data_5566 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5566 _Entry.Title ; 1H, 15N and 13C Resonance Assignments for the PTB Domain of the Signaling Protein Shc ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2002-10-30 _Entry.Accession_date 2002-10-31 _Entry.Last_release_date 2003-03-18 _Entry.Original_release_date 2003-03-18 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Amjad Farooq . . . 5566 2 Lei Zeng . . . 5566 3 Ming-Ming Zhou . . . 5566 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 5566 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 451 5566 '15N chemical shifts' 167 5566 '1H chemical shifts' 879 5566 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 . . 2003-03-18 2002-10-30 original author . 5566 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1N3H 'BMRB Entry Tracking System' 5566 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5566 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Letter to the Editor: 1H, 15N and 13C resonance assignments for the PTB domain of the signaling protein Shc ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 25 _Citation.Journal_issue 3 _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 255 _Citation.Page_last 256 _Citation.Year 2003 _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 Amjad Farooq . . . 5566 1 2 Lei Zeng . . . 5566 1 3 Ming-Ming Zhou . . . 5566 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'PTB domain' 5566 1 'Signaling protein Shc' 5566 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_Shc_PTB_Domain _Assembly.Sf_category assembly _Assembly.Sf_framecode system_Shc_PTB_Domain _Assembly.Entry_ID 5566 _Assembly.ID 1 _Assembly.Name 'Phosphotyrosine binding domain of Shc' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not reported' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 5566 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Shc PTB Domain' 1 $Shc_PTB_Domain . . . 'molten globule' . . . . . 5566 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'Phosphotyrosine binding domain of Shc' system 5566 1 'Shc PTB Domain' abbreviation 5566 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Shc_PTB_Domain _Entity.Sf_category entity _Entity.Sf_framecode Shc_PTB_Domain _Entity.Entry_ID 5566 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Phosphotyrosine Binding Domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MNKLSGGGGRRTRVEGGQLG GEEWTRHGSFVNKPTRGWLH PNDKVMGPGVSYLVRYMGCV EVLQSMRALDFNTRTQVTRE AISLVCEAVPGAKGATRRRK PCSRPLSSILGRSNLKFAGM PITLTVSTSSLNLMAADCKQ IIANHHMQSISFASGGDPDT AEYVAYVAKDPVNQRACHIL ECPEGLAQDVISTIGQAFEL RFKQYLR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 207 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not reported' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 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 16470 . ShcA_PTB_domain . . . . . 92.27 191 100.00 100.00 5.37e-140 . . . . 5566 1 2 no BMRB 17080 . Shc-PTB . . . . . 92.27 211 100.00 100.00 7.74e-140 . . . . 5566 1 3 no PDB 1N3H . "Coupling Of Folding And Binding In The Ptb Domain Of The Signaling Protein Shc" . . . . . 100.00 207 100.00 100.00 5.19e-152 . . . . 5566 1 4 no PDB 1OY2 . "Coupling Of Folding And Binding In The Ptb Domain Of The Signaling Protein Shc" . . . . . 100.00 207 100.00 100.00 5.19e-152 . . . . 5566 1 5 no PDB 1SHC . "Shc Ptb Domain Complexed With A Trka Receptor Phosphopeptide, Nmr, Minimized Average Structure" . . . . . 92.27 195 100.00 100.00 6.97e-140 . . . . 5566 1 6 no PDB 2L1C . "Shc-Ptb:biphosphorylated Integrin Beta3 Cytoplasmic Tail Complex (1:1)" . . . . . 92.27 211 100.00 100.00 7.74e-140 . . . . 5566 1 7 no DBJ BAA74950 . "shc transforming protein [Rattus norvegicus]" . . . . . 66.67 138 100.00 100.00 1.67e-95 . . . . 5566 1 8 no DBJ BAC33706 . "unnamed protein product [Mus musculus]" . . . . . 100.00 469 100.00 100.00 3.48e-148 . . . . 5566 1 9 no DBJ BAE33083 . "unnamed protein product [Mus musculus]" . . . . . 100.00 579 100.00 100.00 2.39e-147 . . . . 5566 1 10 no DBJ BAF84832 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 474 100.00 100.00 4.67e-148 . . . . 5566 1 11 no DBJ BAF98733 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 474 100.00 100.00 4.67e-148 . . . . 5566 1 12 no EMBL CAA48251 . "SHC transforming protein [Homo sapiens]" . . . . . 100.00 473 100.00 100.00 4.10e-148 . . . . 5566 1 13 no EMBL CAA70977 . "shc p66 [Homo sapiens]" . . . . . 100.00 583 100.00 100.00 1.59e-147 . . . . 5566 1 14 no EMBL CAH92143 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 583 100.00 100.00 2.92e-147 . . . . 5566 1 15 no GB AAA91777 . "src homology collagen protein 66 kDa isoform [Mus musculus]" . . . . . 100.00 579 100.00 100.00 2.39e-147 . . . . 5566 1 16 no GB AAB49972 . "p66shc [Homo sapiens]" . . . . . 100.00 583 100.00 100.00 1.75e-147 . . . . 5566 1 17 no GB AAC52146 . "Shcp52 [Mus musculus]" . . . . . 100.00 469 100.00 100.00 3.48e-148 . . . . 5566 1 18 no GB AAH14158 . "SHC (Src homology 2 domain containing) transforming protein 1 [Homo sapiens]" . . . . . 100.00 474 100.00 100.00 4.67e-148 . . . . 5566 1 19 no GB AAH36172 . "Src homology 2 domain-containing transforming protein C1 [Mus musculus]" . . . . . 100.00 469 100.00 100.00 3.48e-148 . . . . 5566 1 20 no REF NP_001068773 . "SHC-transforming protein 1 isoform b [Bos taurus]" . . . . . 100.00 473 100.00 100.00 2.96e-148 . . . . 5566 1 21 no REF NP_001106802 . "SHC-transforming protein 1 isoform a [Mus musculus]" . . . . . 100.00 579 100.00 100.00 2.39e-147 . . . . 5566 1 22 no REF NP_001123512 . "SHC-transforming protein 1 isoform 3 [Homo sapiens]" . . . . . 100.00 584 100.00 100.00 1.93e-147 . . . . 5566 1 23 no REF NP_001123513 . "SHC-transforming protein 1 isoform 4 [Homo sapiens]" . . . . . 100.00 473 100.00 100.00 4.10e-148 . . . . 5566 1 24 no REF NP_001126253 . "SHC-transforming protein 1 [Pongo abelii]" . . . . . 100.00 583 100.00 100.00 2.92e-147 . . . . 5566 1 25 no SP P29353 . "RecName: Full=SHC-transforming protein 1; AltName: Full=SHC-transforming protein 3; AltName: Full=SHC-transforming protein A; A" . . . . . 100.00 583 100.00 100.00 1.57e-147 . . . . 5566 1 26 no SP P98083 . "RecName: Full=SHC-transforming protein 1; AltName: Full=SHC-transforming protein A; AltName: Full=Src homology 2 domain-contain" . . . . . 100.00 579 100.00 100.00 2.39e-147 . . . . 5566 1 27 no SP Q0IIE2 . "RecName: Full=SHC-transforming protein 1; AltName: Full=Src homology 2 domain-containing-transforming protein C1; Short=SH2 dom" . . . . . 100.00 473 100.00 100.00 2.96e-148 . . . . 5566 1 28 no SP Q5M824 . "RecName: Full=SHC-transforming protein 1; AltName: Full=Src homology 2 domain-containing-transforming protein C1; Short=SH2 dom" . . . . . 100.00 469 99.52 99.52 2.94e-147 . . . . 5566 1 29 no SP Q5R7W7 . "RecName: Full=SHC-transforming protein 1; AltName: Full=Src homology 2 domain-containing-transforming protein C1; Short=SH2 dom" . . . . . 100.00 583 100.00 100.00 2.92e-147 . . . . 5566 1 30 no TPG DAA31779 . "TPA: SHC-transforming protein 1 isoform b [Bos taurus]" . . . . . 100.00 473 100.00 100.00 2.96e-148 . . . . 5566 1 31 no TPG DAA31780 . "TPA: SHC-transforming protein 1 isoform a [Bos taurus]" . . . . . 100.00 583 100.00 100.00 9.96e-148 . . . . 5566 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Phosphotyrosine Binding Domain' common 5566 1 'PTB Domain' abbreviation 5566 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 . MET . 5566 1 2 . ASN . 5566 1 3 . LYS . 5566 1 4 . LEU . 5566 1 5 . SER . 5566 1 6 . GLY . 5566 1 7 . GLY . 5566 1 8 . GLY . 5566 1 9 . GLY . 5566 1 10 . ARG . 5566 1 11 . ARG . 5566 1 12 . THR . 5566 1 13 . ARG . 5566 1 14 . VAL . 5566 1 15 . GLU . 5566 1 16 . GLY . 5566 1 17 . GLY . 5566 1 18 . GLN . 5566 1 19 . LEU . 5566 1 20 . GLY . 5566 1 21 . GLY . 5566 1 22 . GLU . 5566 1 23 . GLU . 5566 1 24 . TRP . 5566 1 25 . THR . 5566 1 26 . ARG . 5566 1 27 . HIS . 5566 1 28 . GLY . 5566 1 29 . SER . 5566 1 30 . PHE . 5566 1 31 . VAL . 5566 1 32 . ASN . 5566 1 33 . LYS . 5566 1 34 . PRO . 5566 1 35 . THR . 5566 1 36 . ARG . 5566 1 37 . GLY . 5566 1 38 . TRP . 5566 1 39 . LEU . 5566 1 40 . HIS . 5566 1 41 . PRO . 5566 1 42 . ASN . 5566 1 43 . ASP . 5566 1 44 . LYS . 5566 1 45 . VAL . 5566 1 46 . MET . 5566 1 47 . GLY . 5566 1 48 . PRO . 5566 1 49 . GLY . 5566 1 50 . VAL . 5566 1 51 . SER . 5566 1 52 . TYR . 5566 1 53 . LEU . 5566 1 54 . VAL . 5566 1 55 . ARG . 5566 1 56 . TYR . 5566 1 57 . MET . 5566 1 58 . GLY . 5566 1 59 . CYS . 5566 1 60 . VAL . 5566 1 61 . GLU . 5566 1 62 . VAL . 5566 1 63 . LEU . 5566 1 64 . GLN . 5566 1 65 . SER . 5566 1 66 . MET . 5566 1 67 . ARG . 5566 1 68 . ALA . 5566 1 69 . LEU . 5566 1 70 . ASP . 5566 1 71 . PHE . 5566 1 72 . ASN . 5566 1 73 . THR . 5566 1 74 . ARG . 5566 1 75 . THR . 5566 1 76 . GLN . 5566 1 77 . VAL . 5566 1 78 . THR . 5566 1 79 . ARG . 5566 1 80 . GLU . 5566 1 81 . ALA . 5566 1 82 . ILE . 5566 1 83 . SER . 5566 1 84 . LEU . 5566 1 85 . VAL . 5566 1 86 . CYS . 5566 1 87 . GLU . 5566 1 88 . ALA . 5566 1 89 . VAL . 5566 1 90 . PRO . 5566 1 91 . GLY . 5566 1 92 . ALA . 5566 1 93 . LYS . 5566 1 94 . GLY . 5566 1 95 . ALA . 5566 1 96 . THR . 5566 1 97 . ARG . 5566 1 98 . ARG . 5566 1 99 . ARG . 5566 1 100 . LYS . 5566 1 101 . PRO . 5566 1 102 . CYS . 5566 1 103 . SER . 5566 1 104 . ARG . 5566 1 105 . PRO . 5566 1 106 . LEU . 5566 1 107 . SER . 5566 1 108 . SER . 5566 1 109 . ILE . 5566 1 110 . LEU . 5566 1 111 . GLY . 5566 1 112 . ARG . 5566 1 113 . SER . 5566 1 114 . ASN . 5566 1 115 . LEU . 5566 1 116 . LYS . 5566 1 117 . PHE . 5566 1 118 . ALA . 5566 1 119 . GLY . 5566 1 120 . MET . 5566 1 121 . PRO . 5566 1 122 . ILE . 5566 1 123 . THR . 5566 1 124 . LEU . 5566 1 125 . THR . 5566 1 126 . VAL . 5566 1 127 . SER . 5566 1 128 . THR . 5566 1 129 . SER . 5566 1 130 . SER . 5566 1 131 . LEU . 5566 1 132 . ASN . 5566 1 133 . LEU . 5566 1 134 . MET . 5566 1 135 . ALA . 5566 1 136 . ALA . 5566 1 137 . ASP . 5566 1 138 . CYS . 5566 1 139 . LYS . 5566 1 140 . GLN . 5566 1 141 . ILE . 5566 1 142 . ILE . 5566 1 143 . ALA . 5566 1 144 . ASN . 5566 1 145 . HIS . 5566 1 146 . HIS . 5566 1 147 . MET . 5566 1 148 . GLN . 5566 1 149 . SER . 5566 1 150 . ILE . 5566 1 151 . SER . 5566 1 152 . PHE . 5566 1 153 . ALA . 5566 1 154 . SER . 5566 1 155 . GLY . 5566 1 156 . GLY . 5566 1 157 . ASP . 5566 1 158 . PRO . 5566 1 159 . ASP . 5566 1 160 . THR . 5566 1 161 . ALA . 5566 1 162 . GLU . 5566 1 163 . TYR . 5566 1 164 . VAL . 5566 1 165 . ALA . 5566 1 166 . TYR . 5566 1 167 . VAL . 5566 1 168 . ALA . 5566 1 169 . LYS . 5566 1 170 . ASP . 5566 1 171 . PRO . 5566 1 172 . VAL . 5566 1 173 . ASN . 5566 1 174 . GLN . 5566 1 175 . ARG . 5566 1 176 . ALA . 5566 1 177 . CYS . 5566 1 178 . HIS . 5566 1 179 . ILE . 5566 1 180 . LEU . 5566 1 181 . GLU . 5566 1 182 . CYS . 5566 1 183 . PRO . 5566 1 184 . GLU . 5566 1 185 . GLY . 5566 1 186 . LEU . 5566 1 187 . ALA . 5566 1 188 . GLN . 5566 1 189 . ASP . 5566 1 190 . VAL . 5566 1 191 . ILE . 5566 1 192 . SER . 5566 1 193 . THR . 5566 1 194 . ILE . 5566 1 195 . GLY . 5566 1 196 . GLN . 5566 1 197 . ALA . 5566 1 198 . PHE . 5566 1 199 . GLU . 5566 1 200 . LEU . 5566 1 201 . ARG . 5566 1 202 . PHE . 5566 1 203 . LYS . 5566 1 204 . GLN . 5566 1 205 . TYR . 5566 1 206 . LEU . 5566 1 207 . ARG . 5566 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 5566 1 . ASN 2 2 5566 1 . LYS 3 3 5566 1 . LEU 4 4 5566 1 . SER 5 5 5566 1 . GLY 6 6 5566 1 . GLY 7 7 5566 1 . GLY 8 8 5566 1 . GLY 9 9 5566 1 . ARG 10 10 5566 1 . ARG 11 11 5566 1 . THR 12 12 5566 1 . ARG 13 13 5566 1 . VAL 14 14 5566 1 . GLU 15 15 5566 1 . GLY 16 16 5566 1 . GLY 17 17 5566 1 . GLN 18 18 5566 1 . LEU 19 19 5566 1 . GLY 20 20 5566 1 . GLY 21 21 5566 1 . GLU 22 22 5566 1 . GLU 23 23 5566 1 . TRP 24 24 5566 1 . THR 25 25 5566 1 . ARG 26 26 5566 1 . HIS 27 27 5566 1 . GLY 28 28 5566 1 . SER 29 29 5566 1 . PHE 30 30 5566 1 . VAL 31 31 5566 1 . ASN 32 32 5566 1 . LYS 33 33 5566 1 . PRO 34 34 5566 1 . THR 35 35 5566 1 . ARG 36 36 5566 1 . GLY 37 37 5566 1 . TRP 38 38 5566 1 . LEU 39 39 5566 1 . HIS 40 40 5566 1 . PRO 41 41 5566 1 . ASN 42 42 5566 1 . ASP 43 43 5566 1 . LYS 44 44 5566 1 . VAL 45 45 5566 1 . MET 46 46 5566 1 . GLY 47 47 5566 1 . PRO 48 48 5566 1 . GLY 49 49 5566 1 . VAL 50 50 5566 1 . SER 51 51 5566 1 . TYR 52 52 5566 1 . LEU 53 53 5566 1 . VAL 54 54 5566 1 . ARG 55 55 5566 1 . TYR 56 56 5566 1 . MET 57 57 5566 1 . GLY 58 58 5566 1 . CYS 59 59 5566 1 . VAL 60 60 5566 1 . GLU 61 61 5566 1 . VAL 62 62 5566 1 . LEU 63 63 5566 1 . GLN 64 64 5566 1 . SER 65 65 5566 1 . MET 66 66 5566 1 . ARG 67 67 5566 1 . ALA 68 68 5566 1 . LEU 69 69 5566 1 . ASP 70 70 5566 1 . PHE 71 71 5566 1 . ASN 72 72 5566 1 . THR 73 73 5566 1 . ARG 74 74 5566 1 . THR 75 75 5566 1 . GLN 76 76 5566 1 . VAL 77 77 5566 1 . THR 78 78 5566 1 . ARG 79 79 5566 1 . GLU 80 80 5566 1 . ALA 81 81 5566 1 . ILE 82 82 5566 1 . SER 83 83 5566 1 . LEU 84 84 5566 1 . VAL 85 85 5566 1 . CYS 86 86 5566 1 . GLU 87 87 5566 1 . ALA 88 88 5566 1 . VAL 89 89 5566 1 . PRO 90 90 5566 1 . GLY 91 91 5566 1 . ALA 92 92 5566 1 . LYS 93 93 5566 1 . GLY 94 94 5566 1 . ALA 95 95 5566 1 . THR 96 96 5566 1 . ARG 97 97 5566 1 . ARG 98 98 5566 1 . ARG 99 99 5566 1 . LYS 100 100 5566 1 . PRO 101 101 5566 1 . CYS 102 102 5566 1 . SER 103 103 5566 1 . ARG 104 104 5566 1 . PRO 105 105 5566 1 . LEU 106 106 5566 1 . SER 107 107 5566 1 . SER 108 108 5566 1 . ILE 109 109 5566 1 . LEU 110 110 5566 1 . GLY 111 111 5566 1 . ARG 112 112 5566 1 . SER 113 113 5566 1 . ASN 114 114 5566 1 . LEU 115 115 5566 1 . LYS 116 116 5566 1 . PHE 117 117 5566 1 . ALA 118 118 5566 1 . GLY 119 119 5566 1 . MET 120 120 5566 1 . PRO 121 121 5566 1 . ILE 122 122 5566 1 . THR 123 123 5566 1 . LEU 124 124 5566 1 . THR 125 125 5566 1 . VAL 126 126 5566 1 . SER 127 127 5566 1 . THR 128 128 5566 1 . SER 129 129 5566 1 . SER 130 130 5566 1 . LEU 131 131 5566 1 . ASN 132 132 5566 1 . LEU 133 133 5566 1 . MET 134 134 5566 1 . ALA 135 135 5566 1 . ALA 136 136 5566 1 . ASP 137 137 5566 1 . CYS 138 138 5566 1 . LYS 139 139 5566 1 . GLN 140 140 5566 1 . ILE 141 141 5566 1 . ILE 142 142 5566 1 . ALA 143 143 5566 1 . ASN 144 144 5566 1 . HIS 145 145 5566 1 . HIS 146 146 5566 1 . MET 147 147 5566 1 . GLN 148 148 5566 1 . SER 149 149 5566 1 . ILE 150 150 5566 1 . SER 151 151 5566 1 . PHE 152 152 5566 1 . ALA 153 153 5566 1 . SER 154 154 5566 1 . GLY 155 155 5566 1 . GLY 156 156 5566 1 . ASP 157 157 5566 1 . PRO 158 158 5566 1 . ASP 159 159 5566 1 . THR 160 160 5566 1 . ALA 161 161 5566 1 . GLU 162 162 5566 1 . TYR 163 163 5566 1 . VAL 164 164 5566 1 . ALA 165 165 5566 1 . TYR 166 166 5566 1 . VAL 167 167 5566 1 . ALA 168 168 5566 1 . LYS 169 169 5566 1 . ASP 170 170 5566 1 . PRO 171 171 5566 1 . VAL 172 172 5566 1 . ASN 173 173 5566 1 . GLN 174 174 5566 1 . ARG 175 175 5566 1 . ALA 176 176 5566 1 . CYS 177 177 5566 1 . HIS 178 178 5566 1 . ILE 179 179 5566 1 . LEU 180 180 5566 1 . GLU 181 181 5566 1 . CYS 182 182 5566 1 . PRO 183 183 5566 1 . GLU 184 184 5566 1 . GLY 185 185 5566 1 . LEU 186 186 5566 1 . ALA 187 187 5566 1 . GLN 188 188 5566 1 . ASP 189 189 5566 1 . VAL 190 190 5566 1 . ILE 191 191 5566 1 . SER 192 192 5566 1 . THR 193 193 5566 1 . ILE 194 194 5566 1 . GLY 195 195 5566 1 . GLN 196 196 5566 1 . ALA 197 197 5566 1 . PHE 198 198 5566 1 . GLU 199 199 5566 1 . LEU 200 200 5566 1 . ARG 201 201 5566 1 . PHE 202 202 5566 1 . LYS 203 203 5566 1 . GLN 204 204 5566 1 . TYR 205 205 5566 1 . LEU 206 206 5566 1 . ARG 207 207 5566 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 5566 _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 $Shc_PTB_Domain . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 5566 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 5566 _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 $Shc_PTB_Domain . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5566 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 5566 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Phosphotyrosine Binding Domain' . . . 1 $Shc_PTB_Domain . . 0.5 . . mM . . . . 5566 1 stop_ save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond_1 _Sample_condition_list.Entry_ID 5566 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.5 0.1 n/a 5566 1 temperature 308 1 K 5566 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 5566 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'spectrometer information not available' _NMR_spectrometer.Manufacturer unknown _NMR_spectrometer.Model unknown _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 0 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5566 _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 . unknown unknown . 0 'spectrometer information not available' . . 5566 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 5566 _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 . . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 5566 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 5566 _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 H 1 TSP 'methyl protons' . . . . ppm 0.00 external indirect 1.0 external cylindrical perpendicular 1 $entry_citation . . 1 $entry_citation 5566 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_1 _Assigned_chem_shift_list.Entry_ID 5566 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 5566 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 11 11 ARG CA C 13 55.77 0.00 . 1 . . . . . . . . 5566 1 2 . 1 1 11 11 ARG CB C 13 30.56 0.00 . 1 . . . . . . . . 5566 1 3 . 1 1 11 11 ARG CG C 13 27.50 0.00 . 1 . . . . . . . . 5566 1 4 . 1 1 11 11 ARG CD C 13 43.01 0.00 . 1 . . . . . . . . 5566 1 5 . 1 1 12 12 THR H H 1 8.18 0.00 . 1 . . . . . . . . 5566 1 6 . 1 1 12 12 THR HA H 1 4.42 0.00 . 1 . . . . . . . . 5566 1 7 . 1 1 12 12 THR HB H 1 4.29 0.00 . 1 . . . . . . . . 5566 1 8 . 1 1 12 12 THR CA C 13 61.61 0.00 . 1 . . . . . . . . 5566 1 9 . 1 1 12 12 THR CB C 13 69.58 0.00 . 1 . . . . . . . . 5566 1 10 . 1 1 12 12 THR N N 15 115.48 0.00 . 1 . . . . . . . . 5566 1 11 . 1 1 13 13 ARG H H 1 8.33 0.00 . 1 . . . . . . . . 5566 1 12 . 1 1 13 13 ARG HA H 1 4.39 0.00 . 1 . . . . . . . . 5566 1 13 . 1 1 13 13 ARG CA C 13 55.72 0.00 . 1 . . . . . . . . 5566 1 14 . 1 1 13 13 ARG CB C 13 30.52 0.00 . 1 . . . . . . . . 5566 1 15 . 1 1 13 13 ARG CG C 13 26.91 0.00 . 1 . . . . . . . . 5566 1 16 . 1 1 13 13 ARG CD C 13 43.07 0.00 . 1 . . . . . . . . 5566 1 17 . 1 1 13 13 ARG N N 15 123.45 0.00 . 1 . . . . . . . . 5566 1 18 . 1 1 14 14 VAL H H 1 8.18 0.00 . 1 . . . . . . . . 5566 1 19 . 1 1 14 14 VAL HA H 1 4.13 0.00 . 1 . . . . . . . . 5566 1 20 . 1 1 14 14 VAL HB H 1 2.06 0.00 . 1 . . . . . . . . 5566 1 21 . 1 1 14 14 VAL HG11 H 1 0.93 0.00 . 1 . . . . . . . . 5566 1 22 . 1 1 14 14 VAL HG12 H 1 0.93 0.00 . 1 . . . . . . . . 5566 1 23 . 1 1 14 14 VAL HG13 H 1 0.93 0.00 . 1 . . . . . . . . 5566 1 24 . 1 1 14 14 VAL CA C 13 62.18 0.00 . 1 . . . . . . . . 5566 1 25 . 1 1 14 14 VAL CB C 13 32.87 0.00 . 1 . . . . . . . . 5566 1 26 . 1 1 14 14 VAL CG1 C 13 21.11 0.00 . 1 . . . . . . . . 5566 1 27 . 1 1 14 14 VAL N N 15 121.76 0.00 . 1 . . . . . . . . 5566 1 28 . 1 1 15 15 GLU H H 1 8.49 0.00 . 1 . . . . . . . . 5566 1 29 . 1 1 15 15 GLU HA H 1 4.29 0.00 . 1 . . . . . . . . 5566 1 30 . 1 1 15 15 GLU HB2 H 1 1.97 0.00 . 1 . . . . . . . . 5566 1 31 . 1 1 15 15 GLU HB3 H 1 2.08 0.00 . 1 . . . . . . . . 5566 1 32 . 1 1 15 15 GLU HG3 H 1 2.27 0.00 . 1 . . . . . . . . 5566 1 33 . 1 1 15 15 GLU CA C 13 56.88 0.00 . 1 . . . . . . . . 5566 1 34 . 1 1 15 15 GLU CB C 13 30.29 0.00 . 1 . . . . . . . . 5566 1 35 . 1 1 15 15 GLU CG C 13 36.17 0.00 . 1 . . . . . . . . 5566 1 36 . 1 1 15 15 GLU N N 15 124.78 0.00 . 1 . . . . . . . . 5566 1 37 . 1 1 16 16 GLY H H 1 8.37 0.00 . 1 . . . . . . . . 5566 1 38 . 1 1 16 16 GLY HA3 H 1 3.97 0.00 . 1 . . . . . . . . 5566 1 39 . 1 1 16 16 GLY CA C 13 45.34 0.00 . 1 . . . . . . . . 5566 1 40 . 1 1 16 16 GLY N N 15 109.69 0.00 . 1 . . . . . . . . 5566 1 41 . 1 1 17 17 GLY H H 1 8.27 0.00 . 1 . . . . . . . . 5566 1 42 . 1 1 17 17 GLY HA3 H 1 3.95 0.00 . 1 . . . . . . . . 5566 1 43 . 1 1 17 17 GLY CA C 13 44.75 0.00 . 1 . . . . . . . . 5566 1 44 . 1 1 17 17 GLY N N 15 108.61 0.00 . 1 . . . . . . . . 5566 1 45 . 1 1 18 18 GLN H H 1 8.27 0.00 . 1 . . . . . . . . 5566 1 46 . 1 1 18 18 GLN HA H 1 4.36 0.00 . 1 . . . . . . . . 5566 1 47 . 1 1 18 18 GLN HB2 H 1 1.98 0.00 . 1 . . . . . . . . 5566 1 48 . 1 1 18 18 GLN HB3 H 1 2.11 0.00 . 1 . . . . . . . . 5566 1 49 . 1 1 18 18 GLN HG3 H 1 2.34 0.00 . 1 . . . . . . . . 5566 1 50 . 1 1 18 18 GLN CA C 13 55.76 0.00 . 1 . . . . . . . . 5566 1 51 . 1 1 18 18 GLN CB C 13 29.58 0.00 . 1 . . . . . . . . 5566 1 52 . 1 1 18 18 GLN CG C 13 33.73 0.00 . 1 . . . . . . . . 5566 1 53 . 1 1 18 18 GLN N N 15 119.69 0.00 . 1 . . . . . . . . 5566 1 54 . 1 1 19 19 LEU H H 1 8.33 0.00 . 1 . . . . . . . . 5566 1 55 . 1 1 19 19 LEU HA H 1 4.40 0.00 . 1 . . . . . . . . 5566 1 56 . 1 1 19 19 LEU HB3 H 1 1.63 0.00 . 1 . . . . . . . . 5566 1 57 . 1 1 19 19 LEU HG H 1 1.45 0.00 . 1 . . . . . . . . 5566 1 58 . 1 1 19 19 LEU HD11 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 59 . 1 1 19 19 LEU HD12 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 60 . 1 1 19 19 LEU HD13 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 61 . 1 1 19 19 LEU HD21 H 1 0.77 0.00 . 1 . . . . . . . . 5566 1 62 . 1 1 19 19 LEU HD22 H 1 0.77 0.00 . 1 . . . . . . . . 5566 1 63 . 1 1 19 19 LEU HD23 H 1 0.77 0.00 . 1 . . . . . . . . 5566 1 64 . 1 1 19 19 LEU CA C 13 55.46 0.00 . 1 . . . . . . . . 5566 1 65 . 1 1 19 19 LEU CB C 13 42.29 0.00 . 1 . . . . . . . . 5566 1 66 . 1 1 19 19 LEU CG C 13 24.40 0.00 . 1 . . . . . . . . 5566 1 67 . 1 1 19 19 LEU CD1 C 13 23.40 0.00 . 1 . . . . . . . . 5566 1 68 . 1 1 19 19 LEU N N 15 123.23 0.00 . 1 . . . . . . . . 5566 1 69 . 1 1 20 20 GLY H H 1 8.35 0.00 . 1 . . . . . . . . 5566 1 70 . 1 1 20 20 GLY HA3 H 1 3.95 0.00 . 1 . . . . . . . . 5566 1 71 . 1 1 20 20 GLY CA C 13 44.84 0.00 . 1 . . . . . . . . 5566 1 72 . 1 1 20 20 GLY N N 15 109.72 0.00 . 1 . . . . . . . . 5566 1 73 . 1 1 21 21 GLY H H 1 8.27 0.00 . 1 . . . . . . . . 5566 1 74 . 1 1 21 21 GLY HA3 H 1 3.97 0.00 . 1 . . . . . . . . 5566 1 75 . 1 1 21 21 GLY CA C 13 44.82 0.00 . 1 . . . . . . . . 5566 1 76 . 1 1 21 21 GLY N N 15 108.61 0.00 . 1 . . . . . . . . 5566 1 77 . 1 1 22 22 GLU H H 1 8.43 0.00 . 1 . . . . . . . . 5566 1 78 . 1 1 22 22 GLU HA H 1 4.29 0.00 . 1 . . . . . . . . 5566 1 79 . 1 1 22 22 GLU HB2 H 1 1.86 0.00 . 1 . . . . . . . . 5566 1 80 . 1 1 22 22 GLU HB3 H 1 1.96 0.00 . 1 . . . . . . . . 5566 1 81 . 1 1 22 22 GLU HG3 H 1 2.27 0.00 . 1 . . . . . . . . 5566 1 82 . 1 1 22 22 GLU CA C 13 56.46 0.00 . 1 . . . . . . . . 5566 1 83 . 1 1 22 22 GLU CB C 13 29.74 0.00 . 1 . . . . . . . . 5566 1 84 . 1 1 22 22 GLU CG C 13 36.10 0.00 . 1 . . . . . . . . 5566 1 85 . 1 1 22 22 GLU N N 15 120.35 0.00 . 1 . . . . . . . . 5566 1 86 . 1 1 23 23 GLU H H 1 8.65 0.00 . 1 . . . . . . . . 5566 1 87 . 1 1 23 23 GLU HA H 1 4.19 0.00 . 1 . . . . . . . . 5566 1 88 . 1 1 23 23 GLU HB3 H 1 1.98 0.00 . 1 . . . . . . . . 5566 1 89 . 1 1 23 23 GLU HG3 H 1 2.23 0.00 . 1 . . . . . . . . 5566 1 90 . 1 1 23 23 GLU CA C 13 57.36 0.00 . 1 . . . . . . . . 5566 1 91 . 1 1 23 23 GLU CB C 13 29.62 0.00 . 1 . . . . . . . . 5566 1 92 . 1 1 23 23 GLU CG C 13 36.34 0.00 . 1 . . . . . . . . 5566 1 93 . 1 1 23 23 GLU N N 15 121.46 0.00 . 1 . . . . . . . . 5566 1 94 . 1 1 24 24 TRP H H 1 8.06 0.00 . 1 . . . . . . . . 5566 1 95 . 1 1 24 24 TRP HA H 1 4.61 0.00 . 1 . . . . . . . . 5566 1 96 . 1 1 24 24 TRP HB2 H 1 3.30 0.00 . 1 . . . . . . . . 5566 1 97 . 1 1 24 24 TRP HB3 H 1 3.35 0.00 . 1 . . . . . . . . 5566 1 98 . 1 1 24 24 TRP HD1 H 1 7.26 0.00 . 1 . . . . . . . . 5566 1 99 . 1 1 24 24 TRP HE1 H 1 9.96 0.00 . 1 . . . . . . . . 5566 1 100 . 1 1 24 24 TRP HZ2 H 1 7.45 0.00 . 1 . . . . . . . . 5566 1 101 . 1 1 24 24 TRP HZ3 H 1 7.04 0.00 . 1 . . . . . . . . 5566 1 102 . 1 1 24 24 TRP CA C 13 58.05 0.00 . 1 . . . . . . . . 5566 1 103 . 1 1 24 24 TRP CB C 13 29.11 0.00 . 1 . . . . . . . . 5566 1 104 . 1 1 24 24 TRP CD1 C 13 126.87 0.00 . 1 . . . . . . . . 5566 1 105 . 1 1 24 24 TRP CZ2 C 13 114.35 0.00 . 1 . . . . . . . . 5566 1 106 . 1 1 24 24 TRP CZ3 C 13 124.37 0.00 . 1 . . . . . . . . 5566 1 107 . 1 1 24 24 TRP N N 15 120.58 0.00 . 1 . . . . . . . . 5566 1 108 . 1 1 24 24 TRP NE1 N 15 129.43 0.00 . 1 . . . . . . . . 5566 1 109 . 1 1 25 25 THR H H 1 7.54 0.00 . 1 . . . . . . . . 5566 1 110 . 1 1 25 25 THR HA H 1 4.08 0.00 . 1 . . . . . . . . 5566 1 111 . 1 1 25 25 THR HB H 1 4.24 0.00 . 1 . . . . . . . . 5566 1 112 . 1 1 25 25 THR HG21 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 113 . 1 1 25 25 THR HG22 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 114 . 1 1 25 25 THR HG23 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 115 . 1 1 25 25 THR CA C 13 62.19 0.00 . 1 . . . . . . . . 5566 1 116 . 1 1 25 25 THR CB C 13 69.38 0.00 . 1 . . . . . . . . 5566 1 117 . 1 1 25 25 THR N N 15 112.82 0.00 . 1 . . . . . . . . 5566 1 118 . 1 1 26 26 ARG H H 1 7.85 0.00 . 1 . . . . . . . . 5566 1 119 . 1 1 26 26 ARG N N 15 126.14 0.00 . 1 . . . . . . . . 5566 1 120 . 1 1 29 29 SER H H 1 8.24 0.00 . 1 . . . . . . . . 5566 1 121 . 1 1 29 29 SER N N 15 113.97 0.00 . 1 . . . . . . . . 5566 1 122 . 1 1 30 30 PHE H H 1 7.99 0.00 . 1 . . . . . . . . 5566 1 123 . 1 1 30 30 PHE CA C 13 54.70 0.00 . 1 . . . . . . . . 5566 1 124 . 1 1 30 30 PHE CB C 13 41.77 0.00 . 1 . . . . . . . . 5566 1 125 . 1 1 30 30 PHE N N 15 121.34 0.00 . 1 . . . . . . . . 5566 1 126 . 1 1 31 31 VAL H H 1 7.99 0.00 . 1 . . . . . . . . 5566 1 127 . 1 1 31 31 VAL CA C 13 59.32 0.00 . 1 . . . . . . . . 5566 1 128 . 1 1 31 31 VAL CB C 13 32.34 0.00 . 1 . . . . . . . . 5566 1 129 . 1 1 31 31 VAL N N 15 122.17 0.00 . 1 . . . . . . . . 5566 1 130 . 1 1 35 35 THR H H 1 7.75 0.00 . 1 . . . . . . . . 5566 1 131 . 1 1 35 35 THR N N 15 113.07 0.00 . 1 . . . . . . . . 5566 1 132 . 1 1 36 36 ARG CA C 13 55.73 0.00 . 1 . . . . . . . . 5566 1 133 . 1 1 36 36 ARG CB C 13 29.74 0.00 . 1 . . . . . . . . 5566 1 134 . 1 1 36 36 ARG CD C 13 43.23 0.00 . 1 . . . . . . . . 5566 1 135 . 1 1 37 37 GLY H H 1 7.79 0.00 . 1 . . . . . . . . 5566 1 136 . 1 1 37 37 GLY CA C 13 43.72 0.00 . 1 . . . . . . . . 5566 1 137 . 1 1 37 37 GLY N N 15 108.18 0.00 . 1 . . . . . . . . 5566 1 138 . 1 1 38 38 TRP H H 1 8.00 0.00 . 1 . . . . . . . . 5566 1 139 . 1 1 38 38 TRP HA H 1 4.90 0.00 . 1 . . . . . . . . 5566 1 140 . 1 1 38 38 TRP HB2 H 1 3.19 0.00 . 1 . . . . . . . . 5566 1 141 . 1 1 38 38 TRP HB3 H 1 3.22 0.00 . 1 . . . . . . . . 5566 1 142 . 1 1 38 38 TRP HD1 H 1 7.30 0.00 . 1 . . . . . . . . 5566 1 143 . 1 1 38 38 TRP HE1 H 1 10.37 0.00 . 1 . . . . . . . . 5566 1 144 . 1 1 38 38 TRP HE3 H 1 7.80 0.00 . 1 . . . . . . . . 5566 1 145 . 1 1 38 38 TRP HZ3 H 1 7.22 0.00 . 1 . . . . . . . . 5566 1 146 . 1 1 38 38 TRP CA C 13 55.46 0.00 . 1 . . . . . . . . 5566 1 147 . 1 1 38 38 TRP CB C 13 30.52 0.00 . 1 . . . . . . . . 5566 1 148 . 1 1 38 38 TRP CD1 C 13 126.87 0.00 . 1 . . . . . . . . 5566 1 149 . 1 1 38 38 TRP CE3 C 13 121.86 0.00 . 1 . . . . . . . . 5566 1 150 . 1 1 38 38 TRP CZ3 C 13 122.70 0.00 . 1 . . . . . . . . 5566 1 151 . 1 1 38 38 TRP N N 15 118.80 0.00 . 1 . . . . . . . . 5566 1 152 . 1 1 38 38 TRP NE1 N 15 129.21 0.00 . 1 . . . . . . . . 5566 1 153 . 1 1 39 39 LEU H H 1 8.93 0.00 . 1 . . . . . . . . 5566 1 154 . 1 1 39 39 LEU HA H 1 4.10 0.00 . 1 . . . . . . . . 5566 1 155 . 1 1 39 39 LEU HB2 H 1 1.11 0.00 . 1 . . . . . . . . 5566 1 156 . 1 1 39 39 LEU HB3 H 1 1.28 0.00 . 1 . . . . . . . . 5566 1 157 . 1 1 39 39 LEU HG H 1 1.60 0.00 . 1 . . . . . . . . 5566 1 158 . 1 1 39 39 LEU HD11 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 159 . 1 1 39 39 LEU HD12 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 160 . 1 1 39 39 LEU HD13 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 161 . 1 1 39 39 LEU HD21 H 1 0.97 0.00 . 1 . . . . . . . . 5566 1 162 . 1 1 39 39 LEU HD22 H 1 0.97 0.00 . 1 . . . . . . . . 5566 1 163 . 1 1 39 39 LEU HD23 H 1 0.97 0.00 . 1 . . . . . . . . 5566 1 164 . 1 1 39 39 LEU CA C 13 56.41 0.00 . 1 . . . . . . . . 5566 1 165 . 1 1 39 39 LEU CB C 13 42.76 0.00 . 1 . . . . . . . . 5566 1 166 . 1 1 39 39 LEU CD1 C 13 22.80 0.00 . 1 . . . . . . . . 5566 1 167 . 1 1 39 39 LEU CD2 C 13 25.55 0.00 . 1 . . . . . . . . 5566 1 168 . 1 1 39 39 LEU N N 15 119.91 0.00 . 1 . . . . . . . . 5566 1 169 . 1 1 40 40 HIS H H 1 7.14 0.00 . 1 . . . . . . . . 5566 1 170 . 1 1 40 40 HIS HA H 1 5.12 0.00 . 1 . . . . . . . . 5566 1 171 . 1 1 40 40 HIS HB3 H 1 2.75 0.00 . 1 . . . . . . . . 5566 1 172 . 1 1 40 40 HIS CA C 13 52.93 0.00 . 1 . . . . . . . . 5566 1 173 . 1 1 40 40 HIS CB C 13 31.97 0.00 . 1 . . . . . . . . 5566 1 174 . 1 1 40 40 HIS N N 15 115.04 0.00 . 1 . . . . . . . . 5566 1 175 . 1 1 41 41 PRO CA C 13 62.29 0.00 . 1 . . . . . . . . 5566 1 176 . 1 1 41 41 PRO CB C 13 31.92 0.00 . 1 . . . . . . . . 5566 1 177 . 1 1 42 42 ASN H H 1 8.98 0.00 . 1 . . . . . . . . 5566 1 178 . 1 1 42 42 ASN HA H 1 4.07 0.00 . 1 . . . . . . . . 5566 1 179 . 1 1 42 42 ASN HB2 H 1 2.68 0.00 . 1 . . . . . . . . 5566 1 180 . 1 1 42 42 ASN HB3 H 1 2.89 0.00 . 1 . . . . . . . . 5566 1 181 . 1 1 42 42 ASN CA C 13 56.12 0.00 . 1 . . . . . . . . 5566 1 182 . 1 1 42 42 ASN CB C 13 37.58 0.00 . 1 . . . . . . . . 5566 1 183 . 1 1 42 42 ASN N N 15 123.90 0.00 . 1 . . . . . . . . 5566 1 184 . 1 1 43 43 ASP H H 1 8.74 0.00 . 1 . . . . . . . . 5566 1 185 . 1 1 43 43 ASP HA H 1 4.20 0.00 . 1 . . . . . . . . 5566 1 186 . 1 1 43 43 ASP HB2 H 1 2.58 0.00 . 1 . . . . . . . . 5566 1 187 . 1 1 43 43 ASP HB3 H 1 2.68 0.00 . 1 . . . . . . . . 5566 1 188 . 1 1 43 43 ASP CA C 13 56.52 0.00 . 1 . . . . . . . . 5566 1 189 . 1 1 43 43 ASP CB C 13 39.70 0.00 . 1 . . . . . . . . 5566 1 190 . 1 1 43 43 ASP N N 15 115.48 0.00 . 1 . . . . . . . . 5566 1 191 . 1 1 44 44 LYS H H 1 7.21 0.00 . 1 . . . . . . . . 5566 1 192 . 1 1 44 44 LYS HA H 1 4.12 0.00 . 1 . . . . . . . . 5566 1 193 . 1 1 44 44 LYS HB2 H 1 1.74 0.00 . 1 . . . . . . . . 5566 1 194 . 1 1 44 44 LYS HB3 H 1 1.85 0.00 . 1 . . . . . . . . 5566 1 195 . 1 1 44 44 LYS HG2 H 1 1.30 0.00 . 1 . . . . . . . . 5566 1 196 . 1 1 44 44 LYS HG3 H 1 1.47 0.00 . 1 . . . . . . . . 5566 1 197 . 1 1 44 44 LYS HD3 H 1 1.67 0.00 . 1 . . . . . . . . 5566 1 198 . 1 1 44 44 LYS HE3 H 1 3.00 0.00 . 1 . . . . . . . . 5566 1 199 . 1 1 44 44 LYS CA C 13 58.52 0.00 . 1 . . . . . . . . 5566 1 200 . 1 1 44 44 LYS CB C 13 32.87 0.00 . 1 . . . . . . . . 5566 1 201 . 1 1 44 44 LYS CG C 13 25.11 0.00 . 1 . . . . . . . . 5566 1 202 . 1 1 44 44 LYS CD C 13 29.11 0.00 . 1 . . . . . . . . 5566 1 203 . 1 1 44 44 LYS CE C 13 41.73 0.00 . 1 . . . . . . . . 5566 1 204 . 1 1 44 44 LYS N N 15 119.47 0.00 . 1 . . . . . . . . 5566 1 205 . 1 1 45 45 VAL H H 1 6.93 0.00 . 1 . . . . . . . . 5566 1 206 . 1 1 45 45 VAL HA H 1 3.41 0.00 . 1 . . . . . . . . 5566 1 207 . 1 1 45 45 VAL HB H 1 1.80 0.00 . 1 . . . . . . . . 5566 1 208 . 1 1 45 45 VAL HG11 H 1 0.71 0.00 . 1 . . . . . . . . 5566 1 209 . 1 1 45 45 VAL HG12 H 1 0.71 0.00 . 1 . . . . . . . . 5566 1 210 . 1 1 45 45 VAL HG13 H 1 0.71 0.00 . 1 . . . . . . . . 5566 1 211 . 1 1 45 45 VAL HG21 H 1 0.66 0.00 . 1 . . . . . . . . 5566 1 212 . 1 1 45 45 VAL HG22 H 1 0.66 0.00 . 1 . . . . . . . . 5566 1 213 . 1 1 45 45 VAL HG23 H 1 0.66 0.00 . 1 . . . . . . . . 5566 1 214 . 1 1 45 45 VAL CA C 13 65.82 0.00 . 1 . . . . . . . . 5566 1 215 . 1 1 45 45 VAL CB C 13 31.86 0.00 . 1 . . . . . . . . 5566 1 216 . 1 1 45 45 VAL CG1 C 13 22.52 0.00 . 1 . . . . . . . . 5566 1 217 . 1 1 45 45 VAL N N 15 117.70 0.00 . 1 . . . . . . . . 5566 1 218 . 1 1 46 46 MET H H 1 7.81 0.00 . 1 . . . . . . . . 5566 1 219 . 1 1 46 46 MET HA H 1 4.66 0.00 . 1 . . . . . . . . 5566 1 220 . 1 1 46 46 MET HB2 H 1 1.86 0.00 . 1 . . . . . . . . 5566 1 221 . 1 1 46 46 MET HB3 H 1 2.19 0.00 . 1 . . . . . . . . 5566 1 222 . 1 1 46 46 MET HG2 H 1 2.44 0.00 . 1 . . . . . . . . 5566 1 223 . 1 1 46 46 MET HG3 H 1 2.60 0.00 . 1 . . . . . . . . 5566 1 224 . 1 1 46 46 MET HE1 H 1 2.04 0.00 . 1 . . . . . . . . 5566 1 225 . 1 1 46 46 MET HE2 H 1 2.04 0.00 . 1 . . . . . . . . 5566 1 226 . 1 1 46 46 MET HE3 H 1 2.04 0.00 . 1 . . . . . . . . 5566 1 227 . 1 1 46 46 MET CA C 13 56.64 0.00 . 1 . . . . . . . . 5566 1 228 . 1 1 46 46 MET CB C 13 34.28 0.00 . 1 . . . . . . . . 5566 1 229 . 1 1 46 46 MET CG C 13 32.40 0.00 . 1 . . . . . . . . 5566 1 230 . 1 1 46 46 MET CE C 13 16.70 0.00 . 1 . . . . . . . . 5566 1 231 . 1 1 46 46 MET N N 15 113.71 0.00 . 1 . . . . . . . . 5566 1 232 . 1 1 47 47 GLY H H 1 7.12 0.00 . 1 . . . . . . . . 5566 1 233 . 1 1 47 47 GLY HA2 H 1 4.32 0.00 . 1 . . . . . . . . 5566 1 234 . 1 1 47 47 GLY HA3 H 1 3.86 0.00 . 1 . . . . . . . . 5566 1 235 . 1 1 47 47 GLY CA C 13 43.46 0.00 . 1 . . . . . . . . 5566 1 236 . 1 1 47 47 GLY N N 15 107.10 0.00 . 1 . . . . . . . . 5566 1 237 . 1 1 48 48 PRO HA H 1 4.31 0.00 . 1 . . . . . . . . 5566 1 238 . 1 1 48 48 PRO HB3 H 1 2.01 0.00 . 1 . . . . . . . . 5566 1 239 . 1 1 48 48 PRO HG3 H 1 2.12 0.00 . 1 . . . . . . . . 5566 1 240 . 1 1 48 48 PRO HD2 H 1 4.13 0.00 . 1 . . . . . . . . 5566 1 241 . 1 1 48 48 PRO HD3 H 1 3.71 0.00 . 1 . . . . . . . . 5566 1 242 . 1 1 48 48 PRO CA C 13 63.70 0.00 . 1 . . . . . . . . 5566 1 243 . 1 1 48 48 PRO CB C 13 31.93 0.00 . 1 . . . . . . . . 5566 1 244 . 1 1 48 48 PRO CG C 13 26.75 0.00 . 1 . . . . . . . . 5566 1 245 . 1 1 48 48 PRO CD C 13 51.23 0.00 . 1 . . . . . . . . 5566 1 246 . 1 1 49 49 GLY H H 1 7.93 0.00 . 1 . . . . . . . . 5566 1 247 . 1 1 49 49 GLY HA2 H 1 3.73 0.00 . 1 . . . . . . . . 5566 1 248 . 1 1 49 49 GLY HA3 H 1 3.97 0.00 . 1 . . . . . . . . 5566 1 249 . 1 1 49 49 GLY CA C 13 43.66 0.00 . 1 . . . . . . . . 5566 1 250 . 1 1 49 49 GLY N N 15 106.62 0.00 . 1 . . . . . . . . 5566 1 251 . 1 1 50 50 VAL H H 1 8.26 0.00 . 1 . . . . . . . . 5566 1 252 . 1 1 50 50 VAL HA H 1 3.97 0.00 . 1 . . . . . . . . 5566 1 253 . 1 1 50 50 VAL HB H 1 1.46 0.00 . 1 . . . . . . . . 5566 1 254 . 1 1 50 50 VAL HG11 H 1 0.19 0.00 . 1 . . . . . . . . 5566 1 255 . 1 1 50 50 VAL HG12 H 1 0.19 0.00 . 1 . . . . . . . . 5566 1 256 . 1 1 50 50 VAL HG13 H 1 0.19 0.00 . 1 . . . . . . . . 5566 1 257 . 1 1 50 50 VAL CA C 13 60.88 0.00 . 1 . . . . . . . . 5566 1 258 . 1 1 50 50 VAL CB C 13 33.81 0.00 . 1 . . . . . . . . 5566 1 259 . 1 1 50 50 VAL CG1 C 13 20.40 0.00 . 1 . . . . . . . . 5566 1 260 . 1 1 50 50 VAL N N 15 117.70 0.00 . 1 . . . . . . . . 5566 1 261 . 1 1 51 51 SER H H 1 8.15 0.00 . 1 . . . . . . . . 5566 1 262 . 1 1 51 51 SER HA H 1 5.95 0.00 . 1 . . . . . . . . 5566 1 263 . 1 1 51 51 SER HB2 H 1 3.46 0.00 . 1 . . . . . . . . 5566 1 264 . 1 1 51 51 SER HB3 H 1 3.56 0.00 . 1 . . . . . . . . 5566 1 265 . 1 1 51 51 SER CA C 13 57.00 0.00 . 1 . . . . . . . . 5566 1 266 . 1 1 51 51 SER CB C 13 65.82 0.00 . 1 . . . . . . . . 5566 1 267 . 1 1 51 51 SER N N 15 120.58 0.00 . 1 . . . . . . . . 5566 1 268 . 1 1 52 52 TYR H H 1 9.22 0.00 . 1 . . . . . . . . 5566 1 269 . 1 1 52 52 TYR HA H 1 4.72 0.00 . 1 . . . . . . . . 5566 1 270 . 1 1 52 52 TYR HB2 H 1 2.44 0.00 . 1 . . . . . . . . 5566 1 271 . 1 1 52 52 TYR HB3 H 1 2.88 0.00 . 1 . . . . . . . . 5566 1 272 . 1 1 52 52 TYR HD1 H 1 6.98 0.00 . 3 . . . . . . . . 5566 1 273 . 1 1 52 52 TYR HE1 H 1 6.66 0.00 . 3 . . . . . . . . 5566 1 274 . 1 1 52 52 TYR CA C 13 56.72 0.00 . 1 . . . . . . . . 5566 1 275 . 1 1 52 52 TYR CB C 13 43.76 0.00 . 1 . . . . . . . . 5566 1 276 . 1 1 52 52 TYR CD1 C 13 133.13 0.00 . 3 . . . . . . . . 5566 1 277 . 1 1 52 52 TYR CE1 C 13 117.27 0.00 . 3 . . . . . . . . 5566 1 278 . 1 1 52 52 TYR N N 15 120.35 0.00 . 1 . . . . . . . . 5566 1 279 . 1 1 53 53 LEU H H 1 8.55 0.00 . 1 . . . . . . . . 5566 1 280 . 1 1 53 53 LEU HA H 1 5.30 0.00 . 1 . . . . . . . . 5566 1 281 . 1 1 53 53 LEU HB2 H 1 1.62 0.00 . 1 . . . . . . . . 5566 1 282 . 1 1 53 53 LEU HB3 H 1 1.82 0.00 . 1 . . . . . . . . 5566 1 283 . 1 1 53 53 LEU HD11 H 1 0.92 0.00 . 1 . . . . . . . . 5566 1 284 . 1 1 53 53 LEU HD12 H 1 0.92 0.00 . 1 . . . . . . . . 5566 1 285 . 1 1 53 53 LEU HD13 H 1 0.92 0.00 . 1 . . . . . . . . 5566 1 286 . 1 1 53 53 LEU CA C 13 54.76 0.00 . 1 . . . . . . . . 5566 1 287 . 1 1 53 53 LEU CB C 13 41.34 0.00 . 1 . . . . . . . . 5566 1 288 . 1 1 53 53 LEU CD1 C 13 24.17 0.00 . 1 . . . . . . . . 5566 1 289 . 1 1 53 53 LEU N N 15 125.64 0.00 . 1 . . . . . . . . 5566 1 290 . 1 1 54 54 VAL H H 1 8.51 0.00 . 1 . . . . . . . . 5566 1 291 . 1 1 54 54 VAL HA H 1 4.95 0.00 . 1 . . . . . . . . 5566 1 292 . 1 1 54 54 VAL HB H 1 2.55 0.00 . 1 . . . . . . . . 5566 1 293 . 1 1 54 54 VAL HG11 H 1 0.92 0.00 . 1 . . . . . . . . 5566 1 294 . 1 1 54 54 VAL HG12 H 1 0.92 0.00 . 1 . . . . . . . . 5566 1 295 . 1 1 54 54 VAL HG13 H 1 0.92 0.00 . 1 . . . . . . . . 5566 1 296 . 1 1 54 54 VAL HG21 H 1 0.83 0.00 . 1 . . . . . . . . 5566 1 297 . 1 1 54 54 VAL HG22 H 1 0.83 0.00 . 1 . . . . . . . . 5566 1 298 . 1 1 54 54 VAL HG23 H 1 0.83 0.00 . 1 . . . . . . . . 5566 1 299 . 1 1 54 54 VAL CA C 13 58.76 0.00 . 1 . . . . . . . . 5566 1 300 . 1 1 54 54 VAL CB C 13 34.99 0.00 . 1 . . . . . . . . 5566 1 301 . 1 1 54 54 VAL CG1 C 13 23.23 0.00 . 1 . . . . . . . . 5566 1 302 . 1 1 54 54 VAL CG2 C 13 19.98 0.00 . 1 . . . . . . . . 5566 1 303 . 1 1 54 54 VAL N N 15 116.81 0.00 . 1 . . . . . . . . 5566 1 304 . 1 1 55 55 ARG H H 1 8.73 0.00 . 1 . . . . . . . . 5566 1 305 . 1 1 55 55 ARG HA H 1 5.20 0.00 . 1 . . . . . . . . 5566 1 306 . 1 1 55 55 ARG HB3 H 1 1.81 0.00 . 1 . . . . . . . . 5566 1 307 . 1 1 55 55 ARG HG2 H 1 1.32 0.00 . 1 . . . . . . . . 5566 1 308 . 1 1 55 55 ARG HG3 H 1 1.46 0.00 . 1 . . . . . . . . 5566 1 309 . 1 1 55 55 ARG HD3 H 1 3.29 0.00 . 1 . . . . . . . . 5566 1 310 . 1 1 55 55 ARG CA C 13 55.46 0.00 . 1 . . . . . . . . 5566 1 311 . 1 1 55 55 ARG CB C 13 33.58 0.00 . 1 . . . . . . . . 5566 1 312 . 1 1 55 55 ARG CG C 13 27.70 0.00 . 1 . . . . . . . . 5566 1 313 . 1 1 55 55 ARG CD C 13 39.78 0.00 . 1 . . . . . . . . 5566 1 314 . 1 1 55 55 ARG N N 15 120.13 0.00 . 1 . . . . . . . . 5566 1 315 . 1 1 56 56 TYR H H 1 9.13 0.00 . 1 . . . . . . . . 5566 1 316 . 1 1 56 56 TYR HA H 1 4.80 0.00 . 1 . . . . . . . . 5566 1 317 . 1 1 56 56 TYR HB2 H 1 2.96 0.00 . 1 . . . . . . . . 5566 1 318 . 1 1 56 56 TYR HB3 H 1 3.26 0.00 . 1 . . . . . . . . 5566 1 319 . 1 1 56 56 TYR HD1 H 1 7.14 0.00 . 3 . . . . . . . . 5566 1 320 . 1 1 56 56 TYR HE1 H 1 6.96 0.00 . 3 . . . . . . . . 5566 1 321 . 1 1 56 56 TYR CA C 13 58.12 0.00 . 1 . . . . . . . . 5566 1 322 . 1 1 56 56 TYR CB C 13 39.48 0.00 . 1 . . . . . . . . 5566 1 323 . 1 1 56 56 TYR CD1 C 13 133.13 0.00 . 3 . . . . . . . . 5566 1 324 . 1 1 56 56 TYR N N 15 128.55 0.00 . 1 . . . . . . . . 5566 1 325 . 1 1 57 57 MET H H 1 8.78 0.00 . 1 . . . . . . . . 5566 1 326 . 1 1 57 57 MET HA H 1 4.88 0.00 . 1 . . . . . . . . 5566 1 327 . 1 1 57 57 MET HB3 H 1 2.54 0.00 . 1 . . . . . . . . 5566 1 328 . 1 1 57 57 MET HG3 H 1 2.02 0.00 . 1 . . . . . . . . 5566 1 329 . 1 1 57 57 MET HE1 H 1 2.08 0.00 . 1 . . . . . . . . 5566 1 330 . 1 1 57 57 MET HE2 H 1 2.08 0.00 . 1 . . . . . . . . 5566 1 331 . 1 1 57 57 MET HE3 H 1 2.08 0.00 . 1 . . . . . . . . 5566 1 332 . 1 1 57 57 MET CA C 13 53.03 0.00 . 1 . . . . . . . . 5566 1 333 . 1 1 57 57 MET CB C 13 30.51 0.00 . 1 . . . . . . . . 5566 1 334 . 1 1 57 57 MET CE C 13 17.51 0.00 . 1 . . . . . . . . 5566 1 335 . 1 1 57 57 MET N N 15 123.23 0.00 . 1 . . . . . . . . 5566 1 336 . 1 1 58 58 GLY H H 1 5.37 0.00 . 1 . . . . . . . . 5566 1 337 . 1 1 58 58 GLY HA2 H 1 3.57 0.00 . 1 . . . . . . . . 5566 1 338 . 1 1 58 58 GLY HA3 H 1 4.46 0.00 . 1 . . . . . . . . 5566 1 339 . 1 1 58 58 GLY CA C 13 42.27 0.00 . 1 . . . . . . . . 5566 1 340 . 1 1 58 58 GLY N N 15 128.33 0.00 . 1 . . . . . . . . 5566 1 341 . 1 1 59 59 CYS H H 1 7.67 0.00 . 1 . . . . . . . . 5566 1 342 . 1 1 59 59 CYS HA H 1 5.71 0.00 . 1 . . . . . . . . 5566 1 343 . 1 1 59 59 CYS HB2 H 1 1.57 0.00 . 1 . . . . . . . . 5566 1 344 . 1 1 59 59 CYS HB3 H 1 2.69 0.00 . 1 . . . . . . . . 5566 1 345 . 1 1 59 59 CYS CA C 13 54.05 0.00 . 1 . . . . . . . . 5566 1 346 . 1 1 59 59 CYS CB C 13 32.14 0.00 . 1 . . . . . . . . 5566 1 347 . 1 1 59 59 CYS N N 15 107.51 0.00 . 1 . . . . . . . . 5566 1 348 . 1 1 60 60 VAL H H 1 8.12 0.00 . 1 . . . . . . . . 5566 1 349 . 1 1 60 60 VAL HA H 1 4.61 0.00 . 1 . . . . . . . . 5566 1 350 . 1 1 60 60 VAL HB H 1 1.59 0.00 . 1 . . . . . . . . 5566 1 351 . 1 1 60 60 VAL HG11 H 1 0.85 0.00 . 1 . . . . . . . . 5566 1 352 . 1 1 60 60 VAL HG12 H 1 0.85 0.00 . 1 . . . . . . . . 5566 1 353 . 1 1 60 60 VAL HG13 H 1 0.85 0.00 . 1 . . . . . . . . 5566 1 354 . 1 1 60 60 VAL HG21 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 355 . 1 1 60 60 VAL HG22 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 356 . 1 1 60 60 VAL HG23 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 357 . 1 1 60 60 VAL CA C 13 60.17 0.00 . 1 . . . . . . . . 5566 1 358 . 1 1 60 60 VAL CB C 13 35.46 0.00 . 1 . . . . . . . . 5566 1 359 . 1 1 60 60 VAL CG1 C 13 22.28 0.00 . 1 . . . . . . . . 5566 1 360 . 1 1 60 60 VAL CG2 C 13 21.81 0.00 . 1 . . . . . . . . 5566 1 361 . 1 1 60 60 VAL N N 15 117.25 0.00 . 1 . . . . . . . . 5566 1 362 . 1 1 61 61 GLU H H 1 8.45 0.00 . 1 . . . . . . . . 5566 1 363 . 1 1 61 61 GLU HA H 1 4.19 0.00 . 1 . . . . . . . . 5566 1 364 . 1 1 61 61 GLU HB3 H 1 2.08 0.00 . 1 . . . . . . . . 5566 1 365 . 1 1 61 61 GLU HG2 H 1 2.27 0.00 . 1 . . . . . . . . 5566 1 366 . 1 1 61 61 GLU HG3 H 1 2.58 0.00 . 1 . . . . . . . . 5566 1 367 . 1 1 61 61 GLU CA C 13 57.44 0.00 . 1 . . . . . . . . 5566 1 368 . 1 1 61 61 GLU CB C 13 31.70 0.00 . 1 . . . . . . . . 5566 1 369 . 1 1 61 61 GLU CG C 13 36.64 0.00 . 1 . . . . . . . . 5566 1 370 . 1 1 61 61 GLU N N 15 127.88 0.00 . 1 . . . . . . . . 5566 1 371 . 1 1 62 62 VAL H H 1 8.24 0.00 . 1 . . . . . . . . 5566 1 372 . 1 1 62 62 VAL HA H 1 4.62 0.00 . 1 . . . . . . . . 5566 1 373 . 1 1 62 62 VAL HB H 1 1.61 0.00 . 1 . . . . . . . . 5566 1 374 . 1 1 62 62 VAL HG11 H 1 0.97 0.00 . 1 . . . . . . . . 5566 1 375 . 1 1 62 62 VAL HG12 H 1 0.97 0.00 . 1 . . . . . . . . 5566 1 376 . 1 1 62 62 VAL HG13 H 1 0.97 0.00 . 1 . . . . . . . . 5566 1 377 . 1 1 62 62 VAL HG21 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 378 . 1 1 62 62 VAL HG22 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 379 . 1 1 62 62 VAL HG23 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 380 . 1 1 62 62 VAL CA C 13 61.58 0.00 . 1 . . . . . . . . 5566 1 381 . 1 1 62 62 VAL CB C 13 33.64 0.00 . 1 . . . . . . . . 5566 1 382 . 1 1 62 62 VAL CG1 C 13 21.90 0.00 . 1 . . . . . . . . 5566 1 383 . 1 1 62 62 VAL N N 15 123.68 0.00 . 1 . . . . . . . . 5566 1 384 . 1 1 63 63 LEU H H 1 9.17 0.00 . 1 . . . . . . . . 5566 1 385 . 1 1 63 63 LEU HA H 1 4.26 0.00 . 1 . . . . . . . . 5566 1 386 . 1 1 63 63 LEU HB3 H 1 1.61 0.00 . 1 . . . . . . . . 5566 1 387 . 1 1 63 63 LEU HG H 1 1.33 0.00 . 1 . . . . . . . . 5566 1 388 . 1 1 63 63 LEU HD11 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 389 . 1 1 63 63 LEU HD12 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 390 . 1 1 63 63 LEU HD13 H 1 0.81 0.00 . 1 . . . . . . . . 5566 1 391 . 1 1 63 63 LEU CA C 13 56.41 0.00 . 1 . . . . . . . . 5566 1 392 . 1 1 63 63 LEU CB C 13 41.88 0.00 . 1 . . . . . . . . 5566 1 393 . 1 1 63 63 LEU CD1 C 13 22.29 0.00 . 1 . . . . . . . . 5566 1 394 . 1 1 63 63 LEU N N 15 126.12 0.00 . 1 . . . . . . . . 5566 1 395 . 1 1 64 64 GLN H H 1 6.85 0.00 . 1 . . . . . . . . 5566 1 396 . 1 1 64 64 GLN HA H 1 4.59 0.00 . 1 . . . . . . . . 5566 1 397 . 1 1 64 64 GLN HB2 H 1 1.59 0.00 . 1 . . . . . . . . 5566 1 398 . 1 1 64 64 GLN HB3 H 1 2.06 0.00 . 1 . . . . . . . . 5566 1 399 . 1 1 64 64 GLN HG3 H 1 2.29 0.00 . 1 . . . . . . . . 5566 1 400 . 1 1 64 64 GLN CA C 13 53.58 0.00 . 1 . . . . . . . . 5566 1 401 . 1 1 64 64 GLN CB C 13 32.40 0.00 . 1 . . . . . . . . 5566 1 402 . 1 1 64 64 GLN N N 15 114.90 0.00 . 1 . . . . . . . . 5566 1 403 . 1 1 65 65 SER H H 1 7.97 0.00 . 1 . . . . . . . . 5566 1 404 . 1 1 65 65 SER N N 15 114.22 0.00 . 1 . . . . . . . . 5566 1 405 . 1 1 67 67 ARG H H 1 8.30 0.00 . 1 . . . . . . . . 5566 1 406 . 1 1 67 67 ARG CA C 13 57.98 0.00 . 1 . . . . . . . . 5566 1 407 . 1 1 67 67 ARG CB C 13 29.26 0.00 . 1 . . . . . . . . 5566 1 408 . 1 1 67 67 ARG CD C 13 42.76 0.00 . 1 . . . . . . . . 5566 1 409 . 1 1 67 67 ARG N N 15 116.61 0.00 . 1 . . . . . . . . 5566 1 410 . 1 1 68 68 ALA H H 1 7.48 0.00 . 1 . . . . . . . . 5566 1 411 . 1 1 68 68 ALA HA H 1 4.35 0.00 . 1 . . . . . . . . 5566 1 412 . 1 1 68 68 ALA HB1 H 1 1.43 0.00 . 1 . . . . . . . . 5566 1 413 . 1 1 68 68 ALA HB2 H 1 1.43 0.00 . 1 . . . . . . . . 5566 1 414 . 1 1 68 68 ALA HB3 H 1 1.43 0.00 . 1 . . . . . . . . 5566 1 415 . 1 1 68 68 ALA CA C 13 51.46 0.00 . 1 . . . . . . . . 5566 1 416 . 1 1 68 68 ALA CB C 13 18.99 0.00 . 1 . . . . . . . . 5566 1 417 . 1 1 68 68 ALA N N 15 119.12 0.00 . 1 . . . . . . . . 5566 1 418 . 1 1 69 69 LEU H H 1 7.23 0.00 . 1 . . . . . . . . 5566 1 419 . 1 1 69 69 LEU HA H 1 4.57 0.00 . 1 . . . . . . . . 5566 1 420 . 1 1 69 69 LEU HB3 H 1 1.82 0.00 . 1 . . . . . . . . 5566 1 421 . 1 1 69 69 LEU HD11 H 1 0.73 0.00 . 1 . . . . . . . . 5566 1 422 . 1 1 69 69 LEU HD12 H 1 0.73 0.00 . 1 . . . . . . . . 5566 1 423 . 1 1 69 69 LEU HD13 H 1 0.73 0.00 . 1 . . . . . . . . 5566 1 424 . 1 1 69 69 LEU CA C 13 52.90 0.00 . 1 . . . . . . . . 5566 1 425 . 1 1 69 69 LEU CB C 13 42.86 0.00 . 1 . . . . . . . . 5566 1 426 . 1 1 69 69 LEU CD1 C 13 22.21 0.00 . 1 . . . . . . . . 5566 1 427 . 1 1 69 69 LEU N N 15 118.80 0.00 . 1 . . . . . . . . 5566 1 428 . 1 1 70 70 ASP H H 1 8.34 0.00 . 1 . . . . . . . . 5566 1 429 . 1 1 70 70 ASP HA H 1 4.57 0.00 . 1 . . . . . . . . 5566 1 430 . 1 1 70 70 ASP HB2 H 1 2.79 0.00 . 1 . . . . . . . . 5566 1 431 . 1 1 70 70 ASP HB3 H 1 3.14 0.00 . 1 . . . . . . . . 5566 1 432 . 1 1 70 70 ASP CA C 13 52.88 0.00 . 1 . . . . . . . . 5566 1 433 . 1 1 70 70 ASP CB C 13 40.64 0.00 . 1 . . . . . . . . 5566 1 434 . 1 1 70 70 ASP N N 15 121.20 0.00 . 1 . . . . . . . . 5566 1 435 . 1 1 71 71 PHE CA C 13 62.34 0.00 . 1 . . . . . . . . 5566 1 436 . 1 1 71 71 PHE CB C 13 39.00 0.00 . 1 . . . . . . . . 5566 1 437 . 1 1 72 72 ASN H H 1 8.73 0.00 . 1 . . . . . . . . 5566 1 438 . 1 1 72 72 ASN HA H 1 4.36 0.00 . 1 . . . . . . . . 5566 1 439 . 1 1 72 72 ASN HB2 H 1 2.79 0.00 . 1 . . . . . . . . 5566 1 440 . 1 1 72 72 ASN HB3 H 1 2.87 0.00 . 1 . . . . . . . . 5566 1 441 . 1 1 72 72 ASN CA C 13 56.02 0.00 . 1 . . . . . . . . 5566 1 442 . 1 1 72 72 ASN CB C 13 37.73 0.00 . 1 . . . . . . . . 5566 1 443 . 1 1 72 72 ASN N N 15 118.14 0.00 . 1 . . . . . . . . 5566 1 444 . 1 1 73 73 THR H H 1 8.41 0.00 . 1 . . . . . . . . 5566 1 445 . 1 1 73 73 THR HA H 1 3.88 0.00 . 1 . . . . . . . . 5566 1 446 . 1 1 73 73 THR HB H 1 4.09 0.00 . 1 . . . . . . . . 5566 1 447 . 1 1 73 73 THR HG21 H 1 1.17 0.00 . 1 . . . . . . . . 5566 1 448 . 1 1 73 73 THR HG22 H 1 1.17 0.00 . 1 . . . . . . . . 5566 1 449 . 1 1 73 73 THR HG23 H 1 1.17 0.00 . 1 . . . . . . . . 5566 1 450 . 1 1 73 73 THR CA C 13 66.76 0.00 . 1 . . . . . . . . 5566 1 451 . 1 1 73 73 THR CB C 13 67.17 0.00 . 1 . . . . . . . . 5566 1 452 . 1 1 73 73 THR CG2 C 13 22.39 0.00 . 1 . . . . . . . . 5566 1 453 . 1 1 73 73 THR N N 15 119.47 0.00 . 1 . . . . . . . . 5566 1 454 . 1 1 74 74 ARG H H 1 8.37 0.00 . 1 . . . . . . . . 5566 1 455 . 1 1 74 74 ARG HA H 1 3.49 0.00 . 1 . . . . . . . . 5566 1 456 . 1 1 74 74 ARG CA C 13 60.20 0.00 . 1 . . . . . . . . 5566 1 457 . 1 1 74 74 ARG CB C 13 28.73 0.00 . 1 . . . . . . . . 5566 1 458 . 1 1 74 74 ARG N N 15 121.24 0.00 . 1 . . . . . . . . 5566 1 459 . 1 1 75 75 THR H H 1 7.62 0.00 . 1 . . . . . . . . 5566 1 460 . 1 1 75 75 THR HA H 1 3.87 0.00 . 1 . . . . . . . . 5566 1 461 . 1 1 75 75 THR HB H 1 4.25 0.00 . 1 . . . . . . . . 5566 1 462 . 1 1 75 75 THR HG21 H 1 1.16 0.00 . 1 . . . . . . . . 5566 1 463 . 1 1 75 75 THR HG22 H 1 1.16 0.00 . 1 . . . . . . . . 5566 1 464 . 1 1 75 75 THR HG23 H 1 1.16 0.00 . 1 . . . . . . . . 5566 1 465 . 1 1 75 75 THR CA C 13 66.24 0.00 . 1 . . . . . . . . 5566 1 466 . 1 1 75 75 THR CB C 13 68.54 0.00 . 1 . . . . . . . . 5566 1 467 . 1 1 75 75 THR CG2 C 13 21.61 0.00 . 1 . . . . . . . . 5566 1 468 . 1 1 75 75 THR N N 15 112.85 0.00 . 1 . . . . . . . . 5566 1 469 . 1 1 76 76 GLN H H 1 7.86 0.00 . 1 . . . . . . . . 5566 1 470 . 1 1 76 76 GLN HA H 1 3.97 0.00 . 1 . . . . . . . . 5566 1 471 . 1 1 76 76 GLN HB3 H 1 2.19 0.00 . 1 . . . . . . . . 5566 1 472 . 1 1 76 76 GLN HG2 H 1 2.40 0.00 . 1 . . . . . . . . 5566 1 473 . 1 1 76 76 GLN HG3 H 1 2.51 0.00 . 1 . . . . . . . . 5566 1 474 . 1 1 76 76 GLN CA C 13 59.23 0.00 . 1 . . . . . . . . 5566 1 475 . 1 1 76 76 GLN CB C 13 28.17 0.00 . 1 . . . . . . . . 5566 1 476 . 1 1 76 76 GLN CG C 13 33.58 0.00 . 1 . . . . . . . . 5566 1 477 . 1 1 76 76 GLN N N 15 122.79 0.00 . 1 . . . . . . . . 5566 1 478 . 1 1 77 77 VAL H H 1 8.33 0.00 . 1 . . . . . . . . 5566 1 479 . 1 1 77 77 VAL HA H 1 3.50 0.00 . 1 . . . . . . . . 5566 1 480 . 1 1 77 77 VAL HB H 1 2.21 0.00 . 1 . . . . . . . . 5566 1 481 . 1 1 77 77 VAL HG11 H 1 0.94 0.00 . 1 . . . . . . . . 5566 1 482 . 1 1 77 77 VAL HG12 H 1 0.94 0.00 . 1 . . . . . . . . 5566 1 483 . 1 1 77 77 VAL HG13 H 1 0.94 0.00 . 1 . . . . . . . . 5566 1 484 . 1 1 77 77 VAL HG21 H 1 0.75 0.00 . 1 . . . . . . . . 5566 1 485 . 1 1 77 77 VAL HG22 H 1 0.75 0.00 . 1 . . . . . . . . 5566 1 486 . 1 1 77 77 VAL HG23 H 1 0.75 0.00 . 1 . . . . . . . . 5566 1 487 . 1 1 77 77 VAL CA C 13 66.76 0.00 . 1 . . . . . . . . 5566 1 488 . 1 1 77 77 VAL CB C 13 31.20 0.00 . 1 . . . . . . . . 5566 1 489 . 1 1 77 77 VAL CG1 C 13 24.03 0.00 . 1 . . . . . . . . 5566 1 490 . 1 1 77 77 VAL CG2 C 13 20.87 0.00 . 1 . . . . . . . . 5566 1 491 . 1 1 77 77 VAL N N 15 119.91 0.00 . 1 . . . . . . . . 5566 1 492 . 1 1 78 78 THR H H 1 7.61 0.00 . 1 . . . . . . . . 5566 1 493 . 1 1 78 78 THR HA H 1 3.93 0.00 . 1 . . . . . . . . 5566 1 494 . 1 1 78 78 THR HB H 1 4.04 0.00 . 1 . . . . . . . . 5566 1 495 . 1 1 78 78 THR HG21 H 1 1.24 0.00 . 1 . . . . . . . . 5566 1 496 . 1 1 78 78 THR HG22 H 1 1.24 0.00 . 1 . . . . . . . . 5566 1 497 . 1 1 78 78 THR HG23 H 1 1.24 0.00 . 1 . . . . . . . . 5566 1 498 . 1 1 78 78 THR CA C 13 65.78 0.00 . 1 . . . . . . . . 5566 1 499 . 1 1 78 78 THR CB C 13 68.01 0.00 . 1 . . . . . . . . 5566 1 500 . 1 1 78 78 THR CG2 C 13 23.00 0.00 . 1 . . . . . . . . 5566 1 501 . 1 1 78 78 THR N N 15 109.06 0.00 . 1 . . . . . . . . 5566 1 502 . 1 1 79 79 ARG H H 1 7.85 0.00 . 1 . . . . . . . . 5566 1 503 . 1 1 79 79 ARG HA H 1 3.91 0.00 . 1 . . . . . . . . 5566 1 504 . 1 1 79 79 ARG HB3 H 1 1.78 0.00 . 1 . . . . . . . . 5566 1 505 . 1 1 79 79 ARG HD3 H 1 3.33 0.00 . 1 . . . . . . . . 5566 1 506 . 1 1 79 79 ARG CA C 13 59.18 0.00 . 1 . . . . . . . . 5566 1 507 . 1 1 79 79 ARG CB C 13 29.28 0.00 . 1 . . . . . . . . 5566 1 508 . 1 1 79 79 ARG CD C 13 42.69 0.00 . 1 . . . . . . . . 5566 1 509 . 1 1 79 79 ARG N N 15 121.02 0.00 . 1 . . . . . . . . 5566 1 510 . 1 1 80 80 GLU H H 1 8.34 0.00 . 1 . . . . . . . . 5566 1 511 . 1 1 80 80 GLU HA H 1 4.08 0.00 . 1 . . . . . . . . 5566 1 512 . 1 1 80 80 GLU CA C 13 58.39 0.00 . 1 . . . . . . . . 5566 1 513 . 1 1 80 80 GLU CB C 13 28.59 0.00 . 1 . . . . . . . . 5566 1 514 . 1 1 80 80 GLU CG C 13 35.74 0.00 . 1 . . . . . . . . 5566 1 515 . 1 1 80 80 GLU N N 15 121.24 0.00 . 1 . . . . . . . . 5566 1 516 . 1 1 81 81 ALA H H 1 8.20 0.00 . 1 . . . . . . . . 5566 1 517 . 1 1 81 81 ALA HA H 1 3.88 0.00 . 1 . . . . . . . . 5566 1 518 . 1 1 81 81 ALA HB1 H 1 1.35 0.00 . 1 . . . . . . . . 5566 1 519 . 1 1 81 81 ALA HB2 H 1 1.35 0.00 . 1 . . . . . . . . 5566 1 520 . 1 1 81 81 ALA HB3 H 1 1.35 0.00 . 1 . . . . . . . . 5566 1 521 . 1 1 81 81 ALA CA C 13 55.70 0.00 . 1 . . . . . . . . 5566 1 522 . 1 1 81 81 ALA CB C 13 18.38 0.00 . 1 . . . . . . . . 5566 1 523 . 1 1 81 81 ALA N N 15 122.57 0.00 . 1 . . . . . . . . 5566 1 524 . 1 1 82 82 ILE H H 1 7.85 0.00 . 1 . . . . . . . . 5566 1 525 . 1 1 82 82 ILE HA H 1 3.32 0.00 . 1 . . . . . . . . 5566 1 526 . 1 1 82 82 ILE HB H 1 1.79 0.00 . 1 . . . . . . . . 5566 1 527 . 1 1 82 82 ILE HG13 H 1 1.91 0.00 . 1 . . . . . . . . 5566 1 528 . 1 1 82 82 ILE HG21 H 1 0.35 0.00 . 1 . . . . . . . . 5566 1 529 . 1 1 82 82 ILE HG22 H 1 0.35 0.00 . 1 . . . . . . . . 5566 1 530 . 1 1 82 82 ILE HG23 H 1 0.35 0.00 . 1 . . . . . . . . 5566 1 531 . 1 1 82 82 ILE HD11 H 1 0.76 0.00 . 1 . . . . . . . . 5566 1 532 . 1 1 82 82 ILE HD12 H 1 0.76 0.00 . 1 . . . . . . . . 5566 1 533 . 1 1 82 82 ILE HD13 H 1 0.76 0.00 . 1 . . . . . . . . 5566 1 534 . 1 1 82 82 ILE CA C 13 65.82 0.00 . 1 . . . . . . . . 5566 1 535 . 1 1 82 82 ILE CB C 13 38.62 0.00 . 1 . . . . . . . . 5566 1 536 . 1 1 82 82 ILE CG2 C 13 17.61 0.00 . 1 . . . . . . . . 5566 1 537 . 1 1 82 82 ILE CD1 C 13 13.81 0.00 . 1 . . . . . . . . 5566 1 538 . 1 1 82 82 ILE N N 15 116.11 0.00 . 1 . . . . . . . . 5566 1 539 . 1 1 83 83 SER H H 1 7.65 0.00 . 1 . . . . . . . . 5566 1 540 . 1 1 83 83 SER HA H 1 3.92 0.00 . 1 . . . . . . . . 5566 1 541 . 1 1 83 83 SER CA C 13 61.89 0.00 . 1 . . . . . . . . 5566 1 542 . 1 1 83 83 SER CB C 13 62.85 0.00 . 1 . . . . . . . . 5566 1 543 . 1 1 83 83 SER N N 15 114.37 0.00 . 1 . . . . . . . . 5566 1 544 . 1 1 84 84 LEU H H 1 8.13 0.00 . 1 . . . . . . . . 5566 1 545 . 1 1 84 84 LEU HA H 1 3.98 0.00 . 1 . . . . . . . . 5566 1 546 . 1 1 84 84 LEU HB2 H 1 1.50 0.00 . 1 . . . . . . . . 5566 1 547 . 1 1 84 84 LEU HB3 H 1 1.84 0.00 . 1 . . . . . . . . 5566 1 548 . 1 1 84 84 LEU HG H 1 1.69 0.00 . 1 . . . . . . . . 5566 1 549 . 1 1 84 84 LEU HD11 H 1 0.85 0.00 . 1 . . . . . . . . 5566 1 550 . 1 1 84 84 LEU HD12 H 1 0.85 0.00 . 1 . . . . . . . . 5566 1 551 . 1 1 84 84 LEU HD13 H 1 0.85 0.00 . 1 . . . . . . . . 5566 1 552 . 1 1 84 84 LEU HD21 H 1 0.88 0.00 . 1 . . . . . . . . 5566 1 553 . 1 1 84 84 LEU HD22 H 1 0.88 0.00 . 1 . . . . . . . . 5566 1 554 . 1 1 84 84 LEU HD23 H 1 0.88 0.00 . 1 . . . . . . . . 5566 1 555 . 1 1 84 84 LEU CA C 13 58.29 0.00 . 1 . . . . . . . . 5566 1 556 . 1 1 84 84 LEU CB C 13 42.52 0.00 . 1 . . . . . . . . 5566 1 557 . 1 1 84 84 LEU CG C 13 25.09 0.00 . 1 . . . . . . . . 5566 1 558 . 1 1 84 84 LEU CD1 C 13 24.03 0.00 . 1 . . . . . . . . 5566 1 559 . 1 1 84 84 LEU CD2 C 13 25.80 0.00 . 1 . . . . . . . . 5566 1 560 . 1 1 84 84 LEU N N 15 121.24 0.00 . 1 . . . . . . . . 5566 1 561 . 1 1 85 85 VAL H H 1 7.74 0.00 . 1 . . . . . . . . 5566 1 562 . 1 1 85 85 VAL HA H 1 3.95 0.00 . 1 . . . . . . . . 5566 1 563 . 1 1 85 85 VAL HB H 1 2.24 0.00 . 1 . . . . . . . . 5566 1 564 . 1 1 85 85 VAL HG11 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 565 . 1 1 85 85 VAL HG12 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 566 . 1 1 85 85 VAL HG13 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 567 . 1 1 85 85 VAL HG21 H 1 0.71 0.00 . 1 . . . . . . . . 5566 1 568 . 1 1 85 85 VAL HG22 H 1 0.71 0.00 . 1 . . . . . . . . 5566 1 569 . 1 1 85 85 VAL HG23 H 1 0.71 0.00 . 1 . . . . . . . . 5566 1 570 . 1 1 85 85 VAL CA C 13 65.65 0.00 . 1 . . . . . . . . 5566 1 571 . 1 1 85 85 VAL CB C 13 30.75 0.00 . 1 . . . . . . . . 5566 1 572 . 1 1 85 85 VAL CG1 C 13 21.23 0.00 . 1 . . . . . . . . 5566 1 573 . 1 1 85 85 VAL CG2 C 13 21.81 0.00 . 1 . . . . . . . . 5566 1 574 . 1 1 85 85 VAL N N 15 114.82 0.00 . 1 . . . . . . . . 5566 1 575 . 1 1 86 86 CYS H H 1 8.02 0.00 . 1 . . . . . . . . 5566 1 576 . 1 1 86 86 CYS HA H 1 4.02 0.00 . 1 . . . . . . . . 5566 1 577 . 1 1 86 86 CYS HB2 H 1 2.50 0.00 . 1 . . . . . . . . 5566 1 578 . 1 1 86 86 CYS HB3 H 1 2.79 0.00 . 1 . . . . . . . . 5566 1 579 . 1 1 86 86 CYS CA C 13 63.39 0.00 . 1 . . . . . . . . 5566 1 580 . 1 1 86 86 CYS CB C 13 26.28 0.00 . 1 . . . . . . . . 5566 1 581 . 1 1 86 86 CYS N N 15 117.53 0.00 . 1 . . . . . . . . 5566 1 582 . 1 1 87 87 GLU H H 1 7.48 0.00 . 1 . . . . . . . . 5566 1 583 . 1 1 87 87 GLU HA H 1 4.15 0.00 . 1 . . . . . . . . 5566 1 584 . 1 1 87 87 GLU HB3 H 1 2.04 0.00 . 1 . . . . . . . . 5566 1 585 . 1 1 87 87 GLU HG3 H 1 2.34 0.00 . 1 . . . . . . . . 5566 1 586 . 1 1 87 87 GLU CA C 13 57.15 0.00 . 1 . . . . . . . . 5566 1 587 . 1 1 87 87 GLU CB C 13 29.45 0.00 . 1 . . . . . . . . 5566 1 588 . 1 1 87 87 GLU CG C 13 36.07 0.00 . 1 . . . . . . . . 5566 1 589 . 1 1 87 87 GLU N N 15 116.81 0.00 . 1 . . . . . . . . 5566 1 590 . 1 1 88 88 ALA H H 1 7.35 0.00 . 1 . . . . . . . . 5566 1 591 . 1 1 88 88 ALA HA H 1 4.40 0.00 . 1 . . . . . . . . 5566 1 592 . 1 1 88 88 ALA HB1 H 1 1.47 0.00 . 1 . . . . . . . . 5566 1 593 . 1 1 88 88 ALA HB2 H 1 1.47 0.00 . 1 . . . . . . . . 5566 1 594 . 1 1 88 88 ALA HB3 H 1 1.47 0.00 . 1 . . . . . . . . 5566 1 595 . 1 1 88 88 ALA CA C 13 52.80 0.00 . 1 . . . . . . . . 5566 1 596 . 1 1 88 88 ALA CB C 13 21.07 0.00 . 1 . . . . . . . . 5566 1 597 . 1 1 88 88 ALA N N 15 120.05 0.00 . 1 . . . . . . . . 5566 1 598 . 1 1 89 89 VAL H H 1 7.62 0.00 . 1 . . . . . . . . 5566 1 599 . 1 1 89 89 VAL HA H 1 4.35 0.00 . 1 . . . . . . . . 5566 1 600 . 1 1 89 89 VAL HB H 1 2.07 0.00 . 1 . . . . . . . . 5566 1 601 . 1 1 89 89 VAL HG11 H 1 1.07 0.00 . 1 . . . . . . . . 5566 1 602 . 1 1 89 89 VAL HG12 H 1 1.07 0.00 . 1 . . . . . . . . 5566 1 603 . 1 1 89 89 VAL HG13 H 1 1.07 0.00 . 1 . . . . . . . . 5566 1 604 . 1 1 89 89 VAL HG21 H 1 0.94 0.00 . 1 . . . . . . . . 5566 1 605 . 1 1 89 89 VAL HG22 H 1 0.94 0.00 . 1 . . . . . . . . 5566 1 606 . 1 1 89 89 VAL HG23 H 1 0.94 0.00 . 1 . . . . . . . . 5566 1 607 . 1 1 89 89 VAL CA C 13 60.10 0.00 . 1 . . . . . . . . 5566 1 608 . 1 1 89 89 VAL CB C 13 33.22 0.00 . 1 . . . . . . . . 5566 1 609 . 1 1 89 89 VAL CG1 C 13 22.05 0.00 . 1 . . . . . . . . 5566 1 610 . 1 1 89 89 VAL CG2 C 13 20.71 0.00 . 1 . . . . . . . . 5566 1 611 . 1 1 89 89 VAL N N 15 120.35 0.00 . 1 . . . . . . . . 5566 1 612 . 1 1 90 90 PRO HA H 1 4.31 0.00 . 1 . . . . . . . . 5566 1 613 . 1 1 90 90 PRO HB2 H 1 1.94 0.00 . 1 . . . . . . . . 5566 1 614 . 1 1 90 90 PRO HB3 H 1 2.28 0.00 . 1 . . . . . . . . 5566 1 615 . 1 1 90 90 PRO HG2 H 1 2.00 0.00 . 1 . . . . . . . . 5566 1 616 . 1 1 90 90 PRO HG3 H 1 2.11 0.00 . 1 . . . . . . . . 5566 1 617 . 1 1 90 90 PRO HD3 H 1 3.71 0.00 . 1 . . . . . . . . 5566 1 618 . 1 1 90 90 PRO CA C 13 63.65 0.00 . 1 . . . . . . . . 5566 1 619 . 1 1 90 90 PRO CB C 13 31.98 0.00 . 1 . . . . . . . . 5566 1 620 . 1 1 90 90 PRO CG C 13 27.46 0.00 . 1 . . . . . . . . 5566 1 621 . 1 1 91 91 GLY H H 1 8.56 0.00 . 1 . . . . . . . . 5566 1 622 . 1 1 91 91 GLY HA2 H 1 3.89 0.00 . 1 . . . . . . . . 5566 1 623 . 1 1 91 91 GLY HA3 H 1 4.06 0.00 . 1 . . . . . . . . 5566 1 624 . 1 1 91 91 GLY CA C 13 44.66 0.00 . 1 . . . . . . . . 5566 1 625 . 1 1 91 91 GLY N N 15 109.94 0.00 . 1 . . . . . . . . 5566 1 626 . 1 1 92 92 ALA H H 1 8.09 0.00 . 1 . . . . . . . . 5566 1 627 . 1 1 92 92 ALA HA H 1 4.33 0.00 . 1 . . . . . . . . 5566 1 628 . 1 1 92 92 ALA HB1 H 1 1.53 0.00 . 1 . . . . . . . . 5566 1 629 . 1 1 92 92 ALA HB2 H 1 1.53 0.00 . 1 . . . . . . . . 5566 1 630 . 1 1 92 92 ALA HB3 H 1 1.53 0.00 . 1 . . . . . . . . 5566 1 631 . 1 1 92 92 ALA CA C 13 52.94 0.00 . 1 . . . . . . . . 5566 1 632 . 1 1 92 92 ALA CB C 13 19.17 0.00 . 1 . . . . . . . . 5566 1 633 . 1 1 92 92 ALA N N 15 124.12 0.00 . 1 . . . . . . . . 5566 1 634 . 1 1 93 93 LYS H H 1 8.73 0.00 . 1 . . . . . . . . 5566 1 635 . 1 1 93 93 LYS HA H 1 4.22 0.00 . 1 . . . . . . . . 5566 1 636 . 1 1 93 93 LYS HB2 H 1 1.81 0.00 . 1 . . . . . . . . 5566 1 637 . 1 1 93 93 LYS HB3 H 1 1.92 0.00 . 1 . . . . . . . . 5566 1 638 . 1 1 93 93 LYS HG3 H 1 1.50 0.00 . 1 . . . . . . . . 5566 1 639 . 1 1 93 93 LYS HE3 H 1 3.02 0.00 . 1 . . . . . . . . 5566 1 640 . 1 1 93 93 LYS CA C 13 57.58 0.00 . 1 . . . . . . . . 5566 1 641 . 1 1 93 93 LYS CB C 13 31.93 0.00 . 1 . . . . . . . . 5566 1 642 . 1 1 93 93 LYS CG C 13 25.10 0.00 . 1 . . . . . . . . 5566 1 643 . 1 1 93 93 LYS N N 15 122.35 0.00 . 1 . . . . . . . . 5566 1 644 . 1 1 94 94 GLY H H 1 8.61 0.00 . 1 . . . . . . . . 5566 1 645 . 1 1 94 94 GLY HA3 H 1 3.99 0.00 . 1 . . . . . . . . 5566 1 646 . 1 1 94 94 GLY CA C 13 45.06 0.00 . 1 . . . . . . . . 5566 1 647 . 1 1 94 94 GLY N N 15 106.85 0.00 . 1 . . . . . . . . 5566 1 648 . 1 1 95 95 ALA H H 1 7.79 0.00 . 1 . . . . . . . . 5566 1 649 . 1 1 95 95 ALA HA H 1 4.37 0.00 . 1 . . . . . . . . 5566 1 650 . 1 1 95 95 ALA HB1 H 1 1.46 0.00 . 1 . . . . . . . . 5566 1 651 . 1 1 95 95 ALA HB2 H 1 1.46 0.00 . 1 . . . . . . . . 5566 1 652 . 1 1 95 95 ALA HB3 H 1 1.46 0.00 . 1 . . . . . . . . 5566 1 653 . 1 1 95 95 ALA CA C 13 52.88 0.00 . 1 . . . . . . . . 5566 1 654 . 1 1 95 95 ALA CB C 13 19.42 0.00 . 1 . . . . . . . . 5566 1 655 . 1 1 95 95 ALA N N 15 122.76 0.00 . 1 . . . . . . . . 5566 1 656 . 1 1 96 96 THR H H 1 8.08 0.00 . 1 . . . . . . . . 5566 1 657 . 1 1 96 96 THR HA H 1 4.34 0.00 . 1 . . . . . . . . 5566 1 658 . 1 1 96 96 THR HB H 1 4.20 0.00 . 1 . . . . . . . . 5566 1 659 . 1 1 96 96 THR HG21 H 1 1.20 0.00 . 1 . . . . . . . . 5566 1 660 . 1 1 96 96 THR HG22 H 1 1.20 0.00 . 1 . . . . . . . . 5566 1 661 . 1 1 96 96 THR HG23 H 1 1.20 0.00 . 1 . . . . . . . . 5566 1 662 . 1 1 96 96 THR CA C 13 61.82 0.00 . 1 . . . . . . . . 5566 1 663 . 1 1 96 96 THR CB C 13 69.58 0.00 . 1 . . . . . . . . 5566 1 664 . 1 1 96 96 THR CG2 C 13 21.64 0.00 . 1 . . . . . . . . 5566 1 665 . 1 1 96 96 THR N N 15 111.72 0.00 . 1 . . . . . . . . 5566 1 666 . 1 1 97 97 ARG H H 1 7.98 0.00 . 1 . . . . . . . . 5566 1 667 . 1 1 97 97 ARG HA H 1 4.30 0.00 . 1 . . . . . . . . 5566 1 668 . 1 1 97 97 ARG HB3 H 1 1.77 0.00 . 1 . . . . . . . . 5566 1 669 . 1 1 97 97 ARG HG3 H 1 1.61 0.00 . 1 . . . . . . . . 5566 1 670 . 1 1 97 97 ARG HD3 H 1 3.19 0.00 . 1 . . . . . . . . 5566 1 671 . 1 1 97 97 ARG CA C 13 56.04 0.00 . 1 . . . . . . . . 5566 1 672 . 1 1 97 97 ARG CB C 13 30.32 0.00 . 1 . . . . . . . . 5566 1 673 . 1 1 97 97 ARG CG C 13 27.16 0.00 . 1 . . . . . . . . 5566 1 674 . 1 1 97 97 ARG CD C 13 43.21 0.00 . 1 . . . . . . . . 5566 1 675 . 1 1 97 97 ARG N N 15 122.35 0.00 . 1 . . . . . . . . 5566 1 676 . 1 1 98 98 ARG H H 1 8.28 0.00 . 1 . . . . . . . . 5566 1 677 . 1 1 98 98 ARG HA H 1 4.29 0.00 . 1 . . . . . . . . 5566 1 678 . 1 1 98 98 ARG HB3 H 1 1.75 0.00 . 1 . . . . . . . . 5566 1 679 . 1 1 98 98 ARG HG3 H 1 1.60 0.00 . 1 . . . . . . . . 5566 1 680 . 1 1 98 98 ARG CA C 13 55.59 0.00 . 1 . . . . . . . . 5566 1 681 . 1 1 98 98 ARG CB C 13 30.08 0.00 . 1 . . . . . . . . 5566 1 682 . 1 1 98 98 ARG CG C 13 27.12 0.00 . 1 . . . . . . . . 5566 1 683 . 1 1 98 98 ARG CD C 13 43.04 0.00 . 1 . . . . . . . . 5566 1 684 . 1 1 98 98 ARG N N 15 122.35 0.00 . 1 . . . . . . . . 5566 1 685 . 1 1 99 99 ARG H H 1 8.38 0.00 . 1 . . . . . . . . 5566 1 686 . 1 1 99 99 ARG HA H 1 4.31 0.00 . 1 . . . . . . . . 5566 1 687 . 1 1 99 99 ARG HB3 H 1 1.80 0.00 . 1 . . . . . . . . 5566 1 688 . 1 1 99 99 ARG HG3 H 1 1.62 0.00 . 1 . . . . . . . . 5566 1 689 . 1 1 99 99 ARG CA C 13 55.37 0.00 . 1 . . . . . . . . 5566 1 690 . 1 1 99 99 ARG CB C 13 30.63 0.00 . 1 . . . . . . . . 5566 1 691 . 1 1 99 99 ARG CG C 13 26.76 0.00 . 1 . . . . . . . . 5566 1 692 . 1 1 99 99 ARG CD C 13 43.04 0.00 . 1 . . . . . . . . 5566 1 693 . 1 1 99 99 ARG N N 15 123.23 0.00 . 1 . . . . . . . . 5566 1 694 . 1 1 100 100 LYS H H 1 8.38 0.00 . 1 . . . . . . . . 5566 1 695 . 1 1 100 100 LYS HA H 1 4.59 0.00 . 1 . . . . . . . . 5566 1 696 . 1 1 100 100 LYS HB2 H 1 1.72 0.00 . 1 . . . . . . . . 5566 1 697 . 1 1 100 100 LYS HB3 H 1 1.82 0.00 . 1 . . . . . . . . 5566 1 698 . 1 1 100 100 LYS HG3 H 1 1.48 0.00 . 1 . . . . . . . . 5566 1 699 . 1 1 100 100 LYS HD3 H 1 1.58 0.00 . 1 . . . . . . . . 5566 1 700 . 1 1 100 100 LYS HE3 H 1 3.64 0.00 . 1 . . . . . . . . 5566 1 701 . 1 1 100 100 LYS CA C 13 54.52 0.00 . 1 . . . . . . . . 5566 1 702 . 1 1 100 100 LYS CB C 13 32.40 0.00 . 1 . . . . . . . . 5566 1 703 . 1 1 100 100 LYS CG C 13 24.40 0.00 . 1 . . . . . . . . 5566 1 704 . 1 1 100 100 LYS N N 15 124.34 0.00 . 1 . . . . . . . . 5566 1 705 . 1 1 102 102 CYS H H 1 8.43 0.00 . 1 . . . . . . . . 5566 1 706 . 1 1 102 102 CYS HA H 1 4.50 0.00 . 1 . . . . . . . . 5566 1 707 . 1 1 102 102 CYS HB2 H 1 2.91 0.00 . 1 . . . . . . . . 5566 1 708 . 1 1 102 102 CYS HB3 H 1 2.96 0.00 . 1 . . . . . . . . 5566 1 709 . 1 1 102 102 CYS CA C 13 58.15 0.00 . 1 . . . . . . . . 5566 1 710 . 1 1 102 102 CYS CB C 13 28.12 0.00 . 1 . . . . . . . . 5566 1 711 . 1 1 102 102 CYS N N 15 120.73 0.00 . 1 . . . . . . . . 5566 1 712 . 1 1 103 103 SER H H 1 8.36 0.00 . 1 . . . . . . . . 5566 1 713 . 1 1 103 103 SER CA C 13 58.32 0.00 . 1 . . . . . . . . 5566 1 714 . 1 1 103 103 SER CB C 13 63.70 0.00 . 1 . . . . . . . . 5566 1 715 . 1 1 103 103 SER N N 15 113.90 0.00 . 1 . . . . . . . . 5566 1 716 . 1 1 104 104 ARG H H 1 8.27 0.00 . 1 . . . . . . . . 5566 1 717 . 1 1 104 104 ARG CA C 13 54.43 0.00 . 1 . . . . . . . . 5566 1 718 . 1 1 104 104 ARG CB C 13 32.19 0.00 . 1 . . . . . . . . 5566 1 719 . 1 1 104 104 ARG N N 15 123.19 0.00 . 1 . . . . . . . . 5566 1 720 . 1 1 105 105 PRO HA H 1 4.42 0.00 . 1 . . . . . . . . 5566 1 721 . 1 1 105 105 PRO HB2 H 1 1.92 0.00 . 1 . . . . . . . . 5566 1 722 . 1 1 105 105 PRO HB3 H 1 2.28 0.00 . 1 . . . . . . . . 5566 1 723 . 1 1 105 105 PRO HG3 H 1 1.99 0.00 . 1 . . . . . . . . 5566 1 724 . 1 1 105 105 PRO HD2 H 1 3.65 0.00 . 1 . . . . . . . . 5566 1 725 . 1 1 105 105 PRO HD3 H 1 3.71 0.00 . 1 . . . . . . . . 5566 1 726 . 1 1 105 105 PRO CA C 13 63.23 0.00 . 1 . . . . . . . . 5566 1 727 . 1 1 105 105 PRO CB C 13 31.98 0.00 . 1 . . . . . . . . 5566 1 728 . 1 1 105 105 PRO CG C 13 27.46 0.00 . 1 . . . . . . . . 5566 1 729 . 1 1 105 105 PRO CD C 13 50.76 0.00 . 1 . . . . . . . . 5566 1 730 . 1 1 106 106 LEU H H 1 8.42 0.00 . 1 . . . . . . . . 5566 1 731 . 1 1 106 106 LEU HA H 1 4.31 0.00 . 1 . . . . . . . . 5566 1 732 . 1 1 106 106 LEU HB2 H 1 1.58 0.00 . 1 . . . . . . . . 5566 1 733 . 1 1 106 106 LEU HB3 H 1 1.70 0.00 . 1 . . . . . . . . 5566 1 734 . 1 1 106 106 LEU HD11 H 1 0.82 0.00 . 1 . . . . . . . . 5566 1 735 . 1 1 106 106 LEU HD12 H 1 0.82 0.00 . 1 . . . . . . . . 5566 1 736 . 1 1 106 106 LEU HD13 H 1 0.82 0.00 . 1 . . . . . . . . 5566 1 737 . 1 1 106 106 LEU CA C 13 54.82 0.00 . 1 . . . . . . . . 5566 1 738 . 1 1 106 106 LEU CB C 13 41.34 0.00 . 1 . . . . . . . . 5566 1 739 . 1 1 106 106 LEU N N 15 121.46 0.00 . 1 . . . . . . . . 5566 1 740 . 1 1 107 107 SER H H 1 8.28 0.00 . 1 . . . . . . . . 5566 1 741 . 1 1 107 107 SER HA H 1 4.29 0.00 . 1 . . . . . . . . 5566 1 742 . 1 1 107 107 SER HB2 H 1 3.88 0.00 . 1 . . . . . . . . 5566 1 743 . 1 1 107 107 SER HB3 H 1 3.96 0.00 . 1 . . . . . . . . 5566 1 744 . 1 1 107 107 SER CA C 13 59.97 0.00 . 1 . . . . . . . . 5566 1 745 . 1 1 107 107 SER CB C 13 62.99 0.00 . 1 . . . . . . . . 5566 1 746 . 1 1 107 107 SER N N 15 115.92 0.00 . 1 . . . . . . . . 5566 1 747 . 1 1 108 108 SER CA C 13 58.98 0.00 . 1 . . . . . . . . 5566 1 748 . 1 1 108 108 SER CB C 13 63.13 0.00 . 1 . . . . . . . . 5566 1 749 . 1 1 109 109 ILE H H 1 7.86 0.00 . 1 . . . . . . . . 5566 1 750 . 1 1 109 109 ILE HA H 1 4.03 0.00 . 1 . . . . . . . . 5566 1 751 . 1 1 109 109 ILE HB H 1 1.72 0.00 . 1 . . . . . . . . 5566 1 752 . 1 1 109 109 ILE HG13 H 1 1.48 0.00 . 1 . . . . . . . . 5566 1 753 . 1 1 109 109 ILE HG21 H 1 0.86 0.00 . 1 . . . . . . . . 5566 1 754 . 1 1 109 109 ILE HG22 H 1 0.86 0.00 . 1 . . . . . . . . 5566 1 755 . 1 1 109 109 ILE HG23 H 1 0.86 0.00 . 1 . . . . . . . . 5566 1 756 . 1 1 109 109 ILE HD11 H 1 0.70 0.00 . 1 . . . . . . . . 5566 1 757 . 1 1 109 109 ILE HD12 H 1 0.70 0.00 . 1 . . . . . . . . 5566 1 758 . 1 1 109 109 ILE HD13 H 1 0.70 0.00 . 1 . . . . . . . . 5566 1 759 . 1 1 109 109 ILE CA C 13 62.77 0.00 . 1 . . . . . . . . 5566 1 760 . 1 1 109 109 ILE CB C 13 39.46 0.00 . 1 . . . . . . . . 5566 1 761 . 1 1 109 109 ILE CG2 C 13 18.74 0.00 . 1 . . . . . . . . 5566 1 762 . 1 1 109 109 ILE CD1 C 13 14.05 0.00 . 1 . . . . . . . . 5566 1 763 . 1 1 109 109 ILE N N 15 119.60 0.00 . 1 . . . . . . . . 5566 1 764 . 1 1 110 110 LEU H H 1 7.67 0.00 . 1 . . . . . . . . 5566 1 765 . 1 1 110 110 LEU HA H 1 4.98 0.00 . 1 . . . . . . . . 5566 1 766 . 1 1 110 110 LEU HB2 H 1 1.29 0.00 . 1 . . . . . . . . 5566 1 767 . 1 1 110 110 LEU HB3 H 1 1.78 0.00 . 1 . . . . . . . . 5566 1 768 . 1 1 110 110 LEU HG H 1 1.59 0.00 . 1 . . . . . . . . 5566 1 769 . 1 1 110 110 LEU HD11 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 770 . 1 1 110 110 LEU HD12 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 771 . 1 1 110 110 LEU HD13 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 772 . 1 1 110 110 LEU HD21 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 773 . 1 1 110 110 LEU HD22 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 774 . 1 1 110 110 LEU HD23 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 775 . 1 1 110 110 LEU CA C 13 53.57 0.00 . 1 . . . . . . . . 5566 1 776 . 1 1 110 110 LEU CB C 13 42.76 0.00 . 1 . . . . . . . . 5566 1 777 . 1 1 110 110 LEU CD2 C 13 23.90 0.00 . 1 . . . . . . . . 5566 1 778 . 1 1 110 110 LEU N N 15 120.13 0.00 . 1 . . . . . . . . 5566 1 779 . 1 1 111 111 GLY H H 1 8.46 0.00 . 1 . . . . . . . . 5566 1 780 . 1 1 111 111 GLY HA2 H 1 3.58 0.00 . 1 . . . . . . . . 5566 1 781 . 1 1 111 111 GLY HA3 H 1 4.48 0.00 . 1 . . . . . . . . 5566 1 782 . 1 1 111 111 GLY CA C 13 43.70 0.00 . 1 . . . . . . . . 5566 1 783 . 1 1 111 111 GLY N N 15 110.83 0.00 . 1 . . . . . . . . 5566 1 784 . 1 1 112 112 ARG H H 1 9.04 0.00 . 1 . . . . . . . . 5566 1 785 . 1 1 112 112 ARG HA H 1 4.26 0.00 . 1 . . . . . . . . 5566 1 786 . 1 1 112 112 ARG HB2 H 1 1.78 0.00 . 1 . . . . . . . . 5566 1 787 . 1 1 112 112 ARG HB3 H 1 1.85 0.00 . 1 . . . . . . . . 5566 1 788 . 1 1 112 112 ARG HD3 H 1 3.19 0.00 . 1 . . . . . . . . 5566 1 789 . 1 1 112 112 ARG CA C 13 55.87 0.00 . 1 . . . . . . . . 5566 1 790 . 1 1 112 112 ARG CB C 13 30.77 0.00 . 1 . . . . . . . . 5566 1 791 . 1 1 112 112 ARG CD C 13 43.17 0.00 . 1 . . . . . . . . 5566 1 792 . 1 1 112 112 ARG N N 15 125.00 0.00 . 1 . . . . . . . . 5566 1 793 . 1 1 113 113 SER H H 1 8.53 0.00 . 1 . . . . . . . . 5566 1 794 . 1 1 113 113 SER HA H 1 5.08 0.00 . 1 . . . . . . . . 5566 1 795 . 1 1 113 113 SER HB2 H 1 3.65 0.00 . 1 . . . . . . . . 5566 1 796 . 1 1 113 113 SER HB3 H 1 3.76 0.00 . 1 . . . . . . . . 5566 1 797 . 1 1 113 113 SER CA C 13 57.11 0.00 . 1 . . . . . . . . 5566 1 798 . 1 1 113 113 SER CB C 13 64.64 0.00 . 1 . . . . . . . . 5566 1 799 . 1 1 113 113 SER N N 15 117.25 0.00 . 1 . . . . . . . . 5566 1 800 . 1 1 114 114 ASN H H 1 9.14 0.00 . 1 . . . . . . . . 5566 1 801 . 1 1 114 114 ASN HA H 1 4.95 0.00 . 1 . . . . . . . . 5566 1 802 . 1 1 114 114 ASN HB2 H 1 2.75 0.00 . 1 . . . . . . . . 5566 1 803 . 1 1 114 114 ASN HB3 H 1 3.41 0.00 . 1 . . . . . . . . 5566 1 804 . 1 1 114 114 ASN CA C 13 52.47 0.00 . 1 . . . . . . . . 5566 1 805 . 1 1 114 114 ASN CB C 13 38.76 0.00 . 1 . . . . . . . . 5566 1 806 . 1 1 114 114 ASN N N 15 121.02 0.00 . 1 . . . . . . . . 5566 1 807 . 1 1 115 115 LEU H H 1 9.05 0.00 . 1 . . . . . . . . 5566 1 808 . 1 1 115 115 LEU HA H 1 4.60 0.00 . 1 . . . . . . . . 5566 1 809 . 1 1 115 115 LEU HD11 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 810 . 1 1 115 115 LEU HD12 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 811 . 1 1 115 115 LEU HD13 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 812 . 1 1 115 115 LEU CA C 13 52.51 0.00 . 1 . . . . . . . . 5566 1 813 . 1 1 115 115 LEU CB C 13 38.92 0.00 . 1 . . . . . . . . 5566 1 814 . 1 1 115 115 LEU N N 15 125.00 0.00 . 1 . . . . . . . . 5566 1 815 . 1 1 116 116 LYS H H 1 8.09 0.00 . 1 . . . . . . . . 5566 1 816 . 1 1 116 116 LYS HA H 1 3.83 0.00 . 1 . . . . . . . . 5566 1 817 . 1 1 116 116 LYS CA C 13 53.80 0.00 . 1 . . . . . . . . 5566 1 818 . 1 1 116 116 LYS CB C 13 32.48 0.00 . 1 . . . . . . . . 5566 1 819 . 1 1 116 116 LYS N N 15 124.12 0.00 . 1 . . . . . . . . 5566 1 820 . 1 1 117 117 PHE H H 1 8.88 0.00 . 1 . . . . . . . . 5566 1 821 . 1 1 117 117 PHE HA H 1 4.68 0.00 . 1 . . . . . . . . 5566 1 822 . 1 1 117 117 PHE CA C 13 62.57 0.00 . 1 . . . . . . . . 5566 1 823 . 1 1 117 117 PHE CB C 13 38.49 0.00 . 1 . . . . . . . . 5566 1 824 . 1 1 117 117 PHE N N 15 115.92 0.00 . 1 . . . . . . . . 5566 1 825 . 1 1 118 118 ALA H H 1 7.33 0.00 . 1 . . . . . . . . 5566 1 826 . 1 1 118 118 ALA HA H 1 3.98 0.00 . 1 . . . . . . . . 5566 1 827 . 1 1 118 118 ALA HB1 H 1 1.37 0.00 . 1 . . . . . . . . 5566 1 828 . 1 1 118 118 ALA HB2 H 1 1.37 0.00 . 1 . . . . . . . . 5566 1 829 . 1 1 118 118 ALA HB3 H 1 1.37 0.00 . 1 . . . . . . . . 5566 1 830 . 1 1 118 118 ALA CA C 13 53.87 0.00 . 1 . . . . . . . . 5566 1 831 . 1 1 118 118 ALA CB C 13 20.15 0.00 . 1 . . . . . . . . 5566 1 832 . 1 1 118 118 ALA N N 15 120.13 0.00 . 1 . . . . . . . . 5566 1 833 . 1 1 119 119 GLY H H 1 9.82 0.00 . 1 . . . . . . . . 5566 1 834 . 1 1 119 119 GLY HA2 H 1 3.56 0.00 . 1 . . . . . . . . 5566 1 835 . 1 1 119 119 GLY HA3 H 1 4.40 0.00 . 1 . . . . . . . . 5566 1 836 . 1 1 119 119 GLY CA C 13 44.64 0.00 . 1 . . . . . . . . 5566 1 837 . 1 1 119 119 GLY N N 15 111.70 0.00 . 1 . . . . . . . . 5566 1 838 . 1 1 120 120 MET H H 1 7.95 0.00 . 1 . . . . . . . . 5566 1 839 . 1 1 120 120 MET HA H 1 4.82 0.00 . 1 . . . . . . . . 5566 1 840 . 1 1 120 120 MET HB2 H 1 2.23 0.00 . 1 . . . . . . . . 5566 1 841 . 1 1 120 120 MET HB3 H 1 2.36 0.00 . 1 . . . . . . . . 5566 1 842 . 1 1 120 120 MET HG3 H 1 2.68 0.00 . 1 . . . . . . . . 5566 1 843 . 1 1 120 120 MET HE1 H 1 2.21 0.00 . 1 . . . . . . . . 5566 1 844 . 1 1 120 120 MET HE2 H 1 2.21 0.00 . 1 . . . . . . . . 5566 1 845 . 1 1 120 120 MET HE3 H 1 2.21 0.00 . 1 . . . . . . . . 5566 1 846 . 1 1 120 120 MET CA C 13 54.52 0.00 . 1 . . . . . . . . 5566 1 847 . 1 1 120 120 MET CB C 13 34.76 0.00 . 1 . . . . . . . . 5566 1 848 . 1 1 120 120 MET CG C 13 32.03 0.00 . 1 . . . . . . . . 5566 1 849 . 1 1 120 120 MET CE C 13 17.31 0.00 . 1 . . . . . . . . 5566 1 850 . 1 1 120 120 MET N N 15 122.57 0.00 . 1 . . . . . . . . 5566 1 851 . 1 1 121 121 PRO HA H 1 4.92 0.00 . 1 . . . . . . . . 5566 1 852 . 1 1 121 121 PRO HB2 H 1 2.01 0.00 . 1 . . . . . . . . 5566 1 853 . 1 1 121 121 PRO HB3 H 1 2.35 0.00 . 1 . . . . . . . . 5566 1 854 . 1 1 121 121 PRO HG2 H 1 2.02 0.00 . 1 . . . . . . . . 5566 1 855 . 1 1 121 121 PRO HG3 H 1 2.32 0.00 . 1 . . . . . . . . 5566 1 856 . 1 1 121 121 PRO HD2 H 1 3.87 0.00 . 1 . . . . . . . . 5566 1 857 . 1 1 121 121 PRO HD3 H 1 4.35 0.00 . 1 . . . . . . . . 5566 1 858 . 1 1 121 121 PRO CA C 13 63.23 0.00 . 1 . . . . . . . . 5566 1 859 . 1 1 121 121 PRO CB C 13 31.70 0.00 . 1 . . . . . . . . 5566 1 860 . 1 1 121 121 PRO CG C 13 28.17 0.00 . 1 . . . . . . . . 5566 1 861 . 1 1 121 121 PRO N N 15 31.27 0.00 . 1 . . . . . . . . 5566 1 862 . 1 1 122 122 ILE H H 1 9.21 0.00 . 1 . . . . . . . . 5566 1 863 . 1 1 122 122 ILE HA H 1 5.14 0.00 . 1 . . . . . . . . 5566 1 864 . 1 1 122 122 ILE HB H 1 1.63 0.00 . 1 . . . . . . . . 5566 1 865 . 1 1 122 122 ILE HG13 H 1 1.44 0.00 . 1 . . . . . . . . 5566 1 866 . 1 1 122 122 ILE HG21 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 867 . 1 1 122 122 ILE HG22 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 868 . 1 1 122 122 ILE HG23 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 869 . 1 1 122 122 ILE HD11 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 870 . 1 1 122 122 ILE HD12 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 871 . 1 1 122 122 ILE HD13 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 872 . 1 1 122 122 ILE CA C 13 58.99 0.00 . 1 . . . . . . . . 5566 1 873 . 1 1 122 122 ILE CB C 13 43.70 0.00 . 1 . . . . . . . . 5566 1 874 . 1 1 122 122 ILE CG2 C 13 18.70 0.00 . 1 . . . . . . . . 5566 1 875 . 1 1 122 122 ILE CD1 C 13 16.44 0.00 . 1 . . . . . . . . 5566 1 876 . 1 1 122 122 ILE N N 15 119.03 0.00 . 1 . . . . . . . . 5566 1 877 . 1 1 123 123 THR H H 1 9.23 0.00 . 1 . . . . . . . . 5566 1 878 . 1 1 123 123 THR HA H 1 4.98 0.00 . 1 . . . . . . . . 5566 1 879 . 1 1 123 123 THR HB H 1 3.89 0.00 . 1 . . . . . . . . 5566 1 880 . 1 1 123 123 THR HG21 H 1 1.07 0.00 . 1 . . . . . . . . 5566 1 881 . 1 1 123 123 THR HG22 H 1 1.07 0.00 . 1 . . . . . . . . 5566 1 882 . 1 1 123 123 THR HG23 H 1 1.07 0.00 . 1 . . . . . . . . 5566 1 883 . 1 1 123 123 THR CA C 13 62.05 0.00 . 1 . . . . . . . . 5566 1 884 . 1 1 123 123 THR CB C 13 69.11 0.00 . 1 . . . . . . . . 5566 1 885 . 1 1 123 123 THR CG2 C 13 21.98 0.00 . 1 . . . . . . . . 5566 1 886 . 1 1 123 123 THR N N 15 116.81 0.00 . 1 . . . . . . . . 5566 1 887 . 1 1 124 124 LEU H H 1 9.60 0.00 . 1 . . . . . . . . 5566 1 888 . 1 1 124 124 LEU HA H 1 5.32 0.00 . 1 . . . . . . . . 5566 1 889 . 1 1 124 124 LEU HB2 H 1 1.28 0.00 . 1 . . . . . . . . 5566 1 890 . 1 1 124 124 LEU HB3 H 1 2.04 0.00 . 1 . . . . . . . . 5566 1 891 . 1 1 124 124 LEU HG H 1 1.44 0.00 . 1 . . . . . . . . 5566 1 892 . 1 1 124 124 LEU HD11 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 893 . 1 1 124 124 LEU HD12 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 894 . 1 1 124 124 LEU HD13 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 895 . 1 1 124 124 LEU HD21 H 1 0.70 0.00 . 1 . . . . . . . . 5566 1 896 . 1 1 124 124 LEU HD22 H 1 0.70 0.00 . 1 . . . . . . . . 5566 1 897 . 1 1 124 124 LEU HD23 H 1 0.70 0.00 . 1 . . . . . . . . 5566 1 898 . 1 1 124 124 LEU CA C 13 52.88 0.00 . 1 . . . . . . . . 5566 1 899 . 1 1 124 124 LEU CB C 13 44.20 0.00 . 1 . . . . . . . . 5566 1 900 . 1 1 124 124 LEU CD1 C 13 23.95 0.00 . 1 . . . . . . . . 5566 1 901 . 1 1 124 124 LEU CD2 C 13 22.28 0.00 . 1 . . . . . . . . 5566 1 902 . 1 1 124 124 LEU N N 15 132.98 0.00 . 1 . . . . . . . . 5566 1 903 . 1 1 125 125 THR H H 1 9.38 0.00 . 1 . . . . . . . . 5566 1 904 . 1 1 125 125 THR HA H 1 5.19 0.00 . 1 . . . . . . . . 5566 1 905 . 1 1 125 125 THR HB H 1 3.86 0.00 . 1 . . . . . . . . 5566 1 906 . 1 1 125 125 THR HG21 H 1 1.03 0.00 . 1 . . . . . . . . 5566 1 907 . 1 1 125 125 THR HG22 H 1 1.03 0.00 . 1 . . . . . . . . 5566 1 908 . 1 1 125 125 THR HG23 H 1 1.03 0.00 . 1 . . . . . . . . 5566 1 909 . 1 1 125 125 THR CA C 13 62.05 0.00 . 1 . . . . . . . . 5566 1 910 . 1 1 125 125 THR CB C 13 69.30 0.00 . 1 . . . . . . . . 5566 1 911 . 1 1 125 125 THR CG2 C 13 21.52 0.00 . 1 . . . . . . . . 5566 1 912 . 1 1 125 125 THR N N 15 123.90 0.00 . 1 . . . . . . . . 5566 1 913 . 1 1 126 126 VAL H H 1 9.42 0.00 . 1 . . . . . . . . 5566 1 914 . 1 1 126 126 VAL HA H 1 4.29 0.00 . 1 . . . . . . . . 5566 1 915 . 1 1 126 126 VAL HB H 1 2.04 0.00 . 1 . . . . . . . . 5566 1 916 . 1 1 126 126 VAL HG11 H 1 0.88 0.00 . 1 . . . . . . . . 5566 1 917 . 1 1 126 126 VAL HG12 H 1 0.88 0.00 . 1 . . . . . . . . 5566 1 918 . 1 1 126 126 VAL HG13 H 1 0.88 0.00 . 1 . . . . . . . . 5566 1 919 . 1 1 126 126 VAL HG21 H 1 0.64 0.00 . 1 . . . . . . . . 5566 1 920 . 1 1 126 126 VAL HG22 H 1 0.64 0.00 . 1 . . . . . . . . 5566 1 921 . 1 1 126 126 VAL HG23 H 1 0.64 0.00 . 1 . . . . . . . . 5566 1 922 . 1 1 126 126 VAL CA C 13 61.58 0.00 . 1 . . . . . . . . 5566 1 923 . 1 1 126 126 VAL CB C 13 33.23 0.00 . 1 . . . . . . . . 5566 1 924 . 1 1 126 126 VAL CG1 C 13 19.93 0.00 . 1 . . . . . . . . 5566 1 925 . 1 1 126 126 VAL CG2 C 13 21.81 0.00 . 1 . . . . . . . . 5566 1 926 . 1 1 126 126 VAL N N 15 129.21 0.00 . 1 . . . . . . . . 5566 1 927 . 1 1 127 127 SER H H 1 8.43 0.00 . 1 . . . . . . . . 5566 1 928 . 1 1 127 127 SER HA H 1 5.34 0.00 . 1 . . . . . . . . 5566 1 929 . 1 1 127 127 SER HB2 H 1 3.61 0.00 . 1 . . . . . . . . 5566 1 930 . 1 1 127 127 SER HB3 H 1 4.38 0.00 . 1 . . . . . . . . 5566 1 931 . 1 1 127 127 SER CA C 13 56.17 0.00 . 1 . . . . . . . . 5566 1 932 . 1 1 127 127 SER CB C 13 68.17 0.00 . 1 . . . . . . . . 5566 1 933 . 1 1 127 127 SER N N 15 122.79 0.00 . 1 . . . . . . . . 5566 1 934 . 1 1 128 128 THR H H 1 7.80 0.00 . 1 . . . . . . . . 5566 1 935 . 1 1 128 128 THR HA H 1 3.86 0.00 . 1 . . . . . . . . 5566 1 936 . 1 1 128 128 THR HB H 1 4.25 0.00 . 1 . . . . . . . . 5566 1 937 . 1 1 128 128 THR HG21 H 1 1.30 0.00 . 1 . . . . . . . . 5566 1 938 . 1 1 128 128 THR HG22 H 1 1.30 0.00 . 1 . . . . . . . . 5566 1 939 . 1 1 128 128 THR HG23 H 1 1.30 0.00 . 1 . . . . . . . . 5566 1 940 . 1 1 128 128 THR CA C 13 63.94 0.00 . 1 . . . . . . . . 5566 1 941 . 1 1 128 128 THR CB C 13 68.63 0.00 . 1 . . . . . . . . 5566 1 942 . 1 1 128 128 THR CG2 C 13 25.09 0.00 . 1 . . . . . . . . 5566 1 943 . 1 1 128 128 THR N N 15 132.31 0.00 . 1 . . . . . . . . 5566 1 944 . 1 1 129 129 SER H H 1 7.96 0.00 . 1 . . . . . . . . 5566 1 945 . 1 1 129 129 SER HA H 1 4.43 0.00 . 1 . . . . . . . . 5566 1 946 . 1 1 129 129 SER HB3 H 1 3.77 0.00 . 1 . . . . . . . . 5566 1 947 . 1 1 129 129 SER CA C 13 60.41 0.00 . 1 . . . . . . . . 5566 1 948 . 1 1 129 129 SER CB C 13 63.77 0.00 . 1 . . . . . . . . 5566 1 949 . 1 1 129 129 SER N N 15 113.27 0.00 . 1 . . . . . . . . 5566 1 950 . 1 1 130 130 SER H H 1 7.59 0.00 . 1 . . . . . . . . 5566 1 951 . 1 1 130 130 SER HA H 1 4.89 0.00 . 1 . . . . . . . . 5566 1 952 . 1 1 130 130 SER HB3 H 1 3.75 0.00 . 1 . . . . . . . . 5566 1 953 . 1 1 130 130 SER CA C 13 57.63 0.00 . 1 . . . . . . . . 5566 1 954 . 1 1 130 130 SER CB C 13 65.27 0.00 . 1 . . . . . . . . 5566 1 955 . 1 1 130 130 SER N N 15 115.26 0.00 . 1 . . . . . . . . 5566 1 956 . 1 1 131 131 LEU H H 1 8.49 0.00 . 1 . . . . . . . . 5566 1 957 . 1 1 131 131 LEU HA H 1 4.92 0.00 . 1 . . . . . . . . 5566 1 958 . 1 1 131 131 LEU HB2 H 1 1.20 0.00 . 1 . . . . . . . . 5566 1 959 . 1 1 131 131 LEU HB3 H 1 1.49 0.00 . 1 . . . . . . . . 5566 1 960 . 1 1 131 131 LEU HG H 1 1.49 0.00 . 1 . . . . . . . . 5566 1 961 . 1 1 131 131 LEU HD11 H 1 0.51 0.00 . 1 . . . . . . . . 5566 1 962 . 1 1 131 131 LEU HD12 H 1 0.51 0.00 . 1 . . . . . . . . 5566 1 963 . 1 1 131 131 LEU HD13 H 1 0.51 0.00 . 1 . . . . . . . . 5566 1 964 . 1 1 131 131 LEU HD21 H 1 0.33 0.00 . 1 . . . . . . . . 5566 1 965 . 1 1 131 131 LEU HD22 H 1 0.33 0.00 . 1 . . . . . . . . 5566 1 966 . 1 1 131 131 LEU HD23 H 1 0.33 0.00 . 1 . . . . . . . . 5566 1 967 . 1 1 131 131 LEU CA C 13 54.52 0.00 . 1 . . . . . . . . 5566 1 968 . 1 1 131 131 LEU CB C 13 41.34 0.00 . 1 . . . . . . . . 5566 1 969 . 1 1 131 131 LEU CG C 13 27.93 0.00 . 1 . . . . . . . . 5566 1 970 . 1 1 131 131 LEU CD1 C 13 25.88 0.00 . 1 . . . . . . . . 5566 1 971 . 1 1 131 131 LEU CD2 C 13 24.69 0.00 . 1 . . . . . . . . 5566 1 972 . 1 1 131 131 LEU N N 15 119.03 0.00 . 1 . . . . . . . . 5566 1 973 . 1 1 132 132 ASN H H 1 8.66 0.00 . 1 . . . . . . . . 5566 1 974 . 1 1 132 132 ASN HA H 1 5.07 0.00 . 1 . . . . . . . . 5566 1 975 . 1 1 132 132 ASN HB3 H 1 2.56 0.00 . 1 . . . . . . . . 5566 1 976 . 1 1 132 132 ASN CA C 13 52.88 0.00 . 1 . . . . . . . . 5566 1 977 . 1 1 132 132 ASN CB C 13 42.76 0.00 . 1 . . . . . . . . 5566 1 978 . 1 1 132 132 ASN N N 15 121.90 0.00 . 1 . . . . . . . . 5566 1 979 . 1 1 133 133 LEU H H 1 8.70 0.00 . 1 . . . . . . . . 5566 1 980 . 1 1 133 133 LEU HA H 1 4.94 0.00 . 1 . . . . . . . . 5566 1 981 . 1 1 133 133 LEU HB3 H 1 1.62 0.00 . 1 . . . . . . . . 5566 1 982 . 1 1 133 133 LEU HG H 1 1.49 0.00 . 1 . . . . . . . . 5566 1 983 . 1 1 133 133 LEU HD11 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 984 . 1 1 133 133 LEU HD12 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 985 . 1 1 133 133 LEU HD13 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 986 . 1 1 133 133 LEU HD21 H 1 0.63 0.00 . 1 . . . . . . . . 5566 1 987 . 1 1 133 133 LEU HD22 H 1 0.63 0.00 . 1 . . . . . . . . 5566 1 988 . 1 1 133 133 LEU HD23 H 1 0.63 0.00 . 1 . . . . . . . . 5566 1 989 . 1 1 133 133 LEU CA C 13 53.58 0.00 . 1 . . . . . . . . 5566 1 990 . 1 1 133 133 LEU CB C 13 42.24 0.00 . 1 . . . . . . . . 5566 1 991 . 1 1 133 133 LEU N N 15 126.56 0.00 . 1 . . . . . . . . 5566 1 992 . 1 1 134 134 MET H H 1 8.35 0.00 . 1 . . . . . . . . 5566 1 993 . 1 1 134 134 MET HA H 1 4.92 0.00 . 1 . . . . . . . . 5566 1 994 . 1 1 134 134 MET HB2 H 1 1.84 0.00 . 1 . . . . . . . . 5566 1 995 . 1 1 134 134 MET HB3 H 1 2.01 0.00 . 1 . . . . . . . . 5566 1 996 . 1 1 134 134 MET HG2 H 1 2.32 0.00 . 1 . . . . . . . . 5566 1 997 . 1 1 134 134 MET HG3 H 1 2.50 0.00 . 1 . . . . . . . . 5566 1 998 . 1 1 134 134 MET HE1 H 1 2.08 0.00 . 1 . . . . . . . . 5566 1 999 . 1 1 134 134 MET HE2 H 1 2.08 0.00 . 1 . . . . . . . . 5566 1 1000 . 1 1 134 134 MET HE3 H 1 2.08 0.00 . 1 . . . . . . . . 5566 1 1001 . 1 1 134 134 MET CA C 13 53.48 0.00 . 1 . . . . . . . . 5566 1 1002 . 1 1 134 134 MET CB C 13 36.40 0.00 . 1 . . . . . . . . 5566 1 1003 . 1 1 134 134 MET CG C 13 31.23 0.00 . 1 . . . . . . . . 5566 1 1004 . 1 1 134 134 MET CE C 13 17.60 0.00 . 1 . . . . . . . . 5566 1 1005 . 1 1 134 134 MET N N 15 123.45 0.00 . 1 . . . . . . . . 5566 1 1006 . 1 1 135 135 ALA H H 1 8.81 0.00 . 1 . . . . . . . . 5566 1 1007 . 1 1 135 135 ALA HA H 1 4.41 0.00 . 1 . . . . . . . . 5566 1 1008 . 1 1 135 135 ALA HB1 H 1 1.61 0.00 . 1 . . . . . . . . 5566 1 1009 . 1 1 135 135 ALA HB2 H 1 1.61 0.00 . 1 . . . . . . . . 5566 1 1010 . 1 1 135 135 ALA HB3 H 1 1.61 0.00 . 1 . . . . . . . . 5566 1 1011 . 1 1 135 135 ALA CA C 13 53.11 0.00 . 1 . . . . . . . . 5566 1 1012 . 1 1 135 135 ALA CB C 13 20.11 0.00 . 1 . . . . . . . . 5566 1 1013 . 1 1 135 135 ALA N N 15 127.88 0.00 . 1 . . . . . . . . 5566 1 1014 . 1 1 136 136 ALA H H 1 8.39 0.00 . 1 . . . . . . . . 5566 1 1015 . 1 1 136 136 ALA HA H 1 4.14 0.00 . 1 . . . . . . . . 5566 1 1016 . 1 1 136 136 ALA HB1 H 1 1.33 0.00 . 1 . . . . . . . . 5566 1 1017 . 1 1 136 136 ALA HB2 H 1 1.33 0.00 . 1 . . . . . . . . 5566 1 1018 . 1 1 136 136 ALA HB3 H 1 1.33 0.00 . 1 . . . . . . . . 5566 1 1019 . 1 1 136 136 ALA CA C 13 54.45 0.00 . 1 . . . . . . . . 5566 1 1020 . 1 1 136 136 ALA CB C 13 18.55 0.00 . 1 . . . . . . . . 5566 1 1021 . 1 1 136 136 ALA N N 15 125.23 0.00 . 1 . . . . . . . . 5566 1 1022 . 1 1 137 137 ASP H H 1 8.28 0.00 . 1 . . . . . . . . 5566 1 1023 . 1 1 137 137 ASP HA H 1 4.51 0.00 . 1 . . . . . . . . 5566 1 1024 . 1 1 137 137 ASP HB2 H 1 2.73 0.00 . 1 . . . . . . . . 5566 1 1025 . 1 1 137 137 ASP HB3 H 1 2.87 0.00 . 1 . . . . . . . . 5566 1 1026 . 1 1 137 137 ASP CA C 13 54.74 0.00 . 1 . . . . . . . . 5566 1 1027 . 1 1 137 137 ASP CB C 13 40.15 0.00 . 1 . . . . . . . . 5566 1 1028 . 1 1 137 137 ASP N N 15 114.59 0.00 . 1 . . . . . . . . 5566 1 1029 . 1 1 139 139 LYS H H 1 8.02 0.00 . 1 . . . . . . . . 5566 1 1030 . 1 1 139 139 LYS HA H 1 4.18 0.00 . 1 . . . . . . . . 5566 1 1031 . 1 1 139 139 LYS HB2 H 1 1.73 0.00 . 1 . . . . . . . . 5566 1 1032 . 1 1 139 139 LYS HB3 H 1 1.87 0.00 . 1 . . . . . . . . 5566 1 1033 . 1 1 139 139 LYS HG3 H 1 1.60 0.00 . 1 . . . . . . . . 5566 1 1034 . 1 1 139 139 LYS HE3 H 1 3.19 0.00 . 1 . . . . . . . . 5566 1 1035 . 1 1 139 139 LYS CA C 13 57.30 0.00 . 1 . . . . . . . . 5566 1 1036 . 1 1 139 139 LYS CB C 13 31.70 0.00 . 1 . . . . . . . . 5566 1 1037 . 1 1 139 139 LYS N N 15 117.47 0.00 . 1 . . . . . . . . 5566 1 1038 . 1 1 140 140 GLN H H 1 7.40 0.00 . 1 . . . . . . . . 5566 1 1039 . 1 1 140 140 GLN HA H 1 4.36 0.00 . 1 . . . . . . . . 5566 1 1040 . 1 1 140 140 GLN HB2 H 1 1.85 0.00 . 1 . . . . . . . . 5566 1 1041 . 1 1 140 140 GLN HB3 H 1 1.94 0.00 . 1 . . . . . . . . 5566 1 1042 . 1 1 140 140 GLN HG2 H 1 2.07 0.00 . 1 . . . . . . . . 5566 1 1043 . 1 1 140 140 GLN HG3 H 1 2.12 0.00 . 1 . . . . . . . . 5566 1 1044 . 1 1 140 140 GLN CA C 13 54.76 0.00 . 1 . . . . . . . . 5566 1 1045 . 1 1 140 140 GLN CB C 13 30.77 0.00 . 1 . . . . . . . . 5566 1 1046 . 1 1 140 140 GLN CG C 13 33.11 0.00 . 1 . . . . . . . . 5566 1 1047 . 1 1 140 140 GLN N N 15 117.95 0.00 . 1 . . . . . . . . 5566 1 1048 . 1 1 141 141 ILE H H 1 8.65 0.00 . 1 . . . . . . . . 5566 1 1049 . 1 1 141 141 ILE HA H 1 4.13 0.00 . 1 . . . . . . . . 5566 1 1050 . 1 1 141 141 ILE HB H 1 1.77 0.00 . 1 . . . . . . . . 5566 1 1051 . 1 1 141 141 ILE HG12 H 1 1.11 0.00 . 1 . . . . . . . . 5566 1 1052 . 1 1 141 141 ILE HG13 H 1 1.49 0.00 . 1 . . . . . . . . 5566 1 1053 . 1 1 141 141 ILE HG21 H 1 0.62 0.00 . 1 . . . . . . . . 5566 1 1054 . 1 1 141 141 ILE HG22 H 1 0.62 0.00 . 1 . . . . . . . . 5566 1 1055 . 1 1 141 141 ILE HG23 H 1 0.62 0.00 . 1 . . . . . . . . 5566 1 1056 . 1 1 141 141 ILE HD11 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 1057 . 1 1 141 141 ILE HD12 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 1058 . 1 1 141 141 ILE HD13 H 1 0.79 0.00 . 1 . . . . . . . . 5566 1 1059 . 1 1 141 141 ILE CA C 13 60.88 0.00 . 1 . . . . . . . . 5566 1 1060 . 1 1 141 141 ILE CB C 13 37.81 0.00 . 1 . . . . . . . . 5566 1 1061 . 1 1 141 141 ILE CG1 C 13 27.96 0.00 . 1 . . . . . . . . 5566 1 1062 . 1 1 141 141 ILE CG2 C 13 17.13 0.00 . 1 . . . . . . . . 5566 1 1063 . 1 1 141 141 ILE CD1 C 13 12.55 0.00 . 1 . . . . . . . . 5566 1 1064 . 1 1 141 141 ILE N N 15 126.78 0.00 . 1 . . . . . . . . 5566 1 1065 . 1 1 142 142 ILE H H 1 8.34 0.00 . 1 . . . . . . . . 5566 1 1066 . 1 1 142 142 ILE HA H 1 3.50 0.00 . 1 . . . . . . . . 5566 1 1067 . 1 1 142 142 ILE HB H 1 1.12 0.00 . 1 . . . . . . . . 5566 1 1068 . 1 1 142 142 ILE HG12 H 1 0.42 0.00 . 1 . . . . . . . . 5566 1 1069 . 1 1 142 142 ILE HG13 H 1 0.80 0.00 . 1 . . . . . . . . 5566 1 1070 . 1 1 142 142 ILE HG21 H 1 0.07 0.00 . 1 . . . . . . . . 5566 1 1071 . 1 1 142 142 ILE HG22 H 1 0.07 0.00 . 1 . . . . . . . . 5566 1 1072 . 1 1 142 142 ILE HG23 H 1 0.07 0.00 . 1 . . . . . . . . 5566 1 1073 . 1 1 142 142 ILE HD11 H 1 0.15 0.00 . 1 . . . . . . . . 5566 1 1074 . 1 1 142 142 ILE HD12 H 1 0.15 0.00 . 1 . . . . . . . . 5566 1 1075 . 1 1 142 142 ILE HD13 H 1 0.15 0.00 . 1 . . . . . . . . 5566 1 1076 . 1 1 142 142 ILE CA C 13 62.05 0.00 . 1 . . . . . . . . 5566 1 1077 . 1 1 142 142 ILE CB C 13 37.58 0.00 . 1 . . . . . . . . 5566 1 1078 . 1 1 142 142 ILE CG1 C 13 27.70 0.00 . 1 . . . . . . . . 5566 1 1079 . 1 1 142 142 ILE CG2 C 13 16.18 0.00 . 1 . . . . . . . . 5566 1 1080 . 1 1 142 142 ILE CD1 C 13 12.64 0.00 . 1 . . . . . . . . 5566 1 1081 . 1 1 142 142 ILE N N 15 128.99 0.00 . 1 . . . . . . . . 5566 1 1082 . 1 1 143 143 ALA H H 1 7.43 0.00 . 1 . . . . . . . . 5566 1 1083 . 1 1 143 143 ALA HA H 1 4.04 0.00 . 1 . . . . . . . . 5566 1 1084 . 1 1 143 143 ALA HB1 H 1 0.64 0.00 . 1 . . . . . . . . 5566 1 1085 . 1 1 143 143 ALA HB2 H 1 0.64 0.00 . 1 . . . . . . . . 5566 1 1086 . 1 1 143 143 ALA HB3 H 1 0.64 0.00 . 1 . . . . . . . . 5566 1 1087 . 1 1 143 143 ALA CA C 13 52.17 0.00 . 1 . . . . . . . . 5566 1 1088 . 1 1 143 143 ALA CB C 13 21.31 0.00 . 1 . . . . . . . . 5566 1 1089 . 1 1 143 143 ALA N N 15 118.14 0.00 . 1 . . . . . . . . 5566 1 1090 . 1 1 144 144 ASN H H 1 8.13 0.00 . 1 . . . . . . . . 5566 1 1091 . 1 1 144 144 ASN HA H 1 4.99 0.00 . 1 . . . . . . . . 5566 1 1092 . 1 1 144 144 ASN HB2 H 1 2.29 0.00 . 1 . . . . . . . . 5566 1 1093 . 1 1 144 144 ASN HB3 H 1 2.29 0.00 . 1 . . . . . . . . 5566 1 1094 . 1 1 144 144 ASN CA C 13 52.97 0.00 . 1 . . . . . . . . 5566 1 1095 . 1 1 144 144 ASN CB C 13 40.64 0.00 . 1 . . . . . . . . 5566 1 1096 . 1 1 144 144 ASN N N 15 119.47 0.00 . 1 . . . . . . . . 5566 1 1097 . 1 1 145 145 HIS H H 1 7.99 0.00 . 1 . . . . . . . . 5566 1 1098 . 1 1 145 145 HIS CA C 13 59.60 0.00 . 1 . . . . . . . . 5566 1 1099 . 1 1 145 145 HIS CB C 13 31.70 0.00 . 1 . . . . . . . . 5566 1 1100 . 1 1 145 145 HIS N N 15 124.90 0.00 . 1 . . . . . . . . 5566 1 1101 . 1 1 147 147 MET CA C 13 57.59 0.00 . 1 . . . . . . . . 5566 1 1102 . 1 1 148 148 GLN H H 1 9.61 0.00 . 1 . . . . . . . . 5566 1 1103 . 1 1 148 148 GLN HA H 1 4.29 0.00 . 1 . . . . . . . . 5566 1 1104 . 1 1 148 148 GLN HB2 H 1 2.12 0.00 . 1 . . . . . . . . 5566 1 1105 . 1 1 148 148 GLN HB3 H 1 2.22 0.00 . 1 . . . . . . . . 5566 1 1106 . 1 1 148 148 GLN HG3 H 1 2.46 0.00 . 1 . . . . . . . . 5566 1 1107 . 1 1 148 148 GLN CA C 13 57.82 0.00 . 1 . . . . . . . . 5566 1 1108 . 1 1 148 148 GLN CB C 13 27.90 0.00 . 1 . . . . . . . . 5566 1 1109 . 1 1 148 148 GLN CG C 13 33.58 0.00 . 1 . . . . . . . . 5566 1 1110 . 1 1 148 148 GLN N N 15 115.92 0.00 . 1 . . . . . . . . 5566 1 1111 . 1 1 149 149 SER H H 1 8.25 0.00 . 1 . . . . . . . . 5566 1 1112 . 1 1 149 149 SER HA H 1 4.70 0.00 . 1 . . . . . . . . 5566 1 1113 . 1 1 149 149 SER CA C 13 58.31 0.00 . 1 . . . . . . . . 5566 1 1114 . 1 1 149 149 SER CB C 13 64.88 0.00 . 1 . . . . . . . . 5566 1 1115 . 1 1 149 149 SER N N 15 114.59 0.00 . 1 . . . . . . . . 5566 1 1116 . 1 1 150 150 ILE H H 1 7.56 0.00 . 1 . . . . . . . . 5566 1 1117 . 1 1 150 150 ILE HA H 1 5.08 0.00 . 1 . . . . . . . . 5566 1 1118 . 1 1 150 150 ILE HB H 1 2.36 0.00 . 1 . . . . . . . . 5566 1 1119 . 1 1 150 150 ILE HG13 H 1 1.94 0.00 . 1 . . . . . . . . 5566 1 1120 . 1 1 150 150 ILE HG21 H 1 1.03 0.00 . 1 . . . . . . . . 5566 1 1121 . 1 1 150 150 ILE HG22 H 1 1.03 0.00 . 1 . . . . . . . . 5566 1 1122 . 1 1 150 150 ILE HG23 H 1 1.03 0.00 . 1 . . . . . . . . 5566 1 1123 . 1 1 150 150 ILE HD11 H 1 0.84 0.00 . 1 . . . . . . . . 5566 1 1124 . 1 1 150 150 ILE HD12 H 1 0.84 0.00 . 1 . . . . . . . . 5566 1 1125 . 1 1 150 150 ILE HD13 H 1 0.84 0.00 . 1 . . . . . . . . 5566 1 1126 . 1 1 150 150 ILE CA C 13 60.60 0.00 . 1 . . . . . . . . 5566 1 1127 . 1 1 150 150 ILE CB C 13 37.58 0.00 . 1 . . . . . . . . 5566 1 1128 . 1 1 150 150 ILE CG2 C 13 16.64 0.00 . 1 . . . . . . . . 5566 1 1129 . 1 1 150 150 ILE CD1 C 13 14.05 0.00 . 1 . . . . . . . . 5566 1 1130 . 1 1 150 150 ILE N N 15 124.34 0.00 . 1 . . . . . . . . 5566 1 1131 . 1 1 151 151 SER H H 1 8.53 0.00 . 1 . . . . . . . . 5566 1 1132 . 1 1 151 151 SER N N 15 119.14 0.00 . 1 . . . . . . . . 5566 1 1133 . 1 1 152 152 PHE H H 1 7.34 0.00 . 1 . . . . . . . . 5566 1 1134 . 1 1 152 152 PHE HD1 H 1 7.03 0.00 . 3 . . . . . . . . 5566 1 1135 . 1 1 152 152 PHE HE1 H 1 7.22 0.00 . 3 . . . . . . . . 5566 1 1136 . 1 1 154 154 SER H H 1 9.14 0.00 . 1 . . . . . . . . 5566 1 1137 . 1 1 154 154 SER HA H 1 4.57 0.00 . 1 . . . . . . . . 5566 1 1138 . 1 1 154 154 SER HB2 H 1 3.54 0.00 . 1 . . . . . . . . 5566 1 1139 . 1 1 154 154 SER HB3 H 1 3.82 0.00 . 1 . . . . . . . . 5566 1 1140 . 1 1 154 154 SER CA C 13 57.03 0.00 . 1 . . . . . . . . 5566 1 1141 . 1 1 154 154 SER CB C 13 65.82 0.00 . 1 . . . . . . . . 5566 1 1142 . 1 1 154 154 SER N N 15 113.27 0.00 . 1 . . . . . . . . 5566 1 1143 . 1 1 155 155 GLY H H 1 8.32 0.00 . 1 . . . . . . . . 5566 1 1144 . 1 1 155 155 GLY HA3 H 1 3.80 0.00 . 1 . . . . . . . . 5566 1 1145 . 1 1 155 155 GLY CA C 13 44.21 0.00 . 1 . . . . . . . . 5566 1 1146 . 1 1 155 155 GLY N N 15 109.93 0.00 . 1 . . . . . . . . 5566 1 1147 . 1 1 156 156 GLY H H 1 8.38 0.00 . 1 . . . . . . . . 5566 1 1148 . 1 1 156 156 GLY HA3 H 1 3.86 0.00 . 1 . . . . . . . . 5566 1 1149 . 1 1 156 156 GLY CA C 13 44.94 0.00 . 1 . . . . . . . . 5566 1 1150 . 1 1 156 156 GLY N N 15 105.96 0.00 . 1 . . . . . . . . 5566 1 1151 . 1 1 157 157 ASP H H 1 7.62 0.00 . 1 . . . . . . . . 5566 1 1152 . 1 1 157 157 ASP HA H 1 4.71 0.00 . 1 . . . . . . . . 5566 1 1153 . 1 1 157 157 ASP HB2 H 1 2.65 0.00 . 1 . . . . . . . . 5566 1 1154 . 1 1 157 157 ASP HB3 H 1 2.75 0.00 . 1 . . . . . . . . 5566 1 1155 . 1 1 157 157 ASP CA C 13 52.84 0.00 . 1 . . . . . . . . 5566 1 1156 . 1 1 157 157 ASP CB C 13 38.99 0.00 . 1 . . . . . . . . 5566 1 1157 . 1 1 157 157 ASP N N 15 121.02 0.00 . 1 . . . . . . . . 5566 1 1158 . 1 1 158 158 PRO HA H 1 4.28 0.00 . 1 . . . . . . . . 5566 1 1159 . 1 1 158 158 PRO HD2 H 1 3.72 0.00 . 1 . . . . . . . . 5566 1 1160 . 1 1 158 158 PRO HD3 H 1 3.88 0.00 . 1 . . . . . . . . 5566 1 1161 . 1 1 158 158 PRO CA C 13 65.85 0.00 . 1 . . . . . . . . 5566 1 1162 . 1 1 158 158 PRO CB C 13 31.40 0.00 . 1 . . . . . . . . 5566 1 1163 . 1 1 159 159 ASP H H 1 8.26 0.00 . 1 . . . . . . . . 5566 1 1164 . 1 1 159 159 ASP HA H 1 4.72 0.00 . 1 . . . . . . . . 5566 1 1165 . 1 1 159 159 ASP HB2 H 1 2.75 0.00 . 1 . . . . . . . . 5566 1 1166 . 1 1 159 159 ASP HB3 H 1 2.79 0.00 . 1 . . . . . . . . 5566 1 1167 . 1 1 159 159 ASP CA C 13 54.99 0.00 . 1 . . . . . . . . 5566 1 1168 . 1 1 159 159 ASP CB C 13 40.60 0.00 . 1 . . . . . . . . 5566 1 1169 . 1 1 159 159 ASP N N 15 113.05 0.00 . 1 . . . . . . . . 5566 1 1170 . 1 1 160 160 THR H H 1 8.01 0.00 . 1 . . . . . . . . 5566 1 1171 . 1 1 160 160 THR HA H 1 4.70 0.00 . 1 . . . . . . . . 5566 1 1172 . 1 1 160 160 THR HB H 1 4.71 0.00 . 1 . . . . . . . . 5566 1 1173 . 1 1 160 160 THR HG21 H 1 1.05 0.00 . 1 . . . . . . . . 5566 1 1174 . 1 1 160 160 THR HG22 H 1 1.05 0.00 . 1 . . . . . . . . 5566 1 1175 . 1 1 160 160 THR HG23 H 1 1.05 0.00 . 1 . . . . . . . . 5566 1 1176 . 1 1 160 160 THR CA C 13 59.70 0.00 . 1 . . . . . . . . 5566 1 1177 . 1 1 160 160 THR CB C 13 68.41 0.00 . 1 . . . . . . . . 5566 1 1178 . 1 1 160 160 THR CG2 C 13 22.78 0.00 . 1 . . . . . . . . 5566 1 1179 . 1 1 160 160 THR N N 15 113.27 0.00 . 1 . . . . . . . . 5566 1 1180 . 1 1 161 161 ALA H H 1 7.60 0.00 . 1 . . . . . . . . 5566 1 1181 . 1 1 161 161 ALA HA H 1 3.90 0.00 . 1 . . . . . . . . 5566 1 1182 . 1 1 161 161 ALA HB1 H 1 1.47 0.00 . 1 . . . . . . . . 5566 1 1183 . 1 1 161 161 ALA HB2 H 1 1.47 0.00 . 1 . . . . . . . . 5566 1 1184 . 1 1 161 161 ALA HB3 H 1 1.47 0.00 . 1 . . . . . . . . 5566 1 1185 . 1 1 161 161 ALA CA C 13 55.73 0.00 . 1 . . . . . . . . 5566 1 1186 . 1 1 161 161 ALA CB C 13 18.79 0.00 . 1 . . . . . . . . 5566 1 1187 . 1 1 161 161 ALA N N 15 124.34 0.00 . 1 . . . . . . . . 5566 1 1188 . 1 1 163 163 TYR HA H 1 5.53 0.00 . 1 . . . . . . . . 5566 1 1189 . 1 1 163 163 TYR HD1 H 1 6.92 0.00 . 3 . . . . . . . . 5566 1 1190 . 1 1 163 163 TYR HE1 H 1 6.76 0.00 . 3 . . . . . . . . 5566 1 1191 . 1 1 163 163 TYR CD1 C 13 132.30 0.00 . 3 . . . . . . . . 5566 1 1192 . 1 1 163 163 TYR CE1 C 13 119.77 0.00 . 3 . . . . . . . . 5566 1 1193 . 1 1 164 164 VAL H H 1 8.96 0.00 . 1 . . . . . . . . 5566 1 1194 . 1 1 164 164 VAL HA H 1 4.58 0.00 . 1 . . . . . . . . 5566 1 1195 . 1 1 164 164 VAL HB H 1 1.73 0.00 . 1 . . . . . . . . 5566 1 1196 . 1 1 164 164 VAL HG11 H 1 0.93 0.00 . 1 . . . . . . . . 5566 1 1197 . 1 1 164 164 VAL HG12 H 1 0.93 0.00 . 1 . . . . . . . . 5566 1 1198 . 1 1 164 164 VAL HG13 H 1 0.93 0.00 . 1 . . . . . . . . 5566 1 1199 . 1 1 164 164 VAL HG21 H 1 0.80 0.00 . 1 . . . . . . . . 5566 1 1200 . 1 1 164 164 VAL HG22 H 1 0.80 0.00 . 1 . . . . . . . . 5566 1 1201 . 1 1 164 164 VAL HG23 H 1 0.80 0.00 . 1 . . . . . . . . 5566 1 1202 . 1 1 164 164 VAL CA C 13 60.64 0.00 . 1 . . . . . . . . 5566 1 1203 . 1 1 164 164 VAL CB C 13 35.23 0.00 . 1 . . . . . . . . 5566 1 1204 . 1 1 164 164 VAL N N 15 119.91 0.00 . 1 . . . . . . . . 5566 1 1205 . 1 1 165 165 ALA H H 1 9.04 0.00 . 1 . . . . . . . . 5566 1 1206 . 1 1 165 165 ALA HA H 1 5.93 0.00 . 1 . . . . . . . . 5566 1 1207 . 1 1 165 165 ALA HB1 H 1 1.13 0.00 . 1 . . . . . . . . 5566 1 1208 . 1 1 165 165 ALA HB2 H 1 1.13 0.00 . 1 . . . . . . . . 5566 1 1209 . 1 1 165 165 ALA HB3 H 1 1.13 0.00 . 1 . . . . . . . . 5566 1 1210 . 1 1 165 165 ALA CA C 13 49.35 0.00 . 1 . . . . . . . . 5566 1 1211 . 1 1 165 165 ALA CB C 13 23.86 0.00 . 1 . . . . . . . . 5566 1 1212 . 1 1 165 165 ALA N N 15 127.88 0.00 . 1 . . . . . . . . 5566 1 1213 . 1 1 166 166 TYR H H 1 8.69 0.00 . 1 . . . . . . . . 5566 1 1214 . 1 1 166 166 TYR HA H 1 5.42 0.00 . 1 . . . . . . . . 5566 1 1215 . 1 1 166 166 TYR HB2 H 1 2.70 0.00 . 1 . . . . . . . . 5566 1 1216 . 1 1 166 166 TYR HB3 H 1 2.78 0.00 . 1 . . . . . . . . 5566 1 1217 . 1 1 166 166 TYR HD1 H 1 6.63 0.00 . 3 . . . . . . . . 5566 1 1218 . 1 1 166 166 TYR HE1 H 1 6.40 0.00 . 3 . . . . . . . . 5566 1 1219 . 1 1 166 166 TYR CA C 13 56.07 0.00 . 1 . . . . . . . . 5566 1 1220 . 1 1 166 166 TYR CB C 13 41.11 0.00 . 1 . . . . . . . . 5566 1 1221 . 1 1 166 166 TYR CD1 C 13 132.30 0.00 . 3 . . . . . . . . 5566 1 1222 . 1 1 166 166 TYR CE1 C 13 117.27 0.00 . 3 . . . . . . . . 5566 1 1223 . 1 1 166 166 TYR N N 15 116.14 0.00 . 1 . . . . . . . . 5566 1 1224 . 1 1 167 167 VAL H H 1 8.74 0.00 . 1 . . . . . . . . 5566 1 1225 . 1 1 167 167 VAL HA H 1 5.06 0.00 . 1 . . . . . . . . 5566 1 1226 . 1 1 167 167 VAL HB H 1 2.11 0.00 . 1 . . . . . . . . 5566 1 1227 . 1 1 167 167 VAL HG11 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 1228 . 1 1 167 167 VAL HG12 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 1229 . 1 1 167 167 VAL HG13 H 1 0.87 0.00 . 1 . . . . . . . . 5566 1 1230 . 1 1 167 167 VAL CA C 13 61.10 0.00 . 1 . . . . . . . . 5566 1 1231 . 1 1 167 167 VAL CB C 13 32.20 0.00 . 1 . . . . . . . . 5566 1 1232 . 1 1 167 167 VAL CG1 C 13 21.34 0.00 . 1 . . . . . . . . 5566 1 1233 . 1 1 167 167 VAL N N 15 122.35 0.00 . 1 . . . . . . . . 5566 1 1234 . 1 1 168 168 ALA H H 1 8.74 0.00 . 1 . . . . . . . . 5566 1 1235 . 1 1 168 168 ALA HA H 1 5.49 0.00 . 1 . . . . . . . . 5566 1 1236 . 1 1 168 168 ALA HB1 H 1 1.07 0.00 . 1 . . . . . . . . 5566 1 1237 . 1 1 168 168 ALA HB2 H 1 1.07 0.00 . 1 . . . . . . . . 5566 1 1238 . 1 1 168 168 ALA HB3 H 1 1.07 0.00 . 1 . . . . . . . . 5566 1 1239 . 1 1 168 168 ALA CA C 13 49.82 0.00 . 1 . . . . . . . . 5566 1 1240 . 1 1 168 168 ALA CB C 13 23.66 0.00 . 1 . . . . . . . . 5566 1 1241 . 1 1 168 168 ALA N N 15 128.10 0.00 . 1 . . . . . . . . 5566 1 1242 . 1 1 170 170 ASP HA H 1 5.15 0.00 . 1 . . . . . . . . 5566 1 1243 . 1 1 170 170 ASP HB2 H 1 2.92 0.00 . 1 . . . . . . . . 5566 1 1244 . 1 1 170 170 ASP HB3 H 1 3.32 0.00 . 1 . . . . . . . . 5566 1 1245 . 1 1 170 170 ASP CA C 13 53.35 0.00 . 1 . . . . . . . . 5566 1 1246 . 1 1 170 170 ASP CB C 13 42.99 0.00 . 1 . . . . . . . . 5566 1 1247 . 1 1 171 171 PRO HA H 1 4.50 0.00 . 1 . . . . . . . . 5566 1 1248 . 1 1 171 171 PRO HB3 H 1 2.51 0.00 . 1 . . . . . . . . 5566 1 1249 . 1 1 172 172 VAL H H 1 8.48 0.00 . 1 . . . . . . . . 5566 1 1250 . 1 1 172 172 VAL HA H 1 4.10 0.00 . 1 . . . . . . . . 5566 1 1251 . 1 1 172 172 VAL HB H 1 2.18 0.00 . 1 . . . . . . . . 5566 1 1252 . 1 1 172 172 VAL HG11 H 1 1.01 0.00 . 1 . . . . . . . . 5566 1 1253 . 1 1 172 172 VAL HG12 H 1 1.01 0.00 . 1 . . . . . . . . 5566 1 1254 . 1 1 172 172 VAL HG13 H 1 1.01 0.00 . 1 . . . . . . . . 5566 1 1255 . 1 1 172 172 VAL HG21 H 1 0.96 0.00 . 1 . . . . . . . . 5566 1 1256 . 1 1 172 172 VAL HG22 H 1 0.96 0.00 . 1 . . . . . . . . 5566 1 1257 . 1 1 172 172 VAL HG23 H 1 0.96 0.00 . 1 . . . . . . . . 5566 1 1258 . 1 1 172 172 VAL CA C 13 63.94 0.00 . 1 . . . . . . . . 5566 1 1259 . 1 1 172 172 VAL CB C 13 32.87 0.00 . 1 . . . . . . . . 5566 1 1260 . 1 1 172 172 VAL CG1 C 13 21.50 0.00 . 1 . . . . . . . . 5566 1 1261 . 1 1 172 172 VAL CG2 C 13 21.18 0.00 . 1 . . . . . . . . 5566 1 1262 . 1 1 172 172 VAL N N 15 116.81 0.00 . 1 . . . . . . . . 5566 1 1263 . 1 1 176 176 ALA H H 1 9.14 0.00 . 1 . . . . . . . . 5566 1 1264 . 1 1 176 176 ALA HA H 1 4.96 0.00 . 1 . . . . . . . . 5566 1 1265 . 1 1 176 176 ALA HB1 H 1 0.99 0.00 . 1 . . . . . . . . 5566 1 1266 . 1 1 176 176 ALA HB2 H 1 0.99 0.00 . 1 . . . . . . . . 5566 1 1267 . 1 1 176 176 ALA HB3 H 1 0.99 0.00 . 1 . . . . . . . . 5566 1 1268 . 1 1 176 176 ALA CA C 13 50.99 0.00 . 1 . . . . . . . . 5566 1 1269 . 1 1 176 176 ALA CB C 13 22.39 0.00 . 1 . . . . . . . . 5566 1 1270 . 1 1 176 176 ALA N N 15 121.07 0.00 . 1 . . . . . . . . 5566 1 1271 . 1 1 177 177 CYS H H 1 9.14 0.00 . 1 . . . . . . . . 5566 1 1272 . 1 1 177 177 CYS HA H 1 5.04 0.00 . 1 . . . . . . . . 5566 1 1273 . 1 1 177 177 CYS CA C 13 56.01 0.00 . 1 . . . . . . . . 5566 1 1274 . 1 1 177 177 CYS CB C 13 27.23 0.00 . 1 . . . . . . . . 5566 1 1275 . 1 1 177 177 CYS N N 15 121.02 0.00 . 1 . . . . . . . . 5566 1 1276 . 1 1 178 178 HIS H H 1 9.29 0.00 . 1 . . . . . . . . 5566 1 1277 . 1 1 178 178 HIS HA H 1 4.41 0.00 . 1 . . . . . . . . 5566 1 1278 . 1 1 178 178 HIS CA C 13 55.73 0.00 . 1 . . . . . . . . 5566 1 1279 . 1 1 178 178 HIS N N 15 130.99 0.00 . 1 . . . . . . . . 5566 1 1280 . 1 1 179 179 ILE H H 1 7.85 0.00 . 1 . . . . . . . . 5566 1 1281 . 1 1 179 179 ILE HA H 1 4.92 0.00 . 1 . . . . . . . . 5566 1 1282 . 1 1 179 179 ILE HB H 1 1.59 0.00 . 1 . . . . . . . . 5566 1 1283 . 1 1 179 179 ILE HD11 H 1 0.66 0.00 . 1 . . . . . . . . 5566 1 1284 . 1 1 179 179 ILE HD12 H 1 0.66 0.00 . 1 . . . . . . . . 5566 1 1285 . 1 1 179 179 ILE HD13 H 1 0.66 0.00 . 1 . . . . . . . . 5566 1 1286 . 1 1 179 179 ILE CA C 13 59.75 0.00 . 1 . . . . . . . . 5566 1 1287 . 1 1 179 179 ILE CB C 13 38.99 0.00 . 1 . . . . . . . . 5566 1 1288 . 1 1 179 179 ILE CD1 C 13 14.75 0.00 . 1 . . . . . . . . 5566 1 1289 . 1 1 179 179 ILE N N 15 119.91 0.00 . 1 . . . . . . . . 5566 1 1290 . 1 1 180 180 LEU H H 1 9.52 0.00 . 1 . . . . . . . . 5566 1 1291 . 1 1 180 180 LEU HA H 1 5.31 0.00 . 1 . . . . . . . . 5566 1 1292 . 1 1 180 180 LEU HB2 H 1 1.30 0.00 . 1 . . . . . . . . 5566 1 1293 . 1 1 180 180 LEU HB3 H 1 1.95 0.00 . 1 . . . . . . . . 5566 1 1294 . 1 1 180 180 LEU HD11 H 1 1.19 0.00 . 1 . . . . . . . . 5566 1 1295 . 1 1 180 180 LEU HD12 H 1 1.19 0.00 . 1 . . . . . . . . 5566 1 1296 . 1 1 180 180 LEU HD13 H 1 1.19 0.00 . 1 . . . . . . . . 5566 1 1297 . 1 1 180 180 LEU HD21 H 1 1.00 0.00 . 1 . . . . . . . . 5566 1 1298 . 1 1 180 180 LEU HD22 H 1 1.00 0.00 . 1 . . . . . . . . 5566 1 1299 . 1 1 180 180 LEU HD23 H 1 1.00 0.00 . 1 . . . . . . . . 5566 1 1300 . 1 1 180 180 LEU CA C 13 52.41 0.00 . 1 . . . . . . . . 5566 1 1301 . 1 1 180 180 LEU CB C 13 43.27 0.00 . 1 . . . . . . . . 5566 1 1302 . 1 1 180 180 LEU CD1 C 13 24.40 0.00 . 1 . . . . . . . . 5566 1 1303 . 1 1 180 180 LEU CD2 C 13 26.28 0.00 . 1 . . . . . . . . 5566 1 1304 . 1 1 180 180 LEU N N 15 125.89 0.00 . 1 . . . . . . . . 5566 1 1305 . 1 1 181 181 GLU H H 1 9.58 0.00 . 1 . . . . . . . . 5566 1 1306 . 1 1 181 181 GLU HA H 1 4.46 0.00 . 1 . . . . . . . . 5566 1 1307 . 1 1 181 181 GLU CA C 13 55.05 0.00 . 1 . . . . . . . . 5566 1 1308 . 1 1 181 181 GLU CB C 13 33.08 0.00 . 1 . . . . . . . . 5566 1 1309 . 1 1 181 181 GLU CG C 13 36.98 0.00 . 1 . . . . . . . . 5566 1 1310 . 1 1 181 181 GLU N N 15 124.78 0.00 . 1 . . . . . . . . 5566 1 1311 . 1 1 182 182 CYS H H 1 9.02 0.00 . 1 . . . . . . . . 5566 1 1312 . 1 1 182 182 CYS HA H 1 4.90 0.00 . 1 . . . . . . . . 5566 1 1313 . 1 1 182 182 CYS CA C 13 55.84 0.00 . 1 . . . . . . . . 5566 1 1314 . 1 1 182 182 CYS CB C 13 28.69 0.00 . 1 . . . . . . . . 5566 1 1315 . 1 1 182 182 CYS N N 15 127.31 0.00 . 1 . . . . . . . . 5566 1 1316 . 1 1 183 183 PRO HA H 1 4.53 0.00 . 1 . . . . . . . . 5566 1 1317 . 1 1 183 183 PRO HB2 H 1 2.00 0.00 . 1 . . . . . . . . 5566 1 1318 . 1 1 183 183 PRO HB3 H 1 2.44 0.00 . 1 . . . . . . . . 5566 1 1319 . 1 1 183 183 PRO CA C 13 62.76 0.00 . 1 . . . . . . . . 5566 1 1320 . 1 1 183 183 PRO CB C 13 32.40 0.00 . 1 . . . . . . . . 5566 1 1321 . 1 1 184 184 GLU H H 1 8.82 0.00 . 1 . . . . . . . . 5566 1 1322 . 1 1 184 184 GLU HA H 1 3.90 0.00 . 1 . . . . . . . . 5566 1 1323 . 1 1 184 184 GLU HB3 H 1 2.07 0.00 . 1 . . . . . . . . 5566 1 1324 . 1 1 184 184 GLU HG3 H 1 2.30 0.00 . 1 . . . . . . . . 5566 1 1325 . 1 1 184 184 GLU CA C 13 58.22 0.00 . 1 . . . . . . . . 5566 1 1326 . 1 1 184 184 GLU CB C 13 28.91 0.00 . 1 . . . . . . . . 5566 1 1327 . 1 1 184 184 GLU CG C 13 36.17 0.00 . 1 . . . . . . . . 5566 1 1328 . 1 1 184 184 GLU N N 15 120.07 0.00 . 1 . . . . . . . . 5566 1 1329 . 1 1 185 185 GLY H H 1 8.79 0.00 . 1 . . . . . . . . 5566 1 1330 . 1 1 185 185 GLY HA2 H 1 3.89 0.00 . 1 . . . . . . . . 5566 1 1331 . 1 1 185 185 GLY HA3 H 1 4.24 0.00 . 1 . . . . . . . . 5566 1 1332 . 1 1 185 185 GLY CA C 13 45.58 0.00 . 1 . . . . . . . . 5566 1 1333 . 1 1 185 185 GLY N N 15 111.27 0.00 . 1 . . . . . . . . 5566 1 1334 . 1 1 186 186 LEU H H 1 7.87 0.00 . 1 . . . . . . . . 5566 1 1335 . 1 1 186 186 LEU HA H 1 4.47 0.00 . 1 . . . . . . . . 5566 1 1336 . 1 1 186 186 LEU HB2 H 1 1.49 0.00 . 1 . . . . . . . . 5566 1 1337 . 1 1 186 186 LEU HB3 H 1 1.65 0.00 . 1 . . . . . . . . 5566 1 1338 . 1 1 186 186 LEU HG H 1 1.81 0.00 . 1 . . . . . . . . 5566 1 1339 . 1 1 186 186 LEU HD11 H 1 1.12 0.00 . 1 . . . . . . . . 5566 1 1340 . 1 1 186 186 LEU HD12 H 1 1.12 0.00 . 1 . . . . . . . . 5566 1 1341 . 1 1 186 186 LEU HD13 H 1 1.12 0.00 . 1 . . . . . . . . 5566 1 1342 . 1 1 186 186 LEU HD21 H 1 1.05 0.00 . 1 . . . . . . . . 5566 1 1343 . 1 1 186 186 LEU HD22 H 1 1.05 0.00 . 1 . . . . . . . . 5566 1 1344 . 1 1 186 186 LEU HD23 H 1 1.05 0.00 . 1 . . . . . . . . 5566 1 1345 . 1 1 186 186 LEU CA C 13 55.70 0.00 . 1 . . . . . . . . 5566 1 1346 . 1 1 186 186 LEU CB C 13 43.93 0.00 . 1 . . . . . . . . 5566 1 1347 . 1 1 186 186 LEU CG C 13 27.70 0.00 . 1 . . . . . . . . 5566 1 1348 . 1 1 186 186 LEU CD1 C 13 24.63 0.00 . 1 . . . . . . . . 5566 1 1349 . 1 1 186 186 LEU CD2 C 13 24.81 0.00 . 1 . . . . . . . . 5566 1 1350 . 1 1 186 186 LEU N N 15 120.70 0.00 . 1 . . . . . . . . 5566 1 1351 . 1 1 187 187 ALA H H 1 8.70 0.00 . 1 . . . . . . . . 5566 1 1352 . 1 1 187 187 ALA HA H 1 3.88 0.00 . 1 . . . . . . . . 5566 1 1353 . 1 1 187 187 ALA HB1 H 1 1.35 0.00 . 1 . . . . . . . . 5566 1 1354 . 1 1 187 187 ALA HB2 H 1 1.35 0.00 . 1 . . . . . . . . 5566 1 1355 . 1 1 187 187 ALA HB3 H 1 1.35 0.00 . 1 . . . . . . . . 5566 1 1356 . 1 1 187 187 ALA CA C 13 56.17 0.00 . 1 . . . . . . . . 5566 1 1357 . 1 1 187 187 ALA CB C 13 18.28 0.00 . 1 . . . . . . . . 5566 1 1358 . 1 1 187 187 ALA N N 15 123.40 0.00 . 1 . . . . . . . . 5566 1 1359 . 1 1 188 188 GLN H H 1 8.16 0.00 . 1 . . . . . . . . 5566 1 1360 . 1 1 188 188 GLN HA H 1 4.00 0.00 . 1 . . . . . . . . 5566 1 1361 . 1 1 188 188 GLN HB3 H 1 2.14 0.00 . 1 . . . . . . . . 5566 1 1362 . 1 1 188 188 GLN HG3 H 1 2.49 0.00 . 1 . . . . . . . . 5566 1 1363 . 1 1 188 188 GLN CA C 13 58.80 0.00 . 1 . . . . . . . . 5566 1 1364 . 1 1 188 188 GLN CB C 13 27.90 0.00 . 1 . . . . . . . . 5566 1 1365 . 1 1 188 188 GLN CG C 13 34.00 0.00 . 1 . . . . . . . . 5566 1 1366 . 1 1 188 188 GLN N N 15 113.49 0.00 . 1 . . . . . . . . 5566 1 1367 . 1 1 189 189 ASP H H 1 7.35 0.00 . 1 . . . . . . . . 5566 1 1368 . 1 1 189 189 ASP HA H 1 4.36 0.00 . 1 . . . . . . . . 5566 1 1369 . 1 1 189 189 ASP HB2 H 1 2.80 0.00 . 1 . . . . . . . . 5566 1 1370 . 1 1 189 189 ASP HB3 H 1 2.90 0.00 . 1 . . . . . . . . 5566 1 1371 . 1 1 189 189 ASP CA C 13 56.49 0.00 . 1 . . . . . . . . 5566 1 1372 . 1 1 189 189 ASP CB C 13 37.83 0.00 . 1 . . . . . . . . 5566 1 1373 . 1 1 189 189 ASP N N 15 122.35 0.00 . 1 . . . . . . . . 5566 1 1374 . 1 1 190 190 VAL H H 1 8.18 0.00 . 1 . . . . . . . . 5566 1 1375 . 1 1 190 190 VAL HA H 1 3.13 0.00 . 1 . . . . . . . . 5566 1 1376 . 1 1 190 190 VAL HB H 1 1.99 0.00 . 1 . . . . . . . . 5566 1 1377 . 1 1 190 190 VAL HG11 H 1 0.55 0.00 . 1 . . . . . . . . 5566 1 1378 . 1 1 190 190 VAL HG12 H 1 0.55 0.00 . 1 . . . . . . . . 5566 1 1379 . 1 1 190 190 VAL HG13 H 1 0.55 0.00 . 1 . . . . . . . . 5566 1 1380 . 1 1 190 190 VAL HG21 H 1 0.11 0.00 . 1 . . . . . . . . 5566 1 1381 . 1 1 190 190 VAL HG22 H 1 0.11 0.00 . 1 . . . . . . . . 5566 1 1382 . 1 1 190 190 VAL HG23 H 1 0.11 0.00 . 1 . . . . . . . . 5566 1 1383 . 1 1 190 190 VAL CA C 13 67.40 0.00 . 1 . . . . . . . . 5566 1 1384 . 1 1 190 190 VAL CB C 13 30.75 0.00 . 1 . . . . . . . . 5566 1 1385 . 1 1 190 190 VAL CG1 C 13 21.64 0.00 . 1 . . . . . . . . 5566 1 1386 . 1 1 190 190 VAL CG2 C 13 20.87 0.00 . 1 . . . . . . . . 5566 1 1387 . 1 1 190 190 VAL N N 15 122.12 0.00 . 1 . . . . . . . . 5566 1 1388 . 1 1 191 191 ILE H H 1 8.29 0.00 . 1 . . . . . . . . 5566 1 1389 . 1 1 191 191 ILE HA H 1 3.88 0.00 . 1 . . . . . . . . 5566 1 1390 . 1 1 191 191 ILE HB H 1 1.79 0.00 . 1 . . . . . . . . 5566 1 1391 . 1 1 191 191 ILE N N 15 117.92 0.00 . 1 . . . . . . . . 5566 1 1392 . 1 1 192 192 SER H H 1 8.02 0.00 . 1 . . . . . . . . 5566 1 1393 . 1 1 192 192 SER HA H 1 4.41 0.00 . 1 . . . . . . . . 5566 1 1394 . 1 1 192 192 SER N N 15 117.47 0.00 . 1 . . . . . . . . 5566 1 1395 . 1 1 193 193 THR H H 1 8.39 0.00 . 1 . . . . . . . . 5566 1 1396 . 1 1 193 193 THR N N 15 122.51 0.00 . 1 . . . . . . . . 5566 1 1397 . 1 1 194 194 ILE HG21 H 1 0.13 0.00 . 1 . . . . . . . . 5566 1 1398 . 1 1 194 194 ILE HG22 H 1 0.13 0.00 . 1 . . . . . . . . 5566 1 1399 . 1 1 194 194 ILE HG23 H 1 0.13 0.00 . 1 . . . . . . . . 5566 1 1400 . 1 1 194 194 ILE HD11 H 1 0.51 0.00 . 1 . . . . . . . . 5566 1 1401 . 1 1 194 194 ILE HD12 H 1 0.51 0.00 . 1 . . . . . . . . 5566 1 1402 . 1 1 194 194 ILE HD13 H 1 0.51 0.00 . 1 . . . . . . . . 5566 1 1403 . 1 1 194 194 ILE CD1 C 13 13.34 0.00 . 1 . . . . . . . . 5566 1 1404 . 1 1 195 195 GLY H H 1 8.25 0.00 . 1 . . . . . . . . 5566 1 1405 . 1 1 195 195 GLY CA C 13 44.73 0.00 . 1 . . . . . . . . 5566 1 1406 . 1 1 195 195 GLY N N 15 105.18 0.00 . 1 . . . . . . . . 5566 1 1407 . 1 1 196 196 GLN H H 1 8.05 0.00 . 1 . . . . . . . . 5566 1 1408 . 1 1 196 196 GLN CB C 13 27.21 0.00 . 1 . . . . . . . . 5566 1 1409 . 1 1 196 196 GLN N N 15 123.97 0.00 . 1 . . . . . . . . 5566 1 1410 . 1 1 197 197 ALA H H 1 8.08 0.00 . 1 . . . . . . . . 5566 1 1411 . 1 1 197 197 ALA HA H 1 3.52 0.00 . 1 . . . . . . . . 5566 1 1412 . 1 1 197 197 ALA HB1 H 1 1.02 0.00 . 1 . . . . . . . . 5566 1 1413 . 1 1 197 197 ALA HB2 H 1 1.02 0.00 . 1 . . . . . . . . 5566 1 1414 . 1 1 197 197 ALA HB3 H 1 1.02 0.00 . 1 . . . . . . . . 5566 1 1415 . 1 1 197 197 ALA CA C 13 55.08 0.00 . 1 . . . . . . . . 5566 1 1416 . 1 1 197 197 ALA CB C 13 18.03 0.00 . 1 . . . . . . . . 5566 1 1417 . 1 1 197 197 ALA N N 15 120.80 0.00 . 1 . . . . . . . . 5566 1 1418 . 1 1 198 198 PHE H H 1 8.62 0.00 . 1 . . . . . . . . 5566 1 1419 . 1 1 198 198 PHE N N 15 115.00 0.00 . 1 . . . . . . . . 5566 1 1420 . 1 1 199 199 GLU H H 1 8.30 0.00 . 1 . . . . . . . . 5566 1 1421 . 1 1 199 199 GLU HA H 1 4.11 0.00 . 1 . . . . . . . . 5566 1 1422 . 1 1 199 199 GLU CA C 13 59.47 0.00 . 1 . . . . . . . . 5566 1 1423 . 1 1 199 199 GLU CB C 13 29.58 0.00 . 1 . . . . . . . . 5566 1 1424 . 1 1 199 199 GLU N N 15 119.69 0.00 . 1 . . . . . . . . 5566 1 1425 . 1 1 200 200 LEU H H 1 8.40 0.00 . 1 . . . . . . . . 5566 1 1426 . 1 1 200 200 LEU HA H 1 4.10 0.00 . 1 . . . . . . . . 5566 1 1427 . 1 1 200 200 LEU HB3 H 1 1.70 0.00 . 1 . . . . . . . . 5566 1 1428 . 1 1 200 200 LEU HD11 H 1 0.85 0.00 . 1 . . . . . . . . 5566 1 1429 . 1 1 200 200 LEU HD12 H 1 0.85 0.00 . 1 . . . . . . . . 5566 1 1430 . 1 1 200 200 LEU HD13 H 1 0.85 0.00 . 1 . . . . . . . . 5566 1 1431 . 1 1 200 200 LEU HD21 H 1 0.68 0.00 . 1 . . . . . . . . 5566 1 1432 . 1 1 200 200 LEU HD22 H 1 0.68 0.00 . 1 . . . . . . . . 5566 1 1433 . 1 1 200 200 LEU HD23 H 1 0.68 0.00 . 1 . . . . . . . . 5566 1 1434 . 1 1 200 200 LEU N N 15 117.92 0.00 . 1 . . . . . . . . 5566 1 1435 . 1 1 201 201 ARG CA C 13 56.01 0.00 . 1 . . . . . . . . 5566 1 1436 . 1 1 201 201 ARG CB C 13 27.94 0.00 . 1 . . . . . . . . 5566 1 1437 . 1 1 202 202 PHE H H 1 7.87 0.00 . 1 . . . . . . . . 5566 1 1438 . 1 1 202 202 PHE HA H 1 5.52 0.00 . 1 . . . . . . . . 5566 1 1439 . 1 1 202 202 PHE CA C 13 57.73 0.00 . 1 . . . . . . . . 5566 1 1440 . 1 1 202 202 PHE CB C 13 41.81 0.00 . 1 . . . . . . . . 5566 1 1441 . 1 1 202 202 PHE N N 15 117.67 0.00 . 1 . . . . . . . . 5566 1 1442 . 1 1 203 203 LYS H H 1 7.94 0.00 . 1 . . . . . . . . 5566 1 1443 . 1 1 203 203 LYS HA H 1 4.17 0.00 . 1 . . . . . . . . 5566 1 1444 . 1 1 203 203 LYS HB2 H 1 1.71 0.00 . 1 . . . . . . . . 5566 1 1445 . 1 1 203 203 LYS HB3 H 1 1.90 0.00 . 1 . . . . . . . . 5566 1 1446 . 1 1 203 203 LYS HG3 H 1 1.47 0.00 . 1 . . . . . . . . 5566 1 1447 . 1 1 203 203 LYS HD3 H 1 1.58 0.00 . 1 . . . . . . . . 5566 1 1448 . 1 1 203 203 LYS HE3 H 1 2.94 0.00 . 1 . . . . . . . . 5566 1 1449 . 1 1 203 203 LYS CA C 13 57.16 0.00 . 1 . . . . . . . . 5566 1 1450 . 1 1 203 203 LYS CB C 13 31.94 0.00 . 1 . . . . . . . . 5566 1 1451 . 1 1 203 203 LYS CG C 13 25.01 0.00 . 1 . . . . . . . . 5566 1 1452 . 1 1 203 203 LYS CD C 13 41.49 0.00 . 1 . . . . . . . . 5566 1 1453 . 1 1 203 203 LYS N N 15 119.25 0.00 . 1 . . . . . . . . 5566 1 1454 . 1 1 204 204 GLN H H 1 7.94 0.00 . 1 . . . . . . . . 5566 1 1455 . 1 1 204 204 GLN HA H 1 4.20 0.00 . 1 . . . . . . . . 5566 1 1456 . 1 1 204 204 GLN HB3 H 1 1.98 0.00 . 1 . . . . . . . . 5566 1 1457 . 1 1 204 204 GLN HG2 H 1 2.10 0.00 . 1 . . . . . . . . 5566 1 1458 . 1 1 204 204 GLN HG3 H 1 2.26 0.00 . 1 . . . . . . . . 5566 1 1459 . 1 1 204 204 GLN CA C 13 56.41 0.00 . 1 . . . . . . . . 5566 1 1460 . 1 1 204 204 GLN CB C 13 29.58 0.00 . 1 . . . . . . . . 5566 1 1461 . 1 1 204 204 GLN CG C 13 33.81 0.00 . 1 . . . . . . . . 5566 1 1462 . 1 1 204 204 GLN N N 15 118.36 0.00 . 1 . . . . . . . . 5566 1 1463 . 1 1 205 205 TYR H H 1 7.86 0.00 . 1 . . . . . . . . 5566 1 1464 . 1 1 205 205 TYR HA H 1 4.61 0.00 . 1 . . . . . . . . 5566 1 1465 . 1 1 205 205 TYR HB2 H 1 2.92 0.00 . 1 . . . . . . . . 5566 1 1466 . 1 1 205 205 TYR HB3 H 1 3.15 0.00 . 1 . . . . . . . . 5566 1 1467 . 1 1 205 205 TYR HD1 H 1 7.16 0.00 . 3 . . . . . . . . 5566 1 1468 . 1 1 205 205 TYR HE1 H 1 6.80 0.00 . 3 . . . . . . . . 5566 1 1469 . 1 1 205 205 TYR CA C 13 58.05 0.00 . 1 . . . . . . . . 5566 1 1470 . 1 1 205 205 TYR CB C 13 38.52 0.00 . 1 . . . . . . . . 5566 1 1471 . 1 1 205 205 TYR CD1 C 13 133.13 0.00 . 3 . . . . . . . . 5566 1 1472 . 1 1 205 205 TYR CE1 C 13 118.10 0.00 . 3 . . . . . . . . 5566 1 1473 . 1 1 205 205 TYR N N 15 118.45 0.00 . 1 . . . . . . . . 5566 1 1474 . 1 1 206 206 LEU H H 1 7.87 0.00 . 1 . . . . . . . . 5566 1 1475 . 1 1 206 206 LEU HA H 1 4.34 0.00 . 1 . . . . . . . . 5566 1 1476 . 1 1 206 206 LEU HB3 H 1 1.61 0.00 . 1 . . . . . . . . 5566 1 1477 . 1 1 206 206 LEU HD11 H 1 0.82 0.00 . 1 . . . . . . . . 5566 1 1478 . 1 1 206 206 LEU HD12 H 1 0.82 0.00 . 1 . . . . . . . . 5566 1 1479 . 1 1 206 206 LEU HD13 H 1 0.82 0.00 . 1 . . . . . . . . 5566 1 1480 . 1 1 206 206 LEU HD21 H 1 0.86 0.00 . 1 . . . . . . . . 5566 1 1481 . 1 1 206 206 LEU HD22 H 1 0.86 0.00 . 1 . . . . . . . . 5566 1 1482 . 1 1 206 206 LEU HD23 H 1 0.86 0.00 . 1 . . . . . . . . 5566 1 1483 . 1 1 206 206 LEU CA C 13 55.19 0.00 . 1 . . . . . . . . 5566 1 1484 . 1 1 206 206 LEU CB C 13 42.16 0.00 . 1 . . . . . . . . 5566 1 1485 . 1 1 206 206 LEU CG C 13 24.61 0.00 . 1 . . . . . . . . 5566 1 1486 . 1 1 206 206 LEU CD1 C 13 23.45 0.00 . 1 . . . . . . . . 5566 1 1487 . 1 1 206 206 LEU CD2 C 13 25.37 0.00 . 1 . . . . . . . . 5566 1 1488 . 1 1 206 206 LEU N N 15 122.80 0.00 . 1 . . . . . . . . 5566 1 1489 . 1 1 207 207 ARG H H 1 7.69 0.00 . 1 . . . . . . . . 5566 1 1490 . 1 1 207 207 ARG HA H 1 4.17 0.00 . 1 . . . . . . . . 5566 1 1491 . 1 1 207 207 ARG HB2 H 1 1.71 0.00 . 1 . . . . . . . . 5566 1 1492 . 1 1 207 207 ARG HB3 H 1 1.85 0.00 . 1 . . . . . . . . 5566 1 1493 . 1 1 207 207 ARG HG3 H 1 1.58 0.00 . 1 . . . . . . . . 5566 1 1494 . 1 1 207 207 ARG HD3 H 1 3.16 0.00 . 1 . . . . . . . . 5566 1 1495 . 1 1 207 207 ARG CA C 13 56.96 0.00 . 1 . . . . . . . . 5566 1 1496 . 1 1 207 207 ARG CB C 13 31.15 0.00 . 1 . . . . . . . . 5566 1 1497 . 1 1 207 207 ARG N N 15 126.34 0.00 . 1 . . . . . . . . 5566 1 stop_ save_