . . . A 145 LEU HD13 . 19554 1 1553 . 1 1 148 148 LEU HD21 H 1 0.84 0.02 . 2 . . . A 145 LEU HD21 . 19554 1 1554 . 1 1 148 148 LEU HD22 H 1 0.84 0.02 . 2 . . . A 145 LEU HD22 . 19554 1 1555 . 1 1 148 148 LEU HD23 H 1 0.84 0.02 . 2 . . . A 145 LEU HD23 . 19554 1 1556 . 1 1 148 148 LEU C C 13 178.01 0.25 . 1 . . . A 145 LEU C . 19554 1 1557 . 1 1 148 148 LEU CA C 13 57.35 0.25 . 1 . . . A 145 LEU CA . 19554 1 1558 . 1 1 148 148 LEU CB C 13 42.10 0.25 . 1 . . . A 145 LEU CB . 19554 1 1559 . 1 1 148 148 LEU CG C 13 27.05 0.25 . 1 . . . A 145 LEU CG . 19554 1 1560 . 1 1 148 148 LEU CD1 C 13 24.12 0.25 . 2 . . . A 145 LEU CD1 . 19554 1 1561 . 1 1 148 148 LEU CD2 C 13 24.44 0.25 . 2 . . . A 145 LEU CD2 . 19554 1 1562 . 1 1 148 148 LEU N N 15 124.82 0.15 . 1 . . . A 145 LEU N . 19554 1 1563 . 1 1 149 149 HIS H H 1 8.12 0.02 . 1 . . . A 146 HIS H . 19554 1 1564 . 1 1 149 149 HIS HA H 1 4.54 0.02 . 1 . . . A 146 HIS HA . 19554 1 1565 . 1 1 149 149 HIS HB2 H 1 2.06 0.02 . 2 . . . A 146 HIS HB2 . 19554 1 1566 . 1 1 149 149 HIS HB3 H 1 3.02 0.02 . 2 . . . A 146 HIS HB3 . 19554 1 1567 . 1 1 149 149 HIS HD2 H 1 6.96 0.02 . 1 . . . A 146 HIS HD2 . 19554 1 1568 . 1 1 149 149 HIS HE1 H 1 7.98 0.02 . 1 . . . A 146 HIS HE1 . 19554 1 1569 . 1 1 149 149 HIS C C 13 175.00 0.25 . 1 . . . A 146 HIS C . 19554 1 1570 . 1 1 149 149 HIS CD2 C 13 120.34 0.25 . 1 . . . A 146 HIS CD2 . 19554 1 1571 . 1 1 149 149 HIS CE1 C 13 136.89 0.25 . 1 . . . A 146 HIS CE1 . 19554 1 1572 . 1 1 149 149 HIS N N 15 116.31 0.15 . 1 . . . A 146 HIS N . 19554 1 1573 . 1 1 150 150 LEU H H 1 7.62 0.02 . 1 . . . A 147 LEU H . 19554 1 1574 . 1 1 150 150 LEU HA H 1 4.07 0.02 . 1 . . . A 147 LEU HA . 19554 1 1575 . 1 1 150 150 LEU HB3 H 1 1.23 0.02 . 1 . . . A 147 LEU HB3 . 19554 1 1576 . 1 1 150 150 LEU HG H 1 0.85 0.02 . 1 . . . A 147 LEU HG . 19554 1 1577 . 1 1 150 150 LEU HD11 H 1 0.37 0.02 . 2 . . . A 147 LEU HD11 . 19554 1 1578 . 1 1 150 150 LEU HD12 H 1 0.37 0.02 . 2 . . . A 147 LEU HD12 . 19554 1 1579 . 1 1 150 150 LEU HD13 H 1 0.37 0.02 . 2 . . . A 147 LEU HD13 . 19554 1 1580 . 1 1 150 150 LEU HD21 H 1 0.48 0.02 . 2 . . . A 147 LEU HD21 . 19554 1 1581 . 1 1 150 150 LEU HD22 H 1 0.48 0.02 . 2 . . . A 147 LEU HD22 . 19554 1 1582 . 1 1 150 150 LEU HD23 H 1 0.48 0.02 . 2 . . . A 147 LEU HD23 . 19554 1 1583 . 1 1 150 150 LEU C C 13 176.81 0.25 . 1 . . . A 147 LEU C . 19554 1 1584 . 1 1 150 150 LEU CA C 13 54.71 0.25 . 1 . . . A 147 LEU CA . 19554 1 1585 . 1 1 150 150 LEU CB C 13 41.96 0.25 . 1 . . . A 147 LEU CB . 19554 1 1586 . 1 1 150 150 LEU CG C 13 25.76 0.25 . 1 . . . A 147 LEU CG . 19554 1 1587 . 1 1 150 150 LEU CD1 C 13 25.28 0.25 . 2 . . . A 147 LEU CD1 . 19554 1 1588 . 1 1 150 150 LEU CD2 C 13 22.31 0.25 . 2 . . . A 147 LEU CD2 . 19554 1 1589 . 1 1 150 150 LEU N N 15 120.32 0.15 . 1 . . . A 147 LEU N . 19554 1 1590 . 1 1 151 151 GLU H H 1 7.76 0.02 . 1 . . . A 148 GLU H . 19554 1 1591 . 1 1 151 151 GLU HA H 1 3.78 0.02 . 1 . . . A 148 GLU HA . 19554 1 1592 . 1 1 151 151 GLU HB2 H 1 1.84 0.02 . 2 . . . A 148 GLU HB2 . 19554 1 1593 . 1 1 151 151 GLU HB3 H 1 1.89 0.02 . 2 . . . A 148 GLU HB3 . 19554 1 1594 . 1 1 151 151 GLU HG2 H 1 2.10 0.02 . 2 . . . A 148 GLU HG2 . 19554 1 1595 . 1 1 151 151 GLU HG3 H 1 2.21 0.02 . 2 . . . A 148 GLU HG3 . 19554 1 1596 . 1 1 151 151 GLU C C 13 177.48 0.25 . 1 . . . A 148 GLU C . 19554 1 1597 . 1 1 151 151 GLU CA C 13 58.43 0.25 . 1 . . . A 148 GLU CA . 19554 1 1598 . 1 1 151 151 GLU CB C 13 29.68 0.25 . 1 . . . A 148 GLU CB . 19554 1 1599 . 1 1 151 151 GLU CG C 13 36.72 0.25 . 1 . . . A 148 GLU CG . 19554 1 1600 . 1 1 151 151 GLU N N 15 118.95 0.15 . 1 . . . A 148 GLU N . 19554 1 1601 . 1 1 152 152 GLY H H 1 8.63 0.02 . 1 . . . A 149 GLY H . 19554 1 1602 . 1 1 152 152 GLY HA2 H 1 4.05 0.02 . 2 . . . A 149 GLY HA2 . 19554 1 1603 . 1 1 152 152 GLY HA3 H 1 3.58 0.02 . 2 . . . A 149 GLY HA3 . 19554 1 1604 . 1 1 152 152 GLY C C 13 173.82 0.25 . 1 . . . A 149 GLY C . 19554 1 1605 . 1 1 152 152 GLY CA C 13 45.53 0.25 . 1 . . . A 149 GLY CA . 19554 1 1606 . 1 1 152 152 GLY N N 15 111.07 0.15 . 1 . . . A 149 GLY N . 19554 1 1607 . 1 1 153 153 LYS H H 1 7.52 0.02 . 1 . . . A 150 LYS H . 19554 1 1608 . 1 1 153 153 LYS HA H 1 4.33 0.02 . 1 . . . A 150 LYS HA . 19554 1 1609 . 1 1 153 153 LYS HG2 H 1 1.25 0.02 . 2 . . . A 150 LYS HG2 . 19554 1 1610 . 1 1 153 153 LYS HG3 H 1 1.17 0.02 . 2 . . . A 150 LYS HG3 . 19554 1 1611 . 1 1 153 153 LYS HD2 H 1 1.63 0.02 . 2 . . . A 150 LYS HD2 . 19554 1 1612 . 1 1 153 153 LYS HD3 H 1 1.52 0.02 . 2 . . . A 150 LYS HD3 . 19554 1 1613 . 1 1 153 153 LYS HE2 H 1 2.89 0.02 . 2 . . . A 150 LYS HE2 . 19554 1 1614 . 1 1 153 153 LYS HE3 H 1 2.88 0.02 . 2 . . . A 150 LYS HE3 . 19554 1 1615 . 1 1 153 153 LYS C C 13 175.11 0.25 . 1 . . . A 150 LYS C . 19554 1 1616 . 1 1 153 153 LYS CA C 13 55.17 0.25 . 1 . . . A 150 LYS CA . 19554 1 1617 . 1 1 153 153 LYS CB C 13 33.55 0.25 . 1 . . . A 150 LYS CB . 19554 1 1618 . 1 1 153 153 LYS CG C 13 24.81 0.25 . 1 . . . A 150 LYS CG . 19554 1 1619 . 1 1 153 153 LYS CD C 13 28.61 0.25 . 1 . . . A 150 LYS CD . 19554 1 1620 . 1 1 153 153 LYS CE C 13 41.99 0.25 . 1 . . . A 150 LYS CE . 19554 1 1621 . 1 1 153 153 LYS N N 15 119.38 0.15 . 1 . . . A 150 LYS N . 19554 1 1622 . 1 1 154 154 GLU H H 1 8.41 0.02 . 1 . . . A 151 GLU H . 19554 1 1623 . 1 1 154 154 GLU HA H 1 4.47 0.02 . 1 . . . A 151 GLU HA . 19554 1 1624 . 1 1 154 154 GLU HB2 H 1 1.78 0.02 . 2 . . . A 151 GLU HB2 . 19554 1 1625 . 1 1 154 154 GLU HB3 H 1 1.88 0.02 . 2 . . . A 151 GLU HB3 . 19554 1 1626 . 1 1 154 154 GLU HG2 H 1 1.89 0.02 . 2 . . . A 151 GLU HG2 . 19554 1 1627 . 1 1 154 154 GLU HG3 H 1 2.06 0.02 . 2 . . . A 151 GLU HG3 . 19554 1 1628 . 1 1 154 154 GLU C C 13 175.51 0.25 . 1 . . . A 151 GLU C . 19554 1 1629 . 1 1 154 154 GLU CA C 13 56.34 0.25 . 1 . . . A 151 GLU CA . 19554 1 1630 . 1 1 154 154 GLU CB C 13 30.01 0.25 . 1 . . . A 151 GLU CB . 19554 1 1631 . 1 1 154 154 GLU CG C 13 36.97 0.25 . 1 . . . A 151 GLU CG . 19554 1 1632 . 1 1 154 154 GLU N N 15 122.85 0.15 . 1 . . . A 151 GLU N . 19554 1 1633 . 1 1 155 155 LEU H H 1 8.85 0.02 . 1 . . . A 152 LEU H . 19554 1 1634 . 1 1 155 155 LEU HA H 1 4.54 0.02 . 1 . . . A 152 LEU HA . 19554 1 1635 . 1 1 155 155 LEU C C 13 173.75 0.25 . 1 . . . A 152 LEU C . 19554 1 1636 . 1 1 155 155 LEU CA C 13 52.82 0.25 . 1 . . . A 152 LEU CA . 19554 1 1637 . 1 1 155 155 LEU N N 15 127.52 0.15 . 1 . . . A 152 LEU N . 19554 1 1638 . 1 1 156 156 GLU H H 1 7.11 0.02 . 1 . . . A 153 GLU H . 19554 1 1639 . 1 1 156 156 GLU HA H 1 4.58 0.02 . 1 . . . A 153 GLU HA . 19554 1 1640 . 1 1 156 156 GLU HB2 H 1 1.83 0.02 . 2 . . . A 153 GLU HB2 . 19554 1 1641 . 1 1 156 156 GLU HB3 H 1 1.60 0.02 . 2 . . . A 153 GLU HB3 . 19554 1 1642 . 1 1 156 156 GLU HG2 H 1 1.65 0.02 . 2 . . . A 153 GLU HG2 . 19554 1 1643 . 1 1 156 156 GLU HG3 H 1 2.07 0.02 . 2 . . . A 153 GLU HG3 . 19554 1 1644 . 1 1 156 156 GLU C C 13 175.12 0.25 . 1 . . . A 153 GLU C . 19554 1 1645 . 1 1 156 156 GLU CA C 13 55.16 0.25 . 1 . . . A 153 GLU CA . 19554 1 1646 . 1 1 156 156 GLU CG C 13 36.97 0.25 . 1 . . . A 153 GLU CG . 19554 1 1647 . 1 1 156 156 GLU N N 15 116.50 0.15 . 1 . . . A 153 GLU N . 19554 1 1648 . 1 1 157 157 PHE H H 1 8.91 0.02 . 1 . . . A 154 PHE H . 19554 1 1649 . 1 1 157 157 PHE HA H 1 4.86 0.02 . 1 . . . A 154 PHE HA . 19554 1 1650 . 1 1 157 157 PHE HB2 H 1 2.21 0.02 . 2 . . . A 154 PHE HB2 . 19554 1 1651 . 1 1 157 157 PHE HB3 H 1 2.85 0.02 . 2 . . . A 154 PHE HB3 . 19554 1 1652 . 1 1 157 157 PHE HD1 H 1 6.74 0.02 . 3 . . . A 154 PHE HD1 . 19554 1 1653 . 1 1 157 157 PHE HD2 H 1 6.74 0.02 . 3 . . . A 154 PHE HD2 . 19554 1 1654 . 1 1 157 157 PHE HE1 H 1 6.86 0.02 . 3 . . . A 154 PHE HE1 . 19554 1 1655 . 1 1 157 157 PHE HE2 H 1 6.86 0.02 . 3 . . . A 154 PHE HE2 . 19554 1 1656 . 1 1 157 157 PHE HZ H 1 6.72 0.02 . 1 . . . A 154 PHE HZ . 19554 1 1657 . 1 1 157 157 PHE C C 13 175.63 0.25 . 1 . . . A 154 PHE C . 19554 1 1658 . 1 1 157 157 PHE CA C 13 57.19 0.25 . 1 . . . A 154 PHE CA . 19554 1 1659 . 1 1 157 157 PHE CB C 13 44.25 0.25 . 1 . . . A 154 PHE CB . 19554 1 1660 . 1 1 157 157 PHE N N 15 115.15 0.15 . 1 . . . A 154 PHE N . 19554 1 1661 . 1 1 158 158 LYS H H 1 8.10 0.02 . 1 . . . A 155 LYS H . 19554 1 1662 . 1 1 158 158 LYS HA H 1 4.71 0.02 . 1 . . . A 155 LYS HA . 19554 1 1663 . 1 1 158 158 LYS C C 13 176.50 0.25 . 1 . . . A 155 LYS C . 19554 1 1664 . 1 1 158 158 LYS CA C 13 53.60 0.25 . 1 . . . A 155 LYS CA . 19554 1 1665 . 1 1 158 158 LYS CB C 13 33.96 0.25 . 1 . . . A 155 LYS CB . 19554 1 1666 . 1 1 158 158 LYS CE C 13 41.79 0.25 . 1 . . . A 155 LYS CE . 19554 1 1667 . 1 1 158 158 LYS N N 15 114.56 0.15 . 1 . . . A 155 LYS N . 19554 1 1668 . 1 1 159 159 VAL H H 1 9.92 0.02 . 1 . . . A 156 VAL H . 19554 1 1669 . 1 1 159 159 VAL HB H 1 1.98 0.02 . 1 . . . A 156 VAL HB . 19554 1 1670 . 1 1 159 159 VAL HG11 H 1 0.72 0.02 . 2 . . . A 156 VAL HG11 . 19554 1 1671 . 1 1 159 159 VAL HG12 H 1 0.72 0.02 . 2 . . . A 156 VAL HG12 . 19554 1 1672 . 1 1 159 159 VAL HG13 H 1 0.72 0.02 . 2 . . . A 156 VAL HG13 . 19554 1 1673 . 1 1 159 159 VAL HG21 H 1 0.72 0.02 . 2 . . . A 156 VAL HG21 . 19554 1 1674 . 1 1 159 159 VAL HG22 H 1 0.72 0.02 . 2 . . . A 156 VAL HG22 . 19554 1 1675 . 1 1 159 159 VAL HG23 H 1 0.72 0.02 . 2 . . . A 156 VAL HG23 . 19554 1 1676 . 1 1 159 159 VAL C C 13 175.63 0.25 . 1 . . . A 156 VAL C . 19554 1 1677 . 1 1 159 159 VAL CA C 13 62.69 0.25 . 1 . . . A 156 VAL CA . 19554 1 1678 . 1 1 159 159 VAL CB C 13 31.60 0.25 . 1 . . . A 156 VAL CB . 19554 1 1679 . 1 1 159 159 VAL CG1 C 13 21.52 0.25 . 2 . . . A 156 VAL CG1 . 19554 1 1680 . 1 1 159 159 VAL CG2 C 13 22.93 0.25 . 2 . . . A 156 VAL CG2 . 19554 1 1681 . 1 1 159 159 VAL N N 15 124.53 0.15 . 1 . . . A 156 VAL N . 19554 1 1682 . 1 1 160 160 ILE H H 1 8.53 0.02 . 1 . . . A 157 ILE H . 19554 1 1683 . 1 1 160 160 ILE HA H 1 4.72 0.02 . 1 . . . A 157 ILE HA . 19554 1 1684 . 1 1 160 160 ILE HB H 1 1.97 0.02 . 1 . . . A 157 ILE HB . 19554 1 1685 . 1 1 160 160 ILE HG21 H 1 0.76 0.02 . 1 . . . A 157 ILE HG21 . 19554 1 1686 . 1 1 160 160 ILE HG22 H 1 0.76 0.02 . 1 . . . A 157 ILE HG22 . 19554 1 1687 . 1 1 160 160 ILE HG23 H 1 0.76 0.02 . 1 . . . A 157 ILE HG23 . 19554 1 1688 . 1 1 160 160 ILE HD11 H 1 0.69 0.02 . 1 . . . A 157 ILE HD11 . 19554 1 1689 . 1 1 160 160 ILE HD12 H 1 0.69 0.02 . 1 . . . A 157 ILE HD12 . 19554 1 1690 . 1 1 160 160 ILE HD13 H 1 0.69 0.02 . 1 . . . A 157 ILE HD13 . 19554 1 1691 . 1 1 160 160 ILE C C 13 176.19 0.25 . 1 . . . A 157 ILE C . 19554 1 1692 . 1 1 160 160 ILE CA C 13 61.05 0.25 . 1 . . . A 157 ILE CA . 19554 1 1693 . 1 1 160 160 ILE CB C 13 39.17 0.25 . 1 . . . A 157 ILE CB . 19554 1 1694 . 1 1 160 160 ILE CG1 C 13 26.86 0.25 . 1 . . . A 157 ILE CG1 . 19554 1 1695 . 1 1 160 160 ILE CG2 C 13 18.48 0.25 . 1 . . . A 157 ILE CG2 . 19554 1 1696 . 1 1 160 160 ILE CD1 C 13 14.04 0.25 . 1 . . . A 157 ILE CD1 . 19554 1 1697 . 1 1 160 160 ILE N N 15 119.59 0.15 . 1 . . . A 157 ILE N . 19554 1 1698 . 1 1 161 161 LYS H H 1 7.60 0.02 . 1 . . . A 158 LYS H . 19554 1 1699 . 1 1 161 161 LYS HA H 1 4.20 0.02 . 1 . . . A 158 LYS HA . 19554 1 1700 . 1 1 161 161 LYS HG3 H 1 1.33 0.02 . 1 . . . A 158 LYS HG3 . 19554 1 1701 . 1 1 161 161 LYS C C 13 173.00 0.25 . 1 . . . A 158 LYS C . 19554 1 1702 . 1 1 161 161 LYS CA C 13 56.80 0.25 . 1 . . . A 158 LYS CA . 19554 1 1703 . 1 1 161 161 LYS CB C 13 35.64 0.25 . 1 . . . A 158 LYS CB . 19554 1 1704 . 1 1 161 161 LYS CE C 13 43.01 0.25 . 1 . . . A 158 LYS CE . 19554 1 1705 . 1 1 161 161 LYS N N 15 122.46 0.15 . 1 . . . A 158 LYS N . 19554 1 1706 . 1 1 162 162 LEU H H 1 7.95 0.02 . 1 . . . A 159 LEU H . 19554 1 1707 . 1 1 162 162 LEU HA H 1 4.62 0.02 . 1 . . . A 159 LEU HA . 19554 1 1708 . 1 1 162 162 LEU HB3 H 1 1.25 0.02 . 1 . . . A 159 LEU HB3 . 19554 1 1709 . 1 1 162 162 LEU HD11 H 1 0.70 0.02 . 1 . . . A 159 LEU HD11 . 19554 1 1710 . 1 1 162 162 LEU HD12 H 1 0.70 0.02 . 1 . . . A 159 LEU HD12 . 19554 1 1711 . 1 1 162 162 LEU HD13 H 1 0.70 0.02 . 1 . . . A 159 LEU HD13 . 19554 1 1712 . 1 1 162 162 LEU C C 13 174.39 0.25 . 1 . . . A 159 LEU C . 19554 1 1713 . 1 1 162 162 LEU CA C 13 54.51 0.25 . 1 . . . A 159 LEU CA . 19554 1 1714 . 1 1 162 162 LEU N N 15 125.43 0.15 . 1 . . . A 159 LEU N . 19554 1 1715 . 1 1 163 163 ASP H H 1 8.76 0.02 . 1 . . . A 160 ASP H . 19554 1 1716 . 1 1 163 163 ASP HA H 1 4.67 0.02 . 1 . . . A 160 ASP HA . 19554 1 1717 . 1 1 163 163 ASP HB2 H 1 2.39 0.02 . 2 . . . A 160 ASP HB2 . 19554 1 1718 . 1 1 163 163 ASP HB3 H 1 2.43 0.02 . 2 . . . A 160 ASP HB3 . 19554 1 1719 . 1 1 163 163 ASP C C 13 176.02 0.25 . 1 . . . A 160 ASP C . 19554 1 1720 . 1 1 163 163 ASP CA C 13 52.62 0.25 . 1 . . . A 160 ASP CA . 19554 1 1721 . 1 1 163 163 ASP CB C 13 42.05 0.25 . 1 . . . A 160 ASP CB . 19554 1 1722 . 1 1 163 163 ASP N N 15 124.74 0.15 . 1 . . . A 160 ASP N . 19554 1 1723 . 1 1 164 164 GLN H H 1 9.11 0.02 . 1 . . . A 161 GLN H . 19554 1 1724 . 1 1 164 164 GLN HA H 1 3.12 0.02 . 1 . . . A 161 GLN HA . 19554 1 1725 . 1 1 164 164 GLN HB2 H 1 1.50 0.02 . 2 . . . A 161 GLN HB2 . 19554 1 1726 . 1 1 164 164 GLN HB3 H 1 1.55 0.02 . 2 . . . A 161 GLN HB3 . 19554 1 1727 . 1 1 164 164 GLN HG2 H 1 1.23 0.02 . 2 . . . A 161 GLN HG2 . 19554 1 1728 . 1 1 164 164 GLN HG3 H 1 1.56 0.02 . 2 . . . A 161 GLN HG3 . 19554 1 1729 . 1 1 164 164 GLN HE21 H 1 6.61 0.02 . 1 . . . A 161 GLN HE21 . 19554 1 1730 . 1 1 164 164 GLN HE22 H 1 7.01 0.02 . 1 . . . A 161 GLN HE22 . 19554 1 1731 . 1 1 164 164 GLN C C 13 178.28 0.25 . 1 . . . A 161 GLN C . 19554 1 1732 . 1 1 164 164 GLN CA C 13 58.77 0.25 . 1 . . . A 161 GLN CA . 19554 1 1733 . 1 1 164 164 GLN CB C 13 27.84 0.25 . 1 . . . A 161 GLN CB . 19554 1 1734 . 1 1 164 164 GLN CG C 13 32.85 0.25 . 1 . . . A 161 GLN CG . 19554 1 1735 . 1 1 164 164 GLN N N 15 126.49 0.15 . 1 . . . A 161 GLN N . 19554 1 1736 . 1 1 164 164 GLN NE2 N 15 110.77 0.15 . 1 . . . A 161 GLN NE2 . 19554 1 1737 . 1 1 165 165 LYS H H 1 8.07 0.02 . 1 . . . A 162 LYS H . 19554 1 1738 . 1 1 165 165 LYS HA H 1 3.80 0.02 . 1 . . . A 162 LYS HA . 19554 1 1739 . 1 1 165 165 LYS C C 13 177.90 0.25 . 1 . . . A 162 LYS C . 19554 1 1740 . 1 1 165 165 LYS CA C 13 58.70 0.25 . 1 . . . A 162 LYS CA . 19554 1 1741 . 1 1 165 165 LYS CB C 13 31.39 0.25 . 1 . . . A 162 LYS CB . 19554 1 1742 . 1 1 165 165 LYS CG C 13 24.86 0.25 . 1 . . . A 162 LYS CG . 19554 1 1743 . 1 1 165 165 LYS CD C 13 28.88 0.25 . 1 . . . A 162 LYS CD . 19554 1 1744 . 1 1 165 165 LYS CE C 13 41.83 0.25 . 1 . . . A 162 LYS CE . 19554 1 1745 . 1 1 165 165 LYS N N 15 119.15 0.15 . 1 . . . A 162 LYS N . 19554 1 1746 . 1 1 166 166 ARG H H 1 7.01 0.02 . 1 . . . A 163 ARG H . 19554 1 1747 . 1 1 166 166 ARG HA H 1 4.15 0.02 . 1 . . . A 163 ARG HA . 19554 1 1748 . 1 1 166 166 ARG HB2 H 1 1.85 0.02 . 2 . . . A 163 ARG HB2 . 19554 1 1749 . 1 1 166 166 ARG HB3 H 1 1.44 0.02 . 2 . . . A 163 ARG HB3 . 19554 1 1750 . 1 1 166 166 ARG C C 13 174.75 0.25 . 1 . . . A 163 ARG C . 19554 1 1751 . 1 1 166 166 ARG CA C 13 54.80 0.25 . 1 . . . A 163 ARG CA . 19554 1 1752 . 1 1 166 166 ARG N N 15 114.85 0.15 . 1 . . . A 163 ARG N . 19554 1 1753 . 1 1 167 167 ASN H H 1 7.75 0.02 . 1 . . . A 164 ASN H . 19554 1 1754 . 1 1 167 167 ASN HA H 1 4.13 0.02 . 1 . . . A 164 ASN HA . 19554 1 1755 . 1 1 167 167 ASN HB2 H 1 2.52 0.02 . 2 . . . A 164 ASN HB2 . 19554 1 1756 . 1 1 167 167 ASN HB3 H 1 3.04 0.02 . 2 . . . A 164 ASN HB3 . 19554 1 1757 . 1 1 167 167 ASN HD21 H 1 7.26 0.02 . 1 . . . A 164 ASN HD21 . 19554 1 1758 . 1 1 167 167 ASN HD22 H 1 6.55 0.02 . 1 . . . A 164 ASN HD22 . 19554 1 1759 . 1 1 167 167 ASN C C 13 173.88 0.25 . 1 . . . A 164 ASN C . 19554 1 1760 . 1 1 167 167 ASN CA C 13 53.96 0.25 . 1 . . . A 164 ASN CA . 19554 1 1761 . 1 1 167 167 ASN CB C 13 37.53 0.25 . 1 . . . A 164 ASN CB . 19554 1 1762 . 1 1 167 167 ASN N N 15 117.81 0.15 . 1 . . . A 164 ASN N . 19554 1 1763 . 1 1 167 167 ASN ND2 N 15 111.04 0.15 . 1 . . . A 164 ASN ND2 . 19554 1 1764 . 1 1 168 168 ASN H H 1 8.02 0.02 . 1 . . . A 165 ASN H . 19554 1 1765 . 1 1 168 168 ASN HA H 1 5.06 0.02 . 1 . . . A 165 ASN HA . 19554 1 1766 . 1 1 168 168 ASN HB2 H 1 2.35 0.02 . 2 . . . A 165 ASN HB2 . 19554 1 1767 . 1 1 168 168 ASN HB3 H 1 2.57 0.02 . 2 . . . A 165 ASN HB3 . 19554 1 1768 . 1 1 168 168 ASN HD21 H 1 7.46 0.02 . 1 . . . A 165 ASN HD21 . 19554 1 1769 . 1 1 168 168 ASN HD22 H 1 6.48 0.02 . 1 . . . A 165 ASN HD22 . 19554 1 1770 . 1 1 168 168 ASN C C 13 172.99 0.25 . 1 . . . A 165 ASN C . 19554 1 1771 . 1 1 168 168 ASN CA C 13 52.44 0.25 . 1 . . . A 165 ASN CA . 19554 1 1772 . 1 1 168 168 ASN CB C 13 41.82 0.25 . 1 . . . A 165 ASN CB . 19554 1 1773 . 1 1 168 168 ASN N N 15 116.17 0.15 . 1 . . . A 165 ASN N . 19554 1 1774 . 1 1 168 168 ASN ND2 N 15 110.40 0.15 . 1 . . . A 165 ASN ND2 . 19554 1 1775 . 1 1 169 169 VAL H H 1 8.38 0.02 . 1 . . . A 166 VAL H . 19554 1 1776 . 1 1 169 169 VAL HA H 1 4.50 0.02 . 1 . . . A 166 VAL HA . 19554 1 1777 . 1 1 169 169 VAL HB H 1 1.88 0.02 . 1 . . . A 166 VAL HB . 19554 1 1778 . 1 1 169 169 VAL HG21 H 1 0.75 0.02 . 1 . . . A 166 VAL HG21 . 19554 1 1779 . 1 1 169 169 VAL HG22 H 1 0.75 0.02 . 1 . . . A 166 VAL HG22 . 19554 1 1780 . 1 1 169 169 VAL HG23 H 1 0.75 0.02 . 1 . . . A 166 VAL HG23 . 19554 1 1781 . 1 1 169 169 VAL C C 13 174.19 0.25 . 1 . . . A 166 VAL C . 19554 1 1782 . 1 1 169 169 VAL CA C 13 61.03 0.25 . 1 . . . A 166 VAL CA . 19554 1 1783 . 1 1 169 169 VAL CB C 13 34.62 0.25 . 1 . . . A 166 VAL CB . 19554 1 1784 . 1 1 169 169 VAL CG2 C 13 21.92 0.25 . 1 . . . A 166 VAL CG2 . 19554 1 1785 . 1 1 169 169 VAL N N 15 124.79 0.15 . 1 . . . A 166 VAL N . 19554 1 1786 . 1 1 170 170 VAL H H 1 8.71 0.02 . 1 . . . A 167 VAL H . 19554 1 1787 . 1 1 170 170 VAL HA H 1 5.25 0.02 . 1 . . . A 167 VAL HA . 19554 1 1788 . 1 1 170 170 VAL HB H 1 1.76 0.02 . 1 . . . A 167 VAL HB . 19554 1 1789 . 1 1 170 170 VAL HG11 H 1 0.96 0.02 . 2 . . . A 167 VAL HG11 . 19554 1 1790 . 1 1 170 170 VAL HG12 H 1 0.96 0.02 . 2 . . . A 167 VAL HG12 . 19554 1 1791 . 1 1 170 170 VAL HG13 H 1 0.96 0.02 . 2 . . . A 167 VAL HG13 . 19554 1 1792 . 1 1 170 170 VAL HG21 H 1 0.97 0.02 . 2 . . . A 167 VAL HG21 . 19554 1 1793 . 1 1 170 170 VAL HG22 H 1 0.97 0.02 . 2 . . . A 167 VAL HG22 . 19554 1 1794 . 1 1 170 170 VAL HG23 H 1 0.97 0.02 . 2 . . . A 167 VAL HG23 . 19554 1 1795 . 1 1 170 170 VAL C C 13 176.00 0.25 . 1 . . . A 167 VAL C . 19554 1 1796 . 1 1 170 170 VAL CA C 13 60.61 0.25 . 1 . . . A 167 VAL CA . 19554 1 1797 . 1 1 170 170 VAL CB C 13 33.90 0.25 . 1 . . . A 167 VAL CB . 19554 1 1798 . 1 1 170 170 VAL CG1 C 13 21.53 0.25 . 2 . . . A 167 VAL CG1 . 19554 1 1799 . 1 1 170 170 VAL CG2 C 13 21.55 0.25 . 2 . . . A 167 VAL CG2 . 19554 1 1800 . 1 1 170 170 VAL N N 15 128.00 0.15 . 1 . . . A 167 VAL N . 19554 1 1801 . 1 1 171 171 VAL H H 1 8.56 0.02 . 1 . . . A 168 VAL H . 19554 1 1802 . 1 1 171 171 VAL HA H 1 5.24 0.02 . 1 . . . A 168 VAL HA . 19554 1 1803 . 1 1 171 171 VAL HB H 1 1.86 0.02 . 1 . . . A 168 VAL HB . 19554 1 1804 . 1 1 171 171 VAL HG11 H 1 -0.04 0.02 . 2 . . . A 168 VAL HG11 . 19554 1 1805 . 1 1 171 171 VAL HG12 H 1 -0.04 0.02 . 2 . . . A 168 VAL HG12 . 19554 1 1806 . 1 1 171 171 VAL HG13 H 1 -0.04 0.02 . 2 . . . A 168 VAL HG13 . 19554 1 1807 . 1 1 171 171 VAL HG21 H 1 0.36 0.02 . 2 . . . A 168 VAL HG21 . 19554 1 1808 . 1 1 171 171 VAL HG22 H 1 0.36 0.02 . 2 . . . A 168 VAL HG22 . 19554 1 1809 . 1 1 171 171 VAL HG23 H 1 0.36 0.02 . 2 . . . A 168 VAL HG23 . 19554 1 1810 . 1 1 171 171 VAL C C 13 172.80 0.25 . 1 . . . A 168 VAL C . 19554 1 1811 . 1 1 171 171 VAL CA C 13 57.86 0.25 . 1 . . . A 168 VAL CA . 19554 1 1812 . 1 1 171 171 VAL CB C 13 35.35 0.25 . 1 . . . A 168 VAL CB . 19554 1 1813 . 1 1 171 171 VAL CG1 C 13 18.18 0.25 . 2 . . . A 168 VAL CG1 . 19554 1 1814 . 1 1 171 171 VAL CG2 C 13 22.04 0.25 . 2 . . . A 168 VAL CG2 . 19554 1 1815 . 1 1 171 171 VAL N N 15 118.36 0.15 . 1 . . . A 168 VAL N . 19554 1 1816 . 1 1 172 172 SER H H 1 8.60 0.02 . 1 . . . A 169 SER H . 19554 1 1817 . 1 1 172 172 SER HA H 1 4.48 0.02 . 1 . . . A 169 SER HA . 19554 1 1818 . 1 1 172 172 SER HB2 H 1 3.60 0.02 . 2 . . . A 169 SER HB2 . 19554 1 1819 . 1 1 172 172 SER HB3 H 1 3.66 0.02 . 2 . . . A 169 SER HB3 . 19554 1 1820 . 1 1 172 172 SER C C 13 175.95 0.25 . 1 . . . A 169 SER C . 19554 1 1821 . 1 1 172 172 SER CA C 13 55.55 0.25 . 1 . . . A 169 SER CA . 19554 1 1822 . 1 1 172 172 SER CB C 13 64.98 0.25 . 1 . . . A 169 SER CB . 19554 1 1823 . 1 1 172 172 SER N N 15 106.72 0.15 . 1 . . . A 169 SER N . 19554 1 1824 . 1 1 173 173 ARG H H 1 7.61 0.02 . 1 . . . A 170 ARG H . 19554 1 1825 . 1 1 173 173 ARG HA H 1 4.71 0.02 . 1 . . . A 170 ARG HA . 19554 1 1826 . 1 1 173 173 ARG C C 13 177.87 0.25 . 1 . . . A 170 ARG C . 19554 1 1827 . 1 1 173 173 ARG CA C 13 57.15 0.25 . 1 . . . A 170 ARG CA . 19554 1 1828 . 1 1 173 173 ARG N N 15 129.62 0.15 . 1 . . . A 170 ARG N . 19554 1 1829 . 1 1 174 174 ARG H H 1 8.26 0.02 . 1 . . . A 171 ARG H . 19554 1 1830 . 1 1 174 174 ARG HA H 1 3.47 0.02 . 1 . . . A 171 ARG HA . 19554 1 1831 . 1 1 174 174 ARG HB3 H 1 1.44 0.02 . 1 . . . A 171 ARG HB3 . 19554 1 1832 . 1 1 174 174 ARG HG3 H 1 1.22 0.02 . 1 . . . A 171 ARG HG3 . 19554 1 1833 . 1 1 174 174 ARG HD2 H 1 3.06 0.02 . 2 . . . A 171 ARG HD2 . 19554 1 1834 . 1 1 174 174 ARG HD3 H 1 3.17 0.02 . 2 . . . A 171 ARG HD3 . 19554 1 1835 . 1 1 174 174 ARG C C 13 175.76 0.25 . 1 . . . A 171 ARG C . 19554 1 1836 . 1 1 174 174 ARG CA C 13 59.43 0.25 . 1 . . . A 171 ARG CA . 19554 1 1837 . 1 1 174 174 ARG CB C 13 30.41 0.25 . 1 . . . A 171 ARG CB . 19554 1 1838 . 1 1 174 174 ARG CG C 13 27.11 0.25 . 1 . . . A 171 ARG CG . 19554 1 1839 . 1 1 174 174 ARG CD C 13 43.65 0.25 . 1 . . . A 171 ARG CD . 19554 1 1840 . 1 1 174 174 ARG N N 15 122.23 0.15 . 1 . . . A 171 ARG N . 19554 1 1841 . 1 1 175 175 ALA H H 1 7.76 0.02 . 1 . . . A 172 ALA H . 19554 1 1842 . 1 1 175 175 ALA HA H 1 4.05 0.02 . 1 . . . A 172 ALA HA . 19554 1 1843 . 1 1 175 175 ALA HB1 H 1 1.20 0.02 . 1 . . . A 172 ALA HB1 . 19554 1 1844 . 1 1 175 175 ALA HB2 H 1 1.20 0.02 . 1 . . . A 172 ALA HB2 . 19554 1 1845 . 1 1 175 175 ALA HB3 H 1 1.20 0.02 . 1 . . . A 172 ALA HB3 . 19554 1 1846 . 1 1 175 175 ALA C C 13 179.48 0.25 . 1 . . . A 172 ALA C . 19554 1 1847 . 1 1 175 175 ALA CA C 13 54.01 0.25 . 1 . . . A 172 ALA CA . 19554 1 1848 . 1 1 175 175 ALA CB C 13 18.89 0.25 . 1 . . . A 172 ALA CB . 19554 1 1849 . 1 1 175 175 ALA N N 15 116.49 0.15 . 1 . . . A 172 ALA N . 19554 1 1850 . 1 1 176 176 VAL H H 1 7.21 0.02 . 1 . . . A 173 VAL H . 19554 1 1851 . 1 1 176 176 VAL HA H 1 3.47 0.02 . 1 . . . A 173 VAL HA . 19554 1 1852 . 1 1 176 176 VAL HB H 1 2.09 0.02 . 1 . . . A 173 VAL HB . 19554 1 1853 . 1 1 176 176 VAL HG11 H 1 0.81 0.02 . 2 . . . A 173 VAL HG11 . 19554 1 1854 . 1 1 176 176 VAL HG12 H 1 0.81 0.02 . 2 . . . A 173 VAL HG12 . 19554 1 1855 . 1 1 176 176 VAL HG13 H 1 0.81 0.02 . 2 . . . A 173 VAL HG13 . 19554 1 1856 . 1 1 176 176 VAL HG21 H 1 0.75 0.02 . 2 . . . A 173 VAL HG21 . 19554 1 1857 . 1 1 176 176 VAL HG22 H 1 0.75 0.02 . 2 . . . A 173 VAL HG22 . 19554 1 1858 . 1 1 176 176 VAL HG23 H 1 0.75 0.02 . 2 . . . A 173 VAL HG23 . 19554 1 1859 . 1 1 176 176 VAL C C 13 177.68 0.25 . 1 . . . A 173 VAL C . 19554 1 1860 . 1 1 176 176 VAL CA C 13 65.08 0.25 . 1 . . . A 173 VAL CA . 19554 1 1861 . 1 1 176 176 VAL CB C 13 31.88 0.25 . 1 . . . A 173 VAL CB . 19554 1 1862 . 1 1 176 176 VAL CG1 C 13 22.99 0.25 . 2 . . . A 173 VAL CG1 . 19554 1 1863 . 1 1 176 176 VAL CG2 C 13 21.29 0.25 . 2 . . . A 173 VAL CG2 . 19554 1 1864 . 1 1 176 176 VAL N N 15 116.44 0.15 . 1 . . . A 173 VAL N . 19554 1 1865 . 1 1 177 177 ILE H H 1 7.16 0.02 . 1 . . . A 174 ILE H . 19554 1 1866 . 1 1 177 177 ILE HA H 1 3.68 0.02 . 1 . . . A 174 ILE HA . 19554 1 1867 . 1 1 177 177 ILE HB H 1 1.68 0.02 . 1 . . . A 174 ILE HB . 19554 1 1868 . 1 1 177 177 ILE HG12 H 1 1.39 0.02 . 2 . . . A 174 ILE HG12 . 19554 1 1869 . 1 1 177 177 ILE HG13 H 1 1.09 0.02 . 2 . . . A 174 ILE HG13 . 19554 1 1870 . 1 1 177 177 ILE HG21 H 1 0.84 0.02 . 1 . . . A 174 ILE HG21 . 19554 1 1871 . 1 1 177 177 ILE HG22 H 1 0.84 0.02 . 1 . . . A 174 ILE HG22 . 19554 1 1872 . 1 1 177 177 ILE HG23 H 1 0.84 0.02 . 1 . . . A 174 ILE HG23 . 19554 1 1873 . 1 1 177 177 ILE HD11 H 1 0.75 0.02 . 1 . . . A 174 ILE HD11 . 19554 1 1874 . 1 1 177 177 ILE HD12 H 1 0.75 0.02 . 1 . . . A 174 ILE HD12 . 19554 1 1875 . 1 1 177 177 ILE HD13 H 1 0.75 0.02 . 1 . . . A 174 ILE HD13 . 19554 1 1876 . 1 1 177 177 ILE C C 13 178.31 0.25 . 1 . . . A 174 ILE C . 19554 1 1877 . 1 1 177 177 ILE CA C 13 63.77 0.25 . 1 . . . A 174 ILE CA . 19554 1 1878 . 1 1 177 177 ILE CB C 13 38.45 0.25 . 1 . . . A 174 ILE CB . 19554 1 1879 . 1 1 177 177 ILE CG1 C 13 27.67 0.25 . 1 . . . A 174 ILE CG1 . 19554 1 1880 . 1 1 177 177 ILE CG2 C 13 17.67 0.25 . 1 . . . A 174 ILE CG2 . 19554 1 1881 . 1 1 177 177 ILE CD1 C 13 13.55 0.25 . 1 . . . A 174 ILE CD1 . 19554 1 1882 . 1 1 177 177 ILE N N 15 119.79 0.15 . 1 . . . A 174 ILE N . 19554 1 1883 . 1 1 178 178 GLU H H 1 8.25 0.02 . 1 . . . A 175 GLU H . 19554 1 1884 . 1 1 178 178 GLU HA H 1 4.03 0.02 . 1 . . . A 175 GLU HA . 19554 1 1885 . 1 1 178 178 GLU HB2 H 1 1.91 0.02 . 2 . . . A 175 GLU HB2 . 19554 1 1886 . 1 1 178 178 GLU HB3 H 1 1.84 0.02 . 2 . . . A 175 GLU HB3 . 19554 1 1887 . 1 1 178 178 GLU HG2 H 1 2.10 0.02 . 2 . . . A 175 GLU HG2 . 19554 1 1888 . 1 1 178 178 GLU HG3 H 1 2.15 0.02 . 2 . . . A 175 GLU HG3 . 19554 1 1889 . 1 1 178 178 GLU C C 13 177.17 0.25 . 1 . . . A 175 GLU C . 19554 1 1890 . 1 1 178 178 GLU CA C 13 57.19 0.25 . 1 . . . A 175 GLU CA . 19554 1 1891 . 1 1 178 178 GLU CB C 13 29.64 0.25 . 1 . . . A 175 GLU CB . 19554 1 1892 . 1 1 178 178 GLU CG C 13 36.14 0.25 . 1 . . . A 175 GLU CG . 19554 1 1893 . 1 1 178 178 GLU N N 15 117.81 0.15 . 1 . . . A 175 GLU N . 19554 1 1894 . 1 1 179 179 SER H H 1 7.46 0.02 . 1 . . . A 176 SER H . 19554 1 1895 . 1 1 179 179 SER HA H 1 4.32 0.02 . 1 . . . A 176 SER HA . 19554 1 1896 . 1 1 179 179 SER HB2 H 1 3.89 0.02 . 2 . . . A 176 SER HB2 . 19554 1 1897 . 1 1 179 179 SER HB3 H 1 3.85 0.02 . 2 . . . A 176 SER HB3 . 19554 1 1898 . 1 1 179 179 SER C C 13 174.93 0.25 . 1 . . . A 176 SER C . 19554 1 1899 . 1 1 179 179 SER CA C 13 59.06 0.25 . 1 . . . A 176 SER CA . 19554 1 1900 . 1 1 179 179 SER CB C 13 63.64 0.25 . 1 . . . A 176 SER CB . 19554 1 1901 . 1 1 179 179 SER N N 15 114.30 0.15 . 1 . . . A 176 SER N . 19554 1 1902 . 1 1 180 180 GLU H H 1 7.89 0.02 . 1 . . . A 177 GLU H . 19554 1 1903 . 1 1 180 180 GLU HA H 1 4.17 0.02 . 1 . . . A 177 GLU HA . 19554 1 1904 . 1 1 180 180 GLU HB2 H 1 1.96 0.02 . 2 . . . A 177 GLU HB2 . 19554 1 1905 . 1 1 180 180 GLU HB3 H 1 1.89 0.02 . 2 . . . A 177 GLU HB3 . 19554 1 1906 . 1 1 180 180 GLU HG2 H 1 2.13 0.02 . 2 . . . A 177 GLU HG2 . 19554 1 1907 . 1 1 180 180 GLU HG3 H 1 2.23 0.02 . 2 . . . A 177 GLU HG3 . 19554 1 1908 . 1 1 180 180 GLU C C 13 176.34 0.25 . 1 . . . A 177 GLU C . 19554 1 1909 . 1 1 180 180 GLU CA C 13 56.64 0.25 . 1 . . . A 177 GLU CA . 19554 1 1910 . 1 1 180 180 GLU CB C 13 29.75 0.25 . 1 . . . A 177 GLU CB . 19554 1 1911 . 1 1 180 180 GLU CG C 13 36.21 0.25 . 1 . . . A 177 GLU CG . 19554 1 1912 . 1 1 180 180 GLU N N 15 121.86 0.15 . 1 . . . A 177 GLU N . 19554 1 1913 . 1 1 181 181 ASN H H 1 8.11 0.02 . 1 . . . A 178 ASN H . 19554 1 1914 . 1 1 181 181 ASN HA H 1 4.70 0.02 . 1 . . . A 178 ASN HA . 19554 1 1915 . 1 1 181 181 ASN HB2 H 1 2.77 0.02 . 2 . . . A 178 ASN HB2 . 19554 1 1916 . 1 1 181 181 ASN HB3 H 1 2.62 0.02 . 2 . . . A 178 ASN HB3 . 19554 1 1917 . 1 1 181 181 ASN HD21 H 1 6.84 0.02 . 1 . . . A 178 ASN HD21 . 19554 1 1918 . 1 1 181 181 ASN HD22 H 1 7.52 0.02 . 1 . . . A 178 ASN HD22 . 19554 1 1919 . 1 1 181 181 ASN C C 13 174.23 0.25 . 1 . . . A 178 ASN C . 19554 1 1920 . 1 1 181 181 ASN CA C 13 53.01 0.25 . 1 . . . A 178 ASN CA . 19554 1 1921 . 1 1 181 181 ASN CB C 13 39.08 0.25 . 1 . . . A 178 ASN CB . 19554 1 1922 . 1 1 181 181 ASN N N 15 119.03 0.15 . 1 . . . A 178 ASN N . 19554 1 1923 . 1 1 181 181 ASN ND2 N 15 113.23 0.15 . 1 . . . A 178 ASN ND2 . 19554 1 1924 . 1 1 182 182 SER H H 1 7.76 0.02 . 1 . . . A 179 SER H . 19554 1 1925 . 1 1 182 182 SER HA H 1 4.15 0.02 . 1 . . . A 179 SER HA . 19554 1 1926 . 1 1 182 182 SER HB2 H 1 3.75 0.02 . 1 . . . A 179 SER HB2 . 19554 1 1927 . 1 1 182 182 SER HB3 H 1 3.75 0.02 . 1 . . . A 179 SER HB3 . 19554 1 1928 . 1 1 182 182 SER CA C 13 59.92 0.25 . 1 . . . A 179 SER CA . 19554 1 1929 . 1 1 182 182 SER CB C 13 64.68 0.25 . 1 . . . A 179 SER CB . 19554 1 1930 . 1 1 182 182 SER N N 15 121.47 0.15 . 1 . . . A 179 SER N . 19554 1 stop_ save_