data_16683 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16683 _Entry.Title ; RRM domain of mRNA export adaptor REF2-I bound to HSV-1 ICP27 peptide ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-01-18 _Entry.Accession_date 2010-01-18 _Entry.Last_release_date 2011-01-25 _Entry.Original_release_date 2011-01-25 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'NMR, 20 STRUCTURES' _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 Richard Tunnicliffe N. B. . 16683 2 Alexander Golovanov . P. . 16683 3 Stuart Wilson . A. . 16683 4 Guillaume Hautbergue . M. . 16683 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'not applicable' 'not applicable' . 16683 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'REF ICP27 HSV-1' . 16683 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16683 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 627 16683 '15N chemical shifts' 159 16683 '1H chemical shifts' 1049 16683 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-01-25 2010-01-18 original author . 16683 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2F3J 'REF in free form' 16683 PDB 2KT5 'BMRB Entry Tracking System' 16683 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 16683 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21253573 _Citation.Full_citation . _Citation.Title 'Structural Basis for the Recognition of Cellular mRNA Export Factor REF by Herpes Viral Proteins HSV-1 ICP27 and HVS ORF57.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'PLoS Pathog.' _Citation.Journal_name_full 'PLoS pathogens' _Citation.Journal_volume 7 _Citation.Journal_issue 1 _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 e1001244 _Citation.Page_last . _Citation.Year 2011 _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 Richard Tunnicliffe . B. . 16683 1 2 Guillaume Hautbergue . M. . 16683 1 3 Priti Kalra . . . 16683 1 4 Brian Jackson . R. . 16683 1 5 Adrian Whitehouse . . . 16683 1 6 Stuart Wilson . A. . 16683 1 7 Alexander Golovanov . P. . 16683 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16683 _Assembly.ID 1 _Assembly.Name 'REF2-I/HSV-1 ICP27 peptide' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 REF_54-155 1 $REF_54-155 A . yes native no no . . . 16683 1 2 ICP27_103-138 2 $ICP27_103-138 B . yes native no no . . . 16683 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_REF_54-155 _Entity.Sf_category entity _Entity.Sf_framecode REF_54-155 _Entity.Entry_ID 16683 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name REF_54-155 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MASMTGGQQMGRDPDKWQHD LFDSGCGGGEGVETGAKLLV SNLDFGVSDADIQELFAEFG TLKKAAVDYDRSGRSLGTAD VHFERRADALKAMKQYKGVP LDGRPMDIQLVASQIDLEHH HHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'Residues 54-155 are correctly numbered for wild type sequence' _Entity.Polymer_author_seq_details ; Construct contains the following non-REF sequences: N-terminal T7 tag: MASMTGGQQMGRDP (assigned residue numbers 40-53) C-terminal His tag: LEHHHHHH (assigned residue numbers 156-163) ; _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 124 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'REF fragment containing stable RRM domain' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13596.237 _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 16697 . REF_54-155 . . . . . 100.00 124 100.00 100.00 3.89e-84 . . . . 16683 1 2 no BMRB 17693 . RNA_AND_EXPORT_FACTOR-BINDING_PROTEIN_2 . . . . . 100.00 124 100.00 100.00 3.89e-84 . . . . 16683 1 3 no PDB 2KT5 . "Rrm Domain Of Mrna Export Adaptor Ref2-I Bound To Hsv-1 Icp27 Peptide" . . . . . 100.00 124 100.00 100.00 3.89e-84 . . . . 16683 1 4 no PDB 2YKA . "Rrm Domain Of Mrna Export Adaptor Ref2-i Bound To Hvs Orf57 Peptide" . . . . . 99.19 124 100.00 100.00 2.66e-83 . . . . 16683 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 40 MET . 16683 1 2 41 ALA . 16683 1 3 42 SER . 16683 1 4 43 MET . 16683 1 5 44 THR . 16683 1 6 45 GLY . 16683 1 7 46 GLY . 16683 1 8 47 GLN . 16683 1 9 48 GLN . 16683 1 10 49 MET . 16683 1 11 50 GLY . 16683 1 12 51 ARG . 16683 1 13 52 ASP . 16683 1 14 53 PRO . 16683 1 15 54 ASP . 16683 1 16 55 LYS . 16683 1 17 56 TRP . 16683 1 18 57 GLN . 16683 1 19 58 HIS . 16683 1 20 59 ASP . 16683 1 21 60 LEU . 16683 1 22 61 PHE . 16683 1 23 62 ASP . 16683 1 24 63 SER . 16683 1 25 64 GLY . 16683 1 26 65 CYS . 16683 1 27 66 GLY . 16683 1 28 67 GLY . 16683 1 29 68 GLY . 16683 1 30 69 GLU . 16683 1 31 70 GLY . 16683 1 32 71 VAL . 16683 1 33 72 GLU . 16683 1 34 73 THR . 16683 1 35 74 GLY . 16683 1 36 75 ALA . 16683 1 37 76 LYS . 16683 1 38 77 LEU . 16683 1 39 78 LEU . 16683 1 40 79 VAL . 16683 1 41 80 SER . 16683 1 42 81 ASN . 16683 1 43 82 LEU . 16683 1 44 83 ASP . 16683 1 45 84 PHE . 16683 1 46 85 GLY . 16683 1 47 86 VAL . 16683 1 48 87 SER . 16683 1 49 88 ASP . 16683 1 50 89 ALA . 16683 1 51 90 ASP . 16683 1 52 91 ILE . 16683 1 53 92 GLN . 16683 1 54 93 GLU . 16683 1 55 94 LEU . 16683 1 56 95 PHE . 16683 1 57 96 ALA . 16683 1 58 97 GLU . 16683 1 59 98 PHE . 16683 1 60 99 GLY . 16683 1 61 100 THR . 16683 1 62 101 LEU . 16683 1 63 102 LYS . 16683 1 64 103 LYS . 16683 1 65 104 ALA . 16683 1 66 105 ALA . 16683 1 67 106 VAL . 16683 1 68 107 ASP . 16683 1 69 108 TYR . 16683 1 70 109 ASP . 16683 1 71 110 ARG . 16683 1 72 111 SER . 16683 1 73 112 GLY . 16683 1 74 113 ARG . 16683 1 75 114 SER . 16683 1 76 115 LEU . 16683 1 77 116 GLY . 16683 1 78 117 THR . 16683 1 79 118 ALA . 16683 1 80 119 ASP . 16683 1 81 120 VAL . 16683 1 82 121 HIS . 16683 1 83 122 PHE . 16683 1 84 123 GLU . 16683 1 85 124 ARG . 16683 1 86 125 ARG . 16683 1 87 126 ALA . 16683 1 88 127 ASP . 16683 1 89 128 ALA . 16683 1 90 129 LEU . 16683 1 91 130 LYS . 16683 1 92 131 ALA . 16683 1 93 132 MET . 16683 1 94 133 LYS . 16683 1 95 134 GLN . 16683 1 96 135 TYR . 16683 1 97 136 LYS . 16683 1 98 137 GLY . 16683 1 99 138 VAL . 16683 1 100 139 PRO . 16683 1 101 140 LEU . 16683 1 102 141 ASP . 16683 1 103 142 GLY . 16683 1 104 143 ARG . 16683 1 105 144 PRO . 16683 1 106 145 MET . 16683 1 107 146 ASP . 16683 1 108 147 ILE . 16683 1 109 148 GLN . 16683 1 110 149 LEU . 16683 1 111 150 VAL . 16683 1 112 151 ALA . 16683 1 113 152 SER . 16683 1 114 153 GLN . 16683 1 115 154 ILE . 16683 1 116 155 ASP . 16683 1 117 156 LEU . 16683 1 118 157 GLU . 16683 1 119 158 HIS . 16683 1 120 159 HIS . 16683 1 121 160 HIS . 16683 1 122 161 HIS . 16683 1 123 162 HIS . 16683 1 124 163 HIS . 16683 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 . MET 1 1 16683 1 . ALA 2 2 16683 1 . SER 3 3 16683 1 . MET 4 4 16683 1 . THR 5 5 16683 1 . GLY 6 6 16683 1 . GLY 7 7 16683 1 . GLN 8 8 16683 1 . GLN 9 9 16683 1 . MET 10 10 16683 1 . GLY 11 11 16683 1 . ARG 12 12 16683 1 . ASP 13 13 16683 1 . PRO 14 14 16683 1 . ASP 15 15 16683 1 . LYS 16 16 16683 1 . TRP 17 17 16683 1 . GLN 18 18 16683 1 . HIS 19 19 16683 1 . ASP 20 20 16683 1 . LEU 21 21 16683 1 . PHE 22 22 16683 1 . ASP 23 23 16683 1 . SER 24 24 16683 1 . GLY 25 25 16683 1 . CYS 26 26 16683 1 . GLY 27 27 16683 1 . GLY 28 28 16683 1 . GLY 29 29 16683 1 . GLU 30 30 16683 1 . GLY 31 31 16683 1 . VAL 32 32 16683 1 . GLU 33 33 16683 1 . THR 34 34 16683 1 . GLY 35 35 16683 1 . ALA 36 36 16683 1 . LYS 37 37 16683 1 . LEU 38 38 16683 1 . LEU 39 39 16683 1 . VAL 40 40 16683 1 . SER 41 41 16683 1 . ASN 42 42 16683 1 . LEU 43 43 16683 1 . ASP 44 44 16683 1 . PHE 45 45 16683 1 . GLY 46 46 16683 1 . VAL 47 47 16683 1 . SER 48 48 16683 1 . ASP 49 49 16683 1 . ALA 50 50 16683 1 . ASP 51 51 16683 1 . ILE 52 52 16683 1 . GLN 53 53 16683 1 . GLU 54 54 16683 1 . LEU 55 55 16683 1 . PHE 56 56 16683 1 . ALA 57 57 16683 1 . GLU 58 58 16683 1 . PHE 59 59 16683 1 . GLY 60 60 16683 1 . THR 61 61 16683 1 . LEU 62 62 16683 1 . LYS 63 63 16683 1 . LYS 64 64 16683 1 . ALA 65 65 16683 1 . ALA 66 66 16683 1 . VAL 67 67 16683 1 . ASP 68 68 16683 1 . TYR 69 69 16683 1 . ASP 70 70 16683 1 . ARG 71 71 16683 1 . SER 72 72 16683 1 . GLY 73 73 16683 1 . ARG 74 74 16683 1 . SER 75 75 16683 1 . LEU 76 76 16683 1 . GLY 77 77 16683 1 . THR 78 78 16683 1 . ALA 79 79 16683 1 . ASP 80 80 16683 1 . VAL 81 81 16683 1 . HIS 82 82 16683 1 . PHE 83 83 16683 1 . GLU 84 84 16683 1 . ARG 85 85 16683 1 . ARG 86 86 16683 1 . ALA 87 87 16683 1 . ASP 88 88 16683 1 . ALA 89 89 16683 1 . LEU 90 90 16683 1 . LYS 91 91 16683 1 . ALA 92 92 16683 1 . MET 93 93 16683 1 . LYS 94 94 16683 1 . GLN 95 95 16683 1 . TYR 96 96 16683 1 . LYS 97 97 16683 1 . GLY 98 98 16683 1 . VAL 99 99 16683 1 . PRO 100 100 16683 1 . LEU 101 101 16683 1 . ASP 102 102 16683 1 . GLY 103 103 16683 1 . ARG 104 104 16683 1 . PRO 105 105 16683 1 . MET 106 106 16683 1 . ASP 107 107 16683 1 . ILE 108 108 16683 1 . GLN 109 109 16683 1 . LEU 110 110 16683 1 . VAL 111 111 16683 1 . ALA 112 112 16683 1 . SER 113 113 16683 1 . GLN 114 114 16683 1 . ILE 115 115 16683 1 . ASP 116 116 16683 1 . LEU 117 117 16683 1 . GLU 118 118 16683 1 . HIS 119 119 16683 1 . HIS 120 120 16683 1 . HIS 121 121 16683 1 . HIS 122 122 16683 1 . HIS 123 123 16683 1 . HIS 124 124 16683 1 stop_ save_ save_ICP27_103-138 _Entity.Sf_category entity _Entity.Sf_framecode ICP27_103-138 _Entity.Entry_ID 16683 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name ICP27_103-138 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPLGSVWSRLGARRPSCSPE RHGGKVARLQPPPTKAQPAR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'Residues 103-138 are correctly numbered for wild type sequence' _Entity.Polymer_author_seq_details 'The construct contains the following non-ICP27 sequence remaining from protease cleavage site at N-termini: GPLG (assigned residue numbers 99-102)' _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 40 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'REF interaction fragment' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 4268.970 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-30 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 16696 . ICP27_103-138 . . . . . 100.00 40 100.00 100.00 5.97e-18 . . . . 16683 2 2 no PDB 2KT5 . "Rrm Domain Of Mrna Export Adaptor Ref2-I Bound To Hsv-1 Icp27 Peptide" . . . . . 100.00 40 100.00 100.00 5.97e-18 . . . . 16683 2 3 no DBJ BAE44978 . "ICP27 [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.62e-12 . . . . 16683 2 4 no DBJ BAE44979 . "ICP27 [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.64e-12 . . . . 16683 2 5 no DBJ BAE44980 . "ICP27 [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.62e-12 . . . . 16683 2 6 no DBJ BAE44981 . "ICP27 [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.62e-12 . . . . 16683 2 7 no DBJ BAE44982 . "ICP27 [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.62e-12 . . . . 16683 2 8 no EMBL CAA32290 . "immediate early protein [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.52e-12 . . . . 16683 2 9 no GB AAF43147 . "ICP27 [human herpesvirus 1]" . . . . . 87.50 512 100.00 100.00 4.44e-13 . . . . 16683 2 10 no GB ACM62278 . "multifunctional expression regulator [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.56e-12 . . . . 16683 2 11 no GB ACU57136 . "immediate-early protein ICP27 [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.50e-12 . . . . 16683 2 12 no GB ADD60047 . "multifunctional expression regulator [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.66e-12 . . . . 16683 2 13 no GB ADD60124 . "multifunctional expression regulator [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.69e-12 . . . . 16683 2 14 no REF NP_044657 . "multifunctional expression regulator [Human herpesvirus 1]" . . . . . 87.50 512 97.14 100.00 1.52e-12 . . . . 16683 2 15 no SP P10238 . "RecName: Full=mRNA export factor; AltName: Full=Immediate-early protein IE63; AltName: Full=Infected cell protein 27; Short=ICP" . . . . . 87.50 512 97.14 100.00 1.52e-12 . . . . 16683 2 16 no SP P36295 . "RecName: Full=mRNA export factor; AltName: Full=Immediate-early protein IE63; AltName: Full=Infected cell protein 27; Short=ICP" . . . . . 87.50 511 97.14 100.00 1.54e-12 . . . . 16683 2 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 99 GLY . 16683 2 2 100 PRO . 16683 2 3 101 LEU . 16683 2 4 102 GLY . 16683 2 5 103 SER . 16683 2 6 104 VAL . 16683 2 7 105 TRP . 16683 2 8 106 SER . 16683 2 9 107 ARG . 16683 2 10 108 LEU . 16683 2 11 109 GLY . 16683 2 12 110 ALA . 16683 2 13 111 ARG . 16683 2 14 112 ARG . 16683 2 15 113 PRO . 16683 2 16 114 SER . 16683 2 17 115 CYS . 16683 2 18 116 SER . 16683 2 19 117 PRO . 16683 2 20 118 GLU . 16683 2 21 119 ARG . 16683 2 22 120 HIS . 16683 2 23 121 GLY . 16683 2 24 122 GLY . 16683 2 25 123 LYS . 16683 2 26 124 VAL . 16683 2 27 125 ALA . 16683 2 28 126 ARG . 16683 2 29 127 LEU . 16683 2 30 128 GLN . 16683 2 31 129 PRO . 16683 2 32 130 PRO . 16683 2 33 131 PRO . 16683 2 34 132 THR . 16683 2 35 133 LYS . 16683 2 36 134 ALA . 16683 2 37 135 GLN . 16683 2 38 136 PRO . 16683 2 39 137 ALA . 16683 2 40 138 ARG . 16683 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 16683 2 . PRO 2 2 16683 2 . LEU 3 3 16683 2 . GLY 4 4 16683 2 . SER 5 5 16683 2 . VAL 6 6 16683 2 . TRP 7 7 16683 2 . SER 8 8 16683 2 . ARG 9 9 16683 2 . LEU 10 10 16683 2 . GLY 11 11 16683 2 . ALA 12 12 16683 2 . ARG 13 13 16683 2 . ARG 14 14 16683 2 . PRO 15 15 16683 2 . SER 16 16 16683 2 . CYS 17 17 16683 2 . SER 18 18 16683 2 . PRO 19 19 16683 2 . GLU 20 20 16683 2 . ARG 21 21 16683 2 . HIS 22 22 16683 2 . GLY 23 23 16683 2 . GLY 24 24 16683 2 . LYS 25 25 16683 2 . VAL 26 26 16683 2 . ALA 27 27 16683 2 . ARG 28 28 16683 2 . LEU 29 29 16683 2 . GLN 30 30 16683 2 . PRO 31 31 16683 2 . PRO 32 32 16683 2 . PRO 33 33 16683 2 . THR 34 34 16683 2 . LYS 35 35 16683 2 . ALA 36 36 16683 2 . GLN 37 37 16683 2 . PRO 38 38 16683 2 . ALA 39 39 16683 2 . ARG 40 40 16683 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 16683 _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 $REF_54-155 . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 16683 1 2 2 $ICP27_103-138 . 10298 virus . 'Human herpesvirus 1' 'Herpes simplex virus type 1' HHV-1 00.031.1.01.001. . . Simplexvirus . . . . . . . . . . . . . . . . . . . . . . 16683 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 16683 _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 $REF_54-155 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3) RP' . . . . . . . . . . . . . . . pET24b . . . . . . 16683 1 2 2 $ICP27_103-138 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3) RP' . . . . . . . . . . . . . . . pGEX-6P-1 . . . . . . 16683 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16683 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '13C/15N-REF 54-155 and unlabelled ICP27 103-138 (1:2)' _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 'REF 54-155' '[U-99% 13C; U-99% 15N]' . . 1 $REF_54-155 . . 1 . . mM 0.05 . . . 16683 1 2 'ICP27 103-138' 'natural abundance' . . 2 $ICP27_103-138 . . 2 . . mM 0.05 . . . 16683 1 3 'Na phosphate buffer' 'natural abundance' . . . . . . 20 . . mM . . . . 16683 1 4 NaCl 'natural abundance' . . . . . . 50 . . mM . . . . 16683 1 5 L-Arg 'natural abundance' . . . . . . 50 . . mM . . . . 16683 1 6 L-Glu 'natural abundance' . . . . . . 50 . . mM . . . . 16683 1 7 2-mercaptoethanol 'natural abundance' . . . . . . 50 . . mM . . . . 16683 1 8 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 16683 1 9 EDTA 'natural abundance' . . . . . . 10 . . mM . . . . 16683 1 10 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16683 1 11 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16683 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 16683 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '13C/15N ICP27 103-138 and unlabelled REF 54-155 (1:2)' _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 'ICP27 103-138' '[U-99% 13C; U-99% 15N]' . . 2 $ICP27_103-138 . . 1 . . mM 0.05 . . . 16683 2 2 'REF 54-155' 'natural abundance' . . 1 $REF_54-155 . . 2 . . mM 0.05 . . . 16683 2 3 'Na phosphate buffer' 'natural abundance' . . . . . . 20 . . mM . . . . 16683 2 4 NaCl 'natural abundance' . . . . . . 50 . . mM . . . . 16683 2 5 L-Arg 'natural abundance' . . . . . . 50 . . mM . . . . 16683 2 6 L-Glu 'natural abundance' . . . . . . 50 . . mM . . . . 16683 2 7 2-mercaptoethanol 'natural abundance' . . . . . . 50 . . mM . . . . 16683 2 8 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 16683 2 9 EDTA 'natural abundance' . . . . . . 10 . . mM . . . . 16683 2 10 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16683 2 11 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16683 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions _Sample_condition_list.Entry_ID 16683 _Sample_condition_list.ID 1 _Sample_condition_list.Details '20 mM Na phosphate buffer, pH 6.2, 50 mM NaCl, 50 mM L-Arg, 50 mM L-Glu, 50 mM 2-mercaptoethanol, 10 mM DTT, 10 mM EDTA' 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' 50 0.5 mM 16683 1 pH 6.2 0.05 pH 16683 1 pressure 1 . atm 16683 1 temperature 303 0.1 K 16683 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 16683 _Software.ID 1 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'P.GUNTERT ET AL.' . . 16683 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 16683 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 16683 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 16683 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16683 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 16683 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'Majority of spectra acquired on 600' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _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 16683 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'Used for carbonyl backbone assignment spectra' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance II+' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 16683 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details 'Used for filtered NOESY spectra' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16683 _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 DRX . 600 'Majority of spectra acquired on 600' . . 16683 1 2 spectrometer_2 Bruker 'Avance II+' . 700 'Used for carbonyl backbone assignment spectra' . . 16683 1 3 spectrometer_3 Varian INOVA . 800 'Used for filtered NOESY spectra' . . 16683 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 16683 _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 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16683 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16683 1 3 'filtered 13C-NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16683 1 4 'filtered 13C-NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16683 1 5 '3D 13C-separated NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16683 1 6 '3D 15N-separated NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16683 1 7 '3D Standard triple-resonance' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 16683 1 8 '3d Standard triple-resonance' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions . . . . . . . . . . . . . . . . . . . . . 16683 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_shift_ref _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode shift_ref _Chem_shift_reference.Entry_ID 16683 _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 . . . . . . . . . 16683 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16683 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 16683 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 16683 _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 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $shift_ref _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.10 _Assigned_chem_shift_list.Chem_shift_15N_err 0.10 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details 'The file contains assignments for REF(54-155) merged with assignments of ICP27(103-138). Numbering of ICP27 peptide with the N-terminal tag starts from residue 200 in the file.' _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 7 '3D Standard triple-resonance' . . . 16683 1 8 '3d Standard triple-resonance' . . . 16683 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $CYANA . . 16683 1 2 $SPARKY . . 16683 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 SER HA H 1 4.559 0.020 . 1 . . . . 42 SER HA . 16683 1 2 . 1 1 3 3 SER HB2 H 1 3.898 0.020 . 1 . . . . 42 SER HB2 . 16683 1 3 . 1 1 3 3 SER C C 13 174.420 0.100 . 1 . . . . 42 SER C . 16683 1 4 . 1 1 3 3 SER CA C 13 58.354 0.100 . 1 . . . . 42 SER CA . 16683 1 5 . 1 1 3 3 SER CB C 13 63.912 0.100 . 1 . . . . 42 SER CB . 16683 1 6 . 1 1 4 4 MET H H 1 8.673 0.020 . 1 . . . . 43 MET H . 16683 1 7 . 1 1 4 4 MET HA H 1 4.625 0.020 . 1 . . . . 43 MET HA . 16683 1 8 . 1 1 4 4 MET HB2 H 1 2.167 0.020 . 1 . . . . 43 MET HB2 . 16683 1 9 . 1 1 4 4 MET HB3 H 1 2.074 0.020 . 1 . . . . 43 MET HB3 . 16683 1 10 . 1 1 4 4 MET HE1 H 1 2.090 0.020 . 1 . . . . 43 MET HE . 16683 1 11 . 1 1 4 4 MET HE2 H 1 2.090 0.020 . 1 . . . . 43 MET HE . 16683 1 12 . 1 1 4 4 MET HE3 H 1 2.090 0.020 . 1 . . . . 43 MET HE . 16683 1 13 . 1 1 4 4 MET HG2 H 1 2.642 0.020 . 1 . . . . 43 MET HG2 . 16683 1 14 . 1 1 4 4 MET HG3 H 1 2.517 0.020 . 1 . . . . 43 MET HG3 . 16683 1 15 . 1 1 4 4 MET C C 13 176.440 0.100 . 1 . . . . 43 MET C . 16683 1 16 . 1 1 4 4 MET CA C 13 55.781 0.100 . 1 . . . . 43 MET CA . 16683 1 17 . 1 1 4 4 MET CB C 13 32.862 0.100 . 1 . . . . 43 MET CB . 16683 1 18 . 1 1 4 4 MET CE C 13 17.710 0.100 . 1 . . . . 43 MET CE . 16683 1 19 . 1 1 4 4 MET CG C 13 32.942 0.100 . 1 . . . . 43 MET CG . 16683 1 20 . 1 1 4 4 MET N N 15 122.745 0.100 . 1 . . . . 43 MET N . 16683 1 21 . 1 1 5 5 THR H H 1 8.233 0.020 . 1 . . . . 44 THR H . 16683 1 22 . 1 1 5 5 THR HA H 1 4.386 0.020 . 1 . . . . 44 THR HA . 16683 1 23 . 1 1 5 5 THR HB H 1 4.291 0.020 . 1 . . . . 44 THR HB . 16683 1 24 . 1 1 5 5 THR HG21 H 1 1.223 0.020 . 1 . . . . 44 THR HG2 . 16683 1 25 . 1 1 5 5 THR HG22 H 1 1.223 0.020 . 1 . . . . 44 THR HG2 . 16683 1 26 . 1 1 5 5 THR HG23 H 1 1.223 0.020 . 1 . . . . 44 THR HG2 . 16683 1 27 . 1 1 5 5 THR C C 13 175.110 0.100 . 1 . . . . 44 THR C . 16683 1 28 . 1 1 5 5 THR CA C 13 61.985 0.100 . 1 . . . . 44 THR CA . 16683 1 29 . 1 1 5 5 THR CB C 13 70.039 0.100 . 1 . . . . 44 THR CB . 16683 1 30 . 1 1 5 5 THR CG2 C 13 21.462 0.100 . 1 . . . . 44 THR CG2 . 16683 1 31 . 1 1 5 5 THR N N 15 114.663 0.100 . 1 . . . . 44 THR N . 16683 1 32 . 1 1 6 6 GLY H H 1 8.461 0.020 . 1 . . . . 45 GLY H . 16683 1 33 . 1 1 6 6 GLY HA2 H 1 4.030 0.020 . 1 . . . . 45 GLY HA2 . 16683 1 34 . 1 1 6 6 GLY HA3 H 1 4.030 0.020 . 1 . . . . 45 GLY HA3 . 16683 1 35 . 1 1 6 6 GLY C C 13 174.710 0.100 . 1 . . . . 45 GLY C . 16683 1 36 . 1 1 6 6 GLY CA C 13 45.543 0.100 . 1 . . . . 45 GLY CA . 16683 1 37 . 1 1 6 6 GLY N N 15 111.233 0.100 . 1 . . . . 45 GLY N . 16683 1 38 . 1 1 7 7 GLY HA2 H 1 3.997 0.020 . 1 . . . . 46 GLY HA2 . 16683 1 39 . 1 1 7 7 GLY HA3 H 1 3.986 0.020 . 1 . . . . 46 GLY HA3 . 16683 1 40 . 1 1 7 7 GLY C C 13 174.290 0.100 . 1 . . . . 46 GLY C . 16683 1 41 . 1 1 7 7 GLY CA C 13 45.322 0.100 . 1 . . . . 46 GLY CA . 16683 1 42 . 1 1 8 8 GLN H H 1 8.325 0.020 . 1 . . . . 47 GLN H . 16683 1 43 . 1 1 8 8 GLN HA H 1 4.346 0.020 . 1 . . . . 47 GLN HA . 16683 1 44 . 1 1 8 8 GLN HB2 H 1 2.084 0.020 . 1 . . . . 47 GLN HB2 . 16683 1 45 . 1 1 8 8 GLN HB3 H 1 2.110 0.020 . 1 . . . . 47 GLN HB3 . 16683 1 46 . 1 1 8 8 GLN HE21 H 1 6.870 0.020 . 1 . . . . 47 GLN HE21 . 16683 1 47 . 1 1 8 8 GLN HE22 H 1 7.534 0.020 . 1 . . . . 47 GLN HE22 . 16683 1 48 . 1 1 8 8 GLN HG2 H 1 2.370 0.020 . 1 . . . . 47 GLN HG2 . 16683 1 49 . 1 1 8 8 GLN HG3 H 1 2.378 0.020 . 1 . . . . 47 GLN HG3 . 16683 1 50 . 1 1 8 8 GLN C C 13 176.050 0.100 . 1 . . . . 47 GLN C . 16683 1 51 . 1 1 8 8 GLN CA C 13 56.180 0.100 . 1 . . . . 47 GLN CA . 16683 1 52 . 1 1 8 8 GLN CB C 13 29.462 0.100 . 1 . . . . 47 GLN CB . 16683 1 53 . 1 1 8 8 GLN CG C 13 33.564 0.100 . 1 . . . . 47 GLN CG . 16683 1 54 . 1 1 8 8 GLN N N 15 119.716 0.100 . 1 . . . . 47 GLN N . 16683 1 55 . 1 1 8 8 GLN NE2 N 15 112.200 0.100 . 1 . . . . 47 GLN NE2 . 16683 1 56 . 1 1 9 9 GLN H H 1 8.505 0.020 . 1 . . . . 48 GLN H . 16683 1 57 . 1 1 9 9 GLN HA H 1 4.345 0.020 . 1 . . . . 48 GLN HA . 16683 1 58 . 1 1 9 9 GLN HB2 H 1 2.011 0.020 . 1 . . . . 48 GLN HB2 . 16683 1 59 . 1 1 9 9 GLN HB3 H 1 2.118 0.020 . 1 . . . . 48 GLN HB3 . 16683 1 60 . 1 1 9 9 GLN HE21 H 1 6.867 0.020 . 1 . . . . 48 GLN HE21 . 16683 1 61 . 1 1 9 9 GLN HE22 H 1 7.512 0.020 . 1 . . . . 48 GLN HE22 . 16683 1 62 . 1 1 9 9 GLN HG2 H 1 2.359 0.020 . 1 . . . . 48 GLN HG2 . 16683 1 63 . 1 1 9 9 GLN HG3 H 1 2.376 0.020 . 1 . . . . 48 GLN HG3 . 16683 1 64 . 1 1 9 9 GLN C C 13 175.960 0.100 . 1 . . . . 48 GLN C . 16683 1 65 . 1 1 9 9 GLN CA C 13 56.257 0.100 . 1 . . . . 48 GLN CA . 16683 1 66 . 1 1 9 9 GLN CB C 13 28.964 0.100 . 1 . . . . 48 GLN CB . 16683 1 67 . 1 1 9 9 GLN CG C 13 33.564 0.100 . 1 . . . . 48 GLN CG . 16683 1 68 . 1 1 9 9 GLN N N 15 121.317 0.100 . 1 . . . . 48 GLN N . 16683 1 69 . 1 1 9 9 GLN NE2 N 15 112.300 0.100 . 1 . . . . 48 GLN NE2 . 16683 1 70 . 1 1 10 10 MET H H 1 8.427 0.020 . 1 . . . . 49 MET H . 16683 1 71 . 1 1 10 10 MET HA H 1 4.491 0.020 . 1 . . . . 49 MET HA . 16683 1 72 . 1 1 10 10 MET HB2 H 1 2.028 0.020 . 1 . . . . 49 MET HB2 . 16683 1 73 . 1 1 10 10 MET HB3 H 1 2.106 0.020 . 1 . . . . 49 MET HB3 . 16683 1 74 . 1 1 10 10 MET HG2 H 1 2.558 0.020 . 1 . . . . 49 MET HG2 . 16683 1 75 . 1 1 10 10 MET HG3 H 1 2.638 0.020 . 1 . . . . 49 MET HG3 . 16683 1 76 . 1 1 10 10 MET C C 13 176.640 0.100 . 1 . . . . 49 MET C . 16683 1 77 . 1 1 10 10 MET CA C 13 55.735 0.100 . 1 . . . . 49 MET CA . 16683 1 78 . 1 1 10 10 MET CB C 13 32.524 0.100 . 1 . . . . 49 MET CB . 16683 1 79 . 1 1 10 10 MET CG C 13 32.012 0.100 . 1 . . . . 49 MET CG . 16683 1 80 . 1 1 10 10 MET N N 15 121.446 0.100 . 1 . . . . 49 MET N . 16683 1 81 . 1 1 11 11 GLY H H 1 8.434 0.020 . 1 . . . . 50 GLY H . 16683 1 82 . 1 1 11 11 GLY HA2 H 1 3.976 0.020 . 1 . . . . 50 GLY HA2 . 16683 1 83 . 1 1 11 11 GLY HA3 H 1 3.980 0.020 . 1 . . . . 50 GLY HA3 . 16683 1 84 . 1 1 11 11 GLY C C 13 173.760 0.100 . 1 . . . . 50 GLY C . 16683 1 85 . 1 1 11 11 GLY CA C 13 45.336 0.100 . 1 . . . . 50 GLY CA . 16683 1 86 . 1 1 11 11 GLY N N 15 109.911 0.100 . 1 . . . . 50 GLY N . 16683 1 87 . 1 1 12 12 ARG H H 1 8.133 0.020 . 1 . . . . 51 ARG H . 16683 1 88 . 1 1 12 12 ARG HA H 1 4.383 0.020 . 1 . . . . 51 ARG HA . 16683 1 89 . 1 1 12 12 ARG HB2 H 1 1.740 0.020 . 1 . . . . 51 ARG HB2 . 16683 1 90 . 1 1 12 12 ARG HB3 H 1 1.831 0.020 . 1 . . . . 51 ARG HB3 . 16683 1 91 . 1 1 12 12 ARG HD2 H 1 3.133 0.020 . 1 . . . . 51 ARG HD2 . 16683 1 92 . 1 1 12 12 ARG HD3 H 1 3.124 0.020 . 1 . . . . 51 ARG HD3 . 16683 1 93 . 1 1 12 12 ARG HG2 H 1 1.599 0.020 . 1 . . . . 51 ARG HG2 . 16683 1 94 . 1 1 12 12 ARG HG3 H 1 1.591 0.020 . 1 . . . . 51 ARG HG3 . 16683 1 95 . 1 1 12 12 ARG C C 13 175.680 0.100 . 1 . . . . 51 ARG C . 16683 1 96 . 1 1 12 12 ARG CA C 13 55.850 0.100 . 1 . . . . 51 ARG CA . 16683 1 97 . 1 1 12 12 ARG CB C 13 30.924 0.100 . 1 . . . . 51 ARG CB . 16683 1 98 . 1 1 12 12 ARG CD C 13 43.260 0.100 . 1 . . . . 51 ARG CD . 16683 1 99 . 1 1 12 12 ARG CG C 13 26.764 0.100 . 1 . . . . 51 ARG CG . 16683 1 100 . 1 1 12 12 ARG N N 15 120.041 0.100 . 1 . . . . 51 ARG N . 16683 1 101 . 1 1 13 13 ASP H H 1 8.455 0.020 . 1 . . . . 52 ASP H . 16683 1 102 . 1 1 13 13 ASP HA H 1 4.893 0.020 . 1 . . . . 52 ASP HA . 16683 1 103 . 1 1 13 13 ASP HB2 H 1 2.578 0.020 . 1 . . . . 52 ASP HB2 . 16683 1 104 . 1 1 13 13 ASP HB3 H 1 2.791 0.020 . 1 . . . . 52 ASP HB3 . 16683 1 105 . 1 1 13 13 ASP C C 13 174.780 0.100 . 1 . . . . 52 ASP C . 16683 1 106 . 1 1 13 13 ASP CA C 13 52.299 0.100 . 1 . . . . 52 ASP CA . 16683 1 107 . 1 1 13 13 ASP CB C 13 41.183 0.100 . 1 . . . . 52 ASP CB . 16683 1 108 . 1 1 13 13 ASP N N 15 123.029 0.100 . 1 . . . . 52 ASP N . 16683 1 109 . 1 1 14 14 PRO HA H 1 4.276 0.020 . 1 . . . . 53 PRO HA . 16683 1 110 . 1 1 14 14 PRO HB2 H 1 1.948 0.020 . 1 . . . . 53 PRO HB2 . 16683 1 111 . 1 1 14 14 PRO HB3 H 1 2.249 0.020 . 1 . . . . 53 PRO HB3 . 16683 1 112 . 1 1 14 14 PRO HD2 H 1 3.867 0.020 . 1 . . . . 53 PRO HD2 . 16683 1 113 . 1 1 14 14 PRO HD3 H 1 3.802 0.020 . 1 . . . . 53 PRO HD3 . 16683 1 114 . 1 1 14 14 PRO HG2 H 1 1.998 0.020 . 1 . . . . 53 PRO HG2 . 16683 1 115 . 1 1 14 14 PRO HG3 H 1 2.004 0.020 . 1 . . . . 53 PRO HG3 . 16683 1 116 . 1 1 14 14 PRO C C 13 177.070 0.100 . 1 . . . . 53 PRO C . 16683 1 117 . 1 1 14 14 PRO CA C 13 63.816 0.100 . 1 . . . . 53 PRO CA . 16683 1 118 . 1 1 14 14 PRO CB C 13 32.098 0.100 . 1 . . . . 53 PRO CB . 16683 1 119 . 1 1 14 14 PRO CD C 13 50.756 0.100 . 1 . . . . 53 PRO CD . 16683 1 120 . 1 1 14 14 PRO CG C 13 27.202 0.100 . 1 . . . . 53 PRO CG . 16683 1 121 . 1 1 15 15 ASP H H 1 8.354 0.020 . 1 . . . . 54 ASP H . 16683 1 122 . 1 1 15 15 ASP HA H 1 4.584 0.020 . 1 . . . . 54 ASP HA . 16683 1 123 . 1 1 15 15 ASP HB2 H 1 2.629 0.020 . 1 . . . . 54 ASP HB2 . 16683 1 124 . 1 1 15 15 ASP HB3 H 1 2.646 0.020 . 1 . . . . 54 ASP HB3 . 16683 1 125 . 1 1 15 15 ASP C C 13 176.690 0.100 . 1 . . . . 54 ASP C . 16683 1 126 . 1 1 15 15 ASP CA C 13 54.968 0.100 . 1 . . . . 54 ASP CA . 16683 1 127 . 1 1 15 15 ASP CB C 13 41.116 0.100 . 1 . . . . 54 ASP CB . 16683 1 128 . 1 1 15 15 ASP N N 15 118.771 0.100 . 1 . . . . 54 ASP N . 16683 1 129 . 1 1 16 16 LYS H H 1 7.902 0.020 . 1 . . . . 55 LYS H . 16683 1 130 . 1 1 16 16 LYS HA H 1 4.226 0.020 . 1 . . . . 55 LYS HA . 16683 1 131 . 1 1 16 16 LYS HB2 H 1 1.740 0.020 . 1 . . . . 55 LYS HB2 . 16683 1 132 . 1 1 16 16 LYS HB3 H 1 1.694 0.020 . 1 . . . . 55 LYS HB3 . 16683 1 133 . 1 1 16 16 LYS HD2 H 1 1.614 0.020 . 1 . . . . 55 LYS HD2 . 16683 1 134 . 1 1 16 16 LYS HD3 H 1 1.608 0.020 . 1 . . . . 55 LYS HD3 . 16683 1 135 . 1 1 16 16 LYS HE2 H 1 2.929 0.020 . 1 . . . . 55 LYS HE2 . 16683 1 136 . 1 1 16 16 LYS HE3 H 1 2.943 0.020 . 1 . . . . 55 LYS HE3 . 16683 1 137 . 1 1 16 16 LYS HG2 H 1 1.264 0.020 . 1 . . . . 55 LYS HG2 . 16683 1 138 . 1 1 16 16 LYS HG3 H 1 1.251 0.020 . 1 . . . . 55 LYS HG3 . 16683 1 139 . 1 1 16 16 LYS C C 13 176.450 0.100 . 1 . . . . 55 LYS C . 16683 1 140 . 1 1 16 16 LYS CA C 13 56.761 0.100 . 1 . . . . 55 LYS CA . 16683 1 141 . 1 1 16 16 LYS CB C 13 32.820 0.100 . 1 . . . . 55 LYS CB . 16683 1 142 . 1 1 16 16 LYS CD C 13 29.017 0.100 . 1 . . . . 55 LYS CD . 16683 1 143 . 1 1 16 16 LYS CE C 13 42.050 0.100 . 1 . . . . 55 LYS CE . 16683 1 144 . 1 1 16 16 LYS CG C 13 24.421 0.100 . 1 . . . . 55 LYS CG . 16683 1 145 . 1 1 16 16 LYS N N 15 120.156 0.100 . 1 . . . . 55 LYS N . 16683 1 146 . 1 1 17 17 TRP H H 1 7.962 0.020 . 1 . . . . 56 TRP H . 16683 1 147 . 1 1 17 17 TRP HA H 1 4.663 0.020 . 1 . . . . 56 TRP HA . 16683 1 148 . 1 1 17 17 TRP HB2 H 1 3.267 0.020 . 1 . . . . 56 TRP HB2 . 16683 1 149 . 1 1 17 17 TRP HB3 H 1 3.280 0.020 . 1 . . . . 56 TRP HB3 . 16683 1 150 . 1 1 17 17 TRP HD1 H 1 7.273 0.020 . 1 . . . . 56 TRP HD1 . 16683 1 151 . 1 1 17 17 TRP HE1 H 1 10.168 0.020 . 1 . . . . 56 TRP HE1 . 16683 1 152 . 1 1 17 17 TRP HE3 H 1 7.610 0.020 . 1 . . . . 56 TRP HE3 . 16683 1 153 . 1 1 17 17 TRP HH2 H 1 7.221 0.020 . 1 . . . . 56 TRP HH2 . 16683 1 154 . 1 1 17 17 TRP HZ2 H 1 7.479 0.020 . 1 . . . . 56 TRP HZ2 . 16683 1 155 . 1 1 17 17 TRP HZ3 H 1 7.116 0.020 . 1 . . . . 56 TRP HZ3 . 16683 1 156 . 1 1 17 17 TRP C C 13 176.240 0.100 . 1 . . . . 56 TRP C . 16683 1 157 . 1 1 17 17 TRP CA C 13 57.405 0.100 . 1 . . . . 56 TRP CA . 16683 1 158 . 1 1 17 17 TRP CB C 13 29.104 0.100 . 1 . . . . 56 TRP CB . 16683 1 159 . 1 1 17 17 TRP CD1 C 13 127.210 0.100 . 1 . . . . 56 TRP CD1 . 16683 1 160 . 1 1 17 17 TRP CE3 C 13 121.563 0.100 . 1 . . . . 56 TRP CE3 . 16683 1 161 . 1 1 17 17 TRP CH2 C 13 124.728 0.100 . 1 . . . . 56 TRP CH2 . 16683 1 162 . 1 1 17 17 TRP CZ2 C 13 114.634 0.100 . 1 . . . . 56 TRP CZ2 . 16683 1 163 . 1 1 17 17 TRP CZ3 C 13 121.360 0.100 . 1 . . . . 56 TRP CZ3 . 16683 1 164 . 1 1 17 17 TRP N N 15 120.480 0.100 . 1 . . . . 56 TRP N . 16683 1 165 . 1 1 17 17 TRP NE1 N 15 129.349 0.100 . 1 . . . . 56 TRP NE1 . 16683 1 166 . 1 1 18 18 GLN H H 1 8.011 0.020 . 1 . . . . 57 GLN H . 16683 1 167 . 1 1 18 18 GLN HA H 1 4.166 0.020 . 1 . . . . 57 GLN HA . 16683 1 168 . 1 1 18 18 GLN HB2 H 1 1.835 0.020 . 1 . . . . 57 GLN HB2 . 16683 1 169 . 1 1 18 18 GLN HB3 H 1 1.960 0.020 . 1 . . . . 57 GLN HB3 . 16683 1 170 . 1 1 18 18 GLN HE21 H 1 6.805 0.020 . 1 . . . . 57 GLN HE21 . 16683 1 171 . 1 1 18 18 GLN HE22 H 1 7.433 0.020 . 1 . . . . 57 GLN HE22 . 16683 1 172 . 1 1 18 18 GLN HG2 H 1 2.091 0.020 . 1 . . . . 57 GLN HG2 . 16683 1 173 . 1 1 18 18 GLN HG3 H 1 2.110 0.020 . 1 . . . . 57 GLN HG3 . 16683 1 174 . 1 1 18 18 GLN C C 13 175.710 0.100 . 1 . . . . 57 GLN C . 16683 1 175 . 1 1 18 18 GLN CA C 13 56.280 0.100 . 1 . . . . 57 GLN CA . 16683 1 176 . 1 1 18 18 GLN CB C 13 28.844 0.100 . 1 . . . . 57 GLN CB . 16683 1 177 . 1 1 18 18 GLN CG C 13 32.554 0.100 . 1 . . . . 57 GLN CG . 16683 1 178 . 1 1 18 18 GLN N N 15 120.900 0.100 . 1 . . . . 57 GLN N . 16683 1 179 . 1 1 18 18 GLN NE2 N 15 112.058 0.100 . 1 . . . . 57 GLN NE2 . 16683 1 180 . 1 1 19 19 HIS H H 1 8.162 0.020 . 1 . . . . 58 HIS H . 16683 1 181 . 1 1 19 19 HIS HA H 1 4.544 0.020 . 1 . . . . 58 HIS HA . 16683 1 182 . 1 1 19 19 HIS HB2 H 1 3.186 0.020 . 1 . . . . 58 HIS HB2 . 16683 1 183 . 1 1 19 19 HIS HB3 H 1 3.111 0.020 . 1 . . . . 58 HIS HB3 . 16683 1 184 . 1 1 19 19 HIS HD2 H 1 7.175 0.020 . 1 . . . . 58 HIS HD2 . 16683 1 185 . 1 1 19 19 HIS HE1 H 1 8.213 0.020 . 1 . . . . 58 HIS HE1 . 16683 1 186 . 1 1 19 19 HIS C C 13 174.660 0.100 . 1 . . . . 58 HIS C . 16683 1 187 . 1 1 19 19 HIS CA C 13 56.260 0.100 . 1 . . . . 58 HIS CA . 16683 1 188 . 1 1 19 19 HIS CB C 13 29.544 0.100 . 1 . . . . 58 HIS CB . 16683 1 189 . 1 1 19 19 HIS CD2 C 13 121.060 0.100 . 1 . . . . 58 HIS CD2 . 16683 1 190 . 1 1 19 19 HIS CE1 C 13 137.560 0.100 . 1 . . . . 58 HIS CE1 . 16683 1 191 . 1 1 19 19 HIS N N 15 119.286 0.100 . 1 . . . . 58 HIS N . 16683 1 192 . 1 1 20 20 ASP H H 1 8.380 0.020 . 1 . . . . 59 ASP H . 16683 1 193 . 1 1 20 20 ASP HA H 1 4.571 0.020 . 1 . . . . 59 ASP HA . 16683 1 194 . 1 1 20 20 ASP HB2 H 1 2.666 0.020 . 1 . . . . 59 ASP HB2 . 16683 1 195 . 1 1 20 20 ASP HB3 H 1 2.646 0.020 . 1 . . . . 59 ASP HB3 . 16683 1 196 . 1 1 20 20 ASP C C 13 176.160 0.100 . 1 . . . . 59 ASP C . 16683 1 197 . 1 1 20 20 ASP CA C 13 54.660 0.100 . 1 . . . . 59 ASP CA . 16683 1 198 . 1 1 20 20 ASP CB C 13 41.130 0.100 . 1 . . . . 59 ASP CB . 16683 1 199 . 1 1 20 20 ASP N N 15 120.646 0.100 . 1 . . . . 59 ASP N . 16683 1 200 . 1 1 21 21 LEU H H 1 8.069 0.020 . 1 . . . . 60 LEU H . 16683 1 201 . 1 1 21 21 LEU HA H 1 4.234 0.020 . 1 . . . . 60 LEU HA . 16683 1 202 . 1 1 21 21 LEU HB2 H 1 1.408 0.020 . 1 . . . . 60 LEU HB2 . 16683 1 203 . 1 1 21 21 LEU HB3 H 1 1.492 0.020 . 1 . . . . 60 LEU HB3 . 16683 1 204 . 1 1 21 21 LEU HD11 H 1 0.799 0.020 . 1 . . . . 60 LEU HD1 . 16683 1 205 . 1 1 21 21 LEU HD12 H 1 0.799 0.020 . 1 . . . . 60 LEU HD1 . 16683 1 206 . 1 1 21 21 LEU HD13 H 1 0.799 0.020 . 1 . . . . 60 LEU HD1 . 16683 1 207 . 1 1 21 21 LEU HD21 H 1 0.861 0.020 . 1 . . . . 60 LEU HD2 . 16683 1 208 . 1 1 21 21 LEU HD22 H 1 0.861 0.020 . 1 . . . . 60 LEU HD2 . 16683 1 209 . 1 1 21 21 LEU HD23 H 1 0.861 0.020 . 1 . . . . 60 LEU HD2 . 16683 1 210 . 1 1 21 21 LEU HG H 1 1.501 0.020 . 1 . . . . 60 LEU HG . 16683 1 211 . 1 1 21 21 LEU C C 13 177.210 0.100 . 1 . . . . 60 LEU C . 16683 1 212 . 1 1 21 21 LEU CA C 13 55.718 0.100 . 1 . . . . 60 LEU CA . 16683 1 213 . 1 1 21 21 LEU CB C 13 42.270 0.100 . 1 . . . . 60 LEU CB . 16683 1 214 . 1 1 21 21 LEU CD1 C 13 23.612 0.100 . 1 . . . . 60 LEU CD1 . 16683 1 215 . 1 1 21 21 LEU CD2 C 13 24.892 0.100 . 1 . . . . 60 LEU CD2 . 16683 1 216 . 1 1 21 21 LEU CG C 13 26.932 0.100 . 1 . . . . 60 LEU CG . 16683 1 217 . 1 1 21 21 LEU N N 15 121.482 0.100 . 1 . . . . 60 LEU N . 16683 1 218 . 1 1 22 22 PHE H H 1 8.123 0.020 . 1 . . . . 61 PHE H . 16683 1 219 . 1 1 22 22 PHE HA H 1 4.610 0.020 . 1 . . . . 61 PHE HA . 16683 1 220 . 1 1 22 22 PHE HB2 H 1 3.028 0.020 . 1 . . . . 61 PHE HB2 . 16683 1 221 . 1 1 22 22 PHE HB3 H 1 3.186 0.020 . 1 . . . . 61 PHE HB3 . 16683 1 222 . 1 1 22 22 PHE HD1 H 1 7.259 0.020 . 1 . . . . 61 PHE HD1 . 16683 1 223 . 1 1 22 22 PHE HD2 H 1 7.259 0.020 . 1 . . . . 61 PHE HD2 . 16683 1 224 . 1 1 22 22 PHE HE1 H 1 7.327 0.020 . 1 . . . . 61 PHE HE1 . 16683 1 225 . 1 1 22 22 PHE HE2 H 1 7.327 0.020 . 1 . . . . 61 PHE HE2 . 16683 1 226 . 1 1 22 22 PHE HZ H 1 7.307 0.020 . 1 . . . . 61 PHE HZ . 16683 1 227 . 1 1 22 22 PHE C C 13 175.510 0.100 . 1 . . . . 61 PHE C . 16683 1 228 . 1 1 22 22 PHE CA C 13 57.612 0.100 . 1 . . . . 61 PHE CA . 16683 1 229 . 1 1 22 22 PHE CB C 13 39.427 0.100 . 1 . . . . 61 PHE CB . 16683 1 230 . 1 1 22 22 PHE CD1 C 13 131.501 0.100 . 1 . . . . 61 PHE CD1 . 16683 1 231 . 1 1 22 22 PHE CD2 C 13 131.501 0.100 . 1 . . . . 61 PHE CD2 . 16683 1 232 . 1 1 22 22 PHE CE1 C 13 130.460 0.100 . 1 . . . . 61 PHE CE1 . 16683 1 233 . 1 1 22 22 PHE CE2 C 13 130.460 0.100 . 1 . . . . 61 PHE CE2 . 16683 1 234 . 1 1 22 22 PHE CZ C 13 129.648 0.100 . 1 . . . . 61 PHE CZ . 16683 1 235 . 1 1 22 22 PHE N N 15 119.541 0.100 . 1 . . . . 61 PHE N . 16683 1 236 . 1 1 23 23 ASP H H 1 8.200 0.020 . 1 . . . . 62 ASP H . 16683 1 237 . 1 1 23 23 ASP HA H 1 4.653 0.020 . 1 . . . . 62 ASP HA . 16683 1 238 . 1 1 23 23 ASP HB2 H 1 2.751 0.020 . 1 . . . . 62 ASP HB2 . 16683 1 239 . 1 1 23 23 ASP HB3 H 1 2.660 0.020 . 1 . . . . 62 ASP HB3 . 16683 1 240 . 1 1 23 23 ASP C C 13 176.280 0.100 . 1 . . . . 62 ASP C . 16683 1 241 . 1 1 23 23 ASP CA C 13 54.313 0.100 . 1 . . . . 62 ASP CA . 16683 1 242 . 1 1 23 23 ASP CB C 13 41.440 0.100 . 1 . . . . 62 ASP CB . 16683 1 243 . 1 1 23 23 ASP N N 15 121.666 0.100 . 1 . . . . 62 ASP N . 16683 1 244 . 1 1 24 24 SER H H 1 8.328 0.020 . 1 . . . . 63 SER H . 16683 1 245 . 1 1 24 24 SER HA H 1 4.402 0.020 . 1 . . . . 63 SER HA . 16683 1 246 . 1 1 24 24 SER HB2 H 1 3.989 0.020 . 1 . . . . 63 SER HB2 . 16683 1 247 . 1 1 24 24 SER HB3 H 1 3.938 0.020 . 1 . . . . 63 SER HB3 . 16683 1 248 . 1 1 24 24 SER C C 13 175.360 0.100 . 1 . . . . 63 SER C . 16683 1 249 . 1 1 24 24 SER CA C 13 59.033 0.100 . 1 . . . . 63 SER CA . 16683 1 250 . 1 1 24 24 SER CB C 13 63.885 0.100 . 1 . . . . 63 SER CB . 16683 1 251 . 1 1 24 24 SER N N 15 116.981 0.100 . 1 . . . . 63 SER N . 16683 1 252 . 1 1 25 25 GLY H H 1 8.546 0.020 . 1 . . . . 64 GLY H . 16683 1 253 . 1 1 25 25 GLY HA2 H 1 4.024 0.020 . 1 . . . . 64 GLY HA2 . 16683 1 254 . 1 1 25 25 GLY HA3 H 1 4.049 0.020 . 1 . . . . 64 GLY HA3 . 16683 1 255 . 1 1 25 25 GLY C C 13 174.440 0.100 . 1 . . . . 64 GLY C . 16683 1 256 . 1 1 25 25 GLY CA C 13 45.596 0.100 . 1 . . . . 64 GLY CA . 16683 1 257 . 1 1 25 25 GLY N N 15 110.617 0.100 . 1 . . . . 64 GLY N . 16683 1 258 . 1 1 26 26 CYS H H 1 8.223 0.020 . 1 . . . . 65 CYS H . 16683 1 259 . 1 1 26 26 CYS HA H 1 4.573 0.020 . 1 . . . . 65 CYS HA . 16683 1 260 . 1 1 26 26 CYS HB2 H 1 2.983 0.020 . 1 . . . . 65 CYS HB2 . 16683 1 261 . 1 1 26 26 CYS HB3 H 1 2.977 0.020 . 1 . . . . 65 CYS HB3 . 16683 1 262 . 1 1 26 26 CYS HG H 1 1.531 0.020 . 1 . . . . 65 CYS HG . 16683 1 263 . 1 1 26 26 CYS C C 13 175.160 0.100 . 1 . . . . 65 CYS C . 16683 1 264 . 1 1 26 26 CYS CA C 13 58.595 0.100 . 1 . . . . 65 CYS CA . 16683 1 265 . 1 1 26 26 CYS CB C 13 27.939 0.100 . 1 . . . . 65 CYS CB . 16683 1 266 . 1 1 26 26 CYS N N 15 118.209 0.100 . 1 . . . . 65 CYS N . 16683 1 267 . 1 1 27 27 GLY H H 1 8.577 0.020 . 1 . . . . 66 GLY H . 16683 1 268 . 1 1 27 27 GLY HA2 H 1 4.016 0.020 . 1 . . . . 66 GLY HA2 . 16683 1 269 . 1 1 27 27 GLY HA3 H 1 4.005 0.020 . 1 . . . . 66 GLY HA3 . 16683 1 270 . 1 1 27 27 GLY C C 13 174.660 0.100 . 1 . . . . 66 GLY C . 16683 1 271 . 1 1 27 27 GLY CA C 13 45.424 0.100 . 1 . . . . 66 GLY CA . 16683 1 272 . 1 1 27 27 GLY N N 15 111.116 0.100 . 1 . . . . 66 GLY N . 16683 1 273 . 1 1 28 28 GLY H H 1 8.356 0.020 . 1 . . . . 67 GLY H . 16683 1 274 . 1 1 28 28 GLY HA2 H 1 4.030 0.020 . 1 . . . . 67 GLY HA2 . 16683 1 275 . 1 1 28 28 GLY HA3 H 1 4.030 0.020 . 1 . . . . 67 GLY HA3 . 16683 1 276 . 1 1 28 28 GLY C C 13 174.690 0.100 . 1 . . . . 67 GLY C . 16683 1 277 . 1 1 28 28 GLY CA C 13 45.444 0.100 . 1 . . . . 67 GLY CA . 16683 1 278 . 1 1 28 28 GLY N N 15 108.826 0.100 . 1 . . . . 67 GLY N . 16683 1 279 . 1 1 29 29 GLY H H 1 8.334 0.020 . 1 . . . . 68 GLY H . 16683 1 280 . 1 1 29 29 GLY HA2 H 1 3.997 0.020 . 1 . . . . 68 GLY HA2 . 16683 1 281 . 1 1 29 29 GLY HA3 H 1 4.009 0.020 . 1 . . . . 68 GLY HA3 . 16683 1 282 . 1 1 29 29 GLY C C 13 174.250 0.100 . 1 . . . . 68 GLY C . 16683 1 283 . 1 1 29 29 GLY CA C 13 45.214 0.100 . 1 . . . . 68 GLY CA . 16683 1 284 . 1 1 29 29 GLY N N 15 108.591 0.100 . 1 . . . . 68 GLY N . 16683 1 285 . 1 1 30 30 GLU H H 1 8.483 0.020 . 1 . . . . 69 GLU H . 16683 1 286 . 1 1 30 30 GLU HA H 1 4.336 0.020 . 1 . . . . 69 GLU HA . 16683 1 287 . 1 1 30 30 GLU HB2 H 1 1.993 0.020 . 1 . . . . 69 GLU HB2 . 16683 1 288 . 1 1 30 30 GLU HB3 H 1 2.110 0.020 . 1 . . . . 69 GLU HB3 . 16683 1 289 . 1 1 30 30 GLU HG2 H 1 2.301 0.020 . 1 . . . . 69 GLU HG2 . 16683 1 290 . 1 1 30 30 GLU HG3 H 1 2.340 0.020 . 1 . . . . 69 GLU HG3 . 16683 1 291 . 1 1 30 30 GLU C C 13 177.100 0.100 . 1 . . . . 69 GLU C . 16683 1 292 . 1 1 30 30 GLU CA C 13 56.880 0.100 . 1 . . . . 69 GLU CA . 16683 1 293 . 1 1 30 30 GLU CB C 13 29.944 0.100 . 1 . . . . 69 GLU CB . 16683 1 294 . 1 1 30 30 GLU CG C 13 36.070 0.100 . 1 . . . . 69 GLU CG . 16683 1 295 . 1 1 30 30 GLU N N 15 120.451 0.100 . 1 . . . . 69 GLU N . 16683 1 296 . 1 1 31 31 GLY H H 1 8.518 0.020 . 1 . . . . 70 GLY H . 16683 1 297 . 1 1 31 31 GLY HA2 H 1 3.997 0.020 . 1 . . . . 70 GLY HA2 . 16683 1 298 . 1 1 31 31 GLY HA3 H 1 4.010 0.020 . 1 . . . . 70 GLY HA3 . 16683 1 299 . 1 1 31 31 GLY C C 13 173.980 0.100 . 1 . . . . 70 GLY C . 16683 1 300 . 1 1 31 31 GLY CA C 13 45.400 0.100 . 1 . . . . 70 GLY CA . 16683 1 301 . 1 1 31 31 GLY N N 15 109.872 0.100 . 1 . . . . 70 GLY N . 16683 1 302 . 1 1 32 32 VAL H H 1 7.897 0.020 . 1 . . . . 71 VAL H . 16683 1 303 . 1 1 32 32 VAL HA H 1 4.199 0.020 . 1 . . . . 71 VAL HA . 16683 1 304 . 1 1 32 32 VAL HB H 1 2.104 0.020 . 1 . . . . 71 VAL HB . 16683 1 305 . 1 1 32 32 VAL HG11 H 1 0.940 0.020 . 1 . . . . 71 VAL HG1 . 16683 1 306 . 1 1 32 32 VAL HG12 H 1 0.940 0.020 . 1 . . . . 71 VAL HG1 . 16683 1 307 . 1 1 32 32 VAL HG13 H 1 0.940 0.020 . 1 . . . . 71 VAL HG1 . 16683 1 308 . 1 1 32 32 VAL HG21 H 1 0.925 0.020 . 1 . . . . 71 VAL HG2 . 16683 1 309 . 1 1 32 32 VAL HG22 H 1 0.925 0.020 . 1 . . . . 71 VAL HG2 . 16683 1 310 . 1 1 32 32 VAL HG23 H 1 0.925 0.020 . 1 . . . . 71 VAL HG2 . 16683 1 311 . 1 1 32 32 VAL C C 13 175.970 0.100 . 1 . . . . 71 VAL C . 16683 1 312 . 1 1 32 32 VAL CA C 13 62.051 0.100 . 1 . . . . 71 VAL CA . 16683 1 313 . 1 1 32 32 VAL CB C 13 32.634 0.100 . 1 . . . . 71 VAL CB . 16683 1 314 . 1 1 32 32 VAL CG1 C 13 21.175 0.100 . 1 . . . . 71 VAL CG1 . 16683 1 315 . 1 1 32 32 VAL CG2 C 13 20.576 0.100 . 1 . . . . 71 VAL CG2 . 16683 1 316 . 1 1 32 32 VAL N N 15 118.633 0.100 . 1 . . . . 71 VAL N . 16683 1 317 . 1 1 33 33 GLU H H 1 8.579 0.020 . 1 . . . . 72 GLU H . 16683 1 318 . 1 1 33 33 GLU HA H 1 4.487 0.020 . 1 . . . . 72 GLU HA . 16683 1 319 . 1 1 33 33 GLU HB2 H 1 2.155 0.020 . 1 . . . . 72 GLU HB2 . 16683 1 320 . 1 1 33 33 GLU HB3 H 1 2.103 0.020 . 1 . . . . 72 GLU HB3 . 16683 1 321 . 1 1 33 33 GLU HG2 H 1 2.378 0.020 . 1 . . . . 72 GLU HG2 . 16683 1 322 . 1 1 33 33 GLU HG3 H 1 2.362 0.020 . 1 . . . . 72 GLU HG3 . 16683 1 323 . 1 1 33 33 GLU C C 13 176.500 0.100 . 1 . . . . 72 GLU C . 16683 1 324 . 1 1 33 33 GLU CA C 13 56.440 0.100 . 1 . . . . 72 GLU CA . 16683 1 325 . 1 1 33 33 GLU CB C 13 30.502 0.100 . 1 . . . . 72 GLU CB . 16683 1 326 . 1 1 33 33 GLU CG C 13 36.662 0.100 . 1 . . . . 72 GLU CG . 16683 1 327 . 1 1 33 33 GLU N N 15 124.961 0.100 . 1 . . . . 72 GLU N . 16683 1 328 . 1 1 34 34 THR H H 1 8.300 0.020 . 1 . . . . 73 THR H . 16683 1 329 . 1 1 34 34 THR HA H 1 4.525 0.020 . 1 . . . . 73 THR HA . 16683 1 330 . 1 1 34 34 THR HB H 1 4.442 0.020 . 1 . . . . 73 THR HB . 16683 1 331 . 1 1 34 34 THR HG21 H 1 1.286 0.020 . 1 . . . . 73 THR HG2 . 16683 1 332 . 1 1 34 34 THR HG22 H 1 1.286 0.020 . 1 . . . . 73 THR HG2 . 16683 1 333 . 1 1 34 34 THR HG23 H 1 1.286 0.020 . 1 . . . . 73 THR HG2 . 16683 1 334 . 1 1 34 34 THR C C 13 175.580 0.100 . 1 . . . . 73 THR C . 16683 1 335 . 1 1 34 34 THR CA C 13 61.842 0.100 . 1 . . . . 73 THR CA . 16683 1 336 . 1 1 34 34 THR CB C 13 70.256 0.100 . 1 . . . . 73 THR CB . 16683 1 337 . 1 1 34 34 THR CG2 C 13 21.543 0.100 . 1 . . . . 73 THR CG2 . 16683 1 338 . 1 1 34 34 THR N N 15 115.614 0.100 . 1 . . . . 73 THR N . 16683 1 339 . 1 1 35 35 GLY H H 1 8.890 0.020 . 1 . . . . 74 GLY H . 16683 1 340 . 1 1 35 35 GLY HA2 H 1 3.852 0.020 . 1 . . . . 74 GLY HA2 . 16683 1 341 . 1 1 35 35 GLY HA3 H 1 4.245 0.020 . 1 . . . . 74 GLY HA3 . 16683 1 342 . 1 1 35 35 GLY C C 13 173.200 0.100 . 1 . . . . 74 GLY C . 16683 1 343 . 1 1 35 35 GLY CA C 13 45.608 0.100 . 1 . . . . 74 GLY CA . 16683 1 344 . 1 1 35 35 GLY N N 15 112.187 0.100 . 1 . . . . 74 GLY N . 16683 1 345 . 1 1 36 36 ALA H H 1 8.080 0.020 . 1 . . . . 75 ALA H . 16683 1 346 . 1 1 36 36 ALA HA H 1 4.614 0.020 . 1 . . . . 75 ALA HA . 16683 1 347 . 1 1 36 36 ALA HB1 H 1 1.270 0.020 . 1 . . . . 75 ALA HB . 16683 1 348 . 1 1 36 36 ALA HB2 H 1 1.270 0.020 . 1 . . . . 75 ALA HB . 16683 1 349 . 1 1 36 36 ALA HB3 H 1 1.270 0.020 . 1 . . . . 75 ALA HB . 16683 1 350 . 1 1 36 36 ALA C C 13 174.320 0.100 . 1 . . . . 75 ALA C . 16683 1 351 . 1 1 36 36 ALA CA C 13 51.915 0.100 . 1 . . . . 75 ALA CA . 16683 1 352 . 1 1 36 36 ALA CB C 13 22.711 0.100 . 1 . . . . 75 ALA CB . 16683 1 353 . 1 1 36 36 ALA N N 15 118.476 0.100 . 1 . . . . 75 ALA N . 16683 1 354 . 1 1 37 37 LYS H H 1 8.613 0.020 . 1 . . . . 76 LYS H . 16683 1 355 . 1 1 37 37 LYS HA H 1 5.062 0.020 . 1 . . . . 76 LYS HA . 16683 1 356 . 1 1 37 37 LYS HB2 H 1 1.374 0.020 . 1 . . . . 76 LYS HB2 . 16683 1 357 . 1 1 37 37 LYS HB3 H 1 1.572 0.020 . 1 . . . . 76 LYS HB3 . 16683 1 358 . 1 1 37 37 LYS HD2 H 1 1.368 0.020 . 1 . . . . 76 LYS HD2 . 16683 1 359 . 1 1 37 37 LYS HD3 H 1 1.360 0.020 . 1 . . . . 76 LYS HD3 . 16683 1 360 . 1 1 37 37 LYS HE2 H 1 2.631 0.020 . 1 . . . . 76 LYS HE2 . 16683 1 361 . 1 1 37 37 LYS HE3 H 1 2.648 0.020 . 1 . . . . 76 LYS HE3 . 16683 1 362 . 1 1 37 37 LYS HG2 H 1 0.972 0.020 . 1 . . . . 76 LYS HG2 . 16683 1 363 . 1 1 37 37 LYS HG3 H 1 0.650 0.020 . 1 . . . . 76 LYS HG3 . 16683 1 364 . 1 1 37 37 LYS C C 13 174.320 0.100 . 1 . . . . 76 LYS C . 16683 1 365 . 1 1 37 37 LYS CA C 13 55.064 0.100 . 1 . . . . 76 LYS CA . 16683 1 366 . 1 1 37 37 LYS CB C 13 34.896 0.100 . 1 . . . . 76 LYS CB . 16683 1 367 . 1 1 37 37 LYS CD C 13 29.631 0.100 . 1 . . . . 76 LYS CD . 16683 1 368 . 1 1 37 37 LYS CE C 13 41.600 0.100 . 1 . . . . 76 LYS CE . 16683 1 369 . 1 1 37 37 LYS CG C 13 24.672 0.100 . 1 . . . . 76 LYS CG . 16683 1 370 . 1 1 37 37 LYS N N 15 121.442 0.100 . 1 . . . . 76 LYS N . 16683 1 371 . 1 1 38 38 LEU H H 1 9.439 0.020 . 1 . . . . 77 LEU H . 16683 1 372 . 1 1 38 38 LEU HA H 1 5.300 0.020 . 1 . . . . 77 LEU HA . 16683 1 373 . 1 1 38 38 LEU HB2 H 1 1.737 0.020 . 1 . . . . 77 LEU HB2 . 16683 1 374 . 1 1 38 38 LEU HB3 H 1 1.106 0.020 . 1 . . . . 77 LEU HB3 . 16683 1 375 . 1 1 38 38 LEU HD11 H 1 0.836 0.020 . 1 . . . . 77 LEU HD1 . 16683 1 376 . 1 1 38 38 LEU HD12 H 1 0.836 0.020 . 1 . . . . 77 LEU HD1 . 16683 1 377 . 1 1 38 38 LEU HD13 H 1 0.836 0.020 . 1 . . . . 77 LEU HD1 . 16683 1 378 . 1 1 38 38 LEU HD21 H 1 0.822 0.020 . 1 . . . . 77 LEU HD2 . 16683 1 379 . 1 1 38 38 LEU HD22 H 1 0.822 0.020 . 1 . . . . 77 LEU HD2 . 16683 1 380 . 1 1 38 38 LEU HD23 H 1 0.822 0.020 . 1 . . . . 77 LEU HD2 . 16683 1 381 . 1 1 38 38 LEU HG H 1 0.967 0.020 . 1 . . . . 77 LEU HG . 16683 1 382 . 1 1 38 38 LEU C C 13 175.910 0.100 . 1 . . . . 77 LEU C . 16683 1 383 . 1 1 38 38 LEU CA C 13 52.615 0.100 . 1 . . . . 77 LEU CA . 16683 1 384 . 1 1 38 38 LEU CB C 13 44.104 0.100 . 1 . . . . 77 LEU CB . 16683 1 385 . 1 1 38 38 LEU CD1 C 13 23.262 0.100 . 1 . . . . 77 LEU CD1 . 16683 1 386 . 1 1 38 38 LEU CD2 C 13 23.170 0.100 . 1 . . . . 77 LEU CD2 . 16683 1 387 . 1 1 38 38 LEU CG C 13 26.493 0.100 . 1 . . . . 77 LEU CG . 16683 1 388 . 1 1 38 38 LEU N N 15 120.812 0.100 . 1 . . . . 77 LEU N . 16683 1 389 . 1 1 39 39 LEU H H 1 9.031 0.020 . 1 . . . . 78 LEU H . 16683 1 390 . 1 1 39 39 LEU HA H 1 5.026 0.020 . 1 . . . . 78 LEU HA . 16683 1 391 . 1 1 39 39 LEU HB2 H 1 1.429 0.020 . 1 . . . . 78 LEU HB2 . 16683 1 392 . 1 1 39 39 LEU HB3 H 1 1.684 0.020 . 1 . . . . 78 LEU HB3 . 16683 1 393 . 1 1 39 39 LEU HD11 H 1 0.854 0.020 . 1 . . . . 78 LEU HD1 . 16683 1 394 . 1 1 39 39 LEU HD12 H 1 0.854 0.020 . 1 . . . . 78 LEU HD1 . 16683 1 395 . 1 1 39 39 LEU HD13 H 1 0.854 0.020 . 1 . . . . 78 LEU HD1 . 16683 1 396 . 1 1 39 39 LEU HD21 H 1 0.891 0.020 . 1 . . . . 78 LEU HD2 . 16683 1 397 . 1 1 39 39 LEU HD22 H 1 0.891 0.020 . 1 . . . . 78 LEU HD2 . 16683 1 398 . 1 1 39 39 LEU HD23 H 1 0.891 0.020 . 1 . . . . 78 LEU HD2 . 16683 1 399 . 1 1 39 39 LEU HG H 1 1.480 0.020 . 1 . . . . 78 LEU HG . 16683 1 400 . 1 1 39 39 LEU C C 13 176.400 0.100 . 1 . . . . 78 LEU C . 16683 1 401 . 1 1 39 39 LEU CA C 13 54.086 0.100 . 1 . . . . 78 LEU CA . 16683 1 402 . 1 1 39 39 LEU CB C 13 43.220 0.100 . 1 . . . . 78 LEU CB . 16683 1 403 . 1 1 39 39 LEU CD1 C 13 24.562 0.100 . 1 . . . . 78 LEU CD1 . 16683 1 404 . 1 1 39 39 LEU CD2 C 13 24.264 0.100 . 1 . . . . 78 LEU CD2 . 16683 1 405 . 1 1 39 39 LEU CG C 13 27.314 0.100 . 1 . . . . 78 LEU CG . 16683 1 406 . 1 1 39 39 LEU N N 15 124.258 0.100 . 1 . . . . 78 LEU N . 16683 1 407 . 1 1 40 40 VAL H H 1 8.987 0.020 . 1 . . . . 79 VAL H . 16683 1 408 . 1 1 40 40 VAL HA H 1 4.995 0.020 . 1 . . . . 79 VAL HA . 16683 1 409 . 1 1 40 40 VAL HB H 1 1.894 0.020 . 1 . . . . 79 VAL HB . 16683 1 410 . 1 1 40 40 VAL HG11 H 1 1.027 0.020 . 1 . . . . 79 VAL HG1 . 16683 1 411 . 1 1 40 40 VAL HG12 H 1 1.027 0.020 . 1 . . . . 79 VAL HG1 . 16683 1 412 . 1 1 40 40 VAL HG13 H 1 1.027 0.020 . 1 . . . . 79 VAL HG1 . 16683 1 413 . 1 1 40 40 VAL HG21 H 1 0.734 0.020 . 1 . . . . 79 VAL HG2 . 16683 1 414 . 1 1 40 40 VAL HG22 H 1 0.734 0.020 . 1 . . . . 79 VAL HG2 . 16683 1 415 . 1 1 40 40 VAL HG23 H 1 0.734 0.020 . 1 . . . . 79 VAL HG2 . 16683 1 416 . 1 1 40 40 VAL C C 13 174.530 0.100 . 1 . . . . 79 VAL C . 16683 1 417 . 1 1 40 40 VAL CA C 13 60.774 0.100 . 1 . . . . 79 VAL CA . 16683 1 418 . 1 1 40 40 VAL CB C 13 32.765 0.100 . 1 . . . . 79 VAL CB . 16683 1 419 . 1 1 40 40 VAL CG1 C 13 21.722 0.100 . 1 . . . . 79 VAL CG1 . 16683 1 420 . 1 1 40 40 VAL CG2 C 13 21.699 0.100 . 1 . . . . 79 VAL CG2 . 16683 1 421 . 1 1 40 40 VAL N N 15 130.056 0.100 . 1 . . . . 79 VAL N . 16683 1 422 . 1 1 41 41 SER H H 1 9.650 0.020 . 1 . . . . 80 SER H . 16683 1 423 . 1 1 41 41 SER HA H 1 5.349 0.020 . 1 . . . . 80 SER HA . 16683 1 424 . 1 1 41 41 SER HB2 H 1 3.783 0.020 . 1 . . . . 80 SER HB2 . 16683 1 425 . 1 1 41 41 SER HB3 H 1 4.030 0.020 . 1 . . . . 80 SER HB3 . 16683 1 426 . 1 1 41 41 SER C C 13 173.040 0.100 . 1 . . . . 80 SER C . 16683 1 427 . 1 1 41 41 SER CA C 13 57.238 0.100 . 1 . . . . 80 SER CA . 16683 1 428 . 1 1 41 41 SER CB C 13 65.405 0.100 . 1 . . . . 80 SER CB . 16683 1 429 . 1 1 41 41 SER N N 15 121.171 0.100 . 1 . . . . 80 SER N . 16683 1 430 . 1 1 42 42 ASN H H 1 8.752 0.020 . 1 . . . . 81 ASN H . 16683 1 431 . 1 1 42 42 ASN HA H 1 4.501 0.020 . 1 . . . . 81 ASN HA . 16683 1 432 . 1 1 42 42 ASN HB2 H 1 2.511 0.020 . 1 . . . . 81 ASN HB2 . 16683 1 433 . 1 1 42 42 ASN HB3 H 1 2.529 0.020 . 1 . . . . 81 ASN HB3 . 16683 1 434 . 1 1 42 42 ASN HD21 H 1 8.300 0.020 . 1 . . . . 81 ASN HD21 . 16683 1 435 . 1 1 42 42 ASN HD22 H 1 7.338 0.020 . 1 . . . . 81 ASN HD22 . 16683 1 436 . 1 1 42 42 ASN C C 13 176.850 0.100 . 1 . . . . 81 ASN C . 16683 1 437 . 1 1 42 42 ASN CA C 13 54.153 0.100 . 1 . . . . 81 ASN CA . 16683 1 438 . 1 1 42 42 ASN CB C 13 39.352 0.100 . 1 . . . . 81 ASN CB . 16683 1 439 . 1 1 42 42 ASN N N 15 115.559 0.100 . 1 . . . . 81 ASN N . 16683 1 440 . 1 1 42 42 ASN ND2 N 15 112.100 0.100 . 1 . . . . 81 ASN ND2 . 16683 1 441 . 1 1 43 43 LEU H H 1 8.156 0.020 . 1 . . . . 82 LEU H . 16683 1 442 . 1 1 43 43 LEU HA H 1 4.170 0.020 . 1 . . . . 82 LEU HA . 16683 1 443 . 1 1 43 43 LEU HB2 H 1 1.226 0.020 . 1 . . . . 82 LEU HB2 . 16683 1 444 . 1 1 43 43 LEU HB3 H 1 1.189 0.020 . 1 . . . . 82 LEU HB3 . 16683 1 445 . 1 1 43 43 LEU HD11 H 1 0.738 0.020 . 1 . . . . 82 LEU HD1 . 16683 1 446 . 1 1 43 43 LEU HD12 H 1 0.738 0.020 . 1 . . . . 82 LEU HD1 . 16683 1 447 . 1 1 43 43 LEU HD13 H 1 0.738 0.020 . 1 . . . . 82 LEU HD1 . 16683 1 448 . 1 1 43 43 LEU HD21 H 1 0.774 0.020 . 1 . . . . 82 LEU HD2 . 16683 1 449 . 1 1 43 43 LEU HD22 H 1 0.774 0.020 . 1 . . . . 82 LEU HD2 . 16683 1 450 . 1 1 43 43 LEU HD23 H 1 0.774 0.020 . 1 . . . . 82 LEU HD2 . 16683 1 451 . 1 1 43 43 LEU HG H 1 0.466 0.020 . 1 . . . . 82 LEU HG . 16683 1 452 . 1 1 43 43 LEU C C 13 177.700 0.100 . 1 . . . . 82 LEU C . 16683 1 453 . 1 1 43 43 LEU CA C 13 54.103 0.100 . 1 . . . . 82 LEU CA . 16683 1 454 . 1 1 43 43 LEU CB C 13 42.830 0.100 . 1 . . . . 82 LEU CB . 16683 1 455 . 1 1 43 43 LEU CD1 C 13 21.884 0.100 . 1 . . . . 82 LEU CD1 . 16683 1 456 . 1 1 43 43 LEU CD2 C 13 22.080 0.100 . 1 . . . . 82 LEU CD2 . 16683 1 457 . 1 1 43 43 LEU CG C 13 25.916 0.100 . 1 . . . . 82 LEU CG . 16683 1 458 . 1 1 43 43 LEU N N 15 117.151 0.100 . 1 . . . . 82 LEU N . 16683 1 459 . 1 1 44 44 ASP H H 1 9.520 0.020 . 1 . . . . 83 ASP H . 16683 1 460 . 1 1 44 44 ASP HA H 1 4.180 0.020 . 1 . . . . 83 ASP HA . 16683 1 461 . 1 1 44 44 ASP HB2 H 1 2.575 0.020 . 1 . . . . 83 ASP HB2 . 16683 1 462 . 1 1 44 44 ASP HB3 H 1 2.680 0.020 . 1 . . . . 83 ASP HB3 . 16683 1 463 . 1 1 44 44 ASP C C 13 177.920 0.100 . 1 . . . . 83 ASP C . 16683 1 464 . 1 1 44 44 ASP CA C 13 54.814 0.100 . 1 . . . . 83 ASP CA . 16683 1 465 . 1 1 44 44 ASP CB C 13 43.688 0.100 . 1 . . . . 83 ASP CB . 16683 1 466 . 1 1 44 44 ASP N N 15 122.011 0.100 . 1 . . . . 83 ASP N . 16683 1 467 . 1 1 45 45 PHE H H 1 8.213 0.020 . 1 . . . . 84 PHE H . 16683 1 468 . 1 1 45 45 PHE HA H 1 4.404 0.020 . 1 . . . . 84 PHE HA . 16683 1 469 . 1 1 45 45 PHE HB2 H 1 3.074 0.020 . 1 . . . . 84 PHE HB2 . 16683 1 470 . 1 1 45 45 PHE HB3 H 1 3.441 0.020 . 1 . . . . 84 PHE HB3 . 16683 1 471 . 1 1 45 45 PHE HD1 H 1 7.282 0.020 . 1 . . . . 84 PHE HD1 . 16683 1 472 . 1 1 45 45 PHE HD2 H 1 7.282 0.020 . 1 . . . . 84 PHE HD2 . 16683 1 473 . 1 1 45 45 PHE HE1 H 1 7.255 0.020 . 1 . . . . 84 PHE HE1 . 16683 1 474 . 1 1 45 45 PHE HE2 H 1 7.255 0.020 . 1 . . . . 84 PHE HE2 . 16683 1 475 . 1 1 45 45 PHE HZ H 1 7.263 0.020 . 1 . . . . 84 PHE HZ . 16683 1 476 . 1 1 45 45 PHE C C 13 175.470 0.100 . 1 . . . . 84 PHE C . 16683 1 477 . 1 1 45 45 PHE CA C 13 59.460 0.100 . 1 . . . . 84 PHE CA . 16683 1 478 . 1 1 45 45 PHE CB C 13 37.864 0.100 . 1 . . . . 84 PHE CB . 16683 1 479 . 1 1 45 45 PHE CD1 C 13 131.267 0.100 . 1 . . . . 84 PHE CD1 . 16683 1 480 . 1 1 45 45 PHE CD2 C 13 131.267 0.100 . 1 . . . . 84 PHE CD2 . 16683 1 481 . 1 1 45 45 PHE CE1 C 13 130.866 0.100 . 1 . . . . 84 PHE CE1 . 16683 1 482 . 1 1 45 45 PHE CE2 C 13 130.866 0.100 . 1 . . . . 84 PHE CE2 . 16683 1 483 . 1 1 45 45 PHE CZ C 13 130.460 0.100 . 1 . . . . 84 PHE CZ . 16683 1 484 . 1 1 45 45 PHE N N 15 124.810 0.100 . 1 . . . . 84 PHE N . 16683 1 485 . 1 1 46 46 GLY H H 1 9.156 0.020 . 1 . . . . 85 GLY H . 16683 1 486 . 1 1 46 46 GLY HA2 H 1 4.267 0.020 . 1 . . . . 85 GLY HA2 . 16683 1 487 . 1 1 46 46 GLY HA3 H 1 3.636 0.020 . 1 . . . . 85 GLY HA3 . 16683 1 488 . 1 1 46 46 GLY C C 13 174.990 0.100 . 1 . . . . 85 GLY C . 16683 1 489 . 1 1 46 46 GLY CA C 13 44.960 0.100 . 1 . . . . 85 GLY CA . 16683 1 490 . 1 1 46 46 GLY N N 15 107.308 0.100 . 1 . . . . 85 GLY N . 16683 1 491 . 1 1 47 47 VAL H H 1 7.345 0.020 . 1 . . . . 86 VAL H . 16683 1 492 . 1 1 47 47 VAL HA H 1 3.907 0.020 . 1 . . . . 86 VAL HA . 16683 1 493 . 1 1 47 47 VAL HB H 1 2.052 0.020 . 1 . . . . 86 VAL HB . 16683 1 494 . 1 1 47 47 VAL HG11 H 1 1.069 0.020 . 1 . . . . 86 VAL HG1 . 16683 1 495 . 1 1 47 47 VAL HG12 H 1 1.069 0.020 . 1 . . . . 86 VAL HG1 . 16683 1 496 . 1 1 47 47 VAL HG13 H 1 1.069 0.020 . 1 . . . . 86 VAL HG1 . 16683 1 497 . 1 1 47 47 VAL HG21 H 1 0.997 0.020 . 1 . . . . 86 VAL HG2 . 16683 1 498 . 1 1 47 47 VAL HG22 H 1 0.997 0.020 . 1 . . . . 86 VAL HG2 . 16683 1 499 . 1 1 47 47 VAL HG23 H 1 0.997 0.020 . 1 . . . . 86 VAL HG2 . 16683 1 500 . 1 1 47 47 VAL C C 13 175.940 0.100 . 1 . . . . 86 VAL C . 16683 1 501 . 1 1 47 47 VAL CA C 13 64.260 0.100 . 1 . . . . 86 VAL CA . 16683 1 502 . 1 1 47 47 VAL CB C 13 30.634 0.100 . 1 . . . . 86 VAL CB . 16683 1 503 . 1 1 47 47 VAL CG1 C 13 24.159 0.100 . 1 . . . . 86 VAL CG1 . 16683 1 504 . 1 1 47 47 VAL CG2 C 13 22.030 0.100 . 1 . . . . 86 VAL CG2 . 16683 1 505 . 1 1 47 47 VAL N N 15 122.661 0.100 . 1 . . . . 86 VAL N . 16683 1 506 . 1 1 48 48 SER H H 1 8.918 0.020 . 1 . . . . 87 SER H . 16683 1 507 . 1 1 48 48 SER HA H 1 4.961 0.020 . 1 . . . . 87 SER HA . 16683 1 508 . 1 1 48 48 SER HB2 H 1 4.500 0.020 . 1 . . . . 87 SER HB2 . 16683 1 509 . 1 1 48 48 SER HB3 H 1 3.988 0.020 . 1 . . . . 87 SER HB3 . 16683 1 510 . 1 1 48 48 SER C C 13 174.990 0.100 . 1 . . . . 87 SER C . 16683 1 511 . 1 1 48 48 SER CA C 13 56.364 0.100 . 1 . . . . 87 SER CA . 16683 1 512 . 1 1 48 48 SER CB C 13 68.244 0.100 . 1 . . . . 87 SER CB . 16683 1 513 . 1 1 48 48 SER N N 15 125.216 0.100 . 1 . . . . 87 SER N . 16683 1 514 . 1 1 49 49 ASP H H 1 8.791 0.020 . 1 . . . . 88 ASP H . 16683 1 515 . 1 1 49 49 ASP HA H 1 4.189 0.020 . 1 . . . . 88 ASP HA . 16683 1 516 . 1 1 49 49 ASP HB2 H 1 2.775 0.020 . 1 . . . . 88 ASP HB2 . 16683 1 517 . 1 1 49 49 ASP HB3 H 1 2.940 0.020 . 1 . . . . 88 ASP HB3 . 16683 1 518 . 1 1 49 49 ASP C C 13 177.820 0.100 . 1 . . . . 88 ASP C . 16683 1 519 . 1 1 49 49 ASP CA C 13 58.156 0.100 . 1 . . . . 88 ASP CA . 16683 1 520 . 1 1 49 49 ASP CB C 13 40.400 0.100 . 1 . . . . 88 ASP CB . 16683 1 521 . 1 1 49 49 ASP N N 15 119.966 0.100 . 1 . . . . 88 ASP N . 16683 1 522 . 1 1 50 50 ALA H H 1 8.135 0.020 . 1 . . . . 89 ALA H . 16683 1 523 . 1 1 50 50 ALA HA H 1 4.110 0.020 . 1 . . . . 89 ALA HA . 16683 1 524 . 1 1 50 50 ALA HB1 H 1 1.452 0.020 . 1 . . . . 89 ALA HB . 16683 1 525 . 1 1 50 50 ALA HB2 H 1 1.452 0.020 . 1 . . . . 89 ALA HB . 16683 1 526 . 1 1 50 50 ALA HB3 H 1 1.452 0.020 . 1 . . . . 89 ALA HB . 16683 1 527 . 1 1 50 50 ALA C C 13 180.380 0.100 . 1 . . . . 89 ALA C . 16683 1 528 . 1 1 50 50 ALA CA C 13 55.074 0.100 . 1 . . . . 89 ALA CA . 16683 1 529 . 1 1 50 50 ALA CB C 13 18.257 0.100 . 1 . . . . 89 ALA CB . 16683 1 530 . 1 1 50 50 ALA N N 15 119.806 0.100 . 1 . . . . 89 ALA N . 16683 1 531 . 1 1 51 51 ASP H H 1 7.675 0.020 . 1 . . . . 90 ASP H . 16683 1 532 . 1 1 51 51 ASP HA H 1 4.110 0.020 . 1 . . . . 90 ASP HA . 16683 1 533 . 1 1 51 51 ASP HB2 H 1 2.245 0.020 . 1 . . . . 90 ASP HB2 . 16683 1 534 . 1 1 51 51 ASP HB3 H 1 3.373 0.020 . 1 . . . . 90 ASP HB3 . 16683 1 535 . 1 1 51 51 ASP C C 13 176.970 0.100 . 1 . . . . 90 ASP C . 16683 1 536 . 1 1 51 51 ASP CA C 13 57.640 0.100 . 1 . . . . 90 ASP CA . 16683 1 537 . 1 1 51 51 ASP CB C 13 41.560 0.100 . 1 . . . . 90 ASP CB . 16683 1 538 . 1 1 51 51 ASP N N 15 119.104 0.100 . 1 . . . . 90 ASP N . 16683 1 539 . 1 1 52 52 ILE H H 1 7.356 0.020 . 1 . . . . 91 ILE H . 16683 1 540 . 1 1 52 52 ILE HA H 1 3.777 0.020 . 1 . . . . 91 ILE HA . 16683 1 541 . 1 1 52 52 ILE HB H 1 2.065 0.020 . 1 . . . . 91 ILE HB . 16683 1 542 . 1 1 52 52 ILE HD11 H 1 0.534 0.020 . 1 . . . . 91 ILE HD1 . 16683 1 543 . 1 1 52 52 ILE HD12 H 1 0.534 0.020 . 1 . . . . 91 ILE HD1 . 16683 1 544 . 1 1 52 52 ILE HD13 H 1 0.534 0.020 . 1 . . . . 91 ILE HD1 . 16683 1 545 . 1 1 52 52 ILE HG12 H 1 0.979 0.020 . 1 . . . . 91 ILE HG12 . 16683 1 546 . 1 1 52 52 ILE HG13 H 1 1.658 0.020 . 1 . . . . 91 ILE HG13 . 16683 1 547 . 1 1 52 52 ILE HG21 H 1 0.704 0.020 . 1 . . . . 91 ILE HG2 . 16683 1 548 . 1 1 52 52 ILE HG22 H 1 0.704 0.020 . 1 . . . . 91 ILE HG2 . 16683 1 549 . 1 1 52 52 ILE HG23 H 1 0.704 0.020 . 1 . . . . 91 ILE HG2 . 16683 1 550 . 1 1 52 52 ILE C C 13 177.890 0.100 . 1 . . . . 91 ILE C . 16683 1 551 . 1 1 52 52 ILE CA C 13 61.557 0.100 . 1 . . . . 91 ILE CA . 16683 1 552 . 1 1 52 52 ILE CB C 13 35.769 0.100 . 1 . . . . 91 ILE CB . 16683 1 553 . 1 1 52 52 ILE CD1 C 13 8.952 0.100 . 1 . . . . 91 ILE CD1 . 16683 1 554 . 1 1 52 52 ILE CG1 C 13 26.191 0.100 . 1 . . . . 91 ILE CG1 . 16683 1 555 . 1 1 52 52 ILE CG2 C 13 18.449 0.100 . 1 . . . . 91 ILE CG2 . 16683 1 556 . 1 1 52 52 ILE N N 15 116.598 0.100 . 1 . . . . 91 ILE N . 16683 1 557 . 1 1 53 53 GLN H H 1 8.727 0.020 . 1 . . . . 92 GLN H . 16683 1 558 . 1 1 53 53 GLN HA H 1 3.695 0.020 . 1 . . . . 92 GLN HA . 16683 1 559 . 1 1 53 53 GLN HB2 H 1 2.254 0.020 . 1 . . . . 92 GLN HB2 . 16683 1 560 . 1 1 53 53 GLN HB3 H 1 2.158 0.020 . 1 . . . . 92 GLN HB3 . 16683 1 561 . 1 1 53 53 GLN HE21 H 1 7.495 0.020 . 1 . . . . 92 GLN HE21 . 16683 1 562 . 1 1 53 53 GLN HE22 H 1 6.834 0.020 . 1 . . . . 92 GLN HE22 . 16683 1 563 . 1 1 53 53 GLN HG2 H 1 2.463 0.020 . 1 . . . . 92 GLN HG2 . 16683 1 564 . 1 1 53 53 GLN HG3 H 1 2.474 0.020 . 1 . . . . 92 GLN HG3 . 16683 1 565 . 1 1 53 53 GLN C C 13 177.100 0.100 . 1 . . . . 92 GLN C . 16683 1 566 . 1 1 53 53 GLN CA C 13 59.830 0.100 . 1 . . . . 92 GLN CA . 16683 1 567 . 1 1 53 53 GLN CB C 13 27.862 0.100 . 1 . . . . 92 GLN CB . 16683 1 568 . 1 1 53 53 GLN CG C 13 34.099 0.100 . 1 . . . . 92 GLN CG . 16683 1 569 . 1 1 53 53 GLN N N 15 120.119 0.100 . 1 . . . . 92 GLN N . 16683 1 570 . 1 1 53 53 GLN NE2 N 15 109.900 0.100 . 1 . . . . 92 GLN NE2 . 16683 1 571 . 1 1 54 54 GLU H H 1 7.971 0.020 . 1 . . . . 93 GLU H . 16683 1 572 . 1 1 54 54 GLU HA H 1 4.066 0.020 . 1 . . . . 93 GLU HA . 16683 1 573 . 1 1 54 54 GLU HB2 H 1 2.203 0.020 . 1 . . . . 93 GLU HB2 . 16683 1 574 . 1 1 54 54 GLU HB3 H 1 1.972 0.020 . 1 . . . . 93 GLU HB3 . 16683 1 575 . 1 1 54 54 GLU HG2 H 1 2.576 0.020 . 1 . . . . 93 GLU HG2 . 16683 1 576 . 1 1 54 54 GLU HG3 H 1 2.333 0.020 . 1 . . . . 93 GLU HG3 . 16683 1 577 . 1 1 54 54 GLU C C 13 178.920 0.100 . 1 . . . . 93 GLU C . 16683 1 578 . 1 1 54 54 GLU CA C 13 59.865 0.100 . 1 . . . . 93 GLU CA . 16683 1 579 . 1 1 54 54 GLU CB C 13 29.551 0.100 . 1 . . . . 93 GLU CB . 16683 1 580 . 1 1 54 54 GLU CG C 13 36.332 0.100 . 1 . . . . 93 GLU CG . 16683 1 581 . 1 1 54 54 GLU N N 15 117.316 0.100 . 1 . . . . 93 GLU N . 16683 1 582 . 1 1 55 55 LEU H H 1 7.734 0.020 . 1 . . . . 94 LEU H . 16683 1 583 . 1 1 55 55 LEU HA H 1 3.965 0.020 . 1 . . . . 94 LEU HA . 16683 1 584 . 1 1 55 55 LEU HB2 H 1 0.668 0.020 . 1 . . . . 94 LEU HB2 . 16683 1 585 . 1 1 55 55 LEU HB3 H 1 1.507 0.020 . 1 . . . . 94 LEU HB3 . 16683 1 586 . 1 1 55 55 LEU HD11 H 1 0.240 0.020 . 1 . . . . 94 LEU HD1 . 16683 1 587 . 1 1 55 55 LEU HD12 H 1 0.240 0.020 . 1 . . . . 94 LEU HD1 . 16683 1 588 . 1 1 55 55 LEU HD13 H 1 0.240 0.020 . 1 . . . . 94 LEU HD1 . 16683 1 589 . 1 1 55 55 LEU HD21 H 1 -0.031 0.020 . 1 . . . . 94 LEU HD2 . 16683 1 590 . 1 1 55 55 LEU HD22 H 1 -0.031 0.020 . 1 . . . . 94 LEU HD2 . 16683 1 591 . 1 1 55 55 LEU HD23 H 1 -0.031 0.020 . 1 . . . . 94 LEU HD2 . 16683 1 592 . 1 1 55 55 LEU HG H 1 1.171 0.020 . 1 . . . . 94 LEU HG . 16683 1 593 . 1 1 55 55 LEU C C 13 180.440 0.100 . 1 . . . . 94 LEU C . 16683 1 594 . 1 1 55 55 LEU CA C 13 57.533 0.100 . 1 . . . . 94 LEU CA . 16683 1 595 . 1 1 55 55 LEU CB C 13 43.195 0.100 . 1 . . . . 94 LEU CB . 16683 1 596 . 1 1 55 55 LEU CD1 C 13 25.252 0.100 . 1 . . . . 94 LEU CD1 . 16683 1 597 . 1 1 55 55 LEU CD2 C 13 23.730 0.100 . 1 . . . . 94 LEU CD2 . 16683 1 598 . 1 1 55 55 LEU CG C 13 25.824 0.100 . 1 . . . . 94 LEU CG . 16683 1 599 . 1 1 55 55 LEU N N 15 115.398 0.100 . 1 . . . . 94 LEU N . 16683 1 600 . 1 1 56 56 PHE H H 1 8.202 0.020 . 1 . . . . 95 PHE H . 16683 1 601 . 1 1 56 56 PHE HA H 1 4.868 0.020 . 1 . . . . 95 PHE HA . 16683 1 602 . 1 1 56 56 PHE HB2 H 1 2.935 0.020 . 1 . . . . 95 PHE HB2 . 16683 1 603 . 1 1 56 56 PHE HB3 H 1 3.362 0.020 . 1 . . . . 95 PHE HB3 . 16683 1 604 . 1 1 56 56 PHE HD1 H 1 7.838 0.020 . 1 . . . . 95 PHE HD1 . 16683 1 605 . 1 1 56 56 PHE HD2 H 1 7.838 0.020 . 1 . . . . 95 PHE HD2 . 16683 1 606 . 1 1 56 56 PHE HE1 H 1 7.098 0.020 . 1 . . . . 95 PHE HE1 . 16683 1 607 . 1 1 56 56 PHE HE2 H 1 7.098 0.020 . 1 . . . . 95 PHE HE2 . 16683 1 608 . 1 1 56 56 PHE HZ H 1 7.086 0.020 . 1 . . . . 95 PHE HZ . 16683 1 609 . 1 1 56 56 PHE C C 13 177.110 0.100 . 1 . . . . 95 PHE C . 16683 1 610 . 1 1 56 56 PHE CA C 13 62.449 0.100 . 1 . . . . 95 PHE CA . 16683 1 611 . 1 1 56 56 PHE CB C 13 39.143 0.100 . 1 . . . . 95 PHE CB . 16683 1 612 . 1 1 56 56 PHE CD1 C 13 132.059 0.100 . 1 . . . . 95 PHE CD1 . 16683 1 613 . 1 1 56 56 PHE CD2 C 13 132.059 0.100 . 1 . . . . 95 PHE CD2 . 16683 1 614 . 1 1 56 56 PHE CE1 C 13 130.255 0.100 . 1 . . . . 95 PHE CE1 . 16683 1 615 . 1 1 56 56 PHE CE2 C 13 130.255 0.100 . 1 . . . . 95 PHE CE2 . 16683 1 616 . 1 1 56 56 PHE CZ C 13 131.064 0.100 . 1 . . . . 95 PHE CZ . 16683 1 617 . 1 1 56 56 PHE N N 15 114.093 0.100 . 1 . . . . 95 PHE N . 16683 1 618 . 1 1 57 57 ALA H H 1 8.786 0.020 . 1 . . . . 96 ALA H . 16683 1 619 . 1 1 57 57 ALA HA H 1 4.655 0.020 . 1 . . . . 96 ALA HA . 16683 1 620 . 1 1 57 57 ALA HB1 H 1 1.694 0.020 . 1 . . . . 96 ALA HB . 16683 1 621 . 1 1 57 57 ALA HB2 H 1 1.694 0.020 . 1 . . . . 96 ALA HB . 16683 1 622 . 1 1 57 57 ALA HB3 H 1 1.694 0.020 . 1 . . . . 96 ALA HB . 16683 1 623 . 1 1 57 57 ALA C C 13 179.020 0.100 . 1 . . . . 96 ALA C . 16683 1 624 . 1 1 57 57 ALA CA C 13 54.624 0.100 . 1 . . . . 96 ALA CA . 16683 1 625 . 1 1 57 57 ALA CB C 13 18.177 0.100 . 1 . . . . 96 ALA CB . 16683 1 626 . 1 1 57 57 ALA N N 15 122.827 0.100 . 1 . . . . 96 ALA N . 16683 1 627 . 1 1 58 58 GLU H H 1 7.219 0.020 . 1 . . . . 97 GLU H . 16683 1 628 . 1 1 58 58 GLU HA H 1 4.055 0.020 . 1 . . . . 97 GLU HA . 16683 1 629 . 1 1 58 58 GLU HB2 H 1 1.964 0.020 . 1 . . . . 97 GLU HB2 . 16683 1 630 . 1 1 58 58 GLU HB3 H 1 1.800 0.020 . 1 . . . . 97 GLU HB3 . 16683 1 631 . 1 1 58 58 GLU HG2 H 1 2.255 0.020 . 1 . . . . 97 GLU HG2 . 16683 1 632 . 1 1 58 58 GLU HG3 H 1 2.055 0.020 . 1 . . . . 97 GLU HG3 . 16683 1 633 . 1 1 58 58 GLU C C 13 177.000 0.100 . 1 . . . . 97 GLU C . 16683 1 634 . 1 1 58 58 GLU CA C 13 57.620 0.100 . 1 . . . . 97 GLU CA . 16683 1 635 . 1 1 58 58 GLU CB C 13 30.431 0.100 . 1 . . . . 97 GLU CB . 16683 1 636 . 1 1 58 58 GLU CG C 13 35.584 0.100 . 1 . . . . 97 GLU CG . 16683 1 637 . 1 1 58 58 GLU N N 15 113.995 0.100 . 1 . . . . 97 GLU N . 16683 1 638 . 1 1 59 59 PHE H H 1 7.890 0.020 . 1 . . . . 98 PHE H . 16683 1 639 . 1 1 59 59 PHE HA H 1 4.360 0.020 . 1 . . . . 98 PHE HA . 16683 1 640 . 1 1 59 59 PHE HB2 H 1 3.485 0.020 . 1 . . . . 98 PHE HB2 . 16683 1 641 . 1 1 59 59 PHE HB3 H 1 3.159 0.020 . 1 . . . . 98 PHE HB3 . 16683 1 642 . 1 1 59 59 PHE HD1 H 1 7.486 0.020 . 1 . . . . 98 PHE HD1 . 16683 1 643 . 1 1 59 59 PHE HD2 H 1 7.486 0.020 . 1 . . . . 98 PHE HD2 . 16683 1 644 . 1 1 59 59 PHE HE1 H 1 7.279 0.020 . 1 . . . . 98 PHE HE1 . 16683 1 645 . 1 1 59 59 PHE HE2 H 1 7.279 0.020 . 1 . . . . 98 PHE HE2 . 16683 1 646 . 1 1 59 59 PHE HZ H 1 6.891 0.020 . 1 . . . . 98 PHE HZ . 16683 1 647 . 1 1 59 59 PHE C C 13 174.610 0.100 . 1 . . . . 98 PHE C . 16683 1 648 . 1 1 59 59 PHE CA C 13 60.010 0.100 . 1 . . . . 98 PHE CA . 16683 1 649 . 1 1 59 59 PHE CB C 13 40.710 0.100 . 1 . . . . 98 PHE CB . 16683 1 650 . 1 1 59 59 PHE CD1 C 13 131.255 0.100 . 1 . . . . 98 PHE CD1 . 16683 1 651 . 1 1 59 59 PHE CD2 C 13 131.255 0.100 . 1 . . . . 98 PHE CD2 . 16683 1 652 . 1 1 59 59 PHE CE1 C 13 131.057 0.100 . 1 . . . . 98 PHE CE1 . 16683 1 653 . 1 1 59 59 PHE CE2 C 13 131.057 0.100 . 1 . . . . 98 PHE CE2 . 16683 1 654 . 1 1 59 59 PHE CZ C 13 129.407 0.100 . 1 . . . . 98 PHE CZ . 16683 1 655 . 1 1 59 59 PHE N N 15 114.242 0.100 . 1 . . . . 98 PHE N . 16683 1 656 . 1 1 60 60 GLY H H 1 7.525 0.020 . 1 . . . . 99 GLY H . 16683 1 657 . 1 1 60 60 GLY HA2 H 1 4.908 0.020 . 1 . . . . 99 GLY HA2 . 16683 1 658 . 1 1 60 60 GLY HA3 H 1 3.939 0.020 . 1 . . . . 99 GLY HA3 . 16683 1 659 . 1 1 60 60 GLY C C 13 171.800 0.100 . 1 . . . . 99 GLY C . 16683 1 660 . 1 1 60 60 GLY CA C 13 44.960 0.100 . 1 . . . . 99 GLY CA . 16683 1 661 . 1 1 60 60 GLY N N 15 105.434 0.100 . 1 . . . . 99 GLY N . 16683 1 662 . 1 1 61 61 THR H H 1 8.247 0.020 . 1 . . . . 100 THR H . 16683 1 663 . 1 1 61 61 THR HA H 1 4.146 0.020 . 1 . . . . 100 THR HA . 16683 1 664 . 1 1 61 61 THR HB H 1 4.088 0.020 . 1 . . . . 100 THR HB . 16683 1 665 . 1 1 61 61 THR HG21 H 1 1.241 0.020 . 1 . . . . 100 THR HG2 . 16683 1 666 . 1 1 61 61 THR HG22 H 1 1.241 0.020 . 1 . . . . 100 THR HG2 . 16683 1 667 . 1 1 61 61 THR HG23 H 1 1.241 0.020 . 1 . . . . 100 THR HG2 . 16683 1 668 . 1 1 61 61 THR C C 13 175.080 0.100 . 1 . . . . 100 THR C . 16683 1 669 . 1 1 61 61 THR CA C 13 64.221 0.100 . 1 . . . . 100 THR CA . 16683 1 670 . 1 1 61 61 THR CB C 13 69.381 0.100 . 1 . . . . 100 THR CB . 16683 1 671 . 1 1 61 61 THR CG2 C 13 22.405 0.100 . 1 . . . . 100 THR CG2 . 16683 1 672 . 1 1 61 61 THR N N 15 112.985 0.100 . 1 . . . . 100 THR N . 16683 1 673 . 1 1 62 62 LEU H H 1 8.946 0.020 . 1 . . . . 101 LEU H . 16683 1 674 . 1 1 62 62 LEU HA H 1 4.592 0.020 . 1 . . . . 101 LEU HA . 16683 1 675 . 1 1 62 62 LEU HB2 H 1 1.723 0.020 . 1 . . . . 101 LEU HB2 . 16683 1 676 . 1 1 62 62 LEU HB3 H 1 1.025 0.020 . 1 . . . . 101 LEU HB3 . 16683 1 677 . 1 1 62 62 LEU HD11 H 1 -0.088 0.020 . 1 . . . . 101 LEU HD1 . 16683 1 678 . 1 1 62 62 LEU HD12 H 1 -0.088 0.020 . 1 . . . . 101 LEU HD1 . 16683 1 679 . 1 1 62 62 LEU HD13 H 1 -0.088 0.020 . 1 . . . . 101 LEU HD1 . 16683 1 680 . 1 1 62 62 LEU HD21 H 1 -0.088 0.020 . 1 . . . . 101 LEU HD2 . 16683 1 681 . 1 1 62 62 LEU HD22 H 1 -0.088 0.020 . 1 . . . . 101 LEU HD2 . 16683 1 682 . 1 1 62 62 LEU HD23 H 1 -0.088 0.020 . 1 . . . . 101 LEU HD2 . 16683 1 683 . 1 1 62 62 LEU HG H 1 0.797 0.020 . 1 . . . . 101 LEU HG . 16683 1 684 . 1 1 62 62 LEU C C 13 177.450 0.100 . 1 . . . . 101 LEU C . 16683 1 685 . 1 1 62 62 LEU CA C 13 53.660 0.100 . 1 . . . . 101 LEU CA . 16683 1 686 . 1 1 62 62 LEU CB C 13 42.970 0.100 . 1 . . . . 101 LEU CB . 16683 1 687 . 1 1 62 62 LEU CD1 C 13 23.071 0.100 . 1 . . . . 101 LEU CD1 . 16683 1 688 . 1 1 62 62 LEU CD2 C 13 23.033 0.100 . 1 . . . . 101 LEU CD2 . 16683 1 689 . 1 1 62 62 LEU CG C 13 26.211 0.100 . 1 . . . . 101 LEU CG . 16683 1 690 . 1 1 62 62 LEU N N 15 127.740 0.100 . 1 . . . . 101 LEU N . 16683 1 691 . 1 1 63 63 LYS H H 1 8.926 0.020 . 1 . . . . 102 LYS H . 16683 1 692 . 1 1 63 63 LYS HA H 1 4.322 0.020 . 1 . . . . 102 LYS HA . 16683 1 693 . 1 1 63 63 LYS HB2 H 1 1.706 0.020 . 1 . . . . 102 LYS HB2 . 16683 1 694 . 1 1 63 63 LYS HB3 H 1 1.283 0.020 . 1 . . . . 102 LYS HB3 . 16683 1 695 . 1 1 63 63 LYS HD2 H 1 1.434 0.020 . 1 . . . . 102 LYS HD2 . 16683 1 696 . 1 1 63 63 LYS HD3 H 1 1.449 0.020 . 1 . . . . 102 LYS HD3 . 16683 1 697 . 1 1 63 63 LYS HE2 H 1 2.915 0.020 . 1 . . . . 102 LYS HE2 . 16683 1 698 . 1 1 63 63 LYS HE3 H 1 2.885 0.020 . 1 . . . . 102 LYS HE3 . 16683 1 699 . 1 1 63 63 LYS HG2 H 1 1.261 0.020 . 1 . . . . 102 LYS HG2 . 16683 1 700 . 1 1 63 63 LYS HG3 H 1 1.217 0.020 . 1 . . . . 102 LYS HG3 . 16683 1 701 . 1 1 63 63 LYS C C 13 176.390 0.100 . 1 . . . . 102 LYS C . 16683 1 702 . 1 1 63 63 LYS CA C 13 56.612 0.100 . 1 . . . . 102 LYS CA . 16683 1 703 . 1 1 63 63 LYS CB C 13 33.061 0.100 . 1 . . . . 102 LYS CB . 16683 1 704 . 1 1 63 63 LYS CD C 13 28.435 0.100 . 1 . . . . 102 LYS CD . 16683 1 705 . 1 1 63 63 LYS CE C 13 41.503 0.100 . 1 . . . . 102 LYS CE . 16683 1 706 . 1 1 63 63 LYS CG C 13 24.632 0.100 . 1 . . . . 102 LYS CG . 16683 1 707 . 1 1 63 63 LYS N N 15 121.552 0.100 . 1 . . . . 102 LYS N . 16683 1 708 . 1 1 64 64 LYS H H 1 7.440 0.020 . 1 . . . . 103 LYS H . 16683 1 709 . 1 1 64 64 LYS HA H 1 4.273 0.020 . 1 . . . . 103 LYS HA . 16683 1 710 . 1 1 64 64 LYS HB2 H 1 1.756 0.020 . 1 . . . . 103 LYS HB2 . 16683 1 711 . 1 1 64 64 LYS HB3 H 1 1.297 0.020 . 1 . . . . 103 LYS HB3 . 16683 1 712 . 1 1 64 64 LYS HD2 H 1 1.279 0.020 . 1 . . . . 103 LYS HD2 . 16683 1 713 . 1 1 64 64 LYS HD3 H 1 1.448 0.020 . 1 . . . . 103 LYS HD3 . 16683 1 714 . 1 1 64 64 LYS HE2 H 1 2.821 0.020 . 1 . . . . 103 LYS HE2 . 16683 1 715 . 1 1 64 64 LYS HE3 H 1 2.889 0.020 . 1 . . . . 103 LYS HE3 . 16683 1 716 . 1 1 64 64 LYS HG2 H 1 1.155 0.020 . 1 . . . . 103 LYS HG2 . 16683 1 717 . 1 1 64 64 LYS HG3 H 1 1.339 0.020 . 1 . . . . 103 LYS HG3 . 16683 1 718 . 1 1 64 64 LYS C C 13 174.020 0.100 . 1 . . . . 103 LYS C . 16683 1 719 . 1 1 64 64 LYS CA C 13 56.543 0.100 . 1 . . . . 103 LYS CA . 16683 1 720 . 1 1 64 64 LYS CB C 13 35.604 0.100 . 1 . . . . 103 LYS CB . 16683 1 721 . 1 1 64 64 LYS CD C 13 29.242 0.100 . 1 . . . . 103 LYS CD . 16683 1 722 . 1 1 64 64 LYS CE C 13 42.180 0.100 . 1 . . . . 103 LYS CE . 16683 1 723 . 1 1 64 64 LYS CG C 13 24.660 0.100 . 1 . . . . 103 LYS CG . 16683 1 724 . 1 1 64 64 LYS N N 15 117.265 0.100 . 1 . . . . 103 LYS N . 16683 1 725 . 1 1 65 65 ALA H H 1 8.703 0.020 . 1 . . . . 104 ALA H . 16683 1 726 . 1 1 65 65 ALA HA H 1 4.931 0.020 . 1 . . . . 104 ALA HA . 16683 1 727 . 1 1 65 65 ALA HB1 H 1 1.276 0.020 . 1 . . . . 104 ALA HB . 16683 1 728 . 1 1 65 65 ALA HB2 H 1 1.276 0.020 . 1 . . . . 104 ALA HB . 16683 1 729 . 1 1 65 65 ALA HB3 H 1 1.276 0.020 . 1 . . . . 104 ALA HB . 16683 1 730 . 1 1 65 65 ALA C C 13 173.760 0.100 . 1 . . . . 104 ALA C . 16683 1 731 . 1 1 65 65 ALA CA C 13 52.368 0.100 . 1 . . . . 104 ALA CA . 16683 1 732 . 1 1 65 65 ALA CB C 13 20.170 0.100 . 1 . . . . 104 ALA CB . 16683 1 733 . 1 1 65 65 ALA N N 15 128.166 0.100 . 1 . . . . 104 ALA N . 16683 1 734 . 1 1 66 66 ALA H H 1 8.182 0.020 . 1 . . . . 105 ALA H . 16683 1 735 . 1 1 66 66 ALA HA H 1 4.795 0.020 . 1 . . . . 105 ALA HA . 16683 1 736 . 1 1 66 66 ALA HB1 H 1 1.402 0.020 . 1 . . . . 105 ALA HB . 16683 1 737 . 1 1 66 66 ALA HB2 H 1 1.402 0.020 . 1 . . . . 105 ALA HB . 16683 1 738 . 1 1 66 66 ALA HB3 H 1 1.402 0.020 . 1 . . . . 105 ALA HB . 16683 1 739 . 1 1 66 66 ALA C C 13 176.320 0.100 . 1 . . . . 105 ALA C . 16683 1 740 . 1 1 66 66 ALA CA C 13 51.203 0.100 . 1 . . . . 105 ALA CA . 16683 1 741 . 1 1 66 66 ALA CB C 13 22.502 0.100 . 1 . . . . 105 ALA CB . 16683 1 742 . 1 1 66 66 ALA N N 15 123.692 0.100 . 1 . . . . 105 ALA N . 16683 1 743 . 1 1 67 67 VAL H H 1 9.267 0.020 . 1 . . . . 106 VAL H . 16683 1 744 . 1 1 67 67 VAL HA H 1 3.941 0.020 . 1 . . . . 106 VAL HA . 16683 1 745 . 1 1 67 67 VAL HB H 1 1.951 0.020 . 1 . . . . 106 VAL HB . 16683 1 746 . 1 1 67 67 VAL HG11 H 1 0.728 0.020 . 1 . . . . 106 VAL HG1 . 16683 1 747 . 1 1 67 67 VAL HG12 H 1 0.728 0.020 . 1 . . . . 106 VAL HG1 . 16683 1 748 . 1 1 67 67 VAL HG13 H 1 0.728 0.020 . 1 . . . . 106 VAL HG1 . 16683 1 749 . 1 1 67 67 VAL HG21 H 1 0.477 0.020 . 1 . . . . 106 VAL HG2 . 16683 1 750 . 1 1 67 67 VAL HG22 H 1 0.477 0.020 . 1 . . . . 106 VAL HG2 . 16683 1 751 . 1 1 67 67 VAL HG23 H 1 0.477 0.020 . 1 . . . . 106 VAL HG2 . 16683 1 752 . 1 1 67 67 VAL C C 13 174.960 0.100 . 1 . . . . 106 VAL C . 16683 1 753 . 1 1 67 67 VAL CA C 13 62.640 0.100 . 1 . . . . 106 VAL CA . 16683 1 754 . 1 1 67 67 VAL CB C 13 32.494 0.100 . 1 . . . . 106 VAL CB . 16683 1 755 . 1 1 67 67 VAL CG1 C 13 22.972 0.100 . 1 . . . . 106 VAL CG1 . 16683 1 756 . 1 1 67 67 VAL CG2 C 13 20.495 0.100 . 1 . . . . 106 VAL CG2 . 16683 1 757 . 1 1 67 67 VAL N N 15 127.972 0.100 . 1 . . . . 106 VAL N . 16683 1 758 . 1 1 68 68 ASP H H 1 8.474 0.020 . 1 . . . . 107 ASP H . 16683 1 759 . 1 1 68 68 ASP HA H 1 4.689 0.020 . 1 . . . . 107 ASP HA . 16683 1 760 . 1 1 68 68 ASP HB2 H 1 2.684 0.020 . 1 . . . . 107 ASP HB2 . 16683 1 761 . 1 1 68 68 ASP HB3 H 1 2.799 0.020 . 1 . . . . 107 ASP HB3 . 16683 1 762 . 1 1 68 68 ASP C C 13 173.220 0.100 . 1 . . . . 107 ASP C . 16683 1 763 . 1 1 68 68 ASP CA C 13 54.400 0.100 . 1 . . . . 107 ASP CA . 16683 1 764 . 1 1 68 68 ASP CB C 13 41.810 0.100 . 1 . . . . 107 ASP CB . 16683 1 765 . 1 1 68 68 ASP N N 15 125.365 0.100 . 1 . . . . 107 ASP N . 16683 1 766 . 1 1 69 69 TYR H H 1 8.402 0.020 . 1 . . . . 108 TYR H . 16683 1 767 . 1 1 69 69 TYR HA H 1 5.082 0.020 . 1 . . . . 108 TYR HA . 16683 1 768 . 1 1 69 69 TYR HB2 H 1 2.787 0.020 . 1 . . . . 108 TYR HB2 . 16683 1 769 . 1 1 69 69 TYR HB3 H 1 2.759 0.020 . 1 . . . . 108 TYR HB3 . 16683 1 770 . 1 1 69 69 TYR HD1 H 1 6.938 0.020 . 1 . . . . 108 TYR HD1 . 16683 1 771 . 1 1 69 69 TYR HD2 H 1 6.939 0.020 . 1 . . . . 108 TYR HD2 . 16683 1 772 . 1 1 69 69 TYR HE1 H 1 6.960 0.020 . 1 . . . . 108 TYR HE1 . 16683 1 773 . 1 1 69 69 TYR HE2 H 1 6.959 0.020 . 1 . . . . 108 TYR HE2 . 16683 1 774 . 1 1 69 69 TYR C C 13 176.820 0.100 . 1 . . . . 108 TYR C . 16683 1 775 . 1 1 69 69 TYR CA C 13 57.107 0.100 . 1 . . . . 108 TYR CA . 16683 1 776 . 1 1 69 69 TYR CB C 13 42.470 0.100 . 1 . . . . 108 TYR CB . 16683 1 777 . 1 1 69 69 TYR CD1 C 13 133.351 0.100 . 1 . . . . 108 TYR CD1 . 16683 1 778 . 1 1 69 69 TYR CD2 C 13 133.299 0.100 . 1 . . . . 108 TYR CD2 . 16683 1 779 . 1 1 69 69 TYR CE1 C 13 118.055 0.100 . 1 . . . . 108 TYR CE1 . 16683 1 780 . 1 1 69 69 TYR CE2 C 13 118.060 0.100 . 1 . . . . 108 TYR CE2 . 16683 1 781 . 1 1 69 69 TYR N N 15 120.304 0.100 . 1 . . . . 108 TYR N . 16683 1 782 . 1 1 70 70 ASP H H 1 9.031 0.020 . 1 . . . . 109 ASP H . 16683 1 783 . 1 1 70 70 ASP HA H 1 4.748 0.020 . 1 . . . . 109 ASP HA . 16683 1 784 . 1 1 70 70 ASP HB2 H 1 2.722 0.020 . 1 . . . . 109 ASP HB2 . 16683 1 785 . 1 1 70 70 ASP HB3 H 1 3.463 0.020 . 1 . . . . 109 ASP HB3 . 16683 1 786 . 1 1 70 70 ASP C C 13 178.360 0.100 . 1 . . . . 109 ASP C . 16683 1 787 . 1 1 70 70 ASP CA C 13 52.193 0.100 . 1 . . . . 109 ASP CA . 16683 1 788 . 1 1 70 70 ASP CB C 13 41.347 0.100 . 1 . . . . 109 ASP CB . 16683 1 789 . 1 1 70 70 ASP N N 15 121.122 0.100 . 1 . . . . 109 ASP N . 16683 1 790 . 1 1 71 71 ARG H H 1 8.491 0.020 . 1 . . . . 110 ARG H . 16683 1 791 . 1 1 71 71 ARG HA H 1 4.191 0.020 . 1 . . . . 110 ARG HA . 16683 1 792 . 1 1 71 71 ARG HB2 H 1 1.947 0.020 . 1 . . . . 110 ARG HB2 . 16683 1 793 . 1 1 71 71 ARG HB3 H 1 1.971 0.020 . 1 . . . . 110 ARG HB3 . 16683 1 794 . 1 1 71 71 ARG HD2 H 1 3.280 0.020 . 1 . . . . 110 ARG HD2 . 16683 1 795 . 1 1 71 71 ARG HD3 H 1 3.259 0.020 . 1 . . . . 110 ARG HD3 . 16683 1 796 . 1 1 71 71 ARG HG2 H 1 1.784 0.020 . 1 . . . . 110 ARG HG2 . 16683 1 797 . 1 1 71 71 ARG HG3 H 1 1.770 0.020 . 1 . . . . 110 ARG HG3 . 16683 1 798 . 1 1 71 71 ARG C C 13 177.320 0.100 . 1 . . . . 110 ARG C . 16683 1 799 . 1 1 71 71 ARG CA C 13 58.540 0.100 . 1 . . . . 110 ARG CA . 16683 1 800 . 1 1 71 71 ARG CB C 13 29.602 0.100 . 1 . . . . 110 ARG CB . 16683 1 801 . 1 1 71 71 ARG CD C 13 43.210 0.100 . 1 . . . . 110 ARG CD . 16683 1 802 . 1 1 71 71 ARG CG C 13 26.922 0.100 . 1 . . . . 110 ARG CG . 16683 1 803 . 1 1 71 71 ARG N N 15 117.585 0.100 . 1 . . . . 110 ARG N . 16683 1 804 . 1 1 72 72 SER H H 1 8.429 0.020 . 1 . . . . 111 SER H . 16683 1 805 . 1 1 72 72 SER HA H 1 4.631 0.020 . 1 . . . . 111 SER HA . 16683 1 806 . 1 1 72 72 SER HB2 H 1 3.998 0.020 . 1 . . . . 111 SER HB2 . 16683 1 807 . 1 1 72 72 SER HB3 H 1 4.009 0.020 . 1 . . . . 111 SER HB3 . 16683 1 808 . 1 1 72 72 SER C C 13 174.470 0.100 . 1 . . . . 111 SER C . 16683 1 809 . 1 1 72 72 SER CA C 13 58.460 0.100 . 1 . . . . 111 SER CA . 16683 1 810 . 1 1 72 72 SER CB C 13 64.160 0.100 . 1 . . . . 111 SER CB . 16683 1 811 . 1 1 72 72 SER N N 15 115.561 0.100 . 1 . . . . 111 SER N . 16683 1 812 . 1 1 73 73 GLY H H 1 8.251 0.020 . 1 . . . . 112 GLY H . 16683 1 813 . 1 1 73 73 GLY HA2 H 1 3.597 0.020 . 1 . . . . 112 GLY HA2 . 16683 1 814 . 1 1 73 73 GLY HA3 H 1 4.237 0.020 . 1 . . . . 112 GLY HA3 . 16683 1 815 . 1 1 73 73 GLY C C 13 173.590 0.100 . 1 . . . . 112 GLY C . 16683 1 816 . 1 1 73 73 GLY CA C 13 45.390 0.100 . 1 . . . . 112 GLY CA . 16683 1 817 . 1 1 73 73 GLY N N 15 109.771 0.100 . 1 . . . . 112 GLY N . 16683 1 818 . 1 1 74 74 ARG H H 1 8.293 0.020 . 1 . . . . 113 ARG H . 16683 1 819 . 1 1 74 74 ARG HA H 1 4.510 0.020 . 1 . . . . 113 ARG HA . 16683 1 820 . 1 1 74 74 ARG HB2 H 1 1.854 0.020 . 1 . . . . 113 ARG HB2 . 16683 1 821 . 1 1 74 74 ARG HB3 H 1 1.832 0.020 . 1 . . . . 113 ARG HB3 . 16683 1 822 . 1 1 74 74 ARG HD2 H 1 3.144 0.020 . 1 . . . . 113 ARG HD2 . 16683 1 823 . 1 1 74 74 ARG HD3 H 1 3.116 0.020 . 1 . . . . 113 ARG HD3 . 16683 1 824 . 1 1 74 74 ARG HG2 H 1 1.616 0.020 . 1 . . . . 113 ARG HG2 . 16683 1 825 . 1 1 74 74 ARG HG3 H 1 1.607 0.020 . 1 . . . . 113 ARG HG3 . 16683 1 826 . 1 1 74 74 ARG C C 13 176.200 0.100 . 1 . . . . 113 ARG C . 16683 1 827 . 1 1 74 74 ARG CA C 13 55.330 0.100 . 1 . . . . 113 ARG CA . 16683 1 828 . 1 1 74 74 ARG CB C 13 30.722 0.100 . 1 . . . . 113 ARG CB . 16683 1 829 . 1 1 74 74 ARG CD C 13 43.260 0.100 . 1 . . . . 113 ARG CD . 16683 1 830 . 1 1 74 74 ARG CG C 13 27.082 0.100 . 1 . . . . 113 ARG CG . 16683 1 831 . 1 1 74 74 ARG N N 15 122.247 0.100 . 1 . . . . 113 ARG N . 16683 1 832 . 1 1 75 75 SER H H 1 8.817 0.020 . 1 . . . . 114 SER H . 16683 1 833 . 1 1 75 75 SER HA H 1 4.113 0.020 . 1 . . . . 114 SER HA . 16683 1 834 . 1 1 75 75 SER HB2 H 1 3.884 0.020 . 1 . . . . 114 SER HB2 . 16683 1 835 . 1 1 75 75 SER HB3 H 1 4.141 0.020 . 1 . . . . 114 SER HB3 . 16683 1 836 . 1 1 75 75 SER C C 13 175.860 0.100 . 1 . . . . 114 SER C . 16683 1 837 . 1 1 75 75 SER CA C 13 58.320 0.100 . 1 . . . . 114 SER CA . 16683 1 838 . 1 1 75 75 SER CB C 13 64.020 0.100 . 1 . . . . 114 SER CB . 16683 1 839 . 1 1 75 75 SER N N 15 118.519 0.100 . 1 . . . . 114 SER N . 16683 1 840 . 1 1 76 76 LEU H H 1 8.767 0.020 . 1 . . . . 115 LEU H . 16683 1 841 . 1 1 76 76 LEU HA H 1 4.432 0.020 . 1 . . . . 115 LEU HA . 16683 1 842 . 1 1 76 76 LEU HB2 H 1 1.626 0.020 . 1 . . . . 115 LEU HB2 . 16683 1 843 . 1 1 76 76 LEU HB3 H 1 1.526 0.020 . 1 . . . . 115 LEU HB3 . 16683 1 844 . 1 1 76 76 LEU HD11 H 1 0.951 0.020 . 1 . . . . 115 LEU HD1 . 16683 1 845 . 1 1 76 76 LEU HD12 H 1 0.951 0.020 . 1 . . . . 115 LEU HD1 . 16683 1 846 . 1 1 76 76 LEU HD13 H 1 0.951 0.020 . 1 . . . . 115 LEU HD1 . 16683 1 847 . 1 1 76 76 LEU HD21 H 1 0.725 0.020 . 1 . . . . 115 LEU HD2 . 16683 1 848 . 1 1 76 76 LEU HD22 H 1 0.725 0.020 . 1 . . . . 115 LEU HD2 . 16683 1 849 . 1 1 76 76 LEU HD23 H 1 0.725 0.020 . 1 . . . . 115 LEU HD2 . 16683 1 850 . 1 1 76 76 LEU HG H 1 1.656 0.020 . 1 . . . . 115 LEU HG . 16683 1 851 . 1 1 76 76 LEU C C 13 178.870 0.100 . 1 . . . . 115 LEU C . 16683 1 852 . 1 1 76 76 LEU CA C 13 54.903 0.100 . 1 . . . . 115 LEU CA . 16683 1 853 . 1 1 76 76 LEU CB C 13 42.109 0.100 . 1 . . . . 115 LEU CB . 16683 1 854 . 1 1 76 76 LEU CD1 C 13 23.004 0.100 . 1 . . . . 115 LEU CD1 . 16683 1 855 . 1 1 76 76 LEU CD2 C 13 25.584 0.100 . 1 . . . . 115 LEU CD2 . 16683 1 856 . 1 1 76 76 LEU CG C 13 26.960 0.100 . 1 . . . . 115 LEU CG . 16683 1 857 . 1 1 76 76 LEU N N 15 125.136 0.100 . 1 . . . . 115 LEU N . 16683 1 858 . 1 1 77 77 GLY H H 1 9.623 0.020 . 1 . . . . 116 GLY H . 16683 1 859 . 1 1 77 77 GLY HA2 H 1 3.432 0.020 . 1 . . . . 116 GLY HA2 . 16683 1 860 . 1 1 77 77 GLY HA3 H 1 4.130 0.020 . 1 . . . . 116 GLY HA3 . 16683 1 861 . 1 1 77 77 GLY C C 13 172.130 0.100 . 1 . . . . 116 GLY C . 16683 1 862 . 1 1 77 77 GLY CA C 13 46.140 0.100 . 1 . . . . 116 GLY CA . 16683 1 863 . 1 1 77 77 GLY N N 15 109.474 0.100 . 1 . . . . 116 GLY N . 16683 1 864 . 1 1 78 78 THR H H 1 7.062 0.020 . 1 . . . . 117 THR H . 16683 1 865 . 1 1 78 78 THR HA H 1 5.372 0.020 . 1 . . . . 117 THR HA . 16683 1 866 . 1 1 78 78 THR HB H 1 4.330 0.020 . 1 . . . . 117 THR HB . 16683 1 867 . 1 1 78 78 THR HG21 H 1 1.087 0.020 . 1 . . . . 117 THR HG2 . 16683 1 868 . 1 1 78 78 THR HG22 H 1 1.087 0.020 . 1 . . . . 117 THR HG2 . 16683 1 869 . 1 1 78 78 THR HG23 H 1 1.087 0.020 . 1 . . . . 117 THR HG2 . 16683 1 870 . 1 1 78 78 THR C C 13 172.370 0.100 . 1 . . . . 117 THR C . 16683 1 871 . 1 1 78 78 THR CA C 13 58.433 0.100 . 1 . . . . 117 THR CA . 16683 1 872 . 1 1 78 78 THR CB C 13 72.246 0.100 . 1 . . . . 117 THR CB . 16683 1 873 . 1 1 78 78 THR CG2 C 13 21.163 0.100 . 1 . . . . 117 THR CG2 . 16683 1 874 . 1 1 78 78 THR N N 15 106.681 0.100 . 1 . . . . 117 THR N . 16683 1 875 . 1 1 79 79 ALA H H 1 9.234 0.020 . 1 . . . . 118 ALA H . 16683 1 876 . 1 1 79 79 ALA HA H 1 4.798 0.020 . 1 . . . . 118 ALA HA . 16683 1 877 . 1 1 79 79 ALA HB1 H 1 0.929 0.020 . 1 . . . . 118 ALA HB . 16683 1 878 . 1 1 79 79 ALA HB2 H 1 0.929 0.020 . 1 . . . . 118 ALA HB . 16683 1 879 . 1 1 79 79 ALA HB3 H 1 0.929 0.020 . 1 . . . . 118 ALA HB . 16683 1 880 . 1 1 79 79 ALA C C 13 174.400 0.100 . 1 . . . . 118 ALA C . 16683 1 881 . 1 1 79 79 ALA CA C 13 50.926 0.100 . 1 . . . . 118 ALA CA . 16683 1 882 . 1 1 79 79 ALA CB C 13 22.844 0.100 . 1 . . . . 118 ALA CB . 16683 1 883 . 1 1 79 79 ALA N N 15 119.463 0.100 . 1 . . . . 118 ALA N . 16683 1 884 . 1 1 80 80 ASP H H 1 8.222 0.020 . 1 . . . . 119 ASP H . 16683 1 885 . 1 1 80 80 ASP HA H 1 5.123 0.020 . 1 . . . . 119 ASP HA . 16683 1 886 . 1 1 80 80 ASP HB2 H 1 2.668 0.020 . 1 . . . . 119 ASP HB2 . 16683 1 887 . 1 1 80 80 ASP HB3 H 1 2.594 0.020 . 1 . . . . 119 ASP HB3 . 16683 1 888 . 1 1 80 80 ASP C C 13 175.160 0.100 . 1 . . . . 119 ASP C . 16683 1 889 . 1 1 80 80 ASP CA C 13 52.880 0.100 . 1 . . . . 119 ASP CA . 16683 1 890 . 1 1 80 80 ASP CB C 13 43.507 0.100 . 1 . . . . 119 ASP CB . 16683 1 891 . 1 1 80 80 ASP N N 15 121.364 0.100 . 1 . . . . 119 ASP N . 16683 1 892 . 1 1 81 81 VAL H H 1 8.242 0.020 . 1 . . . . 120 VAL H . 16683 1 893 . 1 1 81 81 VAL HA H 1 4.395 0.020 . 1 . . . . 120 VAL HA . 16683 1 894 . 1 1 81 81 VAL HB H 1 1.621 0.020 . 1 . . . . 120 VAL HB . 16683 1 895 . 1 1 81 81 VAL HG11 H 1 0.366 0.020 . 1 . . . . 120 VAL HG1 . 16683 1 896 . 1 1 81 81 VAL HG12 H 1 0.366 0.020 . 1 . . . . 120 VAL HG1 . 16683 1 897 . 1 1 81 81 VAL HG13 H 1 0.366 0.020 . 1 . . . . 120 VAL HG1 . 16683 1 898 . 1 1 81 81 VAL HG21 H 1 0.158 0.020 . 1 . . . . 120 VAL HG2 . 16683 1 899 . 1 1 81 81 VAL HG22 H 1 0.158 0.020 . 1 . . . . 120 VAL HG2 . 16683 1 900 . 1 1 81 81 VAL HG23 H 1 0.158 0.020 . 1 . . . . 120 VAL HG2 . 16683 1 901 . 1 1 81 81 VAL C C 13 173.960 0.100 . 1 . . . . 120 VAL C . 16683 1 902 . 1 1 81 81 VAL CA C 13 61.195 0.100 . 1 . . . . 120 VAL CA . 16683 1 903 . 1 1 81 81 VAL CB C 13 33.999 0.100 . 1 . . . . 120 VAL CB . 16683 1 904 . 1 1 81 81 VAL CG1 C 13 22.662 0.100 . 1 . . . . 120 VAL CG1 . 16683 1 905 . 1 1 81 81 VAL CG2 C 13 20.576 0.100 . 1 . . . . 120 VAL CG2 . 16683 1 906 . 1 1 81 81 VAL N N 15 122.682 0.100 . 1 . . . . 120 VAL N . 16683 1 907 . 1 1 82 82 HIS H H 1 9.248 0.020 . 1 . . . . 121 HIS H . 16683 1 908 . 1 1 82 82 HIS HA H 1 5.498 0.020 . 1 . . . . 121 HIS HA . 16683 1 909 . 1 1 82 82 HIS HB2 H 1 2.919 0.020 . 1 . . . . 121 HIS HB2 . 16683 1 910 . 1 1 82 82 HIS HB3 H 1 3.193 0.020 . 1 . . . . 121 HIS HB3 . 16683 1 911 . 1 1 82 82 HIS HD2 H 1 6.926 0.020 . 1 . . . . 121 HIS HD2 . 16683 1 912 . 1 1 82 82 HIS HE1 H 1 7.857 0.020 . 1 . . . . 121 HIS HE1 . 16683 1 913 . 1 1 82 82 HIS C C 13 175.000 0.100 . 1 . . . . 121 HIS C . 16683 1 914 . 1 1 82 82 HIS CA C 13 53.329 0.100 . 1 . . . . 121 HIS CA . 16683 1 915 . 1 1 82 82 HIS CB C 13 34.053 0.100 . 1 . . . . 121 HIS CB . 16683 1 916 . 1 1 82 82 HIS CD2 C 13 116.871 0.100 . 1 . . . . 121 HIS CD2 . 16683 1 917 . 1 1 82 82 HIS CE1 C 13 138.317 0.100 . 1 . . . . 121 HIS CE1 . 16683 1 918 . 1 1 82 82 HIS N N 15 127.317 0.100 . 1 . . . . 121 HIS N . 16683 1 919 . 1 1 83 83 PHE H H 1 9.345 0.020 . 1 . . . . 122 PHE H . 16683 1 920 . 1 1 83 83 PHE HA H 1 4.851 0.020 . 1 . . . . 122 PHE HA . 16683 1 921 . 1 1 83 83 PHE HB2 H 1 2.809 0.020 . 1 . . . . 122 PHE HB2 . 16683 1 922 . 1 1 83 83 PHE HB3 H 1 3.727 0.020 . 1 . . . . 122 PHE HB3 . 16683 1 923 . 1 1 83 83 PHE HD1 H 1 7.344 0.020 . 1 . . . . 122 PHE HD1 . 16683 1 924 . 1 1 83 83 PHE HD2 H 1 7.342 0.020 . 1 . . . . 122 PHE HD2 . 16683 1 925 . 1 1 83 83 PHE HE1 H 1 7.286 0.020 . 1 . . . . 122 PHE HE1 . 16683 1 926 . 1 1 83 83 PHE HE2 H 1 7.286 0.020 . 1 . . . . 122 PHE HE2 . 16683 1 927 . 1 1 83 83 PHE C C 13 175.620 0.100 . 1 . . . . 122 PHE C . 16683 1 928 . 1 1 83 83 PHE CA C 13 58.428 0.100 . 1 . . . . 122 PHE CA . 16683 1 929 . 1 1 83 83 PHE CB C 13 41.508 0.100 . 1 . . . . 122 PHE CB . 16683 1 930 . 1 1 83 83 PHE CD1 C 13 131.260 0.100 . 1 . . . . 122 PHE CD1 . 16683 1 931 . 1 1 83 83 PHE CD2 C 13 131.260 0.100 . 1 . . . . 122 PHE CD2 . 16683 1 932 . 1 1 83 83 PHE CE1 C 13 137.060 0.100 . 1 . . . . 122 PHE CE1 . 16683 1 933 . 1 1 83 83 PHE CE2 C 13 137.060 0.100 . 1 . . . . 122 PHE CE2 . 16683 1 934 . 1 1 83 83 PHE N N 15 125.501 0.100 . 1 . . . . 122 PHE N . 16683 1 935 . 1 1 84 84 GLU H H 1 8.154 0.020 . 1 . . . . 123 GLU H . 16683 1 936 . 1 1 84 84 GLU HA H 1 4.100 0.020 . 1 . . . . 123 GLU HA . 16683 1 937 . 1 1 84 84 GLU HB2 H 1 2.026 0.020 . 1 . . . . 123 GLU HB2 . 16683 1 938 . 1 1 84 84 GLU HB3 H 1 2.235 0.020 . 1 . . . . 123 GLU HB3 . 16683 1 939 . 1 1 84 84 GLU HG2 H 1 2.167 0.020 . 1 . . . . 123 GLU HG2 . 16683 1 940 . 1 1 84 84 GLU HG3 H 1 2.195 0.020 . 1 . . . . 123 GLU HG3 . 16683 1 941 . 1 1 84 84 GLU C C 13 176.510 0.100 . 1 . . . . 123 GLU C . 16683 1 942 . 1 1 84 84 GLU CA C 13 59.580 0.100 . 1 . . . . 123 GLU CA . 16683 1 943 . 1 1 84 84 GLU CB C 13 30.339 0.100 . 1 . . . . 123 GLU CB . 16683 1 944 . 1 1 84 84 GLU CG C 13 36.712 0.100 . 1 . . . . 123 GLU CG . 16683 1 945 . 1 1 84 84 GLU N N 15 120.522 0.100 . 1 . . . . 123 GLU N . 16683 1 946 . 1 1 85 85 ARG H H 1 9.377 0.020 . 1 . . . . 124 ARG H . 16683 1 947 . 1 1 85 85 ARG HA H 1 4.899 0.020 . 1 . . . . 124 ARG HA . 16683 1 948 . 1 1 85 85 ARG HB2 H 1 1.992 0.020 . 1 . . . . 124 ARG HB2 . 16683 1 949 . 1 1 85 85 ARG HB3 H 1 1.992 0.020 . 1 . . . . 124 ARG HB3 . 16683 1 950 . 1 1 85 85 ARG HD2 H 1 3.388 0.020 . 1 . . . . 124 ARG HD2 . 16683 1 951 . 1 1 85 85 ARG HD3 H 1 3.341 0.020 . 1 . . . . 124 ARG HD3 . 16683 1 952 . 1 1 85 85 ARG HG2 H 1 1.678 0.020 . 1 . . . . 124 ARG HG2 . 16683 1 953 . 1 1 85 85 ARG HG3 H 1 1.844 0.020 . 1 . . . . 124 ARG HG3 . 16683 1 954 . 1 1 85 85 ARG C C 13 176.840 0.100 . 1 . . . . 124 ARG C . 16683 1 955 . 1 1 85 85 ARG CA C 13 54.270 0.100 . 1 . . . . 124 ARG CA . 16683 1 956 . 1 1 85 85 ARG CB C 13 31.234 0.100 . 1 . . . . 124 ARG CB . 16683 1 957 . 1 1 85 85 ARG CD C 13 43.460 0.100 . 1 . . . . 124 ARG CD . 16683 1 958 . 1 1 85 85 ARG CG C 13 26.714 0.100 . 1 . . . . 124 ARG CG . 16683 1 959 . 1 1 85 85 ARG N N 15 115.392 0.100 . 1 . . . . 124 ARG N . 16683 1 960 . 1 1 86 86 ARG H H 1 9.360 0.020 . 1 . . . . 125 ARG H . 16683 1 961 . 1 1 86 86 ARG HA H 1 3.737 0.020 . 1 . . . . 125 ARG HA . 16683 1 962 . 1 1 86 86 ARG HB2 H 1 1.828 0.020 . 1 . . . . 125 ARG HB2 . 16683 1 963 . 1 1 86 86 ARG HB3 H 1 1.828 0.020 . 1 . . . . 125 ARG HB3 . 16683 1 964 . 1 1 86 86 ARG HD2 H 1 3.182 0.020 . 1 . . . . 125 ARG HD2 . 16683 1 965 . 1 1 86 86 ARG HD3 H 1 3.182 0.020 . 1 . . . . 125 ARG HD3 . 16683 1 966 . 1 1 86 86 ARG HG2 H 1 1.591 0.020 . 1 . . . . 125 ARG HG2 . 16683 1 967 . 1 1 86 86 ARG HG3 H 1 1.591 0.020 . 1 . . . . 125 ARG HG3 . 16683 1 968 . 1 1 86 86 ARG C C 13 177.250 0.100 . 1 . . . . 125 ARG C . 16683 1 969 . 1 1 86 86 ARG CA C 13 59.945 0.100 . 1 . . . . 125 ARG CA . 16683 1 970 . 1 1 86 86 ARG CB C 13 29.692 0.100 . 1 . . . . 125 ARG CB . 16683 1 971 . 1 1 86 86 ARG CD C 13 42.555 0.100 . 1 . . . . 125 ARG CD . 16683 1 972 . 1 1 86 86 ARG CG C 13 25.448 0.100 . 1 . . . . 125 ARG CG . 16683 1 973 . 1 1 86 86 ARG N N 15 127.385 0.100 . 1 . . . . 125 ARG N . 16683 1 974 . 1 1 87 87 ALA H H 1 9.176 0.020 . 1 . . . . 126 ALA H . 16683 1 975 . 1 1 87 87 ALA HA H 1 3.965 0.020 . 1 . . . . 126 ALA HA . 16683 1 976 . 1 1 87 87 ALA HB1 H 1 1.431 0.020 . 1 . . . . 126 ALA HB . 16683 1 977 . 1 1 87 87 ALA HB2 H 1 1.431 0.020 . 1 . . . . 126 ALA HB . 16683 1 978 . 1 1 87 87 ALA HB3 H 1 1.431 0.020 . 1 . . . . 126 ALA HB . 16683 1 979 . 1 1 87 87 ALA C C 13 180.010 0.100 . 1 . . . . 126 ALA C . 16683 1 980 . 1 1 87 87 ALA CA C 13 55.256 0.100 . 1 . . . . 126 ALA CA . 16683 1 981 . 1 1 87 87 ALA CB C 13 18.592 0.100 . 1 . . . . 126 ALA CB . 16683 1 982 . 1 1 87 87 ALA N N 15 118.410 0.100 . 1 . . . . 126 ALA N . 16683 1 983 . 1 1 88 88 ASP H H 1 6.737 0.020 . 1 . . . . 127 ASP H . 16683 1 984 . 1 1 88 88 ASP HA H 1 4.363 0.020 . 1 . . . . 127 ASP HA . 16683 1 985 . 1 1 88 88 ASP HB2 H 1 2.915 0.020 . 1 . . . . 127 ASP HB2 . 16683 1 986 . 1 1 88 88 ASP HB3 H 1 2.745 0.020 . 1 . . . . 127 ASP HB3 . 16683 1 987 . 1 1 88 88 ASP C C 13 176.270 0.100 . 1 . . . . 127 ASP C . 16683 1 988 . 1 1 88 88 ASP CA C 13 56.690 0.100 . 1 . . . . 127 ASP CA . 16683 1 989 . 1 1 88 88 ASP CB C 13 40.520 0.100 . 1 . . . . 127 ASP CB . 16683 1 990 . 1 1 88 88 ASP N N 15 117.647 0.100 . 1 . . . . 127 ASP N . 16683 1 991 . 1 1 89 89 ALA H H 1 6.709 0.020 . 1 . . . . 128 ALA H . 16683 1 992 . 1 1 89 89 ALA HA H 1 2.850 0.020 . 1 . . . . 128 ALA HA . 16683 1 993 . 1 1 89 89 ALA HB1 H 1 1.184 0.020 . 1 . . . . 128 ALA HB . 16683 1 994 . 1 1 89 89 ALA HB2 H 1 1.184 0.020 . 1 . . . . 128 ALA HB . 16683 1 995 . 1 1 89 89 ALA HB3 H 1 1.184 0.020 . 1 . . . . 128 ALA HB . 16683 1 996 . 1 1 89 89 ALA C C 13 178.110 0.100 . 1 . . . . 128 ALA C . 16683 1 997 . 1 1 89 89 ALA CA C 13 53.976 0.100 . 1 . . . . 128 ALA CA . 16683 1 998 . 1 1 89 89 ALA CB C 13 18.858 0.100 . 1 . . . . 128 ALA CB . 16683 1 999 . 1 1 89 89 ALA N N 15 121.456 0.100 . 1 . . . . 128 ALA N . 16683 1 1000 . 1 1 90 90 LEU H H 1 7.862 0.020 . 1 . . . . 129 LEU H . 16683 1 1001 . 1 1 90 90 LEU HA H 1 3.838 0.020 . 1 . . . . 129 LEU HA . 16683 1 1002 . 1 1 90 90 LEU HB2 H 1 1.482 0.020 . 1 . . . . 129 LEU HB2 . 16683 1 1003 . 1 1 90 90 LEU HB3 H 1 1.723 0.020 . 1 . . . . 129 LEU HB3 . 16683 1 1004 . 1 1 90 90 LEU HD11 H 1 0.840 0.020 . 1 . . . . 129 LEU HD1 . 16683 1 1005 . 1 1 90 90 LEU HD12 H 1 0.840 0.020 . 1 . . . . 129 LEU HD1 . 16683 1 1006 . 1 1 90 90 LEU HD13 H 1 0.840 0.020 . 1 . . . . 129 LEU HD1 . 16683 1 1007 . 1 1 90 90 LEU HD21 H 1 0.816 0.020 . 1 . . . . 129 LEU HD2 . 16683 1 1008 . 1 1 90 90 LEU HD22 H 1 0.816 0.020 . 1 . . . . 129 LEU HD2 . 16683 1 1009 . 1 1 90 90 LEU HD23 H 1 0.816 0.020 . 1 . . . . 129 LEU HD2 . 16683 1 1010 . 1 1 90 90 LEU HG H 1 0.877 0.020 . 1 . . . . 129 LEU HG . 16683 1 1011 . 1 1 90 90 LEU C C 13 179.670 0.100 . 1 . . . . 129 LEU C . 16683 1 1012 . 1 1 90 90 LEU CA C 13 58.070 0.100 . 1 . . . . 129 LEU CA . 16683 1 1013 . 1 1 90 90 LEU CB C 13 41.180 0.100 . 1 . . . . 129 LEU CB . 16683 1 1014 . 1 1 90 90 LEU CD1 C 13 23.312 0.100 . 1 . . . . 129 LEU CD1 . 16683 1 1015 . 1 1 90 90 LEU CD2 C 13 23.312 0.100 . 1 . . . . 129 LEU CD2 . 16683 1 1016 . 1 1 90 90 LEU CG C 13 25.092 0.100 . 1 . . . . 129 LEU CG . 16683 1 1017 . 1 1 90 90 LEU N N 15 115.755 0.100 . 1 . . . . 129 LEU N . 16683 1 1018 . 1 1 91 91 LYS H H 1 7.308 0.020 . 1 . . . . 130 LYS H . 16683 1 1019 . 1 1 91 91 LYS HA H 1 3.883 0.020 . 1 . . . . 130 LYS HA . 16683 1 1020 . 1 1 91 91 LYS HB2 H 1 1.965 0.020 . 1 . . . . 130 LYS HB2 . 16683 1 1021 . 1 1 91 91 LYS HB3 H 1 1.969 0.020 . 1 . . . . 130 LYS HB3 . 16683 1 1022 . 1 1 91 91 LYS HD2 H 1 1.909 0.020 . 1 . . . . 130 LYS HD2 . 16683 1 1023 . 1 1 91 91 LYS HD3 H 1 1.921 0.020 . 1 . . . . 130 LYS HD3 . 16683 1 1024 . 1 1 91 91 LYS HE2 H 1 3.103 0.020 . 1 . . . . 130 LYS HE2 . 16683 1 1025 . 1 1 91 91 LYS HE3 H 1 3.111 0.020 . 1 . . . . 130 LYS HE3 . 16683 1 1026 . 1 1 91 91 LYS HG2 H 1 1.702 0.020 . 1 . . . . 130 LYS HG2 . 16683 1 1027 . 1 1 91 91 LYS HG3 H 1 1.516 0.020 . 1 . . . . 130 LYS HG3 . 16683 1 1028 . 1 1 91 91 LYS C C 13 178.290 0.100 . 1 . . . . 130 LYS C . 16683 1 1029 . 1 1 91 91 LYS CA C 13 59.839 0.100 . 1 . . . . 130 LYS CA . 16683 1 1030 . 1 1 91 91 LYS CB C 13 33.726 0.100 . 1 . . . . 130 LYS CB . 16683 1 1031 . 1 1 91 91 LYS CD C 13 29.472 0.100 . 1 . . . . 130 LYS CD . 16683 1 1032 . 1 1 91 91 LYS CE C 13 42.400 0.100 . 1 . . . . 130 LYS CE . 16683 1 1033 . 1 1 91 91 LYS CG C 13 25.492 0.100 . 1 . . . . 130 LYS CG . 16683 1 1034 . 1 1 91 91 LYS N N 15 119.631 0.100 . 1 . . . . 130 LYS N . 16683 1 1035 . 1 1 92 92 ALA H H 1 7.605 0.020 . 1 . . . . 131 ALA H . 16683 1 1036 . 1 1 92 92 ALA HA H 1 2.402 0.020 . 1 . . . . 131 ALA HA . 16683 1 1037 . 1 1 92 92 ALA HB1 H 1 1.308 0.020 . 1 . . . . 131 ALA HB . 16683 1 1038 . 1 1 92 92 ALA HB2 H 1 1.308 0.020 . 1 . . . . 131 ALA HB . 16683 1 1039 . 1 1 92 92 ALA HB3 H 1 1.308 0.020 . 1 . . . . 131 ALA HB . 16683 1 1040 . 1 1 92 92 ALA C C 13 178.650 0.100 . 1 . . . . 131 ALA C . 16683 1 1041 . 1 1 92 92 ALA CA C 13 54.317 0.100 . 1 . . . . 131 ALA CA . 16683 1 1042 . 1 1 92 92 ALA CB C 13 19.472 0.100 . 1 . . . . 131 ALA CB . 16683 1 1043 . 1 1 92 92 ALA N N 15 122.173 0.100 . 1 . . . . 131 ALA N . 16683 1 1044 . 1 1 93 93 MET H H 1 8.209 0.020 . 1 . . . . 132 MET H . 16683 1 1045 . 1 1 93 93 MET HA H 1 3.877 0.020 . 1 . . . . 132 MET HA . 16683 1 1046 . 1 1 93 93 MET HB2 H 1 1.959 0.020 . 1 . . . . 132 MET HB2 . 16683 1 1047 . 1 1 93 93 MET HB3 H 1 2.027 0.020 . 1 . . . . 132 MET HB3 . 16683 1 1048 . 1 1 93 93 MET HE1 H 1 2.108 0.020 . 1 . . . . 132 MET HE . 16683 1 1049 . 1 1 93 93 MET HE2 H 1 2.108 0.020 . 1 . . . . 132 MET HE . 16683 1 1050 . 1 1 93 93 MET HE3 H 1 2.108 0.020 . 1 . . . . 132 MET HE . 16683 1 1051 . 1 1 93 93 MET HG2 H 1 2.234 0.020 . 1 . . . . 132 MET HG2 . 16683 1 1052 . 1 1 93 93 MET HG3 H 1 2.465 0.020 . 1 . . . . 132 MET HG3 . 16683 1 1053 . 1 1 93 93 MET C C 13 176.860 0.100 . 1 . . . . 132 MET C . 16683 1 1054 . 1 1 93 93 MET CA C 13 59.836 0.100 . 1 . . . . 132 MET CA . 16683 1 1055 . 1 1 93 93 MET CB C 13 33.083 0.100 . 1 . . . . 132 MET CB . 16683 1 1056 . 1 1 93 93 MET CE C 13 16.882 0.100 . 1 . . . . 132 MET CE . 16683 1 1057 . 1 1 93 93 MET CG C 13 31.282 0.100 . 1 . . . . 132 MET CG . 16683 1 1058 . 1 1 93 93 MET N N 15 116.144 0.100 . 1 . . . . 132 MET N . 16683 1 1059 . 1 1 94 94 LYS H H 1 7.680 0.020 . 1 . . . . 133 LYS H . 16683 1 1060 . 1 1 94 94 LYS HA H 1 3.969 0.020 . 1 . . . . 133 LYS HA . 16683 1 1061 . 1 1 94 94 LYS HB2 H 1 1.885 0.020 . 1 . . . . 133 LYS HB2 . 16683 1 1062 . 1 1 94 94 LYS HB3 H 1 1.872 0.020 . 1 . . . . 133 LYS HB3 . 16683 1 1063 . 1 1 94 94 LYS HD2 H 1 1.683 0.020 . 1 . . . . 133 LYS HD2 . 16683 1 1064 . 1 1 94 94 LYS HD3 H 1 1.688 0.020 . 1 . . . . 133 LYS HD3 . 16683 1 1065 . 1 1 94 94 LYS HE2 H 1 2.972 0.020 . 1 . . . . 133 LYS HE2 . 16683 1 1066 . 1 1 94 94 LYS HE3 H 1 2.977 0.020 . 1 . . . . 133 LYS HE3 . 16683 1 1067 . 1 1 94 94 LYS HG2 H 1 1.528 0.020 . 1 . . . . 133 LYS HG2 . 16683 1 1068 . 1 1 94 94 LYS HG3 H 1 1.451 0.020 . 1 . . . . 133 LYS HG3 . 16683 1 1069 . 1 1 94 94 LYS C C 13 178.590 0.100 . 1 . . . . 133 LYS C . 16683 1 1070 . 1 1 94 94 LYS CA C 13 58.840 0.100 . 1 . . . . 133 LYS CA . 16683 1 1071 . 1 1 94 94 LYS CB C 13 32.112 0.100 . 1 . . . . 133 LYS CB . 16683 1 1072 . 1 1 94 94 LYS CD C 13 29.142 0.100 . 1 . . . . 133 LYS CD . 16683 1 1073 . 1 1 94 94 LYS CE C 13 42.080 0.100 . 1 . . . . 133 LYS CE . 16683 1 1074 . 1 1 94 94 LYS CG C 13 25.092 0.100 . 1 . . . . 133 LYS CG . 16683 1 1075 . 1 1 94 94 LYS N N 15 116.856 0.100 . 1 . . . . 133 LYS N . 16683 1 1076 . 1 1 95 95 GLN H H 1 7.499 0.020 . 1 . . . . 134 GLN H . 16683 1 1077 . 1 1 95 95 GLN HA H 1 3.961 0.020 . 1 . . . . 134 GLN HA . 16683 1 1078 . 1 1 95 95 GLN HB2 H 1 1.331 0.020 . 1 . . . . 134 GLN HB2 . 16683 1 1079 . 1 1 95 95 GLN HB3 H 1 1.744 0.020 . 1 . . . . 134 GLN HB3 . 16683 1 1080 . 1 1 95 95 GLN HE21 H 1 6.959 0.020 . 1 . . . . 134 GLN HE21 . 16683 1 1081 . 1 1 95 95 GLN HE22 H 1 7.313 0.020 . 1 . . . . 134 GLN HE22 . 16683 1 1082 . 1 1 95 95 GLN HG2 H 1 1.882 0.020 . 1 . . . . 134 GLN HG2 . 16683 1 1083 . 1 1 95 95 GLN HG3 H 1 2.038 0.020 . 1 . . . . 134 GLN HG3 . 16683 1 1084 . 1 1 95 95 GLN C C 13 177.600 0.100 . 1 . . . . 134 GLN C . 16683 1 1085 . 1 1 95 95 GLN CA C 13 58.200 0.100 . 1 . . . . 134 GLN CA . 16683 1 1086 . 1 1 95 95 GLN CB C 13 28.372 0.100 . 1 . . . . 134 GLN CB . 16683 1 1087 . 1 1 95 95 GLN CG C 13 32.692 0.100 . 1 . . . . 134 GLN CG . 16683 1 1088 . 1 1 95 95 GLN N N 15 116.753 0.100 . 1 . . . . 134 GLN N . 16683 1 1089 . 1 1 95 95 GLN NE2 N 15 111.800 0.100 . 1 . . . . 134 GLN NE2 . 16683 1 1090 . 1 1 96 96 TYR H H 1 7.543 0.020 . 1 . . . . 135 TYR H . 16683 1 1091 . 1 1 96 96 TYR HA H 1 4.996 0.020 . 1 . . . . 135 TYR HA . 16683 1 1092 . 1 1 96 96 TYR HB2 H 1 3.468 0.020 . 1 . . . . 135 TYR HB2 . 16683 1 1093 . 1 1 96 96 TYR HB3 H 1 3.429 0.020 . 1 . . . . 135 TYR HB3 . 16683 1 1094 . 1 1 96 96 TYR HD1 H 1 6.731 0.020 . 1 . . . . 135 TYR HD1 . 16683 1 1095 . 1 1 96 96 TYR HD2 H 1 6.731 0.020 . 1 . . . . 135 TYR HD2 . 16683 1 1096 . 1 1 96 96 TYR HE1 H 1 6.607 0.020 . 1 . . . . 135 TYR HE1 . 16683 1 1097 . 1 1 96 96 TYR HE2 H 1 6.607 0.020 . 1 . . . . 135 TYR HE2 . 16683 1 1098 . 1 1 96 96 TYR C C 13 176.710 0.100 . 1 . . . . 135 TYR C . 16683 1 1099 . 1 1 96 96 TYR CA C 13 57.067 0.100 . 1 . . . . 135 TYR CA . 16683 1 1100 . 1 1 96 96 TYR CB C 13 40.270 0.100 . 1 . . . . 135 TYR CB . 16683 1 1101 . 1 1 96 96 TYR CD1 C 13 130.920 0.100 . 1 . . . . 135 TYR CD1 . 16683 1 1102 . 1 1 96 96 TYR CD2 C 13 131.860 0.100 . 1 . . . . 135 TYR CD2 . 16683 1 1103 . 1 1 96 96 TYR CE1 C 13 118.160 0.100 . 1 . . . . 135 TYR CE1 . 16683 1 1104 . 1 1 96 96 TYR CE2 C 13 118.161 0.100 . 1 . . . . 135 TYR CE2 . 16683 1 1105 . 1 1 96 96 TYR N N 15 112.388 0.100 . 1 . . . . 135 TYR N . 16683 1 1106 . 1 1 97 97 LYS H H 1 8.337 0.020 . 1 . . . . 136 LYS H . 16683 1 1107 . 1 1 97 97 LYS HA H 1 3.891 0.020 . 1 . . . . 136 LYS HA . 16683 1 1108 . 1 1 97 97 LYS HB2 H 1 2.010 0.020 . 1 . . . . 136 LYS HB2 . 16683 1 1109 . 1 1 97 97 LYS HB3 H 1 2.028 0.020 . 1 . . . . 136 LYS HB3 . 16683 1 1110 . 1 1 97 97 LYS HD2 H 1 1.856 0.020 . 1 . . . . 136 LYS HD2 . 16683 1 1111 . 1 1 97 97 LYS HD3 H 1 1.833 0.020 . 1 . . . . 136 LYS HD3 . 16683 1 1112 . 1 1 97 97 LYS HE2 H 1 3.174 0.020 . 1 . . . . 136 LYS HE2 . 16683 1 1113 . 1 1 97 97 LYS HE3 H 1 3.168 0.020 . 1 . . . . 136 LYS HE3 . 16683 1 1114 . 1 1 97 97 LYS HG2 H 1 1.574 0.020 . 1 . . . . 136 LYS HG2 . 16683 1 1115 . 1 1 97 97 LYS HG3 H 1 1.596 0.020 . 1 . . . . 136 LYS HG3 . 16683 1 1116 . 1 1 97 97 LYS C C 13 177.950 0.100 . 1 . . . . 136 LYS C . 16683 1 1117 . 1 1 97 97 LYS CA C 13 60.243 0.100 . 1 . . . . 136 LYS CA . 16683 1 1118 . 1 1 97 97 LYS CB C 13 31.932 0.100 . 1 . . . . 136 LYS CB . 16683 1 1119 . 1 1 97 97 LYS CD C 13 29.466 0.100 . 1 . . . . 136 LYS CD . 16683 1 1120 . 1 1 97 97 LYS CE C 13 42.280 0.100 . 1 . . . . 136 LYS CE . 16683 1 1121 . 1 1 97 97 LYS CG C 13 25.443 0.100 . 1 . . . . 136 LYS CG . 16683 1 1122 . 1 1 97 97 LYS N N 15 122.022 0.100 . 1 . . . . 136 LYS N . 16683 1 1123 . 1 1 98 98 GLY H H 1 9.369 0.020 . 1 . . . . 137 GLY H . 16683 1 1124 . 1 1 98 98 GLY HA2 H 1 3.630 0.020 . 1 . . . . 137 GLY HA2 . 16683 1 1125 . 1 1 98 98 GLY HA3 H 1 4.352 0.020 . 1 . . . . 137 GLY HA3 . 16683 1 1126 . 1 1 98 98 GLY C C 13 173.450 0.100 . 1 . . . . 137 GLY C . 16683 1 1127 . 1 1 98 98 GLY CA C 13 45.610 0.100 . 1 . . . . 137 GLY CA . 16683 1 1128 . 1 1 98 98 GLY N N 15 116.507 0.100 . 1 . . . . 137 GLY N . 16683 1 1129 . 1 1 99 99 VAL H H 1 8.374 0.020 . 1 . . . . 138 VAL H . 16683 1 1130 . 1 1 99 99 VAL HA H 1 4.240 0.020 . 1 . . . . 138 VAL HA . 16683 1 1131 . 1 1 99 99 VAL HB H 1 2.429 0.020 . 1 . . . . 138 VAL HB . 16683 1 1132 . 1 1 99 99 VAL HG11 H 1 1.159 0.020 . 1 . . . . 138 VAL HG1 . 16683 1 1133 . 1 1 99 99 VAL HG12 H 1 1.159 0.020 . 1 . . . . 138 VAL HG1 . 16683 1 1134 . 1 1 99 99 VAL HG13 H 1 1.159 0.020 . 1 . . . . 138 VAL HG1 . 16683 1 1135 . 1 1 99 99 VAL HG21 H 1 1.098 0.020 . 1 . . . . 138 VAL HG2 . 16683 1 1136 . 1 1 99 99 VAL HG22 H 1 1.098 0.020 . 1 . . . . 138 VAL HG2 . 16683 1 1137 . 1 1 99 99 VAL HG23 H 1 1.098 0.020 . 1 . . . . 138 VAL HG2 . 16683 1 1138 . 1 1 99 99 VAL CA C 13 61.130 0.100 . 1 . . . . 138 VAL CA . 16683 1 1139 . 1 1 99 99 VAL CB C 13 32.542 0.100 . 1 . . . . 138 VAL CB . 16683 1 1140 . 1 1 99 99 VAL CG1 C 13 23.517 0.100 . 1 . . . . 138 VAL CG1 . 16683 1 1141 . 1 1 99 99 VAL CG2 C 13 21.033 0.100 . 1 . . . . 138 VAL CG2 . 16683 1 1142 . 1 1 99 99 VAL N N 15 124.638 0.100 . 1 . . . . 138 VAL N . 16683 1 1143 . 1 1 100 100 PRO HA H 1 4.360 0.020 . 1 . . . . 139 PRO HA . 16683 1 1144 . 1 1 100 100 PRO HB2 H 1 1.685 0.020 . 1 . . . . 139 PRO HB2 . 16683 1 1145 . 1 1 100 100 PRO HB3 H 1 1.861 0.020 . 1 . . . . 139 PRO HB3 . 16683 1 1146 . 1 1 100 100 PRO HD2 H 1 3.548 0.020 . 1 . . . . 139 PRO HD2 . 16683 1 1147 . 1 1 100 100 PRO HD3 H 1 3.558 0.020 . 1 . . . . 139 PRO HD3 . 16683 1 1148 . 1 1 100 100 PRO HG2 H 1 1.874 0.020 . 1 . . . . 139 PRO HG2 . 16683 1 1149 . 1 1 100 100 PRO HG3 H 1 2.130 0.020 . 1 . . . . 139 PRO HG3 . 16683 1 1150 . 1 1 100 100 PRO C C 13 174.530 0.100 . 1 . . . . 139 PRO C . 16683 1 1151 . 1 1 100 100 PRO CA C 13 62.079 0.100 . 1 . . . . 139 PRO CA . 16683 1 1152 . 1 1 100 100 PRO CB C 13 31.862 0.100 . 1 . . . . 139 PRO CB . 16683 1 1153 . 1 1 100 100 PRO CD C 13 51.559 0.100 . 1 . . . . 139 PRO CD . 16683 1 1154 . 1 1 100 100 PRO CG C 13 28.412 0.100 . 1 . . . . 139 PRO CG . 16683 1 1155 . 1 1 101 101 LEU H H 1 8.075 0.020 . 1 . . . . 140 LEU H . 16683 1 1156 . 1 1 101 101 LEU HA H 1 4.878 0.020 . 1 . . . . 140 LEU HA . 16683 1 1157 . 1 1 101 101 LEU HB2 H 1 1.450 0.020 . 1 . . . . 140 LEU HB2 . 16683 1 1158 . 1 1 101 101 LEU HB3 H 1 1.455 0.020 . 1 . . . . 140 LEU HB3 . 16683 1 1159 . 1 1 101 101 LEU HD11 H 1 0.606 0.020 . 1 . . . . 140 LEU HD1 . 16683 1 1160 . 1 1 101 101 LEU HD12 H 1 0.606 0.020 . 1 . . . . 140 LEU HD1 . 16683 1 1161 . 1 1 101 101 LEU HD13 H 1 0.606 0.020 . 1 . . . . 140 LEU HD1 . 16683 1 1162 . 1 1 101 101 LEU HD21 H 1 0.619 0.020 . 1 . . . . 140 LEU HD2 . 16683 1 1163 . 1 1 101 101 LEU HD22 H 1 0.619 0.020 . 1 . . . . 140 LEU HD2 . 16683 1 1164 . 1 1 101 101 LEU HD23 H 1 0.619 0.020 . 1 . . . . 140 LEU HD2 . 16683 1 1165 . 1 1 101 101 LEU HG H 1 0.678 0.020 . 1 . . . . 140 LEU HG . 16683 1 1166 . 1 1 101 101 LEU C C 13 177.520 0.100 . 1 . . . . 140 LEU C . 16683 1 1167 . 1 1 101 101 LEU CA C 13 54.180 0.100 . 1 . . . . 140 LEU CA . 16683 1 1168 . 1 1 101 101 LEU CB C 13 43.575 0.100 . 1 . . . . 140 LEU CB . 16683 1 1169 . 1 1 101 101 LEU CD1 C 13 22.805 0.100 . 1 . . . . 140 LEU CD1 . 16683 1 1170 . 1 1 101 101 LEU CD2 C 13 23.112 0.100 . 1 . . . . 140 LEU CD2 . 16683 1 1171 . 1 1 101 101 LEU CG C 13 26.063 0.100 . 1 . . . . 140 LEU CG . 16683 1 1172 . 1 1 101 101 LEU N N 15 125.347 0.100 . 1 . . . . 140 LEU N . 16683 1 1173 . 1 1 102 102 ASP H H 1 8.963 0.020 . 1 . . . . 141 ASP H . 16683 1 1174 . 1 1 102 102 ASP HA H 1 4.372 0.020 . 1 . . . . 141 ASP HA . 16683 1 1175 . 1 1 102 102 ASP HB2 H 1 2.766 0.020 . 1 . . . . 141 ASP HB2 . 16683 1 1176 . 1 1 102 102 ASP HB3 H 1 2.745 0.020 . 1 . . . . 141 ASP HB3 . 16683 1 1177 . 1 1 102 102 ASP C C 13 176.100 0.100 . 1 . . . . 141 ASP C . 16683 1 1178 . 1 1 102 102 ASP CA C 13 56.777 0.100 . 1 . . . . 141 ASP CA . 16683 1 1179 . 1 1 102 102 ASP CB C 13 39.632 0.100 . 1 . . . . 141 ASP CB . 16683 1 1180 . 1 1 102 102 ASP N N 15 126.100 0.100 . 1 . . . . 141 ASP N . 16683 1 1181 . 1 1 103 103 GLY H H 1 8.959 0.020 . 1 . . . . 142 GLY H . 16683 1 1182 . 1 1 103 103 GLY HA2 H 1 4.224 0.020 . 1 . . . . 142 GLY HA2 . 16683 1 1183 . 1 1 103 103 GLY HA3 H 1 3.613 0.020 . 1 . . . . 142 GLY HA3 . 16683 1 1184 . 1 1 103 103 GLY C C 13 174.240 0.100 . 1 . . . . 142 GLY C . 16683 1 1185 . 1 1 103 103 GLY CA C 13 45.280 0.100 . 1 . . . . 142 GLY CA . 16683 1 1186 . 1 1 103 103 GLY N N 15 101.774 0.100 . 1 . . . . 142 GLY N . 16683 1 1187 . 1 1 104 104 ARG H H 1 7.567 0.020 . 1 . . . . 143 ARG H . 16683 1 1188 . 1 1 104 104 ARG HA H 1 4.968 0.020 . 1 . . . . 143 ARG HA . 16683 1 1189 . 1 1 104 104 ARG HB2 H 1 2.010 0.020 . 1 . . . . 143 ARG HB2 . 16683 1 1190 . 1 1 104 104 ARG HB3 H 1 1.943 0.020 . 1 . . . . 143 ARG HB3 . 16683 1 1191 . 1 1 104 104 ARG HD2 H 1 3.275 0.020 . 1 . . . . 143 ARG HD2 . 16683 1 1192 . 1 1 104 104 ARG HD3 H 1 2.937 0.020 . 1 . . . . 143 ARG HD3 . 16683 1 1193 . 1 1 104 104 ARG HE H 1 6.360 0.020 . 1 . . . . 143 ARG HE . 16683 1 1194 . 1 1 104 104 ARG HG2 H 1 1.628 0.020 . 1 . . . . 143 ARG HG2 . 16683 1 1195 . 1 1 104 104 ARG HG3 H 1 1.499 0.020 . 1 . . . . 143 ARG HG3 . 16683 1 1196 . 1 1 104 104 ARG C C 13 174.860 0.100 . 1 . . . . 143 ARG C . 16683 1 1197 . 1 1 104 104 ARG CA C 13 52.980 0.100 . 1 . . . . 143 ARG CA . 16683 1 1198 . 1 1 104 104 ARG CB C 13 31.932 0.100 . 1 . . . . 143 ARG CB . 16683 1 1199 . 1 1 104 104 ARG CD C 13 43.110 0.100 . 1 . . . . 143 ARG CD . 16683 1 1200 . 1 1 104 104 ARG CG C 13 26.962 0.100 . 1 . . . . 143 ARG CG . 16683 1 1201 . 1 1 104 104 ARG N N 15 120.296 0.100 . 1 . . . . 143 ARG N . 16683 1 1202 . 1 1 104 104 ARG NE N 15 82.725 0.100 . 1 . . . . 143 ARG NE . 16683 1 1203 . 1 1 105 105 PRO HA H 1 3.827 0.020 . 1 . . . . 144 PRO HA . 16683 1 1204 . 1 1 105 105 PRO HB2 H 1 1.904 0.020 . 1 . . . . 144 PRO HB2 . 16683 1 1205 . 1 1 105 105 PRO HB3 H 1 2.078 0.020 . 1 . . . . 144 PRO HB3 . 16683 1 1206 . 1 1 105 105 PRO HD2 H 1 3.935 0.020 . 1 . . . . 144 PRO HD2 . 16683 1 1207 . 1 1 105 105 PRO HD3 H 1 3.728 0.020 . 1 . . . . 144 PRO HD3 . 16683 1 1208 . 1 1 105 105 PRO HG2 H 1 2.192 0.020 . 1 . . . . 144 PRO HG2 . 16683 1 1209 . 1 1 105 105 PRO HG3 H 1 2.195 0.020 . 1 . . . . 144 PRO HG3 . 16683 1 1210 . 1 1 105 105 PRO C C 13 176.560 0.100 . 1 . . . . 144 PRO C . 16683 1 1211 . 1 1 105 105 PRO CA C 13 62.960 0.100 . 1 . . . . 144 PRO CA . 16683 1 1212 . 1 1 105 105 PRO CB C 13 31.502 0.100 . 1 . . . . 144 PRO CB . 16683 1 1213 . 1 1 105 105 PRO CD C 13 51.210 0.100 . 1 . . . . 144 PRO CD . 16683 1 1214 . 1 1 105 105 PRO CG C 13 28.091 0.100 . 1 . . . . 144 PRO CG . 16683 1 1215 . 1 1 106 106 MET H H 1 8.342 0.020 . 1 . . . . 145 MET H . 16683 1 1216 . 1 1 106 106 MET HA H 1 4.295 0.020 . 1 . . . . 145 MET HA . 16683 1 1217 . 1 1 106 106 MET HB2 H 1 1.766 0.020 . 1 . . . . 145 MET HB2 . 16683 1 1218 . 1 1 106 106 MET HB3 H 1 2.524 0.020 . 1 . . . . 145 MET HB3 . 16683 1 1219 . 1 1 106 106 MET HE1 H 1 1.821 0.020 . 1 . . . . 145 MET HE . 16683 1 1220 . 1 1 106 106 MET HE2 H 1 1.821 0.020 . 1 . . . . 145 MET HE . 16683 1 1221 . 1 1 106 106 MET HE3 H 1 1.821 0.020 . 1 . . . . 145 MET HE . 16683 1 1222 . 1 1 106 106 MET HG2 H 1 2.521 0.020 . 1 . . . . 145 MET HG2 . 16683 1 1223 . 1 1 106 106 MET HG3 H 1 2.720 0.020 . 1 . . . . 145 MET HG3 . 16683 1 1224 . 1 1 106 106 MET C C 13 176.250 0.100 . 1 . . . . 145 MET C . 16683 1 1225 . 1 1 106 106 MET CA C 13 58.309 0.100 . 1 . . . . 145 MET CA . 16683 1 1226 . 1 1 106 106 MET CB C 13 35.434 0.100 . 1 . . . . 145 MET CB . 16683 1 1227 . 1 1 106 106 MET CE C 13 17.142 0.100 . 1 . . . . 145 MET CE . 16683 1 1228 . 1 1 106 106 MET CG C 13 32.942 0.100 . 1 . . . . 145 MET CG . 16683 1 1229 . 1 1 106 106 MET N N 15 127.300 0.100 . 1 . . . . 145 MET N . 16683 1 1230 . 1 1 107 107 ASP H H 1 8.085 0.020 . 1 . . . . 146 ASP H . 16683 1 1231 . 1 1 107 107 ASP HA H 1 5.143 0.020 . 1 . . . . 146 ASP HA . 16683 1 1232 . 1 1 107 107 ASP HB2 H 1 2.770 0.020 . 1 . . . . 146 ASP HB2 . 16683 1 1233 . 1 1 107 107 ASP HB3 H 1 2.500 0.020 . 1 . . . . 146 ASP HB3 . 16683 1 1234 . 1 1 107 107 ASP C C 13 175.540 0.100 . 1 . . . . 146 ASP C . 16683 1 1235 . 1 1 107 107 ASP CA C 13 53.100 0.100 . 1 . . . . 146 ASP CA . 16683 1 1236 . 1 1 107 107 ASP CB C 13 41.930 0.100 . 1 . . . . 146 ASP CB . 16683 1 1237 . 1 1 107 107 ASP N N 15 125.621 0.100 . 1 . . . . 146 ASP N . 16683 1 1238 . 1 1 108 108 ILE H H 1 7.649 0.020 . 1 . . . . 147 ILE H . 16683 1 1239 . 1 1 108 108 ILE HA H 1 5.092 0.020 . 1 . . . . 147 ILE HA . 16683 1 1240 . 1 1 108 108 ILE HB H 1 1.556 0.020 . 1 . . . . 147 ILE HB . 16683 1 1241 . 1 1 108 108 ILE HD11 H 1 1.162 0.020 . 1 . . . . 147 ILE HD1 . 16683 1 1242 . 1 1 108 108 ILE HD12 H 1 1.162 0.020 . 1 . . . . 147 ILE HD1 . 16683 1 1243 . 1 1 108 108 ILE HD13 H 1 1.162 0.020 . 1 . . . . 147 ILE HD1 . 16683 1 1244 . 1 1 108 108 ILE HG12 H 1 1.266 0.020 . 1 . . . . 147 ILE HG12 . 16683 1 1245 . 1 1 108 108 ILE HG13 H 1 1.715 0.020 . 1 . . . . 147 ILE HG13 . 16683 1 1246 . 1 1 108 108 ILE HG21 H 1 0.954 0.020 . 1 . . . . 147 ILE HG2 . 16683 1 1247 . 1 1 108 108 ILE HG22 H 1 0.954 0.020 . 1 . . . . 147 ILE HG2 . 16683 1 1248 . 1 1 108 108 ILE HG23 H 1 0.954 0.020 . 1 . . . . 147 ILE HG2 . 16683 1 1249 . 1 1 108 108 ILE C C 13 173.530 0.100 . 1 . . . . 147 ILE C . 16683 1 1250 . 1 1 108 108 ILE CA C 13 60.660 0.100 . 1 . . . . 147 ILE CA . 16683 1 1251 . 1 1 108 108 ILE CB C 13 42.790 0.100 . 1 . . . . 147 ILE CB . 16683 1 1252 . 1 1 108 108 ILE CD1 C 13 14.793 0.100 . 1 . . . . 147 ILE CD1 . 16683 1 1253 . 1 1 108 108 ILE CG1 C 13 28.312 0.100 . 1 . . . . 147 ILE CG1 . 16683 1 1254 . 1 1 108 108 ILE CG2 C 13 19.972 0.100 . 1 . . . . 147 ILE CG2 . 16683 1 1255 . 1 1 108 108 ILE N N 15 121.794 0.100 . 1 . . . . 147 ILE N . 16683 1 1256 . 1 1 109 109 GLN H H 1 8.556 0.020 . 1 . . . . 148 GLN H . 16683 1 1257 . 1 1 109 109 GLN HA H 1 4.763 0.020 . 1 . . . . 148 GLN HA . 16683 1 1258 . 1 1 109 109 GLN HB2 H 1 2.125 0.020 . 1 . . . . 148 GLN HB2 . 16683 1 1259 . 1 1 109 109 GLN HB3 H 1 2.103 0.020 . 1 . . . . 148 GLN HB3 . 16683 1 1260 . 1 1 109 109 GLN HE21 H 1 6.782 0.020 . 1 . . . . 148 GLN HE21 . 16683 1 1261 . 1 1 109 109 GLN HE22 H 1 7.729 0.020 . 1 . . . . 148 GLN HE22 . 16683 1 1262 . 1 1 109 109 GLN HG2 H 1 2.300 0.020 . 1 . . . . 148 GLN HG2 . 16683 1 1263 . 1 1 109 109 GLN HG3 H 1 2.319 0.020 . 1 . . . . 148 GLN HG3 . 16683 1 1264 . 1 1 109 109 GLN C C 13 173.760 0.100 . 1 . . . . 148 GLN C . 16683 1 1265 . 1 1 109 109 GLN CA C 13 53.880 0.100 . 1 . . . . 148 GLN CA . 16683 1 1266 . 1 1 109 109 GLN CB C 13 32.812 0.100 . 1 . . . . 148 GLN CB . 16683 1 1267 . 1 1 109 109 GLN CG C 13 33.442 0.100 . 1 . . . . 148 GLN CG . 16683 1 1268 . 1 1 109 109 GLN N N 15 124.149 0.100 . 1 . . . . 148 GLN N . 16683 1 1269 . 1 1 109 109 GLN NE2 N 15 112.612 0.100 . 1 . . . . 148 GLN NE2 . 16683 1 1270 . 1 1 110 110 LEU H H 1 8.669 0.020 . 1 . . . . 149 LEU H . 16683 1 1271 . 1 1 110 110 LEU HA H 1 4.790 0.020 . 1 . . . . 149 LEU HA . 16683 1 1272 . 1 1 110 110 LEU HB2 H 1 1.711 0.020 . 1 . . . . 149 LEU HB2 . 16683 1 1273 . 1 1 110 110 LEU HB3 H 1 1.420 0.020 . 1 . . . . 149 LEU HB3 . 16683 1 1274 . 1 1 110 110 LEU HD11 H 1 0.830 0.020 . 1 . . . . 149 LEU HD1 . 16683 1 1275 . 1 1 110 110 LEU HD12 H 1 0.830 0.020 . 1 . . . . 149 LEU HD1 . 16683 1 1276 . 1 1 110 110 LEU HD13 H 1 0.830 0.020 . 1 . . . . 149 LEU HD1 . 16683 1 1277 . 1 1 110 110 LEU HD21 H 1 0.867 0.020 . 1 . . . . 149 LEU HD2 . 16683 1 1278 . 1 1 110 110 LEU HD22 H 1 0.867 0.020 . 1 . . . . 149 LEU HD2 . 16683 1 1279 . 1 1 110 110 LEU HD23 H 1 0.867 0.020 . 1 . . . . 149 LEU HD2 . 16683 1 1280 . 1 1 110 110 LEU HG H 1 0.816 0.020 . 1 . . . . 149 LEU HG . 16683 1 1281 . 1 1 110 110 LEU C C 13 176.670 0.100 . 1 . . . . 149 LEU C . 16683 1 1282 . 1 1 110 110 LEU CA C 13 54.976 0.100 . 1 . . . . 149 LEU CA . 16683 1 1283 . 1 1 110 110 LEU CB C 13 43.120 0.100 . 1 . . . . 149 LEU CB . 16683 1 1284 . 1 1 110 110 LEU CD1 C 13 24.844 0.100 . 1 . . . . 149 LEU CD1 . 16683 1 1285 . 1 1 110 110 LEU CD2 C 13 24.860 0.100 . 1 . . . . 149 LEU CD2 . 16683 1 1286 . 1 1 110 110 LEU CG C 13 25.271 0.100 . 1 . . . . 149 LEU CG . 16683 1 1287 . 1 1 110 110 LEU N N 15 125.834 0.100 . 1 . . . . 149 LEU N . 16683 1 1288 . 1 1 111 111 VAL H H 1 8.667 0.020 . 1 . . . . 150 VAL H . 16683 1 1289 . 1 1 111 111 VAL HA H 1 4.123 0.020 . 1 . . . . 150 VAL HA . 16683 1 1290 . 1 1 111 111 VAL HB H 1 1.968 0.020 . 1 . . . . 150 VAL HB . 16683 1 1291 . 1 1 111 111 VAL HG11 H 1 0.855 0.020 . 1 . . . . 150 VAL HG1 . 16683 1 1292 . 1 1 111 111 VAL HG12 H 1 0.855 0.020 . 1 . . . . 150 VAL HG1 . 16683 1 1293 . 1 1 111 111 VAL HG13 H 1 0.855 0.020 . 1 . . . . 150 VAL HG1 . 16683 1 1294 . 1 1 111 111 VAL HG21 H 1 0.876 0.020 . 1 . . . . 150 VAL HG2 . 16683 1 1295 . 1 1 111 111 VAL HG22 H 1 0.876 0.020 . 1 . . . . 150 VAL HG2 . 16683 1 1296 . 1 1 111 111 VAL HG23 H 1 0.876 0.020 . 1 . . . . 150 VAL HG2 . 16683 1 1297 . 1 1 111 111 VAL C C 13 175.190 0.100 . 1 . . . . 150 VAL C . 16683 1 1298 . 1 1 111 111 VAL CA C 13 62.305 0.100 . 1 . . . . 150 VAL CA . 16683 1 1299 . 1 1 111 111 VAL CB C 13 32.793 0.100 . 1 . . . . 150 VAL CB . 16683 1 1300 . 1 1 111 111 VAL CG1 C 13 21.132 0.100 . 1 . . . . 150 VAL CG1 . 16683 1 1301 . 1 1 111 111 VAL CG2 C 13 21.132 0.100 . 1 . . . . 150 VAL CG2 . 16683 1 1302 . 1 1 111 111 VAL N N 15 126.906 0.100 . 1 . . . . 150 VAL N . 16683 1 1303 . 1 1 112 112 ALA H H 1 8.527 0.020 . 1 . . . . 151 ALA H . 16683 1 1304 . 1 1 112 112 ALA HA H 1 4.450 0.020 . 1 . . . . 151 ALA HA . 16683 1 1305 . 1 1 112 112 ALA HB1 H 1 1.422 0.020 . 1 . . . . 151 ALA HB . 16683 1 1306 . 1 1 112 112 ALA HB2 H 1 1.422 0.020 . 1 . . . . 151 ALA HB . 16683 1 1307 . 1 1 112 112 ALA HB3 H 1 1.422 0.020 . 1 . . . . 151 ALA HB . 16683 1 1308 . 1 1 112 112 ALA C C 13 177.190 0.100 . 1 . . . . 151 ALA C . 16683 1 1309 . 1 1 112 112 ALA CA C 13 52.059 0.100 . 1 . . . . 151 ALA CA . 16683 1 1310 . 1 1 112 112 ALA CB C 13 19.572 0.100 . 1 . . . . 151 ALA CB . 16683 1 1311 . 1 1 112 112 ALA N N 15 128.986 0.100 . 1 . . . . 151 ALA N . 16683 1 1312 . 1 1 113 113 SER H H 1 8.396 0.020 . 1 . . . . 152 SER H . 16683 1 1313 . 1 1 113 113 SER HA H 1 4.446 0.020 . 1 . . . . 152 SER HA . 16683 1 1314 . 1 1 113 113 SER HB2 H 1 3.884 0.020 . 1 . . . . 152 SER HB2 . 16683 1 1315 . 1 1 113 113 SER HB3 H 1 3.859 0.020 . 1 . . . . 152 SER HB3 . 16683 1 1316 . 1 1 113 113 SER C C 13 174.340 0.100 . 1 . . . . 152 SER C . 16683 1 1317 . 1 1 113 113 SER CA C 13 58.400 0.100 . 1 . . . . 152 SER CA . 16683 1 1318 . 1 1 113 113 SER CB C 13 64.080 0.100 . 1 . . . . 152 SER CB . 16683 1 1319 . 1 1 113 113 SER N N 15 115.698 0.100 . 1 . . . . 152 SER N . 16683 1 1320 . 1 1 114 114 GLN H H 1 8.537 0.020 . 1 . . . . 153 GLN H . 16683 1 1321 . 1 1 114 114 GLN HA H 1 4.374 0.020 . 1 . . . . 153 GLN HA . 16683 1 1322 . 1 1 114 114 GLN HB2 H 1 2.019 0.020 . 1 . . . . 153 GLN HB2 . 16683 1 1323 . 1 1 114 114 GLN HB3 H 1 2.121 0.020 . 1 . . . . 153 GLN HB3 . 16683 1 1324 . 1 1 114 114 GLN HE21 H 1 6.867 0.020 . 1 . . . . 153 GLN HE21 . 16683 1 1325 . 1 1 114 114 GLN HE22 H 1 7.619 0.020 . 1 . . . . 153 GLN HE22 . 16683 1 1326 . 1 1 114 114 GLN HG2 H 1 2.369 0.020 . 1 . . . . 153 GLN HG2 . 16683 1 1327 . 1 1 114 114 GLN HG3 H 1 2.364 0.020 . 1 . . . . 153 GLN HG3 . 16683 1 1328 . 1 1 114 114 GLN C C 13 175.950 0.100 . 1 . . . . 153 GLN C . 16683 1 1329 . 1 1 114 114 GLN CA C 13 56.290 0.100 . 1 . . . . 153 GLN CA . 16683 1 1330 . 1 1 114 114 GLN CB C 13 29.352 0.100 . 1 . . . . 153 GLN CB . 16683 1 1331 . 1 1 114 114 GLN CG C 13 33.762 0.100 . 1 . . . . 153 GLN CG . 16683 1 1332 . 1 1 114 114 GLN N N 15 122.175 0.100 . 1 . . . . 153 GLN N . 16683 1 1333 . 1 1 114 114 GLN NE2 N 15 112.400 0.100 . 1 . . . . 153 GLN NE2 . 16683 1 1334 . 1 1 115 115 ILE H H 1 8.119 0.020 . 1 . . . . 154 ILE H . 16683 1 1335 . 1 1 115 115 ILE HA H 1 4.138 0.020 . 1 . . . . 154 ILE HA . 16683 1 1336 . 1 1 115 115 ILE HB H 1 1.834 0.020 . 1 . . . . 154 ILE HB . 16683 1 1337 . 1 1 115 115 ILE HD11 H 1 0.853 0.020 . 1 . . . . 154 ILE HD1 . 16683 1 1338 . 1 1 115 115 ILE HD12 H 1 0.853 0.020 . 1 . . . . 154 ILE HD1 . 16683 1 1339 . 1 1 115 115 ILE HD13 H 1 0.853 0.020 . 1 . . . . 154 ILE HD1 . 16683 1 1340 . 1 1 115 115 ILE HG12 H 1 1.441 0.020 . 1 . . . . 154 ILE HG12 . 16683 1 1341 . 1 1 115 115 ILE HG13 H 1 1.168 0.020 . 1 . . . . 154 ILE HG13 . 16683 1 1342 . 1 1 115 115 ILE HG21 H 1 0.880 0.020 . 1 . . . . 154 ILE HG2 . 16683 1 1343 . 1 1 115 115 ILE HG22 H 1 0.880 0.020 . 1 . . . . 154 ILE HG2 . 16683 1 1344 . 1 1 115 115 ILE HG23 H 1 0.880 0.020 . 1 . . . . 154 ILE HG2 . 16683 1 1345 . 1 1 115 115 ILE C C 13 175.700 0.100 . 1 . . . . 154 ILE C . 16683 1 1346 . 1 1 115 115 ILE CA C 13 61.600 0.100 . 1 . . . . 154 ILE CA . 16683 1 1347 . 1 1 115 115 ILE CB C 13 38.824 0.100 . 1 . . . . 154 ILE CB . 16683 1 1348 . 1 1 115 115 ILE CD1 C 13 13.011 0.100 . 1 . . . . 154 ILE CD1 . 16683 1 1349 . 1 1 115 115 ILE CG1 C 13 27.464 0.100 . 1 . . . . 154 ILE CG1 . 16683 1 1350 . 1 1 115 115 ILE CG2 C 13 17.382 0.100 . 1 . . . . 154 ILE CG2 . 16683 1 1351 . 1 1 115 115 ILE N N 15 121.003 0.100 . 1 . . . . 154 ILE N . 16683 1 1352 . 1 1 116 116 ASP H H 1 8.312 0.020 . 1 . . . . 155 ASP H . 16683 1 1353 . 1 1 116 116 ASP HA H 1 4.649 0.020 . 1 . . . . 155 ASP HA . 16683 1 1354 . 1 1 116 116 ASP HB2 H 1 2.655 0.020 . 1 . . . . 155 ASP HB2 . 16683 1 1355 . 1 1 116 116 ASP HB3 H 1 2.786 0.020 . 1 . . . . 155 ASP HB3 . 16683 1 1356 . 1 1 116 116 ASP C C 13 176.350 0.100 . 1 . . . . 155 ASP C . 16683 1 1357 . 1 1 116 116 ASP CA C 13 54.380 0.100 . 1 . . . . 155 ASP CA . 16683 1 1358 . 1 1 116 116 ASP CB C 13 41.126 0.100 . 1 . . . . 155 ASP CB . 16683 1 1359 . 1 1 116 116 ASP N N 15 123.691 0.100 . 1 . . . . 155 ASP N . 16683 1 1360 . 1 1 117 117 LEU H H 1 8.198 0.020 . 1 . . . . 156 LEU H . 16683 1 1361 . 1 1 117 117 LEU HA H 1 4.237 0.020 . 1 . . . . 156 LEU HA . 16683 1 1362 . 1 1 117 117 LEU HB2 H 1 1.649 0.020 . 1 . . . . 156 LEU HB2 . 16683 1 1363 . 1 1 117 117 LEU HB3 H 1 1.576 0.020 . 1 . . . . 156 LEU HB3 . 16683 1 1364 . 1 1 117 117 LEU HD11 H 1 0.911 0.020 . 1 . . . . 156 LEU HD1 . 16683 1 1365 . 1 1 117 117 LEU HD12 H 1 0.911 0.020 . 1 . . . . 156 LEU HD1 . 16683 1 1366 . 1 1 117 117 LEU HD13 H 1 0.911 0.020 . 1 . . . . 156 LEU HD1 . 16683 1 1367 . 1 1 117 117 LEU HD21 H 1 0.832 0.020 . 1 . . . . 156 LEU HD2 . 16683 1 1368 . 1 1 117 117 LEU HD22 H 1 0.832 0.020 . 1 . . . . 156 LEU HD2 . 16683 1 1369 . 1 1 117 117 LEU HD23 H 1 0.832 0.020 . 1 . . . . 156 LEU HD2 . 16683 1 1370 . 1 1 117 117 LEU HG H 1 1.627 0.020 . 1 . . . . 156 LEU HG . 16683 1 1371 . 1 1 117 117 LEU C C 13 177.720 0.100 . 1 . . . . 156 LEU C . 16683 1 1372 . 1 1 117 117 LEU CA C 13 55.830 0.100 . 1 . . . . 156 LEU CA . 16683 1 1373 . 1 1 117 117 LEU CB C 13 42.313 0.100 . 1 . . . . 156 LEU CB . 16683 1 1374 . 1 1 117 117 LEU CD1 C 13 24.966 0.100 . 1 . . . . 156 LEU CD1 . 16683 1 1375 . 1 1 117 117 LEU CD2 C 13 23.297 0.100 . 1 . . . . 156 LEU CD2 . 16683 1 1376 . 1 1 117 117 LEU CG C 13 26.812 0.100 . 1 . . . . 156 LEU CG . 16683 1 1377 . 1 1 117 117 LEU N N 15 122.685 0.100 . 1 . . . . 156 LEU N . 16683 1 1378 . 1 1 118 118 GLU H H 1 8.232 0.020 . 1 . . . . 157 GLU H . 16683 1 1379 . 1 1 118 118 GLU HA H 1 4.161 0.020 . 1 . . . . 157 GLU HA . 16683 1 1380 . 1 1 118 118 GLU HB2 H 1 1.908 0.020 . 1 . . . . 157 GLU HB2 . 16683 1 1381 . 1 1 118 118 GLU HB3 H 1 1.908 0.020 . 1 . . . . 157 GLU HB3 . 16683 1 1382 . 1 1 118 118 GLU HG2 H 1 2.149 0.020 . 1 . . . . 157 GLU HG2 . 16683 1 1383 . 1 1 118 118 GLU HG3 H 1 2.231 0.020 . 1 . . . . 157 GLU HG3 . 16683 1 1384 . 1 1 118 118 GLU C C 13 176.470 0.100 . 1 . . . . 157 GLU C . 16683 1 1385 . 1 1 118 118 GLU CA C 13 56.960 0.100 . 1 . . . . 157 GLU CA . 16683 1 1386 . 1 1 118 118 GLU CB C 13 30.002 0.100 . 1 . . . . 157 GLU CB . 16683 1 1387 . 1 1 118 118 GLU CG C 13 36.182 0.100 . 1 . . . . 157 GLU CG . 16683 1 1388 . 1 1 118 118 GLU N N 15 119.605 0.100 . 1 . . . . 157 GLU N . 16683 1 1389 . 1 1 119 119 HIS H H 1 8.168 0.020 . 1 . . . . 158 HIS H . 16683 1 1390 . 1 1 119 119 HIS HA H 1 4.582 0.020 . 1 . . . . 158 HIS HA . 16683 1 1391 . 1 1 119 119 HIS HB2 H 1 3.059 0.020 . 1 . . . . 158 HIS HB2 . 16683 1 1392 . 1 1 119 119 HIS HB3 H 1 3.137 0.020 . 1 . . . . 158 HIS HB3 . 16683 1 1393 . 1 1 119 119 HIS C C 13 174.680 0.100 . 1 . . . . 158 HIS C . 16683 1 1394 . 1 1 119 119 HIS CA C 13 55.970 0.100 . 1 . . . . 158 HIS CA . 16683 1 1395 . 1 1 119 119 HIS CB C 13 29.562 0.100 . 1 . . . . 158 HIS CB . 16683 1 1396 . 1 1 119 119 HIS N N 15 118.280 0.100 . 1 . . . . 158 HIS N . 16683 1 1397 . 1 1 120 120 HIS HA H 1 4.648 0.020 . 1 . . . . 159 HIS HA . 16683 1 1398 . 1 1 120 120 HIS HB2 H 1 3.130 0.020 . 1 . . . . 159 HIS HB2 . 16683 1 1399 . 1 1 120 120 HIS HB3 H 1 3.205 0.020 . 1 . . . . 159 HIS HB3 . 16683 1 1400 . 1 1 120 120 HIS C C 13 173.820 0.100 . 1 . . . . 159 HIS C . 16683 1 1401 . 1 1 120 120 HIS CA C 13 55.971 0.100 . 1 . . . . 159 HIS CA . 16683 1 1402 . 1 1 120 120 HIS CB C 13 29.839 0.100 . 1 . . . . 159 HIS CB . 16683 1 1403 . 1 1 121 121 HIS H H 1 8.233 0.020 . 1 . . . . 160 HIS H . 16683 1 1404 . 1 1 121 121 HIS HA H 1 4.469 0.020 . 1 . . . . 160 HIS HA . 16683 1 1405 . 1 1 121 121 HIS HB2 H 1 3.114 0.020 . 1 . . . . 160 HIS HB2 . 16683 1 1406 . 1 1 121 121 HIS HB3 H 1 3.251 0.020 . 1 . . . . 160 HIS HB3 . 16683 1 1407 . 1 1 121 121 HIS C C 13 179.040 0.100 . 1 . . . . 160 HIS C . 16683 1 1408 . 1 1 121 121 HIS CA C 13 57.318 0.100 . 1 . . . . 160 HIS CA . 16683 1 1409 . 1 1 121 121 HIS CB C 13 30.130 0.100 . 1 . . . . 160 HIS CB . 16683 1 1410 . 1 1 121 121 HIS N N 15 125.240 0.100 . 1 . . . . 160 HIS N . 16683 1 1411 . 2 2 2 2 PRO HA H 1 4.498 0.020 . 1 . . . . 100 PRO HA . 16683 1 1412 . 2 2 2 2 PRO HB2 H 1 2.354 0.020 . 1 . . . . 100 PRO HB2 . 16683 1 1413 . 2 2 2 2 PRO HB3 H 1 1.980 0.020 . 1 . . . . 100 PRO HB3 . 16683 1 1414 . 2 2 2 2 PRO HD2 H 1 3.848 0.020 . 1 . . . . 100 PRO HD2 . 16683 1 1415 . 2 2 2 2 PRO HD3 H 1 3.653 0.020 . 1 . . . . 100 PRO HD3 . 16683 1 1416 . 2 2 2 2 PRO HG2 H 1 2.061 0.020 . 1 . . . . 100 PRO HG2 . 16683 1 1417 . 2 2 2 2 PRO HG3 H 1 2.067 0.020 . 1 . . . . 100 PRO HG3 . 16683 1 1418 . 2 2 2 2 PRO CA C 13 63.436 0.100 . 1 . . . . 100 PRO CA . 16683 1 1419 . 2 2 2 2 PRO CB C 13 32.204 0.100 . 1 . . . . 100 PRO CB . 16683 1 1420 . 2 2 2 2 PRO CD C 13 50.540 0.100 . 1 . . . . 100 PRO CD . 16683 1 1421 . 2 2 2 2 PRO CG C 13 27.130 0.100 . 1 . . . . 100 PRO CG . 16683 1 1422 . 2 2 3 3 LEU H H 1 8.540 0.020 . 1 . . . . 101 LEU H . 16683 1 1423 . 2 2 3 3 LEU HA H 1 4.392 0.020 . 1 . . . . 101 LEU HA . 16683 1 1424 . 2 2 3 3 LEU HB2 H 1 1.689 0.020 . 1 . . . . 101 LEU HB2 . 16683 1 1425 . 2 2 3 3 LEU HB3 H 1 1.550 0.020 . 1 . . . . 101 LEU HB3 . 16683 1 1426 . 2 2 3 3 LEU HD11 H 1 0.914 0.020 . 1 . . . . 101 LEU HD1 . 16683 1 1427 . 2 2 3 3 LEU HD12 H 1 0.914 0.020 . 1 . . . . 101 LEU HD1 . 16683 1 1428 . 2 2 3 3 LEU HD13 H 1 0.914 0.020 . 1 . . . . 101 LEU HD1 . 16683 1 1429 . 2 2 3 3 LEU HD21 H 1 0.898 0.020 . 1 . . . . 101 LEU HD2 . 16683 1 1430 . 2 2 3 3 LEU HD22 H 1 0.898 0.020 . 1 . . . . 101 LEU HD2 . 16683 1 1431 . 2 2 3 3 LEU HD23 H 1 0.898 0.020 . 1 . . . . 101 LEU HD2 . 16683 1 1432 . 2 2 3 3 LEU HG H 1 1.631 0.020 . 1 . . . . 101 LEU HG . 16683 1 1433 . 2 2 3 3 LEU CA C 13 55.420 0.100 . 1 . . . . 101 LEU CA . 16683 1 1434 . 2 2 3 3 LEU CB C 13 42.387 0.100 . 1 . . . . 101 LEU CB . 16683 1 1435 . 2 2 3 3 LEU CD1 C 13 24.711 0.100 . 1 . . . . 101 LEU CD1 . 16683 1 1436 . 2 2 3 3 LEU CD2 C 13 22.976 0.100 . 1 . . . . 101 LEU CD2 . 16683 1 1437 . 2 2 3 3 LEU CG C 13 26.960 0.100 . 1 . . . . 101 LEU CG . 16683 1 1438 . 2 2 3 3 LEU N N 15 121.519 0.100 . 1 . . . . 101 LEU N . 16683 1 1439 . 2 2 4 4 GLY H H 1 8.426 0.020 . 1 . . . . 102 GLY H . 16683 1 1440 . 2 2 4 4 GLY HA2 H 1 4.124 0.020 . 1 . . . . 102 GLY HA2 . 16683 1 1441 . 2 2 4 4 GLY HA3 H 1 4.022 0.020 . 1 . . . . 102 GLY HA3 . 16683 1 1442 . 2 2 4 4 GLY CA C 13 44.360 0.100 . 1 . . . . 102 GLY CA . 16683 1 1443 . 2 2 4 4 GLY N N 15 108.878 0.100 . 1 . . . . 102 GLY N . 16683 1 1444 . 2 2 5 5 SER H H 1 8.493 0.020 . 1 . . . . 103 SER H . 16683 1 1445 . 2 2 5 5 SER HA H 1 4.497 0.020 . 1 . . . . 103 SER HA . 16683 1 1446 . 2 2 5 5 SER HB2 H 1 4.206 0.020 . 1 . . . . 103 SER HB2 . 16683 1 1447 . 2 2 5 5 SER HB3 H 1 3.991 0.020 . 1 . . . . 103 SER HB3 . 16683 1 1448 . 2 2 5 5 SER CA C 13 58.166 0.100 . 1 . . . . 103 SER CA . 16683 1 1449 . 2 2 5 5 SER CB C 13 64.448 0.100 . 1 . . . . 103 SER CB . 16683 1 1450 . 2 2 5 5 SER N N 15 115.841 0.100 . 1 . . . . 103 SER N . 16683 1 1451 . 2 2 6 6 VAL H H 1 9.118 0.020 . 1 . . . . 104 VAL H . 16683 1 1452 . 2 2 6 6 VAL HA H 1 3.636 0.020 . 1 . . . . 104 VAL HA . 16683 1 1453 . 2 2 6 6 VAL HB H 1 1.898 0.020 . 1 . . . . 104 VAL HB . 16683 1 1454 . 2 2 6 6 VAL HG11 H 1 0.435 0.020 . 1 . . . . 104 VAL HG1 . 16683 1 1455 . 2 2 6 6 VAL HG12 H 1 0.435 0.020 . 1 . . . . 104 VAL HG1 . 16683 1 1456 . 2 2 6 6 VAL HG13 H 1 0.435 0.020 . 1 . . . . 104 VAL HG1 . 16683 1 1457 . 2 2 6 6 VAL HG21 H 1 0.065 0.020 . 1 . . . . 104 VAL HG2 . 16683 1 1458 . 2 2 6 6 VAL HG22 H 1 0.065 0.020 . 1 . . . . 104 VAL HG2 . 16683 1 1459 . 2 2 6 6 VAL HG23 H 1 0.065 0.020 . 1 . . . . 104 VAL HG2 . 16683 1 1460 . 2 2 6 6 VAL CA C 13 65.145 0.100 . 1 . . . . 104 VAL CA . 16683 1 1461 . 2 2 6 6 VAL CB C 13 30.814 0.100 . 1 . . . . 104 VAL CB . 16683 1 1462 . 2 2 6 6 VAL CG1 C 13 21.197 0.100 . 1 . . . . 104 VAL CG1 . 16683 1 1463 . 2 2 6 6 VAL CG2 C 13 18.122 0.100 . 1 . . . . 104 VAL CG2 . 16683 1 1464 . 2 2 6 6 VAL N N 15 125.713 0.100 . 1 . . . . 104 VAL N . 16683 1 1465 . 2 2 7 7 TRP H H 1 6.574 0.020 . 1 . . . . 105 TRP H . 16683 1 1466 . 2 2 7 7 TRP HA H 1 4.409 0.020 . 1 . . . . 105 TRP HA . 16683 1 1467 . 2 2 7 7 TRP HB2 H 1 3.009 0.020 . 1 . . . . 105 TRP HB2 . 16683 1 1468 . 2 2 7 7 TRP HB3 H 1 3.235 0.020 . 1 . . . . 105 TRP HB3 . 16683 1 1469 . 2 2 7 7 TRP HD1 H 1 7.320 0.020 . 1 . . . . 105 TRP HD1 . 16683 1 1470 . 2 2 7 7 TRP HE1 H 1 10.599 0.020 . 1 . . . . 105 TRP HE1 . 16683 1 1471 . 2 2 7 7 TRP HE3 H 1 7.837 0.020 . 1 . . . . 105 TRP HE3 . 16683 1 1472 . 2 2 7 7 TRP HH2 H 1 7.269 0.020 . 1 . . . . 105 TRP HH2 . 16683 1 1473 . 2 2 7 7 TRP HZ2 H 1 7.476 0.020 . 1 . . . . 105 TRP HZ2 . 16683 1 1474 . 2 2 7 7 TRP HZ3 H 1 7.624 0.020 . 1 . . . . 105 TRP HZ3 . 16683 1 1475 . 2 2 7 7 TRP CA C 13 56.280 0.100 . 1 . . . . 105 TRP CA . 16683 1 1476 . 2 2 7 7 TRP CB C 13 29.974 0.100 . 1 . . . . 105 TRP CB . 16683 1 1477 . 2 2 7 7 TRP CD1 C 13 127.474 0.100 . 1 . . . . 105 TRP CD1 . 16683 1 1478 . 2 2 7 7 TRP CE3 C 13 117.660 0.100 . 1 . . . . 105 TRP CE3 . 16683 1 1479 . 2 2 7 7 TRP CH2 C 13 122.765 0.100 . 1 . . . . 105 TRP CH2 . 16683 1 1480 . 2 2 7 7 TRP CZ2 C 13 114.730 0.100 . 1 . . . . 105 TRP CZ2 . 16683 1 1481 . 2 2 7 7 TRP CZ3 C 13 121.033 0.100 . 1 . . . . 105 TRP CZ3 . 16683 1 1482 . 2 2 7 7 TRP N N 15 118.969 0.100 . 1 . . . . 105 TRP N . 16683 1 1483 . 2 2 7 7 TRP NE1 N 15 130.492 0.100 . 1 . . . . 105 TRP NE1 . 16683 1 1484 . 2 2 8 8 SER H H 1 7.851 0.020 . 1 . . . . 106 SER H . 16683 1 1485 . 2 2 8 8 SER HA H 1 4.543 0.020 . 1 . . . . 106 SER HA . 16683 1 1486 . 2 2 8 8 SER HB2 H 1 4.058 0.020 . 1 . . . . 106 SER HB2 . 16683 1 1487 . 2 2 8 8 SER HB3 H 1 4.116 0.020 . 1 . . . . 106 SER HB3 . 16683 1 1488 . 2 2 8 8 SER CA C 13 59.010 0.100 . 1 . . . . 106 SER CA . 16683 1 1489 . 2 2 8 8 SER CB C 13 63.680 0.100 . 1 . . . . 106 SER CB . 16683 1 1490 . 2 2 8 8 SER N N 15 113.699 0.100 . 1 . . . . 106 SER N . 16683 1 1491 . 2 2 9 9 ARG H H 1 7.460 0.020 . 1 . . . . 107 ARG H . 16683 1 1492 . 2 2 9 9 ARG HA H 1 4.339 0.020 . 1 . . . . 107 ARG HA . 16683 1 1493 . 2 2 9 9 ARG HB2 H 1 1.961 0.020 . 1 . . . . 107 ARG HB2 . 16683 1 1494 . 2 2 9 9 ARG HB3 H 1 1.708 0.020 . 1 . . . . 107 ARG HB3 . 16683 1 1495 . 2 2 9 9 ARG HD2 H 1 3.028 0.020 . 1 . . . . 107 ARG HD2 . 16683 1 1496 . 2 2 9 9 ARG HD3 H 1 3.192 0.020 . 1 . . . . 107 ARG HD3 . 16683 1 1497 . 2 2 9 9 ARG HG2 H 1 1.708 0.020 . 1 . . . . 107 ARG HG2 . 16683 1 1498 . 2 2 9 9 ARG HG3 H 1 1.446 0.020 . 1 . . . . 107 ARG HG3 . 16683 1 1499 . 2 2 9 9 ARG CA C 13 56.110 0.100 . 1 . . . . 107 ARG CA . 16683 1 1500 . 2 2 9 9 ARG CB C 13 31.060 0.100 . 1 . . . . 107 ARG CB . 16683 1 1501 . 2 2 9 9 ARG CD C 13 43.240 0.100 . 1 . . . . 107 ARG CD . 16683 1 1502 . 2 2 9 9 ARG CG C 13 26.130 0.100 . 1 . . . . 107 ARG CG . 16683 1 1503 . 2 2 9 9 ARG N N 15 121.499 0.100 . 1 . . . . 107 ARG N . 16683 1 1504 . 2 2 10 10 LEU H H 1 7.212 0.020 . 1 . . . . 108 LEU H . 16683 1 1505 . 2 2 10 10 LEU HA H 1 5.090 0.020 . 1 . . . . 108 LEU HA . 16683 1 1506 . 2 2 10 10 LEU HB2 H 1 1.921 0.020 . 1 . . . . 108 LEU HB2 . 16683 1 1507 . 2 2 10 10 LEU HB3 H 1 1.638 0.020 . 1 . . . . 108 LEU HB3 . 16683 1 1508 . 2 2 10 10 LEU HD11 H 1 0.989 0.020 . 1 . . . . 108 LEU HD1 . 16683 1 1509 . 2 2 10 10 LEU HD12 H 1 0.989 0.020 . 1 . . . . 108 LEU HD1 . 16683 1 1510 . 2 2 10 10 LEU HD13 H 1 0.989 0.020 . 1 . . . . 108 LEU HD1 . 16683 1 1511 . 2 2 10 10 LEU HD21 H 1 0.948 0.020 . 1 . . . . 108 LEU HD2 . 16683 1 1512 . 2 2 10 10 LEU HD22 H 1 0.948 0.020 . 1 . . . . 108 LEU HD2 . 16683 1 1513 . 2 2 10 10 LEU HD23 H 1 0.948 0.020 . 1 . . . . 108 LEU HD2 . 16683 1 1514 . 2 2 10 10 LEU HG H 1 1.794 0.020 . 1 . . . . 108 LEU HG . 16683 1 1515 . 2 2 10 10 LEU CA C 13 53.860 0.100 . 1 . . . . 108 LEU CA . 16683 1 1516 . 2 2 10 10 LEU CB C 13 44.590 0.100 . 1 . . . . 108 LEU CB . 16683 1 1517 . 2 2 10 10 LEU CD1 C 13 25.308 0.100 . 1 . . . . 108 LEU CD1 . 16683 1 1518 . 2 2 10 10 LEU CD2 C 13 25.339 0.100 . 1 . . . . 108 LEU CD2 . 16683 1 1519 . 2 2 10 10 LEU N N 15 124.434 0.100 . 1 . . . . 108 LEU N . 16683 1 1520 . 2 2 11 11 GLY H H 1 9.041 0.020 . 1 . . . . 109 GLY H . 16683 1 1521 . 2 2 11 11 GLY HA2 H 1 3.716 0.020 . 1 . . . . 109 GLY HA2 . 16683 1 1522 . 2 2 11 11 GLY HA3 H 1 4.029 0.020 . 1 . . . . 109 GLY HA3 . 16683 1 1523 . 2 2 11 11 GLY CA C 13 45.111 0.100 . 1 . . . . 109 GLY CA . 16683 1 1524 . 2 2 11 11 GLY N N 15 112.901 0.100 . 1 . . . . 109 GLY N . 16683 1 1525 . 2 2 12 12 ALA H H 1 8.123 0.020 . 1 . . . . 110 ALA H . 16683 1 1526 . 2 2 12 12 ALA HA H 1 4.506 0.020 . 1 . . . . 110 ALA HA . 16683 1 1527 . 2 2 12 12 ALA HB1 H 1 1.455 0.020 . 1 . . . . 110 ALA HB . 16683 1 1528 . 2 2 12 12 ALA HB2 H 1 1.455 0.020 . 1 . . . . 110 ALA HB . 16683 1 1529 . 2 2 12 12 ALA HB3 H 1 1.455 0.020 . 1 . . . . 110 ALA HB . 16683 1 1530 . 2 2 12 12 ALA CA C 13 51.650 0.100 . 1 . . . . 110 ALA CA . 16683 1 1531 . 2 2 12 12 ALA CB C 13 20.605 0.100 . 1 . . . . 110 ALA CB . 16683 1 1532 . 2 2 12 12 ALA N N 15 122.281 0.100 . 1 . . . . 110 ALA N . 16683 1 1533 . 2 2 13 13 ARG H H 1 8.473 0.020 . 1 . . . . 111 ARG H . 16683 1 1534 . 2 2 13 13 ARG HA H 1 4.310 0.020 . 1 . . . . 111 ARG HA . 16683 1 1535 . 2 2 13 13 ARG HB2 H 1 1.709 0.020 . 1 . . . . 111 ARG HB2 . 16683 1 1536 . 2 2 13 13 ARG HB3 H 1 1.787 0.020 . 1 . . . . 111 ARG HB3 . 16683 1 1537 . 2 2 13 13 ARG HD2 H 1 3.244 0.020 . 1 . . . . 111 ARG HD2 . 16683 1 1538 . 2 2 13 13 ARG HD3 H 1 3.245 0.020 . 1 . . . . 111 ARG HD3 . 16683 1 1539 . 2 2 13 13 ARG HG2 H 1 1.576 0.020 . 1 . . . . 111 ARG HG2 . 16683 1 1540 . 2 2 13 13 ARG HG3 H 1 1.576 0.020 . 1 . . . . 111 ARG HG3 . 16683 1 1541 . 2 2 13 13 ARG CA C 13 55.975 0.100 . 1 . . . . 111 ARG CA . 16683 1 1542 . 2 2 13 13 ARG CB C 13 29.786 0.100 . 1 . . . . 111 ARG CB . 16683 1 1543 . 2 2 13 13 ARG CD C 13 43.310 0.100 . 1 . . . . 111 ARG CD . 16683 1 1544 . 2 2 13 13 ARG CG C 13 26.870 0.100 . 1 . . . . 111 ARG CG . 16683 1 1545 . 2 2 13 13 ARG N N 15 119.910 0.100 . 1 . . . . 111 ARG N . 16683 1 1546 . 2 2 14 14 ARG H H 1 8.451 0.020 . 1 . . . . 112 ARG H . 16683 1 1547 . 2 2 14 14 ARG HA H 1 4.330 0.020 . 1 . . . . 112 ARG HA . 16683 1 1548 . 2 2 14 14 ARG HB2 H 1 1.775 0.020 . 1 . . . . 112 ARG HB2 . 16683 1 1549 . 2 2 14 14 ARG HB3 H 1 1.611 0.020 . 1 . . . . 112 ARG HB3 . 16683 1 1550 . 2 2 14 14 ARG HD2 H 1 3.021 0.020 . 1 . . . . 112 ARG HD2 . 16683 1 1551 . 2 2 14 14 ARG HD3 H 1 2.758 0.020 . 1 . . . . 112 ARG HD3 . 16683 1 1552 . 2 2 14 14 ARG HG2 H 1 1.513 0.020 . 1 . . . . 112 ARG HG2 . 16683 1 1553 . 2 2 14 14 ARG HG3 H 1 1.240 0.020 . 1 . . . . 112 ARG HG3 . 16683 1 1554 . 2 2 14 14 ARG CA C 13 54.098 0.100 . 1 . . . . 112 ARG CA . 16683 1 1555 . 2 2 14 14 ARG CB C 13 30.230 0.100 . 1 . . . . 112 ARG CB . 16683 1 1556 . 2 2 14 14 ARG CD C 13 43.310 0.100 . 1 . . . . 112 ARG CD . 16683 1 1557 . 2 2 14 14 ARG CG C 13 26.492 0.100 . 1 . . . . 112 ARG CG . 16683 1 1558 . 2 2 14 14 ARG N N 15 123.988 0.100 . 1 . . . . 112 ARG N . 16683 1 1559 . 2 2 15 15 PRO HA H 1 4.434 0.020 . 1 . . . . 113 PRO HA . 16683 1 1560 . 2 2 15 15 PRO HB2 H 1 2.302 0.020 . 1 . . . . 113 PRO HB2 . 16683 1 1561 . 2 2 15 15 PRO HB3 H 1 2.302 0.020 . 1 . . . . 113 PRO HB3 . 16683 1 1562 . 2 2 15 15 PRO HD2 H 1 3.806 0.020 . 1 . . . . 113 PRO HD2 . 16683 1 1563 . 2 2 15 15 PRO HD3 H 1 3.696 0.020 . 1 . . . . 113 PRO HD3 . 16683 1 1564 . 2 2 15 15 PRO HG2 H 1 2.056 0.020 . 1 . . . . 113 PRO HG2 . 16683 1 1565 . 2 2 15 15 PRO HG3 H 1 2.051 0.020 . 1 . . . . 113 PRO HG3 . 16683 1 1566 . 2 2 15 15 PRO CA C 13 63.550 0.100 . 1 . . . . 113 PRO CA . 16683 1 1567 . 2 2 15 15 PRO CB C 13 32.017 0.100 . 1 . . . . 113 PRO CB . 16683 1 1568 . 2 2 15 15 PRO CD C 13 50.820 0.100 . 1 . . . . 113 PRO CD . 16683 1 1569 . 2 2 15 15 PRO CG C 13 26.981 0.100 . 1 . . . . 113 PRO CG . 16683 1 1570 . 2 2 16 16 SER H H 1 8.364 0.020 . 1 . . . . 114 SER H . 16683 1 1571 . 2 2 16 16 SER HA H 1 4.430 0.020 . 1 . . . . 114 SER HA . 16683 1 1572 . 2 2 16 16 SER HB2 H 1 3.890 0.020 . 1 . . . . 114 SER HB2 . 16683 1 1573 . 2 2 16 16 SER HB3 H 1 3.912 0.020 . 1 . . . . 114 SER HB3 . 16683 1 1574 . 2 2 16 16 SER CA C 13 58.410 0.100 . 1 . . . . 114 SER CA . 16683 1 1575 . 2 2 16 16 SER CB C 13 63.658 0.100 . 1 . . . . 114 SER CB . 16683 1 1576 . 2 2 16 16 SER N N 15 115.084 0.100 . 1 . . . . 114 SER N . 16683 1 1577 . 2 2 17 17 CYS H H 1 8.276 0.020 . 1 . . . . 115 CYS H . 16683 1 1578 . 2 2 17 17 CYS HA H 1 4.585 0.020 . 1 . . . . 115 CYS HA . 16683 1 1579 . 2 2 17 17 CYS HB2 H 1 2.967 0.020 . 1 . . . . 115 CYS HB2 . 16683 1 1580 . 2 2 17 17 CYS HB3 H 1 2.930 0.020 . 1 . . . . 115 CYS HB3 . 16683 1 1581 . 2 2 17 17 CYS CA C 13 58.191 0.100 . 1 . . . . 115 CYS CA . 16683 1 1582 . 2 2 17 17 CYS CB C 13 28.224 0.100 . 1 . . . . 115 CYS CB . 16683 1 1583 . 2 2 17 17 CYS N N 15 120.493 0.100 . 1 . . . . 115 CYS N . 16683 1 1584 . 2 2 18 18 SER H H 1 8.376 0.020 . 1 . . . . 116 SER H . 16683 1 1585 . 2 2 18 18 SER HA H 1 4.786 0.020 . 1 . . . . 116 SER HA . 16683 1 1586 . 2 2 18 18 SER HB2 H 1 3.882 0.020 . 1 . . . . 116 SER HB2 . 16683 1 1587 . 2 2 18 18 SER HB3 H 1 3.913 0.020 . 1 . . . . 116 SER HB3 . 16683 1 1588 . 2 2 18 18 SER CA C 13 56.510 0.100 . 1 . . . . 116 SER CA . 16683 1 1589 . 2 2 18 18 SER CB C 13 63.558 0.100 . 1 . . . . 116 SER CB . 16683 1 1590 . 2 2 18 18 SER N N 15 119.135 0.100 . 1 . . . . 116 SER N . 16683 1 1591 . 2 2 19 19 PRO HA H 1 4.441 0.020 . 1 . . . . 117 PRO HA . 16683 1 1592 . 2 2 19 19 PRO HB2 H 1 2.317 0.020 . 1 . . . . 117 PRO HB2 . 16683 1 1593 . 2 2 19 19 PRO HB3 H 1 1.942 0.020 . 1 . . . . 117 PRO HB3 . 16683 1 1594 . 2 2 19 19 PRO HD2 H 1 3.828 0.020 . 1 . . . . 117 PRO HD2 . 16683 1 1595 . 2 2 19 19 PRO HD3 H 1 3.682 0.020 . 1 . . . . 117 PRO HD3 . 16683 1 1596 . 2 2 19 19 PRO HG2 H 1 2.065 0.020 . 1 . . . . 117 PRO HG2 . 16683 1 1597 . 2 2 19 19 PRO HG3 H 1 2.050 0.020 . 1 . . . . 117 PRO HG3 . 16683 1 1598 . 2 2 19 19 PRO CA C 13 63.508 0.100 . 1 . . . . 117 PRO CA . 16683 1 1599 . 2 2 19 19 PRO CB C 13 31.919 0.100 . 1 . . . . 117 PRO CB . 16683 1 1600 . 2 2 19 19 PRO CD C 13 50.600 0.100 . 1 . . . . 117 PRO CD . 16683 1 1601 . 2 2 19 19 PRO CG C 13 27.332 0.100 . 1 . . . . 117 PRO CG . 16683 1 1602 . 2 2 20 20 GLU H H 1 8.506 0.020 . 1 . . . . 118 GLU H . 16683 1 1603 . 2 2 20 20 GLU HA H 1 4.243 0.020 . 1 . . . . 118 GLU HA . 16683 1 1604 . 2 2 20 20 GLU HB2 H 1 1.937 0.020 . 1 . . . . 118 GLU HB2 . 16683 1 1605 . 2 2 20 20 GLU HB3 H 1 1.993 0.020 . 1 . . . . 118 GLU HB3 . 16683 1 1606 . 2 2 20 20 GLU HG2 H 1 2.267 0.020 . 1 . . . . 118 GLU HG2 . 16683 1 1607 . 2 2 20 20 GLU HG3 H 1 2.298 0.020 . 1 . . . . 118 GLU HG3 . 16683 1 1608 . 2 2 20 20 GLU CA C 13 56.878 0.100 . 1 . . . . 118 GLU CA . 16683 1 1609 . 2 2 20 20 GLU CB C 13 30.050 0.100 . 1 . . . . 118 GLU CB . 16683 1 1610 . 2 2 20 20 GLU CG C 13 36.190 0.100 . 1 . . . . 118 GLU CG . 16683 1 1611 . 2 2 20 20 GLU N N 15 120.567 0.100 . 1 . . . . 118 GLU N . 16683 1 1612 . 2 2 21 21 ARG H H 1 8.268 0.020 . 1 . . . . 119 ARG H . 16683 1 1613 . 2 2 21 21 ARG HA H 1 4.324 0.020 . 1 . . . . 119 ARG HA . 16683 1 1614 . 2 2 21 21 ARG HB2 H 1 1.749 0.020 . 1 . . . . 119 ARG HB2 . 16683 1 1615 . 2 2 21 21 ARG HB3 H 1 1.787 0.020 . 1 . . . . 119 ARG HB3 . 16683 1 1616 . 2 2 21 21 ARG HD2 H 1 3.187 0.020 . 1 . . . . 119 ARG HD2 . 16683 1 1617 . 2 2 21 21 ARG HD3 H 1 3.180 0.020 . 1 . . . . 119 ARG HD3 . 16683 1 1618 . 2 2 21 21 ARG HG2 H 1 1.585 0.020 . 1 . . . . 119 ARG HG2 . 16683 1 1619 . 2 2 21 21 ARG HG3 H 1 1.571 0.020 . 1 . . . . 119 ARG HG3 . 16683 1 1620 . 2 2 21 21 ARG CA C 13 55.980 0.100 . 1 . . . . 119 ARG CA . 16683 1 1621 . 2 2 21 21 ARG CB C 13 30.660 0.100 . 1 . . . . 119 ARG CB . 16683 1 1622 . 2 2 21 21 ARG CD C 13 43.310 0.100 . 1 . . . . 119 ARG CD . 16683 1 1623 . 2 2 21 21 ARG CG C 13 27.002 0.100 . 1 . . . . 119 ARG CG . 16683 1 1624 . 2 2 21 21 ARG N N 15 121.773 0.100 . 1 . . . . 119 ARG N . 16683 1 1625 . 2 2 22 22 HIS H H 1 8.474 0.020 . 1 . . . . 120 HIS H . 16683 1 1626 . 2 2 22 22 HIS HA H 1 4.720 0.020 . 1 . . . . 120 HIS HA . 16683 1 1627 . 2 2 22 22 HIS HB2 H 1 3.169 0.020 . 1 . . . . 120 HIS HB2 . 16683 1 1628 . 2 2 22 22 HIS HB3 H 1 3.244 0.020 . 1 . . . . 120 HIS HB3 . 16683 1 1629 . 2 2 22 22 HIS HD2 H 1 7.222 0.020 . 1 . . . . 120 HIS HD2 . 16683 1 1630 . 2 2 22 22 HIS HE1 H 1 8.220 0.020 . 1 . . . . 120 HIS HE1 . 16683 1 1631 . 2 2 22 22 HIS CA C 13 55.830 0.100 . 1 . . . . 120 HIS CA . 16683 1 1632 . 2 2 22 22 HIS CB C 13 29.900 0.100 . 1 . . . . 120 HIS CB . 16683 1 1633 . 2 2 22 22 HIS CD2 C 13 119.910 0.100 . 1 . . . . 120 HIS CD2 . 16683 1 1634 . 2 2 22 22 HIS CE1 C 13 137.260 0.100 . 1 . . . . 120 HIS CE1 . 16683 1 1635 . 2 2 22 22 HIS N N 15 119.985 0.100 . 1 . . . . 120 HIS N . 16683 1 1636 . 2 2 23 23 GLY H H 1 8.503 0.020 . 1 . . . . 121 GLY H . 16683 1 1637 . 2 2 23 23 GLY HA2 H 1 4.006 0.020 . 1 . . . . 121 GLY HA2 . 16683 1 1638 . 2 2 23 23 GLY HA3 H 1 4.000 0.020 . 1 . . . . 121 GLY HA3 . 16683 1 1639 . 2 2 23 23 GLY CA C 13 45.260 0.100 . 1 . . . . 121 GLY CA . 16683 1 1640 . 2 2 23 23 GLY N N 15 110.295 0.100 . 1 . . . . 121 GLY N . 16683 1 1641 . 2 2 24 24 GLY H H 1 8.363 0.020 . 1 . . . . 122 GLY H . 16683 1 1642 . 2 2 24 24 GLY HA2 H 1 3.991 0.020 . 1 . . . . 122 GLY HA2 . 16683 1 1643 . 2 2 24 24 GLY HA3 H 1 4.000 0.020 . 1 . . . . 122 GLY HA3 . 16683 1 1644 . 2 2 24 24 GLY CA C 13 45.149 0.100 . 1 . . . . 122 GLY CA . 16683 1 1645 . 2 2 24 24 GLY N N 15 108.738 0.100 . 1 . . . . 122 GLY N . 16683 1 1646 . 2 2 25 25 LYS H H 1 8.239 0.020 . 1 . . . . 123 LYS H . 16683 1 1647 . 2 2 25 25 LYS HA H 1 4.365 0.020 . 1 . . . . 123 LYS HA . 16683 1 1648 . 2 2 25 25 LYS HB2 H 1 1.828 0.020 . 1 . . . . 123 LYS HB2 . 16683 1 1649 . 2 2 25 25 LYS HB3 H 1 1.788 0.020 . 1 . . . . 123 LYS HB3 . 16683 1 1650 . 2 2 25 25 LYS HD2 H 1 1.709 0.020 . 1 . . . . 123 LYS HD2 . 16683 1 1651 . 2 2 25 25 LYS HD3 H 1 1.718 0.020 . 1 . . . . 123 LYS HD3 . 16683 1 1652 . 2 2 25 25 LYS HE2 H 1 3.020 0.020 . 1 . . . . 123 LYS HE2 . 16683 1 1653 . 2 2 25 25 LYS HE3 H 1 3.024 0.020 . 1 . . . . 123 LYS HE3 . 16683 1 1654 . 2 2 25 25 LYS HG2 H 1 1.407 0.020 . 1 . . . . 123 LYS HG2 . 16683 1 1655 . 2 2 25 25 LYS HG3 H 1 1.434 0.020 . 1 . . . . 123 LYS HG3 . 16683 1 1656 . 2 2 25 25 LYS HZ1 H 1 6.501 0.020 . 1 . . . . 123 LYS HZ1 . 16683 1 1657 . 2 2 25 25 LYS HZ2 H 1 6.501 0.020 . 1 . . . . 123 LYS HZ2 . 16683 1 1658 . 2 2 25 25 LYS HZ3 H 1 6.501 0.020 . 1 . . . . 123 LYS HZ3 . 16683 1 1659 . 2 2 25 25 LYS CA C 13 56.430 0.100 . 1 . . . . 123 LYS CA . 16683 1 1660 . 2 2 25 25 LYS CB C 13 33.015 0.100 . 1 . . . . 123 LYS CB . 16683 1 1661 . 2 2 25 25 LYS CD C 13 29.099 0.100 . 1 . . . . 123 LYS CD . 16683 1 1662 . 2 2 25 25 LYS CE C 13 42.120 0.100 . 1 . . . . 123 LYS CE . 16683 1 1663 . 2 2 25 25 LYS CG C 13 24.662 0.100 . 1 . . . . 123 LYS CG . 16683 1 1664 . 2 2 25 25 LYS N N 15 120.923 0.100 . 1 . . . . 123 LYS N . 16683 1 1665 . 2 2 25 25 LYS NZ N 15 85.959 0.100 . 1 . . . . 123 LYS NZ . 16683 1 1666 . 2 2 26 26 VAL H H 1 8.178 0.020 . 1 . . . . 124 VAL H . 16683 1 1667 . 2 2 26 26 VAL HA H 1 4.120 0.020 . 1 . . . . 124 VAL HA . 16683 1 1668 . 2 2 26 26 VAL HB H 1 2.082 0.020 . 1 . . . . 124 VAL HB . 16683 1 1669 . 2 2 26 26 VAL HG11 H 1 0.954 0.020 . 1 . . . . 124 VAL HG1 . 16683 1 1670 . 2 2 26 26 VAL HG12 H 1 0.954 0.020 . 1 . . . . 124 VAL HG1 . 16683 1 1671 . 2 2 26 26 VAL HG13 H 1 0.954 0.020 . 1 . . . . 124 VAL HG1 . 16683 1 1672 . 2 2 26 26 VAL HG21 H 1 0.959 0.020 . 1 . . . . 124 VAL HG2 . 16683 1 1673 . 2 2 26 26 VAL HG22 H 1 0.959 0.020 . 1 . . . . 124 VAL HG2 . 16683 1 1674 . 2 2 26 26 VAL HG23 H 1 0.959 0.020 . 1 . . . . 124 VAL HG2 . 16683 1 1675 . 2 2 26 26 VAL CA C 13 62.110 0.100 . 1 . . . . 124 VAL CA . 16683 1 1676 . 2 2 26 26 VAL CB C 13 32.660 0.100 . 1 . . . . 124 VAL CB . 16683 1 1677 . 2 2 26 26 VAL CG1 C 13 20.510 0.100 . 1 . . . . 124 VAL CG1 . 16683 1 1678 . 2 2 26 26 VAL CG2 C 13 20.729 0.100 . 1 . . . . 124 VAL CG2 . 16683 1 1679 . 2 2 26 26 VAL N N 15 121.616 0.100 . 1 . . . . 124 VAL N . 16683 1 1680 . 2 2 27 27 ALA H H 1 8.375 0.020 . 1 . . . . 125 ALA H . 16683 1 1681 . 2 2 27 27 ALA HA H 1 4.335 0.020 . 1 . . . . 125 ALA HA . 16683 1 1682 . 2 2 27 27 ALA HB1 H 1 1.391 0.020 . 1 . . . . 125 ALA HB . 16683 1 1683 . 2 2 27 27 ALA HB2 H 1 1.391 0.020 . 1 . . . . 125 ALA HB . 16683 1 1684 . 2 2 27 27 ALA HB3 H 1 1.391 0.020 . 1 . . . . 125 ALA HB . 16683 1 1685 . 2 2 27 27 ALA CA C 13 52.435 0.100 . 1 . . . . 125 ALA CA . 16683 1 1686 . 2 2 27 27 ALA CB C 13 19.152 0.100 . 1 . . . . 125 ALA CB . 16683 1 1687 . 2 2 27 27 ALA N N 15 128.153 0.100 . 1 . . . . 125 ALA N . 16683 1 1688 . 2 2 28 28 ARG H H 1 8.279 0.020 . 1 . . . . 126 ARG H . 16683 1 1689 . 2 2 28 28 ARG HA H 1 4.346 0.020 . 1 . . . . 126 ARG HA . 16683 1 1690 . 2 2 28 28 ARG HB2 H 1 1.853 0.020 . 1 . . . . 126 ARG HB2 . 16683 1 1691 . 2 2 28 28 ARG HB3 H 1 1.790 0.020 . 1 . . . . 126 ARG HB3 . 16683 1 1692 . 2 2 28 28 ARG HD2 H 1 3.254 0.020 . 1 . . . . 126 ARG HD2 . 16683 1 1693 . 2 2 28 28 ARG HD3 H 1 3.231 0.020 . 1 . . . . 126 ARG HD3 . 16683 1 1694 . 2 2 28 28 ARG HG2 H 1 1.668 0.020 . 1 . . . . 126 ARG HG2 . 16683 1 1695 . 2 2 28 28 ARG HG3 H 1 1.659 0.020 . 1 . . . . 126 ARG HG3 . 16683 1 1696 . 2 2 28 28 ARG CA C 13 55.990 0.100 . 1 . . . . 126 ARG CA . 16683 1 1697 . 2 2 28 28 ARG CB C 13 30.790 0.100 . 1 . . . . 126 ARG CB . 16683 1 1698 . 2 2 28 28 ARG CD C 13 43.310 0.100 . 1 . . . . 126 ARG CD . 16683 1 1699 . 2 2 28 28 ARG CG C 13 27.002 0.100 . 1 . . . . 126 ARG CG . 16683 1 1700 . 2 2 28 28 ARG N N 15 120.561 0.100 . 1 . . . . 126 ARG N . 16683 1 1701 . 2 2 29 29 LEU H H 1 8.275 0.020 . 1 . . . . 127 LEU H . 16683 1 1702 . 2 2 29 29 LEU HA H 1 4.391 0.020 . 1 . . . . 127 LEU HA . 16683 1 1703 . 2 2 29 29 LEU HB2 H 1 1.638 0.020 . 1 . . . . 127 LEU HB2 . 16683 1 1704 . 2 2 29 29 LEU HB3 H 1 1.650 0.020 . 1 . . . . 127 LEU HB3 . 16683 1 1705 . 2 2 29 29 LEU HD11 H 1 0.947 0.020 . 1 . . . . 127 LEU HD1 . 16683 1 1706 . 2 2 29 29 LEU HD12 H 1 0.947 0.020 . 1 . . . . 127 LEU HD1 . 16683 1 1707 . 2 2 29 29 LEU HD13 H 1 0.947 0.020 . 1 . . . . 127 LEU HD1 . 16683 1 1708 . 2 2 29 29 LEU HD21 H 1 0.892 0.020 . 1 . . . . 127 LEU HD2 . 16683 1 1709 . 2 2 29 29 LEU HD22 H 1 0.892 0.020 . 1 . . . . 127 LEU HD2 . 16683 1 1710 . 2 2 29 29 LEU HD23 H 1 0.892 0.020 . 1 . . . . 127 LEU HD2 . 16683 1 1711 . 2 2 29 29 LEU HG H 1 1.630 0.020 . 1 . . . . 127 LEU HG . 16683 1 1712 . 2 2 29 29 LEU CA C 13 54.972 0.100 . 1 . . . . 127 LEU CA . 16683 1 1713 . 2 2 29 29 LEU CB C 13 42.406 0.100 . 1 . . . . 127 LEU CB . 16683 1 1714 . 2 2 29 29 LEU CD1 C 13 24.752 0.100 . 1 . . . . 127 LEU CD1 . 16683 1 1715 . 2 2 29 29 LEU CD2 C 13 23.420 0.100 . 1 . . . . 127 LEU CD2 . 16683 1 1716 . 2 2 29 29 LEU CG C 13 27.100 0.100 . 1 . . . . 127 LEU CG . 16683 1 1717 . 2 2 29 29 LEU N N 15 123.601 0.100 . 1 . . . . 127 LEU N . 16683 1 1718 . 2 2 30 30 GLN H H 1 8.345 0.020 . 1 . . . . 128 GLN H . 16683 1 1719 . 2 2 30 30 GLN HA H 1 4.683 0.020 . 1 . . . . 128 GLN HA . 16683 1 1720 . 2 2 30 30 GLN HB2 H 1 1.959 0.020 . 1 . . . . 128 GLN HB2 . 16683 1 1721 . 2 2 30 30 GLN HB3 H 1 2.122 0.020 . 1 . . . . 128 GLN HB3 . 16683 1 1722 . 2 2 30 30 GLN HE21 H 1 6.900 0.020 . 1 . . . . 128 GLN HE21 . 16683 1 1723 . 2 2 30 30 GLN HE22 H 1 7.655 0.020 . 1 . . . . 128 GLN HE22 . 16683 1 1724 . 2 2 30 30 GLN HG2 H 1 2.481 0.020 . 1 . . . . 128 GLN HG2 . 16683 1 1725 . 2 2 30 30 GLN HG3 H 1 2.424 0.020 . 1 . . . . 128 GLN HG3 . 16683 1 1726 . 2 2 30 30 GLN CA C 13 53.400 0.100 . 1 . . . . 128 GLN CA . 16683 1 1727 . 2 2 30 30 GLN CB C 13 29.351 0.100 . 1 . . . . 128 GLN CB . 16683 1 1728 . 2 2 30 30 GLN CG C 13 33.490 0.100 . 1 . . . . 128 GLN CG . 16683 1 1729 . 2 2 30 30 GLN N N 15 112.350 0.100 . 1 . . . . 128 GLN N . 16683 1 1730 . 2 2 30 30 GLN NE2 N 15 112.350 0.100 . 1 . . . . 128 GLN NE2 . 16683 1 1731 . 2 2 31 31 PRO HA H 1 4.731 0.020 . 1 . . . . 129 PRO HA . 16683 1 1732 . 2 2 31 31 PRO HB2 H 1 2.380 0.020 . 1 . . . . 129 PRO HB2 . 16683 1 1733 . 2 2 31 31 PRO HB3 H 1 1.928 0.020 . 1 . . . . 129 PRO HB3 . 16683 1 1734 . 2 2 31 31 PRO HD2 H 1 3.660 0.020 . 1 . . . . 129 PRO HD2 . 16683 1 1735 . 2 2 31 31 PRO HD3 H 1 3.853 0.020 . 1 . . . . 129 PRO HD3 . 16683 1 1736 . 2 2 31 31 PRO HG2 H 1 2.098 0.020 . 1 . . . . 129 PRO HG2 . 16683 1 1737 . 2 2 31 31 PRO HG3 H 1 2.074 0.020 . 1 . . . . 129 PRO HG3 . 16683 1 1738 . 2 2 31 31 PRO CA C 13 61.360 0.100 . 1 . . . . 129 PRO CA . 16683 1 1739 . 2 2 31 31 PRO CB C 13 30.750 0.100 . 1 . . . . 129 PRO CB . 16683 1 1740 . 2 2 31 31 PRO CD C 13 50.460 0.100 . 1 . . . . 129 PRO CD . 16683 1 1741 . 2 2 31 31 PRO CG C 13 27.262 0.100 . 1 . . . . 129 PRO CG . 16683 1 1742 . 2 2 32 32 PRO HA H 1 4.698 0.020 . 1 . . . . 130 PRO HA . 16683 1 1743 . 2 2 32 32 PRO HD2 H 1 3.687 0.020 . 1 . . . . 130 PRO HD2 . 16683 1 1744 . 2 2 32 32 PRO HD3 H 1 3.843 0.020 . 1 . . . . 130 PRO HD3 . 16683 1 1745 . 2 2 32 32 PRO CA C 13 62.558 0.100 . 1 . . . . 130 PRO CA . 16683 1 1746 . 2 2 33 33 PRO HA H 1 4.524 0.020 . 1 . . . . 131 PRO HA . 16683 1 1747 . 2 2 33 33 PRO HB2 H 1 2.333 0.020 . 1 . . . . 131 PRO HB2 . 16683 1 1748 . 2 2 33 33 PRO HB3 H 1 1.963 0.020 . 1 . . . . 131 PRO HB3 . 16683 1 1749 . 2 2 33 33 PRO HD2 H 1 3.681 0.020 . 1 . . . . 131 PRO HD2 . 16683 1 1750 . 2 2 33 33 PRO HD3 H 1 3.847 0.020 . 1 . . . . 131 PRO HD3 . 16683 1 1751 . 2 2 33 33 PRO HG2 H 1 2.059 0.020 . 1 . . . . 131 PRO HG2 . 16683 1 1752 . 2 2 33 33 PRO HG3 H 1 2.064 0.020 . 1 . . . . 131 PRO HG3 . 16683 1 1753 . 2 2 33 33 PRO CA C 13 62.975 0.100 . 1 . . . . 131 PRO CA . 16683 1 1754 . 2 2 33 33 PRO CB C 13 31.860 0.100 . 1 . . . . 131 PRO CB . 16683 1 1755 . 2 2 33 33 PRO CD C 13 50.660 0.100 . 1 . . . . 131 PRO CD . 16683 1 1756 . 2 2 33 33 PRO CG C 13 27.210 0.100 . 1 . . . . 131 PRO CG . 16683 1 1757 . 2 2 34 34 THR H H 1 8.198 0.020 . 1 . . . . 132 THR H . 16683 1 1758 . 2 2 34 34 THR HA H 1 4.321 0.020 . 1 . . . . 132 THR HA . 16683 1 1759 . 2 2 34 34 THR HB H 1 4.218 0.020 . 1 . . . . 132 THR HB . 16683 1 1760 . 2 2 34 34 THR HG21 H 1 1.251 0.020 . 1 . . . . 132 THR HG2 . 16683 1 1761 . 2 2 34 34 THR HG22 H 1 1.251 0.020 . 1 . . . . 132 THR HG2 . 16683 1 1762 . 2 2 34 34 THR HG23 H 1 1.251 0.020 . 1 . . . . 132 THR HG2 . 16683 1 1763 . 2 2 34 34 THR CA C 13 61.775 0.100 . 1 . . . . 132 THR CA . 16683 1 1764 . 2 2 34 34 THR CB C 13 70.028 0.100 . 1 . . . . 132 THR CB . 16683 1 1765 . 2 2 34 34 THR CG2 C 13 21.611 0.100 . 1 . . . . 132 THR CG2 . 16683 1 1766 . 2 2 34 34 THR N N 15 114.527 0.100 . 1 . . . . 132 THR N . 16683 1 1767 . 2 2 35 35 LYS H H 1 8.311 0.020 . 1 . . . . 133 LYS H . 16683 1 1768 . 2 2 35 35 LYS HA H 1 4.357 0.020 . 1 . . . . 133 LYS HA . 16683 1 1769 . 2 2 35 35 LYS HB2 H 1 1.859 0.020 . 1 . . . . 133 LYS HB2 . 16683 1 1770 . 2 2 35 35 LYS HB3 H 1 1.774 0.020 . 1 . . . . 133 LYS HB3 . 16683 1 1771 . 2 2 35 35 LYS HD2 H 1 1.699 0.020 . 1 . . . . 133 LYS HD2 . 16683 1 1772 . 2 2 35 35 LYS HD3 H 1 1.712 0.020 . 1 . . . . 133 LYS HD3 . 16683 1 1773 . 2 2 35 35 LYS HE2 H 1 3.030 0.020 . 1 . . . . 133 LYS HE2 . 16683 1 1774 . 2 2 35 35 LYS HE3 H 1 3.026 0.020 . 1 . . . . 133 LYS HE3 . 16683 1 1775 . 2 2 35 35 LYS HG2 H 1 1.477 0.020 . 1 . . . . 133 LYS HG2 . 16683 1 1776 . 2 2 35 35 LYS HG3 H 1 1.457 0.020 . 1 . . . . 133 LYS HG3 . 16683 1 1777 . 2 2 35 35 LYS CA C 13 56.030 0.100 . 1 . . . . 133 LYS CA . 16683 1 1778 . 2 2 35 35 LYS CB C 13 33.104 0.100 . 1 . . . . 133 LYS CB . 16683 1 1779 . 2 2 35 35 LYS CD C 13 29.070 0.100 . 1 . . . . 133 LYS CD . 16683 1 1780 . 2 2 35 35 LYS CE C 13 42.120 0.100 . 1 . . . . 133 LYS CE . 16683 1 1781 . 2 2 35 35 LYS CG C 13 24.662 0.100 . 1 . . . . 133 LYS CG . 16683 1 1782 . 2 2 35 35 LYS N N 15 123.721 0.100 . 1 . . . . 133 LYS N . 16683 1 1783 . 2 2 36 36 ALA H H 1 8.324 0.020 . 1 . . . . 134 ALA H . 16683 1 1784 . 2 2 36 36 ALA HA H 1 4.331 0.020 . 1 . . . . 134 ALA HA . 16683 1 1785 . 2 2 36 36 ALA HB1 H 1 1.393 0.020 . 1 . . . . 134 ALA HB . 16683 1 1786 . 2 2 36 36 ALA HB2 H 1 1.393 0.020 . 1 . . . . 134 ALA HB . 16683 1 1787 . 2 2 36 36 ALA HB3 H 1 1.393 0.020 . 1 . . . . 134 ALA HB . 16683 1 1788 . 2 2 36 36 ALA CA C 13 52.310 0.100 . 1 . . . . 134 ALA CA . 16683 1 1789 . 2 2 36 36 ALA CB C 13 19.151 0.100 . 1 . . . . 134 ALA CB . 16683 1 1790 . 2 2 36 36 ALA N N 15 125.563 0.100 . 1 . . . . 134 ALA N . 16683 1 1791 . 2 2 37 37 GLN H H 1 8.358 0.020 . 1 . . . . 135 GLN H . 16683 1 1792 . 2 2 37 37 GLN HA H 1 4.659 0.020 . 1 . . . . 135 GLN HA . 16683 1 1793 . 2 2 37 37 GLN HB2 H 1 1.960 0.020 . 1 . . . . 135 GLN HB2 . 16683 1 1794 . 2 2 37 37 GLN HB3 H 1 2.118 0.020 . 1 . . . . 135 GLN HB3 . 16683 1 1795 . 2 2 37 37 GLN HE21 H 1 6.908 0.020 . 1 . . . . 135 GLN HE21 . 16683 1 1796 . 2 2 37 37 GLN HE22 H 1 7.574 0.020 . 1 . . . . 135 GLN HE22 . 16683 1 1797 . 2 2 37 37 GLN HG2 H 1 2.412 0.020 . 1 . . . . 135 GLN HG2 . 16683 1 1798 . 2 2 37 37 GLN HG3 H 1 2.425 0.020 . 1 . . . . 135 GLN HG3 . 16683 1 1799 . 2 2 37 37 GLN CA C 13 53.473 0.100 . 1 . . . . 135 GLN CA . 16683 1 1800 . 2 2 37 37 GLN CB C 13 28.880 0.100 . 1 . . . . 135 GLN CB . 16683 1 1801 . 2 2 37 37 GLN CG C 13 33.400 0.100 . 1 . . . . 135 GLN CG . 16683 1 1802 . 2 2 37 37 GLN N N 15 120.897 0.100 . 1 . . . . 135 GLN N . 16683 1 1803 . 2 2 37 37 GLN NE2 N 15 112.417 0.100 . 1 . . . . 135 GLN NE2 . 16683 1 1804 . 2 2 38 38 PRO HA H 1 4.441 0.020 . 1 . . . . 136 PRO HA . 16683 1 1805 . 2 2 38 38 PRO HB2 H 1 1.947 0.020 . 1 . . . . 136 PRO HB2 . 16683 1 1806 . 2 2 38 38 PRO HB3 H 1 2.321 0.020 . 1 . . . . 136 PRO HB3 . 16683 1 1807 . 2 2 38 38 PRO HD2 H 1 3.823 0.020 . 1 . . . . 136 PRO HD2 . 16683 1 1808 . 2 2 38 38 PRO HD3 H 1 3.675 0.020 . 1 . . . . 136 PRO HD3 . 16683 1 1809 . 2 2 38 38 PRO HG2 H 1 2.050 0.020 . 1 . . . . 136 PRO HG2 . 16683 1 1810 . 2 2 38 38 PRO HG3 H 1 2.053 0.020 . 1 . . . . 136 PRO HG3 . 16683 1 1811 . 2 2 38 38 PRO CA C 13 63.040 0.100 . 1 . . . . 136 PRO CA . 16683 1 1812 . 2 2 38 38 PRO CB C 13 32.050 0.100 . 1 . . . . 136 PRO CB . 16683 1 1813 . 2 2 38 38 PRO CD C 13 50.550 0.100 . 1 . . . . 136 PRO CD . 16683 1 1814 . 2 2 38 38 PRO CG C 13 27.262 0.100 . 1 . . . . 136 PRO CG . 16683 1 1815 . 2 2 39 39 ALA H H 1 8.433 0.020 . 1 . . . . 137 ALA H . 16683 1 1816 . 2 2 39 39 ALA HA H 1 4.335 0.020 . 1 . . . . 137 ALA HA . 16683 1 1817 . 2 2 39 39 ALA HB1 H 1 1.432 0.020 . 1 . . . . 137 ALA HB . 16683 1 1818 . 2 2 39 39 ALA HB2 H 1 1.432 0.020 . 1 . . . . 137 ALA HB . 16683 1 1819 . 2 2 39 39 ALA HB3 H 1 1.432 0.020 . 1 . . . . 137 ALA HB . 16683 1 1820 . 2 2 39 39 ALA CA C 13 52.520 0.100 . 1 . . . . 137 ALA CA . 16683 1 1821 . 2 2 39 39 ALA CB C 13 19.082 0.100 . 1 . . . . 137 ALA CB . 16683 1 1822 . 2 2 39 39 ALA N N 15 124.917 0.100 . 1 . . . . 137 ALA N . 16683 1 1823 . 2 2 40 40 ARG H H 1 7.907 0.020 . 1 . . . . 138 ARG H . 16683 1 1824 . 2 2 40 40 ARG HA H 1 4.197 0.020 . 1 . . . . 138 ARG HA . 16683 1 1825 . 2 2 40 40 ARG HB2 H 1 1.746 0.020 . 1 . . . . 138 ARG HB2 . 16683 1 1826 . 2 2 40 40 ARG HB3 H 1 1.877 0.020 . 1 . . . . 138 ARG HB3 . 16683 1 1827 . 2 2 40 40 ARG HD2 H 1 3.226 0.020 . 1 . . . . 138 ARG HD2 . 16683 1 1828 . 2 2 40 40 ARG HD3 H 1 3.223 0.020 . 1 . . . . 138 ARG HD3 . 16683 1 1829 . 2 2 40 40 ARG HG2 H 1 1.632 0.020 . 1 . . . . 138 ARG HG2 . 16683 1 1830 . 2 2 40 40 ARG HG3 H 1 1.625 0.020 . 1 . . . . 138 ARG HG3 . 16683 1 1831 . 2 2 40 40 ARG CA C 13 57.297 0.100 . 1 . . . . 138 ARG CA . 16683 1 1832 . 2 2 40 40 ARG CB C 13 31.536 0.100 . 1 . . . . 138 ARG CB . 16683 1 1833 . 2 2 40 40 ARG CD C 13 43.530 0.100 . 1 . . . . 138 ARG CD . 16683 1 1834 . 2 2 40 40 ARG CG C 13 27.099 0.100 . 1 . . . . 138 ARG CG . 16683 1 1835 . 2 2 40 40 ARG N N 15 125.228 0.100 . 1 . . . . 138 ARG N . 16683 1 stop_ save_