data_18575 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18575 _Entry.Title ; 1H, 13C and 15N resonance assignments of Bacillus subtilis Lipase A mutant evolved towards thermostability ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-07-05 _Entry.Accession_date 2012-07-05 _Entry.Last_release_date 2012-08-29 _Entry.Original_release_date 2012-08-29 _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 Wojciech Augustyniak . . . 18575 2 Hans Wienk . . . 18575 3 Rolf Boelens . . . 18575 4 Manfred Reetz . T. . 18575 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Max-Planck-Institut fur Kohlenforschung' . 18575 2 . 'Bijvoet Center for Biomolecular Research, Utrecht University' . 18575 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18575 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 741 18575 '15N chemical shifts' 195 18575 '1H chemical shifts' 1228 18575 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2012-08-29 2012-07-05 original author . 18575 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 18574 'wild-type Lipase A' 18575 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18575 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22267088 _Citation.Full_citation . _Citation.Title 'Biophysical characterization of mutants of Bacillus subtilis lipase evolved for thermostability: factors contributing to increased activity retention.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Protein Sci.' _Citation.Journal_name_full 'Protein science : a publication of the Protein Society' _Citation.Journal_volume 21 _Citation.Journal_issue 4 _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 487 _Citation.Page_last 497 _Citation.Year 2012 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Wojciech Augustyniak . . . 18575 1 2 Agnieszka Brzezinska . A. . 18575 1 3 Tjaard Pijning . . . 18575 1 4 Hans Wienk . . . 18575 1 5 Rolf Boelens . . . 18575 1 6 Bauke Dijkstra . W. . 18575 1 7 Manfred Reetz . T. . 18575 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'chemical shift comparison' 18575 1 'directed evolution' 18575 1 'kinetic stability' 18575 1 thermostability 18575 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18575 _Assembly.ID 1 _Assembly.Name 'variant XI LipA' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 19192 _Assembly.Enzyme_commission_number 'E.C. 3.1.1.3' _Assembly.Details 'Lipase A from Bacillus subtilis kinetically thermostable variant XI' _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 'variant XI LipA' 1 $variant_XI_LipA A . yes native no no 1 'catalytically active enzyme' . 18575 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'Triacylglyceride hydrolysis, lipase, esterase' 18575 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_variant_XI_LipA _Entity.Sf_category entity _Entity.Sf_framecode variant_XI_LipA _Entity.Entry_ID 18575 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name variant_XI_LipA _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AEHNPVVMVHGIGGASFNFA GIKSYLVSQGWSGDKLYAVD FWDKTGTNYNNGPVLSRFVQ KVLDETGAKKVDIVAHSMGG ANTLYYIKNLDGGNKVANVV TLGGANRLTTGDALPGTDPN QKILYTSIYSSADDIVMNCL SRLDGARNVQIHGVGHMGLL YSSQVNSLIKEGLNGGGQNT N ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Full length Lipase A variant' _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 181 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'Lipase A thermostable variant' _Entity.Mutation 'R33G, K112D, M134D, Y139C, I157M' _Entity.EC_number 'E.C. 3.1.1.3' _Entity.Calc_isoelectric_point . _Entity.Formula_weight 19192 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 18574 . WT_LipA . . . . . 100.00 181 97.24 97.79 6.56e-121 . . . . 18575 1 2 no PDB 1I6W . "The Crystal Structure Of Bacillus Subtilis Lipase: A Minimal AlphaBETA HYDROLASE ENZYME" . . . . . 100.00 181 97.24 97.79 6.56e-121 . . . . 18575 1 3 no PDB 1ISP . "Crystal Structure Of Bacillus Subtilis Lipase At 1.3a Resolution" . . . . . 100.00 181 97.24 97.79 6.56e-121 . . . . 18575 1 4 no PDB 1R4Z . "Bacillus Subtilis Lipase A With Covalently Bound Rc-Ipg- Phosphonate-Inhibitor" . . . . . 100.00 181 97.24 97.79 6.56e-121 . . . . 18575 1 5 no PDB 1R50 . "Bacillus Subtilis Lipase A With Covalently Bound Sc-Ipg- Phosphonate-Inhibitor" . . . . . 100.00 181 97.24 97.79 6.56e-121 . . . . 18575 1 6 no PDB 2QXT . "Crystal Structure Analysis Of The Bacillus Subtilis Lipase Crystallized At Ph 4.5" . . . . . 98.90 179 97.21 97.77 3.23e-119 . . . . 18575 1 7 no PDB 2QXU . "Crystal Structure Analysis Of The Bacillus Subtilis Lipase Crystallized At Ph 5.0" . . . . . 98.90 179 97.21 97.77 3.23e-119 . . . . 18575 1 8 no PDB 3QZU . "Crystal Structure Of Bacillus Subtilis Lipase A 7-Fold Mutant; The Outcome Of Directed Evolution Towards Thermostability" . . . . . 100.00 181 98.34 98.90 6.07e-124 . . . . 18575 1 9 no PDB 5CRI . "Wild-type Bacillus Subtilis Lipase A With 0% [bmim][cl]" . . . . . 100.00 181 97.24 97.79 6.56e-121 . . . . 18575 1 10 no PDB 5CT4 . "Wild-type Bacillus Subtilis Lipase A With 5% [bmim][cl]" . . . . . 99.45 180 97.22 97.78 2.83e-120 . . . . 18575 1 11 no PDB 5CT5 . "Wild-type Bacillus Subtilis Lipase A With 10% [bmim][cl]" . . . . . 99.45 180 97.22 97.78 2.83e-120 . . . . 18575 1 12 no PDB 5CT6 . "Wild-type Bacillus Subtilis Lipase A With 20% [bmim][cl]" . . . . . 99.45 180 97.22 97.78 2.83e-120 . . . . 18575 1 13 no DBJ BAA22231 . "Triacylglycerol lipase [Bacillus subtilis]" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 14 no DBJ BAI83725 . "lipase [Bacillus subtilis subsp. natto BEST195]" . . . . . 100.00 220 97.24 97.79 8.47e-122 . . . . 18575 1 15 no DBJ BAM49200 . "secreted alkaliphilic lipase [Bacillus subtilis BEST7613]" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 16 no DBJ BAM56470 . "secreted alkaliphilic lipase [Bacillus subtilis BEST7003]" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 17 no DBJ BAP19127 . "lipase [Bacillus subtilis]" . . . . . 99.45 201 97.22 97.78 1.24e-120 . . . . 18575 1 18 no EMBL CAB12064 . "secreted alkaliphilic lipase [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 19 no EMBL CEI55388 . "lipase EstA [Bacillus subtilis]" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 20 no EMBL CEJ75813 . "lipase EstA [Bacillus sp.]" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 21 no EMBL CJR84790 . "Lipase A [Streptococcus pneumoniae]" . . . . . 100.00 212 97.24 97.79 1.12e-121 . . . . 18575 1 22 no EMBL COO28547 . "Lipase A [Streptococcus pneumoniae]" . . . . . 100.00 212 97.24 97.79 1.12e-121 . . . . 18575 1 23 no GB ABQ08591 . "lipase [Bacillus subtilis]" . . . . . 100.00 212 97.24 97.79 1.12e-121 . . . . 18575 1 24 no GB ABQ42598 . "lipase [Bacillus subtilis]" . . . . . 100.00 212 97.24 97.79 1.12e-121 . . . . 18575 1 25 no GB ABQ50891 . "lipase [Bacillus subtilis]" . . . . . 100.00 212 97.24 97.79 1.12e-121 . . . . 18575 1 26 no GB AFN11641 . "lipase A [Bacillus subtilis]" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 27 no GB AFQ56205 . "Secreted alkaliphilic lipase [Bacillus subtilis QB928]" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 28 no REF NP_388152 . "lipase EstA [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 29 no REF WP_003246250 . "MULTISPECIES: lipase EstA [Bacillus]" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 30 no REF WP_014478727 . "lipase EstA [Bacillus subtilis]" . . . . . 100.00 212 97.24 97.79 1.10e-121 . . . . 18575 1 31 no REF WP_019712347 . "esterase, partial [Bacillus subtilis]" . . . . . 68.51 155 98.39 98.39 1.46e-81 . . . . 18575 1 32 no REF WP_038428323 . "esterase [Bacillus subtilis]" . . . . . 100.00 212 97.24 97.79 1.12e-121 . . . . 18575 1 33 no SP P37957 . "RecName: Full=Lipase EstA; AltName: Full=Lipase A; AltName: Full=Triacylglycerol lipase; Flags: Precursor" . . . . . 100.00 212 97.24 97.79 9.72e-122 . . . . 18575 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Triacylglyceride hydrolase, lipase, esterase' 18575 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 . ALA . 18575 1 2 . GLU . 18575 1 3 . HIS . 18575 1 4 . ASN . 18575 1 5 . PRO . 18575 1 6 . VAL . 18575 1 7 . VAL . 18575 1 8 . MET . 18575 1 9 . VAL . 18575 1 10 . HIS . 18575 1 11 . GLY . 18575 1 12 . ILE . 18575 1 13 . GLY . 18575 1 14 . GLY . 18575 1 15 . ALA . 18575 1 16 . SER . 18575 1 17 . PHE . 18575 1 18 . ASN . 18575 1 19 . PHE . 18575 1 20 . ALA . 18575 1 21 . GLY . 18575 1 22 . ILE . 18575 1 23 . LYS . 18575 1 24 . SER . 18575 1 25 . TYR . 18575 1 26 . LEU . 18575 1 27 . VAL . 18575 1 28 . SER . 18575 1 29 . GLN . 18575 1 30 . GLY . 18575 1 31 . TRP . 18575 1 32 . SER . 18575 1 33 . GLY . 18575 1 34 . ASP . 18575 1 35 . LYS . 18575 1 36 . LEU . 18575 1 37 . TYR . 18575 1 38 . ALA . 18575 1 39 . VAL . 18575 1 40 . ASP . 18575 1 41 . PHE . 18575 1 42 . TRP . 18575 1 43 . ASP . 18575 1 44 . LYS . 18575 1 45 . THR . 18575 1 46 . GLY . 18575 1 47 . THR . 18575 1 48 . ASN . 18575 1 49 . TYR . 18575 1 50 . ASN . 18575 1 51 . ASN . 18575 1 52 . GLY . 18575 1 53 . PRO . 18575 1 54 . VAL . 18575 1 55 . LEU . 18575 1 56 . SER . 18575 1 57 . ARG . 18575 1 58 . PHE . 18575 1 59 . VAL . 18575 1 60 . GLN . 18575 1 61 . LYS . 18575 1 62 . VAL . 18575 1 63 . LEU . 18575 1 64 . ASP . 18575 1 65 . GLU . 18575 1 66 . THR . 18575 1 67 . GLY . 18575 1 68 . ALA . 18575 1 69 . LYS . 18575 1 70 . LYS . 18575 1 71 . VAL . 18575 1 72 . ASP . 18575 1 73 . ILE . 18575 1 74 . VAL . 18575 1 75 . ALA . 18575 1 76 . HIS . 18575 1 77 . SER . 18575 1 78 . MET . 18575 1 79 . GLY . 18575 1 80 . GLY . 18575 1 81 . ALA . 18575 1 82 . ASN . 18575 1 83 . THR . 18575 1 84 . LEU . 18575 1 85 . TYR . 18575 1 86 . TYR . 18575 1 87 . ILE . 18575 1 88 . LYS . 18575 1 89 . ASN . 18575 1 90 . LEU . 18575 1 91 . ASP . 18575 1 92 . GLY . 18575 1 93 . GLY . 18575 1 94 . ASN . 18575 1 95 . LYS . 18575 1 96 . VAL . 18575 1 97 . ALA . 18575 1 98 . ASN . 18575 1 99 . VAL . 18575 1 100 . VAL . 18575 1 101 . THR . 18575 1 102 . LEU . 18575 1 103 . GLY . 18575 1 104 . GLY . 18575 1 105 . ALA . 18575 1 106 . ASN . 18575 1 107 . ARG . 18575 1 108 . LEU . 18575 1 109 . THR . 18575 1 110 . THR . 18575 1 111 . GLY . 18575 1 112 . ASP . 18575 1 113 . ALA . 18575 1 114 . LEU . 18575 1 115 . PRO . 18575 1 116 . GLY . 18575 1 117 . THR . 18575 1 118 . ASP . 18575 1 119 . PRO . 18575 1 120 . ASN . 18575 1 121 . GLN . 18575 1 122 . LYS . 18575 1 123 . ILE . 18575 1 124 . LEU . 18575 1 125 . TYR . 18575 1 126 . THR . 18575 1 127 . SER . 18575 1 128 . ILE . 18575 1 129 . TYR . 18575 1 130 . SER . 18575 1 131 . SER . 18575 1 132 . ALA . 18575 1 133 . ASP . 18575 1 134 . ASP . 18575 1 135 . ILE . 18575 1 136 . VAL . 18575 1 137 . MET . 18575 1 138 . ASN . 18575 1 139 . CYS . 18575 1 140 . LEU . 18575 1 141 . SER . 18575 1 142 . ARG . 18575 1 143 . LEU . 18575 1 144 . ASP . 18575 1 145 . GLY . 18575 1 146 . ALA . 18575 1 147 . ARG . 18575 1 148 . ASN . 18575 1 149 . VAL . 18575 1 150 . GLN . 18575 1 151 . ILE . 18575 1 152 . HIS . 18575 1 153 . GLY . 18575 1 154 . VAL . 18575 1 155 . GLY . 18575 1 156 . HIS . 18575 1 157 . MET . 18575 1 158 . GLY . 18575 1 159 . LEU . 18575 1 160 . LEU . 18575 1 161 . TYR . 18575 1 162 . SER . 18575 1 163 . SER . 18575 1 164 . GLN . 18575 1 165 . VAL . 18575 1 166 . ASN . 18575 1 167 . SER . 18575 1 168 . LEU . 18575 1 169 . ILE . 18575 1 170 . LYS . 18575 1 171 . GLU . 18575 1 172 . GLY . 18575 1 173 . LEU . 18575 1 174 . ASN . 18575 1 175 . GLY . 18575 1 176 . GLY . 18575 1 177 . GLY . 18575 1 178 . GLN . 18575 1 179 . ASN . 18575 1 180 . THR . 18575 1 181 . ASN . 18575 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 . ALA 1 1 18575 1 . GLU 2 2 18575 1 . HIS 3 3 18575 1 . ASN 4 4 18575 1 . PRO 5 5 18575 1 . VAL 6 6 18575 1 . VAL 7 7 18575 1 . MET 8 8 18575 1 . VAL 9 9 18575 1 . HIS 10 10 18575 1 . GLY 11 11 18575 1 . ILE 12 12 18575 1 . GLY 13 13 18575 1 . GLY 14 14 18575 1 . ALA 15 15 18575 1 . SER 16 16 18575 1 . PHE 17 17 18575 1 . ASN 18 18 18575 1 . PHE 19 19 18575 1 . ALA 20 20 18575 1 . GLY 21 21 18575 1 . ILE 22 22 18575 1 . LYS 23 23 18575 1 . SER 24 24 18575 1 . TYR 25 25 18575 1 . LEU 26 26 18575 1 . VAL 27 27 18575 1 . SER 28 28 18575 1 . GLN 29 29 18575 1 . GLY 30 30 18575 1 . TRP 31 31 18575 1 . SER 32 32 18575 1 . GLY 33 33 18575 1 . ASP 34 34 18575 1 . LYS 35 35 18575 1 . LEU 36 36 18575 1 . TYR 37 37 18575 1 . ALA 38 38 18575 1 . VAL 39 39 18575 1 . ASP 40 40 18575 1 . PHE 41 41 18575 1 . TRP 42 42 18575 1 . ASP 43 43 18575 1 . LYS 44 44 18575 1 . THR 45 45 18575 1 . GLY 46 46 18575 1 . THR 47 47 18575 1 . ASN 48 48 18575 1 . TYR 49 49 18575 1 . ASN 50 50 18575 1 . ASN 51 51 18575 1 . GLY 52 52 18575 1 . PRO 53 53 18575 1 . VAL 54 54 18575 1 . LEU 55 55 18575 1 . SER 56 56 18575 1 . ARG 57 57 18575 1 . PHE 58 58 18575 1 . VAL 59 59 18575 1 . GLN 60 60 18575 1 . LYS 61 61 18575 1 . VAL 62 62 18575 1 . LEU 63 63 18575 1 . ASP 64 64 18575 1 . GLU 65 65 18575 1 . THR 66 66 18575 1 . GLY 67 67 18575 1 . ALA 68 68 18575 1 . LYS 69 69 18575 1 . LYS 70 70 18575 1 . VAL 71 71 18575 1 . ASP 72 72 18575 1 . ILE 73 73 18575 1 . VAL 74 74 18575 1 . ALA 75 75 18575 1 . HIS 76 76 18575 1 . SER 77 77 18575 1 . MET 78 78 18575 1 . GLY 79 79 18575 1 . GLY 80 80 18575 1 . ALA 81 81 18575 1 . ASN 82 82 18575 1 . THR 83 83 18575 1 . LEU 84 84 18575 1 . TYR 85 85 18575 1 . TYR 86 86 18575 1 . ILE 87 87 18575 1 . LYS 88 88 18575 1 . ASN 89 89 18575 1 . LEU 90 90 18575 1 . ASP 91 91 18575 1 . GLY 92 92 18575 1 . GLY 93 93 18575 1 . ASN 94 94 18575 1 . LYS 95 95 18575 1 . VAL 96 96 18575 1 . ALA 97 97 18575 1 . ASN 98 98 18575 1 . VAL 99 99 18575 1 . VAL 100 100 18575 1 . THR 101 101 18575 1 . LEU 102 102 18575 1 . GLY 103 103 18575 1 . GLY 104 104 18575 1 . ALA 105 105 18575 1 . ASN 106 106 18575 1 . ARG 107 107 18575 1 . LEU 108 108 18575 1 . THR 109 109 18575 1 . THR 110 110 18575 1 . GLY 111 111 18575 1 . ASP 112 112 18575 1 . ALA 113 113 18575 1 . LEU 114 114 18575 1 . PRO 115 115 18575 1 . GLY 116 116 18575 1 . THR 117 117 18575 1 . ASP 118 118 18575 1 . PRO 119 119 18575 1 . ASN 120 120 18575 1 . GLN 121 121 18575 1 . LYS 122 122 18575 1 . ILE 123 123 18575 1 . LEU 124 124 18575 1 . TYR 125 125 18575 1 . THR 126 126 18575 1 . SER 127 127 18575 1 . ILE 128 128 18575 1 . TYR 129 129 18575 1 . SER 130 130 18575 1 . SER 131 131 18575 1 . ALA 132 132 18575 1 . ASP 133 133 18575 1 . ASP 134 134 18575 1 . ILE 135 135 18575 1 . VAL 136 136 18575 1 . MET 137 137 18575 1 . ASN 138 138 18575 1 . CYS 139 139 18575 1 . LEU 140 140 18575 1 . SER 141 141 18575 1 . ARG 142 142 18575 1 . LEU 143 143 18575 1 . ASP 144 144 18575 1 . GLY 145 145 18575 1 . ALA 146 146 18575 1 . ARG 147 147 18575 1 . ASN 148 148 18575 1 . VAL 149 149 18575 1 . GLN 150 150 18575 1 . ILE 151 151 18575 1 . HIS 152 152 18575 1 . GLY 153 153 18575 1 . VAL 154 154 18575 1 . GLY 155 155 18575 1 . HIS 156 156 18575 1 . MET 157 157 18575 1 . GLY 158 158 18575 1 . LEU 159 159 18575 1 . LEU 160 160 18575 1 . TYR 161 161 18575 1 . SER 162 162 18575 1 . SER 163 163 18575 1 . GLN 164 164 18575 1 . VAL 165 165 18575 1 . ASN 166 166 18575 1 . SER 167 167 18575 1 . LEU 168 168 18575 1 . ILE 169 169 18575 1 . LYS 170 170 18575 1 . GLU 171 171 18575 1 . GLY 172 172 18575 1 . LEU 173 173 18575 1 . ASN 174 174 18575 1 . GLY 175 175 18575 1 . GLY 176 176 18575 1 . GLY 177 177 18575 1 . GLN 178 178 18575 1 . ASN 179 179 18575 1 . THR 180 180 18575 1 . ASN 181 181 18575 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 18575 _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 $variant_XI_LipA . 1423 organism . 'Bacillus subtilis' Firmicutes . . Bacteria . Bacillus subtilis 168 . . . . . . . . . . . . . . . estA . 'Gene locus name: BSU02700' . . 18575 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 18575 _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 $variant_XI_LipA . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3) RP' . . . . . . . . . . . . . . . pET-22b(+) . . . . . . 18575 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18575 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'variant XI LipA' '[U-99% 13C; U-99% 15N]' . . 1 $variant_XI_LipA . . 0.5 . . mM 0.05 . . . 18575 1 2 DTT '[U-99% 2H]' . . . . . . 5.0 . . mM 0.1 . . . 18575 1 3 'potassium phosphate' 'natural abundance' . . . . . . 10.0 . . mM 0.1 . . . 18575 1 4 'sodium azide' 'natural abundance' . . . . . . 4.6 . . mM 0.1 . . . 18575 1 5 H2O 'natural abundance' . . . . . . 90 . . % 0.1 . . . 18575 1 6 D2O '[U-99% 2H]' . . . . . . 10 . . % 0.1 . . . 18575 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 18575 _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' 40 10 mM 18575 1 pH 7.0 0.1 pH 18575 1 pressure 1 . atm 18575 1 temperature 298.0 0.1 K 18575 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 18575 _Software.ID 1 _Software.Name TOPSPIN _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 18575 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 18575 1 processing 18575 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 18575 _Software.ID 2 _Software.Name CARA _Software.Version 1.8.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' 'Rochus Keller & DATONAL AG, CH-6343 Rotkreuz, Switzerland' rkeller@nmr.ch 18575 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18575 2 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 18575 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18575 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 18575 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 18575 1 2 spectrometer_2 Bruker Avance . 900 . . . 18575 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 18575 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18575 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18575 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18575 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18575 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18575 1 6 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18575 1 7 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18575 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18575 1 9 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18575 1 10 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18575 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 18575 _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 . . . . . . . . . 18575 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18575 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18575 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 18575 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 'Precision of peak maximum' _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 3 '3D HNCO' . . . 18575 1 4 '3D CBCA(CO)NH' . . . 18575 1 5 '3D HNCACB' . . . 18575 1 6 '3D HBHA(CO)NH' . . . 18575 1 7 '3D HCCH-TOCSY' . . . 18575 1 8 '3D 1H-15N NOESY' . . . 18575 1 9 '3D 1H-13C NOESY' . . . 18575 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ALA HA H 1 3.860 0.010 . 1 . . . . 1 ALA HA . 18575 1 2 . 1 1 1 1 ALA HB1 H 1 1.249 0.010 . 1 . . . . 1 ALA QB . 18575 1 3 . 1 1 1 1 ALA HB2 H 1 1.249 0.010 . 1 . . . . 1 ALA QB . 18575 1 4 . 1 1 1 1 ALA HB3 H 1 1.249 0.010 . 1 . . . . 1 ALA QB . 18575 1 5 . 1 1 1 1 ALA C C 13 175.34 0.20 . 1 . . . . 1 ALA C . 18575 1 6 . 1 1 1 1 ALA CA C 13 51.34 0.20 . 1 . . . . 1 ALA CA . 18575 1 7 . 1 1 1 1 ALA CB C 13 19.35 0.20 . 1 . . . . 1 ALA CB . 18575 1 8 . 1 1 2 2 GLU H H 1 8.226 0.010 . 1 . . . . 2 GLU H . 18575 1 9 . 1 1 2 2 GLU HA H 1 4.127 0.010 . 1 . . . . 2 GLU HA . 18575 1 10 . 1 1 2 2 GLU HB2 H 1 1.844 0.010 . 2 . . . . 2 GLU HB2 . 18575 1 11 . 1 1 2 2 GLU HB3 H 1 1.726 0.010 . 2 . . . . 2 GLU HB3 . 18575 1 12 . 1 1 2 2 GLU HG2 H 1 2.144 0.010 . 2 . . . . 2 GLU HG2 . 18575 1 13 . 1 1 2 2 GLU HG3 H 1 2.102 0.010 . 2 . . . . 2 GLU HG3 . 18575 1 14 . 1 1 2 2 GLU C C 13 175.77 0.20 . 1 . . . . 2 GLU C . 18575 1 15 . 1 1 2 2 GLU CA C 13 55.36 0.20 . 1 . . . . 2 GLU CA . 18575 1 16 . 1 1 2 2 GLU CB C 13 30.23 0.20 . 1 . . . . 2 GLU CB . 18575 1 17 . 1 1 2 2 GLU CG C 13 35.65 0.20 . 1 . . . . 2 GLU CG . 18575 1 18 . 1 1 2 2 GLU N N 15 122.97 0.20 . 1 . . . . 2 GLU N . 18575 1 19 . 1 1 3 3 HIS H H 1 8.157 0.010 . 1 . . . . 3 HIS H . 18575 1 20 . 1 1 3 3 HIS HA H 1 4.619 0.010 . 1 . . . . 3 HIS HA . 18575 1 21 . 1 1 3 3 HIS HB2 H 1 2.693 0.010 . 2 . . . . 3 HIS HB2 . 18575 1 22 . 1 1 3 3 HIS HB3 H 1 3.271 0.010 . 2 . . . . 3 HIS HB3 . 18575 1 23 . 1 1 3 3 HIS HD2 H 1 6.217 0.010 . 1 . . . . 3 HIS HD2 . 18575 1 24 . 1 1 3 3 HIS HE1 H 1 6.822 0.010 . 1 . . . . 3 HIS HE1 . 18575 1 25 . 1 1 3 3 HIS C C 13 175.05 0.20 . 1 . . . . 3 HIS C . 18575 1 26 . 1 1 3 3 HIS CA C 13 54.46 0.20 . 1 . . . . 3 HIS CA . 18575 1 27 . 1 1 3 3 HIS CB C 13 29.49 0.20 . 1 . . . . 3 HIS CB . 18575 1 28 . 1 1 3 3 HIS CD2 C 13 118.86 0.20 . 1 . . . . 3 HIS CD2 . 18575 1 29 . 1 1 3 3 HIS N N 15 119.73 0.20 . 1 . . . . 3 HIS N . 18575 1 30 . 1 1 4 4 ASN H H 1 9.209 0.010 . 1 . . . . 4 ASN H . 18575 1 31 . 1 1 4 4 ASN HA H 1 4.959 0.010 . 1 . . . . 4 ASN HA . 18575 1 32 . 1 1 4 4 ASN HB2 H 1 3.045 0.010 . 2 . . . . 4 ASN HB2 . 18575 1 33 . 1 1 4 4 ASN HB3 H 1 2.634 0.010 . 2 . . . . 4 ASN HB3 . 18575 1 34 . 1 1 4 4 ASN HD21 H 1 7.865 0.010 . 2 . . . . 4 ASN HD21 . 18575 1 35 . 1 1 4 4 ASN HD22 H 1 6.864 0.010 . 2 . . . . 4 ASN HD22 . 18575 1 36 . 1 1 4 4 ASN CA C 13 51.86 0.20 . 1 . . . . 4 ASN CA . 18575 1 37 . 1 1 4 4 ASN CB C 13 36.24 0.20 . 1 . . . . 4 ASN CB . 18575 1 38 . 1 1 4 4 ASN CG C 13 176.06 0.20 . 1 . . . . 4 ASN CG . 18575 1 39 . 1 1 4 4 ASN N N 15 122.23 0.20 . 1 . . . . 4 ASN N . 18575 1 40 . 1 1 4 4 ASN ND2 N 15 114.00 0.20 . 1 . . . . 4 ASN ND2 . 18575 1 41 . 1 1 5 5 PRO HA H 1 4.990 0.010 . 1 . . . . 5 PRO HA . 18575 1 42 . 1 1 5 5 PRO HB2 H 1 2.377 0.010 . 2 . . . . 5 PRO HB2 . 18575 1 43 . 1 1 5 5 PRO HB3 H 1 1.804 0.010 . 2 . . . . 5 PRO HB3 . 18575 1 44 . 1 1 5 5 PRO HG2 H 1 2.068 0.010 . 2 . . . . 5 PRO HG2 . 18575 1 45 . 1 1 5 5 PRO HG3 H 1 2.171 0.010 . 2 . . . . 5 PRO HG3 . 18575 1 46 . 1 1 5 5 PRO HD2 H 1 4.044 0.010 . 1 . . . . 5 PRO HD2 . 18575 1 47 . 1 1 5 5 PRO HD3 H 1 4.044 0.010 . 1 . . . . 5 PRO HD3 . 18575 1 48 . 1 1 5 5 PRO C C 13 173.98 0.20 . 1 . . . . 5 PRO C . 18575 1 49 . 1 1 5 5 PRO CA C 13 63.47 0.20 . 1 . . . . 5 PRO CA . 18575 1 50 . 1 1 5 5 PRO CB C 13 32.36 0.20 . 1 . . . . 5 PRO CB . 18575 1 51 . 1 1 5 5 PRO CG C 13 28.27 0.20 . 1 . . . . 5 PRO CG . 18575 1 52 . 1 1 5 5 PRO CD C 13 49.66 0.20 . 1 . . . . 5 PRO CD . 18575 1 53 . 1 1 6 6 VAL H H 1 8.308 0.010 . 1 . . . . 6 VAL H . 18575 1 54 . 1 1 6 6 VAL HA H 1 4.911 0.010 . 1 . . . . 6 VAL HA . 18575 1 55 . 1 1 6 6 VAL HB H 1 1.984 0.010 . 1 . . . . 6 VAL HB . 18575 1 56 . 1 1 6 6 VAL HG11 H 1 0.640 0.010 . 2 . . . . 6 VAL QG1 . 18575 1 57 . 1 1 6 6 VAL HG12 H 1 0.640 0.010 . 2 . . . . 6 VAL QG1 . 18575 1 58 . 1 1 6 6 VAL HG13 H 1 0.640 0.010 . 2 . . . . 6 VAL QG1 . 18575 1 59 . 1 1 6 6 VAL HG21 H 1 1.124 0.010 . 2 . . . . 6 VAL QG2 . 18575 1 60 . 1 1 6 6 VAL HG22 H 1 1.124 0.010 . 2 . . . . 6 VAL QG2 . 18575 1 61 . 1 1 6 6 VAL HG23 H 1 1.124 0.010 . 2 . . . . 6 VAL QG2 . 18575 1 62 . 1 1 6 6 VAL C C 13 174.62 0.20 . 1 . . . . 6 VAL C . 18575 1 63 . 1 1 6 6 VAL CA C 13 60.20 0.20 . 1 . . . . 6 VAL CA . 18575 1 64 . 1 1 6 6 VAL CB C 13 34.43 0.20 . 1 . . . . 6 VAL CB . 18575 1 65 . 1 1 6 6 VAL CG1 C 13 22.35 0.20 . 2 . . . . 6 VAL CG1 . 18575 1 66 . 1 1 6 6 VAL CG2 C 13 23.46 0.20 . 2 . . . . 6 VAL CG2 . 18575 1 67 . 1 1 6 6 VAL N N 15 121.22 0.20 . 1 . . . . 6 VAL N . 18575 1 68 . 1 1 7 7 VAL H H 1 9.274 0.010 . 1 . . . . 7 VAL H . 18575 1 69 . 1 1 7 7 VAL HA H 1 4.605 0.010 . 1 . . . . 7 VAL HA . 18575 1 70 . 1 1 7 7 VAL HB H 1 1.909 0.010 . 1 . . . . 7 VAL HB . 18575 1 71 . 1 1 7 7 VAL HG11 H 1 0.634 0.010 . 2 . . . . 7 VAL QG1 . 18575 1 72 . 1 1 7 7 VAL HG12 H 1 0.634 0.010 . 2 . . . . 7 VAL QG1 . 18575 1 73 . 1 1 7 7 VAL HG13 H 1 0.634 0.010 . 2 . . . . 7 VAL QG1 . 18575 1 74 . 1 1 7 7 VAL HG21 H 1 0.923 0.010 . 2 . . . . 7 VAL QG2 . 18575 1 75 . 1 1 7 7 VAL HG22 H 1 0.923 0.010 . 2 . . . . 7 VAL QG2 . 18575 1 76 . 1 1 7 7 VAL HG23 H 1 0.923 0.010 . 2 . . . . 7 VAL QG2 . 18575 1 77 . 1 1 7 7 VAL C C 13 174.34 0.20 . 1 . . . . 7 VAL C . 18575 1 78 . 1 1 7 7 VAL CA C 13 60.79 0.20 . 1 . . . . 7 VAL CA . 18575 1 79 . 1 1 7 7 VAL CB C 13 33.42 0.20 . 1 . . . . 7 VAL CB . 18575 1 80 . 1 1 7 7 VAL CG1 C 13 20.51 0.20 . 2 . . . . 7 VAL CG1 . 18575 1 81 . 1 1 7 7 VAL CG2 C 13 21.64 0.20 . 2 . . . . 7 VAL CG2 . 18575 1 82 . 1 1 7 7 VAL N N 15 126.74 0.20 . 1 . . . . 7 VAL N . 18575 1 83 . 1 1 8 8 MET H H 1 8.872 0.010 . 1 . . . . 8 MET H . 18575 1 84 . 1 1 8 8 MET HA H 1 5.174 0.010 . 1 . . . . 8 MET HA . 18575 1 85 . 1 1 8 8 MET HB2 H 1 1.087 0.010 . 2 . . . . 8 MET HB2 . 18575 1 86 . 1 1 8 8 MET HB3 H 1 -0.425 0.010 . 2 . . . . 8 MET HB3 . 18575 1 87 . 1 1 8 8 MET HG2 H 1 1.858 0.010 . 2 . . . . 8 MET HG2 . 18575 1 88 . 1 1 8 8 MET HG3 H 1 2.235 0.010 . 2 . . . . 8 MET HG3 . 18575 1 89 . 1 1 8 8 MET HE1 H 1 1.725 0.010 . 1 . . . . 8 MET HE . 18575 1 90 . 1 1 8 8 MET HE2 H 1 1.725 0.010 . 1 . . . . 8 MET HE . 18575 1 91 . 1 1 8 8 MET HE3 H 1 1.725 0.010 . 1 . . . . 8 MET HE . 18575 1 92 . 1 1 8 8 MET C C 13 176.98 0.20 . 1 . . . . 8 MET C . 18575 1 93 . 1 1 8 8 MET CA C 13 53.85 0.20 . 1 . . . . 8 MET CA . 18575 1 94 . 1 1 8 8 MET CB C 13 31.04 0.20 . 1 . . . . 8 MET CB . 18575 1 95 . 1 1 8 8 MET CG C 13 34.20 0.20 . 1 . . . . 8 MET CG . 18575 1 96 . 1 1 8 8 MET CE C 13 19.45 0.20 . 1 . . . . 8 MET CE . 18575 1 97 . 1 1 8 8 MET N N 15 126.46 0.20 . 1 . . . . 8 MET N . 18575 1 98 . 1 1 9 9 VAL H H 1 8.673 0.010 . 1 . . . . 9 VAL H . 18575 1 99 . 1 1 9 9 VAL HA H 1 3.789 0.010 . 1 . . . . 9 VAL HA . 18575 1 100 . 1 1 9 9 VAL HB H 1 1.810 0.010 . 1 . . . . 9 VAL HB . 18575 1 101 . 1 1 9 9 VAL HG11 H 1 1.132 0.010 . 2 . . . . 9 VAL QG1 . 18575 1 102 . 1 1 9 9 VAL HG12 H 1 1.132 0.010 . 2 . . . . 9 VAL QG1 . 18575 1 103 . 1 1 9 9 VAL HG13 H 1 1.132 0.010 . 2 . . . . 9 VAL QG1 . 18575 1 104 . 1 1 9 9 VAL HG21 H 1 0.665 0.010 . 2 . . . . 9 VAL QG2 . 18575 1 105 . 1 1 9 9 VAL HG22 H 1 0.665 0.010 . 2 . . . . 9 VAL QG2 . 18575 1 106 . 1 1 9 9 VAL HG23 H 1 0.665 0.010 . 2 . . . . 9 VAL QG2 . 18575 1 107 . 1 1 9 9 VAL C C 13 174.14 0.20 . 1 . . . . 9 VAL C . 18575 1 108 . 1 1 9 9 VAL CA C 13 62.72 0.20 . 1 . . . . 9 VAL CA . 18575 1 109 . 1 1 9 9 VAL CB C 13 34.13 0.20 . 1 . . . . 9 VAL CB . 18575 1 110 . 1 1 9 9 VAL CG1 C 13 22.43 0.20 . 2 . . . . 9 VAL CG1 . 18575 1 111 . 1 1 9 9 VAL CG2 C 13 21.57 0.20 . 2 . . . . 9 VAL CG2 . 18575 1 112 . 1 1 9 9 VAL N N 15 125.86 0.20 . 1 . . . . 9 VAL N . 18575 1 113 . 1 1 10 10 HIS H H 1 7.619 0.010 . 1 . . . . 10 HIS H . 18575 1 114 . 1 1 10 10 HIS HA H 1 4.955 0.010 . 1 . . . . 10 HIS HA . 18575 1 115 . 1 1 10 10 HIS HB2 H 1 3.361 0.010 . 1 . . . . 10 HIS HB2 . 18575 1 116 . 1 1 10 10 HIS HB3 H 1 3.361 0.010 . 1 . . . . 10 HIS HB3 . 18575 1 117 . 1 1 10 10 HIS HD1 H 1 12.813 0.010 . 1 . . . . 10 HIS HD1 . 18575 1 118 . 1 1 10 10 HIS HD2 H 1 6.416 0.010 . 1 . . . . 10 HIS HD2 . 18575 1 119 . 1 1 10 10 HIS HE1 H 1 7.819 0.010 . 1 . . . . 10 HIS HE1 . 18575 1 120 . 1 1 10 10 HIS C C 13 173.96 0.20 . 1 . . . . 10 HIS C . 18575 1 121 . 1 1 10 10 HIS CA C 13 55.81 0.20 . 1 . . . . 10 HIS CA . 18575 1 122 . 1 1 10 10 HIS CB C 13 29.46 0.20 . 1 . . . . 10 HIS CB . 18575 1 123 . 1 1 10 10 HIS N N 15 127.18 0.20 . 1 . . . . 10 HIS N . 18575 1 124 . 1 1 11 11 GLY H H 1 9.603 0.010 . 1 . . . . 11 GLY H . 18575 1 125 . 1 1 11 11 GLY HA2 H 1 4.920 0.010 . 2 . . . . 11 GLY HA2 . 18575 1 126 . 1 1 11 11 GLY HA3 H 1 3.334 0.010 . 2 . . . . 11 GLY HA3 . 18575 1 127 . 1 1 11 11 GLY C C 13 177.15 0.20 . 1 . . . . 11 GLY C . 18575 1 128 . 1 1 11 11 GLY CA C 13 44.26 0.20 . 1 . . . . 11 GLY CA . 18575 1 129 . 1 1 11 11 GLY N N 15 105.30 0.20 . 1 . . . . 11 GLY N . 18575 1 130 . 1 1 12 12 ILE H H 1 8.638 0.010 . 1 . . . . 12 ILE H . 18575 1 131 . 1 1 12 12 ILE HA H 1 3.814 0.010 . 1 . . . . 12 ILE HA . 18575 1 132 . 1 1 12 12 ILE HB H 1 1.765 0.010 . 1 . . . . 12 ILE HB . 18575 1 133 . 1 1 12 12 ILE HG12 H 1 1.480 0.010 . 2 . . . . 12 ILE HG12 . 18575 1 134 . 1 1 12 12 ILE HG13 H 1 0.801 0.010 . 2 . . . . 12 ILE HG13 . 18575 1 135 . 1 1 12 12 ILE HG21 H 1 0.922 0.010 . 1 . . . . 12 ILE QG2 . 18575 1 136 . 1 1 12 12 ILE HG22 H 1 0.922 0.010 . 1 . . . . 12 ILE QG2 . 18575 1 137 . 1 1 12 12 ILE HG23 H 1 0.922 0.010 . 1 . . . . 12 ILE QG2 . 18575 1 138 . 1 1 12 12 ILE HD11 H 1 0.851 0.010 . 1 . . . . 12 ILE QD1 . 18575 1 139 . 1 1 12 12 ILE HD12 H 1 0.851 0.010 . 1 . . . . 12 ILE QD1 . 18575 1 140 . 1 1 12 12 ILE HD13 H 1 0.851 0.010 . 1 . . . . 12 ILE QD1 . 18575 1 141 . 1 1 12 12 ILE C C 13 178.52 0.20 . 1 . . . . 12 ILE C . 18575 1 142 . 1 1 12 12 ILE CA C 13 63.66 0.20 . 1 . . . . 12 ILE CA . 18575 1 143 . 1 1 12 12 ILE CB C 13 37.29 0.20 . 1 . . . . 12 ILE CB . 18575 1 144 . 1 1 12 12 ILE CG1 C 13 29.17 0.20 . 1 . . . . 12 ILE CG1 . 18575 1 145 . 1 1 12 12 ILE CG2 C 13 16.64 0.20 . 1 . . . . 12 ILE CG2 . 18575 1 146 . 1 1 12 12 ILE CD1 C 13 13.20 0.20 . 1 . . . . 12 ILE CD1 . 18575 1 147 . 1 1 12 12 ILE N N 15 123.22 0.20 . 1 . . . . 12 ILE N . 18575 1 148 . 1 1 13 13 GLY H H 1 9.258 0.010 . 1 . . . . 13 GLY H . 18575 1 149 . 1 1 13 13 GLY HA2 H 1 3.864 0.010 . 2 . . . . 13 GLY HA2 . 18575 1 150 . 1 1 13 13 GLY HA3 H 1 4.180 0.010 . 2 . . . . 13 GLY HA3 . 18575 1 151 . 1 1 13 13 GLY C C 13 174.15 0.20 . 1 . . . . 13 GLY C . 18575 1 152 . 1 1 13 13 GLY CA C 13 45.45 0.20 . 1 . . . . 13 GLY CA . 18575 1 153 . 1 1 13 13 GLY N N 15 116.73 0.20 . 1 . . . . 13 GLY N . 18575 1 154 . 1 1 14 14 GLY H H 1 7.792 0.010 . 1 . . . . 14 GLY H . 18575 1 155 . 1 1 14 14 GLY HA2 H 1 4.401 0.010 . 2 . . . . 14 GLY HA2 . 18575 1 156 . 1 1 14 14 GLY HA3 H 1 3.384 0.010 . 2 . . . . 14 GLY HA3 . 18575 1 157 . 1 1 14 14 GLY C C 13 170.30 0.20 . 1 . . . . 14 GLY C . 18575 1 158 . 1 1 14 14 GLY CA C 13 43.79 0.20 . 1 . . . . 14 GLY CA . 18575 1 159 . 1 1 14 14 GLY N N 15 106.07 0.20 . 1 . . . . 14 GLY N . 18575 1 160 . 1 1 15 15 ALA H H 1 7.010 0.010 . 1 . . . . 15 ALA H . 18575 1 161 . 1 1 15 15 ALA HA H 1 3.717 0.010 . 1 . . . . 15 ALA HA . 18575 1 162 . 1 1 15 15 ALA HB1 H 1 0.826 0.010 . 1 . . . . 15 ALA QB . 18575 1 163 . 1 1 15 15 ALA HB2 H 1 0.826 0.010 . 1 . . . . 15 ALA QB . 18575 1 164 . 1 1 15 15 ALA HB3 H 1 0.826 0.010 . 1 . . . . 15 ALA QB . 18575 1 165 . 1 1 15 15 ALA C C 13 177.66 0.20 . 1 . . . . 15 ALA C . 18575 1 166 . 1 1 15 15 ALA CA C 13 50.82 0.20 . 1 . . . . 15 ALA CA . 18575 1 167 . 1 1 15 15 ALA CB C 13 22.46 0.20 . 1 . . . . 15 ALA CB . 18575 1 168 . 1 1 15 15 ALA N N 15 115.00 0.20 . 1 . . . . 15 ALA N . 18575 1 169 . 1 1 16 16 SER H H 1 9.479 0.010 . 1 . . . . 16 SER H . 18575 1 170 . 1 1 16 16 SER HA H 1 4.708 0.010 . 1 . . . . 16 SER HA . 18575 1 171 . 1 1 16 16 SER HB2 H 1 4.235 0.010 . 2 . . . . 16 SER HB2 . 18575 1 172 . 1 1 16 16 SER HB3 H 1 3.664 0.010 . 2 . . . . 16 SER HB3 . 18575 1 173 . 1 1 16 16 SER C C 13 178.54 0.20 . 1 . . . . 16 SER C . 18575 1 174 . 1 1 16 16 SER CA C 13 60.00 0.20 . 1 . . . . 16 SER CA . 18575 1 175 . 1 1 16 16 SER CB C 13 61.35 0.20 . 1 . . . . 16 SER CB . 18575 1 176 . 1 1 16 16 SER N N 15 117.94 0.20 . 1 . . . . 16 SER N . 18575 1 177 . 1 1 17 17 PHE H H 1 6.908 0.010 . 1 . . . . 17 PHE H . 18575 1 178 . 1 1 17 17 PHE HA H 1 4.556 0.010 . 1 . . . . 17 PHE HA . 18575 1 179 . 1 1 17 17 PHE HB2 H 1 3.089 0.010 . 2 . . . . 17 PHE HB2 . 18575 1 180 . 1 1 17 17 PHE HB3 H 1 3.381 0.010 . 2 . . . . 17 PHE HB3 . 18575 1 181 . 1 1 17 17 PHE HD1 H 1 7.169 0.010 . 3 . . . . 17 PHE HD1 . 18575 1 182 . 1 1 17 17 PHE HD2 H 1 7.169 0.010 . 3 . . . . 17 PHE HD2 . 18575 1 183 . 1 1 17 17 PHE HE1 H 1 7.297 0.010 . 3 . . . . 17 PHE HE1 . 18575 1 184 . 1 1 17 17 PHE HE2 H 1 7.297 0.010 . 3 . . . . 17 PHE HE2 . 18575 1 185 . 1 1 17 17 PHE HZ H 1 7.253 0.010 . 1 . . . . 17 PHE HZ . 18575 1 186 . 1 1 17 17 PHE C C 13 177.32 0.20 . 1 . . . . 17 PHE C . 18575 1 187 . 1 1 17 17 PHE CA C 13 58.93 0.20 . 1 . . . . 17 PHE CA . 18575 1 188 . 1 1 17 17 PHE CB C 13 37.22 0.20 . 1 . . . . 17 PHE CB . 18575 1 189 . 1 1 17 17 PHE CD1 C 13 131.82 0.20 . 3 . . . . 17 PHE CD1 . 18575 1 190 . 1 1 17 17 PHE CD2 C 13 131.82 0.20 . 3 . . . . 17 PHE CD2 . 18575 1 191 . 1 1 17 17 PHE CE1 C 13 131.83 0.20 . 3 . . . . 17 PHE CE1 . 18575 1 192 . 1 1 17 17 PHE CE2 C 13 131.83 0.20 . 3 . . . . 17 PHE CE2 . 18575 1 193 . 1 1 17 17 PHE CZ C 13 129.91 0.20 . 1 . . . . 17 PHE CZ . 18575 1 194 . 1 1 17 17 PHE N N 15 116.96 0.20 . 1 . . . . 17 PHE N . 18575 1 195 . 1 1 18 18 ASN H H 1 8.023 0.010 . 1 . . . . 18 ASN H . 18575 1 196 . 1 1 18 18 ASN HA H 1 4.505 0.010 . 1 . . . . 18 ASN HA . 18575 1 197 . 1 1 18 18 ASN HB2 H 1 2.352 0.010 . 2 . . . . 18 ASN HB2 . 18575 1 198 . 1 1 18 18 ASN HB3 H 1 2.394 0.010 . 2 . . . . 18 ASN HB3 . 18575 1 199 . 1 1 18 18 ASN HD21 H 1 7.015 0.010 . 2 . . . . 18 ASN HD21 . 18575 1 200 . 1 1 18 18 ASN HD22 H 1 7.469 0.010 . 2 . . . . 18 ASN HD22 . 18575 1 201 . 1 1 18 18 ASN C C 13 174.67 0.20 . 1 . . . . 18 ASN C . 18575 1 202 . 1 1 18 18 ASN CA C 13 55.85 0.20 . 1 . . . . 18 ASN CA . 18575 1 203 . 1 1 18 18 ASN CB C 13 38.59 0.20 . 1 . . . . 18 ASN CB . 18575 1 204 . 1 1 18 18 ASN CG C 13 175.92 0.20 . 1 . . . . 18 ASN CG . 18575 1 205 . 1 1 18 18 ASN N N 15 120.61 0.20 . 1 . . . . 18 ASN N . 18575 1 206 . 1 1 18 18 ASN ND2 N 15 109.17 0.20 . 1 . . . . 18 ASN ND2 . 18575 1 207 . 1 1 19 19 PHE H H 1 7.459 0.010 . 1 . . . . 19 PHE H . 18575 1 208 . 1 1 19 19 PHE HA H 1 4.306 0.010 . 1 . . . . 19 PHE HA . 18575 1 209 . 1 1 19 19 PHE HB2 H 1 2.233 0.010 . 2 . . . . 19 PHE HB2 . 18575 1 210 . 1 1 19 19 PHE HB3 H 1 2.634 0.010 . 2 . . . . 19 PHE HB3 . 18575 1 211 . 1 1 19 19 PHE HD1 H 1 7.119 0.010 . 3 . . . . 19 PHE HD1 . 18575 1 212 . 1 1 19 19 PHE HD2 H 1 7.119 0.010 . 3 . . . . 19 PHE HD2 . 18575 1 213 . 1 1 19 19 PHE HE1 H 1 6.874 0.010 . 3 . . . . 19 PHE HE1 . 18575 1 214 . 1 1 19 19 PHE HE2 H 1 6.874 0.010 . 3 . . . . 19 PHE HE2 . 18575 1 215 . 1 1 19 19 PHE HZ H 1 7.111 0.010 . 1 . . . . 19 PHE HZ . 18575 1 216 . 1 1 19 19 PHE C C 13 174.42 0.20 . 1 . . . . 19 PHE C . 18575 1 217 . 1 1 19 19 PHE CA C 13 59.47 0.20 . 1 . . . . 19 PHE CA . 18575 1 218 . 1 1 19 19 PHE CB C 13 39.66 0.20 . 1 . . . . 19 PHE CB . 18575 1 219 . 1 1 19 19 PHE CD1 C 13 132.33 0.20 . 3 . . . . 19 PHE CD1 . 18575 1 220 . 1 1 19 19 PHE CD2 C 13 132.33 0.20 . 3 . . . . 19 PHE CD2 . 18575 1 221 . 1 1 19 19 PHE N N 15 112.34 0.20 . 1 . . . . 19 PHE N . 18575 1 222 . 1 1 20 20 ALA H H 1 7.405 0.010 . 1 . . . . 20 ALA H . 18575 1 223 . 1 1 20 20 ALA HA H 1 3.962 0.010 . 1 . . . . 20 ALA HA . 18575 1 224 . 1 1 20 20 ALA HB1 H 1 1.599 0.010 . 1 . . . . 20 ALA QB . 18575 1 225 . 1 1 20 20 ALA HB2 H 1 1.599 0.010 . 1 . . . . 20 ALA QB . 18575 1 226 . 1 1 20 20 ALA HB3 H 1 1.599 0.010 . 1 . . . . 20 ALA QB . 18575 1 227 . 1 1 20 20 ALA C C 13 180.03 0.20 . 1 . . . . 20 ALA C . 18575 1 228 . 1 1 20 20 ALA CA C 13 56.23 0.20 . 1 . . . . 20 ALA CA . 18575 1 229 . 1 1 20 20 ALA CB C 13 18.42 0.20 . 1 . . . . 20 ALA CB . 18575 1 230 . 1 1 20 20 ALA N N 15 122.18 0.20 . 1 . . . . 20 ALA N . 18575 1 231 . 1 1 21 21 GLY H H 1 8.079 0.010 . 1 . . . . 21 GLY H . 18575 1 232 . 1 1 21 21 GLY HA2 H 1 3.910 0.010 . 2 . . . . 21 GLY HA2 . 18575 1 233 . 1 1 21 21 GLY HA3 H 1 3.655 0.010 . 2 . . . . 21 GLY HA3 . 18575 1 234 . 1 1 21 21 GLY C C 13 176.61 0.20 . 1 . . . . 21 GLY C . 18575 1 235 . 1 1 21 21 GLY CA C 13 47.13 0.20 . 1 . . . . 21 GLY CA . 18575 1 236 . 1 1 21 21 GLY N N 15 107.53 0.20 . 1 . . . . 21 GLY N . 18575 1 237 . 1 1 22 22 ILE H H 1 7.964 0.010 . 1 . . . . 22 ILE H . 18575 1 238 . 1 1 22 22 ILE HA H 1 3.464 0.010 . 1 . . . . 22 ILE HA . 18575 1 239 . 1 1 22 22 ILE HB H 1 1.686 0.010 . 1 . . . . 22 ILE HB . 18575 1 240 . 1 1 22 22 ILE HG12 H 1 1.706 0.010 . 2 . . . . 22 ILE HG12 . 18575 1 241 . 1 1 22 22 ILE HG13 H 1 0.936 0.010 . 2 . . . . 22 ILE HG13 . 18575 1 242 . 1 1 22 22 ILE HG21 H 1 0.785 0.010 . 1 . . . . 22 ILE QG2 . 18575 1 243 . 1 1 22 22 ILE HG22 H 1 0.785 0.010 . 1 . . . . 22 ILE QG2 . 18575 1 244 . 1 1 22 22 ILE HG23 H 1 0.785 0.010 . 1 . . . . 22 ILE QG2 . 18575 1 245 . 1 1 22 22 ILE HD11 H 1 0.780 0.010 . 1 . . . . 22 ILE QD1 . 18575 1 246 . 1 1 22 22 ILE HD12 H 1 0.780 0.010 . 1 . . . . 22 ILE QD1 . 18575 1 247 . 1 1 22 22 ILE HD13 H 1 0.780 0.010 . 1 . . . . 22 ILE QD1 . 18575 1 248 . 1 1 22 22 ILE C C 13 177.79 0.20 . 1 . . . . 22 ILE C . 18575 1 249 . 1 1 22 22 ILE CA C 13 65.66 0.20 . 1 . . . . 22 ILE CA . 18575 1 250 . 1 1 22 22 ILE CB C 13 38.37 0.20 . 1 . . . . 22 ILE CB . 18575 1 251 . 1 1 22 22 ILE CG1 C 13 29.92 0.20 . 1 . . . . 22 ILE CG1 . 18575 1 252 . 1 1 22 22 ILE CG2 C 13 17.03 0.20 . 1 . . . . 22 ILE CG2 . 18575 1 253 . 1 1 22 22 ILE CD1 C 13 15.27 0.20 . 1 . . . . 22 ILE CD1 . 18575 1 254 . 1 1 22 22 ILE N N 15 126.41 0.20 . 1 . . . . 22 ILE N . 18575 1 255 . 1 1 23 23 LYS H H 1 8.824 0.010 . 1 . . . . 23 LYS H . 18575 1 256 . 1 1 23 23 LYS HA H 1 3.682 0.010 . 1 . . . . 23 LYS HA . 18575 1 257 . 1 1 23 23 LYS HB2 H 1 1.853 0.010 . 2 . . . . 23 LYS HB2 . 18575 1 258 . 1 1 23 23 LYS HB3 H 1 1.774 0.010 . 2 . . . . 23 LYS HB3 . 18575 1 259 . 1 1 23 23 LYS HG2 H 1 1.150 0.010 . 2 . . . . 23 LYS HG2 . 18575 1 260 . 1 1 23 23 LYS HG3 H 1 1.464 0.010 . 2 . . . . 23 LYS HG3 . 18575 1 261 . 1 1 23 23 LYS HD2 H 1 1.555 0.010 . 1 . . . . 23 LYS HD2 . 18575 1 262 . 1 1 23 23 LYS HD3 H 1 1.555 0.010 . 1 . . . . 23 LYS HD3 . 18575 1 263 . 1 1 23 23 LYS HE2 H 1 2.754 0.010 . 2 . . . . 23 LYS HE2 . 18575 1 264 . 1 1 23 23 LYS HE3 H 1 2.974 0.010 . 2 . . . . 23 LYS HE3 . 18575 1 265 . 1 1 23 23 LYS C C 13 177.20 0.20 . 1 . . . . 23 LYS C . 18575 1 266 . 1 1 23 23 LYS CA C 13 60.72 0.20 . 1 . . . . 23 LYS CA . 18575 1 267 . 1 1 23 23 LYS CB C 13 32.44 0.20 . 1 . . . . 23 LYS CB . 18575 1 268 . 1 1 23 23 LYS CG C 13 25.98 0.20 . 1 . . . . 23 LYS CG . 18575 1 269 . 1 1 23 23 LYS CD C 13 29.81 0.20 . 1 . . . . 23 LYS CD . 18575 1 270 . 1 1 23 23 LYS CE C 13 41.67 0.20 . 1 . . . . 23 LYS CE . 18575 1 271 . 1 1 23 23 LYS N N 15 119.18 0.20 . 1 . . . . 23 LYS N . 18575 1 272 . 1 1 24 24 SER H H 1 7.669 0.010 . 1 . . . . 24 SER H . 18575 1 273 . 1 1 24 24 SER HA H 1 4.012 0.010 . 1 . . . . 24 SER HA . 18575 1 274 . 1 1 24 24 SER HB2 H 1 4.000 0.010 . 2 . . . . 24 SER HB2 . 18575 1 275 . 1 1 24 24 SER HB3 H 1 4.012 0.010 . 2 . . . . 24 SER HB3 . 18575 1 276 . 1 1 24 24 SER C C 13 177.70 0.20 . 1 . . . . 24 SER C . 18575 1 277 . 1 1 24 24 SER CA C 13 60.99 0.20 . 1 . . . . 24 SER CA . 18575 1 278 . 1 1 24 24 SER CB C 13 62.45 0.20 . 1 . . . . 24 SER CB . 18575 1 279 . 1 1 24 24 SER N N 15 111.98 0.20 . 1 . . . . 24 SER N . 18575 1 280 . 1 1 25 25 TYR H H 1 8.316 0.010 . 1 . . . . 25 TYR H . 18575 1 281 . 1 1 25 25 TYR HA H 1 4.098 0.010 . 1 . . . . 25 TYR HA . 18575 1 282 . 1 1 25 25 TYR HB2 H 1 3.042 0.010 . 2 . . . . 25 TYR HB2 . 18575 1 283 . 1 1 25 25 TYR HB3 H 1 2.865 0.010 . 2 . . . . 25 TYR HB3 . 18575 1 284 . 1 1 25 25 TYR HD1 H 1 7.098 0.010 . 3 . . . . 25 TYR HD1 . 18575 1 285 . 1 1 25 25 TYR HD2 H 1 7.098 0.010 . 3 . . . . 25 TYR HD2 . 18575 1 286 . 1 1 25 25 TYR HE1 H 1 6.319 0.010 . 3 . . . . 25 TYR HE1 . 18575 1 287 . 1 1 25 25 TYR HE2 H 1 6.319 0.010 . 3 . . . . 25 TYR HE2 . 18575 1 288 . 1 1 25 25 TYR HH H 1 9.770 0.010 . 1 . . . . 25 TYR HH . 18575 1 289 . 1 1 25 25 TYR C C 13 178.81 0.20 . 1 . . . . 25 TYR C . 18575 1 290 . 1 1 25 25 TYR CA C 13 61.51 0.20 . 1 . . . . 25 TYR CA . 18575 1 291 . 1 1 25 25 TYR CB C 13 37.60 0.20 . 1 . . . . 25 TYR CB . 18575 1 292 . 1 1 25 25 TYR CE1 C 13 118.43 0.20 . 3 . . . . 25 TYR CE1 . 18575 1 293 . 1 1 25 25 TYR CE2 C 13 118.43 0.20 . 3 . . . . 25 TYR CE2 . 18575 1 294 . 1 1 25 25 TYR N N 15 122.51 0.20 . 1 . . . . 25 TYR N . 18575 1 295 . 1 1 26 26 LEU H H 1 8.802 0.010 . 1 . . . . 26 LEU H . 18575 1 296 . 1 1 26 26 LEU HA H 1 3.375 0.010 . 1 . . . . 26 LEU HA . 18575 1 297 . 1 1 26 26 LEU HB2 H 1 1.581 0.010 . 2 . . . . 26 LEU HB2 . 18575 1 298 . 1 1 26 26 LEU HB3 H 1 0.663 0.010 . 2 . . . . 26 LEU HB3 . 18575 1 299 . 1 1 26 26 LEU HG H 1 1.622 0.010 . 1 . . . . 26 LEU HG . 18575 1 300 . 1 1 26 26 LEU HD11 H 1 0.054 0.010 . 2 . . . . 26 LEU QD1 . 18575 1 301 . 1 1 26 26 LEU HD12 H 1 0.054 0.010 . 2 . . . . 26 LEU QD1 . 18575 1 302 . 1 1 26 26 LEU HD13 H 1 0.054 0.010 . 2 . . . . 26 LEU QD1 . 18575 1 303 . 1 1 26 26 LEU HD21 H 1 -0.553 0.010 . 2 . . . . 26 LEU QD2 . 18575 1 304 . 1 1 26 26 LEU HD22 H 1 -0.553 0.010 . 2 . . . . 26 LEU QD2 . 18575 1 305 . 1 1 26 26 LEU HD23 H 1 -0.553 0.010 . 2 . . . . 26 LEU QD2 . 18575 1 306 . 1 1 26 26 LEU C C 13 180.50 0.20 . 1 . . . . 26 LEU C . 18575 1 307 . 1 1 26 26 LEU CA C 13 58.19 0.20 . 1 . . . . 26 LEU CA . 18575 1 308 . 1 1 26 26 LEU CB C 13 39.05 0.20 . 1 . . . . 26 LEU CB . 18575 1 309 . 1 1 26 26 LEU CG C 13 26.17 0.20 . 1 . . . . 26 LEU CG . 18575 1 310 . 1 1 26 26 LEU CD1 C 13 25.61 0.20 . 2 . . . . 26 LEU CD1 . 18575 1 311 . 1 1 26 26 LEU CD2 C 13 19.00 0.20 . 2 . . . . 26 LEU CD2 . 18575 1 312 . 1 1 26 26 LEU N N 15 122.24 0.20 . 1 . . . . 26 LEU N . 18575 1 313 . 1 1 27 27 VAL H H 1 8.440 0.010 . 1 . . . . 27 VAL H . 18575 1 314 . 1 1 27 27 VAL HA H 1 4.519 0.010 . 1 . . . . 27 VAL HA . 18575 1 315 . 1 1 27 27 VAL HB H 1 2.100 0.010 . 1 . . . . 27 VAL HB . 18575 1 316 . 1 1 27 27 VAL HG11 H 1 0.971 0.010 . 2 . . . . 27 VAL QG1 . 18575 1 317 . 1 1 27 27 VAL HG12 H 1 0.971 0.010 . 2 . . . . 27 VAL QG1 . 18575 1 318 . 1 1 27 27 VAL HG13 H 1 0.971 0.010 . 2 . . . . 27 VAL QG1 . 18575 1 319 . 1 1 27 27 VAL HG21 H 1 0.974 0.010 . 2 . . . . 27 VAL QG2 . 18575 1 320 . 1 1 27 27 VAL HG22 H 1 0.974 0.010 . 2 . . . . 27 VAL QG2 . 18575 1 321 . 1 1 27 27 VAL HG23 H 1 0.974 0.010 . 2 . . . . 27 VAL QG2 . 18575 1 322 . 1 1 27 27 VAL C C 13 180.89 0.20 . 1 . . . . 27 VAL C . 18575 1 323 . 1 1 27 27 VAL CA C 13 65.66 0.20 . 1 . . . . 27 VAL CA . 18575 1 324 . 1 1 27 27 VAL CB C 13 31.33 0.20 . 1 . . . . 27 VAL CB . 18575 1 325 . 1 1 27 27 VAL CG1 C 13 22.63 0.20 . 2 . . . . 27 VAL CG1 . 18575 1 326 . 1 1 27 27 VAL CG2 C 13 20.94 0.20 . 2 . . . . 27 VAL CG2 . 18575 1 327 . 1 1 27 27 VAL N N 15 122.49 0.20 . 1 . . . . 27 VAL N . 18575 1 328 . 1 1 28 28 SER H H 1 7.876 0.010 . 1 . . . . 28 SER H . 18575 1 329 . 1 1 28 28 SER HA H 1 4.361 0.010 . 1 . . . . 28 SER HA . 18575 1 330 . 1 1 28 28 SER HB2 H 1 4.036 0.010 . 1 . . . . 28 SER HB2 . 18575 1 331 . 1 1 28 28 SER HB3 H 1 4.036 0.010 . 1 . . . . 28 SER HB3 . 18575 1 332 . 1 1 28 28 SER C C 13 174.69 0.20 . 1 . . . . 28 SER C . 18575 1 333 . 1 1 28 28 SER CA C 13 60.96 0.20 . 1 . . . . 28 SER CA . 18575 1 334 . 1 1 28 28 SER CB C 13 62.81 0.20 . 1 . . . . 28 SER CB . 18575 1 335 . 1 1 28 28 SER N N 15 118.24 0.20 . 1 . . . . 28 SER N . 18575 1 336 . 1 1 29 29 GLN H H 1 7.353 0.010 . 1 . . . . 29 GLN H . 18575 1 337 . 1 1 29 29 GLN HA H 1 4.355 0.010 . 1 . . . . 29 GLN HA . 18575 1 338 . 1 1 29 29 GLN HB2 H 1 1.880 0.010 . 2 . . . . 29 GLN HB2 . 18575 1 339 . 1 1 29 29 GLN HB3 H 1 2.672 0.010 . 2 . . . . 29 GLN HB3 . 18575 1 340 . 1 1 29 29 GLN HG2 H 1 1.629 0.010 . 1 . . . . 29 GLN HG2 . 18575 1 341 . 1 1 29 29 GLN HG3 H 1 1.629 0.010 . 1 . . . . 29 GLN HG3 . 18575 1 342 . 1 1 29 29 GLN HE21 H 1 6.786 0.010 . 2 . . . . 29 GLN HE21 . 18575 1 343 . 1 1 29 29 GLN HE22 H 1 6.963 0.010 . 2 . . . . 29 GLN HE22 . 18575 1 344 . 1 1 29 29 GLN C C 13 176.18 0.20 . 1 . . . . 29 GLN C . 18575 1 345 . 1 1 29 29 GLN CA C 13 53.71 0.20 . 1 . . . . 29 GLN CA . 18575 1 346 . 1 1 29 29 GLN CB C 13 29.04 0.20 . 1 . . . . 29 GLN CB . 18575 1 347 . 1 1 29 29 GLN CG C 13 32.71 0.20 . 1 . . . . 29 GLN CG . 18575 1 348 . 1 1 29 29 GLN CD C 13 179.32 0.20 . 1 . . . . 29 GLN CD . 18575 1 349 . 1 1 29 29 GLN N N 15 117.74 0.20 . 1 . . . . 29 GLN N . 18575 1 350 . 1 1 29 29 GLN NE2 N 15 115.61 0.20 . 1 . . . . 29 GLN NE2 . 18575 1 351 . 1 1 30 30 GLY H H 1 7.947 0.010 . 1 . . . . 30 GLY H . 18575 1 352 . 1 1 30 30 GLY HA2 H 1 4.414 0.010 . 2 . . . . 30 GLY HA2 . 18575 1 353 . 1 1 30 30 GLY HA3 H 1 3.784 0.010 . 2 . . . . 30 GLY HA3 . 18575 1 354 . 1 1 30 30 GLY C C 13 175.16 0.20 . 1 . . . . 30 GLY C . 18575 1 355 . 1 1 30 30 GLY CA C 13 45.70 0.20 . 1 . . . . 30 GLY CA . 18575 1 356 . 1 1 30 30 GLY N N 15 107.25 0.20 . 1 . . . . 30 GLY N . 18575 1 357 . 1 1 31 31 TRP H H 1 8.509 0.010 . 1 . . . . 31 TRP H . 18575 1 358 . 1 1 31 31 TRP HA H 1 4.314 0.010 . 1 . . . . 31 TRP HA . 18575 1 359 . 1 1 31 31 TRP HB2 H 1 2.657 0.010 . 1 . . . . 31 TRP HB2 . 18575 1 360 . 1 1 31 31 TRP HB3 H 1 2.657 0.010 . 1 . . . . 31 TRP HB3 . 18575 1 361 . 1 1 31 31 TRP HD1 H 1 7.272 0.010 . 1 . . . . 31 TRP HD1 . 18575 1 362 . 1 1 31 31 TRP HE1 H 1 10.418 0.010 . 1 . . . . 31 TRP HE1 . 18575 1 363 . 1 1 31 31 TRP HE3 H 1 7.477 0.010 . 1 . . . . 31 TRP HE3 . 18575 1 364 . 1 1 31 31 TRP HZ2 H 1 6.825 0.010 . 1 . . . . 31 TRP HZ2 . 18575 1 365 . 1 1 31 31 TRP HZ3 H 1 6.586 0.010 . 1 . . . . 31 TRP HZ3 . 18575 1 366 . 1 1 31 31 TRP HH2 H 1 6.922 0.010 . 1 . . . . 31 TRP HH2 . 18575 1 367 . 1 1 31 31 TRP C C 13 176.01 0.20 . 1 . . . . 31 TRP C . 18575 1 368 . 1 1 31 31 TRP CA C 13 59.56 0.20 . 1 . . . . 31 TRP CA . 18575 1 369 . 1 1 31 31 TRP CB C 13 31.39 0.20 . 1 . . . . 31 TRP CB . 18575 1 370 . 1 1 31 31 TRP CD1 C 13 127.40 0.20 . 1 . . . . 31 TRP CD1 . 18575 1 371 . 1 1 31 31 TRP CE3 C 13 122.74 0.20 . 1 . . . . 31 TRP CE3 . 18575 1 372 . 1 1 31 31 TRP CZ2 C 13 114.51 0.20 . 1 . . . . 31 TRP CZ2 . 18575 1 373 . 1 1 31 31 TRP CZ3 C 13 119.57 0.20 . 1 . . . . 31 TRP CZ3 . 18575 1 374 . 1 1 31 31 TRP CH2 C 13 122.79 0.20 . 1 . . . . 31 TRP CH2 . 18575 1 375 . 1 1 31 31 TRP N N 15 125.31 0.20 . 1 . . . . 31 TRP N . 18575 1 376 . 1 1 31 31 TRP NE1 N 15 129.20 0.20 . 1 . . . . 31 TRP NE1 . 18575 1 377 . 1 1 32 32 SER H H 1 9.575 0.010 . 1 . . . . 32 SER H . 18575 1 378 . 1 1 32 32 SER HA H 1 4.454 0.010 . 1 . . . . 32 SER HA . 18575 1 379 . 1 1 32 32 SER HB2 H 1 3.867 0.010 . 2 . . . . 32 SER HB2 . 18575 1 380 . 1 1 32 32 SER HB3 H 1 3.928 0.010 . 2 . . . . 32 SER HB3 . 18575 1 381 . 1 1 32 32 SER C C 13 177.11 0.20 . 1 . . . . 32 SER C . 18575 1 382 . 1 1 32 32 SER CA C 13 57.56 0.20 . 1 . . . . 32 SER CA . 18575 1 383 . 1 1 32 32 SER CB C 13 63.29 0.20 . 1 . . . . 32 SER CB . 18575 1 384 . 1 1 32 32 SER N N 15 117.96 0.20 . 1 . . . . 32 SER N . 18575 1 385 . 1 1 33 33 GLY H H 1 9.201 0.010 . 1 . . . . 33 GLY H . 18575 1 386 . 1 1 33 33 GLY HA2 H 1 3.878 0.010 . 2 . . . . 33 GLY HA2 . 18575 1 387 . 1 1 33 33 GLY HA3 H 1 3.481 0.010 . 2 . . . . 33 GLY HA3 . 18575 1 388 . 1 1 33 33 GLY C C 13 174.86 0.20 . 1 . . . . 33 GLY C . 18575 1 389 . 1 1 33 33 GLY CA C 13 47.46 0.20 . 1 . . . . 33 GLY CA . 18575 1 390 . 1 1 33 33 GLY N N 15 115.75 0.20 . 1 . . . . 33 GLY N . 18575 1 391 . 1 1 34 34 ASP H H 1 8.030 0.010 . 1 . . . . 34 ASP H . 18575 1 392 . 1 1 34 34 ASP HA H 1 4.348 0.010 . 1 . . . . 34 ASP HA . 18575 1 393 . 1 1 34 34 ASP HB2 H 1 2.638 0.010 . 1 . . . . 34 ASP HB2 . 18575 1 394 . 1 1 34 34 ASP HB3 H 1 2.638 0.010 . 1 . . . . 34 ASP HB3 . 18575 1 395 . 1 1 34 34 ASP C C 13 176.26 0.20 . 1 . . . . 34 ASP C . 18575 1 396 . 1 1 34 34 ASP CA C 13 54.22 0.20 . 1 . . . . 34 ASP CA . 18575 1 397 . 1 1 34 34 ASP CB C 13 39.66 0.20 . 1 . . . . 34 ASP CB . 18575 1 398 . 1 1 34 34 ASP N N 15 116.10 0.20 . 1 . . . . 34 ASP N . 18575 1 399 . 1 1 35 35 LYS H H 1 7.597 0.010 . 1 . . . . 35 LYS H . 18575 1 400 . 1 1 35 35 LYS HA H 1 4.636 0.010 . 1 . . . . 35 LYS HA . 18575 1 401 . 1 1 35 35 LYS HB2 H 1 1.871 0.010 . 2 . . . . 35 LYS HB2 . 18575 1 402 . 1 1 35 35 LYS HB3 H 1 2.213 0.010 . 2 . . . . 35 LYS HB3 . 18575 1 403 . 1 1 35 35 LYS HG2 H 1 1.606 0.010 . 2 . . . . 35 LYS HG2 . 18575 1 404 . 1 1 35 35 LYS HG3 H 1 1.426 0.010 . 2 . . . . 35 LYS HG3 . 18575 1 405 . 1 1 35 35 LYS HD2 H 1 1.725 0.010 . 2 . . . . 35 LYS HD2 . 18575 1 406 . 1 1 35 35 LYS HD3 H 1 1.827 0.010 . 2 . . . . 35 LYS HD3 . 18575 1 407 . 1 1 35 35 LYS HE2 H 1 3.034 0.010 . 1 . . . . 35 LYS HE2 . 18575 1 408 . 1 1 35 35 LYS HE3 H 1 3.034 0.010 . 1 . . . . 35 LYS HE3 . 18575 1 409 . 1 1 35 35 LYS C C 13 174.66 0.20 . 1 . . . . 35 LYS C . 18575 1 410 . 1 1 35 35 LYS CA C 13 55.05 0.20 . 1 . . . . 35 LYS CA . 18575 1 411 . 1 1 35 35 LYS CB C 13 33.21 0.20 . 1 . . . . 35 LYS CB . 18575 1 412 . 1 1 35 35 LYS CG C 13 25.13 0.20 . 1 . . . . 35 LYS CG . 18575 1 413 . 1 1 35 35 LYS CD C 13 29.03 0.20 . 1 . . . . 35 LYS CD . 18575 1 414 . 1 1 35 35 LYS CE C 13 42.34 0.20 . 1 . . . . 35 LYS CE . 18575 1 415 . 1 1 35 35 LYS N N 15 117.65 0.20 . 1 . . . . 35 LYS N . 18575 1 416 . 1 1 36 36 LEU H H 1 6.823 0.010 . 1 . . . . 36 LEU H . 18575 1 417 . 1 1 36 36 LEU HA H 1 4.869 0.010 . 1 . . . . 36 LEU HA . 18575 1 418 . 1 1 36 36 LEU HB2 H 1 1.955 0.010 . 2 . . . . 36 LEU HB2 . 18575 1 419 . 1 1 36 36 LEU HB3 H 1 0.885 0.010 . 2 . . . . 36 LEU HB3 . 18575 1 420 . 1 1 36 36 LEU HG H 1 2.031 0.010 . 1 . . . . 36 LEU HG . 18575 1 421 . 1 1 36 36 LEU HD11 H 1 0.759 0.010 . 2 . . . . 36 LEU QD1 . 18575 1 422 . 1 1 36 36 LEU HD12 H 1 0.759 0.010 . 2 . . . . 36 LEU QD1 . 18575 1 423 . 1 1 36 36 LEU HD13 H 1 0.759 0.010 . 2 . . . . 36 LEU QD1 . 18575 1 424 . 1 1 36 36 LEU HD21 H 1 0.806 0.010 . 2 . . . . 36 LEU QD2 . 18575 1 425 . 1 1 36 36 LEU HD22 H 1 0.806 0.010 . 2 . . . . 36 LEU QD2 . 18575 1 426 . 1 1 36 36 LEU HD23 H 1 0.806 0.010 . 2 . . . . 36 LEU QD2 . 18575 1 427 . 1 1 36 36 LEU C C 13 174.68 0.20 . 1 . . . . 36 LEU C . 18575 1 428 . 1 1 36 36 LEU CA C 13 53.53 0.20 . 1 . . . . 36 LEU CA . 18575 1 429 . 1 1 36 36 LEU CB C 13 42.81 0.20 . 1 . . . . 36 LEU CB . 18575 1 430 . 1 1 36 36 LEU CG C 13 25.07 0.20 . 1 . . . . 36 LEU CG . 18575 1 431 . 1 1 36 36 LEU CD1 C 13 24.96 0.20 . 2 . . . . 36 LEU CD1 . 18575 1 432 . 1 1 36 36 LEU CD2 C 13 28.76 0.20 . 2 . . . . 36 LEU CD2 . 18575 1 433 . 1 1 36 36 LEU N N 15 121.10 0.20 . 1 . . . . 36 LEU N . 18575 1 434 . 1 1 37 37 TYR H H 1 9.287 0.010 . 1 . . . . 37 TYR H . 18575 1 435 . 1 1 37 37 TYR HA H 1 4.698 0.010 . 1 . . . . 37 TYR HA . 18575 1 436 . 1 1 37 37 TYR HB2 H 1 3.029 0.010 . 2 . . . . 37 TYR HB2 . 18575 1 437 . 1 1 37 37 TYR HB3 H 1 2.983 0.010 . 2 . . . . 37 TYR HB3 . 18575 1 438 . 1 1 37 37 TYR HD1 H 1 6.973 0.010 . 3 . . . . 37 TYR HD1 . 18575 1 439 . 1 1 37 37 TYR HD2 H 1 6.973 0.010 . 3 . . . . 37 TYR HD2 . 18575 1 440 . 1 1 37 37 TYR HE1 H 1 6.609 0.010 . 3 . . . . 37 TYR HE1 . 18575 1 441 . 1 1 37 37 TYR HE2 H 1 6.609 0.010 . 3 . . . . 37 TYR HE2 . 18575 1 442 . 1 1 37 37 TYR CA C 13 57.08 0.20 . 1 . . . . 37 TYR CA . 18575 1 443 . 1 1 37 37 TYR CB C 13 41.97 0.20 . 1 . . . . 37 TYR CB . 18575 1 444 . 1 1 37 37 TYR CD1 C 13 133.10 0.20 . 3 . . . . 37 TYR CD1 . 18575 1 445 . 1 1 37 37 TYR CD2 C 13 133.10 0.20 . 3 . . . . 37 TYR CD2 . 18575 1 446 . 1 1 37 37 TYR CE1 C 13 118.17 0.20 . 3 . . . . 37 TYR CE1 . 18575 1 447 . 1 1 37 37 TYR CE2 C 13 118.17 0.20 . 3 . . . . 37 TYR CE2 . 18575 1 448 . 1 1 37 37 TYR N N 15 122.46 0.20 . 1 . . . . 37 TYR N . 18575 1 449 . 1 1 38 38 ALA H H 1 8.875 0.010 . 1 . . . . 38 ALA H . 18575 1 450 . 1 1 38 38 ALA HA H 1 4.968 0.010 . 1 . . . . 38 ALA HA . 18575 1 451 . 1 1 38 38 ALA HB1 H 1 1.250 0.010 . 1 . . . . 38 ALA QB . 18575 1 452 . 1 1 38 38 ALA HB2 H 1 1.250 0.010 . 1 . . . . 38 ALA QB . 18575 1 453 . 1 1 38 38 ALA HB3 H 1 1.250 0.010 . 1 . . . . 38 ALA QB . 18575 1 454 . 1 1 38 38 ALA C C 13 174.02 0.20 . 1 . . . . 38 ALA C . 18575 1 455 . 1 1 38 38 ALA CA C 13 50.96 0.20 . 1 . . . . 38 ALA CA . 18575 1 456 . 1 1 38 38 ALA CB C 13 21.68 0.20 . 1 . . . . 38 ALA CB . 18575 1 457 . 1 1 39 39 VAL H H 1 6.728 0.010 . 1 . . . . 39 VAL H . 18575 1 458 . 1 1 39 39 VAL HA H 1 3.130 0.010 . 1 . . . . 39 VAL HA . 18575 1 459 . 1 1 39 39 VAL HB H 1 0.468 0.010 . 1 . . . . 39 VAL HB . 18575 1 460 . 1 1 39 39 VAL HG11 H 1 -0.075 0.010 . 2 . . . . 39 VAL QG1 . 18575 1 461 . 1 1 39 39 VAL HG12 H 1 -0.075 0.010 . 2 . . . . 39 VAL QG1 . 18575 1 462 . 1 1 39 39 VAL HG13 H 1 -0.075 0.010 . 2 . . . . 39 VAL QG1 . 18575 1 463 . 1 1 39 39 VAL HG21 H 1 -0.202 0.010 . 2 . . . . 39 VAL QG2 . 18575 1 464 . 1 1 39 39 VAL HG22 H 1 -0.202 0.010 . 2 . . . . 39 VAL QG2 . 18575 1 465 . 1 1 39 39 VAL HG23 H 1 -0.202 0.010 . 2 . . . . 39 VAL QG2 . 18575 1 466 . 1 1 39 39 VAL C C 13 172.49 0.20 . 1 . . . . 39 VAL C . 18575 1 467 . 1 1 39 39 VAL CA C 13 59.47 0.20 . 1 . . . . 39 VAL CA . 18575 1 468 . 1 1 39 39 VAL CB C 13 32.78 0.20 . 1 . . . . 39 VAL CB . 18575 1 469 . 1 1 39 39 VAL CG1 C 13 21.57 0.20 . 2 . . . . 39 VAL CG1 . 18575 1 470 . 1 1 39 39 VAL CG2 C 13 18.55 0.20 . 2 . . . . 39 VAL CG2 . 18575 1 471 . 1 1 39 39 VAL N N 15 121.13 0.20 . 1 . . . . 39 VAL N . 18575 1 472 . 1 1 40 40 ASP H H 1 7.767 0.010 . 1 . . . . 40 ASP H . 18575 1 473 . 1 1 40 40 ASP HA H 1 5.243 0.010 . 1 . . . . 40 ASP HA . 18575 1 474 . 1 1 40 40 ASP HB2 H 1 2.487 0.010 . 2 . . . . 40 ASP HB2 . 18575 1 475 . 1 1 40 40 ASP HB3 H 1 2.397 0.010 . 2 . . . . 40 ASP HB3 . 18575 1 476 . 1 1 40 40 ASP C C 13 175.15 0.20 . 1 . . . . 40 ASP C . 18575 1 477 . 1 1 40 40 ASP CA C 13 54.20 0.20 . 1 . . . . 40 ASP CA . 18575 1 478 . 1 1 40 40 ASP CB C 13 43.79 0.20 . 1 . . . . 40 ASP CB . 18575 1 479 . 1 1 40 40 ASP N N 15 123.57 0.20 . 1 . . . . 40 ASP N . 18575 1 480 . 1 1 41 41 PHE H H 1 10.555 0.010 . 1 . . . . 41 PHE H . 18575 1 481 . 1 1 41 41 PHE HA H 1 4.580 0.010 . 1 . . . . 41 PHE HA . 18575 1 482 . 1 1 41 41 PHE HB2 H 1 2.709 0.010 . 2 . . . . 41 PHE HB2 . 18575 1 483 . 1 1 41 41 PHE HB3 H 1 2.844 0.010 . 2 . . . . 41 PHE HB3 . 18575 1 484 . 1 1 41 41 PHE HD1 H 1 7.200 0.010 . 3 . . . . 41 PHE HD1 . 18575 1 485 . 1 1 41 41 PHE HD2 H 1 7.200 0.010 . 3 . . . . 41 PHE HD2 . 18575 1 486 . 1 1 41 41 PHE HE1 H 1 6.579 0.010 . 3 . . . . 41 PHE HE1 . 18575 1 487 . 1 1 41 41 PHE HE2 H 1 6.579 0.010 . 3 . . . . 41 PHE HE2 . 18575 1 488 . 1 1 41 41 PHE HZ H 1 7.109 0.010 . 1 . . . . 41 PHE HZ . 18575 1 489 . 1 1 41 41 PHE C C 13 176.00 0.20 . 1 . . . . 41 PHE C . 18575 1 490 . 1 1 41 41 PHE CA C 13 57.08 0.20 . 1 . . . . 41 PHE CA . 18575 1 491 . 1 1 41 41 PHE CB C 13 37.73 0.20 . 1 . . . . 41 PHE CB . 18575 1 492 . 1 1 41 41 PHE CZ C 13 132.24 0.20 . 1 . . . . 41 PHE CZ . 18575 1 493 . 1 1 41 41 PHE N N 15 126.10 0.20 . 1 . . . . 41 PHE N . 18575 1 494 . 1 1 42 42 TRP H H 1 7.697 0.010 . 1 . . . . 42 TRP H . 18575 1 495 . 1 1 42 42 TRP HA H 1 4.725 0.010 . 1 . . . . 42 TRP HA . 18575 1 496 . 1 1 42 42 TRP HB2 H 1 3.554 0.010 . 2 . . . . 42 TRP HB2 . 18575 1 497 . 1 1 42 42 TRP HB3 H 1 3.281 0.010 . 2 . . . . 42 TRP HB3 . 18575 1 498 . 1 1 42 42 TRP HD1 H 1 7.510 0.010 . 1 . . . . 42 TRP HD1 . 18575 1 499 . 1 1 42 42 TRP HE1 H 1 10.292 0.010 . 1 . . . . 42 TRP HE1 . 18575 1 500 . 1 1 42 42 TRP HE3 H 1 7.685 0.010 . 1 . . . . 42 TRP HE3 . 18575 1 501 . 1 1 42 42 TRP HZ2 H 1 7.510 0.010 . 1 . . . . 42 TRP HZ2 . 18575 1 502 . 1 1 42 42 TRP HZ3 H 1 7.233 0.010 . 1 . . . . 42 TRP HZ3 . 18575 1 503 . 1 1 42 42 TRP HH2 H 1 7.141 0.010 . 1 . . . . 42 TRP HH2 . 18575 1 504 . 1 1 42 42 TRP C C 13 177.11 0.20 . 1 . . . . 42 TRP C . 18575 1 505 . 1 1 42 42 TRP CA C 13 56.99 0.20 . 1 . . . . 42 TRP CA . 18575 1 506 . 1 1 42 42 TRP CB C 13 28.71 0.20 . 1 . . . . 42 TRP CB . 18575 1 507 . 1 1 42 42 TRP CD1 C 13 128.03 0.20 . 1 . . . . 42 TRP CD1 . 18575 1 508 . 1 1 42 42 TRP CZ2 C 13 113.94 0.20 . 1 . . . . 42 TRP CZ2 . 18575 1 509 . 1 1 42 42 TRP CH2 C 13 124.81 0.20 . 1 . . . . 42 TRP CH2 . 18575 1 510 . 1 1 42 42 TRP N N 15 120.52 0.20 . 1 . . . . 42 TRP N . 18575 1 511 . 1 1 42 42 TRP NE1 N 15 128.54 0.20 . 1 . . . . 42 TRP NE1 . 18575 1 512 . 1 1 43 43 ASP H H 1 7.238 0.010 . 1 . . . . 43 ASP H . 18575 1 513 . 1 1 43 43 ASP HA H 1 4.512 0.010 . 1 . . . . 43 ASP HA . 18575 1 514 . 1 1 43 43 ASP HB2 H 1 0.960 0.010 . 2 . . . . 43 ASP HB2 . 18575 1 515 . 1 1 43 43 ASP HB3 H 1 2.761 0.010 . 2 . . . . 43 ASP HB3 . 18575 1 516 . 1 1 43 43 ASP C C 13 177.46 0.20 . 1 . . . . 43 ASP C . 18575 1 517 . 1 1 43 43 ASP CA C 13 53.37 0.20 . 1 . . . . 43 ASP CA . 18575 1 518 . 1 1 43 43 ASP CB C 13 38.27 0.20 . 1 . . . . 43 ASP CB . 18575 1 519 . 1 1 43 43 ASP N N 15 121.05 0.20 . 1 . . . . 43 ASP N . 18575 1 520 . 1 1 44 44 LYS H H 1 8.755 0.010 . 1 . . . . 44 LYS H . 18575 1 521 . 1 1 44 44 LYS HA H 1 4.311 0.010 . 1 . . . . 44 LYS HA . 18575 1 522 . 1 1 44 44 LYS HB2 H 1 2.010 0.010 . 1 . . . . 44 LYS HB2 . 18575 1 523 . 1 1 44 44 LYS HB3 H 1 2.010 0.010 . 1 . . . . 44 LYS HB3 . 18575 1 524 . 1 1 44 44 LYS HG2 H 1 1.694 0.010 . 2 . . . . 44 LYS HG2 . 18575 1 525 . 1 1 44 44 LYS HG3 H 1 1.644 0.010 . 2 . . . . 44 LYS HG3 . 18575 1 526 . 1 1 44 44 LYS HD2 H 1 1.723 0.010 . 1 . . . . 44 LYS HD2 . 18575 1 527 . 1 1 44 44 LYS HD3 H 1 1.723 0.010 . 1 . . . . 44 LYS HD3 . 18575 1 528 . 1 1 44 44 LYS HE2 H 1 3.147 0.010 . 1 . . . . 44 LYS HE2 . 18575 1 529 . 1 1 44 44 LYS HE3 H 1 3.147 0.010 . 1 . . . . 44 LYS HE3 . 18575 1 530 . 1 1 44 44 LYS C C 13 177.48 0.20 . 1 . . . . 44 LYS C . 18575 1 531 . 1 1 44 44 LYS CA C 13 57.25 0.20 . 1 . . . . 44 LYS CA . 18575 1 532 . 1 1 44 44 LYS CB C 13 31.68 0.20 . 1 . . . . 44 LYS CB . 18575 1 533 . 1 1 44 44 LYS CG C 13 24.49 0.20 . 1 . . . . 44 LYS CG . 18575 1 534 . 1 1 44 44 LYS CD C 13 28.42 0.20 . 1 . . . . 44 LYS CD . 18575 1 535 . 1 1 44 44 LYS CE C 13 42.48 0.20 . 1 . . . . 44 LYS CE . 18575 1 536 . 1 1 44 44 LYS N N 15 125.82 0.20 . 1 . . . . 44 LYS N . 18575 1 537 . 1 1 45 45 THR H H 1 8.683 0.010 . 1 . . . . 45 THR H . 18575 1 538 . 1 1 45 45 THR HA H 1 4.345 0.010 . 1 . . . . 45 THR HA . 18575 1 539 . 1 1 45 45 THR HB H 1 4.298 0.010 . 1 . . . . 45 THR HB . 18575 1 540 . 1 1 45 45 THR HG21 H 1 1.197 0.010 . 1 . . . . 45 THR QG2 . 18575 1 541 . 1 1 45 45 THR HG22 H 1 1.197 0.010 . 1 . . . . 45 THR QG2 . 18575 1 542 . 1 1 45 45 THR HG23 H 1 1.197 0.010 . 1 . . . . 45 THR QG2 . 18575 1 543 . 1 1 45 45 THR C C 13 176.07 0.20 . 1 . . . . 45 THR C . 18575 1 544 . 1 1 45 45 THR CA C 13 62.46 0.20 . 1 . . . . 45 THR CA . 18575 1 545 . 1 1 45 45 THR CB C 13 69.39 0.20 . 1 . . . . 45 THR CB . 18575 1 546 . 1 1 45 45 THR CG2 C 13 21.42 0.20 . 1 . . . . 45 THR CG2 . 18575 1 547 . 1 1 45 45 THR N N 15 109.74 0.20 . 1 . . . . 45 THR N . 18575 1 548 . 1 1 46 46 GLY H H 1 7.367 0.010 . 1 . . . . 46 GLY H . 18575 1 549 . 1 1 46 46 GLY HA2 H 1 3.568 0.010 . 1 . . . . 46 GLY HA2 . 18575 1 550 . 1 1 46 46 GLY HA3 H 1 3.568 0.010 . 1 . . . . 46 GLY HA3 . 18575 1 551 . 1 1 46 46 GLY C C 13 172.97 0.20 . 1 . . . . 46 GLY C . 18575 1 552 . 1 1 46 46 GLY CA C 13 46.39 0.20 . 1 . . . . 46 GLY CA . 18575 1 553 . 1 1 46 46 GLY N N 15 107.34 0.20 . 1 . . . . 46 GLY N . 18575 1 554 . 1 1 47 47 THR H H 1 6.797 0.010 . 1 . . . . 47 THR H . 18575 1 555 . 1 1 47 47 THR HA H 1 3.583 0.010 . 1 . . . . 47 THR HA . 18575 1 556 . 1 1 47 47 THR HB H 1 3.888 0.010 . 1 . . . . 47 THR HB . 18575 1 557 . 1 1 47 47 THR HG21 H 1 1.075 0.010 . 1 . . . . 47 THR QG2 . 18575 1 558 . 1 1 47 47 THR HG22 H 1 1.075 0.010 . 1 . . . . 47 THR QG2 . 18575 1 559 . 1 1 47 47 THR HG23 H 1 1.075 0.010 . 1 . . . . 47 THR QG2 . 18575 1 560 . 1 1 47 47 THR C C 13 175.59 0.20 . 1 . . . . 47 THR C . 18575 1 561 . 1 1 47 47 THR CA C 13 62.34 0.20 . 1 . . . . 47 THR CA . 18575 1 562 . 1 1 47 47 THR CB C 13 69.10 0.20 . 1 . . . . 47 THR CB . 18575 1 563 . 1 1 47 47 THR CG2 C 13 21.33 0.20 . 1 . . . . 47 THR CG2 . 18575 1 564 . 1 1 47 47 THR N N 15 110.12 0.20 . 1 . . . . 47 THR N . 18575 1 565 . 1 1 48 48 ASN H H 1 8.734 0.010 . 1 . . . . 48 ASN H . 18575 1 566 . 1 1 48 48 ASN HA H 1 3.648 0.010 . 1 . . . . 48 ASN HA . 18575 1 567 . 1 1 48 48 ASN HB2 H 1 0.738 0.010 . 2 . . . . 48 ASN HB2 . 18575 1 568 . 1 1 48 48 ASN HB3 H 1 2.039 0.010 . 2 . . . . 48 ASN HB3 . 18575 1 569 . 1 1 48 48 ASN HD21 H 1 7.293 0.010 . 2 . . . . 48 ASN HD21 . 18575 1 570 . 1 1 48 48 ASN HD22 H 1 6.220 0.010 . 2 . . . . 48 ASN HD22 . 18575 1 571 . 1 1 48 48 ASN CA C 13 55.71 0.20 . 1 . . . . 48 ASN CA . 18575 1 572 . 1 1 48 48 ASN CB C 13 36.06 0.20 . 1 . . . . 48 ASN CB . 18575 1 573 . 1 1 48 48 ASN CG C 13 173.49 0.20 . 1 . . . . 48 ASN CG . 18575 1 574 . 1 1 48 48 ASN N N 15 124.50 0.20 . 1 . . . . 48 ASN N . 18575 1 575 . 1 1 48 48 ASN ND2 N 15 108.72 0.20 . 1 . . . . 48 ASN ND2 . 18575 1 576 . 1 1 49 49 TYR H H 1 7.616 0.010 . 1 . . . . 49 TYR H . 18575 1 577 . 1 1 49 49 TYR HA H 1 3.881 0.010 . 1 . . . . 49 TYR HA . 18575 1 578 . 1 1 49 49 TYR HB2 H 1 2.670 0.010 . 2 . . . . 49 TYR HB2 . 18575 1 579 . 1 1 49 49 TYR HB3 H 1 3.014 0.010 . 2 . . . . 49 TYR HB3 . 18575 1 580 . 1 1 49 49 TYR HD1 H 1 7.000 0.010 . 3 . . . . 49 TYR HD1 . 18575 1 581 . 1 1 49 49 TYR HD2 H 1 7.000 0.010 . 3 . . . . 49 TYR HD2 . 18575 1 582 . 1 1 49 49 TYR HE1 H 1 6.839 0.010 . 3 . . . . 49 TYR HE1 . 18575 1 583 . 1 1 49 49 TYR HE2 H 1 6.839 0.010 . 3 . . . . 49 TYR HE2 . 18575 1 584 . 1 1 49 49 TYR C C 13 176.27 0.20 . 1 . . . . 49 TYR C . 18575 1 585 . 1 1 49 49 TYR CA C 13 60.00 0.20 . 1 . . . . 49 TYR CA . 18575 1 586 . 1 1 49 49 TYR CB C 13 37.63 0.20 . 1 . . . . 49 TYR CB . 18575 1 587 . 1 1 49 49 TYR CD1 C 13 132.63 0.20 . 3 . . . . 49 TYR CD1 . 18575 1 588 . 1 1 49 49 TYR CD2 C 13 132.63 0.20 . 3 . . . . 49 TYR CD2 . 18575 1 589 . 1 1 49 49 TYR CE1 C 13 118.32 0.20 . 3 . . . . 49 TYR CE1 . 18575 1 590 . 1 1 49 49 TYR CE2 C 13 118.32 0.20 . 3 . . . . 49 TYR CE2 . 18575 1 591 . 1 1 49 49 TYR N N 15 115.12 0.20 . 1 . . . . 49 TYR N . 18575 1 592 . 1 1 50 50 ASN H H 1 6.663 0.010 . 1 . . . . 50 ASN H . 18575 1 593 . 1 1 50 50 ASN HA H 1 4.845 0.010 . 1 . . . . 50 ASN HA . 18575 1 594 . 1 1 50 50 ASN HB2 H 1 2.473 0.010 . 2 . . . . 50 ASN HB2 . 18575 1 595 . 1 1 50 50 ASN HB3 H 1 1.999 0.010 . 2 . . . . 50 ASN HB3 . 18575 1 596 . 1 1 50 50 ASN HD21 H 1 7.052 0.010 . 2 . . . . 50 ASN HD21 . 18575 1 597 . 1 1 50 50 ASN HD22 H 1 7.812 0.010 . 2 . . . . 50 ASN HD22 . 18575 1 598 . 1 1 50 50 ASN C C 13 177.27 0.20 . 1 . . . . 50 ASN C . 18575 1 599 . 1 1 50 50 ASN CA C 13 53.29 0.20 . 1 . . . . 50 ASN CA . 18575 1 600 . 1 1 50 50 ASN CB C 13 38.67 0.20 . 1 . . . . 50 ASN CB . 18575 1 601 . 1 1 50 50 ASN CG C 13 174.95 0.20 . 1 . . . . 50 ASN CG . 18575 1 602 . 1 1 50 50 ASN N N 15 111.16 0.20 . 1 . . . . 50 ASN N . 18575 1 603 . 1 1 50 50 ASN ND2 N 15 114.92 0.20 . 1 . . . . 50 ASN ND2 . 18575 1 604 . 1 1 51 51 ASN H H 1 7.986 0.010 . 1 . . . . 51 ASN H . 18575 1 605 . 1 1 51 51 ASN HA H 1 3.987 0.010 . 1 . . . . 51 ASN HA . 18575 1 606 . 1 1 51 51 ASN HB2 H 1 1.814 0.010 . 2 . . . . 51 ASN HB2 . 18575 1 607 . 1 1 51 51 ASN HB3 H 1 0.943 0.010 . 2 . . . . 51 ASN HB3 . 18575 1 608 . 1 1 51 51 ASN HD21 H 1 5.581 0.010 . 2 . . . . 51 ASN HD21 . 18575 1 609 . 1 1 51 51 ASN HD22 H 1 5.869 0.010 . 2 . . . . 51 ASN HD22 . 18575 1 610 . 1 1 51 51 ASN C C 13 177.52 0.20 . 1 . . . . 51 ASN C . 18575 1 611 . 1 1 51 51 ASN CA C 13 54.24 0.20 . 1 . . . . 51 ASN CA . 18575 1 612 . 1 1 51 51 ASN CB C 13 34.69 0.20 . 1 . . . . 51 ASN CB . 18575 1 613 . 1 1 51 51 ASN N N 15 120.26 0.20 . 1 . . . . 51 ASN N . 18575 1 614 . 1 1 51 51 ASN ND2 N 15 106.58 0.20 . 1 . . . . 51 ASN ND2 . 18575 1 615 . 1 1 52 52 GLY H H 1 8.985 0.010 . 1 . . . . 52 GLY H . 18575 1 616 . 1 1 52 52 GLY HA2 H 1 3.963 0.010 . 2 . . . . 52 GLY HA2 . 18575 1 617 . 1 1 52 52 GLY HA3 H 1 3.701 0.010 . 2 . . . . 52 GLY HA3 . 18575 1 618 . 1 1 52 52 GLY CA C 13 48.52 0.20 . 1 . . . . 52 GLY CA . 18575 1 619 . 1 1 52 52 GLY N N 15 108.79 0.20 . 1 . . . . 52 GLY N . 18575 1 620 . 1 1 53 53 PRO HA H 1 4.347 0.010 . 1 . . . . 53 PRO HA . 18575 1 621 . 1 1 53 53 PRO HB2 H 1 2.001 0.010 . 2 . . . . 53 PRO HB2 . 18575 1 622 . 1 1 53 53 PRO HB3 H 1 2.564 0.010 . 2 . . . . 53 PRO HB3 . 18575 1 623 . 1 1 53 53 PRO HG2 H 1 1.981 0.010 . 2 . . . . 53 PRO HG2 . 18575 1 624 . 1 1 53 53 PRO HG3 H 1 2.283 0.010 . 2 . . . . 53 PRO HG3 . 18575 1 625 . 1 1 53 53 PRO HD2 H 1 3.465 0.010 . 2 . . . . 53 PRO HD2 . 18575 1 626 . 1 1 53 53 PRO HD3 H 1 3.548 0.010 . 2 . . . . 53 PRO HD3 . 18575 1 627 . 1 1 53 53 PRO C C 13 178.70 0.20 . 1 . . . . 53 PRO C . 18575 1 628 . 1 1 53 53 PRO CA C 13 65.20 0.20 . 1 . . . . 53 PRO CA . 18575 1 629 . 1 1 53 53 PRO CB C 13 32.01 0.20 . 1 . . . . 53 PRO CB . 18575 1 630 . 1 1 53 53 PRO CG C 13 28.20 0.20 . 1 . . . . 53 PRO CG . 18575 1 631 . 1 1 53 53 PRO CD C 13 52.22 0.20 . 1 . . . . 53 PRO CD . 18575 1 632 . 1 1 54 54 VAL H H 1 6.502 0.010 . 1 . . . . 54 VAL H . 18575 1 633 . 1 1 54 54 VAL HA H 1 3.750 0.010 . 1 . . . . 54 VAL HA . 18575 1 634 . 1 1 54 54 VAL HB H 1 2.293 0.010 . 1 . . . . 54 VAL HB . 18575 1 635 . 1 1 54 54 VAL HG11 H 1 1.444 0.010 . 2 . . . . 54 VAL QG1 . 18575 1 636 . 1 1 54 54 VAL HG12 H 1 1.444 0.010 . 2 . . . . 54 VAL QG1 . 18575 1 637 . 1 1 54 54 VAL HG13 H 1 1.444 0.010 . 2 . . . . 54 VAL QG1 . 18575 1 638 . 1 1 54 54 VAL HG21 H 1 1.110 0.010 . 2 . . . . 54 VAL QG2 . 18575 1 639 . 1 1 54 54 VAL HG22 H 1 1.110 0.010 . 2 . . . . 54 VAL QG2 . 18575 1 640 . 1 1 54 54 VAL HG23 H 1 1.110 0.010 . 2 . . . . 54 VAL QG2 . 18575 1 641 . 1 1 54 54 VAL C C 13 178.73 0.20 . 1 . . . . 54 VAL C . 18575 1 642 . 1 1 54 54 VAL CA C 13 66.18 0.20 . 1 . . . . 54 VAL CA . 18575 1 643 . 1 1 54 54 VAL CB C 13 31.61 0.20 . 1 . . . . 54 VAL CB . 18575 1 644 . 1 1 54 54 VAL CG1 C 13 22.74 0.20 . 2 . . . . 54 VAL CG1 . 18575 1 645 . 1 1 54 54 VAL CG2 C 13 21.43 0.20 . 2 . . . . 54 VAL CG2 . 18575 1 646 . 1 1 54 54 VAL N N 15 116.33 0.20 . 1 . . . . 54 VAL N . 18575 1 647 . 1 1 55 55 LEU H H 1 8.375 0.010 . 1 . . . . 55 LEU H . 18575 1 648 . 1 1 55 55 LEU HA H 1 3.927 0.010 . 1 . . . . 55 LEU HA . 18575 1 649 . 1 1 55 55 LEU HB2 H 1 1.880 0.010 . 2 . . . . 55 LEU HB2 . 18575 1 650 . 1 1 55 55 LEU HB3 H 1 1.360 0.010 . 2 . . . . 55 LEU HB3 . 18575 1 651 . 1 1 55 55 LEU HG H 1 0.905 0.010 . 1 . . . . 55 LEU HG . 18575 1 652 . 1 1 55 55 LEU HD11 H 1 0.774 0.010 . 2 . . . . 55 LEU QD1 . 18575 1 653 . 1 1 55 55 LEU HD12 H 1 0.774 0.010 . 2 . . . . 55 LEU QD1 . 18575 1 654 . 1 1 55 55 LEU HD13 H 1 0.774 0.010 . 2 . . . . 55 LEU QD1 . 18575 1 655 . 1 1 55 55 LEU HD21 H 1 0.681 0.010 . 2 . . . . 55 LEU QD2 . 18575 1 656 . 1 1 55 55 LEU HD22 H 1 0.681 0.010 . 2 . . . . 55 LEU QD2 . 18575 1 657 . 1 1 55 55 LEU HD23 H 1 0.681 0.010 . 2 . . . . 55 LEU QD2 . 18575 1 658 . 1 1 55 55 LEU C C 13 176.69 0.20 . 1 . . . . 55 LEU C . 18575 1 659 . 1 1 55 55 LEU CA C 13 57.50 0.20 . 1 . . . . 55 LEU CA . 18575 1 660 . 1 1 55 55 LEU CB C 13 41.39 0.20 . 1 . . . . 55 LEU CB . 18575 1 661 . 1 1 55 55 LEU CG C 13 26.49 0.20 . 1 . . . . 55 LEU CG . 18575 1 662 . 1 1 55 55 LEU CD1 C 13 26.33 0.20 . 2 . . . . 55 LEU CD1 . 18575 1 663 . 1 1 55 55 LEU CD2 C 13 23.82 0.20 . 2 . . . . 55 LEU CD2 . 18575 1 664 . 1 1 55 55 LEU N N 15 121.82 0.20 . 1 . . . . 55 LEU N . 18575 1 665 . 1 1 56 56 SER H H 1 8.304 0.010 . 1 . . . . 56 SER H . 18575 1 666 . 1 1 56 56 SER HA H 1 4.031 0.010 . 1 . . . . 56 SER HA . 18575 1 667 . 1 1 56 56 SER HB2 H 1 4.143 0.010 . 1 . . . . 56 SER HB2 . 18575 1 668 . 1 1 56 56 SER HB3 H 1 4.143 0.010 . 1 . . . . 56 SER HB3 . 18575 1 669 . 1 1 56 56 SER C C 13 178.81 0.20 . 1 . . . . 56 SER C . 18575 1 670 . 1 1 56 56 SER CA C 13 60.20 0.20 . 1 . . . . 56 SER CA . 18575 1 671 . 1 1 56 56 SER CB C 13 61.56 0.20 . 1 . . . . 56 SER CB . 18575 1 672 . 1 1 56 56 SER N N 15 110.77 0.20 . 1 . . . . 56 SER N . 18575 1 673 . 1 1 57 57 ARG H H 1 8.032 0.010 . 1 . . . . 57 ARG H . 18575 1 674 . 1 1 57 57 ARG HA H 1 4.098 0.010 . 1 . . . . 57 ARG HA . 18575 1 675 . 1 1 57 57 ARG HB2 H 1 1.936 0.010 . 2 . . . . 57 ARG HB2 . 18575 1 676 . 1 1 57 57 ARG HB3 H 1 2.016 0.010 . 2 . . . . 57 ARG HB3 . 18575 1 677 . 1 1 57 57 ARG HG2 H 1 1.744 0.010 . 2 . . . . 57 ARG HG2 . 18575 1 678 . 1 1 57 57 ARG HG3 H 1 1.944 0.010 . 2 . . . . 57 ARG HG3 . 18575 1 679 . 1 1 57 57 ARG HD2 H 1 3.359 0.010 . 2 . . . . 57 ARG HD2 . 18575 1 680 . 1 1 57 57 ARG HD3 H 1 3.243 0.010 . 2 . . . . 57 ARG HD3 . 18575 1 681 . 1 1 57 57 ARG C C 13 178.25 0.20 . 1 . . . . 57 ARG C . 18575 1 682 . 1 1 57 57 ARG CA C 13 58.67 0.20 . 1 . . . . 57 ARG CA . 18575 1 683 . 1 1 57 57 ARG CB C 13 30.09 0.20 . 1 . . . . 57 ARG CB . 18575 1 684 . 1 1 57 57 ARG CG C 13 27.87 0.20 . 1 . . . . 57 ARG CG . 18575 1 685 . 1 1 57 57 ARG CD C 13 43.29 0.20 . 1 . . . . 57 ARG CD . 18575 1 686 . 1 1 57 57 ARG N N 15 118.88 0.20 . 1 . . . . 57 ARG N . 18575 1 687 . 1 1 58 58 PHE H H 1 8.354 0.010 . 1 . . . . 58 PHE H . 18575 1 688 . 1 1 58 58 PHE HA H 1 4.102 0.010 . 1 . . . . 58 PHE HA . 18575 1 689 . 1 1 58 58 PHE HB2 H 1 2.988 0.010 . 2 . . . . 58 PHE HB2 . 18575 1 690 . 1 1 58 58 PHE HB3 H 1 3.200 0.010 . 2 . . . . 58 PHE HB3 . 18575 1 691 . 1 1 58 58 PHE HD1 H 1 6.972 0.010 . 3 . . . . 58 PHE HD1 . 18575 1 692 . 1 1 58 58 PHE HD2 H 1 6.972 0.010 . 3 . . . . 58 PHE HD2 . 18575 1 693 . 1 1 58 58 PHE HE1 H 1 7.154 0.010 . 3 . . . . 58 PHE HE1 . 18575 1 694 . 1 1 58 58 PHE HE2 H 1 7.154 0.010 . 3 . . . . 58 PHE HE2 . 18575 1 695 . 1 1 58 58 PHE HZ H 1 7.242 0.010 . 1 . . . . 58 PHE HZ . 18575 1 696 . 1 1 58 58 PHE C C 13 177.16 0.20 . 1 . . . . 58 PHE C . 18575 1 697 . 1 1 58 58 PHE CA C 13 61.52 0.20 . 1 . . . . 58 PHE CA . 18575 1 698 . 1 1 58 58 PHE CB C 13 40.14 0.20 . 1 . . . . 58 PHE CB . 18575 1 699 . 1 1 58 58 PHE CD1 C 13 131.22 0.20 . 3 . . . . 58 PHE CD1 . 18575 1 700 . 1 1 58 58 PHE CD2 C 13 131.22 0.20 . 3 . . . . 58 PHE CD2 . 18575 1 701 . 1 1 58 58 PHE CE1 C 13 130.58 0.20 . 3 . . . . 58 PHE CE1 . 18575 1 702 . 1 1 58 58 PHE CE2 C 13 130.58 0.20 . 3 . . . . 58 PHE CE2 . 18575 1 703 . 1 1 58 58 PHE N N 15 122.39 0.20 . 1 . . . . 58 PHE N . 18575 1 704 . 1 1 59 59 VAL H H 1 8.816 0.010 . 1 . . . . 59 VAL H . 18575 1 705 . 1 1 59 59 VAL HA H 1 3.139 0.010 . 1 . . . . 59 VAL HA . 18575 1 706 . 1 1 59 59 VAL HB H 1 2.020 0.010 . 1 . . . . 59 VAL HB . 18575 1 707 . 1 1 59 59 VAL HG11 H 1 0.891 0.010 . 2 . . . . 59 VAL QG1 . 18575 1 708 . 1 1 59 59 VAL HG12 H 1 0.891 0.010 . 2 . . . . 59 VAL QG1 . 18575 1 709 . 1 1 59 59 VAL HG13 H 1 0.891 0.010 . 2 . . . . 59 VAL QG1 . 18575 1 710 . 1 1 59 59 VAL HG21 H 1 0.919 0.010 . 2 . . . . 59 VAL QG2 . 18575 1 711 . 1 1 59 59 VAL HG22 H 1 0.919 0.010 . 2 . . . . 59 VAL QG2 . 18575 1 712 . 1 1 59 59 VAL HG23 H 1 0.919 0.010 . 2 . . . . 59 VAL QG2 . 18575 1 713 . 1 1 59 59 VAL C C 13 177.16 0.20 . 1 . . . . 59 VAL C . 18575 1 714 . 1 1 59 59 VAL CA C 13 67.21 0.20 . 1 . . . . 59 VAL CA . 18575 1 715 . 1 1 59 59 VAL CB C 13 31.51 0.20 . 1 . . . . 59 VAL CB . 18575 1 716 . 1 1 59 59 VAL CG1 C 13 23.34 0.20 . 2 . . . . 59 VAL CG1 . 18575 1 717 . 1 1 59 59 VAL CG2 C 13 21.76 0.20 . 2 . . . . 59 VAL CG2 . 18575 1 718 . 1 1 59 59 VAL N N 15 118.47 0.20 . 1 . . . . 59 VAL N . 18575 1 719 . 1 1 60 60 GLN H H 1 7.733 0.010 . 1 . . . . 60 GLN H . 18575 1 720 . 1 1 60 60 GLN HA H 1 3.746 0.010 . 1 . . . . 60 GLN HA . 18575 1 721 . 1 1 60 60 GLN HB2 H 1 2.052 0.010 . 2 . . . . 60 GLN HB2 . 18575 1 722 . 1 1 60 60 GLN HB3 H 1 2.264 0.010 . 2 . . . . 60 GLN HB3 . 18575 1 723 . 1 1 60 60 GLN HG2 H 1 2.320 0.010 . 2 . . . . 60 GLN HG2 . 18575 1 724 . 1 1 60 60 GLN HG3 H 1 2.359 0.010 . 2 . . . . 60 GLN HG3 . 18575 1 725 . 1 1 60 60 GLN HE21 H 1 7.594 0.010 . 2 . . . . 60 GLN HE21 . 18575 1 726 . 1 1 60 60 GLN HE22 H 1 6.848 0.010 . 2 . . . . 60 GLN HE22 . 18575 1 727 . 1 1 60 60 GLN C C 13 177.17 0.20 . 1 . . . . 60 GLN C . 18575 1 728 . 1 1 60 60 GLN CA C 13 58.46 0.20 . 1 . . . . 60 GLN CA . 18575 1 729 . 1 1 60 60 GLN CB C 13 28.21 0.20 . 1 . . . . 60 GLN CB . 18575 1 730 . 1 1 60 60 GLN CG C 13 33.46 0.20 . 1 . . . . 60 GLN CG . 18575 1 731 . 1 1 60 60 GLN CD C 13 179.87 0.20 . 1 . . . . 60 GLN CD . 18575 1 732 . 1 1 60 60 GLN N N 15 117.35 0.20 . 1 . . . . 60 GLN N . 18575 1 733 . 1 1 60 60 GLN NE2 N 15 115.99 0.20 . 1 . . . . 60 GLN NE2 . 18575 1 734 . 1 1 61 61 LYS H H 1 7.559 0.010 . 1 . . . . 61 LYS H . 18575 1 735 . 1 1 61 61 LYS HA H 1 4.017 0.010 . 1 . . . . 61 LYS HA . 18575 1 736 . 1 1 61 61 LYS HB2 H 1 1.751 0.010 . 2 . . . . 61 LYS HB2 . 18575 1 737 . 1 1 61 61 LYS HB3 H 1 1.829 0.010 . 2 . . . . 61 LYS HB3 . 18575 1 738 . 1 1 61 61 LYS HG2 H 1 1.128 0.010 . 2 . . . . 61 LYS HG2 . 18575 1 739 . 1 1 61 61 LYS HG3 H 1 1.415 0.010 . 2 . . . . 61 LYS HG3 . 18575 1 740 . 1 1 61 61 LYS HD2 H 1 1.587 0.010 . 2 . . . . 61 LYS HD2 . 18575 1 741 . 1 1 61 61 LYS HD3 H 1 1.460 0.010 . 2 . . . . 61 LYS HD3 . 18575 1 742 . 1 1 61 61 LYS HE2 H 1 2.818 0.010 . 2 . . . . 61 LYS HE2 . 18575 1 743 . 1 1 61 61 LYS HE3 H 1 2.890 0.010 . 2 . . . . 61 LYS HE3 . 18575 1 744 . 1 1 61 61 LYS C C 13 178.37 0.20 . 1 . . . . 61 LYS C . 18575 1 745 . 1 1 61 61 LYS CA C 13 59.00 0.20 . 1 . . . . 61 LYS CA . 18575 1 746 . 1 1 61 61 LYS CB C 13 31.28 0.20 . 1 . . . . 61 LYS CB . 18575 1 747 . 1 1 61 61 LYS CG C 13 24.04 0.20 . 1 . . . . 61 LYS CG . 18575 1 748 . 1 1 61 61 LYS CD C 13 29.25 0.20 . 1 . . . . 61 LYS CD . 18575 1 749 . 1 1 61 61 LYS CE C 13 41.84 0.20 . 1 . . . . 61 LYS CE . 18575 1 750 . 1 1 61 61 LYS N N 15 119.49 0.20 . 1 . . . . 61 LYS N . 18575 1 751 . 1 1 62 62 VAL H H 1 7.616 0.010 . 1 . . . . 62 VAL H . 18575 1 752 . 1 1 62 62 VAL HA H 1 2.935 0.010 . 1 . . . . 62 VAL HA . 18575 1 753 . 1 1 62 62 VAL HB H 1 1.826 0.010 . 1 . . . . 62 VAL HB . 18575 1 754 . 1 1 62 62 VAL HG11 H 1 0.287 0.010 . 2 . . . . 62 VAL QG1 . 18575 1 755 . 1 1 62 62 VAL HG12 H 1 0.287 0.010 . 2 . . . . 62 VAL QG1 . 18575 1 756 . 1 1 62 62 VAL HG13 H 1 0.287 0.010 . 2 . . . . 62 VAL QG1 . 18575 1 757 . 1 1 62 62 VAL HG21 H 1 -0.360 0.010 . 2 . . . . 62 VAL QG2 . 18575 1 758 . 1 1 62 62 VAL HG22 H 1 -0.360 0.010 . 2 . . . . 62 VAL QG2 . 18575 1 759 . 1 1 62 62 VAL HG23 H 1 -0.360 0.010 . 2 . . . . 62 VAL QG2 . 18575 1 760 . 1 1 62 62 VAL C C 13 180.01 0.20 . 1 . . . . 62 VAL C . 18575 1 761 . 1 1 62 62 VAL CA C 13 66.31 0.20 . 1 . . . . 62 VAL CA . 18575 1 762 . 1 1 62 62 VAL CB C 13 30.54 0.20 . 1 . . . . 62 VAL CB . 18575 1 763 . 1 1 62 62 VAL CG1 C 13 22.01 0.20 . 2 . . . . 62 VAL CG1 . 18575 1 764 . 1 1 62 62 VAL CG2 C 13 21.27 0.20 . 2 . . . . 62 VAL CG2 . 18575 1 765 . 1 1 62 62 VAL N N 15 120.23 0.20 . 1 . . . . 62 VAL N . 18575 1 766 . 1 1 63 63 LEU H H 1 8.698 0.010 . 1 . . . . 63 LEU H . 18575 1 767 . 1 1 63 63 LEU HA H 1 3.679 0.010 . 1 . . . . 63 LEU HA . 18575 1 768 . 1 1 63 63 LEU HB2 H 1 1.861 0.010 . 2 . . . . 63 LEU HB2 . 18575 1 769 . 1 1 63 63 LEU HB3 H 1 1.399 0.010 . 2 . . . . 63 LEU HB3 . 18575 1 770 . 1 1 63 63 LEU HG H 1 1.737 0.010 . 1 . . . . 63 LEU HG . 18575 1 771 . 1 1 63 63 LEU HD11 H 1 0.727 0.010 . 2 . . . . 63 LEU QD1 . 18575 1 772 . 1 1 63 63 LEU HD12 H 1 0.727 0.010 . 2 . . . . 63 LEU QD1 . 18575 1 773 . 1 1 63 63 LEU HD13 H 1 0.727 0.010 . 2 . . . . 63 LEU QD1 . 18575 1 774 . 1 1 63 63 LEU HD21 H 1 0.390 0.010 . 2 . . . . 63 LEU QD2 . 18575 1 775 . 1 1 63 63 LEU HD22 H 1 0.390 0.010 . 2 . . . . 63 LEU QD2 . 18575 1 776 . 1 1 63 63 LEU HD23 H 1 0.390 0.010 . 2 . . . . 63 LEU QD2 . 18575 1 777 . 1 1 63 63 LEU C C 13 179.63 0.20 . 1 . . . . 63 LEU C . 18575 1 778 . 1 1 63 63 LEU CA C 13 58.40 0.20 . 1 . . . . 63 LEU CA . 18575 1 779 . 1 1 63 63 LEU CB C 13 39.81 0.20 . 1 . . . . 63 LEU CB . 18575 1 780 . 1 1 63 63 LEU CG C 13 25.67 0.20 . 1 . . . . 63 LEU CG . 18575 1 781 . 1 1 63 63 LEU CD1 C 13 25.65 0.20 . 2 . . . . 63 LEU CD1 . 18575 1 782 . 1 1 63 63 LEU CD2 C 13 22.33 0.20 . 2 . . . . 63 LEU CD2 . 18575 1 783 . 1 1 63 63 LEU N N 15 123.14 0.20 . 1 . . . . 63 LEU N . 18575 1 784 . 1 1 64 64 ASP H H 1 8.573 0.010 . 1 . . . . 64 ASP H . 18575 1 785 . 1 1 64 64 ASP HA H 1 4.274 0.010 . 1 . . . . 64 ASP HA . 18575 1 786 . 1 1 64 64 ASP HB2 H 1 2.619 0.010 . 2 . . . . 64 ASP HB2 . 18575 1 787 . 1 1 64 64 ASP HB3 H 1 2.833 0.010 . 2 . . . . 64 ASP HB3 . 18575 1 788 . 1 1 64 64 ASP C C 13 178.92 0.20 . 1 . . . . 64 ASP C . 18575 1 789 . 1 1 64 64 ASP CA C 13 57.01 0.20 . 1 . . . . 64 ASP CA . 18575 1 790 . 1 1 64 64 ASP CB C 13 40.04 0.20 . 1 . . . . 64 ASP CB . 18575 1 791 . 1 1 64 64 ASP N N 15 120.67 0.20 . 1 . . . . 64 ASP N . 18575 1 792 . 1 1 65 65 GLU H H 1 8.329 0.010 . 1 . . . . 65 GLU H . 18575 1 793 . 1 1 65 65 GLU HA H 1 4.111 0.010 . 1 . . . . 65 GLU HA . 18575 1 794 . 1 1 65 65 GLU HB2 H 1 2.071 0.010 . 2 . . . . 65 GLU HB2 . 18575 1 795 . 1 1 65 65 GLU HB3 H 1 2.028 0.010 . 2 . . . . 65 GLU HB3 . 18575 1 796 . 1 1 65 65 GLU HG2 H 1 2.451 0.010 . 2 . . . . 65 GLU HG2 . 18575 1 797 . 1 1 65 65 GLU HG3 H 1 2.262 0.010 . 2 . . . . 65 GLU HG3 . 18575 1 798 . 1 1 65 65 GLU C C 13 178.57 0.20 . 1 . . . . 65 GLU C . 18575 1 799 . 1 1 65 65 GLU CA C 13 58.69 0.20 . 1 . . . . 65 GLU CA . 18575 1 800 . 1 1 65 65 GLU CB C 13 30.10 0.20 . 1 . . . . 65 GLU CB . 18575 1 801 . 1 1 65 65 GLU CG C 13 36.35 0.20 . 1 . . . . 65 GLU CG . 18575 1 802 . 1 1 65 65 GLU N N 15 117.80 0.20 . 1 . . . . 65 GLU N . 18575 1 803 . 1 1 66 66 THR H H 1 7.987 0.010 . 1 . . . . 66 THR H . 18575 1 804 . 1 1 66 66 THR HA H 1 4.385 0.010 . 1 . . . . 66 THR HA . 18575 1 805 . 1 1 66 66 THR HB H 1 4.244 0.010 . 1 . . . . 66 THR HB . 18575 1 806 . 1 1 66 66 THR HG21 H 1 1.519 0.010 . 1 . . . . 66 THR QG2 . 18575 1 807 . 1 1 66 66 THR HG22 H 1 1.519 0.010 . 1 . . . . 66 THR QG2 . 18575 1 808 . 1 1 66 66 THR HG23 H 1 1.519 0.010 . 1 . . . . 66 THR QG2 . 18575 1 809 . 1 1 66 66 THR C C 13 177.16 0.20 . 1 . . . . 66 THR C . 18575 1 810 . 1 1 66 66 THR CA C 13 62.70 0.20 . 1 . . . . 66 THR CA . 18575 1 811 . 1 1 66 66 THR CB C 13 71.67 0.20 . 1 . . . . 66 THR CB . 18575 1 812 . 1 1 66 66 THR CG2 C 13 22.59 0.20 . 1 . . . . 66 THR CG2 . 18575 1 813 . 1 1 66 66 THR N N 15 106.07 0.20 . 1 . . . . 66 THR N . 18575 1 814 . 1 1 67 67 GLY H H 1 8.215 0.010 . 1 . . . . 67 GLY H . 18575 1 815 . 1 1 67 67 GLY HA2 H 1 4.115 0.010 . 2 . . . . 67 GLY HA2 . 18575 1 816 . 1 1 67 67 GLY HA3 H 1 3.868 0.010 . 2 . . . . 67 GLY HA3 . 18575 1 817 . 1 1 67 67 GLY C C 13 173.82 0.20 . 1 . . . . 67 GLY C . 18575 1 818 . 1 1 67 67 GLY CA C 13 45.51 0.20 . 1 . . . . 67 GLY CA . 18575 1 819 . 1 1 67 67 GLY N N 15 112.18 0.20 . 1 . . . . 67 GLY N . 18575 1 820 . 1 1 68 68 ALA H H 1 7.642 0.010 . 1 . . . . 68 ALA H . 18575 1 821 . 1 1 68 68 ALA HA H 1 4.316 0.010 . 1 . . . . 68 ALA HA . 18575 1 822 . 1 1 68 68 ALA HB1 H 1 1.389 0.010 . 1 . . . . 68 ALA QB . 18575 1 823 . 1 1 68 68 ALA HB2 H 1 1.389 0.010 . 1 . . . . 68 ALA QB . 18575 1 824 . 1 1 68 68 ALA HB3 H 1 1.389 0.010 . 1 . . . . 68 ALA QB . 18575 1 825 . 1 1 68 68 ALA C C 13 175.64 0.20 . 1 . . . . 68 ALA C . 18575 1 826 . 1 1 68 68 ALA CA C 13 51.49 0.20 . 1 . . . . 68 ALA CA . 18575 1 827 . 1 1 68 68 ALA CB C 13 19.94 0.20 . 1 . . . . 68 ALA CB . 18575 1 828 . 1 1 68 68 ALA N N 15 122.56 0.20 . 1 . . . . 68 ALA N . 18575 1 829 . 1 1 69 69 LYS H H 1 8.161 0.010 . 1 . . . . 69 LYS H . 18575 1 830 . 1 1 69 69 LYS HA H 1 4.263 0.010 . 1 . . . . 69 LYS HA . 18575 1 831 . 1 1 69 69 LYS HB2 H 1 1.708 0.010 . 2 . . . . 69 LYS HB2 . 18575 1 832 . 1 1 69 69 LYS HB3 H 1 1.835 0.010 . 2 . . . . 69 LYS HB3 . 18575 1 833 . 1 1 69 69 LYS HG2 H 1 1.517 0.010 . 2 . . . . 69 LYS HG2 . 18575 1 834 . 1 1 69 69 LYS HG3 H 1 1.433 0.010 . 2 . . . . 69 LYS HG3 . 18575 1 835 . 1 1 69 69 LYS HD2 H 1 1.629 0.010 . 2 . . . . 69 LYS HD2 . 18575 1 836 . 1 1 69 69 LYS HD3 H 1 1.517 0.010 . 2 . . . . 69 LYS HD3 . 18575 1 837 . 1 1 69 69 LYS HE2 H 1 2.974 0.010 . 1 . . . . 69 LYS HE2 . 18575 1 838 . 1 1 69 69 LYS HE3 H 1 2.974 0.010 . 1 . . . . 69 LYS HE3 . 18575 1 839 . 1 1 69 69 LYS C C 13 176.58 0.20 . 1 . . . . 69 LYS C . 18575 1 840 . 1 1 69 69 LYS CA C 13 56.46 0.20 . 1 . . . . 69 LYS CA . 18575 1 841 . 1 1 69 69 LYS CB C 13 33.44 0.20 . 1 . . . . 69 LYS CB . 18575 1 842 . 1 1 69 69 LYS CG C 13 24.95 0.20 . 1 . . . . 69 LYS CG . 18575 1 843 . 1 1 69 69 LYS CD C 13 28.19 0.20 . 1 . . . . 69 LYS CD . 18575 1 844 . 1 1 69 69 LYS CE C 13 41.90 0.20 . 1 . . . . 69 LYS CE . 18575 1 845 . 1 1 69 69 LYS N N 15 116.20 0.20 . 1 . . . . 69 LYS N . 18575 1 846 . 1 1 70 70 LYS H H 1 7.455 0.010 . 1 . . . . 70 LYS H . 18575 1 847 . 1 1 70 70 LYS HA H 1 4.574 0.010 . 1 . . . . 70 LYS HA . 18575 1 848 . 1 1 70 70 LYS HB2 H 1 1.391 0.010 . 1 . . . . 70 LYS HB2 . 18575 1 849 . 1 1 70 70 LYS HB3 H 1 1.391 0.010 . 1 . . . . 70 LYS HB3 . 18575 1 850 . 1 1 70 70 LYS HG2 H 1 1.150 0.010 . 1 . . . . 70 LYS HG2 . 18575 1 851 . 1 1 70 70 LYS HG3 H 1 1.150 0.010 . 1 . . . . 70 LYS HG3 . 18575 1 852 . 1 1 70 70 LYS HD2 H 1 1.690 0.010 . 2 . . . . 70 LYS HD2 . 18575 1 853 . 1 1 70 70 LYS HD3 H 1 1.778 0.010 . 2 . . . . 70 LYS HD3 . 18575 1 854 . 1 1 70 70 LYS HE2 H 1 2.715 0.010 . 1 . . . . 70 LYS HE2 . 18575 1 855 . 1 1 70 70 LYS HE3 H 1 2.715 0.010 . 1 . . . . 70 LYS HE3 . 18575 1 856 . 1 1 70 70 LYS C C 13 174.64 0.20 . 1 . . . . 70 LYS C . 18575 1 857 . 1 1 70 70 LYS CA C 13 53.96 0.20 . 1 . . . . 70 LYS CA . 18575 1 858 . 1 1 70 70 LYS CB C 13 39.39 0.20 . 1 . . . . 70 LYS CB . 18575 1 859 . 1 1 70 70 LYS CG C 13 25.95 0.20 . 1 . . . . 70 LYS CG . 18575 1 860 . 1 1 70 70 LYS CD C 13 32.73 0.20 . 1 . . . . 70 LYS CD . 18575 1 861 . 1 1 70 70 LYS CE C 13 41.90 0.20 . 1 . . . . 70 LYS CE . 18575 1 862 . 1 1 70 70 LYS N N 15 114.50 0.20 . 1 . . . . 70 LYS N . 18575 1 863 . 1 1 71 71 VAL H H 1 8.310 0.010 . 1 . . . . 71 VAL H . 18575 1 864 . 1 1 71 71 VAL HA H 1 4.875 0.010 . 1 . . . . 71 VAL HA . 18575 1 865 . 1 1 71 71 VAL HB H 1 2.265 0.010 . 1 . . . . 71 VAL HB . 18575 1 866 . 1 1 71 71 VAL HG11 H 1 0.833 0.010 . 2 . . . . 71 VAL QG1 . 18575 1 867 . 1 1 71 71 VAL HG12 H 1 0.833 0.010 . 2 . . . . 71 VAL QG1 . 18575 1 868 . 1 1 71 71 VAL HG13 H 1 0.833 0.010 . 2 . . . . 71 VAL QG1 . 18575 1 869 . 1 1 71 71 VAL HG21 H 1 0.750 0.010 . 2 . . . . 71 VAL QG2 . 18575 1 870 . 1 1 71 71 VAL HG22 H 1 0.750 0.010 . 2 . . . . 71 VAL QG2 . 18575 1 871 . 1 1 71 71 VAL HG23 H 1 0.750 0.010 . 2 . . . . 71 VAL QG2 . 18575 1 872 . 1 1 71 71 VAL C C 13 174.61 0.20 . 1 . . . . 71 VAL C . 18575 1 873 . 1 1 71 71 VAL CA C 13 58.26 0.20 . 1 . . . . 71 VAL CA . 18575 1 874 . 1 1 71 71 VAL CB C 13 34.13 0.20 . 1 . . . . 71 VAL CB . 18575 1 875 . 1 1 71 71 VAL CG1 C 13 19.11 0.20 . 2 . . . . 71 VAL CG1 . 18575 1 876 . 1 1 71 71 VAL CG2 C 13 22.38 0.20 . 2 . . . . 71 VAL CG2 . 18575 1 877 . 1 1 71 71 VAL N N 15 107.17 0.20 . 1 . . . . 71 VAL N . 18575 1 878 . 1 1 72 72 ASP H H 1 8.826 0.010 . 1 . . . . 72 ASP H . 18575 1 879 . 1 1 72 72 ASP HA H 1 5.707 0.010 . 1 . . . . 72 ASP HA . 18575 1 880 . 1 1 72 72 ASP HB2 H 1 2.720 0.010 . 2 . . . . 72 ASP HB2 . 18575 1 881 . 1 1 72 72 ASP HB3 H 1 2.497 0.010 . 2 . . . . 72 ASP HB3 . 18575 1 882 . 1 1 72 72 ASP C C 13 175.84 0.20 . 1 . . . . 72 ASP C . 18575 1 883 . 1 1 72 72 ASP CA C 13 52.72 0.20 . 1 . . . . 72 ASP CA . 18575 1 884 . 1 1 72 72 ASP CB C 13 43.86 0.20 . 1 . . . . 72 ASP CB . 18575 1 885 . 1 1 72 72 ASP N N 15 120.16 0.20 . 1 . . . . 72 ASP N . 18575 1 886 . 1 1 73 73 ILE H H 1 8.866 0.010 . 1 . . . . 73 ILE H . 18575 1 887 . 1 1 73 73 ILE HA H 1 5.443 0.010 . 1 . . . . 73 ILE HA . 18575 1 888 . 1 1 73 73 ILE HB H 1 1.552 0.010 . 1 . . . . 73 ILE HB . 18575 1 889 . 1 1 73 73 ILE HG12 H 1 1.147 0.010 . 2 . . . . 73 ILE HG12 . 18575 1 890 . 1 1 73 73 ILE HG13 H 1 1.557 0.010 . 2 . . . . 73 ILE HG13 . 18575 1 891 . 1 1 73 73 ILE HG21 H 1 0.937 0.010 . 1 . . . . 73 ILE QG2 . 18575 1 892 . 1 1 73 73 ILE HG22 H 1 0.937 0.010 . 1 . . . . 73 ILE QG2 . 18575 1 893 . 1 1 73 73 ILE HG23 H 1 0.937 0.010 . 1 . . . . 73 ILE QG2 . 18575 1 894 . 1 1 73 73 ILE HD11 H 1 0.848 0.010 . 1 . . . . 73 ILE QD1 . 18575 1 895 . 1 1 73 73 ILE HD12 H 1 0.848 0.010 . 1 . . . . 73 ILE QD1 . 18575 1 896 . 1 1 73 73 ILE HD13 H 1 0.848 0.010 . 1 . . . . 73 ILE QD1 . 18575 1 897 . 1 1 73 73 ILE C C 13 175.28 0.20 . 1 . . . . 73 ILE C . 18575 1 898 . 1 1 73 73 ILE CA C 13 58.72 0.20 . 1 . . . . 73 ILE CA . 18575 1 899 . 1 1 73 73 ILE CB C 13 42.18 0.20 . 1 . . . . 73 ILE CB . 18575 1 900 . 1 1 73 73 ILE CG1 C 13 27.91 0.20 . 1 . . . . 73 ILE CG1 . 18575 1 901 . 1 1 73 73 ILE CG2 C 13 17.35 0.20 . 1 . . . . 73 ILE CG2 . 18575 1 902 . 1 1 73 73 ILE CD1 C 13 12.97 0.20 . 1 . . . . 73 ILE CD1 . 18575 1 903 . 1 1 73 73 ILE N N 15 119.29 0.20 . 1 . . . . 73 ILE N . 18575 1 904 . 1 1 74 74 VAL H H 1 8.073 0.010 . 1 . . . . 74 VAL H . 18575 1 905 . 1 1 74 74 VAL HA H 1 5.111 0.010 . 1 . . . . 74 VAL HA . 18575 1 906 . 1 1 74 74 VAL HB H 1 1.620 0.010 . 1 . . . . 74 VAL HB . 18575 1 907 . 1 1 74 74 VAL HG11 H 1 0.826 0.010 . 2 . . . . 74 VAL QG1 . 18575 1 908 . 1 1 74 74 VAL HG12 H 1 0.826 0.010 . 2 . . . . 74 VAL QG1 . 18575 1 909 . 1 1 74 74 VAL HG13 H 1 0.826 0.010 . 2 . . . . 74 VAL QG1 . 18575 1 910 . 1 1 74 74 VAL HG21 H 1 0.723 0.010 . 2 . . . . 74 VAL QG2 . 18575 1 911 . 1 1 74 74 VAL HG22 H 1 0.723 0.010 . 2 . . . . 74 VAL QG2 . 18575 1 912 . 1 1 74 74 VAL HG23 H 1 0.723 0.010 . 2 . . . . 74 VAL QG2 . 18575 1 913 . 1 1 74 74 VAL C C 13 173.96 0.20 . 1 . . . . 74 VAL C . 18575 1 914 . 1 1 74 74 VAL CA C 13 60.12 0.20 . 1 . . . . 74 VAL CA . 18575 1 915 . 1 1 74 74 VAL CB C 13 33.92 0.20 . 1 . . . . 74 VAL CB . 18575 1 916 . 1 1 74 74 VAL CG1 C 13 21.03 0.20 . 2 . . . . 74 VAL CG1 . 18575 1 917 . 1 1 74 74 VAL CG2 C 13 21.55 0.20 . 2 . . . . 74 VAL CG2 . 18575 1 918 . 1 1 74 74 VAL N N 15 125.39 0.20 . 1 . . . . 74 VAL N . 18575 1 919 . 1 1 75 75 ALA H H 1 9.210 0.010 . 1 . . . . 75 ALA H . 18575 1 920 . 1 1 75 75 ALA HA H 1 5.478 0.010 . 1 . . . . 75 ALA HA . 18575 1 921 . 1 1 75 75 ALA HB1 H 1 1.038 0.010 . 1 . . . . 75 ALA QB . 18575 1 922 . 1 1 75 75 ALA HB2 H 1 1.038 0.010 . 1 . . . . 75 ALA QB . 18575 1 923 . 1 1 75 75 ALA HB3 H 1 1.038 0.010 . 1 . . . . 75 ALA QB . 18575 1 924 . 1 1 75 75 ALA C C 13 174.77 0.20 . 1 . . . . 75 ALA C . 18575 1 925 . 1 1 75 75 ALA CA C 13 49.21 0.20 . 1 . . . . 75 ALA CA . 18575 1 926 . 1 1 75 75 ALA CB C 13 22.29 0.20 . 1 . . . . 75 ALA CB . 18575 1 927 . 1 1 75 75 ALA N N 15 127.84 0.20 . 1 . . . . 75 ALA N . 18575 1 928 . 1 1 76 76 HIS H H 1 8.812 0.010 . 1 . . . . 76 HIS H . 18575 1 929 . 1 1 76 76 HIS HA H 1 5.664 0.010 . 1 . . . . 76 HIS HA . 18575 1 930 . 1 1 76 76 HIS HB2 H 1 2.858 0.010 . 2 . . . . 76 HIS HB2 . 18575 1 931 . 1 1 76 76 HIS HB3 H 1 3.118 0.010 . 2 . . . . 76 HIS HB3 . 18575 1 932 . 1 1 76 76 HIS HD2 H 1 6.674 0.010 . 1 . . . . 76 HIS HD2 . 18575 1 933 . 1 1 76 76 HIS HE1 H 1 7.539 0.010 . 1 . . . . 76 HIS HE1 . 18575 1 934 . 1 1 76 76 HIS HE2 H 1 9.782 0.010 . 1 . . . . 76 HIS HE2 . 18575 1 935 . 1 1 76 76 HIS C C 13 175.85 0.20 . 1 . . . . 76 HIS C . 18575 1 936 . 1 1 76 76 HIS CA C 13 53.22 0.20 . 1 . . . . 76 HIS CA . 18575 1 937 . 1 1 76 76 HIS CB C 13 36.71 0.20 . 1 . . . . 76 HIS CB . 18575 1 938 . 1 1 76 76 HIS CD2 C 13 116.35 0.20 . 1 . . . . 76 HIS CD2 . 18575 1 939 . 1 1 76 76 HIS N N 15 122.22 0.20 . 1 . . . . 76 HIS N . 18575 1 940 . 1 1 77 77 SER H H 1 7.976 0.010 . 1 . . . . 77 SER H . 18575 1 941 . 1 1 77 77 SER HA H 1 4.661 0.010 . 1 . . . . 77 SER HA . 18575 1 942 . 1 1 77 77 SER HB2 H 1 3.232 0.010 . 2 . . . . 77 SER HB2 . 18575 1 943 . 1 1 77 77 SER HB3 H 1 3.729 0.010 . 2 . . . . 77 SER HB3 . 18575 1 944 . 1 1 77 77 SER CA C 13 59.10 0.20 . 1 . . . . 77 SER CA . 18575 1 945 . 1 1 77 77 SER CB C 13 61.20 0.20 . 1 . . . . 77 SER CB . 18575 1 946 . 1 1 77 77 SER N N 15 122.89 0.20 . 1 . . . . 77 SER N . 18575 1 947 . 1 1 78 78 MET H H 1 7.104 0.010 . 1 . . . . 78 MET H . 18575 1 948 . 1 1 78 78 MET HA H 1 4.548 0.010 . 1 . . . . 78 MET HA . 18575 1 949 . 1 1 78 78 MET HB2 H 1 2.123 0.010 . 2 . . . . 78 MET HB2 . 18575 1 950 . 1 1 78 78 MET HB3 H 1 2.411 0.010 . 2 . . . . 78 MET HB3 . 18575 1 951 . 1 1 78 78 MET HG2 H 1 2.763 0.010 . 1 . . . . 78 MET HG2 . 18575 1 952 . 1 1 78 78 MET HG3 H 1 2.763 0.010 . 1 . . . . 78 MET HG3 . 18575 1 953 . 1 1 78 78 MET HE1 H 1 1.906 0.010 . 1 . . . . 78 MET HE . 18575 1 954 . 1 1 78 78 MET HE2 H 1 1.906 0.010 . 1 . . . . 78 MET HE . 18575 1 955 . 1 1 78 78 MET HE3 H 1 1.906 0.010 . 1 . . . . 78 MET HE . 18575 1 956 . 1 1 78 78 MET C C 13 175.80 0.20 . 1 . . . . 78 MET C . 18575 1 957 . 1 1 78 78 MET CA C 13 56.90 0.20 . 1 . . . . 78 MET CA . 18575 1 958 . 1 1 78 78 MET CB C 13 31.80 0.20 . 1 . . . . 78 MET CB . 18575 1 959 . 1 1 78 78 MET CG C 13 32.31 0.20 . 1 . . . . 78 MET CG . 18575 1 960 . 1 1 78 78 MET CE C 13 16.85 0.20 . 1 . . . . 78 MET CE . 18575 1 961 . 1 1 79 79 GLY H H 1 9.070 0.010 . 1 . . . . 79 GLY H . 18575 1 962 . 1 1 79 79 GLY HA2 H 1 3.624 0.010 . 2 . . . . 79 GLY HA2 . 18575 1 963 . 1 1 79 79 GLY HA3 H 1 3.828 0.010 . 2 . . . . 79 GLY HA3 . 18575 1 964 . 1 1 79 79 GLY C C 13 178.78 0.20 . 1 . . . . 79 GLY C . 18575 1 965 . 1 1 79 79 GLY CA C 13 47.84 0.20 . 1 . . . . 79 GLY CA . 18575 1 966 . 1 1 79 79 GLY N N 15 108.10 0.20 . 1 . . . . 79 GLY N . 18575 1 967 . 1 1 80 80 GLY H H 1 8.418 0.010 . 1 . . . . 80 GLY H . 18575 1 968 . 1 1 80 80 GLY HA2 H 1 3.479 0.010 . 2 . . . . 80 GLY HA2 . 18575 1 969 . 1 1 80 80 GLY HA3 H 1 4.172 0.010 . 2 . . . . 80 GLY HA3 . 18575 1 970 . 1 1 80 80 GLY C C 13 174.14 0.20 . 1 . . . . 80 GLY C . 18575 1 971 . 1 1 80 80 GLY CA C 13 47.33 0.20 . 1 . . . . 80 GLY CA . 18575 1 972 . 1 1 80 80 GLY N N 15 110.87 0.20 . 1 . . . . 80 GLY N . 18575 1 973 . 1 1 81 81 ALA H H 1 6.347 0.010 . 1 . . . . 81 ALA H . 18575 1 974 . 1 1 81 81 ALA HA H 1 4.122 0.010 . 1 . . . . 81 ALA HA . 18575 1 975 . 1 1 81 81 ALA HB1 H 1 1.819 0.010 . 1 . . . . 81 ALA QB . 18575 1 976 . 1 1 81 81 ALA HB2 H 1 1.819 0.010 . 1 . . . . 81 ALA QB . 18575 1 977 . 1 1 81 81 ALA HB3 H 1 1.819 0.010 . 1 . . . . 81 ALA QB . 18575 1 978 . 1 1 81 81 ALA C C 13 182.12 0.20 . 1 . . . . 81 ALA C . 18575 1 979 . 1 1 81 81 ALA CA C 13 56.30 0.20 . 1 . . . . 81 ALA CA . 18575 1 980 . 1 1 81 81 ALA CB C 13 17.27 0.20 . 1 . . . . 81 ALA CB . 18575 1 981 . 1 1 81 81 ALA N N 15 123.44 0.20 . 1 . . . . 81 ALA N . 18575 1 982 . 1 1 82 82 ASN H H 1 8.334 0.010 . 1 . . . . 82 ASN H . 18575 1 983 . 1 1 82 82 ASN HA H 1 4.482 0.010 . 1 . . . . 82 ASN HA . 18575 1 984 . 1 1 82 82 ASN HB2 H 1 3.851 0.010 . 2 . . . . 82 ASN HB2 . 18575 1 985 . 1 1 82 82 ASN HB3 H 1 2.560 0.010 . 2 . . . . 82 ASN HB3 . 18575 1 986 . 1 1 82 82 ASN HD21 H 1 7.462 0.010 . 2 . . . . 82 ASN HD21 . 18575 1 987 . 1 1 82 82 ASN HD22 H 1 6.755 0.010 . 2 . . . . 82 ASN HD22 . 18575 1 988 . 1 1 82 82 ASN C C 13 176.56 0.20 . 1 . . . . 82 ASN C . 18575 1 989 . 1 1 82 82 ASN CA C 13 56.13 0.20 . 1 . . . . 82 ASN CA . 18575 1 990 . 1 1 82 82 ASN CB C 13 38.86 0.20 . 1 . . . . 82 ASN CB . 18575 1 991 . 1 1 82 82 ASN CG C 13 178.29 0.20 . 1 . . . . 82 ASN CG . 18575 1 992 . 1 1 82 82 ASN N N 15 117.09 0.20 . 1 . . . . 82 ASN N . 18575 1 993 . 1 1 82 82 ASN ND2 N 15 112.38 0.20 . 1 . . . . 82 ASN ND2 . 18575 1 994 . 1 1 83 83 THR H H 1 8.041 0.010 . 1 . . . . 83 THR H . 18575 1 995 . 1 1 83 83 THR HA H 1 3.820 0.010 . 1 . . . . 83 THR HA . 18575 1 996 . 1 1 83 83 THR HB H 1 4.322 0.010 . 1 . . . . 83 THR HB . 18575 1 997 . 1 1 83 83 THR HG21 H 1 1.201 0.010 . 1 . . . . 83 THR QG2 . 18575 1 998 . 1 1 83 83 THR HG22 H 1 1.201 0.010 . 1 . . . . 83 THR QG2 . 18575 1 999 . 1 1 83 83 THR HG23 H 1 1.201 0.010 . 1 . . . . 83 THR QG2 . 18575 1 1000 . 1 1 83 83 THR C C 13 175.74 0.20 . 1 . . . . 83 THR C . 18575 1 1001 . 1 1 83 83 THR CA C 13 67.85 0.20 . 1 . . . . 83 THR CA . 18575 1 1002 . 1 1 83 83 THR CB C 13 68.43 0.20 . 1 . . . . 83 THR CB . 18575 1 1003 . 1 1 83 83 THR CG2 C 13 21.04 0.20 . 1 . . . . 83 THR CG2 . 18575 1 1004 . 1 1 83 83 THR N N 15 117.31 0.20 . 1 . . . . 83 THR N . 18575 1 1005 . 1 1 84 84 LEU H H 1 7.986 0.010 . 1 . . . . 84 LEU H . 18575 1 1006 . 1 1 84 84 LEU HA H 1 4.082 0.010 . 1 . . . . 84 LEU HA . 18575 1 1007 . 1 1 84 84 LEU HB2 H 1 1.895 0.010 . 2 . . . . 84 LEU HB2 . 18575 1 1008 . 1 1 84 84 LEU HB3 H 1 1.423 0.010 . 2 . . . . 84 LEU HB3 . 18575 1 1009 . 1 1 84 84 LEU HG H 1 1.795 0.010 . 1 . . . . 84 LEU HG . 18575 1 1010 . 1 1 84 84 LEU HD11 H 1 0.907 0.010 . 2 . . . . 84 LEU QD1 . 18575 1 1011 . 1 1 84 84 LEU HD12 H 1 0.907 0.010 . 2 . . . . 84 LEU QD1 . 18575 1 1012 . 1 1 84 84 LEU HD13 H 1 0.907 0.010 . 2 . . . . 84 LEU QD1 . 18575 1 1013 . 1 1 84 84 LEU HD21 H 1 0.926 0.010 . 2 . . . . 84 LEU QD2 . 18575 1 1014 . 1 1 84 84 LEU HD22 H 1 0.926 0.010 . 2 . . . . 84 LEU QD2 . 18575 1 1015 . 1 1 84 84 LEU HD23 H 1 0.926 0.010 . 2 . . . . 84 LEU QD2 . 18575 1 1016 . 1 1 84 84 LEU C C 13 177.49 0.20 . 1 . . . . 84 LEU C . 18575 1 1017 . 1 1 84 84 LEU CA C 13 58.26 0.20 . 1 . . . . 84 LEU CA . 18575 1 1018 . 1 1 84 84 LEU CB C 13 41.21 0.20 . 1 . . . . 84 LEU CB . 18575 1 1019 . 1 1 84 84 LEU CG C 13 27.98 0.20 . 1 . . . . 84 LEU CG . 18575 1 1020 . 1 1 84 84 LEU CD1 C 13 26.48 0.20 . 2 . . . . 84 LEU CD1 . 18575 1 1021 . 1 1 84 84 LEU CD2 C 13 22.54 0.20 . 2 . . . . 84 LEU CD2 . 18575 1 1022 . 1 1 84 84 LEU N N 15 120.66 0.20 . 1 . . . . 84 LEU N . 18575 1 1023 . 1 1 85 85 TYR H H 1 8.260 0.010 . 1 . . . . 85 TYR H . 18575 1 1024 . 1 1 85 85 TYR HA H 1 3.918 0.010 . 1 . . . . 85 TYR HA . 18575 1 1025 . 1 1 85 85 TYR HB2 H 1 3.015 0.010 . 1 . . . . 85 TYR HB2 . 18575 1 1026 . 1 1 85 85 TYR HB3 H 1 3.015 0.010 . 1 . . . . 85 TYR HB3 . 18575 1 1027 . 1 1 85 85 TYR HD1 H 1 7.101 0.010 . 3 . . . . 85 TYR HD1 . 18575 1 1028 . 1 1 85 85 TYR HD2 H 1 7.101 0.010 . 3 . . . . 85 TYR HD2 . 18575 1 1029 . 1 1 85 85 TYR HE1 H 1 6.804 0.010 . 3 . . . . 85 TYR HE1 . 18575 1 1030 . 1 1 85 85 TYR HE2 H 1 6.804 0.010 . 3 . . . . 85 TYR HE2 . 18575 1 1031 . 1 1 85 85 TYR C C 13 176.43 0.20 . 1 . . . . 85 TYR C . 18575 1 1032 . 1 1 85 85 TYR CA C 13 61.37 0.20 . 1 . . . . 85 TYR CA . 18575 1 1033 . 1 1 85 85 TYR CB C 13 37.55 0.20 . 1 . . . . 85 TYR CB . 18575 1 1034 . 1 1 85 85 TYR N N 15 121.36 0.20 . 1 . . . . 85 TYR N . 18575 1 1035 . 1 1 86 86 TYR H H 1 8.039 0.010 . 1 . . . . 86 TYR H . 18575 1 1036 . 1 1 86 86 TYR HA H 1 4.220 0.010 . 1 . . . . 86 TYR HA . 18575 1 1037 . 1 1 86 86 TYR HB2 H 1 3.273 0.010 . 2 . . . . 86 TYR HB2 . 18575 1 1038 . 1 1 86 86 TYR HB3 H 1 3.587 0.010 . 2 . . . . 86 TYR HB3 . 18575 1 1039 . 1 1 86 86 TYR HD1 H 1 7.067 0.010 . 3 . . . . 86 TYR HD1 . 18575 1 1040 . 1 1 86 86 TYR HD2 H 1 7.067 0.010 . 3 . . . . 86 TYR HD2 . 18575 1 1041 . 1 1 86 86 TYR HE1 H 1 6.782 0.010 . 3 . . . . 86 TYR HE1 . 18575 1 1042 . 1 1 86 86 TYR HE2 H 1 6.782 0.010 . 3 . . . . 86 TYR HE2 . 18575 1 1043 . 1 1 86 86 TYR HH H 1 9.771 0.010 . 1 . . . . 86 TYR HH . 18575 1 1044 . 1 1 86 86 TYR C C 13 176.74 0.20 . 1 . . . . 86 TYR C . 18575 1 1045 . 1 1 86 86 TYR CA C 13 58.93 0.20 . 1 . . . . 86 TYR CA . 18575 1 1046 . 1 1 86 86 TYR CB C 13 38.51 0.20 . 1 . . . . 86 TYR CB . 18575 1 1047 . 1 1 86 86 TYR N N 15 121.77 0.20 . 1 . . . . 86 TYR N . 18575 1 1048 . 1 1 87 87 ILE H H 1 7.611 0.010 . 1 . . . . 87 ILE H . 18575 1 1049 . 1 1 87 87 ILE HA H 1 2.706 0.010 . 1 . . . . 87 ILE HA . 18575 1 1050 . 1 1 87 87 ILE HB H 1 1.636 0.010 . 1 . . . . 87 ILE HB . 18575 1 1051 . 1 1 87 87 ILE HG12 H 1 1.678 0.010 . 2 . . . . 87 ILE HG12 . 18575 1 1052 . 1 1 87 87 ILE HG13 H 1 0.458 0.010 . 2 . . . . 87 ILE HG13 . 18575 1 1053 . 1 1 87 87 ILE HG21 H 1 0.628 0.010 . 1 . . . . 87 ILE QG2 . 18575 1 1054 . 1 1 87 87 ILE HG22 H 1 0.628 0.010 . 1 . . . . 87 ILE QG2 . 18575 1 1055 . 1 1 87 87 ILE HG23 H 1 0.628 0.010 . 1 . . . . 87 ILE QG2 . 18575 1 1056 . 1 1 87 87 ILE HD11 H 1 0.884 0.010 . 1 . . . . 87 ILE QD1 . 18575 1 1057 . 1 1 87 87 ILE HD12 H 1 0.884 0.010 . 1 . . . . 87 ILE QD1 . 18575 1 1058 . 1 1 87 87 ILE HD13 H 1 0.884 0.010 . 1 . . . . 87 ILE QD1 . 18575 1 1059 . 1 1 87 87 ILE C C 13 175.65 0.20 . 1 . . . . 87 ILE C . 18575 1 1060 . 1 1 87 87 ILE CA C 13 64.98 0.20 . 1 . . . . 87 ILE CA . 18575 1 1061 . 1 1 87 87 ILE CB C 13 39.20 0.20 . 1 . . . . 87 ILE CB . 18575 1 1062 . 1 1 87 87 ILE CG1 C 13 29.45 0.20 . 1 . . . . 87 ILE CG1 . 18575 1 1063 . 1 1 87 87 ILE CG2 C 13 17.45 0.20 . 1 . . . . 87 ILE CG2 . 18575 1 1064 . 1 1 87 87 ILE CD1 C 13 14.46 0.20 . 1 . . . . 87 ILE CD1 . 18575 1 1065 . 1 1 87 87 ILE N N 15 118.98 0.20 . 1 . . . . 87 ILE N . 18575 1 1066 . 1 1 88 88 LYS H H 1 8.549 0.010 . 1 . . . . 88 LYS H . 18575 1 1067 . 1 1 88 88 LYS HA H 1 3.798 0.010 . 1 . . . . 88 LYS HA . 18575 1 1068 . 1 1 88 88 LYS HB2 H 1 1.700 0.010 . 1 . . . . 88 LYS HB2 . 18575 1 1069 . 1 1 88 88 LYS HB3 H 1 1.700 0.010 . 1 . . . . 88 LYS HB3 . 18575 1 1070 . 1 1 88 88 LYS HG2 H 1 1.237 0.010 . 1 . . . . 88 LYS HG2 . 18575 1 1071 . 1 1 88 88 LYS HG3 H 1 1.237 0.010 . 1 . . . . 88 LYS HG3 . 18575 1 1072 . 1 1 88 88 LYS HD2 H 1 1.478 0.010 . 1 . . . . 88 LYS HD2 . 18575 1 1073 . 1 1 88 88 LYS HD3 H 1 1.478 0.010 . 1 . . . . 88 LYS HD3 . 18575 1 1074 . 1 1 88 88 LYS HE2 H 1 2.998 0.010 . 1 . . . . 88 LYS HE2 . 18575 1 1075 . 1 1 88 88 LYS HE3 H 1 2.998 0.010 . 1 . . . . 88 LYS HE3 . 18575 1 1076 . 1 1 88 88 LYS C C 13 177.32 0.20 . 1 . . . . 88 LYS C . 18575 1 1077 . 1 1 88 88 LYS CA C 13 59.15 0.20 . 1 . . . . 88 LYS CA . 18575 1 1078 . 1 1 88 88 LYS CB C 13 33.91 0.20 . 1 . . . . 88 LYS CB . 18575 1 1079 . 1 1 88 88 LYS CG C 13 24.43 0.20 . 1 . . . . 88 LYS CG . 18575 1 1080 . 1 1 88 88 LYS CD C 13 29.49 0.20 . 1 . . . . 88 LYS CD . 18575 1 1081 . 1 1 88 88 LYS CE C 13 41.79 0.20 . 1 . . . . 88 LYS CE . 18575 1 1082 . 1 1 88 88 LYS N N 15 119.68 0.20 . 1 . . . . 88 LYS N . 18575 1 1083 . 1 1 89 89 ASN H H 1 8.488 0.010 . 1 . . . . 89 ASN H . 18575 1 1084 . 1 1 89 89 ASN HA H 1 4.638 0.010 . 1 . . . . 89 ASN HA . 18575 1 1085 . 1 1 89 89 ASN HB2 H 1 2.335 0.010 . 2 . . . . 89 ASN HB2 . 18575 1 1086 . 1 1 89 89 ASN HB3 H 1 1.453 0.010 . 2 . . . . 89 ASN HB3 . 18575 1 1087 . 1 1 89 89 ASN HD21 H 1 6.882 0.010 . 2 . . . . 89 ASN HD21 . 18575 1 1088 . 1 1 89 89 ASN HD22 H 1 6.545 0.010 . 2 . . . . 89 ASN HD22 . 18575 1 1089 . 1 1 89 89 ASN C C 13 175.39 0.20 . 1 . . . . 89 ASN C . 18575 1 1090 . 1 1 89 89 ASN CA C 13 54.76 0.20 . 1 . . . . 89 ASN CA . 18575 1 1091 . 1 1 89 89 ASN CB C 13 39.90 0.20 . 1 . . . . 89 ASN CB . 18575 1 1092 . 1 1 89 89 ASN N N 15 112.94 0.20 . 1 . . . . 89 ASN N . 18575 1 1093 . 1 1 89 89 ASN ND2 N 15 111.03 0.20 . 1 . . . . 89 ASN ND2 . 18575 1 1094 . 1 1 90 90 LEU H H 1 6.517 0.010 . 1 . . . . 90 LEU H . 18575 1 1095 . 1 1 90 90 LEU HA H 1 4.913 0.010 . 1 . . . . 90 LEU HA . 18575 1 1096 . 1 1 90 90 LEU HB2 H 1 1.849 0.010 . 2 . . . . 90 LEU HB2 . 18575 1 1097 . 1 1 90 90 LEU HB3 H 1 2.421 0.010 . 2 . . . . 90 LEU HB3 . 18575 1 1098 . 1 1 90 90 LEU HG H 1 1.387 0.010 . 1 . . . . 90 LEU HG . 18575 1 1099 . 1 1 90 90 LEU HD11 H 1 0.892 0.010 . 2 . . . . 90 LEU QD1 . 18575 1 1100 . 1 1 90 90 LEU HD12 H 1 0.892 0.010 . 2 . . . . 90 LEU QD1 . 18575 1 1101 . 1 1 90 90 LEU HD13 H 1 0.892 0.010 . 2 . . . . 90 LEU QD1 . 18575 1 1102 . 1 1 90 90 LEU HD21 H 1 0.974 0.010 . 2 . . . . 90 LEU QD2 . 18575 1 1103 . 1 1 90 90 LEU HD22 H 1 0.974 0.010 . 2 . . . . 90 LEU QD2 . 18575 1 1104 . 1 1 90 90 LEU HD23 H 1 0.974 0.010 . 2 . . . . 90 LEU QD2 . 18575 1 1105 . 1 1 90 90 LEU C C 13 175.72 0.20 . 1 . . . . 90 LEU C . 18575 1 1106 . 1 1 90 90 LEU CA C 13 52.35 0.20 . 1 . . . . 90 LEU CA . 18575 1 1107 . 1 1 90 90 LEU CB C 13 39.18 0.20 . 1 . . . . 90 LEU CB . 18575 1 1108 . 1 1 90 90 LEU CG C 13 26.75 0.20 . 1 . . . . 90 LEU CG . 18575 1 1109 . 1 1 90 90 LEU CD1 C 13 21.71 0.20 . 2 . . . . 90 LEU CD1 . 18575 1 1110 . 1 1 90 90 LEU CD2 C 13 26.46 0.20 . 2 . . . . 90 LEU CD2 . 18575 1 1111 . 1 1 90 90 LEU N N 15 118.76 0.20 . 1 . . . . 90 LEU N . 18575 1 1112 . 1 1 91 91 ASP H H 1 9.436 0.010 . 1 . . . . 91 ASP H . 18575 1 1113 . 1 1 91 91 ASP HA H 1 4.669 0.010 . 1 . . . . 91 ASP HA . 18575 1 1114 . 1 1 91 91 ASP HB2 H 1 2.516 0.010 . 2 . . . . 91 ASP HB2 . 18575 1 1115 . 1 1 91 91 ASP HB3 H 1 2.444 0.010 . 2 . . . . 91 ASP HB3 . 18575 1 1116 . 1 1 91 91 ASP C C 13 175.66 0.20 . 1 . . . . 91 ASP C . 18575 1 1117 . 1 1 91 91 ASP CA C 13 53.37 0.20 . 1 . . . . 91 ASP CA . 18575 1 1118 . 1 1 91 91 ASP CB C 13 39.29 0.20 . 1 . . . . 91 ASP CB . 18575 1 1119 . 1 1 91 91 ASP N N 15 118.25 0.20 . 1 . . . . 91 ASP N . 18575 1 1120 . 1 1 92 92 GLY H H 1 6.914 0.010 . 1 . . . . 92 GLY H . 18575 1 1121 . 1 1 92 92 GLY HA2 H 1 3.471 0.010 . 2 . . . . 92 GLY HA2 . 18575 1 1122 . 1 1 92 92 GLY HA3 H 1 1.624 0.010 . 2 . . . . 92 GLY HA3 . 18575 1 1123 . 1 1 92 92 GLY C C 13 174.52 0.20 . 1 . . . . 92 GLY C . 18575 1 1124 . 1 1 92 92 GLY CA C 13 45.64 0.20 . 1 . . . . 92 GLY CA . 18575 1 1125 . 1 1 92 92 GLY N N 15 106.93 0.20 . 1 . . . . 92 GLY N . 18575 1 1126 . 1 1 93 93 GLY H H 1 8.615 0.010 . 1 . . . . 93 GLY H . 18575 1 1127 . 1 1 93 93 GLY HA2 H 1 3.788 0.010 . 2 . . . . 93 GLY HA2 . 18575 1 1128 . 1 1 93 93 GLY HA3 H 1 3.643 0.010 . 2 . . . . 93 GLY HA3 . 18575 1 1129 . 1 1 93 93 GLY C C 13 174.11 0.20 . 1 . . . . 93 GLY C . 18575 1 1130 . 1 1 93 93 GLY CA C 13 47.49 0.20 . 1 . . . . 93 GLY CA . 18575 1 1131 . 1 1 93 93 GLY N N 15 106.18 0.20 . 1 . . . . 93 GLY N . 18575 1 1132 . 1 1 94 94 ASN H H 1 7.185 0.010 . 1 . . . . 94 ASN H . 18575 1 1133 . 1 1 94 94 ASN HA H 1 5.187 0.010 . 1 . . . . 94 ASN HA . 18575 1 1134 . 1 1 94 94 ASN HB2 H 1 2.665 0.010 . 2 . . . . 94 ASN HB2 . 18575 1 1135 . 1 1 94 94 ASN HB3 H 1 3.011 0.010 . 2 . . . . 94 ASN HB3 . 18575 1 1136 . 1 1 94 94 ASN HD21 H 1 7.381 0.010 . 2 . . . . 94 ASN HD21 . 18575 1 1137 . 1 1 94 94 ASN HD22 H 1 6.742 0.010 . 2 . . . . 94 ASN HD22 . 18575 1 1138 . 1 1 94 94 ASN C C 13 176.63 0.20 . 1 . . . . 94 ASN C . 18575 1 1139 . 1 1 94 94 ASN CA C 13 51.36 0.20 . 1 . . . . 94 ASN CA . 18575 1 1140 . 1 1 94 94 ASN CB C 13 37.37 0.20 . 1 . . . . 94 ASN CB . 18575 1 1141 . 1 1 94 94 ASN CG C 13 177.62 0.20 . 1 . . . . 94 ASN CG . 18575 1 1142 . 1 1 94 94 ASN N N 15 113.50 0.20 . 1 . . . . 94 ASN N . 18575 1 1143 . 1 1 94 94 ASN ND2 N 15 110.09 0.20 . 1 . . . . 94 ASN ND2 . 18575 1 1144 . 1 1 95 95 LYS H H 1 7.430 0.010 . 1 . . . . 95 LYS H . 18575 1 1145 . 1 1 95 95 LYS HA H 1 4.633 0.010 . 1 . . . . 95 LYS HA . 18575 1 1146 . 1 1 95 95 LYS HB2 H 1 2.213 0.010 . 2 . . . . 95 LYS HB2 . 18575 1 1147 . 1 1 95 95 LYS HB3 H 1 1.605 0.010 . 2 . . . . 95 LYS HB3 . 18575 1 1148 . 1 1 95 95 LYS HG2 H 1 1.578 0.010 . 2 . . . . 95 LYS HG2 . 18575 1 1149 . 1 1 95 95 LYS HG3 H 1 1.221 0.010 . 2 . . . . 95 LYS HG3 . 18575 1 1150 . 1 1 95 95 LYS HD2 H 1 1.257 0.010 . 2 . . . . 95 LYS HD2 . 18575 1 1151 . 1 1 95 95 LYS HD3 H 1 1.177 0.010 . 2 . . . . 95 LYS HD3 . 18575 1 1152 . 1 1 95 95 LYS HE2 H 1 2.678 0.010 . 2 . . . . 95 LYS HE2 . 18575 1 1153 . 1 1 95 95 LYS HE3 H 1 2.733 0.010 . 2 . . . . 95 LYS HE3 . 18575 1 1154 . 1 1 95 95 LYS C C 13 173.42 0.20 . 1 . . . . 95 LYS C . 18575 1 1155 . 1 1 95 95 LYS CA C 13 57.01 0.20 . 1 . . . . 95 LYS CA . 18575 1 1156 . 1 1 95 95 LYS CB C 13 35.56 0.20 . 1 . . . . 95 LYS CB . 18575 1 1157 . 1 1 95 95 LYS CG C 13 25.76 0.20 . 1 . . . . 95 LYS CG . 18575 1 1158 . 1 1 95 95 LYS CD C 13 29.74 0.20 . 1 . . . . 95 LYS CD . 18575 1 1159 . 1 1 95 95 LYS CE C 13 42.03 0.20 . 1 . . . . 95 LYS CE . 18575 1 1160 . 1 1 95 95 LYS N N 15 117.89 0.20 . 1 . . . . 95 LYS N . 18575 1 1161 . 1 1 96 96 VAL H H 1 6.831 0.010 . 1 . . . . 96 VAL H . 18575 1 1162 . 1 1 96 96 VAL HA H 1 5.084 0.010 . 1 . . . . 96 VAL HA . 18575 1 1163 . 1 1 96 96 VAL HB H 1 1.610 0.010 . 1 . . . . 96 VAL HB . 18575 1 1164 . 1 1 96 96 VAL HG11 H 1 0.915 0.010 . 2 . . . . 96 VAL QG1 . 18575 1 1165 . 1 1 96 96 VAL HG12 H 1 0.915 0.010 . 2 . . . . 96 VAL QG1 . 18575 1 1166 . 1 1 96 96 VAL HG13 H 1 0.915 0.010 . 2 . . . . 96 VAL QG1 . 18575 1 1167 . 1 1 96 96 VAL HG21 H 1 0.745 0.010 . 2 . . . . 96 VAL QG2 . 18575 1 1168 . 1 1 96 96 VAL HG22 H 1 0.745 0.010 . 2 . . . . 96 VAL QG2 . 18575 1 1169 . 1 1 96 96 VAL HG23 H 1 0.745 0.010 . 2 . . . . 96 VAL QG2 . 18575 1 1170 . 1 1 96 96 VAL C C 13 174.02 0.20 . 1 . . . . 96 VAL C . 18575 1 1171 . 1 1 96 96 VAL CA C 13 59.71 0.20 . 1 . . . . 96 VAL CA . 18575 1 1172 . 1 1 96 96 VAL CB C 13 35.07 0.20 . 1 . . . . 96 VAL CB . 18575 1 1173 . 1 1 96 96 VAL CG1 C 13 22.01 0.20 . 2 . . . . 96 VAL CG1 . 18575 1 1174 . 1 1 96 96 VAL CG2 C 13 22.52 0.20 . 2 . . . . 96 VAL CG2 . 18575 1 1175 . 1 1 96 96 VAL N N 15 116.32 0.20 . 1 . . . . 96 VAL N . 18575 1 1176 . 1 1 97 97 ALA H H 1 8.845 0.010 . 1 . . . . 97 ALA H . 18575 1 1177 . 1 1 97 97 ALA HA H 1 4.724 0.010 . 1 . . . . 97 ALA HA . 18575 1 1178 . 1 1 97 97 ALA HB1 H 1 1.296 0.010 . 1 . . . . 97 ALA QB . 18575 1 1179 . 1 1 97 97 ALA HB2 H 1 1.296 0.010 . 1 . . . . 97 ALA QB . 18575 1 1180 . 1 1 97 97 ALA HB3 H 1 1.296 0.010 . 1 . . . . 97 ALA QB . 18575 1 1181 . 1 1 97 97 ALA C C 13 175.46 0.20 . 1 . . . . 97 ALA C . 18575 1 1182 . 1 1 97 97 ALA CA C 13 53.07 0.20 . 1 . . . . 97 ALA CA . 18575 1 1183 . 1 1 97 97 ALA CB C 13 20.28 0.20 . 1 . . . . 97 ALA CB . 18575 1 1184 . 1 1 97 97 ALA N N 15 128.79 0.20 . 1 . . . . 97 ALA N . 18575 1 1185 . 1 1 98 98 ASN H H 1 8.088 0.010 . 1 . . . . 98 ASN H . 18575 1 1186 . 1 1 98 98 ASN HA H 1 5.299 0.010 . 1 . . . . 98 ASN HA . 18575 1 1187 . 1 1 98 98 ASN HB2 H 1 2.514 0.010 . 2 . . . . 98 ASN HB2 . 18575 1 1188 . 1 1 98 98 ASN HB3 H 1 2.197 0.010 . 2 . . . . 98 ASN HB3 . 18575 1 1189 . 1 1 98 98 ASN HD21 H 1 8.319 0.010 . 2 . . . . 98 ASN HD21 . 18575 1 1190 . 1 1 98 98 ASN HD22 H 1 7.036 0.010 . 2 . . . . 98 ASN HD22 . 18575 1 1191 . 1 1 98 98 ASN C C 13 173.39 0.20 . 1 . . . . 98 ASN C . 18575 1 1192 . 1 1 98 98 ASN CA C 13 51.88 0.20 . 1 . . . . 98 ASN CA . 18575 1 1193 . 1 1 98 98 ASN CB C 13 41.16 0.20 . 1 . . . . 98 ASN CB . 18575 1 1194 . 1 1 98 98 ASN CG C 13 176.40 0.20 . 1 . . . . 98 ASN CG . 18575 1 1195 . 1 1 98 98 ASN N N 15 115.77 0.20 . 1 . . . . 98 ASN N . 18575 1 1196 . 1 1 98 98 ASN ND2 N 15 119.05 0.20 . 1 . . . . 98 ASN ND2 . 18575 1 1197 . 1 1 99 99 VAL H H 1 8.927 0.010 . 1 . . . . 99 VAL H . 18575 1 1198 . 1 1 99 99 VAL HA H 1 4.760 0.010 . 1 . . . . 99 VAL HA . 18575 1 1199 . 1 1 99 99 VAL HB H 1 1.474 0.010 . 1 . . . . 99 VAL HB . 18575 1 1200 . 1 1 99 99 VAL HG11 H 1 0.736 0.010 . 2 . . . . 99 VAL QG1 . 18575 1 1201 . 1 1 99 99 VAL HG12 H 1 0.736 0.010 . 2 . . . . 99 VAL QG1 . 18575 1 1202 . 1 1 99 99 VAL HG13 H 1 0.736 0.010 . 2 . . . . 99 VAL QG1 . 18575 1 1203 . 1 1 99 99 VAL HG21 H 1 0.426 0.010 . 2 . . . . 99 VAL QG2 . 18575 1 1204 . 1 1 99 99 VAL HG22 H 1 0.426 0.010 . 2 . . . . 99 VAL QG2 . 18575 1 1205 . 1 1 99 99 VAL HG23 H 1 0.426 0.010 . 2 . . . . 99 VAL QG2 . 18575 1 1206 . 1 1 99 99 VAL C C 13 175.78 0.20 . 1 . . . . 99 VAL C . 18575 1 1207 . 1 1 99 99 VAL CA C 13 60.81 0.20 . 1 . . . . 99 VAL CA . 18575 1 1208 . 1 1 99 99 VAL CB C 13 34.08 0.20 . 1 . . . . 99 VAL CB . 18575 1 1209 . 1 1 99 99 VAL CG1 C 13 21.11 0.20 . 2 . . . . 99 VAL CG1 . 18575 1 1210 . 1 1 99 99 VAL CG2 C 13 22.41 0.20 . 2 . . . . 99 VAL CG2 . 18575 1 1211 . 1 1 99 99 VAL N N 15 120.37 0.20 . 1 . . . . 99 VAL N . 18575 1 1212 . 1 1 100 100 VAL H H 1 9.428 0.010 . 1 . . . . 100 VAL H . 18575 1 1213 . 1 1 100 100 VAL HA H 1 5.384 0.010 . 1 . . . . 100 VAL HA . 18575 1 1214 . 1 1 100 100 VAL HB H 1 2.080 0.010 . 1 . . . . 100 VAL HB . 18575 1 1215 . 1 1 100 100 VAL HG11 H 1 0.915 0.010 . 2 . . . . 100 VAL QG1 . 18575 1 1216 . 1 1 100 100 VAL HG12 H 1 0.915 0.010 . 2 . . . . 100 VAL QG1 . 18575 1 1217 . 1 1 100 100 VAL HG13 H 1 0.915 0.010 . 2 . . . . 100 VAL QG1 . 18575 1 1218 . 1 1 100 100 VAL HG21 H 1 0.948 0.010 . 2 . . . . 100 VAL QG2 . 18575 1 1219 . 1 1 100 100 VAL HG22 H 1 0.948 0.010 . 2 . . . . 100 VAL QG2 . 18575 1 1220 . 1 1 100 100 VAL HG23 H 1 0.948 0.010 . 2 . . . . 100 VAL QG2 . 18575 1 1221 . 1 1 100 100 VAL C C 13 175.88 0.20 . 1 . . . . 100 VAL C . 18575 1 1222 . 1 1 100 100 VAL CA C 13 59.92 0.20 . 1 . . . . 100 VAL CA . 18575 1 1223 . 1 1 100 100 VAL CB C 13 34.36 0.20 . 1 . . . . 100 VAL CB . 18575 1 1224 . 1 1 100 100 VAL CG1 C 13 22.08 0.20 . 2 . . . . 100 VAL CG1 . 18575 1 1225 . 1 1 100 100 VAL CG2 C 13 20.19 0.20 . 2 . . . . 100 VAL CG2 . 18575 1 1226 . 1 1 100 100 VAL N N 15 130.21 0.20 . 1 . . . . 100 VAL N . 18575 1 1227 . 1 1 101 101 THR H H 1 9.380 0.010 . 1 . . . . 101 THR H . 18575 1 1228 . 1 1 101 101 THR HA H 1 5.742 0.010 . 1 . . . . 101 THR HA . 18575 1 1229 . 1 1 101 101 THR HB H 1 4.191 0.010 . 1 . . . . 101 THR HB . 18575 1 1230 . 1 1 101 101 THR HG1 H 1 5.237 0.010 . 1 . . . . 101 THR HG1 . 18575 1 1231 . 1 1 101 101 THR HG21 H 1 1.214 0.010 . 1 . . . . 101 THR QG2 . 18575 1 1232 . 1 1 101 101 THR HG22 H 1 1.214 0.010 . 1 . . . . 101 THR QG2 . 18575 1 1233 . 1 1 101 101 THR HG23 H 1 1.214 0.010 . 1 . . . . 101 THR QG2 . 18575 1 1234 . 1 1 101 101 THR C C 13 173.15 0.20 . 1 . . . . 101 THR C . 18575 1 1235 . 1 1 101 101 THR CA C 13 59.28 0.20 . 1 . . . . 101 THR CA . 18575 1 1236 . 1 1 101 101 THR CB C 13 71.04 0.20 . 1 . . . . 101 THR CB . 18575 1 1237 . 1 1 101 101 THR CG2 C 13 19.36 0.20 . 1 . . . . 101 THR CG2 . 18575 1 1238 . 1 1 101 101 THR N N 15 115.40 0.20 . 1 . . . . 101 THR N . 18575 1 1239 . 1 1 102 102 LEU H H 1 9.170 0.010 . 1 . . . . 102 LEU H . 18575 1 1240 . 1 1 102 102 LEU HA H 1 5.001 0.010 . 1 . . . . 102 LEU HA . 18575 1 1241 . 1 1 102 102 LEU HB2 H 1 1.251 0.010 . 2 . . . . 102 LEU HB2 . 18575 1 1242 . 1 1 102 102 LEU HB3 H 1 2.091 0.010 . 2 . . . . 102 LEU HB3 . 18575 1 1243 . 1 1 102 102 LEU HG H 1 1.614 0.010 . 1 . . . . 102 LEU HG . 18575 1 1244 . 1 1 102 102 LEU HD11 H 1 0.702 0.010 . 2 . . . . 102 LEU QD1 . 18575 1 1245 . 1 1 102 102 LEU HD12 H 1 0.702 0.010 . 2 . . . . 102 LEU QD1 . 18575 1 1246 . 1 1 102 102 LEU HD13 H 1 0.702 0.010 . 2 . . . . 102 LEU QD1 . 18575 1 1247 . 1 1 102 102 LEU HD21 H 1 0.972 0.010 . 2 . . . . 102 LEU QD2 . 18575 1 1248 . 1 1 102 102 LEU HD22 H 1 0.972 0.010 . 2 . . . . 102 LEU QD2 . 18575 1 1249 . 1 1 102 102 LEU HD23 H 1 0.972 0.010 . 2 . . . . 102 LEU QD2 . 18575 1 1250 . 1 1 102 102 LEU C C 13 175.20 0.20 . 1 . . . . 102 LEU C . 18575 1 1251 . 1 1 102 102 LEU CA C 13 51.88 0.20 . 1 . . . . 102 LEU CA . 18575 1 1252 . 1 1 102 102 LEU CB C 13 43.24 0.20 . 1 . . . . 102 LEU CB . 18575 1 1253 . 1 1 102 102 LEU CG C 13 26.49 0.20 . 1 . . . . 102 LEU CG . 18575 1 1254 . 1 1 102 102 LEU CD1 C 13 25.44 0.20 . 2 . . . . 102 LEU CD1 . 18575 1 1255 . 1 1 102 102 LEU CD2 C 13 25.63 0.20 . 2 . . . . 102 LEU CD2 . 18575 1 1256 . 1 1 102 102 LEU N N 15 122.21 0.20 . 1 . . . . 102 LEU N . 18575 1 1257 . 1 1 103 103 GLY H H 1 9.484 0.010 . 1 . . . . 103 GLY H . 18575 1 1258 . 1 1 103 103 GLY HA2 H 1 4.176 0.010 . 2 . . . . 103 GLY HA2 . 18575 1 1259 . 1 1 103 103 GLY HA3 H 1 3.552 0.010 . 2 . . . . 103 GLY HA3 . 18575 1 1260 . 1 1 103 103 GLY C C 13 174.78 0.20 . 1 . . . . 103 GLY C . 18575 1 1261 . 1 1 103 103 GLY CA C 13 48.38 0.20 . 1 . . . . 103 GLY CA . 18575 1 1262 . 1 1 103 103 GLY N N 15 115.24 0.20 . 1 . . . . 103 GLY N . 18575 1 1263 . 1 1 104 104 GLY H H 1 8.298 0.010 . 1 . . . . 104 GLY H . 18575 1 1264 . 1 1 104 104 GLY HA2 H 1 4.213 0.010 . 2 . . . . 104 GLY HA2 . 18575 1 1265 . 1 1 104 104 GLY HA3 H 1 3.346 0.010 . 2 . . . . 104 GLY HA3 . 18575 1 1266 . 1 1 104 104 GLY C C 13 176.67 0.20 . 1 . . . . 104 GLY C . 18575 1 1267 . 1 1 104 104 GLY CA C 13 45.03 0.20 . 1 . . . . 104 GLY CA . 18575 1 1268 . 1 1 104 104 GLY N N 15 98.39 0.20 . 1 . . . . 104 GLY N . 18575 1 1269 . 1 1 105 105 ALA H H 1 7.361 0.010 . 1 . . . . 105 ALA H . 18575 1 1270 . 1 1 105 105 ALA HA H 1 4.351 0.010 . 1 . . . . 105 ALA HA . 18575 1 1271 . 1 1 105 105 ALA HB1 H 1 1.244 0.010 . 1 . . . . 105 ALA QB . 18575 1 1272 . 1 1 105 105 ALA HB2 H 1 1.244 0.010 . 1 . . . . 105 ALA QB . 18575 1 1273 . 1 1 105 105 ALA HB3 H 1 1.244 0.010 . 1 . . . . 105 ALA QB . 18575 1 1274 . 1 1 105 105 ALA C C 13 177.14 0.20 . 1 . . . . 105 ALA C . 18575 1 1275 . 1 1 105 105 ALA CA C 13 49.51 0.20 . 1 . . . . 105 ALA CA . 18575 1 1276 . 1 1 105 105 ALA CB C 13 15.35 0.20 . 1 . . . . 105 ALA CB . 18575 1 1277 . 1 1 105 105 ALA N N 15 133.19 0.20 . 1 . . . . 105 ALA N . 18575 1 1278 . 1 1 106 106 ASN H H 1 6.866 0.010 . 1 . . . . 106 ASN H . 18575 1 1279 . 1 1 106 106 ASN HA H 1 3.919 0.010 . 1 . . . . 106 ASN HA . 18575 1 1280 . 1 1 106 106 ASN HB2 H 1 2.645 0.010 . 2 . . . . 106 ASN HB2 . 18575 1 1281 . 1 1 106 106 ASN HB3 H 1 2.514 0.010 . 2 . . . . 106 ASN HB3 . 18575 1 1282 . 1 1 106 106 ASN HD21 H 1 7.024 0.010 . 2 . . . . 106 ASN HD21 . 18575 1 1283 . 1 1 106 106 ASN HD22 H 1 6.811 0.010 . 2 . . . . 106 ASN HD22 . 18575 1 1284 . 1 1 106 106 ASN C C 13 177.84 0.20 . 1 . . . . 106 ASN C . 18575 1 1285 . 1 1 106 106 ASN CA C 13 57.03 0.20 . 1 . . . . 106 ASN CA . 18575 1 1286 . 1 1 106 106 ASN CB C 13 38.73 0.20 . 1 . . . . 106 ASN CB . 18575 1 1287 . 1 1 106 106 ASN CG C 13 172.15 0.20 . 1 . . . . 106 ASN CG . 18575 1 1288 . 1 1 106 106 ASN N N 15 117.10 0.20 . 1 . . . . 106 ASN N . 18575 1 1289 . 1 1 106 106 ASN ND2 N 15 106.37 0.20 . 1 . . . . 106 ASN ND2 . 18575 1 1290 . 1 1 107 107 ARG H H 1 8.777 0.010 . 1 . . . . 107 ARG H . 18575 1 1291 . 1 1 107 107 ARG HA H 1 4.138 0.010 . 1 . . . . 107 ARG HA . 18575 1 1292 . 1 1 107 107 ARG HB2 H 1 1.472 0.010 . 2 . . . . 107 ARG HB2 . 18575 1 1293 . 1 1 107 107 ARG HB3 H 1 1.795 0.010 . 2 . . . . 107 ARG HB3 . 18575 1 1294 . 1 1 107 107 ARG HG2 H 1 1.356 0.010 . 1 . . . . 107 ARG HG2 . 18575 1 1295 . 1 1 107 107 ARG HG3 H 1 1.356 0.010 . 1 . . . . 107 ARG HG3 . 18575 1 1296 . 1 1 107 107 ARG HD2 H 1 3.214 0.010 . 2 . . . . 107 ARG HD2 . 18575 1 1297 . 1 1 107 107 ARG HD3 H 1 3.061 0.010 . 2 . . . . 107 ARG HD3 . 18575 1 1298 . 1 1 107 107 ARG C C 13 176.48 0.20 . 1 . . . . 107 ARG C . 18575 1 1299 . 1 1 107 107 ARG CA C 13 57.51 0.20 . 1 . . . . 107 ARG CA . 18575 1 1300 . 1 1 107 107 ARG CB C 13 29.44 0.20 . 1 . . . . 107 ARG CB . 18575 1 1301 . 1 1 107 107 ARG CG C 13 29.89 0.20 . 1 . . . . 107 ARG CG . 18575 1 1302 . 1 1 107 107 ARG CD C 13 43.38 0.20 . 1 . . . . 107 ARG CD . 18575 1 1303 . 1 1 107 107 ARG N N 15 114.68 0.20 . 1 . . . . 107 ARG N . 18575 1 1304 . 1 1 108 108 LEU H H 1 7.259 0.010 . 1 . . . . 108 LEU H . 18575 1 1305 . 1 1 108 108 LEU HA H 1 4.147 0.010 . 1 . . . . 108 LEU HA . 18575 1 1306 . 1 1 108 108 LEU HB2 H 1 1.777 0.010 . 2 . . . . 108 LEU HB2 . 18575 1 1307 . 1 1 108 108 LEU HB3 H 1 1.521 0.010 . 2 . . . . 108 LEU HB3 . 18575 1 1308 . 1 1 108 108 LEU HG H 1 1.511 0.010 . 1 . . . . 108 LEU HG . 18575 1 1309 . 1 1 108 108 LEU HD11 H 1 0.895 0.010 . 2 . . . . 108 LEU QD1 . 18575 1 1310 . 1 1 108 108 LEU HD12 H 1 0.895 0.010 . 2 . . . . 108 LEU QD1 . 18575 1 1311 . 1 1 108 108 LEU HD13 H 1 0.895 0.010 . 2 . . . . 108 LEU QD1 . 18575 1 1312 . 1 1 108 108 LEU HD21 H 1 0.764 0.010 . 2 . . . . 108 LEU QD2 . 18575 1 1313 . 1 1 108 108 LEU HD22 H 1 0.764 0.010 . 2 . . . . 108 LEU QD2 . 18575 1 1314 . 1 1 108 108 LEU HD23 H 1 0.764 0.010 . 2 . . . . 108 LEU QD2 . 18575 1 1315 . 1 1 108 108 LEU C C 13 178.12 0.20 . 1 . . . . 108 LEU C . 18575 1 1316 . 1 1 108 108 LEU CA C 13 56.92 0.20 . 1 . . . . 108 LEU CA . 18575 1 1317 . 1 1 108 108 LEU CB C 13 39.88 0.20 . 1 . . . . 108 LEU CB . 18575 1 1318 . 1 1 108 108 LEU CG C 13 27.50 0.20 . 1 . . . . 108 LEU CG . 18575 1 1319 . 1 1 108 108 LEU CD1 C 13 25.56 0.20 . 2 . . . . 108 LEU CD1 . 18575 1 1320 . 1 1 108 108 LEU CD2 C 13 22.04 0.20 . 2 . . . . 108 LEU CD2 . 18575 1 1321 . 1 1 108 108 LEU N N 15 117.56 0.20 . 1 . . . . 108 LEU N . 18575 1 1322 . 1 1 109 109 THR H H 1 8.174 0.010 . 1 . . . . 109 THR H . 18575 1 1323 . 1 1 109 109 THR HA H 1 4.375 0.010 . 1 . . . . 109 THR HA . 18575 1 1324 . 1 1 109 109 THR HB H 1 4.132 0.010 . 1 . . . . 109 THR HB . 18575 1 1325 . 1 1 109 109 THR HG21 H 1 1.136 0.010 . 1 . . . . 109 THR QG2 . 18575 1 1326 . 1 1 109 109 THR HG22 H 1 1.136 0.010 . 1 . . . . 109 THR QG2 . 18575 1 1327 . 1 1 109 109 THR HG23 H 1 1.136 0.010 . 1 . . . . 109 THR QG2 . 18575 1 1328 . 1 1 109 109 THR C C 13 172.90 0.20 . 1 . . . . 109 THR C . 18575 1 1329 . 1 1 109 109 THR CA C 13 63.92 0.20 . 1 . . . . 109 THR CA . 18575 1 1330 . 1 1 109 109 THR CB C 13 68.95 0.20 . 1 . . . . 109 THR CB . 18575 1 1331 . 1 1 109 109 THR CG2 C 13 22.32 0.20 . 1 . . . . 109 THR CG2 . 18575 1 1332 . 1 1 109 109 THR N N 15 114.18 0.20 . 1 . . . . 109 THR N . 18575 1 1333 . 1 1 110 110 THR H H 1 7.743 0.010 . 1 . . . . 110 THR H . 18575 1 1334 . 1 1 110 110 THR HA H 1 4.496 0.010 . 1 . . . . 110 THR HA . 18575 1 1335 . 1 1 110 110 THR HB H 1 4.117 0.010 . 1 . . . . 110 THR HB . 18575 1 1336 . 1 1 110 110 THR HG21 H 1 1.072 0.010 . 1 . . . . 110 THR QG2 . 18575 1 1337 . 1 1 110 110 THR HG22 H 1 1.072 0.010 . 1 . . . . 110 THR QG2 . 18575 1 1338 . 1 1 110 110 THR HG23 H 1 1.072 0.010 . 1 . . . . 110 THR QG2 . 18575 1 1339 . 1 1 110 110 THR C C 13 169.58 0.20 . 1 . . . . 110 THR C . 18575 1 1340 . 1 1 110 110 THR CA C 13 60.21 0.20 . 1 . . . . 110 THR CA . 18575 1 1341 . 1 1 110 110 THR CB C 13 66.67 0.20 . 1 . . . . 110 THR CB . 18575 1 1342 . 1 1 110 110 THR CG2 C 13 19.62 0.20 . 1 . . . . 110 THR CG2 . 18575 1 1343 . 1 1 110 110 THR N N 15 114.77 0.20 . 1 . . . . 110 THR N . 18575 1 1344 . 1 1 111 111 GLY H H 1 8.043 0.010 . 1 . . . . 111 GLY H . 18575 1 1345 . 1 1 111 111 GLY HA2 H 1 4.202 0.010 . 2 . . . . 111 GLY HA2 . 18575 1 1346 . 1 1 111 111 GLY HA3 H 1 3.466 0.010 . 2 . . . . 111 GLY HA3 . 18575 1 1347 . 1 1 111 111 GLY C C 13 172.42 0.20 . 1 . . . . 111 GLY C . 18575 1 1348 . 1 1 111 111 GLY CA C 13 44.57 0.20 . 1 . . . . 111 GLY CA . 18575 1 1349 . 1 1 111 111 GLY N N 15 110.46 0.20 . 1 . . . . 111 GLY N . 18575 1 1350 . 1 1 112 112 ASP H H 1 7.978 0.010 . 1 . . . . 112 ASP H . 18575 1 1351 . 1 1 112 112 ASP HA H 1 4.714 0.010 . 1 . . . . 112 ASP HA . 18575 1 1352 . 1 1 112 112 ASP HB2 H 1 2.277 0.010 . 2 . . . . 112 ASP HB2 . 18575 1 1353 . 1 1 112 112 ASP HB3 H 1 2.222 0.010 . 2 . . . . 112 ASP HB3 . 18575 1 1354 . 1 1 112 112 ASP C C 13 174.12 0.20 . 1 . . . . 112 ASP C . 18575 1 1355 . 1 1 112 112 ASP CA C 13 53.72 0.20 . 1 . . . . 112 ASP CA . 18575 1 1356 . 1 1 112 112 ASP CB C 13 43.07 0.20 . 1 . . . . 112 ASP CB . 18575 1 1357 . 1 1 112 112 ASP N N 15 120.19 0.20 . 1 . . . . 112 ASP N . 18575 1 1358 . 1 1 113 113 ALA H H 1 7.458 0.010 . 1 . . . . 113 ALA H . 18575 1 1359 . 1 1 113 113 ALA HA H 1 2.969 0.010 . 1 . . . . 113 ALA HA . 18575 1 1360 . 1 1 113 113 ALA HB1 H 1 0.679 0.010 . 1 . . . . 113 ALA QB . 18575 1 1361 . 1 1 113 113 ALA HB2 H 1 0.679 0.010 . 1 . . . . 113 ALA QB . 18575 1 1362 . 1 1 113 113 ALA HB3 H 1 0.679 0.010 . 1 . . . . 113 ALA QB . 18575 1 1363 . 1 1 113 113 ALA C C 13 175.45 0.20 . 1 . . . . 113 ALA C . 18575 1 1364 . 1 1 113 113 ALA CA C 13 49.93 0.20 . 1 . . . . 113 ALA CA . 18575 1 1365 . 1 1 113 113 ALA CB C 13 15.90 0.20 . 1 . . . . 113 ALA CB . 18575 1 1366 . 1 1 113 113 ALA N N 15 119.50 0.20 . 1 . . . . 113 ALA N . 18575 1 1367 . 1 1 114 114 LEU H H 1 6.151 0.010 . 1 . . . . 114 LEU H . 18575 1 1368 . 1 1 114 114 LEU HA H 1 4.342 0.010 . 1 . . . . 114 LEU HA . 18575 1 1369 . 1 1 114 114 LEU HB2 H 1 1.592 0.010 . 2 . . . . 114 LEU HB2 . 18575 1 1370 . 1 1 114 114 LEU HB3 H 1 1.740 0.010 . 2 . . . . 114 LEU HB3 . 18575 1 1371 . 1 1 114 114 LEU HG H 1 1.722 0.010 . 1 . . . . 114 LEU HG . 18575 1 1372 . 1 1 114 114 LEU HD11 H 1 0.873 0.010 . 2 . . . . 114 LEU QD1 . 18575 1 1373 . 1 1 114 114 LEU HD12 H 1 0.873 0.010 . 2 . . . . 114 LEU QD1 . 18575 1 1374 . 1 1 114 114 LEU HD13 H 1 0.873 0.010 . 2 . . . . 114 LEU QD1 . 18575 1 1375 . 1 1 114 114 LEU HD21 H 1 0.879 0.010 . 2 . . . . 114 LEU QD2 . 18575 1 1376 . 1 1 114 114 LEU HD22 H 1 0.879 0.010 . 2 . . . . 114 LEU QD2 . 18575 1 1377 . 1 1 114 114 LEU HD23 H 1 0.879 0.010 . 2 . . . . 114 LEU QD2 . 18575 1 1378 . 1 1 114 114 LEU CA C 13 52.78 0.20 . 1 . . . . 114 LEU CA . 18575 1 1379 . 1 1 114 114 LEU CB C 13 40.41 0.20 . 1 . . . . 114 LEU CB . 18575 1 1380 . 1 1 114 114 LEU CG C 13 25.70 0.20 . 1 . . . . 114 LEU CG . 18575 1 1381 . 1 1 114 114 LEU CD1 C 13 27.85 0.20 . 2 . . . . 114 LEU CD1 . 18575 1 1382 . 1 1 114 114 LEU CD2 C 13 22.68 0.20 . 2 . . . . 114 LEU CD2 . 18575 1 1383 . 1 1 114 114 LEU N N 15 127.06 0.20 . 1 . . . . 114 LEU N . 18575 1 1384 . 1 1 115 115 PRO HA H 1 4.348 0.010 . 1 . . . . 115 PRO HA . 18575 1 1385 . 1 1 115 115 PRO HB2 H 1 2.134 0.010 . 1 . . . . 115 PRO HB2 . 18575 1 1386 . 1 1 115 115 PRO HB3 H 1 2.134 0.010 . 1 . . . . 115 PRO HB3 . 18575 1 1387 . 1 1 115 115 PRO HG2 H 1 2.184 0.010 . 2 . . . . 115 PRO HG2 . 18575 1 1388 . 1 1 115 115 PRO HG3 H 1 2.070 0.010 . 2 . . . . 115 PRO HG3 . 18575 1 1389 . 1 1 115 115 PRO HD2 H 1 3.863 0.010 . 2 . . . . 115 PRO HD2 . 18575 1 1390 . 1 1 115 115 PRO HD3 H 1 4.071 0.010 . 2 . . . . 115 PRO HD3 . 18575 1 1391 . 1 1 115 115 PRO C C 13 177.46 0.20 . 1 . . . . 115 PRO C . 18575 1 1392 . 1 1 115 115 PRO CA C 13 64.83 0.20 . 1 . . . . 115 PRO CA . 18575 1 1393 . 1 1 115 115 PRO CB C 13 32.16 0.20 . 1 . . . . 115 PRO CB . 18575 1 1394 . 1 1 115 115 PRO CG C 13 26.91 0.20 . 1 . . . . 115 PRO CG . 18575 1 1395 . 1 1 115 115 PRO CD C 13 51.05 0.20 . 1 . . . . 115 PRO CD . 18575 1 1396 . 1 1 116 116 GLY H H 1 8.566 0.010 . 1 . . . . 116 GLY H . 18575 1 1397 . 1 1 116 116 GLY HA2 H 1 3.760 0.010 . 2 . . . . 116 GLY HA2 . 18575 1 1398 . 1 1 116 116 GLY HA3 H 1 4.687 0.010 . 2 . . . . 116 GLY HA3 . 18575 1 1399 . 1 1 116 116 GLY C C 13 174.86 0.20 . 1 . . . . 116 GLY C . 18575 1 1400 . 1 1 116 116 GLY CA C 13 43.93 0.20 . 1 . . . . 116 GLY CA . 18575 1 1401 . 1 1 116 116 GLY N N 15 106.83 0.20 . 1 . . . . 116 GLY N . 18575 1 1402 . 1 1 117 117 THR H H 1 7.828 0.010 . 1 . . . . 117 THR H . 18575 1 1403 . 1 1 117 117 THR HA H 1 4.305 0.010 . 1 . . . . 117 THR HA . 18575 1 1404 . 1 1 117 117 THR HB H 1 4.444 0.010 . 1 . . . . 117 THR HB . 18575 1 1405 . 1 1 117 117 THR HG21 H 1 0.997 0.010 . 1 . . . . 117 THR QG2 . 18575 1 1406 . 1 1 117 117 THR HG22 H 1 0.997 0.010 . 1 . . . . 117 THR QG2 . 18575 1 1407 . 1 1 117 117 THR HG23 H 1 0.997 0.010 . 1 . . . . 117 THR QG2 . 18575 1 1408 . 1 1 117 117 THR C C 13 175.20 0.20 . 1 . . . . 117 THR C . 18575 1 1409 . 1 1 117 117 THR CA C 13 60.65 0.20 . 1 . . . . 117 THR CA . 18575 1 1410 . 1 1 117 117 THR CB C 13 68.32 0.20 . 1 . . . . 117 THR CB . 18575 1 1411 . 1 1 117 117 THR CG2 C 13 21.55 0.20 . 1 . . . . 117 THR CG2 . 18575 1 1412 . 1 1 117 117 THR N N 15 107.34 0.20 . 1 . . . . 117 THR N . 18575 1 1413 . 1 1 118 118 ASP H H 1 8.967 0.010 . 1 . . . . 118 ASP H . 18575 1 1414 . 1 1 118 118 ASP HA H 1 5.057 0.010 . 1 . . . . 118 ASP HA . 18575 1 1415 . 1 1 118 118 ASP HB2 H 1 2.285 0.010 . 2 . . . . 118 ASP HB2 . 18575 1 1416 . 1 1 118 118 ASP HB3 H 1 3.409 0.010 . 2 . . . . 118 ASP HB3 . 18575 1 1417 . 1 1 118 118 ASP CA C 13 50.46 0.20 . 1 . . . . 118 ASP CA . 18575 1 1418 . 1 1 118 118 ASP CB C 13 40.92 0.20 . 1 . . . . 118 ASP CB . 18575 1 1419 . 1 1 118 118 ASP N N 15 125.48 0.20 . 1 . . . . 118 ASP N . 18575 1 1420 . 1 1 119 119 PRO HA H 1 4.220 0.010 . 1 . . . . 119 PRO HA . 18575 1 1421 . 1 1 119 119 PRO HB2 H 1 1.882 0.010 . 2 . . . . 119 PRO HB2 . 18575 1 1422 . 1 1 119 119 PRO HB3 H 1 2.271 0.010 . 2 . . . . 119 PRO HB3 . 18575 1 1423 . 1 1 119 119 PRO HG2 H 1 1.895 0.010 . 2 . . . . 119 PRO HG2 . 18575 1 1424 . 1 1 119 119 PRO HG3 H 1 1.989 0.010 . 2 . . . . 119 PRO HG3 . 18575 1 1425 . 1 1 119 119 PRO HD2 H 1 3.977 0.010 . 2 . . . . 119 PRO HD2 . 18575 1 1426 . 1 1 119 119 PRO HD3 H 1 4.050 0.010 . 2 . . . . 119 PRO HD3 . 18575 1 1427 . 1 1 119 119 PRO C C 13 177.29 0.20 . 1 . . . . 119 PRO C . 18575 1 1428 . 1 1 119 119 PRO CA C 13 63.71 0.20 . 1 . . . . 119 PRO CA . 18575 1 1429 . 1 1 119 119 PRO CB C 13 31.92 0.20 . 1 . . . . 119 PRO CB . 18575 1 1430 . 1 1 119 119 PRO CG C 13 26.55 0.20 . 1 . . . . 119 PRO CG . 18575 1 1431 . 1 1 119 119 PRO CD C 13 50.79 0.20 . 1 . . . . 119 PRO CD . 18575 1 1432 . 1 1 120 120 ASN H H 1 8.214 0.010 . 1 . . . . 120 ASN H . 18575 1 1433 . 1 1 120 120 ASN HA H 1 4.657 0.010 . 1 . . . . 120 ASN HA . 18575 1 1434 . 1 1 120 120 ASN HB2 H 1 2.689 0.010 . 2 . . . . 120 ASN HB2 . 18575 1 1435 . 1 1 120 120 ASN HB3 H 1 2.813 0.010 . 2 . . . . 120 ASN HB3 . 18575 1 1436 . 1 1 120 120 ASN HD21 H 1 7.822 0.010 . 2 . . . . 120 ASN HD21 . 18575 1 1437 . 1 1 120 120 ASN HD22 H 1 6.971 0.010 . 2 . . . . 120 ASN HD22 . 18575 1 1438 . 1 1 120 120 ASN C C 13 174.85 0.20 . 1 . . . . 120 ASN C . 18575 1 1439 . 1 1 120 120 ASN CA C 13 53.49 0.20 . 1 . . . . 120 ASN CA . 18575 1 1440 . 1 1 120 120 ASN CB C 13 39.55 0.20 . 1 . . . . 120 ASN CB . 18575 1 1441 . 1 1 120 120 ASN CG C 13 177.07 0.20 . 1 . . . . 120 ASN CG . 18575 1 1442 . 1 1 120 120 ASN N N 15 113.85 0.20 . 1 . . . . 120 ASN N . 18575 1 1443 . 1 1 120 120 ASN ND2 N 15 114.60 0.20 . 1 . . . . 120 ASN ND2 . 18575 1 1444 . 1 1 121 121 GLN H H 1 7.280 0.010 . 1 . . . . 121 GLN H . 18575 1 1445 . 1 1 121 121 GLN HA H 1 4.362 0.010 . 1 . . . . 121 GLN HA . 18575 1 1446 . 1 1 121 121 GLN HB2 H 1 1.844 0.010 . 2 . . . . 121 GLN HB2 . 18575 1 1447 . 1 1 121 121 GLN HB3 H 1 1.696 0.010 . 2 . . . . 121 GLN HB3 . 18575 1 1448 . 1 1 121 121 GLN HG2 H 1 2.212 0.010 . 2 . . . . 121 GLN HG2 . 18575 1 1449 . 1 1 121 121 GLN HG3 H 1 2.110 0.010 . 2 . . . . 121 GLN HG3 . 18575 1 1450 . 1 1 121 121 GLN HE21 H 1 7.662 0.010 . 2 . . . . 121 GLN HE21 . 18575 1 1451 . 1 1 121 121 GLN HE22 H 1 6.846 0.010 . 2 . . . . 121 GLN HE22 . 18575 1 1452 . 1 1 121 121 GLN C C 13 173.01 0.20 . 1 . . . . 121 GLN C . 18575 1 1453 . 1 1 121 121 GLN CA C 13 55.58 0.20 . 1 . . . . 121 GLN CA . 18575 1 1454 . 1 1 121 121 GLN CB C 13 30.30 0.20 . 1 . . . . 121 GLN CB . 18575 1 1455 . 1 1 121 121 GLN CG C 13 33.20 0.20 . 1 . . . . 121 GLN CG . 18575 1 1456 . 1 1 121 121 GLN CD C 13 180.62 0.20 . 1 . . . . 121 GLN CD . 18575 1 1457 . 1 1 121 121 GLN N N 15 119.63 0.20 . 1 . . . . 121 GLN N . 18575 1 1458 . 1 1 121 121 GLN NE2 N 15 112.14 0.20 . 1 . . . . 121 GLN NE2 . 18575 1 1459 . 1 1 122 122 LYS H H 1 8.446 0.010 . 1 . . . . 122 LYS H . 18575 1 1460 . 1 1 122 122 LYS HA H 1 4.449 0.010 . 1 . . . . 122 LYS HA . 18575 1 1461 . 1 1 122 122 LYS HB2 H 1 1.683 0.010 . 1 . . . . 122 LYS HB2 . 18575 1 1462 . 1 1 122 122 LYS HB3 H 1 1.683 0.010 . 1 . . . . 122 LYS HB3 . 18575 1 1463 . 1 1 122 122 LYS HG2 H 1 1.489 0.010 . 1 . . . . 122 LYS HG2 . 18575 1 1464 . 1 1 122 122 LYS HG3 H 1 1.489 0.010 . 1 . . . . 122 LYS HG3 . 18575 1 1465 . 1 1 122 122 LYS HD2 H 1 1.623 0.010 . 1 . . . . 122 LYS HD2 . 18575 1 1466 . 1 1 122 122 LYS HD3 H 1 1.623 0.010 . 1 . . . . 122 LYS HD3 . 18575 1 1467 . 1 1 122 122 LYS HE2 H 1 2.976 0.010 . 2 . . . . 122 LYS HE2 . 18575 1 1468 . 1 1 122 122 LYS HE3 H 1 2.897 0.010 . 2 . . . . 122 LYS HE3 . 18575 1 1469 . 1 1 122 122 LYS C C 13 176.60 0.20 . 1 . . . . 122 LYS C . 18575 1 1470 . 1 1 122 122 LYS CA C 13 56.23 0.20 . 1 . . . . 122 LYS CA . 18575 1 1471 . 1 1 122 122 LYS CB C 13 33.66 0.20 . 1 . . . . 122 LYS CB . 18575 1 1472 . 1 1 122 122 LYS CG C 13 25.27 0.20 . 1 . . . . 122 LYS CG . 18575 1 1473 . 1 1 122 122 LYS CD C 13 29.55 0.20 . 1 . . . . 122 LYS CD . 18575 1 1474 . 1 1 122 122 LYS CE C 13 41.88 0.20 . 1 . . . . 122 LYS CE . 18575 1 1475 . 1 1 122 122 LYS N N 15 127.68 0.20 . 1 . . . . 122 LYS N . 18575 1 1476 . 1 1 123 123 ILE H H 1 8.012 0.010 . 1 . . . . 123 ILE H . 18575 1 1477 . 1 1 123 123 ILE HA H 1 3.817 0.010 . 1 . . . . 123 ILE HA . 18575 1 1478 . 1 1 123 123 ILE HB H 1 1.661 0.010 . 1 . . . . 123 ILE HB . 18575 1 1479 . 1 1 123 123 ILE HG12 H 1 1.158 0.010 . 2 . . . . 123 ILE HG12 . 18575 1 1480 . 1 1 123 123 ILE HG13 H 1 1.752 0.010 . 2 . . . . 123 ILE HG13 . 18575 1 1481 . 1 1 123 123 ILE HG21 H 1 0.120 0.010 . 1 . . . . 123 ILE QG2 . 18575 1 1482 . 1 1 123 123 ILE HG22 H 1 0.120 0.010 . 1 . . . . 123 ILE QG2 . 18575 1 1483 . 1 1 123 123 ILE HG23 H 1 0.120 0.010 . 1 . . . . 123 ILE QG2 . 18575 1 1484 . 1 1 123 123 ILE HD11 H 1 0.764 0.010 . 1 . . . . 123 ILE QD1 . 18575 1 1485 . 1 1 123 123 ILE HD12 H 1 0.764 0.010 . 1 . . . . 123 ILE QD1 . 18575 1 1486 . 1 1 123 123 ILE HD13 H 1 0.764 0.010 . 1 . . . . 123 ILE QD1 . 18575 1 1487 . 1 1 123 123 ILE C C 13 174.79 0.20 . 1 . . . . 123 ILE C . 18575 1 1488 . 1 1 123 123 ILE CA C 13 62.85 0.20 . 1 . . . . 123 ILE CA . 18575 1 1489 . 1 1 123 123 ILE CB C 13 37.50 0.20 . 1 . . . . 123 ILE CB . 18575 1 1490 . 1 1 123 123 ILE CG1 C 13 27.62 0.20 . 1 . . . . 123 ILE CG1 . 18575 1 1491 . 1 1 123 123 ILE CG2 C 13 17.06 0.20 . 1 . . . . 123 ILE CG2 . 18575 1 1492 . 1 1 123 123 ILE CD1 C 13 14.11 0.20 . 1 . . . . 123 ILE CD1 . 18575 1 1493 . 1 1 123 123 ILE N N 15 124.77 0.20 . 1 . . . . 123 ILE N . 18575 1 1494 . 1 1 124 124 LEU H H 1 7.494 0.010 . 1 . . . . 124 LEU H . 18575 1 1495 . 1 1 124 124 LEU HA H 1 4.479 0.010 . 1 . . . . 124 LEU HA . 18575 1 1496 . 1 1 124 124 LEU HB2 H 1 1.938 0.010 . 2 . . . . 124 LEU HB2 . 18575 1 1497 . 1 1 124 124 LEU HB3 H 1 0.766 0.010 . 2 . . . . 124 LEU HB3 . 18575 1 1498 . 1 1 124 124 LEU HG H 1 1.741 0.010 . 1 . . . . 124 LEU HG . 18575 1 1499 . 1 1 124 124 LEU HD11 H 1 0.643 0.010 . 2 . . . . 124 LEU QD1 . 18575 1 1500 . 1 1 124 124 LEU HD12 H 1 0.643 0.010 . 2 . . . . 124 LEU QD1 . 18575 1 1501 . 1 1 124 124 LEU HD13 H 1 0.643 0.010 . 2 . . . . 124 LEU QD1 . 18575 1 1502 . 1 1 124 124 LEU HD21 H 1 0.811 0.010 . 2 . . . . 124 LEU QD2 . 18575 1 1503 . 1 1 124 124 LEU HD22 H 1 0.811 0.010 . 2 . . . . 124 LEU QD2 . 18575 1 1504 . 1 1 124 124 LEU HD23 H 1 0.811 0.010 . 2 . . . . 124 LEU QD2 . 18575 1 1505 . 1 1 124 124 LEU C C 13 176.20 0.20 . 1 . . . . 124 LEU C . 18575 1 1506 . 1 1 124 124 LEU CA C 13 53.51 0.20 . 1 . . . . 124 LEU CA . 18575 1 1507 . 1 1 124 124 LEU CB C 13 44.34 0.20 . 1 . . . . 124 LEU CB . 18575 1 1508 . 1 1 124 124 LEU CG C 13 25.49 0.20 . 1 . . . . 124 LEU CG . 18575 1 1509 . 1 1 124 124 LEU CD1 C 13 22.35 0.20 . 2 . . . . 124 LEU CD1 . 18575 1 1510 . 1 1 124 124 LEU CD2 C 13 25.07 0.20 . 2 . . . . 124 LEU CD2 . 18575 1 1511 . 1 1 124 124 LEU N N 15 124.86 0.20 . 1 . . . . 124 LEU N . 18575 1 1512 . 1 1 125 125 TYR H H 1 8.204 0.010 . 1 . . . . 125 TYR H . 18575 1 1513 . 1 1 125 125 TYR HA H 1 5.522 0.010 . 1 . . . . 125 TYR HA . 18575 1 1514 . 1 1 125 125 TYR HB2 H 1 2.869 0.010 . 2 . . . . 125 TYR HB2 . 18575 1 1515 . 1 1 125 125 TYR HB3 H 1 2.529 0.010 . 2 . . . . 125 TYR HB3 . 18575 1 1516 . 1 1 125 125 TYR HD1 H 1 6.983 0.010 . 3 . . . . 125 TYR HD1 . 18575 1 1517 . 1 1 125 125 TYR HD2 H 1 6.983 0.010 . 3 . . . . 125 TYR HD2 . 18575 1 1518 . 1 1 125 125 TYR HE1 H 1 6.400 0.010 . 3 . . . . 125 TYR HE1 . 18575 1 1519 . 1 1 125 125 TYR HE2 H 1 6.400 0.010 . 3 . . . . 125 TYR HE2 . 18575 1 1520 . 1 1 125 125 TYR HH H 1 9.306 0.010 . 1 . . . . 125 TYR HH . 18575 1 1521 . 1 1 125 125 TYR C C 13 177.36 0.20 . 1 . . . . 125 TYR C . 18575 1 1522 . 1 1 125 125 TYR CA C 13 57.94 0.20 . 1 . . . . 125 TYR CA . 18575 1 1523 . 1 1 125 125 TYR CB C 13 43.88 0.20 . 1 . . . . 125 TYR CB . 18575 1 1524 . 1 1 125 125 TYR N N 15 116.04 0.20 . 1 . . . . 125 TYR N . 18575 1 1525 . 1 1 126 126 THR H H 1 8.772 0.010 . 1 . . . . 126 THR H . 18575 1 1526 . 1 1 126 126 THR HA H 1 5.250 0.010 . 1 . . . . 126 THR HA . 18575 1 1527 . 1 1 126 126 THR HB H 1 4.086 0.010 . 1 . . . . 126 THR HB . 18575 1 1528 . 1 1 126 126 THR HG1 H 1 6.211 0.010 . 1 . . . . 126 THR HG1 . 18575 1 1529 . 1 1 126 126 THR HG21 H 1 1.087 0.010 . 1 . . . . 126 THR QG2 . 18575 1 1530 . 1 1 126 126 THR HG22 H 1 1.087 0.010 . 1 . . . . 126 THR QG2 . 18575 1 1531 . 1 1 126 126 THR HG23 H 1 1.087 0.010 . 1 . . . . 126 THR QG2 . 18575 1 1532 . 1 1 126 126 THR C C 13 173.22 0.20 . 1 . . . . 126 THR C . 18575 1 1533 . 1 1 126 126 THR CA C 13 62.36 0.20 . 1 . . . . 126 THR CA . 18575 1 1534 . 1 1 126 126 THR CB C 13 70.59 0.20 . 1 . . . . 126 THR CB . 18575 1 1535 . 1 1 126 126 THR CG2 C 13 19.84 0.20 . 1 . . . . 126 THR CG2 . 18575 1 1536 . 1 1 126 126 THR N N 15 121.24 0.20 . 1 . . . . 126 THR N . 18575 1 1537 . 1 1 127 127 SER H H 1 9.502 0.010 . 1 . . . . 127 SER H . 18575 1 1538 . 1 1 127 127 SER HA H 1 5.303 0.010 . 1 . . . . 127 SER HA . 18575 1 1539 . 1 1 127 127 SER HB2 H 1 4.736 0.010 . 2 . . . . 127 SER HB2 . 18575 1 1540 . 1 1 127 127 SER HB3 H 1 3.482 0.010 . 2 . . . . 127 SER HB3 . 18575 1 1541 . 1 1 127 127 SER C C 13 172.16 0.20 . 1 . . . . 127 SER C . 18575 1 1542 . 1 1 127 127 SER CA C 13 54.39 0.20 . 1 . . . . 127 SER CA . 18575 1 1543 . 1 1 127 127 SER CB C 13 64.01 0.20 . 1 . . . . 127 SER CB . 18575 1 1544 . 1 1 127 127 SER N N 15 121.47 0.20 . 1 . . . . 127 SER N . 18575 1 1545 . 1 1 128 128 ILE H H 1 9.001 0.010 . 1 . . . . 128 ILE H . 18575 1 1546 . 1 1 128 128 ILE HA H 1 4.944 0.010 . 1 . . . . 128 ILE HA . 18575 1 1547 . 1 1 128 128 ILE HB H 1 1.922 0.010 . 1 . . . . 128 ILE HB . 18575 1 1548 . 1 1 128 128 ILE HG12 H 1 0.765 0.010 . 2 . . . . 128 ILE HG12 . 18575 1 1549 . 1 1 128 128 ILE HG13 H 1 1.627 0.010 . 2 . . . . 128 ILE HG13 . 18575 1 1550 . 1 1 128 128 ILE HG21 H 1 0.729 0.010 . 1 . . . . 128 ILE QG2 . 18575 1 1551 . 1 1 128 128 ILE HG22 H 1 0.729 0.010 . 1 . . . . 128 ILE QG2 . 18575 1 1552 . 1 1 128 128 ILE HG23 H 1 0.729 0.010 . 1 . . . . 128 ILE QG2 . 18575 1 1553 . 1 1 128 128 ILE HD11 H 1 0.699 0.010 . 1 . . . . 128 ILE QD1 . 18575 1 1554 . 1 1 128 128 ILE HD12 H 1 0.699 0.010 . 1 . . . . 128 ILE QD1 . 18575 1 1555 . 1 1 128 128 ILE HD13 H 1 0.699 0.010 . 1 . . . . 128 ILE QD1 . 18575 1 1556 . 1 1 128 128 ILE C C 13 176.18 0.20 . 1 . . . . 128 ILE C . 18575 1 1557 . 1 1 128 128 ILE CA C 13 60.12 0.20 . 1 . . . . 128 ILE CA . 18575 1 1558 . 1 1 128 128 ILE CB C 13 39.58 0.20 . 1 . . . . 128 ILE CB . 18575 1 1559 . 1 1 128 128 ILE CG1 C 13 27.55 0.20 . 1 . . . . 128 ILE CG1 . 18575 1 1560 . 1 1 128 128 ILE CG2 C 13 17.42 0.20 . 1 . . . . 128 ILE CG2 . 18575 1 1561 . 1 1 128 128 ILE CD1 C 13 15.96 0.20 . 1 . . . . 128 ILE CD1 . 18575 1 1562 . 1 1 128 128 ILE N N 15 126.86 0.20 . 1 . . . . 128 ILE N . 18575 1 1563 . 1 1 129 129 TYR H H 1 8.558 0.010 . 1 . . . . 129 TYR H . 18575 1 1564 . 1 1 129 129 TYR HA H 1 5.116 0.010 . 1 . . . . 129 TYR HA . 18575 1 1565 . 1 1 129 129 TYR HB2 H 1 3.125 0.010 . 2 . . . . 129 TYR HB2 . 18575 1 1566 . 1 1 129 129 TYR HB3 H 1 2.899 0.010 . 2 . . . . 129 TYR HB3 . 18575 1 1567 . 1 1 129 129 TYR HD1 H 1 6.979 0.010 . 3 . . . . 129 TYR HD1 . 18575 1 1568 . 1 1 129 129 TYR HD2 H 1 6.979 0.010 . 3 . . . . 129 TYR HD2 . 18575 1 1569 . 1 1 129 129 TYR HE1 H 1 6.572 0.010 . 3 . . . . 129 TYR HE1 . 18575 1 1570 . 1 1 129 129 TYR HE2 H 1 6.572 0.010 . 3 . . . . 129 TYR HE2 . 18575 1 1571 . 1 1 129 129 TYR C C 13 172.60 0.20 . 1 . . . . 129 TYR C . 18575 1 1572 . 1 1 129 129 TYR CA C 13 54.50 0.20 . 1 . . . . 129 TYR CA . 18575 1 1573 . 1 1 129 129 TYR CB C 13 39.03 0.20 . 1 . . . . 129 TYR CB . 18575 1 1574 . 1 1 129 129 TYR CD1 C 13 131.24 0.20 . 3 . . . . 129 TYR CD1 . 18575 1 1575 . 1 1 129 129 TYR CD2 C 13 131.24 0.20 . 3 . . . . 129 TYR CD2 . 18575 1 1576 . 1 1 129 129 TYR CE1 C 13 116.83 0.20 . 3 . . . . 129 TYR CE1 . 18575 1 1577 . 1 1 129 129 TYR CE2 C 13 116.83 0.20 . 3 . . . . 129 TYR CE2 . 18575 1 1578 . 1 1 129 129 TYR N N 15 128.26 0.20 . 1 . . . . 129 TYR N . 18575 1 1579 . 1 1 130 130 SER H H 1 10.326 0.010 . 1 . . . . 130 SER H . 18575 1 1580 . 1 1 130 130 SER HA H 1 5.369 0.010 . 1 . . . . 130 SER HA . 18575 1 1581 . 1 1 130 130 SER HB2 H 1 3.302 0.010 . 2 . . . . 130 SER HB2 . 18575 1 1582 . 1 1 130 130 SER HB3 H 1 3.653 0.010 . 2 . . . . 130 SER HB3 . 18575 1 1583 . 1 1 130 130 SER HG H 1 7.355 0.010 . 1 . . . . 130 SER HG . 18575 1 1584 . 1 1 130 130 SER C C 13 178.26 0.20 . 1 . . . . 130 SER C . 18575 1 1585 . 1 1 130 130 SER CA C 13 52.99 0.20 . 1 . . . . 130 SER CA . 18575 1 1586 . 1 1 130 130 SER CB C 13 65.32 0.20 . 1 . . . . 130 SER CB . 18575 1 1587 . 1 1 130 130 SER N N 15 113.74 0.20 . 1 . . . . 130 SER N . 18575 1 1588 . 1 1 131 131 SER H H 1 9.377 0.010 . 1 . . . . 131 SER H . 18575 1 1589 . 1 1 131 131 SER HA H 1 4.715 0.010 . 1 . . . . 131 SER HA . 18575 1 1590 . 1 1 131 131 SER HB2 H 1 4.253 0.010 . 2 . . . . 131 SER HB2 . 18575 1 1591 . 1 1 131 131 SER HB3 H 1 4.006 0.010 . 2 . . . . 131 SER HB3 . 18575 1 1592 . 1 1 131 131 SER C C 13 174.98 0.20 . 1 . . . . 131 SER C . 18575 1 1593 . 1 1 131 131 SER CA C 13 60.15 0.20 . 1 . . . . 131 SER CA . 18575 1 1594 . 1 1 131 131 SER CB C 13 61.96 0.20 . 1 . . . . 131 SER CB . 18575 1 1595 . 1 1 131 131 SER N N 15 127.45 0.20 . 1 . . . . 131 SER N . 18575 1 1596 . 1 1 132 132 ALA H H 1 7.980 0.010 . 1 . . . . 132 ALA H . 18575 1 1597 . 1 1 132 132 ALA HA H 1 4.633 0.010 . 1 . . . . 132 ALA HA . 18575 1 1598 . 1 1 132 132 ALA HB1 H 1 1.211 0.010 . 1 . . . . 132 ALA QB . 18575 1 1599 . 1 1 132 132 ALA HB2 H 1 1.211 0.010 . 1 . . . . 132 ALA QB . 18575 1 1600 . 1 1 132 132 ALA HB3 H 1 1.211 0.010 . 1 . . . . 132 ALA QB . 18575 1 1601 . 1 1 132 132 ALA C C 13 176.31 0.20 . 1 . . . . 132 ALA C . 18575 1 1602 . 1 1 132 132 ALA CA C 13 51.55 0.20 . 1 . . . . 132 ALA CA . 18575 1 1603 . 1 1 132 132 ALA CB C 13 18.02 0.20 . 1 . . . . 132 ALA CB . 18575 1 1604 . 1 1 132 132 ALA N N 15 124.33 0.20 . 1 . . . . 132 ALA N . 18575 1 1605 . 1 1 133 133 ASP H H 1 7.491 0.010 . 1 . . . . 133 ASP H . 18575 1 1606 . 1 1 133 133 ASP HA H 1 4.292 0.010 . 1 . . . . 133 ASP HA . 18575 1 1607 . 1 1 133 133 ASP HB2 H 1 2.749 0.010 . 2 . . . . 133 ASP HB2 . 18575 1 1608 . 1 1 133 133 ASP HB3 H 1 3.310 0.010 . 2 . . . . 133 ASP HB3 . 18575 1 1609 . 1 1 133 133 ASP C C 13 175.89 0.20 . 1 . . . . 133 ASP C . 18575 1 1610 . 1 1 133 133 ASP CA C 13 55.72 0.20 . 1 . . . . 133 ASP CA . 18575 1 1611 . 1 1 133 133 ASP CB C 13 42.12 0.20 . 1 . . . . 133 ASP CB . 18575 1 1612 . 1 1 133 133 ASP N N 15 120.67 0.20 . 1 . . . . 133 ASP N . 18575 1 1613 . 1 1 134 134 ASP H H 1 8.671 0.010 . 1 . . . . 134 ASP H . 18575 1 1614 . 1 1 134 134 ASP HA H 1 4.597 0.010 . 1 . . . . 134 ASP HA . 18575 1 1615 . 1 1 134 134 ASP HB2 H 1 2.852 0.010 . 2 . . . . 134 ASP HB2 . 18575 1 1616 . 1 1 134 134 ASP HB3 H 1 2.617 0.010 . 2 . . . . 134 ASP HB3 . 18575 1 1617 . 1 1 134 134 ASP C C 13 175.37 0.20 . 1 . . . . 134 ASP C . 18575 1 1618 . 1 1 134 134 ASP CA C 13 53.65 0.20 . 1 . . . . 134 ASP CA . 18575 1 1619 . 1 1 134 134 ASP CB C 13 40.03 0.20 . 1 . . . . 134 ASP CB . 18575 1 1620 . 1 1 134 134 ASP N N 15 126.01 0.20 . 1 . . . . 134 ASP N . 18575 1 1621 . 1 1 135 135 ILE H H 1 9.368 0.010 . 1 . . . . 135 ILE H . 18575 1 1622 . 1 1 135 135 ILE HA H 1 3.972 0.010 . 1 . . . . 135 ILE HA . 18575 1 1623 . 1 1 135 135 ILE HB H 1 0.983 0.010 . 1 . . . . 135 ILE HB . 18575 1 1624 . 1 1 135 135 ILE HG12 H 1 1.304 0.010 . 1 . . . . 135 ILE HG12 . 18575 1 1625 . 1 1 135 135 ILE HG13 H 1 1.304 0.010 . 1 . . . . 135 ILE HG13 . 18575 1 1626 . 1 1 135 135 ILE HG21 H 1 0.430 0.010 . 1 . . . . 135 ILE QG2 . 18575 1 1627 . 1 1 135 135 ILE HG22 H 1 0.430 0.010 . 1 . . . . 135 ILE QG2 . 18575 1 1628 . 1 1 135 135 ILE HG23 H 1 0.430 0.010 . 1 . . . . 135 ILE QG2 . 18575 1 1629 . 1 1 135 135 ILE HD11 H 1 0.658 0.010 . 1 . . . . 135 ILE QD1 . 18575 1 1630 . 1 1 135 135 ILE HD12 H 1 0.658 0.010 . 1 . . . . 135 ILE QD1 . 18575 1 1631 . 1 1 135 135 ILE HD13 H 1 0.658 0.010 . 1 . . . . 135 ILE QD1 . 18575 1 1632 . 1 1 135 135 ILE C C 13 176.49 0.20 . 1 . . . . 135 ILE C . 18575 1 1633 . 1 1 135 135 ILE CA C 13 60.99 0.20 . 1 . . . . 135 ILE CA . 18575 1 1634 . 1 1 135 135 ILE CB C 13 36.92 0.20 . 1 . . . . 135 ILE CB . 18575 1 1635 . 1 1 135 135 ILE CG1 C 13 26.61 0.20 . 1 . . . . 135 ILE CG1 . 18575 1 1636 . 1 1 135 135 ILE CG2 C 13 16.36 0.20 . 1 . . . . 135 ILE CG2 . 18575 1 1637 . 1 1 135 135 ILE CD1 C 13 9.59 0.20 . 1 . . . . 135 ILE CD1 . 18575 1 1638 . 1 1 135 135 ILE N N 15 123.30 0.20 . 1 . . . . 135 ILE N . 18575 1 1639 . 1 1 136 136 VAL H H 1 8.197 0.010 . 1 . . . . 136 VAL H . 18575 1 1640 . 1 1 136 136 VAL HA H 1 3.917 0.010 . 1 . . . . 136 VAL HA . 18575 1 1641 . 1 1 136 136 VAL HB H 1 1.681 0.010 . 1 . . . . 136 VAL HB . 18575 1 1642 . 1 1 136 136 VAL HG11 H 1 0.492 0.010 . 2 . . . . 136 VAL QG1 . 18575 1 1643 . 1 1 136 136 VAL HG12 H 1 0.492 0.010 . 2 . . . . 136 VAL QG1 . 18575 1 1644 . 1 1 136 136 VAL HG13 H 1 0.492 0.010 . 2 . . . . 136 VAL QG1 . 18575 1 1645 . 1 1 136 136 VAL HG21 H 1 0.646 0.010 . 2 . . . . 136 VAL QG2 . 18575 1 1646 . 1 1 136 136 VAL HG22 H 1 0.646 0.010 . 2 . . . . 136 VAL QG2 . 18575 1 1647 . 1 1 136 136 VAL HG23 H 1 0.646 0.010 . 2 . . . . 136 VAL QG2 . 18575 1 1648 . 1 1 136 136 VAL CA C 13 60.80 0.20 . 1 . . . . 136 VAL CA . 18575 1 1649 . 1 1 136 136 VAL CB C 13 32.85 0.20 . 1 . . . . 136 VAL CB . 18575 1 1650 . 1 1 136 136 VAL CG1 C 13 21.06 0.20 . 2 . . . . 136 VAL CG1 . 18575 1 1651 . 1 1 136 136 VAL CG2 C 13 22.26 0.20 . 2 . . . . 136 VAL CG2 . 18575 1 1652 . 1 1 136 136 VAL N N 15 122.92 0.20 . 1 . . . . 136 VAL N . 18575 1 1653 . 1 1 137 137 MET H H 1 8.425 0.010 . 1 . . . . 137 MET H . 18575 1 1654 . 1 1 137 137 MET HE1 H 1 2.009 0.010 . 1 . . . . 137 MET HE . 18575 1 1655 . 1 1 137 137 MET HE2 H 1 2.009 0.010 . 1 . . . . 137 MET HE . 18575 1 1656 . 1 1 137 137 MET HE3 H 1 2.009 0.010 . 1 . . . . 137 MET HE . 18575 1 1657 . 1 1 137 137 MET C C 13 178.05 0.20 . 1 . . . . 137 MET C . 18575 1 1658 . 1 1 137 137 MET CE C 13 17.12 0.20 . 1 . . . . 137 MET CE . 18575 1 1659 . 1 1 138 138 ASN H H 1 9.404 0.010 . 1 . . . . 138 ASN H . 18575 1 1660 . 1 1 138 138 ASN HD21 H 1 7.867 0.010 . 2 . . . . 138 ASN HD21 . 18575 1 1661 . 1 1 138 138 ASN CG C 13 176.40 0.20 . 1 . . . . 138 ASN CG . 18575 1 1662 . 1 1 138 138 ASN N N 15 120.68 0.20 . 1 . . . . 138 ASN N . 18575 1 1663 . 1 1 138 138 ASN ND2 N 15 112.17 0.20 . 1 . . . . 138 ASN ND2 . 18575 1 1664 . 1 1 139 139 CYS HA H 1 4.110 0.010 . 1 . . . . 139 CYS HA . 18575 1 1665 . 1 1 139 139 CYS HB2 H 1 3.019 0.010 . 2 . . . . 139 CYS HB2 . 18575 1 1666 . 1 1 139 139 CYS HB3 H 1 2.836 0.010 . 2 . . . . 139 CYS HB3 . 18575 1 1667 . 1 1 139 139 CYS C C 13 175.51 0.20 . 1 . . . . 139 CYS C . 18575 1 1668 . 1 1 139 139 CYS CA C 13 58.82 0.20 . 1 . . . . 139 CYS CA . 18575 1 1669 . 1 1 139 139 CYS CB C 13 26.10 0.20 . 1 . . . . 139 CYS CB . 18575 1 1670 . 1 1 140 140 LEU H H 1 7.492 0.010 . 1 . . . . 140 LEU H . 18575 1 1671 . 1 1 140 140 LEU HA H 1 3.989 0.010 . 1 . . . . 140 LEU HA . 18575 1 1672 . 1 1 140 140 LEU HB2 H 1 1.959 0.010 . 2 . . . . 140 LEU HB2 . 18575 1 1673 . 1 1 140 140 LEU HB3 H 1 1.083 0.010 . 2 . . . . 140 LEU HB3 . 18575 1 1674 . 1 1 140 140 LEU HG H 1 1.565 0.010 . 1 . . . . 140 LEU HG . 18575 1 1675 . 1 1 140 140 LEU HD11 H 1 0.776 0.010 . 2 . . . . 140 LEU QD1 . 18575 1 1676 . 1 1 140 140 LEU HD12 H 1 0.776 0.010 . 2 . . . . 140 LEU QD1 . 18575 1 1677 . 1 1 140 140 LEU HD13 H 1 0.776 0.010 . 2 . . . . 140 LEU QD1 . 18575 1 1678 . 1 1 140 140 LEU C C 13 177.61 0.20 . 1 . . . . 140 LEU C . 18575 1 1679 . 1 1 140 140 LEU CA C 13 55.50 0.20 . 1 . . . . 140 LEU CA . 18575 1 1680 . 1 1 140 140 LEU CB C 13 43.11 0.20 . 1 . . . . 140 LEU CB . 18575 1 1681 . 1 1 140 140 LEU CG C 13 29.67 0.20 . 1 . . . . 140 LEU CG . 18575 1 1682 . 1 1 140 140 LEU N N 15 118.29 0.20 . 1 . . . . 140 LEU N . 18575 1 1683 . 1 1 141 141 SER H H 1 7.264 0.010 . 1 . . . . 141 SER H . 18575 1 1684 . 1 1 141 141 SER HA H 1 4.598 0.010 . 1 . . . . 141 SER HA . 18575 1 1685 . 1 1 141 141 SER HB2 H 1 3.130 0.010 . 2 . . . . 141 SER HB2 . 18575 1 1686 . 1 1 141 141 SER HB3 H 1 3.805 0.010 . 2 . . . . 141 SER HB3 . 18575 1 1687 . 1 1 141 141 SER C C 13 176.05 0.20 . 1 . . . . 141 SER C . 18575 1 1688 . 1 1 141 141 SER CA C 13 58.93 0.20 . 1 . . . . 141 SER CA . 18575 1 1689 . 1 1 141 141 SER CB C 13 64.63 0.20 . 1 . . . . 141 SER CB . 18575 1 1690 . 1 1 141 141 SER N N 15 113.11 0.20 . 1 . . . . 141 SER N . 18575 1 1691 . 1 1 142 142 ARG H H 1 6.723 0.010 . 1 . . . . 142 ARG H . 18575 1 1692 . 1 1 142 142 ARG HA H 1 3.878 0.010 . 1 . . . . 142 ARG HA . 18575 1 1693 . 1 1 142 142 ARG HB2 H 1 1.537 0.010 . 2 . . . . 142 ARG HB2 . 18575 1 1694 . 1 1 142 142 ARG HB3 H 1 1.349 0.010 . 2 . . . . 142 ARG HB3 . 18575 1 1695 . 1 1 142 142 ARG HG2 H 1 1.260 0.010 . 1 . . . . 142 ARG HG2 . 18575 1 1696 . 1 1 142 142 ARG HG3 H 1 1.260 0.010 . 1 . . . . 142 ARG HG3 . 18575 1 1697 . 1 1 142 142 ARG HD2 H 1 3.064 0.010 . 2 . . . . 142 ARG HD2 . 18575 1 1698 . 1 1 142 142 ARG HD3 H 1 3.005 0.010 . 2 . . . . 142 ARG HD3 . 18575 1 1699 . 1 1 142 142 ARG HE H 1 7.592 0.010 . 1 . . . . 142 ARG HE . 18575 1 1700 . 1 1 142 142 ARG C C 13 174.70 0.20 . 1 . . . . 142 ARG C . 18575 1 1701 . 1 1 142 142 ARG CA C 13 57.31 0.20 . 1 . . . . 142 ARG CA . 18575 1 1702 . 1 1 142 142 ARG CB C 13 30.16 0.20 . 1 . . . . 142 ARG CB . 18575 1 1703 . 1 1 142 142 ARG CG C 13 27.27 0.20 . 1 . . . . 142 ARG CG . 18575 1 1704 . 1 1 142 142 ARG CD C 13 42.79 0.20 . 1 . . . . 142 ARG CD . 18575 1 1705 . 1 1 142 142 ARG N N 15 125.27 0.20 . 1 . . . . 142 ARG N . 18575 1 1706 . 1 1 143 143 LEU H H 1 8.763 0.010 . 1 . . . . 143 LEU H . 18575 1 1707 . 1 1 143 143 LEU HA H 1 4.651 0.010 . 1 . . . . 143 LEU HA . 18575 1 1708 . 1 1 143 143 LEU HB2 H 1 1.275 0.010 . 2 . . . . 143 LEU HB2 . 18575 1 1709 . 1 1 143 143 LEU HB3 H 1 0.813 0.010 . 2 . . . . 143 LEU HB3 . 18575 1 1710 . 1 1 143 143 LEU HG H 1 1.274 0.010 . 1 . . . . 143 LEU HG . 18575 1 1711 . 1 1 143 143 LEU HD11 H 1 0.433 0.010 . 2 . . . . 143 LEU QD1 . 18575 1 1712 . 1 1 143 143 LEU HD12 H 1 0.433 0.010 . 2 . . . . 143 LEU QD1 . 18575 1 1713 . 1 1 143 143 LEU HD13 H 1 0.433 0.010 . 2 . . . . 143 LEU QD1 . 18575 1 1714 . 1 1 143 143 LEU HD21 H 1 0.460 0.010 . 2 . . . . 143 LEU QD2 . 18575 1 1715 . 1 1 143 143 LEU HD22 H 1 0.460 0.010 . 2 . . . . 143 LEU QD2 . 18575 1 1716 . 1 1 143 143 LEU HD23 H 1 0.460 0.010 . 2 . . . . 143 LEU QD2 . 18575 1 1717 . 1 1 143 143 LEU C C 13 176.95 0.20 . 1 . . . . 143 LEU C . 18575 1 1718 . 1 1 143 143 LEU CA C 13 52.19 0.20 . 1 . . . . 143 LEU CA . 18575 1 1719 . 1 1 143 143 LEU CB C 13 46.53 0.20 . 1 . . . . 143 LEU CB . 18575 1 1720 . 1 1 143 143 LEU CG C 13 24.66 0.20 . 1 . . . . 143 LEU CG . 18575 1 1721 . 1 1 143 143 LEU CD1 C 13 23.67 0.20 . 2 . . . . 143 LEU CD1 . 18575 1 1722 . 1 1 143 143 LEU CD2 C 13 25.09 0.20 . 2 . . . . 143 LEU CD2 . 18575 1 1723 . 1 1 143 143 LEU N N 15 125.38 0.20 . 1 . . . . 143 LEU N . 18575 1 1724 . 1 1 144 144 ASP H H 1 9.489 0.010 . 1 . . . . 144 ASP H . 18575 1 1725 . 1 1 144 144 ASP HA H 1 4.623 0.010 . 1 . . . . 144 ASP HA . 18575 1 1726 . 1 1 144 144 ASP HB2 H 1 2.658 0.010 . 2 . . . . 144 ASP HB2 . 18575 1 1727 . 1 1 144 144 ASP HB3 H 1 2.802 0.010 . 2 . . . . 144 ASP HB3 . 18575 1 1728 . 1 1 144 144 ASP CA C 13 56.74 0.20 . 1 . . . . 144 ASP CA . 18575 1 1729 . 1 1 144 144 ASP CB C 13 39.19 0.20 . 1 . . . . 144 ASP CB . 18575 1 1730 . 1 1 144 144 ASP N N 15 127.74 0.20 . 1 . . . . 144 ASP N . 18575 1 1731 . 1 1 145 145 GLY H H 1 8.815 0.010 . 1 . . . . 145 GLY H . 18575 1 1732 . 1 1 145 145 GLY HA2 H 1 4.189 0.010 . 2 . . . . 145 GLY HA2 . 18575 1 1733 . 1 1 145 145 GLY HA3 H 1 3.852 0.010 . 2 . . . . 145 GLY HA3 . 18575 1 1734 . 1 1 145 145 GLY C C 13 173.40 0.20 . 1 . . . . 145 GLY C . 18575 1 1735 . 1 1 145 145 GLY CA C 13 44.75 0.20 . 1 . . . . 145 GLY CA . 18575 1 1736 . 1 1 145 145 GLY N N 15 115.98 0.20 . 1 . . . . 145 GLY N . 18575 1 1737 . 1 1 146 146 ALA H H 1 7.084 0.010 . 1 . . . . 146 ALA H . 18575 1 1738 . 1 1 146 146 ALA HA H 1 4.629 0.010 . 1 . . . . 146 ALA HA . 18575 1 1739 . 1 1 146 146 ALA HB1 H 1 1.186 0.010 . 1 . . . . 146 ALA QB . 18575 1 1740 . 1 1 146 146 ALA HB2 H 1 1.186 0.010 . 1 . . . . 146 ALA QB . 18575 1 1741 . 1 1 146 146 ALA HB3 H 1 1.186 0.010 . 1 . . . . 146 ALA QB . 18575 1 1742 . 1 1 146 146 ALA C C 13 176.23 0.20 . 1 . . . . 146 ALA C . 18575 1 1743 . 1 1 146 146 ALA CA C 13 49.74 0.20 . 1 . . . . 146 ALA CA . 18575 1 1744 . 1 1 146 146 ALA CB C 13 22.85 0.20 . 1 . . . . 146 ALA CB . 18575 1 1745 . 1 1 146 146 ALA N N 15 117.92 0.20 . 1 . . . . 146 ALA N . 18575 1 1746 . 1 1 147 147 ARG H H 1 7.429 0.010 . 1 . . . . 147 ARG H . 18575 1 1747 . 1 1 147 147 ARG HA H 1 4.523 0.010 . 1 . . . . 147 ARG HA . 18575 1 1748 . 1 1 147 147 ARG HB2 H 1 1.645 0.010 . 2 . . . . 147 ARG HB2 . 18575 1 1749 . 1 1 147 147 ARG HB3 H 1 2.411 0.010 . 2 . . . . 147 ARG HB3 . 18575 1 1750 . 1 1 147 147 ARG HG2 H 1 1.304 0.010 . 2 . . . . 147 ARG HG2 . 18575 1 1751 . 1 1 147 147 ARG HG3 H 1 1.645 0.010 . 2 . . . . 147 ARG HG3 . 18575 1 1752 . 1 1 147 147 ARG HD2 H 1 3.069 0.010 . 2 . . . . 147 ARG HD2 . 18575 1 1753 . 1 1 147 147 ARG HD3 H 1 3.219 0.010 . 2 . . . . 147 ARG HD3 . 18575 1 1754 . 1 1 147 147 ARG C C 13 173.82 0.20 . 1 . . . . 147 ARG C . 18575 1 1755 . 1 1 147 147 ARG CA C 13 56.64 0.20 . 1 . . . . 147 ARG CA . 18575 1 1756 . 1 1 147 147 ARG CB C 13 29.61 0.20 . 1 . . . . 147 ARG CB . 18575 1 1757 . 1 1 147 147 ARG CG C 13 26.80 0.20 . 1 . . . . 147 ARG CG . 18575 1 1758 . 1 1 147 147 ARG CD C 13 43.68 0.20 . 1 . . . . 147 ARG CD . 18575 1 1759 . 1 1 147 147 ARG N N 15 118.74 0.20 . 1 . . . . 147 ARG N . 18575 1 1760 . 1 1 148 148 ASN H H 1 8.699 0.010 . 1 . . . . 148 ASN H . 18575 1 1761 . 1 1 148 148 ASN HA H 1 5.559 0.010 . 1 . . . . 148 ASN HA . 18575 1 1762 . 1 1 148 148 ASN HB2 H 1 3.294 0.010 . 2 . . . . 148 ASN HB2 . 18575 1 1763 . 1 1 148 148 ASN HB3 H 1 2.739 0.010 . 2 . . . . 148 ASN HB3 . 18575 1 1764 . 1 1 148 148 ASN HD21 H 1 7.193 0.010 . 2 . . . . 148 ASN HD21 . 18575 1 1765 . 1 1 148 148 ASN HD22 H 1 7.632 0.010 . 2 . . . . 148 ASN HD22 . 18575 1 1766 . 1 1 148 148 ASN C C 13 174.60 0.20 . 1 . . . . 148 ASN C . 18575 1 1767 . 1 1 148 148 ASN CA C 13 53.34 0.20 . 1 . . . . 148 ASN CA . 18575 1 1768 . 1 1 148 148 ASN CB C 13 40.22 0.20 . 1 . . . . 148 ASN CB . 18575 1 1769 . 1 1 148 148 ASN CG C 13 176.21 0.20 . 1 . . . . 148 ASN CG . 18575 1 1770 . 1 1 148 148 ASN N N 15 130.24 0.20 . 1 . . . . 148 ASN N . 18575 1 1771 . 1 1 148 148 ASN ND2 N 15 115.42 0.20 . 1 . . . . 148 ASN ND2 . 18575 1 1772 . 1 1 149 149 VAL H H 1 9.438 0.010 . 1 . . . . 149 VAL H . 18575 1 1773 . 1 1 149 149 VAL HA H 1 3.958 0.010 . 1 . . . . 149 VAL HA . 18575 1 1774 . 1 1 149 149 VAL HB H 1 1.775 0.010 . 1 . . . . 149 VAL HB . 18575 1 1775 . 1 1 149 149 VAL HG11 H 1 0.722 0.010 . 2 . . . . 149 VAL QG1 . 18575 1 1776 . 1 1 149 149 VAL HG12 H 1 0.722 0.010 . 2 . . . . 149 VAL QG1 . 18575 1 1777 . 1 1 149 149 VAL HG13 H 1 0.722 0.010 . 2 . . . . 149 VAL QG1 . 18575 1 1778 . 1 1 149 149 VAL HG21 H 1 0.693 0.010 . 2 . . . . 149 VAL QG2 . 18575 1 1779 . 1 1 149 149 VAL HG22 H 1 0.693 0.010 . 2 . . . . 149 VAL QG2 . 18575 1 1780 . 1 1 149 149 VAL HG23 H 1 0.693 0.010 . 2 . . . . 149 VAL QG2 . 18575 1 1781 . 1 1 149 149 VAL C C 13 171.45 0.20 . 1 . . . . 149 VAL C . 18575 1 1782 . 1 1 149 149 VAL CA C 13 61.31 0.20 . 1 . . . . 149 VAL CA . 18575 1 1783 . 1 1 149 149 VAL CB C 13 33.94 0.20 . 1 . . . . 149 VAL CB . 18575 1 1784 . 1 1 149 149 VAL CG1 C 13 21.17 0.20 . 2 . . . . 149 VAL CG1 . 18575 1 1785 . 1 1 149 149 VAL CG2 C 13 19.97 0.20 . 2 . . . . 149 VAL CG2 . 18575 1 1786 . 1 1 149 149 VAL N N 15 127.00 0.20 . 1 . . . . 149 VAL N . 18575 1 1787 . 1 1 150 150 GLN H H 1 8.046 0.010 . 1 . . . . 150 GLN H . 18575 1 1788 . 1 1 150 150 GLN HA H 1 4.176 0.010 . 1 . . . . 150 GLN HA . 18575 1 1789 . 1 1 150 150 GLN HB2 H 1 1.983 0.010 . 2 . . . . 150 GLN HB2 . 18575 1 1790 . 1 1 150 150 GLN HB3 H 1 1.634 0.010 . 2 . . . . 150 GLN HB3 . 18575 1 1791 . 1 1 150 150 GLN HG2 H 1 2.054 0.010 . 2 . . . . 150 GLN HG2 . 18575 1 1792 . 1 1 150 150 GLN HG3 H 1 1.710 0.010 . 2 . . . . 150 GLN HG3 . 18575 1 1793 . 1 1 150 150 GLN HE21 H 1 7.256 0.010 . 2 . . . . 150 GLN HE21 . 18575 1 1794 . 1 1 150 150 GLN HE22 H 1 7.050 0.010 . 2 . . . . 150 GLN HE22 . 18575 1 1795 . 1 1 150 150 GLN C C 13 175.66 0.20 . 1 . . . . 150 GLN C . 18575 1 1796 . 1 1 150 150 GLN CA C 13 53.46 0.20 . 1 . . . . 150 GLN CA . 18575 1 1797 . 1 1 150 150 GLN CB C 13 30.13 0.20 . 1 . . . . 150 GLN CB . 18575 1 1798 . 1 1 150 150 GLN CG C 13 34.44 0.20 . 1 . . . . 150 GLN CG . 18575 1 1799 . 1 1 150 150 GLN CD C 13 179.77 0.20 . 1 . . . . 150 GLN CD . 18575 1 1800 . 1 1 150 150 GLN N N 15 126.52 0.20 . 1 . . . . 150 GLN N . 18575 1 1801 . 1 1 150 150 GLN NE2 N 15 112.69 0.20 . 1 . . . . 150 GLN NE2 . 18575 1 1802 . 1 1 151 151 ILE H H 1 8.830 0.010 . 1 . . . . 151 ILE H . 18575 1 1803 . 1 1 151 151 ILE HA H 1 4.489 0.010 . 1 . . . . 151 ILE HA . 18575 1 1804 . 1 1 151 151 ILE HB H 1 1.937 0.010 . 1 . . . . 151 ILE HB . 18575 1 1805 . 1 1 151 151 ILE HG12 H 1 1.007 0.010 . 2 . . . . 151 ILE HG12 . 18575 1 1806 . 1 1 151 151 ILE HG13 H 1 0.578 0.010 . 2 . . . . 151 ILE HG13 . 18575 1 1807 . 1 1 151 151 ILE HG21 H 1 0.532 0.010 . 1 . . . . 151 ILE QG2 . 18575 1 1808 . 1 1 151 151 ILE HG22 H 1 0.532 0.010 . 1 . . . . 151 ILE QG2 . 18575 1 1809 . 1 1 151 151 ILE HG23 H 1 0.532 0.010 . 1 . . . . 151 ILE QG2 . 18575 1 1810 . 1 1 151 151 ILE HD11 H 1 0.460 0.010 . 1 . . . . 151 ILE QD1 . 18575 1 1811 . 1 1 151 151 ILE HD12 H 1 0.460 0.010 . 1 . . . . 151 ILE QD1 . 18575 1 1812 . 1 1 151 151 ILE HD13 H 1 0.460 0.010 . 1 . . . . 151 ILE QD1 . 18575 1 1813 . 1 1 151 151 ILE C C 13 173.43 0.20 . 1 . . . . 151 ILE C . 18575 1 1814 . 1 1 151 151 ILE CA C 13 58.76 0.20 . 1 . . . . 151 ILE CA . 18575 1 1815 . 1 1 151 151 ILE CB C 13 39.74 0.20 . 1 . . . . 151 ILE CB . 18575 1 1816 . 1 1 151 151 ILE CG1 C 13 25.32 0.20 . 1 . . . . 151 ILE CG1 . 18575 1 1817 . 1 1 151 151 ILE CG2 C 13 17.02 0.20 . 1 . . . . 151 ILE CG2 . 18575 1 1818 . 1 1 151 151 ILE CD1 C 13 14.43 0.20 . 1 . . . . 151 ILE CD1 . 18575 1 1819 . 1 1 151 151 ILE N N 15 122.39 0.20 . 1 . . . . 151 ILE N . 18575 1 1820 . 1 1 152 152 HIS H H 1 8.396 0.010 . 1 . . . . 152 HIS H . 18575 1 1821 . 1 1 152 152 HIS HA H 1 5.251 0.010 . 1 . . . . 152 HIS HA . 18575 1 1822 . 1 1 152 152 HIS HB2 H 1 2.720 0.010 . 2 . . . . 152 HIS HB2 . 18575 1 1823 . 1 1 152 152 HIS HB3 H 1 3.076 0.010 . 2 . . . . 152 HIS HB3 . 18575 1 1824 . 1 1 152 152 HIS HD2 H 1 6.939 0.010 . 1 . . . . 152 HIS HD2 . 18575 1 1825 . 1 1 152 152 HIS HE1 H 1 7.650 0.010 . 1 . . . . 152 HIS HE1 . 18575 1 1826 . 1 1 152 152 HIS C C 13 177.34 0.20 . 1 . . . . 152 HIS C . 18575 1 1827 . 1 1 152 152 HIS CA C 13 54.57 0.20 . 1 . . . . 152 HIS CA . 18575 1 1828 . 1 1 152 152 HIS CB C 13 33.79 0.20 . 1 . . . . 152 HIS CB . 18575 1 1829 . 1 1 152 152 HIS CD2 C 13 118.78 0.20 . 1 . . . . 152 HIS CD2 . 18575 1 1830 . 1 1 152 152 HIS N N 15 117.23 0.20 . 1 . . . . 152 HIS N . 18575 1 1831 . 1 1 153 153 GLY H H 1 8.874 0.010 . 1 . . . . 153 GLY H . 18575 1 1832 . 1 1 153 153 GLY HA2 H 1 3.599 0.010 . 2 . . . . 153 GLY HA2 . 18575 1 1833 . 1 1 153 153 GLY HA3 H 1 4.091 0.010 . 2 . . . . 153 GLY HA3 . 18575 1 1834 . 1 1 153 153 GLY C C 13 173.71 0.20 . 1 . . . . 153 GLY C . 18575 1 1835 . 1 1 153 153 GLY CA C 13 46.46 0.20 . 1 . . . . 153 GLY CA . 18575 1 1836 . 1 1 153 153 GLY N N 15 107.06 0.20 . 1 . . . . 153 GLY N . 18575 1 1837 . 1 1 154 154 VAL H H 1 6.689 0.010 . 1 . . . . 154 VAL H . 18575 1 1838 . 1 1 154 154 VAL HA H 1 4.173 0.010 . 1 . . . . 154 VAL HA . 18575 1 1839 . 1 1 154 154 VAL HB H 1 1.525 0.010 . 1 . . . . 154 VAL HB . 18575 1 1840 . 1 1 154 154 VAL HG11 H 1 0.890 0.010 . 2 . . . . 154 VAL QG1 . 18575 1 1841 . 1 1 154 154 VAL HG12 H 1 0.890 0.010 . 2 . . . . 154 VAL QG1 . 18575 1 1842 . 1 1 154 154 VAL HG13 H 1 0.890 0.010 . 2 . . . . 154 VAL QG1 . 18575 1 1843 . 1 1 154 154 VAL HG21 H 1 0.890 0.010 . 2 . . . . 154 VAL QG2 . 18575 1 1844 . 1 1 154 154 VAL HG22 H 1 0.890 0.010 . 2 . . . . 154 VAL QG2 . 18575 1 1845 . 1 1 154 154 VAL HG23 H 1 0.890 0.010 . 2 . . . . 154 VAL QG2 . 18575 1 1846 . 1 1 154 154 VAL C C 13 175.58 0.20 . 1 . . . . 154 VAL C . 18575 1 1847 . 1 1 154 154 VAL CA C 13 60.99 0.20 . 1 . . . . 154 VAL CA . 18575 1 1848 . 1 1 154 154 VAL CB C 13 34.10 0.20 . 1 . . . . 154 VAL CB . 18575 1 1849 . 1 1 154 154 VAL CG1 C 13 21.49 0.20 . 2 . . . . 154 VAL CG1 . 18575 1 1850 . 1 1 154 154 VAL CG2 C 13 21.49 0.20 . 2 . . . . 154 VAL CG2 . 18575 1 1851 . 1 1 154 154 VAL N N 15 119.04 0.20 . 1 . . . . 154 VAL N . 18575 1 1852 . 1 1 155 155 GLY H H 1 8.722 0.010 . 1 . . . . 155 GLY H . 18575 1 1853 . 1 1 155 155 GLY HA2 H 1 4.173 0.010 . 2 . . . . 155 GLY HA2 . 18575 1 1854 . 1 1 155 155 GLY HA3 H 1 3.937 0.010 . 2 . . . . 155 GLY HA3 . 18575 1 1855 . 1 1 155 155 GLY C C 13 173.09 0.20 . 1 . . . . 155 GLY C . 18575 1 1856 . 1 1 155 155 GLY CA C 13 44.01 0.20 . 1 . . . . 155 GLY CA . 18575 1 1857 . 1 1 155 155 GLY N N 15 114.75 0.20 . 1 . . . . 155 GLY N . 18575 1 1858 . 1 1 156 156 HIS H H 1 8.766 0.010 . 1 . . . . 156 HIS H . 18575 1 1859 . 1 1 156 156 HIS HA H 1 4.208 0.010 . 1 . . . . 156 HIS HA . 18575 1 1860 . 1 1 156 156 HIS HB2 H 1 3.563 0.010 . 2 . . . . 156 HIS HB2 . 18575 1 1861 . 1 1 156 156 HIS HB3 H 1 3.114 0.010 . 2 . . . . 156 HIS HB3 . 18575 1 1862 . 1 1 156 156 HIS HD2 H 1 6.794 0.010 . 1 . . . . 156 HIS HD2 . 18575 1 1863 . 1 1 156 156 HIS HE1 H 1 7.746 0.010 . 1 . . . . 156 HIS HE1 . 18575 1 1864 . 1 1 156 156 HIS C C 13 179.43 0.20 . 1 . . . . 156 HIS C . 18575 1 1865 . 1 1 156 156 HIS CA C 13 61.45 0.20 . 1 . . . . 156 HIS CA . 18575 1 1866 . 1 1 156 156 HIS CB C 13 30.15 0.20 . 1 . . . . 156 HIS CB . 18575 1 1867 . 1 1 156 156 HIS N N 15 117.12 0.20 . 1 . . . . 156 HIS N . 18575 1 1868 . 1 1 157 157 MET H H 1 8.762 0.010 . 1 . . . . 157 MET H . 18575 1 1869 . 1 1 157 157 MET HA H 1 4.527 0.010 . 1 . . . . 157 MET HA . 18575 1 1870 . 1 1 157 157 MET HB2 H 1 2.071 0.010 . 1 . . . . 157 MET HB2 . 18575 1 1871 . 1 1 157 157 MET HB3 H 1 2.071 0.010 . 1 . . . . 157 MET HB3 . 18575 1 1872 . 1 1 157 157 MET HG2 H 1 2.880 0.010 . 2 . . . . 157 MET HG2 . 18575 1 1873 . 1 1 157 157 MET HG3 H 1 2.710 0.010 . 2 . . . . 157 MET HG3 . 18575 1 1874 . 1 1 157 157 MET HE1 H 1 2.043 0.010 . 1 . . . . 157 MET HE . 18575 1 1875 . 1 1 157 157 MET HE2 H 1 2.043 0.010 . 1 . . . . 157 MET HE . 18575 1 1876 . 1 1 157 157 MET HE3 H 1 2.043 0.010 . 1 . . . . 157 MET HE . 18575 1 1877 . 1 1 157 157 MET C C 13 179.19 0.20 . 1 . . . . 157 MET C . 18575 1 1878 . 1 1 157 157 MET CA C 13 55.22 0.20 . 1 . . . . 157 MET CA . 18575 1 1879 . 1 1 157 157 MET CB C 13 29.12 0.20 . 1 . . . . 157 MET CB . 18575 1 1880 . 1 1 157 157 MET CG C 13 32.06 0.20 . 1 . . . . 157 MET CG . 18575 1 1881 . 1 1 157 157 MET CE C 13 15.48 0.20 . 1 . . . . 157 MET CE . 18575 1 1882 . 1 1 157 157 MET N N 15 114.67 0.20 . 1 . . . . 157 MET N . 18575 1 1883 . 1 1 158 158 GLY H H 1 7.630 0.010 . 1 . . . . 158 GLY H . 18575 1 1884 . 1 1 158 158 GLY HA2 H 1 3.756 0.010 . 2 . . . . 158 GLY HA2 . 18575 1 1885 . 1 1 158 158 GLY HA3 H 1 3.640 0.010 . 2 . . . . 158 GLY HA3 . 18575 1 1886 . 1 1 158 158 GLY C C 13 175.83 0.20 . 1 . . . . 158 GLY C . 18575 1 1887 . 1 1 158 158 GLY CA C 13 46.48 0.20 . 1 . . . . 158 GLY CA . 18575 1 1888 . 1 1 158 158 GLY N N 15 108.94 0.20 . 1 . . . . 158 GLY N . 18575 1 1889 . 1 1 159 159 LEU H H 1 7.206 0.010 . 1 . . . . 159 LEU H . 18575 1 1890 . 1 1 159 159 LEU HA H 1 3.734 0.010 . 1 . . . . 159 LEU HA . 18575 1 1891 . 1 1 159 159 LEU HB2 H 1 1.596 0.010 . 2 . . . . 159 LEU HB2 . 18575 1 1892 . 1 1 159 159 LEU HB3 H 1 1.216 0.010 . 2 . . . . 159 LEU HB3 . 18575 1 1893 . 1 1 159 159 LEU HG H 1 2.122 0.010 . 1 . . . . 159 LEU HG . 18575 1 1894 . 1 1 159 159 LEU HD11 H 1 0.967 0.010 . 2 . . . . 159 LEU QD1 . 18575 1 1895 . 1 1 159 159 LEU HD12 H 1 0.967 0.010 . 2 . . . . 159 LEU QD1 . 18575 1 1896 . 1 1 159 159 LEU HD13 H 1 0.967 0.010 . 2 . . . . 159 LEU QD1 . 18575 1 1897 . 1 1 159 159 LEU HD21 H 1 0.660 0.010 . 2 . . . . 159 LEU QD2 . 18575 1 1898 . 1 1 159 159 LEU HD22 H 1 0.660 0.010 . 2 . . . . 159 LEU QD2 . 18575 1 1899 . 1 1 159 159 LEU HD23 H 1 0.660 0.010 . 2 . . . . 159 LEU QD2 . 18575 1 1900 . 1 1 159 159 LEU C C 13 175.68 0.20 . 1 . . . . 159 LEU C . 18575 1 1901 . 1 1 159 159 LEU CA C 13 57.00 0.20 . 1 . . . . 159 LEU CA . 18575 1 1902 . 1 1 159 159 LEU CB C 13 43.42 0.20 . 1 . . . . 159 LEU CB . 18575 1 1903 . 1 1 159 159 LEU CG C 13 25.58 0.20 . 1 . . . . 159 LEU CG . 18575 1 1904 . 1 1 159 159 LEU CD1 C 13 25.53 0.20 . 2 . . . . 159 LEU CD1 . 18575 1 1905 . 1 1 159 159 LEU CD2 C 13 23.65 0.20 . 2 . . . . 159 LEU CD2 . 18575 1 1906 . 1 1 159 159 LEU N N 15 120.22 0.20 . 1 . . . . 159 LEU N . 18575 1 1907 . 1 1 160 160 LEU H H 1 6.939 0.010 . 1 . . . . 160 LEU H . 18575 1 1908 . 1 1 160 160 LEU HA H 1 3.663 0.010 . 1 . . . . 160 LEU HA . 18575 1 1909 . 1 1 160 160 LEU HB2 H 1 1.403 0.010 . 2 . . . . 160 LEU HB2 . 18575 1 1910 . 1 1 160 160 LEU HB3 H 1 0.892 0.010 . 2 . . . . 160 LEU HB3 . 18575 1 1911 . 1 1 160 160 LEU HG H 1 0.538 0.010 . 1 . . . . 160 LEU HG . 18575 1 1912 . 1 1 160 160 LEU HD11 H 1 0.182 0.010 . 2 . . . . 160 LEU QD1 . 18575 1 1913 . 1 1 160 160 LEU HD12 H 1 0.182 0.010 . 2 . . . . 160 LEU QD1 . 18575 1 1914 . 1 1 160 160 LEU HD13 H 1 0.182 0.010 . 2 . . . . 160 LEU QD1 . 18575 1 1915 . 1 1 160 160 LEU HD21 H 1 -0.277 0.010 . 2 . . . . 160 LEU QD2 . 18575 1 1916 . 1 1 160 160 LEU HD22 H 1 -0.277 0.010 . 2 . . . . 160 LEU QD2 . 18575 1 1917 . 1 1 160 160 LEU HD23 H 1 -0.277 0.010 . 2 . . . . 160 LEU QD2 . 18575 1 1918 . 1 1 160 160 LEU C C 13 176.71 0.20 . 1 . . . . 160 LEU C . 18575 1 1919 . 1 1 160 160 LEU CA C 13 54.33 0.20 . 1 . . . . 160 LEU CA . 18575 1 1920 . 1 1 160 160 LEU CB C 13 41.06 0.20 . 1 . . . . 160 LEU CB . 18575 1 1921 . 1 1 160 160 LEU CG C 13 26.58 0.20 . 1 . . . . 160 LEU CG . 18575 1 1922 . 1 1 160 160 LEU CD1 C 13 25.04 0.20 . 2 . . . . 160 LEU CD1 . 18575 1 1923 . 1 1 160 160 LEU CD2 C 13 21.54 0.20 . 2 . . . . 160 LEU CD2 . 18575 1 1924 . 1 1 160 160 LEU N N 15 112.44 0.20 . 1 . . . . 160 LEU N . 18575 1 1925 . 1 1 161 161 TYR H H 1 7.339 0.010 . 1 . . . . 161 TYR H . 18575 1 1926 . 1 1 161 161 TYR HA H 1 4.543 0.010 . 1 . . . . 161 TYR HA . 18575 1 1927 . 1 1 161 161 TYR HB2 H 1 2.400 0.010 . 2 . . . . 161 TYR HB2 . 18575 1 1928 . 1 1 161 161 TYR HB3 H 1 3.206 0.010 . 2 . . . . 161 TYR HB3 . 18575 1 1929 . 1 1 161 161 TYR HD1 H 1 6.976 0.010 . 3 . . . . 161 TYR HD1 . 18575 1 1930 . 1 1 161 161 TYR HD2 H 1 6.976 0.010 . 3 . . . . 161 TYR HD2 . 18575 1 1931 . 1 1 161 161 TYR HE1 H 1 6.641 0.010 . 3 . . . . 161 TYR HE1 . 18575 1 1932 . 1 1 161 161 TYR HE2 H 1 6.641 0.010 . 3 . . . . 161 TYR HE2 . 18575 1 1933 . 1 1 161 161 TYR C C 13 174.20 0.20 . 1 . . . . 161 TYR C . 18575 1 1934 . 1 1 161 161 TYR CA C 13 56.95 0.20 . 1 . . . . 161 TYR CA . 18575 1 1935 . 1 1 161 161 TYR CB C 13 39.30 0.20 . 1 . . . . 161 TYR CB . 18575 1 1936 . 1 1 161 161 TYR CD1 C 13 133.15 0.20 . 3 . . . . 161 TYR CD1 . 18575 1 1937 . 1 1 161 161 TYR CD2 C 13 133.15 0.20 . 3 . . . . 161 TYR CD2 . 18575 1 1938 . 1 1 161 161 TYR CE1 C 13 117.89 0.20 . 3 . . . . 161 TYR CE1 . 18575 1 1939 . 1 1 161 161 TYR CE2 C 13 117.89 0.20 . 3 . . . . 161 TYR CE2 . 18575 1 1940 . 1 1 161 161 TYR N N 15 120.19 0.20 . 1 . . . . 161 TYR N . 18575 1 1941 . 1 1 162 162 SER H H 1 8.836 0.010 . 1 . . . . 162 SER H . 18575 1 1942 . 1 1 162 162 SER HA H 1 4.881 0.010 . 1 . . . . 162 SER HA . 18575 1 1943 . 1 1 162 162 SER HB2 H 1 3.840 0.010 . 2 . . . . 162 SER HB2 . 18575 1 1944 . 1 1 162 162 SER HB3 H 1 3.290 0.010 . 2 . . . . 162 SER HB3 . 18575 1 1945 . 1 1 162 162 SER CA C 13 55.15 0.20 . 1 . . . . 162 SER CA . 18575 1 1946 . 1 1 162 162 SER CB C 13 63.87 0.20 . 1 . . . . 162 SER CB . 18575 1 1947 . 1 1 162 162 SER N N 15 117.52 0.20 . 1 . . . . 162 SER N . 18575 1 1948 . 1 1 163 163 SER HA H 1 3.915 0.010 . 1 . . . . 163 SER HA . 18575 1 1949 . 1 1 163 163 SER CA C 13 61.55 0.20 . 1 . . . . 163 SER CA . 18575 1 1950 . 1 1 164 164 GLN HA H 1 4.016 0.010 . 1 . . . . 164 GLN HA . 18575 1 1951 . 1 1 164 164 GLN HB2 H 1 1.968 0.010 . 2 . . . . 164 GLN HB2 . 18575 1 1952 . 1 1 164 164 GLN HB3 H 1 1.795 0.010 . 2 . . . . 164 GLN HB3 . 18575 1 1953 . 1 1 164 164 GLN HG2 H 1 2.333 0.010 . 2 . . . . 164 GLN HG2 . 18575 1 1954 . 1 1 164 164 GLN HG3 H 1 2.102 0.010 . 2 . . . . 164 GLN HG3 . 18575 1 1955 . 1 1 164 164 GLN HE21 H 1 6.873 0.010 . 2 . . . . 164 GLN HE21 . 18575 1 1956 . 1 1 164 164 GLN HE22 H 1 7.428 0.010 . 2 . . . . 164 GLN HE22 . 18575 1 1957 . 1 1 164 164 GLN C C 13 178.29 0.20 . 1 . . . . 164 GLN C . 18575 1 1958 . 1 1 164 164 GLN CA C 13 58.89 0.20 . 1 . . . . 164 GLN CA . 18575 1 1959 . 1 1 164 164 GLN CB C 13 28.19 0.20 . 1 . . . . 164 GLN CB . 18575 1 1960 . 1 1 164 164 GLN CG C 13 33.37 0.20 . 1 . . . . 164 GLN CG . 18575 1 1961 . 1 1 164 164 GLN CD C 13 179.03 0.20 . 1 . . . . 164 GLN CD . 18575 1 1962 . 1 1 164 164 GLN NE2 N 15 110.46 0.20 . 1 . . . . 164 GLN NE2 . 18575 1 1963 . 1 1 165 165 VAL H H 1 7.401 0.010 . 1 . . . . 165 VAL H . 18575 1 1964 . 1 1 165 165 VAL HA H 1 3.309 0.010 . 1 . . . . 165 VAL HA . 18575 1 1965 . 1 1 165 165 VAL HB H 1 2.130 0.010 . 1 . . . . 165 VAL HB . 18575 1 1966 . 1 1 165 165 VAL HG11 H 1 0.979 0.010 . 2 . . . . 165 VAL QG1 . 18575 1 1967 . 1 1 165 165 VAL HG12 H 1 0.979 0.010 . 2 . . . . 165 VAL QG1 . 18575 1 1968 . 1 1 165 165 VAL HG13 H 1 0.979 0.010 . 2 . . . . 165 VAL QG1 . 18575 1 1969 . 1 1 165 165 VAL HG21 H 1 0.912 0.010 . 2 . . . . 165 VAL QG2 . 18575 1 1970 . 1 1 165 165 VAL HG22 H 1 0.912 0.010 . 2 . . . . 165 VAL QG2 . 18575 1 1971 . 1 1 165 165 VAL HG23 H 1 0.912 0.010 . 2 . . . . 165 VAL QG2 . 18575 1 1972 . 1 1 165 165 VAL C C 13 177.16 0.20 . 1 . . . . 165 VAL C . 18575 1 1973 . 1 1 165 165 VAL CA C 13 66.22 0.20 . 1 . . . . 165 VAL CA . 18575 1 1974 . 1 1 165 165 VAL CB C 13 31.22 0.20 . 1 . . . . 165 VAL CB . 18575 1 1975 . 1 1 165 165 VAL CG1 C 13 22.59 0.20 . 2 . . . . 165 VAL CG1 . 18575 1 1976 . 1 1 165 165 VAL CG2 C 13 23.63 0.20 . 2 . . . . 165 VAL CG2 . 18575 1 1977 . 1 1 165 165 VAL N N 15 119.75 0.20 . 1 . . . . 165 VAL N . 18575 1 1978 . 1 1 166 166 ASN H H 1 8.335 0.010 . 1 . . . . 166 ASN H . 18575 1 1979 . 1 1 166 166 ASN HA H 1 3.769 0.010 . 1 . . . . 166 ASN HA . 18575 1 1980 . 1 1 166 166 ASN HB2 H 1 0.332 0.010 . 2 . . . . 166 ASN HB2 . 18575 1 1981 . 1 1 166 166 ASN HB3 H 1 2.073 0.010 . 2 . . . . 166 ASN HB3 . 18575 1 1982 . 1 1 166 166 ASN HD21 H 1 5.889 0.010 . 2 . . . . 166 ASN HD21 . 18575 1 1983 . 1 1 166 166 ASN HD22 H 1 6.696 0.010 . 2 . . . . 166 ASN HD22 . 18575 1 1984 . 1 1 166 166 ASN C C 13 176.05 0.20 . 1 . . . . 166 ASN C . 18575 1 1985 . 1 1 166 166 ASN CA C 13 55.60 0.20 . 1 . . . . 166 ASN CA . 18575 1 1986 . 1 1 166 166 ASN CB C 13 34.09 0.20 . 1 . . . . 166 ASN CB . 18575 1 1987 . 1 1 166 166 ASN CG C 13 174.60 0.20 . 1 . . . . 166 ASN CG . 18575 1 1988 . 1 1 166 166 ASN N N 15 119.86 0.20 . 1 . . . . 166 ASN N . 18575 1 1989 . 1 1 166 166 ASN ND2 N 15 105.17 0.20 . 1 . . . . 166 ASN ND2 . 18575 1 1990 . 1 1 167 167 SER H H 1 7.194 0.010 . 1 . . . . 167 SER H . 18575 1 1991 . 1 1 167 167 SER HA H 1 4.248 0.010 . 1 . . . . 167 SER HA . 18575 1 1992 . 1 1 167 167 SER HB2 H 1 3.898 0.010 . 1 . . . . 167 SER HB2 . 18575 1 1993 . 1 1 167 167 SER HB3 H 1 3.898 0.010 . 1 . . . . 167 SER HB3 . 18575 1 1994 . 1 1 167 167 SER C C 13 176.99 0.20 . 1 . . . . 167 SER C . 18575 1 1995 . 1 1 167 167 SER CA C 13 61.57 0.20 . 1 . . . . 167 SER CA . 18575 1 1996 . 1 1 167 167 SER CB C 13 62.57 0.20 . 1 . . . . 167 SER CB . 18575 1 1997 . 1 1 167 167 SER N N 15 112.29 0.20 . 1 . . . . 167 SER N . 18575 1 1998 . 1 1 168 168 LEU H H 1 7.275 0.010 . 1 . . . . 168 LEU H . 18575 1 1999 . 1 1 168 168 LEU HA H 1 4.071 0.010 . 1 . . . . 168 LEU HA . 18575 1 2000 . 1 1 168 168 LEU HB2 H 1 1.170 0.010 . 2 . . . . 168 LEU HB2 . 18575 1 2001 . 1 1 168 168 LEU HB3 H 1 2.059 0.010 . 2 . . . . 168 LEU HB3 . 18575 1 2002 . 1 1 168 168 LEU HG H 1 1.773 0.010 . 1 . . . . 168 LEU HG . 18575 1 2003 . 1 1 168 168 LEU HD11 H 1 0.784 0.010 . 2 . . . . 168 LEU QD1 . 18575 1 2004 . 1 1 168 168 LEU HD12 H 1 0.784 0.010 . 2 . . . . 168 LEU QD1 . 18575 1 2005 . 1 1 168 168 LEU HD13 H 1 0.784 0.010 . 2 . . . . 168 LEU QD1 . 18575 1 2006 . 1 1 168 168 LEU HD21 H 1 0.718 0.010 . 2 . . . . 168 LEU QD2 . 18575 1 2007 . 1 1 168 168 LEU HD22 H 1 0.718 0.010 . 2 . . . . 168 LEU QD2 . 18575 1 2008 . 1 1 168 168 LEU HD23 H 1 0.718 0.010 . 2 . . . . 168 LEU QD2 . 18575 1 2009 . 1 1 168 168 LEU C C 13 179.61 0.20 . 1 . . . . 168 LEU C . 18575 1 2010 . 1 1 168 168 LEU CA C 13 57.49 0.20 . 1 . . . . 168 LEU CA . 18575 1 2011 . 1 1 168 168 LEU CB C 13 43.21 0.20 . 1 . . . . 168 LEU CB . 18575 1 2012 . 1 1 168 168 LEU CG C 13 26.50 0.20 . 1 . . . . 168 LEU CG . 18575 1 2013 . 1 1 168 168 LEU CD1 C 13 22.39 0.20 . 2 . . . . 168 LEU CD1 . 18575 1 2014 . 1 1 168 168 LEU CD2 C 13 26.47 0.20 . 2 . . . . 168 LEU CD2 . 18575 1 2015 . 1 1 168 168 LEU N N 15 122.70 0.20 . 1 . . . . 168 LEU N . 18575 1 2016 . 1 1 169 169 ILE H H 1 8.669 0.010 . 1 . . . . 169 ILE H . 18575 1 2017 . 1 1 169 169 ILE HA H 1 3.469 0.010 . 1 . . . . 169 ILE HA . 18575 1 2018 . 1 1 169 169 ILE HB H 1 2.065 0.010 . 1 . . . . 169 ILE HB . 18575 1 2019 . 1 1 169 169 ILE HG12 H 1 0.618 0.010 . 2 . . . . 169 ILE HG12 . 18575 1 2020 . 1 1 169 169 ILE HG13 H 1 1.860 0.010 . 2 . . . . 169 ILE HG13 . 18575 1 2021 . 1 1 169 169 ILE HG21 H 1 0.649 0.010 . 1 . . . . 169 ILE QG2 . 18575 1 2022 . 1 1 169 169 ILE HG22 H 1 0.649 0.010 . 1 . . . . 169 ILE QG2 . 18575 1 2023 . 1 1 169 169 ILE HG23 H 1 0.649 0.010 . 1 . . . . 169 ILE QG2 . 18575 1 2024 . 1 1 169 169 ILE HD11 H 1 0.823 0.010 . 1 . . . . 169 ILE QD1 . 18575 1 2025 . 1 1 169 169 ILE HD12 H 1 0.823 0.010 . 1 . . . . 169 ILE QD1 . 18575 1 2026 . 1 1 169 169 ILE HD13 H 1 0.823 0.010 . 1 . . . . 169 ILE QD1 . 18575 1 2027 . 1 1 169 169 ILE C C 13 177.37 0.20 . 1 . . . . 169 ILE C . 18575 1 2028 . 1 1 169 169 ILE CA C 13 65.92 0.20 . 1 . . . . 169 ILE CA . 18575 1 2029 . 1 1 169 169 ILE CB C 13 37.33 0.20 . 1 . . . . 169 ILE CB . 18575 1 2030 . 1 1 169 169 ILE CG1 C 13 28.79 0.20 . 1 . . . . 169 ILE CG1 . 18575 1 2031 . 1 1 169 169 ILE CG2 C 13 17.36 0.20 . 1 . . . . 169 ILE CG2 . 18575 1 2032 . 1 1 169 169 ILE CD1 C 13 15.31 0.20 . 1 . . . . 169 ILE CD1 . 18575 1 2033 . 1 1 169 169 ILE N N 15 121.71 0.20 . 1 . . . . 169 ILE N . 18575 1 2034 . 1 1 170 170 LYS H H 1 7.964 0.010 . 1 . . . . 170 LYS H . 18575 1 2035 . 1 1 170 170 LYS HA H 1 3.571 0.010 . 1 . . . . 170 LYS HA . 18575 1 2036 . 1 1 170 170 LYS HB2 H 1 1.997 0.010 . 2 . . . . 170 LYS HB2 . 18575 1 2037 . 1 1 170 170 LYS HB3 H 1 2.233 0.010 . 2 . . . . 170 LYS HB3 . 18575 1 2038 . 1 1 170 170 LYS HG2 H 1 1.503 0.010 . 2 . . . . 170 LYS HG2 . 18575 1 2039 . 1 1 170 170 LYS HG3 H 1 1.703 0.010 . 2 . . . . 170 LYS HG3 . 18575 1 2040 . 1 1 170 170 LYS HD2 H 1 1.580 0.010 . 2 . . . . 170 LYS HD2 . 18575 1 2041 . 1 1 170 170 LYS HD3 H 1 1.470 0.010 . 2 . . . . 170 LYS HD3 . 18575 1 2042 . 1 1 170 170 LYS HE2 H 1 3.171 0.010 . 2 . . . . 170 LYS HE2 . 18575 1 2043 . 1 1 170 170 LYS HE3 H 1 3.042 0.010 . 2 . . . . 170 LYS HE3 . 18575 1 2044 . 1 1 170 170 LYS C C 13 177.35 0.20 . 1 . . . . 170 LYS C . 18575 1 2045 . 1 1 170 170 LYS CA C 13 60.18 0.20 . 1 . . . . 170 LYS CA . 18575 1 2046 . 1 1 170 170 LYS CB C 13 32.35 0.20 . 1 . . . . 170 LYS CB . 18575 1 2047 . 1 1 170 170 LYS CG C 13 25.40 0.20 . 1 . . . . 170 LYS CG . 18575 1 2048 . 1 1 170 170 LYS CD C 13 29.12 0.20 . 1 . . . . 170 LYS CD . 18575 1 2049 . 1 1 170 170 LYS CE C 13 42.11 0.20 . 1 . . . . 170 LYS CE . 18575 1 2050 . 1 1 170 170 LYS N N 15 119.68 0.20 . 1 . . . . 170 LYS N . 18575 1 2051 . 1 1 171 171 GLU H H 1 7.644 0.010 . 1 . . . . 171 GLU H . 18575 1 2052 . 1 1 171 171 GLU HA H 1 4.062 0.010 . 1 . . . . 171 GLU HA . 18575 1 2053 . 1 1 171 171 GLU HB2 H 1 2.165 0.010 . 2 . . . . 171 GLU HB2 . 18575 1 2054 . 1 1 171 171 GLU HB3 H 1 2.031 0.010 . 2 . . . . 171 GLU HB3 . 18575 1 2055 . 1 1 171 171 GLU HG2 H 1 2.224 0.010 . 2 . . . . 171 GLU HG2 . 18575 1 2056 . 1 1 171 171 GLU HG3 H 1 2.551 0.010 . 2 . . . . 171 GLU HG3 . 18575 1 2057 . 1 1 171 171 GLU C C 13 180.91 0.20 . 1 . . . . 171 GLU C . 18575 1 2058 . 1 1 171 171 GLU CA C 13 59.42 0.20 . 1 . . . . 171 GLU CA . 18575 1 2059 . 1 1 171 171 GLU CB C 13 29.59 0.20 . 1 . . . . 171 GLU CB . 18575 1 2060 . 1 1 171 171 GLU CG C 13 36.19 0.20 . 1 . . . . 171 GLU CG . 18575 1 2061 . 1 1 171 171 GLU N N 15 115.59 0.20 . 1 . . . . 171 GLU N . 18575 1 2062 . 1 1 172 172 GLY H H 1 8.416 0.010 . 1 . . . . 172 GLY H . 18575 1 2063 . 1 1 172 172 GLY HA2 H 1 3.516 0.010 . 2 . . . . 172 GLY HA2 . 18575 1 2064 . 1 1 172 172 GLY HA3 H 1 3.603 0.010 . 2 . . . . 172 GLY HA3 . 18575 1 2065 . 1 1 172 172 GLY C C 13 177.07 0.20 . 1 . . . . 172 GLY C . 18575 1 2066 . 1 1 172 172 GLY CA C 13 47.81 0.20 . 1 . . . . 172 GLY CA . 18575 1 2067 . 1 1 172 172 GLY N N 15 107.76 0.20 . 1 . . . . 172 GLY N . 18575 1 2068 . 1 1 173 173 LEU H H 1 8.934 0.010 . 1 . . . . 173 LEU H . 18575 1 2069 . 1 1 173 173 LEU HA H 1 4.116 0.010 . 1 . . . . 173 LEU HA . 18575 1 2070 . 1 1 173 173 LEU HB2 H 1 1.824 0.010 . 2 . . . . 173 LEU HB2 . 18575 1 2071 . 1 1 173 173 LEU HB3 H 1 1.948 0.010 . 2 . . . . 173 LEU HB3 . 18575 1 2072 . 1 1 173 173 LEU HG H 1 1.765 0.010 . 1 . . . . 173 LEU HG . 18575 1 2073 . 1 1 173 173 LEU HD11 H 1 0.717 0.010 . 2 . . . . 173 LEU QD1 . 18575 1 2074 . 1 1 173 173 LEU HD12 H 1 0.717 0.010 . 2 . . . . 173 LEU QD1 . 18575 1 2075 . 1 1 173 173 LEU HD13 H 1 0.717 0.010 . 2 . . . . 173 LEU QD1 . 18575 1 2076 . 1 1 173 173 LEU HD21 H 1 0.359 0.010 . 2 . . . . 173 LEU QD2 . 18575 1 2077 . 1 1 173 173 LEU HD22 H 1 0.359 0.010 . 2 . . . . 173 LEU QD2 . 18575 1 2078 . 1 1 173 173 LEU HD23 H 1 0.359 0.010 . 2 . . . . 173 LEU QD2 . 18575 1 2079 . 1 1 173 173 LEU C C 13 176.61 0.20 . 1 . . . . 173 LEU C . 18575 1 2080 . 1 1 173 173 LEU CA C 13 57.08 0.20 . 1 . . . . 173 LEU CA . 18575 1 2081 . 1 1 173 173 LEU CB C 13 41.55 0.20 . 1 . . . . 173 LEU CB . 18575 1 2082 . 1 1 173 173 LEU CG C 13 25.83 0.20 . 1 . . . . 173 LEU CG . 18575 1 2083 . 1 1 173 173 LEU CD1 C 13 21.83 0.20 . 2 . . . . 173 LEU CD1 . 18575 1 2084 . 1 1 173 173 LEU CD2 C 13 26.61 0.20 . 2 . . . . 173 LEU CD2 . 18575 1 2085 . 1 1 173 173 LEU N N 15 123.46 0.20 . 1 . . . . 173 LEU N . 18575 1 2086 . 1 1 174 174 ASN H H 1 7.735 0.010 . 1 . . . . 174 ASN H . 18575 1 2087 . 1 1 174 174 ASN HA H 1 5.190 0.010 . 1 . . . . 174 ASN HA . 18575 1 2088 . 1 1 174 174 ASN HB2 H 1 2.923 0.010 . 2 . . . . 174 ASN HB2 . 18575 1 2089 . 1 1 174 174 ASN HB3 H 1 3.212 0.010 . 2 . . . . 174 ASN HB3 . 18575 1 2090 . 1 1 174 174 ASN HD21 H 1 7.408 0.010 . 2 . . . . 174 ASN HD21 . 18575 1 2091 . 1 1 174 174 ASN HD22 H 1 7.071 0.010 . 2 . . . . 174 ASN HD22 . 18575 1 2092 . 1 1 174 174 ASN C C 13 175.81 0.20 . 1 . . . . 174 ASN C . 18575 1 2093 . 1 1 174 174 ASN CA C 13 52.11 0.20 . 1 . . . . 174 ASN CA . 18575 1 2094 . 1 1 174 174 ASN CB C 13 38.31 0.20 . 1 . . . . 174 ASN CB . 18575 1 2095 . 1 1 174 174 ASN CG C 13 176.67 0.20 . 1 . . . . 174 ASN CG . 18575 1 2096 . 1 1 174 174 ASN N N 15 116.86 0.20 . 1 . . . . 174 ASN N . 18575 1 2097 . 1 1 174 174 ASN ND2 N 15 108.79 0.20 . 1 . . . . 174 ASN ND2 . 18575 1 2098 . 1 1 175 175 GLY H H 1 7.536 0.010 . 1 . . . . 175 GLY H . 18575 1 2099 . 1 1 175 175 GLY HA2 H 1 3.717 0.010 . 2 . . . . 175 GLY HA2 . 18575 1 2100 . 1 1 175 175 GLY HA3 H 1 4.334 0.010 . 2 . . . . 175 GLY HA3 . 18575 1 2101 . 1 1 175 175 GLY C C 13 174.75 0.20 . 1 . . . . 175 GLY C . 18575 1 2102 . 1 1 175 175 GLY CA C 13 45.66 0.20 . 1 . . . . 175 GLY CA . 18575 1 2103 . 1 1 175 175 GLY N N 15 105.85 0.20 . 1 . . . . 175 GLY N . 18575 1 2104 . 1 1 176 176 GLY H H 1 8.288 0.010 . 1 . . . . 176 GLY H . 18575 1 2105 . 1 1 176 176 GLY HA2 H 1 4.232 0.010 . 2 . . . . 176 GLY HA2 . 18575 1 2106 . 1 1 176 176 GLY HA3 H 1 3.413 0.010 . 2 . . . . 176 GLY HA3 . 18575 1 2107 . 1 1 176 176 GLY C C 13 175.30 0.20 . 1 . . . . 176 GLY C . 18575 1 2108 . 1 1 176 176 GLY CA C 13 45.46 0.20 . 1 . . . . 176 GLY CA . 18575 1 2109 . 1 1 176 176 GLY N N 15 106.14 0.20 . 1 . . . . 176 GLY N . 18575 1 2110 . 1 1 177 177 GLY H H 1 8.218 0.010 . 1 . . . . 177 GLY H . 18575 1 2111 . 1 1 177 177 GLY HA2 H 1 4.120 0.010 . 2 . . . . 177 GLY HA2 . 18575 1 2112 . 1 1 177 177 GLY HA3 H 1 3.545 0.010 . 2 . . . . 177 GLY HA3 . 18575 1 2113 . 1 1 177 177 GLY C C 13 170.70 0.20 . 1 . . . . 177 GLY C . 18575 1 2114 . 1 1 177 177 GLY CA C 13 44.88 0.20 . 1 . . . . 177 GLY CA . 18575 1 2115 . 1 1 177 177 GLY N N 15 107.91 0.20 . 1 . . . . 177 GLY N . 18575 1 2116 . 1 1 178 178 GLN H H 1 8.050 0.010 . 1 . . . . 178 GLN H . 18575 1 2117 . 1 1 178 178 GLN HA H 1 4.848 0.010 . 1 . . . . 178 GLN HA . 18575 1 2118 . 1 1 178 178 GLN HB2 H 1 1.937 0.010 . 2 . . . . 178 GLN HB2 . 18575 1 2119 . 1 1 178 178 GLN HB3 H 1 2.071 0.010 . 2 . . . . 178 GLN HB3 . 18575 1 2120 . 1 1 178 178 GLN HG2 H 1 2.252 0.010 . 2 . . . . 178 GLN HG2 . 18575 1 2121 . 1 1 178 178 GLN HG3 H 1 2.424 0.010 . 2 . . . . 178 GLN HG3 . 18575 1 2122 . 1 1 178 178 GLN HE21 H 1 7.226 0.010 . 2 . . . . 178 GLN HE21 . 18575 1 2123 . 1 1 178 178 GLN HE22 H 1 6.750 0.010 . 2 . . . . 178 GLN HE22 . 18575 1 2124 . 1 1 178 178 GLN C C 13 176.11 0.20 . 1 . . . . 178 GLN C . 18575 1 2125 . 1 1 178 178 GLN CA C 13 54.30 0.20 . 1 . . . . 178 GLN CA . 18575 1 2126 . 1 1 178 178 GLN CB C 13 34.42 0.20 . 1 . . . . 178 GLN CB . 18575 1 2127 . 1 1 178 178 GLN CG C 13 34.06 0.20 . 1 . . . . 178 GLN CG . 18575 1 2128 . 1 1 178 178 GLN CD C 13 179.76 0.20 . 1 . . . . 178 GLN CD . 18575 1 2129 . 1 1 178 178 GLN N N 15 112.92 0.20 . 1 . . . . 178 GLN N . 18575 1 2130 . 1 1 178 178 GLN NE2 N 15 110.61 0.20 . 1 . . . . 178 GLN NE2 . 18575 1 2131 . 1 1 179 179 ASN H H 1 8.825 0.010 . 1 . . . . 179 ASN H . 18575 1 2132 . 1 1 179 179 ASN HA H 1 4.845 0.010 . 1 . . . . 179 ASN HA . 18575 1 2133 . 1 1 179 179 ASN HB2 H 1 3.559 0.010 . 2 . . . . 179 ASN HB2 . 18575 1 2134 . 1 1 179 179 ASN HB3 H 1 2.860 0.010 . 2 . . . . 179 ASN HB3 . 18575 1 2135 . 1 1 179 179 ASN HD21 H 1 8.400 0.010 . 2 . . . . 179 ASN HD21 . 18575 1 2136 . 1 1 179 179 ASN HD22 H 1 5.762 0.010 . 2 . . . . 179 ASN HD22 . 18575 1 2137 . 1 1 179 179 ASN C C 13 175.83 0.20 . 1 . . . . 179 ASN C . 18575 1 2138 . 1 1 179 179 ASN CA C 13 53.83 0.20 . 1 . . . . 179 ASN CA . 18575 1 2139 . 1 1 179 179 ASN CB C 13 38.43 0.20 . 1 . . . . 179 ASN CB . 18575 1 2140 . 1 1 179 179 ASN CG C 13 177.41 0.20 . 1 . . . . 179 ASN CG . 18575 1 2141 . 1 1 179 179 ASN N N 15 116.63 0.20 . 1 . . . . 179 ASN N . 18575 1 2142 . 1 1 179 179 ASN ND2 N 15 107.30 0.20 . 1 . . . . 179 ASN ND2 . 18575 1 2143 . 1 1 180 180 THR H H 1 8.839 0.010 . 1 . . . . 180 THR H . 18575 1 2144 . 1 1 180 180 THR HA H 1 4.445 0.010 . 1 . . . . 180 THR HA . 18575 1 2145 . 1 1 180 180 THR HB H 1 4.669 0.010 . 1 . . . . 180 THR HB . 18575 1 2146 . 1 1 180 180 THR HG21 H 1 1.184 0.010 . 1 . . . . 180 THR QG2 . 18575 1 2147 . 1 1 180 180 THR HG22 H 1 1.184 0.010 . 1 . . . . 180 THR QG2 . 18575 1 2148 . 1 1 180 180 THR HG23 H 1 1.184 0.010 . 1 . . . . 180 THR QG2 . 18575 1 2149 . 1 1 180 180 THR C C 13 174.59 0.20 . 1 . . . . 180 THR C . 18575 1 2150 . 1 1 180 180 THR CA C 13 61.28 0.20 . 1 . . . . 180 THR CA . 18575 1 2151 . 1 1 180 180 THR CB C 13 67.87 0.20 . 1 . . . . 180 THR CB . 18575 1 2152 . 1 1 180 180 THR CG2 C 13 21.34 0.20 . 1 . . . . 180 THR CG2 . 18575 1 2153 . 1 1 180 180 THR N N 15 115.59 0.20 . 1 . . . . 180 THR N . 18575 1 2154 . 1 1 181 181 ASN H H 1 8.275 0.010 . 1 . . . . 181 ASN H . 18575 1 2155 . 1 1 181 181 ASN HA H 1 4.487 0.010 . 1 . . . . 181 ASN HA . 18575 1 2156 . 1 1 181 181 ASN HB2 H 1 2.878 0.010 . 2 . . . . 181 ASN HB2 . 18575 1 2157 . 1 1 181 181 ASN HB3 H 1 2.691 0.010 . 2 . . . . 181 ASN HB3 . 18575 1 2158 . 1 1 181 181 ASN HD21 H 1 7.770 0.010 . 2 . . . . 181 ASN HD21 . 18575 1 2159 . 1 1 181 181 ASN HD22 H 1 7.041 0.010 . 2 . . . . 181 ASN HD22 . 18575 1 2160 . 1 1 181 181 ASN CA C 13 55.04 0.20 . 1 . . . . 181 ASN CA . 18575 1 2161 . 1 1 181 181 ASN CB C 13 39.61 0.20 . 1 . . . . 181 ASN CB . 18575 1 2162 . 1 1 181 181 ASN CG C 13 178.25 0.20 . 1 . . . . 181 ASN CG . 18575 1 2163 . 1 1 181 181 ASN N N 15 125.88 0.20 . 1 . . . . 181 ASN N . 18575 1 2164 . 1 1 181 181 ASN ND2 N 15 115.23 0.20 . 1 . . . . 181 ASN ND2 . 18575 1 stop_ save_