data_17909 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17909 _Entry.Title ; Resonance assignments of human Steroidogenic acute regulatory-related lipid transfer domain protein 5 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-09-01 _Entry.Accession_date 2011-09-01 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Aurelien Lorin . . . 17909 2 Danny Letourneau . . . 17909 3 Andree Lefebvre . . . 17909 4 Jean-Guy LeHoux . . . 17909 5 Pierre Lavigne . . . 17909 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 17909 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Biochemistry Department of Universite de Sherbrooke' . 17909 2 . 'Pharmacology Department of Universite de Sherbrooke' . 17909 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17909 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 705 17909 '15N chemical shifts' 190 17909 '1H chemical shifts' 344 17909 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 2 . . 2014-05-14 2011-09-01 update BMRB 'update entry citation' 17909 1 . . 2011-10-03 2011-09-01 original author 'original release' 17909 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17909 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22392336 _Citation.Full_citation . _Citation.Title '(1)H, (13)C, and (15)N backbone chemical shift assignments of StAR-related lipid transfer domain protein 5 (STARD5).' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 7 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 21 _Citation.Page_last 24 _Citation.Year 2013 _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 Aurelien Lorin . . . 17909 1 2 Danny Letourneau . . . 17909 1 3 Andree Lefebvre . . . 17909 1 4 Jean-Guy LeHoux . . . 17909 1 5 Pierre Lavigne . . . 17909 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17909 _Assembly.ID 1 _Assembly.Name StarD5 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 23797.1169 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 StarD5 1 $StarD5 A . yes native no no . . . 17909 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_StarD5 _Entity.Sf_category entity _Entity.Sf_framecode StarD5 _Entity.Entry_ID 17909 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name StarD5 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MDPALAAQMSEAVAEKMLQY RRDTAGWKICREGNGVSVSW RPSVEFPGNLYRGEGIVYGT LEEVWDCVKPAVGGLRVKWD ENVTGFEIIQSITDTLCVSR TSTPSAAMKLISPRDFVDLV LVKRYEDGTISSNATHVEHP LCPPKPGFVRGFNHPCGCFC EPLPGEPTKTNLVTFFHTDL SGYLPQNVVDSFFPRSMTRF YANLQKAVKQFHE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 213 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 23797.1169 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UniProt Q9NSY2 . Q9NSY2 . . . . . . . . . . . . . . 17909 1 2 no BMRB 18721 . Molecule_1 . . . . . 100.00 213 100.00 100.00 3.08e-157 . . . . 17909 1 3 no PDB 2R55 . "Human Star-Related Lipid Transfer Protein 5" . . . . . 98.59 231 99.05 100.00 9.32e-154 . . . . 17909 1 4 no EMBL CAH91861 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 213 99.53 100.00 7.06e-157 . . . . 17909 1 5 no GB AAH04365 . "StAR-related lipid transfer (START) domain containing 5 [Homo sapiens]" . . . . . 100.00 213 100.00 100.00 3.08e-157 . . . . 17909 1 6 no GB AAL89654 . "START domain-containing 5 protein [Homo sapiens]" . . . . . 100.00 213 100.00 100.00 3.08e-157 . . . . 17909 1 7 no GB AIC52409 . "STARD5, partial [synthetic construct]" . . . . . 100.00 213 100.00 100.00 3.08e-157 . . . . 17909 1 8 no GB EAW99097 . "START domain containing 5, isoform CRA_c [Homo sapiens]" . . . . . 100.00 213 100.00 100.00 3.08e-157 . . . . 17909 1 9 no GB EHH27540 . "START domain-containing protein 5 [Macaca mulatta]" . . . . . 100.00 213 97.65 98.59 7.72e-153 . . . . 17909 1 10 no REF NP_001126078 . "stAR-related lipid transfer protein 5 [Pongo abelii]" . . . . . 100.00 213 99.53 100.00 7.06e-157 . . . . 17909 1 11 no REF NP_001247845 . "stAR-related lipid transfer protein 5 [Macaca mulatta]" . . . . . 100.00 213 97.65 98.59 7.72e-153 . . . . 17909 1 12 no REF NP_871629 . "stAR-related lipid transfer protein 5 [Homo sapiens]" . . . . . 100.00 213 100.00 100.00 3.08e-157 . . . . 17909 1 13 no REF XP_003281060 . "PREDICTED: stAR-related lipid transfer protein 5 [Nomascus leucogenys]" . . . . . 100.00 213 99.06 99.06 4.42e-155 . . . . 17909 1 14 no REF XP_003810787 . "PREDICTED: stAR-related lipid transfer protein 5 isoform X2 [Pan paniscus]" . . . . . 100.00 213 99.06 99.06 4.87e-155 . . . . 17909 1 15 no SP Q5R8P9 . "RecName: Full=StAR-related lipid transfer protein 5; AltName: Full=START domain-containing protein 5; Short=StARD5" . . . . . 100.00 213 99.53 100.00 7.06e-157 . . . . 17909 1 16 no SP Q9NSY2 . "RecName: Full=StAR-related lipid transfer protein 5; AltName: Full=START domain-containing protein 5; Short=StARD5" . . . . . 100.00 213 100.00 100.00 3.08e-157 . . . . 17909 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 . 17909 1 2 . ASP . 17909 1 3 . PRO . 17909 1 4 . ALA . 17909 1 5 . LEU . 17909 1 6 . ALA . 17909 1 7 . ALA . 17909 1 8 . GLN . 17909 1 9 . MET . 17909 1 10 . SER . 17909 1 11 . GLU . 17909 1 12 . ALA . 17909 1 13 . VAL . 17909 1 14 . ALA . 17909 1 15 . GLU . 17909 1 16 . LYS . 17909 1 17 . MET . 17909 1 18 . LEU . 17909 1 19 . GLN . 17909 1 20 . TYR . 17909 1 21 . ARG . 17909 1 22 . ARG . 17909 1 23 . ASP . 17909 1 24 . THR . 17909 1 25 . ALA . 17909 1 26 . GLY . 17909 1 27 . TRP . 17909 1 28 . LYS . 17909 1 29 . ILE . 17909 1 30 . CYS . 17909 1 31 . ARG . 17909 1 32 . GLU . 17909 1 33 . GLY . 17909 1 34 . ASN . 17909 1 35 . GLY . 17909 1 36 . VAL . 17909 1 37 . SER . 17909 1 38 . VAL . 17909 1 39 . SER . 17909 1 40 . TRP . 17909 1 41 . ARG . 17909 1 42 . PRO . 17909 1 43 . SER . 17909 1 44 . VAL . 17909 1 45 . GLU . 17909 1 46 . PHE . 17909 1 47 . PRO . 17909 1 48 . GLY . 17909 1 49 . ASN . 17909 1 50 . LEU . 17909 1 51 . TYR . 17909 1 52 . ARG . 17909 1 53 . GLY . 17909 1 54 . GLU . 17909 1 55 . GLY . 17909 1 56 . ILE . 17909 1 57 . VAL . 17909 1 58 . TYR . 17909 1 59 . GLY . 17909 1 60 . THR . 17909 1 61 . LEU . 17909 1 62 . GLU . 17909 1 63 . GLU . 17909 1 64 . VAL . 17909 1 65 . TRP . 17909 1 66 . ASP . 17909 1 67 . CYS . 17909 1 68 . VAL . 17909 1 69 . LYS . 17909 1 70 . PRO . 17909 1 71 . ALA . 17909 1 72 . VAL . 17909 1 73 . GLY . 17909 1 74 . GLY . 17909 1 75 . LEU . 17909 1 76 . ARG . 17909 1 77 . VAL . 17909 1 78 . LYS . 17909 1 79 . TRP . 17909 1 80 . ASP . 17909 1 81 . GLU . 17909 1 82 . ASN . 17909 1 83 . VAL . 17909 1 84 . THR . 17909 1 85 . GLY . 17909 1 86 . PHE . 17909 1 87 . GLU . 17909 1 88 . ILE . 17909 1 89 . ILE . 17909 1 90 . GLN . 17909 1 91 . SER . 17909 1 92 . ILE . 17909 1 93 . THR . 17909 1 94 . ASP . 17909 1 95 . THR . 17909 1 96 . LEU . 17909 1 97 . CYS . 17909 1 98 . VAL . 17909 1 99 . SER . 17909 1 100 . ARG . 17909 1 101 . THR . 17909 1 102 . SER . 17909 1 103 . THR . 17909 1 104 . PRO . 17909 1 105 . SER . 17909 1 106 . ALA . 17909 1 107 . ALA . 17909 1 108 . MET . 17909 1 109 . LYS . 17909 1 110 . LEU . 17909 1 111 . ILE . 17909 1 112 . SER . 17909 1 113 . PRO . 17909 1 114 . ARG . 17909 1 115 . ASP . 17909 1 116 . PHE . 17909 1 117 . VAL . 17909 1 118 . ASP . 17909 1 119 . LEU . 17909 1 120 . VAL . 17909 1 121 . LEU . 17909 1 122 . VAL . 17909 1 123 . LYS . 17909 1 124 . ARG . 17909 1 125 . TYR . 17909 1 126 . GLU . 17909 1 127 . ASP . 17909 1 128 . GLY . 17909 1 129 . THR . 17909 1 130 . ILE . 17909 1 131 . SER . 17909 1 132 . SER . 17909 1 133 . ASN . 17909 1 134 . ALA . 17909 1 135 . THR . 17909 1 136 . HIS . 17909 1 137 . VAL . 17909 1 138 . GLU . 17909 1 139 . HIS . 17909 1 140 . PRO . 17909 1 141 . LEU . 17909 1 142 . CYS . 17909 1 143 . PRO . 17909 1 144 . PRO . 17909 1 145 . LYS . 17909 1 146 . PRO . 17909 1 147 . GLY . 17909 1 148 . PHE . 17909 1 149 . VAL . 17909 1 150 . ARG . 17909 1 151 . GLY . 17909 1 152 . PHE . 17909 1 153 . ASN . 17909 1 154 . HIS . 17909 1 155 . PRO . 17909 1 156 . CYS . 17909 1 157 . GLY . 17909 1 158 . CYS . 17909 1 159 . PHE . 17909 1 160 . CYS . 17909 1 161 . GLU . 17909 1 162 . PRO . 17909 1 163 . LEU . 17909 1 164 . PRO . 17909 1 165 . GLY . 17909 1 166 . GLU . 17909 1 167 . PRO . 17909 1 168 . THR . 17909 1 169 . LYS . 17909 1 170 . THR . 17909 1 171 . ASN . 17909 1 172 . LEU . 17909 1 173 . VAL . 17909 1 174 . THR . 17909 1 175 . PHE . 17909 1 176 . PHE . 17909 1 177 . HIS . 17909 1 178 . THR . 17909 1 179 . ASP . 17909 1 180 . LEU . 17909 1 181 . SER . 17909 1 182 . GLY . 17909 1 183 . TYR . 17909 1 184 . LEU . 17909 1 185 . PRO . 17909 1 186 . GLN . 17909 1 187 . ASN . 17909 1 188 . VAL . 17909 1 189 . VAL . 17909 1 190 . ASP . 17909 1 191 . SER . 17909 1 192 . PHE . 17909 1 193 . PHE . 17909 1 194 . PRO . 17909 1 195 . ARG . 17909 1 196 . SER . 17909 1 197 . MET . 17909 1 198 . THR . 17909 1 199 . ARG . 17909 1 200 . PHE . 17909 1 201 . TYR . 17909 1 202 . ALA . 17909 1 203 . ASN . 17909 1 204 . LEU . 17909 1 205 . GLN . 17909 1 206 . LYS . 17909 1 207 . ALA . 17909 1 208 . VAL . 17909 1 209 . LYS . 17909 1 210 . GLN . 17909 1 211 . PHE . 17909 1 212 . HIS . 17909 1 213 . GLU . 17909 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 17909 1 . ASP 2 2 17909 1 . PRO 3 3 17909 1 . ALA 4 4 17909 1 . LEU 5 5 17909 1 . ALA 6 6 17909 1 . ALA 7 7 17909 1 . GLN 8 8 17909 1 . MET 9 9 17909 1 . SER 10 10 17909 1 . GLU 11 11 17909 1 . ALA 12 12 17909 1 . VAL 13 13 17909 1 . ALA 14 14 17909 1 . GLU 15 15 17909 1 . LYS 16 16 17909 1 . MET 17 17 17909 1 . LEU 18 18 17909 1 . GLN 19 19 17909 1 . TYR 20 20 17909 1 . ARG 21 21 17909 1 . ARG 22 22 17909 1 . ASP 23 23 17909 1 . THR 24 24 17909 1 . ALA 25 25 17909 1 . GLY 26 26 17909 1 . TRP 27 27 17909 1 . LYS 28 28 17909 1 . ILE 29 29 17909 1 . CYS 30 30 17909 1 . ARG 31 31 17909 1 . GLU 32 32 17909 1 . GLY 33 33 17909 1 . ASN 34 34 17909 1 . GLY 35 35 17909 1 . VAL 36 36 17909 1 . SER 37 37 17909 1 . VAL 38 38 17909 1 . SER 39 39 17909 1 . TRP 40 40 17909 1 . ARG 41 41 17909 1 . PRO 42 42 17909 1 . SER 43 43 17909 1 . VAL 44 44 17909 1 . GLU 45 45 17909 1 . PHE 46 46 17909 1 . PRO 47 47 17909 1 . GLY 48 48 17909 1 . ASN 49 49 17909 1 . LEU 50 50 17909 1 . TYR 51 51 17909 1 . ARG 52 52 17909 1 . GLY 53 53 17909 1 . GLU 54 54 17909 1 . GLY 55 55 17909 1 . ILE 56 56 17909 1 . VAL 57 57 17909 1 . TYR 58 58 17909 1 . GLY 59 59 17909 1 . THR 60 60 17909 1 . LEU 61 61 17909 1 . GLU 62 62 17909 1 . GLU 63 63 17909 1 . VAL 64 64 17909 1 . TRP 65 65 17909 1 . ASP 66 66 17909 1 . CYS 67 67 17909 1 . VAL 68 68 17909 1 . LYS 69 69 17909 1 . PRO 70 70 17909 1 . ALA 71 71 17909 1 . VAL 72 72 17909 1 . GLY 73 73 17909 1 . GLY 74 74 17909 1 . LEU 75 75 17909 1 . ARG 76 76 17909 1 . VAL 77 77 17909 1 . LYS 78 78 17909 1 . TRP 79 79 17909 1 . ASP 80 80 17909 1 . GLU 81 81 17909 1 . ASN 82 82 17909 1 . VAL 83 83 17909 1 . THR 84 84 17909 1 . GLY 85 85 17909 1 . PHE 86 86 17909 1 . GLU 87 87 17909 1 . ILE 88 88 17909 1 . ILE 89 89 17909 1 . GLN 90 90 17909 1 . SER 91 91 17909 1 . ILE 92 92 17909 1 . THR 93 93 17909 1 . ASP 94 94 17909 1 . THR 95 95 17909 1 . LEU 96 96 17909 1 . CYS 97 97 17909 1 . VAL 98 98 17909 1 . SER 99 99 17909 1 . ARG 100 100 17909 1 . THR 101 101 17909 1 . SER 102 102 17909 1 . THR 103 103 17909 1 . PRO 104 104 17909 1 . SER 105 105 17909 1 . ALA 106 106 17909 1 . ALA 107 107 17909 1 . MET 108 108 17909 1 . LYS 109 109 17909 1 . LEU 110 110 17909 1 . ILE 111 111 17909 1 . SER 112 112 17909 1 . PRO 113 113 17909 1 . ARG 114 114 17909 1 . ASP 115 115 17909 1 . PHE 116 116 17909 1 . VAL 117 117 17909 1 . ASP 118 118 17909 1 . LEU 119 119 17909 1 . VAL 120 120 17909 1 . LEU 121 121 17909 1 . VAL 122 122 17909 1 . LYS 123 123 17909 1 . ARG 124 124 17909 1 . TYR 125 125 17909 1 . GLU 126 126 17909 1 . ASP 127 127 17909 1 . GLY 128 128 17909 1 . THR 129 129 17909 1 . ILE 130 130 17909 1 . SER 131 131 17909 1 . SER 132 132 17909 1 . ASN 133 133 17909 1 . ALA 134 134 17909 1 . THR 135 135 17909 1 . HIS 136 136 17909 1 . VAL 137 137 17909 1 . GLU 138 138 17909 1 . HIS 139 139 17909 1 . PRO 140 140 17909 1 . LEU 141 141 17909 1 . CYS 142 142 17909 1 . PRO 143 143 17909 1 . PRO 144 144 17909 1 . LYS 145 145 17909 1 . PRO 146 146 17909 1 . GLY 147 147 17909 1 . PHE 148 148 17909 1 . VAL 149 149 17909 1 . ARG 150 150 17909 1 . GLY 151 151 17909 1 . PHE 152 152 17909 1 . ASN 153 153 17909 1 . HIS 154 154 17909 1 . PRO 155 155 17909 1 . CYS 156 156 17909 1 . GLY 157 157 17909 1 . CYS 158 158 17909 1 . PHE 159 159 17909 1 . CYS 160 160 17909 1 . GLU 161 161 17909 1 . PRO 162 162 17909 1 . LEU 163 163 17909 1 . PRO 164 164 17909 1 . GLY 165 165 17909 1 . GLU 166 166 17909 1 . PRO 167 167 17909 1 . THR 168 168 17909 1 . LYS 169 169 17909 1 . THR 170 170 17909 1 . ASN 171 171 17909 1 . LEU 172 172 17909 1 . VAL 173 173 17909 1 . THR 174 174 17909 1 . PHE 175 175 17909 1 . PHE 176 176 17909 1 . HIS 177 177 17909 1 . THR 178 178 17909 1 . ASP 179 179 17909 1 . LEU 180 180 17909 1 . SER 181 181 17909 1 . GLY 182 182 17909 1 . TYR 183 183 17909 1 . LEU 184 184 17909 1 . PRO 185 185 17909 1 . GLN 186 186 17909 1 . ASN 187 187 17909 1 . VAL 188 188 17909 1 . VAL 189 189 17909 1 . ASP 190 190 17909 1 . SER 191 191 17909 1 . PHE 192 192 17909 1 . PHE 193 193 17909 1 . PRO 194 194 17909 1 . ARG 195 195 17909 1 . SER 196 196 17909 1 . MET 197 197 17909 1 . THR 198 198 17909 1 . ARG 199 199 17909 1 . PHE 200 200 17909 1 . TYR 201 201 17909 1 . ALA 202 202 17909 1 . ASN 203 203 17909 1 . LEU 204 204 17909 1 . GLN 205 205 17909 1 . LYS 206 206 17909 1 . ALA 207 207 17909 1 . VAL 208 208 17909 1 . LYS 209 209 17909 1 . GLN 210 210 17909 1 . PHE 211 211 17909 1 . HIS 212 212 17909 1 . GLU 213 213 17909 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 17909 _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 $StarD5 . 562 organism . 'Escherichia coli BL21(DE3)' 'E. coli BL21(DE3)' . . Bacteria . Escherichia coli BL21 . . . . . . . . . . . . . . . . . . . . 17909 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 17909 _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 $StarD5 . 'recombinant technology' 'Escherichia coli' 'Escherichia coli' . . Escherichia coli BL21 . . . . . . . . . . . . . . . pET3A . . . . . . 17909 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_StarD5_1 _Sample.Sf_category sample _Sample.Sf_framecode StarD5_1 _Sample.Entry_ID 17909 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 StarD5 '[U-13C; U-15N; U-2H]' . . 1 $StarD5 . . 1.0 . . mM . . . . 17909 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17909 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17909 1 stop_ save_ ####################### # Sample conditions # ####################### save_CondSet1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode CondSet1 _Sample_condition_list.Entry_ID 17909 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.050 . M 17909 1 pH 7.400 . pH 17909 1 pressure 1.000 . atm 17909 1 temperature 298.000 . K 17909 1 stop_ save_ ############################ # Computer software used # ############################ save_CcpNmr_Analysis _Software.Sf_category software _Software.Sf_framecode CcpNmr_Analysis _Software.Entry_ID 17909 _Software.ID 1 _Software.Name ANALYSIS _Software.Version 2.1 _Software.Details 'The CCPN NMR assignment and data analysis application' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN 'Department of Biochemistry, Cambridge CB2 1GA, UK' http://www.ccpn.ac.uk 17909 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17909 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17909 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model UnityInova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17909 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian UnityInova . 600 . . . 17909 1 stop_ save_ save_probe_1 _NMR_spectrometer_probe.Sf_category NMR_spectrometer_probe _NMR_spectrometer_probe.Sf_framecode probe_1 _NMR_spectrometer_probe.Entry_ID 17909 _NMR_spectrometer_probe.ID 1 _NMR_spectrometer_probe.Details . _NMR_spectrometer_probe.Manufacturer Varian _NMR_spectrometer_probe.Model . _NMR_spectrometer_probe.Serial_number . _NMR_spectrometer_probe.Diameter . _NMR_spectrometer_probe.Rotor_length . _NMR_spectrometer_probe.Rotor_composition . _NMR_spectrometer_probe.Internal_volume . _NMR_spectrometer_probe.Spacer_present . loop_ _NMR_probe.Type _NMR_probe.Entry_ID _NMR_probe.NMR_spectrometer_probe_ID liquid 17909 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 17909 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCACB' no . . . . . . . . . . 1 $StarD5_1 isotropic . . 1 $CondSet1 . . . 1 $spectrometer_1 1 $probe_1 . . . . . . . . . . . . . . 17909 1 2 'Expt_4 (H[N[co[{CA|ca[C]}]]])' no . . . . . . . . . . 1 $StarD5_1 isotropic . . 1 $CondSet1 . . . 1 $spectrometer_1 1 $probe_1 . . . . . . . . . . . . . . 17909 1 3 '3D HNCACB' no . . . . . . . . . . 1 $StarD5_1 isotropic . . 1 $CondSet1 . . . 1 $spectrometer_1 1 $probe_1 . . . . . . . . . . . . . . 17909 1 4 '3D HNCO' no . . . . . . . . . . 1 $StarD5_1 isotropic . . 1 $CondSet1 . . . 1 $spectrometer_1 1 $probe_1 . . . . . . . . . . . . . . 17909 1 5 'Expt_49 (H{[N]+[HA]})' no . . . . . . . . . . 1 $StarD5_1 isotropic . . 1 $CondSet1 . . . 1 $spectrometer_1 1 $probe_1 . . . . . . . . . . . . . . 17909 1 6 'Expt_53 (H{[N]+[HA]})' no . . . . . . . . . . 1 $StarD5_1 isotropic . . 1 $CondSet1 . . . 1 $spectrometer_1 1 $probe_1 . . . . . . . . . . . . . . 17909 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17909 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 n/a indirect 0.251449530 . . . . . . . . . 17909 1 H 1 water protons . . . . ppm 4.66 internal indirect 1.000000000 . . . . . . . . . 17909 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 n/a indirect 0.101329118 . . . . . . . . . 17909 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 17909 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $CondSet1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCACB' 1 $StarD5_1 isotropic 17909 1 2 'Expt_4 (H[N[co[{CA|ca[C]}]]])' 1 $StarD5_1 isotropic 17909 1 4 '3D HNCO' 1 $StarD5_1 isotropic 17909 1 5 'Expt_49 (H{[N]+[HA]})' 1 $StarD5_1 isotropic 17909 1 6 'Expt_53 (H{[N]+[HA]})' 1 $StarD5_1 isotropic 17909 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 PRO C C 13 178.509 0.2 . 1 . 706 . . 3 PRO C . 17909 1 2 . 1 1 3 3 PRO CA C 13 65.135 0.2 . 1 . 627 . . 3 PRO CA . 17909 1 3 . 1 1 3 3 PRO CB C 13 32.020 0.2 . 1 . 628 . . 3 PRO CB . 17909 1 4 . 1 1 3 3 PRO CG C 13 27.033 0.2 . 1 . 1031 . . 3 PRO CG . 17909 1 5 . 1 1 4 4 ALA H H 1 8.203 0.024 . 1 . 94 . . 4 ALA H . 17909 1 6 . 1 1 4 4 ALA HA H 1 4.121 0.05 . 1 . 1087 . . 4 ALA HA . 17909 1 7 . 1 1 4 4 ALA C C 13 180.786 0.2 . 1 . 816 . . 4 ALA C . 17909 1 8 . 1 1 4 4 ALA CA C 13 54.440 0.2 . 1 . 625 . . 4 ALA CA . 17909 1 9 . 1 1 4 4 ALA CB C 13 17.444 0.2 . 1 . 358 . . 4 ALA CB . 17909 1 10 . 1 1 4 4 ALA N N 15 121.288 0.17 . 1 . 93 . . 4 ALA N . 17909 1 11 . 1 1 5 5 LEU H H 1 7.584 0.02 . 1 . 180 . . 5 LEU H . 17909 1 12 . 1 1 5 5 LEU HA H 1 4.124 0.05 . 1 . 1088 . . 5 LEU HA . 17909 1 13 . 1 1 5 5 LEU C C 13 179.033 0.2 . 1 . 708 . . 5 LEU C . 17909 1 14 . 1 1 5 5 LEU CA C 13 56.781 0.2 . 1 . 341 . . 5 LEU CA . 17909 1 15 . 1 1 5 5 LEU CB C 13 40.818 0.2 . 1 . 340 . . 5 LEU CB . 17909 1 16 . 1 1 5 5 LEU CG C 13 26.816 0.2 . 1 . 1034 . . 5 LEU CG . 17909 1 17 . 1 1 5 5 LEU CD1 C 13 23.505 0.2 . 1 . 1032 . . 5 LEU CD1 . 17909 1 18 . 1 1 5 5 LEU CD2 C 13 23.505 0.2 . 1 . 1033 . . 5 LEU CD2 . 17909 1 19 . 1 1 5 5 LEU N N 15 121.510 0.166 . 1 . 179 . . 5 LEU N . 17909 1 20 . 1 1 6 6 ALA H H 1 8.191 0.014 . 1 . 164 . . 6 ALA H . 17909 1 21 . 1 1 6 6 ALA HA H 1 3.940 0.05 . 1 . 1089 . . 6 ALA HA . 17909 1 22 . 1 1 6 6 ALA C C 13 179.895 0.2 . 1 . 787 . . 6 ALA C . 17909 1 23 . 1 1 6 6 ALA CA C 13 54.419 0.2 . 1 . 343 . . 6 ALA CA . 17909 1 24 . 1 1 6 6 ALA CB C 13 18.647 0.2 . 1 . 342 . . 6 ALA CB . 17909 1 25 . 1 1 6 6 ALA N N 15 120.364 0.159 . 1 . 163 . . 6 ALA N . 17909 1 26 . 1 1 7 7 ALA H H 1 8.047 0.015 . 1 . 25 . . 7 ALA H . 17909 1 27 . 1 1 7 7 ALA HA H 1 3.841 0.05 . 1 . 1090 . . 7 ALA HA . 17909 1 28 . 1 1 7 7 ALA C C 13 179.042 0.2 . 1 . 858 . . 7 ALA C . 17909 1 29 . 1 1 7 7 ALA CA C 13 54.743 0.2 . 1 . 344 . . 7 ALA CA . 17909 1 30 . 1 1 7 7 ALA CB C 13 17.651 0.2 . 1 . 345 . . 7 ALA CB . 17909 1 31 . 1 1 7 7 ALA N N 15 121.632 0.095 . 1 . 24 . . 7 ALA N . 17909 1 32 . 1 1 8 8 GLN H H 1 7.520 0.029 . 1 . 245 . . 8 GLN H . 17909 1 33 . 1 1 8 8 GLN HA H 1 3.898 0.05 . 1 . 1091 . . 8 GLN HA . 17909 1 34 . 1 1 8 8 GLN C C 13 179.295 0.2 . 1 . 782 . . 8 GLN C . 17909 1 35 . 1 1 8 8 GLN CA C 13 58.532 0.2 . 1 . 346 . . 8 GLN CA . 17909 1 36 . 1 1 8 8 GLN CB C 13 28.299 0.2 . 1 . 347 . . 8 GLN CB . 17909 1 37 . 1 1 8 8 GLN CG C 13 33.408 0.2 . 1 . 1035 . . 8 GLN CG . 17909 1 38 . 1 1 8 8 GLN N N 15 117.976 0.164 . 1 . 244 . . 8 GLN N . 17909 1 39 . 1 1 9 9 MET H H 1 8.708 0.012 . 1 . 124 . . 9 MET H . 17909 1 40 . 1 1 9 9 MET HA H 1 3.963 0.012 . 1 . 1079 . . 9 MET HA . 17909 1 41 . 1 1 9 9 MET C C 13 178.936 0.2 . 1 . 832 . . 9 MET C . 17909 1 42 . 1 1 9 9 MET CA C 13 58.586 0.2 . 1 . 349 . . 9 MET CA . 17909 1 43 . 1 1 9 9 MET CB C 13 32.857 0.2 . 1 . 348 . . 9 MET CB . 17909 1 44 . 1 1 9 9 MET CG C 13 31.547 0.2 . 1 . 931 . . 9 MET CG . 17909 1 45 . 1 1 9 9 MET N N 15 119.001 0.117 . 1 . 123 . . 9 MET N . 17909 1 46 . 1 1 10 10 SER H H 1 8.231 0.016 . 1 . 19 . . 10 SER H . 17909 1 47 . 1 1 10 10 SER HA H 1 4.148 0.05 . 1 . 1092 . . 10 SER HA . 17909 1 48 . 1 1 10 10 SER C C 13 176.327 0.2 . 1 . 780 . . 10 SER C . 17909 1 49 . 1 1 10 10 SER CA C 13 60.680 0.2 . 1 . 350 . . 10 SER CA . 17909 1 50 . 1 1 10 10 SER CB C 13 62.633 0.2 . 1 . 351 . . 10 SER CB . 17909 1 51 . 1 1 10 10 SER N N 15 114.477 0.127 . 1 . 18 . . 10 SER N . 17909 1 52 . 1 1 11 11 GLU H H 1 7.636 0.008 . 1 . 617 . . 11 GLU H . 17909 1 53 . 1 1 11 11 GLU HA H 1 3.886 0.05 . 1 . 1093 . . 11 GLU HA . 17909 1 54 . 1 1 11 11 GLU C C 13 179.169 0.2 . 1 . 841 . . 11 GLU C . 17909 1 55 . 1 1 11 11 GLU CA C 13 58.505 0.2 . 1 . 352 . . 11 GLU CA . 17909 1 56 . 1 1 11 11 GLU CB C 13 28.272 0.2 . 1 . 353 . . 11 GLU CB . 17909 1 57 . 1 1 11 11 GLU CG C 13 35.412 0.2 . 1 . 1036 . . 11 GLU CG . 17909 1 58 . 1 1 11 11 GLU N N 15 123.653 0.065 . 1 . 618 . . 11 GLU N . 17909 1 59 . 1 1 12 12 ALA H H 1 7.203 0.01 . 1 . 50 . . 12 ALA H . 17909 1 60 . 1 1 12 12 ALA HA H 1 4.143 0.05 . 1 . 1094 . . 12 ALA HA . 17909 1 61 . 1 1 12 12 ALA C C 13 180.850 0.2 . 1 . 794 . . 12 ALA C . 17909 1 62 . 1 1 12 12 ALA CA C 13 54.400 0.2 . 1 . 355 . . 12 ALA CA . 17909 1 63 . 1 1 12 12 ALA CB C 13 17.219 0.2 . 1 . 354 . . 12 ALA CB . 17909 1 64 . 1 1 12 12 ALA N N 15 121.316 0.129 . 1 . 49 . . 12 ALA N . 17909 1 65 . 1 1 13 13 VAL H H 1 7.624 0.017 . 1 . 98 . . 13 VAL H . 17909 1 66 . 1 1 13 13 VAL HA H 1 3.289 0.05 . 1 . 1095 . . 13 VAL HA . 17909 1 67 . 1 1 13 13 VAL C C 13 178.116 0.2 . 1 . 761 . . 13 VAL C . 17909 1 68 . 1 1 13 13 VAL CA C 13 66.008 0.2 . 1 . 580 . . 13 VAL CA . 17909 1 69 . 1 1 13 13 VAL CB C 13 30.439 0.2 . 1 . 579 . . 13 VAL CB . 17909 1 70 . 1 1 13 13 VAL CG1 C 13 21.758 0.2 . 1 . 1037 . . 13 VAL CG1 . 17909 1 71 . 1 1 13 13 VAL CG2 C 13 21.758 0.2 . 1 . 1038 . . 13 VAL CG2 . 17909 1 72 . 1 1 13 13 VAL N N 15 120.517 0.121 . 1 . 97 . . 13 VAL N . 17909 1 73 . 1 1 14 14 ALA H H 1 8.214 0.009 . 1 . 667 . . 14 ALA H . 17909 1 74 . 1 1 14 14 ALA HA H 1 3.957 0.05 . 1 . 1127 . . 14 ALA HA . 17909 1 75 . 1 1 14 14 ALA C C 13 180.387 0.2 . 1 . 740 . . 14 ALA C . 17909 1 76 . 1 1 14 14 ALA CA C 13 54.321 0.2 . 1 . 670 . . 14 ALA CA . 17909 1 77 . 1 1 14 14 ALA CB C 13 16.859 0.2 . 1 . 626 . . 14 ALA CB . 17909 1 78 . 1 1 14 14 ALA N N 15 121.155 0.192 . 1 . 666 . . 14 ALA N . 17909 1 79 . 1 1 15 15 GLU H H 1 7.894 0.014 . 1 . 265 . . 15 GLU H . 17909 1 80 . 1 1 15 15 GLU HA H 1 3.960 0.05 . 1 . 1096 . . 15 GLU HA . 17909 1 81 . 1 1 15 15 GLU C C 13 179.013 0.2 . 1 . 742 . . 15 GLU C . 17909 1 82 . 1 1 15 15 GLU CA C 13 58.814 0.2 . 1 . 383 . . 15 GLU CA . 17909 1 83 . 1 1 15 15 GLU CB C 13 28.811 0.2 . 1 . 382 . . 15 GLU CB . 17909 1 84 . 1 1 15 15 GLU N N 15 118.615 0.127 . 1 . 264 . . 15 GLU N . 17909 1 85 . 1 1 16 16 LYS H H 1 7.547 0.006 . 1 . 1014 . . 16 LYS H . 17909 1 86 . 1 1 16 16 LYS HA H 1 3.613 0.05 . 1 . 1097 . . 16 LYS HA . 17909 1 87 . 1 1 16 16 LYS CA C 13 59.319 0.2 . 1 . 1015 . . 16 LYS CA . 17909 1 88 . 1 1 16 16 LYS CB C 13 31.769 0.2 . 1 . 1012 . . 16 LYS CB . 17909 1 89 . 1 1 16 16 LYS N N 15 121.407 0.044 . 1 . 1013 . . 16 LYS N . 17909 1 90 . 1 1 17 17 MET C C 13 178.306 0.2 . 1 . 1074 . . 17 MET C . 17909 1 91 . 1 1 18 18 LEU H H 1 7.768 0.002 . 1 . 630 . . 18 LEU H . 17909 1 92 . 1 1 18 18 LEU HA H 1 3.866 0.05 . 1 . 1226 . . 18 LEU HA . 17909 1 93 . 1 1 18 18 LEU C C 13 179.085 0.2 . 1 . 1028 . . 18 LEU C . 17909 1 94 . 1 1 18 18 LEU CA C 13 57.625 0.2 . 1 . 632 . . 18 LEU CA . 17909 1 95 . 1 1 18 18 LEU CB C 13 41.161 0.2 . 1 . 629 . . 18 LEU CB . 17909 1 96 . 1 1 18 18 LEU N N 15 118.534 0.175 . 1 . 631 . . 18 LEU N . 17909 1 97 . 1 1 19 19 GLN H H 1 7.554 0.014 . 1 . 267 . . 19 GLN H . 17909 1 98 . 1 1 19 19 GLN HA H 1 3.786 0.05 . 1 . 1098 . . 19 GLN HA . 17909 1 99 . 1 1 19 19 GLN C C 13 179.622 0.2 . 1 . 850 . . 19 GLN C . 17909 1 100 . 1 1 19 19 GLN CA C 13 58.535 0.2 . 1 . 634 . . 19 GLN CA . 17909 1 101 . 1 1 19 19 GLN CB C 13 26.659 0.2 . 1 . 633 . . 19 GLN CB . 17909 1 102 . 1 1 19 19 GLN N N 15 118.710 0.065 . 1 . 266 . . 19 GLN N . 17909 1 103 . 1 1 20 20 TYR H H 1 8.466 0.016 . 1 . 160 . . 20 TYR H . 17909 1 104 . 1 1 20 20 TYR HA H 1 5.360 0.05 . 1 . 1099 . . 20 TYR HA . 17909 1 105 . 1 1 20 20 TYR C C 13 178.990 0.2 . 1 . 811 . . 20 TYR C . 17909 1 106 . 1 1 20 20 TYR CA C 13 57.361 0.2 . 1 . 636 . . 20 TYR CA . 17909 1 107 . 1 1 20 20 TYR CB C 13 36.332 0.2 . 1 . 635 . . 20 TYR CB . 17909 1 108 . 1 1 20 20 TYR N N 15 119.396 0.137 . 1 . 159 . . 20 TYR N . 17909 1 109 . 1 1 21 21 ARG H H 1 7.998 0.014 . 1 . 224 . . 21 ARG H . 17909 1 110 . 1 1 21 21 ARG HA H 1 4.444 0.05 . 1 . 1181 . . 21 ARG HA . 17909 1 111 . 1 1 21 21 ARG C C 13 178.198 0.2 . 1 . 694 . . 21 ARG C . 17909 1 112 . 1 1 21 21 ARG CA C 13 57.702 0.2 . 1 . 669 . . 21 ARG CA . 17909 1 113 . 1 1 21 21 ARG CB C 13 28.733 0.2 . 1 . 668 . . 21 ARG CB . 17909 1 114 . 1 1 21 21 ARG N N 15 116.518 0.226 . 1 . 223 . . 21 ARG N . 17909 1 115 . 1 1 22 22 ARG H H 1 7.804 0.022 . 1 . 17 . . 22 ARG H . 17909 1 116 . 1 1 22 22 ARG HA H 1 4.169 0.05 . 1 . 1228 . . 22 ARG HA . 17909 1 117 . 1 1 22 22 ARG C C 13 176.089 0.2 . 1 . 789 . . 22 ARG C . 17909 1 118 . 1 1 22 22 ARG CA C 13 55.996 0.2 . 1 . 1017 . . 22 ARG CA . 17909 1 119 . 1 1 22 22 ARG CB C 13 30.049 0.2 . 1 . 1016 . . 22 ARG CB . 17909 1 120 . 1 1 22 22 ARG CG C 13 27.324 0.2 . 1 . 1018 . . 22 ARG CG . 17909 1 121 . 1 1 22 22 ARG N N 15 116.482 0.204 . 1 . 16 . . 22 ARG N . 17909 1 122 . 1 1 23 23 ASP H H 1 7.732 0.015 . 1 . 128 . . 23 ASP H . 17909 1 123 . 1 1 23 23 ASP HA H 1 4.690 0.05 . 1 . 754 . . 23 ASP HA . 17909 1 124 . 1 1 23 23 ASP C C 13 177.144 0.2 . 1 . 692 . . 23 ASP C . 17909 1 125 . 1 1 23 23 ASP CA C 13 53.935 0.2 . 1 . 362 . . 23 ASP CA . 17909 1 126 . 1 1 23 23 ASP CB C 13 40.953 0.2 . 1 . 361 . . 23 ASP CB . 17909 1 127 . 1 1 23 23 ASP N N 15 120.810 0.097 . 1 . 127 . . 23 ASP N . 17909 1 128 . 1 1 24 24 THR H H 1 8.298 0.015 . 1 . 259 . . 24 THR H . 17909 1 129 . 1 1 24 24 THR HA H 1 4.802 0.05 . 1 . 1150 . . 24 THR HA . 17909 1 130 . 1 1 24 24 THR C C 13 174.980 0.2 . 1 . 804 . . 24 THR C . 17909 1 131 . 1 1 24 24 THR CA C 13 61.132 0.2 . 1 . 363 . . 24 THR CA . 17909 1 132 . 1 1 24 24 THR CB C 13 68.754 0.2 . 1 . 364 . . 24 THR CB . 17909 1 133 . 1 1 24 24 THR N N 15 116.290 0.136 . 1 . 258 . . 24 THR N . 17909 1 134 . 1 1 25 25 ALA H H 1 8.071 0.014 . 1 . 122 . . 25 ALA H . 17909 1 135 . 1 1 25 25 ALA HA H 1 4.424 0.05 . 1 . 1100 . . 25 ALA HA . 17909 1 136 . 1 1 25 25 ALA C C 13 177.732 0.2 . 1 . 805 . . 25 ALA C . 17909 1 137 . 1 1 25 25 ALA CA C 13 51.861 0.2 . 1 . 365 . . 25 ALA CA . 17909 1 138 . 1 1 25 25 ALA CB C 13 19.836 0.2 . 1 . 366 . . 25 ALA CB . 17909 1 139 . 1 1 25 25 ALA N N 15 127.149 0.119 . 1 . 121 . . 25 ALA N . 17909 1 140 . 1 1 26 26 GLY H H 1 8.266 0.007 . 1 . 134 . . 26 GLY H . 17909 1 141 . 1 1 26 26 GLY HA2 H 1 3.620 0.05 . 1 . 1085 . . 26 GLY HA2 . 17909 1 142 . 1 1 26 26 GLY HA3 H 1 3.620 0.05 . 1 . 1086 . . 26 GLY HA3 . 17909 1 143 . 1 1 26 26 GLY C C 13 174.189 0.2 . 1 . 749 . . 26 GLY C . 17909 1 144 . 1 1 26 26 GLY CA C 13 45.234 0.2 . 1 . 367 . . 26 GLY CA . 17909 1 145 . 1 1 26 26 GLY N N 15 106.953 0.199 . 1 . 133 . . 26 GLY N . 17909 1 146 . 1 1 27 27 TRP H H 1 7.101 0.02 . 1 . 188 . . 27 TRP H . 17909 1 147 . 1 1 27 27 TRP HA H 1 4.102 0.05 . 1 . 1101 . . 27 TRP HA . 17909 1 148 . 1 1 27 27 TRP C C 13 176.135 0.2 . 1 . 731 . . 27 TRP C . 17909 1 149 . 1 1 27 27 TRP CA C 13 55.835 0.2 . 1 . 486 . . 27 TRP CA . 17909 1 150 . 1 1 27 27 TRP CB C 13 30.509 0.2 . 1 . 487 . . 27 TRP CB . 17909 1 151 . 1 1 27 27 TRP N N 15 119.075 0.122 . 1 . 187 . . 27 TRP N . 17909 1 152 . 1 1 28 28 LYS H H 1 8.447 0.008 . 1 . 1190 . . 28 LYS H . 17909 1 153 . 1 1 28 28 LYS HA H 1 4.535 0.05 . 1 . 1189 . . 28 LYS HA . 17909 1 154 . 1 1 28 28 LYS C C 13 175.783 0.2 . 1 . 713 . . 28 LYS C . 17909 1 155 . 1 1 28 28 LYS CA C 13 55.128 0.2 . 1 . 484 . . 28 LYS CA . 17909 1 156 . 1 1 28 28 LYS CB C 13 33.847 0.2 . 1 . 483 . . 28 LYS CB . 17909 1 157 . 1 1 28 28 LYS CG C 13 24.497 0.2 . 1 . 979 . . 28 LYS CG . 17909 1 158 . 1 1 28 28 LYS CD C 13 28.044 0.2 . 1 . 980 . . 28 LYS CD . 17909 1 159 . 1 1 28 28 LYS N N 15 122.782 0.046 . 1 . 485 . . 28 LYS N . 17909 1 160 . 1 1 29 29 ILE H H 1 8.655 0.022 . 1 . 251 . . 29 ILE H . 17909 1 161 . 1 1 29 29 ILE HA H 1 4.125 0.05 . 1 . 1102 . . 29 ILE HA . 17909 1 162 . 1 1 29 29 ILE C C 13 176.945 0.2 . 1 . 847 . . 29 ILE C . 17909 1 163 . 1 1 29 29 ILE CA C 13 61.605 0.2 . 1 . 482 . . 29 ILE CA . 17909 1 164 . 1 1 29 29 ILE CB C 13 37.630 0.2 . 1 . 481 . . 29 ILE CB . 17909 1 165 . 1 1 29 29 ILE N N 15 124.727 0.151 . 1 . 250 . . 29 ILE N . 17909 1 166 . 1 1 30 30 CYS H H 1 9.673 0.017 . 1 . 1 . . 30 CYS H . 17909 1 167 . 1 1 30 30 CYS HA H 1 5.199 0.05 . 1 . 1229 . . 30 CYS HA . 17909 1 168 . 1 1 30 30 CYS C C 13 174.228 0.2 . 1 . 802 . . 30 CYS C . 17909 1 169 . 1 1 30 30 CYS CA C 13 57.319 0.2 . 1 . 3 . . 30 CYS CA . 17909 1 170 . 1 1 30 30 CYS CB C 13 30.132 0.2 . 1 . 480 . . 30 CYS CB . 17909 1 171 . 1 1 30 30 CYS N N 15 122.733 0.126 . 1 . 2 . . 30 CYS N . 17909 1 172 . 1 1 31 31 ARG H H 1 7.961 0.017 . 1 . 271 . . 31 ARG H . 17909 1 173 . 1 1 31 31 ARG HA H 1 4.653 0.05 . 1 . 1103 . . 31 ARG HA . 17909 1 174 . 1 1 31 31 ARG C C 13 173.236 0.2 . 1 . 1071 . . 31 ARG C . 17909 1 175 . 1 1 31 31 ARG CA C 13 56.114 0.2 . 1 . 555 . . 31 ARG CA . 17909 1 176 . 1 1 31 31 ARG CB C 13 32.495 0.2 . 1 . 554 . . 31 ARG CB . 17909 1 177 . 1 1 31 31 ARG CG C 13 26.452 0.2 . 1 . 986 . . 31 ARG CG . 17909 1 178 . 1 1 31 31 ARG CD C 13 42.786 0.2 . 1 . 985 . . 31 ARG CD . 17909 1 179 . 1 1 31 31 ARG N N 15 121.694 0.165 . 1 . 270 . . 31 ARG N . 17909 1 180 . 1 1 32 32 GLU H H 1 8.543 0.018 . 1 . 558 . . 32 GLU H . 17909 1 181 . 1 1 32 32 GLU HA H 1 5.183 0.05 . 1 . 1230 . . 32 GLU HA . 17909 1 182 . 1 1 32 32 GLU C C 13 175.210 0.2 . 1 . 762 . . 32 GLU C . 17909 1 183 . 1 1 32 32 GLU CA C 13 55.398 0.2 . 1 . 559 . . 32 GLU CA . 17909 1 184 . 1 1 32 32 GLU CB C 13 32.070 0.2 . 1 . 556 . . 32 GLU CB . 17909 1 185 . 1 1 32 32 GLU CG C 13 35.964 0.2 . 1 . 1030 . . 32 GLU CG . 17909 1 186 . 1 1 32 32 GLU N N 15 122.333 0.039 . 1 . 557 . . 32 GLU N . 17909 1 187 . 1 1 33 33 GLY H H 1 8.236 0.017 . 1 . 114 . . 33 GLY H . 17909 1 188 . 1 1 33 33 GLY HA3 H 1 3.968 0.05 . 1 . 1104 . . 33 GLY HA3 . 17909 1 189 . 1 1 33 33 GLY C C 13 172.526 0.2 . 1 . 796 . . 33 GLY C . 17909 1 190 . 1 1 33 33 GLY CA C 13 44.873 0.2 . 1 . 560 . . 33 GLY CA . 17909 1 191 . 1 1 33 33 GLY N N 15 110.509 0.156 . 1 . 113 . . 33 GLY N . 17909 1 192 . 1 1 34 34 ASN H H 1 8.160 0.004 . 1 . 663 . . 34 ASN H . 17909 1 193 . 1 1 34 34 ASN HA H 1 4.489 0.05 . 1 . 1105 . . 34 ASN HA . 17909 1 194 . 1 1 34 34 ASN C C 13 174.992 0.2 . 1 . 769 . . 34 ASN C . 17909 1 195 . 1 1 34 34 ASN CA C 13 54.848 0.2 . 1 . 660 . . 34 ASN CA . 17909 1 196 . 1 1 34 34 ASN CB C 13 41.806 0.2 . 1 . 661 . . 34 ASN CB . 17909 1 197 . 1 1 34 34 ASN N N 15 123.436 0.119 . 1 . 662 . . 34 ASN N . 17909 1 198 . 1 1 35 35 GLY H H 1 8.585 0.016 . 1 . 120 . . 35 GLY H . 17909 1 199 . 1 1 35 35 GLY HA2 H 1 3.967 0.05 . 1 . 1224 . . 35 GLY HA2 . 17909 1 200 . 1 1 35 35 GLY HA3 H 1 3.967 0.05 . 1 . 1223 . . 35 GLY HA3 . 17909 1 201 . 1 1 35 35 GLY C C 13 173.789 0.2 . 1 . 743 . . 35 GLY C . 17909 1 202 . 1 1 35 35 GLY CA C 13 45.081 0.2 . 1 . 897 . . 35 GLY CA . 17909 1 203 . 1 1 35 35 GLY N N 15 106.365 0.136 . 1 . 119 . . 35 GLY N . 17909 1 204 . 1 1 36 36 VAL H H 1 7.443 0.011 . 1 . 130 . . 36 VAL H . 17909 1 205 . 1 1 36 36 VAL HA H 1 4.490 0.05 . 1 . 1106 . . 36 VAL HA . 17909 1 206 . 1 1 36 36 VAL C C 13 173.797 0.2 . 1 . 817 . . 36 VAL C . 17909 1 207 . 1 1 36 36 VAL CA C 13 59.804 0.2 . 1 . 464 . . 36 VAL CA . 17909 1 208 . 1 1 36 36 VAL CB C 13 33.673 0.2 . 1 . 465 . . 36 VAL CB . 17909 1 209 . 1 1 36 36 VAL N N 15 120.060 0.052 . 1 . 129 . . 36 VAL N . 17909 1 210 . 1 1 37 37 SER H H 1 8.044 0.019 . 1 . 116 . . 37 SER H . 17909 1 211 . 1 1 37 37 SER HA H 1 4.813 0.05 . 1 . 1107 . . 37 SER HA . 17909 1 212 . 1 1 37 37 SER C C 13 173.644 0.2 . 1 . 746 . . 37 SER C . 17909 1 213 . 1 1 37 37 SER CA C 13 56.297 0.2 . 1 . 463 . . 37 SER CA . 17909 1 214 . 1 1 37 37 SER CB C 13 64.355 0.2 . 1 . 462 . . 37 SER CB . 17909 1 215 . 1 1 37 37 SER N N 15 120.497 0.152 . 1 . 115 . . 37 SER N . 17909 1 216 . 1 1 38 38 VAL H H 1 9.010 0.022 . 1 . 58 . . 38 VAL H . 17909 1 217 . 1 1 38 38 VAL C C 13 174.820 0.2 . 1 . 744 . . 38 VAL C . 17909 1 218 . 1 1 38 38 VAL CA C 13 60.448 0.2 . 1 . 461 . . 38 VAL CA . 17909 1 219 . 1 1 38 38 VAL CB C 13 33.105 0.2 . 1 . 404 . . 38 VAL CB . 17909 1 220 . 1 1 38 38 VAL N N 15 125.868 0.177 . 1 . 57 . . 38 VAL N . 17909 1 221 . 1 1 39 39 SER H H 1 9.779 0.009 . 1 . 44 . . 39 SER H . 17909 1 222 . 1 1 39 39 SER HA H 1 5.877 0.05 . 1 . 1108 . . 39 SER HA . 17909 1 223 . 1 1 39 39 SER C C 13 172.409 0.2 . 1 . 829 . . 39 SER C . 17909 1 224 . 1 1 39 39 SER CA C 13 56.734 0.2 . 1 . 459 . . 39 SER CA . 17909 1 225 . 1 1 39 39 SER CB C 13 66.799 0.2 . 1 . 460 . . 39 SER CB . 17909 1 226 . 1 1 39 39 SER N N 15 123.579 0.143 . 1 . 43 . . 39 SER N . 17909 1 227 . 1 1 40 40 TRP H H 1 9.370 0.017 . 1 . 69 . . 40 TRP H . 17909 1 228 . 1 1 40 40 TRP HA H 1 6.021 0.05 . 1 . 1233 . . 40 TRP HA . 17909 1 229 . 1 1 40 40 TRP C C 13 174.239 0.2 . 1 . 845 . . 40 TRP C . 17909 1 230 . 1 1 40 40 TRP CA C 13 55.099 0.2 . 1 . 458 . . 40 TRP CA . 17909 1 231 . 1 1 40 40 TRP CB C 13 33.572 0.2 . 1 . 457 . . 40 TRP CB . 17909 1 232 . 1 1 40 40 TRP N N 15 117.987 0.112 . 1 . 68 . . 40 TRP N . 17909 1 233 . 1 1 41 41 ARG H H 1 8.830 0.002 . 1 . 596 . . 41 ARG H . 17909 1 234 . 1 1 41 41 ARG CA C 13 53.839 0.2 . 1 . 598 . . 41 ARG CA . 17909 1 235 . 1 1 41 41 ARG CB C 13 30.020 0.2 . 1 . 595 . . 41 ARG CB . 17909 1 236 . 1 1 41 41 ARG N N 15 116.841 0.003 . 1 . 597 . . 41 ARG N . 17909 1 237 . 1 1 42 42 PRO C C 13 177.316 0.2 . 1 . 783 . . 42 PRO C . 17909 1 238 . 1 1 42 42 PRO CA C 13 63.416 0.2 . 1 . 665 . . 42 PRO CA . 17909 1 239 . 1 1 42 42 PRO CB C 13 31.097 0.2 . 1 . 664 . . 42 PRO CB . 17909 1 240 . 1 1 43 43 SER H H 1 8.940 0.016 . 1 . 15 . . 43 SER H . 17909 1 241 . 1 1 43 43 SER C C 13 176.683 0.2 . 1 . 798 . . 43 SER C . 17909 1 242 . 1 1 43 43 SER CA C 13 57.532 0.2 . 1 . 573 . . 43 SER CA . 17909 1 243 . 1 1 43 43 SER CB C 13 61.816 0.2 . 1 . 574 . . 43 SER CB . 17909 1 244 . 1 1 43 43 SER N N 15 118.280 0.05 . 1 . 14 . . 43 SER N . 17909 1 245 . 1 1 44 44 VAL H H 1 8.591 0.008 . 1 . 954 . . 44 VAL H . 17909 1 246 . 1 1 44 44 VAL HA H 1 4.486 0.05 . 1 . 1234 . . 44 VAL HA . 17909 1 247 . 1 1 44 44 VAL C C 13 176.858 0.2 . 1 . 730 . . 44 VAL C . 17909 1 248 . 1 1 44 44 VAL CA C 13 60.933 0.2 . 1 . 957 . . 44 VAL CA . 17909 1 249 . 1 1 44 44 VAL CB C 13 30.429 0.2 . 1 . 955 . . 44 VAL CB . 17909 1 250 . 1 1 44 44 VAL CG1 C 13 18.888 0.2 . 2 . 959 . . 44 VAL CG1 . 17909 1 251 . 1 1 44 44 VAL CG2 C 13 20.657 0.2 . 2 . 958 . . 44 VAL CG2 . 17909 1 252 . 1 1 44 44 VAL N N 15 117.979 0.063 . 1 . 956 . . 44 VAL N . 17909 1 253 . 1 1 45 45 GLU H H 1 9.522 0.022 . 1 . 92 . . 45 GLU H . 17909 1 254 . 1 1 45 45 GLU C C 13 174.866 0.2 . 1 . 757 . . 45 GLU C . 17909 1 255 . 1 1 45 45 GLU CA C 13 55.444 0.2 . 1 . 576 . . 45 GLU CA . 17909 1 256 . 1 1 45 45 GLU CB C 13 29.553 0.2 . 1 . 575 . . 45 GLU CB . 17909 1 257 . 1 1 45 45 GLU N N 15 121.467 0.141 . 1 . 91 . . 45 GLU N . 17909 1 258 . 1 1 46 46 PHE H H 1 7.712 0.018 . 1 . 46 . . 46 PHE H . 17909 1 259 . 1 1 46 46 PHE HA H 1 3.961 0.05 . 1 . 1109 . . 46 PHE HA . 17909 1 260 . 1 1 46 46 PHE CA C 13 54.266 0.2 . 1 . 578 . . 46 PHE CA . 17909 1 261 . 1 1 46 46 PHE CB C 13 37.526 0.2 . 1 . 577 . . 46 PHE CB . 17909 1 262 . 1 1 46 46 PHE N N 15 118.722 0.186 . 1 . 45 . . 46 PHE N . 17909 1 263 . 1 1 47 47 PRO C C 13 174.582 0.2 . 1 . 831 . . 47 PRO C . 17909 1 264 . 1 1 47 47 PRO CA C 13 61.907 0.2 . 1 . 984 . . 47 PRO CA . 17909 1 265 . 1 1 47 47 PRO CB C 13 28.354 0.2 . 1 . 983 . . 47 PRO CB . 17909 1 266 . 1 1 48 48 GLY H H 1 6.278 0.014 . 1 . 142 . . 48 GLY H . 17909 1 267 . 1 1 48 48 GLY HA2 H 1 3.824 0.05 . 1 . 1111 . . 48 GLY HA2 . 17909 1 268 . 1 1 48 48 GLY HA3 H 1 3.824 0.05 . 1 . 1110 . . 48 GLY HA3 . 17909 1 269 . 1 1 48 48 GLY C C 13 171.329 0.2 . 1 . 825 . . 48 GLY C . 17909 1 270 . 1 1 48 48 GLY CA C 13 44.676 0.2 . 1 . 982 . . 48 GLY CA . 17909 1 271 . 1 1 48 48 GLY N N 15 111.342 0.147 . 1 . 141 . . 48 GLY N . 17909 1 272 . 1 1 49 49 ASN H H 1 8.539 0.019 . 1 . 108 . . 49 ASN H . 17909 1 273 . 1 1 49 49 ASN HA H 1 5.191 0.05 . 1 . 1112 . . 49 ASN HA . 17909 1 274 . 1 1 49 49 ASN C C 13 174.450 0.2 . 1 . 775 . . 49 ASN C . 17909 1 275 . 1 1 49 49 ASN CA C 13 52.371 0.2 . 1 . 508 . . 49 ASN CA . 17909 1 276 . 1 1 49 49 ASN CB C 13 41.823 0.2 . 1 . 509 . . 49 ASN CB . 17909 1 277 . 1 1 49 49 ASN N N 15 118.077 0.15 . 1 . 107 . . 49 ASN N . 17909 1 278 . 1 1 50 50 LEU H H 1 9.216 0.016 . 1 . 289 . . 50 LEU H . 17909 1 279 . 1 1 50 50 LEU HA H 1 4.842 0.05 . 1 . 1113 . . 50 LEU HA . 17909 1 280 . 1 1 50 50 LEU C C 13 174.425 0.2 . 1 . 720 . . 50 LEU C . 17909 1 281 . 1 1 50 50 LEU CA C 13 53.229 0.2 . 1 . 514 . . 50 LEU CA . 17909 1 282 . 1 1 50 50 LEU CB C 13 43.711 0.2 . 1 . 515 . . 50 LEU CB . 17909 1 283 . 1 1 50 50 LEU N N 15 121.912 0.122 . 1 . 288 . . 50 LEU N . 17909 1 284 . 1 1 51 51 TYR H H 1 9.111 0.013 . 1 . 511 . . 51 TYR H . 17909 1 285 . 1 1 51 51 TYR C C 13 173.797 0.2 . 1 . 727 . . 51 TYR C . 17909 1 286 . 1 1 51 51 TYR CA C 13 56.903 0.2 . 1 . 513 . . 51 TYR CA . 17909 1 287 . 1 1 51 51 TYR CB C 13 41.852 0.2 . 1 . 510 . . 51 TYR CB . 17909 1 288 . 1 1 51 51 TYR N N 15 121.960 0.139 . 1 . 512 . . 51 TYR N . 17909 1 289 . 1 1 52 52 ARG H H 1 9.076 0.004 . 1 . 212 . . 52 ARG H . 17909 1 290 . 1 1 52 52 ARG C C 13 174.630 0.2 . 1 . 860 . . 52 ARG C . 17909 1 291 . 1 1 52 52 ARG CA C 13 52.633 0.2 . 1 . 516 . . 52 ARG CA . 17909 1 292 . 1 1 52 52 ARG CB C 13 33.517 0.2 . 1 . 517 . . 52 ARG CB . 17909 1 293 . 1 1 52 52 ARG N N 15 123.378 0.172 . 1 . 211 . . 52 ARG N . 17909 1 294 . 1 1 53 53 GLY H H 1 9.642 0.01 . 1 . 174 . . 53 GLY H . 17909 1 295 . 1 1 53 53 GLY HA2 H 1 5.171 0.05 . 1 . 1115 . . 53 GLY HA2 . 17909 1 296 . 1 1 53 53 GLY HA3 H 1 5.171 0.05 . 1 . 1114 . . 53 GLY HA3 . 17909 1 297 . 1 1 53 53 GLY C C 13 172.016 0.2 . 1 . 820 . . 53 GLY C . 17909 1 298 . 1 1 53 53 GLY CA C 13 42.744 0.2 . 1 . 518 . . 53 GLY CA . 17909 1 299 . 1 1 53 53 GLY N N 15 118.176 0.155 . 1 . 173 . . 53 GLY N . 17909 1 300 . 1 1 54 54 GLU H H 1 7.803 0.024 . 1 . 136 . . 54 GLU H . 17909 1 301 . 1 1 54 54 GLU HA H 1 4.980 0.05 . 1 . 1227 . . 54 GLU HA . 17909 1 302 . 1 1 54 54 GLU C C 13 174.883 0.2 . 1 . 1040 . . 54 GLU C . 17909 1 303 . 1 1 54 54 GLU CA C 13 54.983 0.2 . 1 . 519 . . 54 GLU CA . 17909 1 304 . 1 1 54 54 GLU CB C 13 32.456 0.2 . 1 . 520 . . 54 GLU CB . 17909 1 305 . 1 1 54 54 GLU CG C 13 36.017 0.2 . 1 . 1039 . . 54 GLU CG . 17909 1 306 . 1 1 54 54 GLU N N 15 118.985 0.216 . 1 . 135 . . 54 GLU N . 17909 1 307 . 1 1 55 55 GLY H H 1 7.915 0.003 . 1 . 523 . . 55 GLY H . 17909 1 308 . 1 1 55 55 GLY C C 13 170.262 0.2 . 1 . 778 . . 55 GLY C . 17909 1 309 . 1 1 55 55 GLY CA C 13 45.232 0.2 . 1 . 521 . . 55 GLY CA . 17909 1 310 . 1 1 55 55 GLY N N 15 113.016 0.015 . 1 . 522 . . 55 GLY N . 17909 1 311 . 1 1 56 56 ILE H H 1 8.215 0.004 . 1 . 526 . . 56 ILE H . 17909 1 312 . 1 1 56 56 ILE HA H 1 4.475 0.05 . 1 . 1125 . . 56 ILE HA . 17909 1 313 . 1 1 56 56 ILE C C 13 175.941 0.2 . 1 . 1061 . . 56 ILE C . 17909 1 314 . 1 1 56 56 ILE CA C 13 59.856 0.2 . 1 . 524 . . 56 ILE CA . 17909 1 315 . 1 1 56 56 ILE CB C 13 37.609 0.2 . 1 . 671 . . 56 ILE CB . 17909 1 316 . 1 1 56 56 ILE CG1 C 13 27.427 0.2 . 1 . 1063 . . 56 ILE CG1 . 17909 1 317 . 1 1 56 56 ILE CG2 C 13 17.520 0.2 . 1 . 1062 . . 56 ILE CG2 . 17909 1 318 . 1 1 56 56 ILE N N 15 121.134 0.059 . 1 . 525 . . 56 ILE N . 17909 1 319 . 1 1 57 57 VAL H H 1 9.387 0.011 . 1 . 867 . . 57 VAL H . 17909 1 320 . 1 1 57 57 VAL HA H 1 3.988 0.008 . 1 . 1117 . . 57 VAL HA . 17909 1 321 . 1 1 57 57 VAL C C 13 173.413 0.2 . 1 . 773 . . 57 VAL C . 17909 1 322 . 1 1 57 57 VAL CA C 13 61.011 0.2 . 1 . 866 . . 57 VAL CA . 17909 1 323 . 1 1 57 57 VAL CB C 13 33.543 0.2 . 1 . 865 . . 57 VAL CB . 17909 1 324 . 1 1 57 57 VAL CG1 C 13 21.335 0.2 . 1 . 1240 . . 57 VAL CG1 . 17909 1 325 . 1 1 57 57 VAL CG2 C 13 21.335 0.2 . 1 . 1239 . . 57 VAL CG2 . 17909 1 326 . 1 1 57 57 VAL N N 15 127.991 0.04 . 1 . 868 . . 57 VAL N . 17909 1 327 . 1 1 58 58 TYR H H 1 9.122 0.018 . 1 . 56 . . 58 TYR H . 17909 1 328 . 1 1 58 58 TYR HA H 1 4.481 0.05 . 1 . 1118 . . 58 TYR HA . 17909 1 329 . 1 1 58 58 TYR C C 13 174.859 0.2 . 1 . 770 . . 58 TYR C . 17909 1 330 . 1 1 58 58 TYR CA C 13 58.442 0.2 . 1 . 294 . . 58 TYR CA . 17909 1 331 . 1 1 58 58 TYR CB C 13 35.356 0.2 . 1 . 293 . . 58 TYR CB . 17909 1 332 . 1 1 58 58 TYR N N 15 128.457 0.125 . 1 . 55 . . 58 TYR N . 17909 1 333 . 1 1 59 59 GLY H H 1 7.942 0.02 . 1 . 29 . . 59 GLY H . 17909 1 334 . 1 1 59 59 GLY C C 13 171.870 0.2 . 1 . 723 . . 59 GLY C . 17909 1 335 . 1 1 59 59 GLY CA C 13 44.286 0.2 . 1 . 319 . . 59 GLY CA . 17909 1 336 . 1 1 59 59 GLY N N 15 113.126 0.202 . 1 . 28 . . 59 GLY N . 17909 1 337 . 1 1 60 60 THR H H 1 8.540 0.022 . 1 . 285 . . 60 THR H . 17909 1 338 . 1 1 60 60 THR HA H 1 4.287 0.05 . 1 . 1128 . . 60 THR HA . 17909 1 339 . 1 1 60 60 THR C C 13 174.415 0.2 . 1 . 1069 . . 60 THR C . 17909 1 340 . 1 1 60 60 THR CA C 13 60.406 0.2 . 1 . 320 . . 60 THR CA . 17909 1 341 . 1 1 60 60 THR CB C 13 70.107 0.2 . 1 . 321 . . 60 THR CB . 17909 1 342 . 1 1 60 60 THR CG2 C 13 21.251 0.2 . 1 . 1042 . . 60 THR CG2 . 17909 1 343 . 1 1 60 60 THR N N 15 112.227 0.141 . 1 . 284 . . 60 THR N . 17909 1 344 . 1 1 61 61 LEU H H 1 8.179 0.023 . 1 . 73 . . 61 LEU H . 17909 1 345 . 1 1 61 61 LEU C C 13 178.696 0.2 . 1 . 750 . . 61 LEU C . 17909 1 346 . 1 1 61 61 LEU CA C 13 58.784 0.2 . 1 . 322 . . 61 LEU CA . 17909 1 347 . 1 1 61 61 LEU CB C 13 41.738 0.2 . 1 . 323 . . 61 LEU CB . 17909 1 348 . 1 1 61 61 LEU CG C 13 25.006 0.2 . 1 . 976 . . 61 LEU CG . 17909 1 349 . 1 1 61 61 LEU CD1 C 13 25.006 0.2 . 1 . 978 . . 61 LEU CD1 . 17909 1 350 . 1 1 61 61 LEU CD2 C 13 25.006 0.2 . 1 . 977 . . 61 LEU CD2 . 17909 1 351 . 1 1 61 61 LEU N N 15 122.837 0.168 . 1 . 72 . . 61 LEU N . 17909 1 352 . 1 1 62 62 GLU H H 1 8.102 0.011 . 1 . 31 . . 62 GLU H . 17909 1 353 . 1 1 62 62 GLU HA H 1 3.815 0.05 . 1 . 1119 . . 62 GLU HA . 17909 1 354 . 1 1 62 62 GLU C C 13 179.009 0.2 . 1 . 734 . . 62 GLU C . 17909 1 355 . 1 1 62 62 GLU CA C 13 59.098 0.2 . 1 . 325 . . 62 GLU CA . 17909 1 356 . 1 1 62 62 GLU CB C 13 28.512 0.2 . 1 . 324 . . 62 GLU CB . 17909 1 357 . 1 1 62 62 GLU CG C 13 36.305 0.2 . 1 . 975 . . 62 GLU CG . 17909 1 358 . 1 1 62 62 GLU N N 15 113.801 0.17 . 1 . 30 . . 62 GLU N . 17909 1 359 . 1 1 63 63 GLU H H 1 7.358 0.009 . 1 . 61 . . 63 GLU H . 17909 1 360 . 1 1 63 63 GLU HA H 1 3.510 0.05 . 1 . 1120 . . 63 GLU HA . 17909 1 361 . 1 1 63 63 GLU C C 13 177.483 0.2 . 1 . 788 . . 63 GLU C . 17909 1 362 . 1 1 63 63 GLU CA C 13 58.608 0.2 . 1 . 360 . . 63 GLU CA . 17909 1 363 . 1 1 63 63 GLU CB C 13 28.931 0.2 . 1 . 359 . . 63 GLU CB . 17909 1 364 . 1 1 63 63 GLU CG C 13 36.524 0.2 . 1 . 1019 . . 63 GLU CG . 17909 1 365 . 1 1 63 63 GLU N N 15 119.237 0.136 . 1 . 60 . . 63 GLU N . 17909 1 366 . 1 1 64 64 VAL H H 1 8.347 0.005 . 1 . 673 . . 64 VAL H . 17909 1 367 . 1 1 64 64 VAL C C 13 178.206 0.2 . 1 . 687 . . 64 VAL C . 17909 1 368 . 1 1 64 64 VAL CA C 13 66.726 0.2 . 1 . 675 . . 64 VAL CA . 17909 1 369 . 1 1 64 64 VAL CB C 13 30.101 0.2 . 1 . 672 . . 64 VAL CB . 17909 1 370 . 1 1 64 64 VAL CG1 C 13 21.917 0.2 . 1 . 1043 . . 64 VAL CG1 . 17909 1 371 . 1 1 64 64 VAL CG2 C 13 21.917 0.2 . 1 . 1044 . . 64 VAL CG2 . 17909 1 372 . 1 1 64 64 VAL N N 15 119.602 0.171 . 1 . 674 . . 64 VAL N . 17909 1 373 . 1 1 65 65 TRP H H 1 8.897 0.021 . 1 . 208 . . 65 TRP H . 17909 1 374 . 1 1 65 65 TRP CA C 13 58.747 0.2 . 1 . 676 . . 65 TRP CA . 17909 1 375 . 1 1 65 65 TRP CB C 13 30.091 0.2 . 1 . 677 . . 65 TRP CB . 17909 1 376 . 1 1 65 65 TRP N N 15 119.813 0.131 . 1 . 207 . . 65 TRP N . 17909 1 377 . 1 1 66 66 ASP C C 13 178.299 0.2 . 1 . 777 . . 66 ASP C . 17909 1 378 . 1 1 66 66 ASP CA C 13 56.963 0.2 . 1 . 682 . . 66 ASP CA . 17909 1 379 . 1 1 66 66 ASP CB C 13 39.536 0.2 . 1 . 681 . . 66 ASP CB . 17909 1 380 . 1 1 67 67 CYS H H 1 7.237 0.014 . 1 . 158 . . 67 CYS H . 17909 1 381 . 1 1 67 67 CYS HA H 1 4.184 0.05 . 1 . 1121 . . 67 CYS HA . 17909 1 382 . 1 1 67 67 CYS C C 13 175.858 0.2 . 1 . 1045 . . 67 CYS C . 17909 1 383 . 1 1 67 67 CYS CA C 13 63.688 0.2 . 1 . 620 . . 67 CYS CA . 17909 1 384 . 1 1 67 67 CYS CB C 13 27.698 0.2 . 1 . 619 . . 67 CYS CB . 17909 1 385 . 1 1 67 67 CYS N N 15 112.726 0.164 . 1 . 157 . . 67 CYS N . 17909 1 386 . 1 1 68 68 VAL H H 1 7.327 0.009 . 1 . 946 . . 68 VAL H . 17909 1 387 . 1 1 68 68 VAL C C 13 176.193 0.2 . 1 . 1046 . . 68 VAL C . 17909 1 388 . 1 1 68 68 VAL CA C 13 60.953 0.2 . 1 . 947 . . 68 VAL CA . 17909 1 389 . 1 1 68 68 VAL CB C 13 33.494 0.2 . 1 . 621 . . 68 VAL CB . 17909 1 390 . 1 1 68 68 VAL CG2 C 13 19.709 0.2 . 1 . 948 . . 68 VAL CG2 . 17909 1 391 . 1 1 68 68 VAL N N 15 109.667 0.179 . 1 . 945 . . 68 VAL N . 17909 1 392 . 1 1 69 69 LYS H H 1 7.731 0.011 . 1 . 13 . . 69 LYS H . 17909 1 393 . 1 1 69 69 LYS HA H 1 4.820 0.05 . 1 . 1133 . . 69 LYS HA . 17909 1 394 . 1 1 69 69 LYS CA C 13 54.337 0.2 . 1 . 950 . . 69 LYS CA . 17909 1 395 . 1 1 69 69 LYS CB C 13 29.449 0.2 . 1 . 949 . . 69 LYS CB . 17909 1 396 . 1 1 69 69 LYS N N 15 121.843 0.086 . 1 . 12 . . 69 LYS N . 17909 1 397 . 1 1 70 70 PRO C C 13 174.566 0.2 . 1 . 699 . . 70 PRO C . 17909 1 398 . 1 1 70 70 PRO CA C 13 61.130 0.2 . 1 . 658 . . 70 PRO CA . 17909 1 399 . 1 1 70 70 PRO CB C 13 28.557 0.2 . 1 . 678 . . 70 PRO CB . 17909 1 400 . 1 1 71 71 ALA H H 1 6.998 0.014 . 1 . 112 . . 71 ALA H . 17909 1 401 . 1 1 71 71 ALA HA H 1 4.349 0.001 . 1 . 1078 . . 71 ALA HA . 17909 1 402 . 1 1 71 71 ALA C C 13 177.083 0.2 . 1 . 752 . . 71 ALA C . 17909 1 403 . 1 1 71 71 ALA CA C 13 50.795 0.2 . 1 . 379 . . 71 ALA CA . 17909 1 404 . 1 1 71 71 ALA CB C 13 21.057 0.2 . 1 . 378 . . 71 ALA CB . 17909 1 405 . 1 1 71 71 ALA N N 15 125.122 0.058 . 1 . 111 . . 71 ALA N . 17909 1 406 . 1 1 72 72 VAL H H 1 8.860 0.028 . 1 . 40 . . 72 VAL H . 17909 1 407 . 1 1 72 72 VAL HA H 1 4.806 0.05 . 1 . 1122 . . 72 VAL HA . 17909 1 408 . 1 1 72 72 VAL C C 13 170.752 0.2 . 1 . 818 . . 72 VAL C . 17909 1 409 . 1 1 72 72 VAL CA C 13 63.753 0.2 . 1 . 377 . . 72 VAL CA . 17909 1 410 . 1 1 72 72 VAL CB C 13 30.939 0.2 . 1 . 376 . . 72 VAL CB . 17909 1 411 . 1 1 72 72 VAL N N 15 124.745 0.114 . 1 . 39 . . 72 VAL N . 17909 1 412 . 1 1 73 73 GLY H H 1 8.705 0.012 . 1 . 236 . . 73 GLY H . 17909 1 413 . 1 1 73 73 GLY HA2 H 1 3.796 0.05 . 1 . 1134 . . 73 GLY HA2 . 17909 1 414 . 1 1 73 73 GLY HA3 H 1 3.796 0.05 . 1 . 1135 . . 73 GLY HA3 . 17909 1 415 . 1 1 73 73 GLY C C 13 174.976 0.2 . 1 . 849 . . 73 GLY C . 17909 1 416 . 1 1 73 73 GLY CA C 13 45.064 0.2 . 1 . 561 . . 73 GLY CA . 17909 1 417 . 1 1 73 73 GLY N N 15 111.812 0.145 . 1 . 235 . . 73 GLY N . 17909 1 418 . 1 1 74 74 GLY H H 1 7.486 0.015 . 1 . 42 . . 74 GLY H . 17909 1 419 . 1 1 74 74 GLY HA2 H 1 3.968 0.05 . 1 . 1080 . . 74 GLY HA2 . 17909 1 420 . 1 1 74 74 GLY HA3 H 1 3.968 0.05 . 1 . 1081 . . 74 GLY HA3 . 17909 1 421 . 1 1 74 74 GLY C C 13 174.010 0.2 . 1 . 693 . . 74 GLY C . 17909 1 422 . 1 1 74 74 GLY CA C 13 44.321 0.2 . 1 . 375 . . 74 GLY CA . 17909 1 423 . 1 1 74 74 GLY N N 15 105.101 0.111 . 1 . 41 . . 74 GLY N . 17909 1 424 . 1 1 75 75 LEU H H 1 8.296 0.025 . 1 . 67 . . 75 LEU H . 17909 1 425 . 1 1 75 75 LEU HA H 1 4.694 0.05 . 1 . 1124 . . 75 LEU HA . 17909 1 426 . 1 1 75 75 LEU C C 13 178.387 0.2 . 1 . 737 . . 75 LEU C . 17909 1 427 . 1 1 75 75 LEU CA C 13 56.347 0.2 . 1 . 456 . . 75 LEU CA . 17909 1 428 . 1 1 75 75 LEU CB C 13 41.790 0.2 . 1 . 455 . . 75 LEU CB . 17909 1 429 . 1 1 75 75 LEU CG C 13 24.922 0.2 . 1 . 1021 . . 75 LEU CG . 17909 1 430 . 1 1 75 75 LEU CD1 C 13 21.641 0.2 . 1 . 1022 . . 75 LEU CD1 . 17909 1 431 . 1 1 75 75 LEU CD2 C 13 21.641 0.2 . 1 . 1020 . . 75 LEU CD2 . 17909 1 432 . 1 1 75 75 LEU N N 15 119.169 0.182 . 1 . 66 . . 75 LEU N . 17909 1 433 . 1 1 76 76 ARG H H 1 8.346 0.005 . 1 . 736 . . 76 ARG H . 17909 1 434 . 1 1 76 76 ARG C C 13 176.894 0.2 . 1 . 703 . . 76 ARG C . 17909 1 435 . 1 1 76 76 ARG CA C 13 59.463 0.2 . 1 . 454 . . 76 ARG CA . 17909 1 436 . 1 1 76 76 ARG CB C 13 29.272 0.2 . 1 . 974 . . 76 ARG CB . 17909 1 437 . 1 1 76 76 ARG CG C 13 27.363 0.2 . 1 . 951 . . 76 ARG CG . 17909 1 438 . 1 1 76 76 ARG CD C 13 42.761 0.2 . 1 . 952 . . 76 ARG CD . 17909 1 439 . 1 1 76 76 ARG N N 15 120.064 0.09 . 1 . 738 . . 76 ARG N . 17909 1 440 . 1 1 77 77 VAL H H 1 7.082 0.016 . 1 . 79 . . 77 VAL H . 17909 1 441 . 1 1 77 77 VAL HA H 1 3.438 0.05 . 1 . 1123 . . 77 VAL HA . 17909 1 442 . 1 1 77 77 VAL C C 13 176.269 0.2 . 1 . 748 . . 77 VAL C . 17909 1 443 . 1 1 77 77 VAL CA C 13 63.159 0.2 . 1 . 453 . . 77 VAL CA . 17909 1 444 . 1 1 77 77 VAL CB C 13 30.993 0.2 . 1 . 452 . . 77 VAL CB . 17909 1 445 . 1 1 77 77 VAL CG1 C 13 20.520 0.2 . 1 . 1048 . . 77 VAL CG1 . 17909 1 446 . 1 1 77 77 VAL CG2 C 13 20.520 0.2 . 1 . 1047 . . 77 VAL CG2 . 17909 1 447 . 1 1 77 77 VAL N N 15 109.951 0.129 . 1 . 78 . . 77 VAL N . 17909 1 448 . 1 1 78 78 LYS H H 1 7.622 0.023 . 1 . 152 . . 78 LYS H . 17909 1 449 . 1 1 78 78 LYS HA H 1 4.621 0.05 . 1 . 1143 . . 78 LYS HA . 17909 1 450 . 1 1 78 78 LYS C C 13 177.927 0.2 . 1 . 772 . . 78 LYS C . 17909 1 451 . 1 1 78 78 LYS CA C 13 57.121 0.2 . 1 . 645 . . 78 LYS CA . 17909 1 452 . 1 1 78 78 LYS CB C 13 31.762 0.2 . 1 . 451 . . 78 LYS CB . 17909 1 453 . 1 1 78 78 LYS CG C 13 24.995 0.2 . 1 . 1049 . . 78 LYS CG . 17909 1 454 . 1 1 78 78 LYS CD C 13 28.599 0.2 . 1 . 1050 . . 78 LYS CD . 17909 1 455 . 1 1 78 78 LYS N N 15 117.376 0.162 . 1 . 151 . . 78 LYS N . 17909 1 456 . 1 1 79 79 TRP H H 1 6.915 0.022 . 1 . 63 . . 79 TRP H . 17909 1 457 . 1 1 79 79 TRP HA H 1 4.821 0.05 . 1 . 1144 . . 79 TRP HA . 17909 1 458 . 1 1 79 79 TRP C C 13 175.854 0.2 . 1 . 830 . . 79 TRP C . 17909 1 459 . 1 1 79 79 TRP CA C 13 55.965 0.2 . 1 . 450 . . 79 TRP CA . 17909 1 460 . 1 1 79 79 TRP CB C 13 31.702 0.2 . 1 . 449 . . 79 TRP CB . 17909 1 461 . 1 1 79 79 TRP N N 15 112.688 0.097 . 1 . 62 . . 79 TRP N . 17909 1 462 . 1 1 80 80 ASP H H 1 7.326 0.006 . 1 . 190 . . 80 ASP H . 17909 1 463 . 1 1 80 80 ASP HA H 1 3.958 0.05 . 1 . 1145 . . 80 ASP HA . 17909 1 464 . 1 1 80 80 ASP C C 13 176.927 0.2 . 1 . 691 . . 80 ASP C . 17909 1 465 . 1 1 80 80 ASP CA C 13 54.283 0.2 . 1 . 448 . . 80 ASP CA . 17909 1 466 . 1 1 80 80 ASP CB C 13 39.371 0.2 . 1 . 447 . . 80 ASP CB . 17909 1 467 . 1 1 80 80 ASP N N 15 124.141 0.141 . 1 . 189 . . 80 ASP N . 17909 1 468 . 1 1 81 81 GLU H H 1 7.358 0.022 . 1 . 106 . . 81 GLU H . 17909 1 469 . 1 1 81 81 GLU HA H 1 4.145 0.05 . 1 . 1147 . . 81 GLU HA . 17909 1 470 . 1 1 81 81 GLU C C 13 176.290 0.2 . 1 . 709 . . 81 GLU C . 17909 1 471 . 1 1 81 81 GLU CA C 13 56.936 0.2 . 1 . 435 . . 81 GLU CA . 17909 1 472 . 1 1 81 81 GLU CB C 13 29.343 0.2 . 1 . 434 . . 81 GLU CB . 17909 1 473 . 1 1 81 81 GLU CG C 13 35.368 0.2 . 1 . 1051 . . 81 GLU CG . 17909 1 474 . 1 1 81 81 GLU N N 15 126.188 0.098 . 1 . 105 . . 81 GLU N . 17909 1 475 . 1 1 82 82 ASN H H 1 8.372 0.016 . 1 . 196 . . 82 ASN H . 17909 1 476 . 1 1 82 82 ASN HA H 1 4.671 0.05 . 1 . 1149 . . 82 ASN HA . 17909 1 477 . 1 1 82 82 ASN C C 13 173.941 0.2 . 1 . 759 . . 82 ASN C . 17909 1 478 . 1 1 82 82 ASN CA C 13 53.362 0.2 . 1 . 394 . . 82 ASN CA . 17909 1 479 . 1 1 82 82 ASN CB C 13 39.171 0.2 . 1 . 395 . . 82 ASN CB . 17909 1 480 . 1 1 82 82 ASN N N 15 116.055 0.149 . 1 . 195 . . 82 ASN N . 17909 1 481 . 1 1 83 83 VAL H H 1 7.318 0.017 . 1 . 83 . . 83 VAL H . 17909 1 482 . 1 1 83 83 VAL HA H 1 4.490 0.05 . 1 . 1151 . . 83 VAL HA . 17909 1 483 . 1 1 83 83 VAL C C 13 174.288 0.2 . 1 . 733 . . 83 VAL C . 17909 1 484 . 1 1 83 83 VAL CA C 13 61.125 0.2 . 1 . 445 . . 83 VAL CA . 17909 1 485 . 1 1 83 83 VAL CB C 13 34.395 0.2 . 1 . 446 . . 83 VAL CB . 17909 1 486 . 1 1 83 83 VAL CG1 C 13 21.099 0.2 . 1 . 1053 . . 83 VAL CG1 . 17909 1 487 . 1 1 83 83 VAL CG2 C 13 21.099 0.2 . 1 . 1052 . . 83 VAL CG2 . 17909 1 488 . 1 1 83 83 VAL N N 15 117.474 0.096 . 1 . 82 . . 83 VAL N . 17909 1 489 . 1 1 84 84 THR H H 1 8.780 0.017 . 1 . 54 . . 84 THR H . 17909 1 490 . 1 1 84 84 THR HA H 1 4.356 0.05 . 1 . 1152 . . 84 THR HA . 17909 1 491 . 1 1 84 84 THR C C 13 175.223 0.2 . 1 . 859 . . 84 THR C . 17909 1 492 . 1 1 84 84 THR CA C 13 60.922 0.2 . 1 . 443 . . 84 THR CA . 17909 1 493 . 1 1 84 84 THR CB C 13 69.024 0.2 . 1 . 444 . . 84 THR CB . 17909 1 494 . 1 1 84 84 THR CG2 C 13 22.119 0.2 . 1 . 953 . . 84 THR CG2 . 17909 1 495 . 1 1 84 84 THR N N 15 114.086 0.139 . 1 . 53 . . 84 THR N . 17909 1 496 . 1 1 85 85 GLY H H 1 7.334 0.015 . 1 . 9 . . 85 GLY H . 17909 1 497 . 1 1 85 85 GLY HA2 H 1 4.348 0.05 . 1 . 1132 . . 85 GLY HA2 . 17909 1 498 . 1 1 85 85 GLY HA3 H 1 4.348 0.05 . 1 . 1131 . . 85 GLY HA3 . 17909 1 499 . 1 1 85 85 GLY C C 13 170.429 0.2 . 1 . 827 . . 85 GLY C . 17909 1 500 . 1 1 85 85 GLY CA C 13 45.100 0.2 . 1 . 442 . . 85 GLY CA . 17909 1 501 . 1 1 85 85 GLY N N 15 109.583 0.196 . 1 . 8 . . 85 GLY N . 17909 1 502 . 1 1 86 86 PHE H H 1 8.125 0.027 . 1 . 232 . . 86 PHE H . 17909 1 503 . 1 1 86 86 PHE HA H 1 5.081 0.05 . 1 . 1153 . . 86 PHE HA . 17909 1 504 . 1 1 86 86 PHE C C 13 173.181 0.2 . 1 . 862 . . 86 PHE C . 17909 1 505 . 1 1 86 86 PHE CA C 13 57.840 0.2 . 1 . 441 . . 86 PHE CA . 17909 1 506 . 1 1 86 86 PHE CB C 13 41.824 0.2 . 1 . 440 . . 86 PHE CB . 17909 1 507 . 1 1 86 86 PHE N N 15 121.676 0.173 . 1 . 231 . . 86 PHE N . 17909 1 508 . 1 1 87 87 GLU H H 1 8.174 0.01 . 1 . 176 . . 87 GLU H . 17909 1 509 . 1 1 87 87 GLU HA H 1 4.368 0.05 . 1 . 1154 . . 87 GLU HA . 17909 1 510 . 1 1 87 87 GLU C C 13 173.863 0.2 . 1 . 851 . . 87 GLU C . 17909 1 511 . 1 1 87 87 GLU CA C 13 53.263 0.2 . 1 . 439 . . 87 GLU CA . 17909 1 512 . 1 1 87 87 GLU CB C 13 32.942 0.2 . 1 . 438 . . 87 GLU CB . 17909 1 513 . 1 1 87 87 GLU CG C 13 35.415 0.2 . 1 . 1054 . . 87 GLU CG . 17909 1 514 . 1 1 87 87 GLU N N 15 125.081 0.159 . 1 . 175 . . 87 GLU N . 17909 1 515 . 1 1 88 88 ILE H H 1 8.511 0.02 . 1 . 88 . . 88 ILE H . 17909 1 516 . 1 1 88 88 ILE HA H 1 3.779 0.05 . 1 . 1155 . . 88 ILE HA . 17909 1 517 . 1 1 88 88 ILE C C 13 175.476 0.2 . 1 . 724 . . 88 ILE C . 17909 1 518 . 1 1 88 88 ILE CA C 13 60.185 0.2 . 1 . 437 . . 88 ILE CA . 17909 1 519 . 1 1 88 88 ILE CB C 13 36.856 0.2 . 1 . 436 . . 88 ILE CB . 17909 1 520 . 1 1 88 88 ILE CG1 C 13 27.771 0.2 . 1 . 1056 . . 88 ILE CG1 . 17909 1 521 . 1 1 88 88 ILE CG2 C 13 17.486 0.2 . 1 . 1055 . . 88 ILE CG2 . 17909 1 522 . 1 1 88 88 ILE N N 15 121.648 0.147 . 1 . 87 . . 88 ILE N . 17909 1 523 . 1 1 89 89 ILE H H 1 8.842 0.007 . 1 . 603 . . 89 ILE H . 17909 1 524 . 1 1 89 89 ILE C C 13 175.672 0.2 . 1 . 768 . . 89 ILE C . 17909 1 525 . 1 1 89 89 ILE CA C 13 59.820 0.2 . 1 . 602 . . 89 ILE CA . 17909 1 526 . 1 1 89 89 ILE CB C 13 36.594 0.2 . 1 . 601 . . 89 ILE CB . 17909 1 527 . 1 1 89 89 ILE CG1 C 13 26.009 0.2 . 1 . 1057 . . 89 ILE CG1 . 17909 1 528 . 1 1 89 89 ILE CG2 C 13 16.274 0.2 . 1 . 1058 . . 89 ILE CG2 . 17909 1 529 . 1 1 89 89 ILE N N 15 128.963 0.007 . 1 . 604 . . 89 ILE N . 17909 1 530 . 1 1 90 90 GLN H H 1 7.433 0.019 . 1 . 230 . . 90 GLN H . 17909 1 531 . 1 1 90 90 GLN HA H 1 4.316 0.05 . 1 . 1156 . . 90 GLN HA . 17909 1 532 . 1 1 90 90 GLN CA C 13 54.897 0.2 . 1 . 600 . . 90 GLN CA . 17909 1 533 . 1 1 90 90 GLN CB C 13 30.839 0.2 . 1 . 599 . . 90 GLN CB . 17909 1 534 . 1 1 90 90 GLN N N 15 117.640 0.186 . 1 . 229 . . 90 GLN N . 17909 1 535 . 1 1 91 91 SER C C 13 174.005 0.2 . 1 . 1064 . . 91 SER C . 17909 1 536 . 1 1 91 91 SER CA C 13 57.709 0.2 . 1 . 680 . . 91 SER CA . 17909 1 537 . 1 1 91 91 SER CB C 13 62.668 0.2 . 1 . 679 . . 91 SER CB . 17909 1 538 . 1 1 92 92 ILE H H 1 8.216 0.014 . 1 . 287 . . 92 ILE H . 17909 1 539 . 1 1 92 92 ILE HA H 1 4.165 0.05 . 1 . 1157 . . 92 ILE HA . 17909 1 540 . 1 1 92 92 ILE C C 13 176.012 0.2 . 1 . 792 . . 92 ILE C . 17909 1 541 . 1 1 92 92 ILE CA C 13 64.214 0.2 . 1 . 318 . . 92 ILE CA . 17909 1 542 . 1 1 92 92 ILE CB C 13 37.353 0.2 . 1 . 295 . . 92 ILE CB . 17909 1 543 . 1 1 92 92 ILE N N 15 127.582 0.212 . 1 . 286 . . 92 ILE N . 17909 1 544 . 1 1 93 93 THR H H 1 8.783 0.016 . 1 . 1138 . . 93 THR H . 17909 1 545 . 1 1 93 93 THR HA H 1 4.673 0.05 . 1 . 1139 . . 93 THR HA . 17909 1 546 . 1 1 93 93 THR C C 13 174.386 0.2 . 1 . 711 . . 93 THR C . 17909 1 547 . 1 1 93 93 THR CA C 13 59.403 0.2 . 1 . 296 . . 93 THR CA . 17909 1 548 . 1 1 93 93 THR CB C 13 71.854 0.2 . 1 . 297 . . 93 THR CB . 17909 1 549 . 1 1 93 93 THR N N 15 110.655 0.153 . 1 . 36 . . 93 THR N . 17909 1 550 . 1 1 94 94 ASP H H 1 8.814 0.015 . 1 . 273 . . 94 ASP H . 17909 1 551 . 1 1 94 94 ASP C C 13 177.303 0.2 . 1 . 756 . . 94 ASP C . 17909 1 552 . 1 1 94 94 ASP CA C 13 56.370 0.2 . 1 . 298 . . 94 ASP CA . 17909 1 553 . 1 1 94 94 ASP CB C 13 39.637 0.2 . 1 . 299 . . 94 ASP CB . 17909 1 554 . 1 1 94 94 ASP N N 15 116.951 0.071 . 1 . 272 . . 94 ASP N . 17909 1 555 . 1 1 95 95 THR H H 1 8.082 0.009 . 1 . 48 . . 95 THR H . 17909 1 556 . 1 1 95 95 THR HA H 1 4.496 0.05 . 1 . 1082 . . 95 THR HA . 17909 1 557 . 1 1 95 95 THR C C 13 172.992 0.2 . 1 . 828 . . 95 THR C . 17909 1 558 . 1 1 95 95 THR CA C 13 60.241 0.2 . 1 . 300 . . 95 THR CA . 17909 1 559 . 1 1 95 95 THR CB C 13 69.495 0.2 . 1 . 301 . . 95 THR CB . 17909 1 560 . 1 1 95 95 THR N N 15 106.007 0.063 . 1 . 47 . . 95 THR N . 17909 1 561 . 1 1 96 96 LEU H H 1 7.300 0.017 . 1 . 275 . . 96 LEU H . 17909 1 562 . 1 1 96 96 LEU HA H 1 5.702 0.05 . 1 . 1146 . . 96 LEU HA . 17909 1 563 . 1 1 96 96 LEU C C 13 174.205 0.2 . 1 . 688 . . 96 LEU C . 17909 1 564 . 1 1 96 96 LEU CA C 13 54.093 0.2 . 1 . 302 . . 96 LEU CA . 17909 1 565 . 1 1 96 96 LEU CB C 13 44.900 0.2 . 1 . 303 . . 96 LEU CB . 17909 1 566 . 1 1 96 96 LEU N N 15 125.981 0.121 . 1 . 274 . . 96 LEU N . 17909 1 567 . 1 1 97 97 CYS H H 1 8.980 0.013 . 1 . 202 . . 97 CYS H . 17909 1 568 . 1 1 97 97 CYS HA H 1 5.187 0.05 . 1 . 1159 . . 97 CYS HA . 17909 1 569 . 1 1 97 97 CYS C C 13 171.021 0.2 . 1 . 690 . . 97 CYS C . 17909 1 570 . 1 1 97 97 CYS CA C 13 54.769 0.2 . 1 . 304 . . 97 CYS CA . 17909 1 571 . 1 1 97 97 CYS CB C 13 31.579 0.2 . 1 . 305 . . 97 CYS CB . 17909 1 572 . 1 1 97 97 CYS N N 15 120.429 0.155 . 1 . 201 . . 97 CYS N . 17909 1 573 . 1 1 98 98 VAL H H 1 8.793 0.018 . 1 . 279 . . 98 VAL H . 17909 1 574 . 1 1 98 98 VAL HA H 1 5.487 0.05 . 1 . 1160 . . 98 VAL HA . 17909 1 575 . 1 1 98 98 VAL C C 13 175.608 0.2 . 1 . 801 . . 98 VAL C . 17909 1 576 . 1 1 98 98 VAL CA C 13 60.136 0.2 . 1 . 307 . . 98 VAL CA . 17909 1 577 . 1 1 98 98 VAL CB C 13 31.876 0.2 . 1 . 306 . . 98 VAL CB . 17909 1 578 . 1 1 98 98 VAL N N 15 119.239 0.119 . 1 . 278 . . 98 VAL N . 17909 1 579 . 1 1 99 99 SER H H 1 9.924 0.017 . 1 . 255 . . 99 SER H . 17909 1 580 . 1 1 99 99 SER C C 13 172.093 0.2 . 1 . 856 . . 99 SER C . 17909 1 581 . 1 1 99 99 SER CA C 13 56.108 0.2 . 1 . 308 . . 99 SER CA . 17909 1 582 . 1 1 99 99 SER CB C 13 68.591 0.2 . 1 . 309 . . 99 SER CB . 17909 1 583 . 1 1 99 99 SER N N 15 124.389 0.122 . 1 . 254 . . 99 SER N . 17909 1 584 . 1 1 100 100 ARG H H 1 8.700 0.016 . 1 . 226 . . 100 ARG H . 17909 1 585 . 1 1 100 100 ARG HA H 1 5.567 0.05 . 1 . 1161 . . 100 ARG HA . 17909 1 586 . 1 1 100 100 ARG C C 13 175.567 0.2 . 1 . 1060 . . 100 ARG C . 17909 1 587 . 1 1 100 100 ARG CA C 13 53.472 0.2 . 1 . 310 . . 100 ARG CA . 17909 1 588 . 1 1 100 100 ARG CB C 13 32.334 0.2 . 1 . 311 . . 100 ARG CB . 17909 1 589 . 1 1 100 100 ARG CG C 13 27.748 0.2 . 1 . 1059 . . 100 ARG CG . 17909 1 590 . 1 1 100 100 ARG N N 15 119.878 0.115 . 1 . 225 . . 100 ARG N . 17909 1 591 . 1 1 101 101 THR H H 1 8.899 0.018 . 1 . 118 . . 101 THR H . 17909 1 592 . 1 1 101 101 THR HA H 1 5.100 0.05 . 1 . 1166 . . 101 THR HA . 17909 1 593 . 1 1 101 101 THR C C 13 173.378 0.2 . 1 . 844 . . 101 THR C . 17909 1 594 . 1 1 101 101 THR CA C 13 61.210 0.2 . 1 . 312 . . 101 THR CA . 17909 1 595 . 1 1 101 101 THR CB C 13 70.218 0.2 . 1 . 313 . . 101 THR CB . 17909 1 596 . 1 1 101 101 THR N N 15 125.850 0.127 . 1 . 117 . . 101 THR N . 17909 1 597 . 1 1 102 102 SER H H 1 8.456 0.016 . 1 . 214 . . 102 SER H . 17909 1 598 . 1 1 102 102 SER HA H 1 5.039 0.05 . 1 . 1141 . . 102 SER HA . 17909 1 599 . 1 1 102 102 SER C C 13 173.311 0.2 . 1 . 779 . . 102 SER C . 17909 1 600 . 1 1 102 102 SER CA C 13 56.529 0.2 . 1 . 314 . . 102 SER CA . 17909 1 601 . 1 1 102 102 SER CB C 13 65.360 0.2 . 1 . 315 . . 102 SER CB . 17909 1 602 . 1 1 102 102 SER N N 15 119.925 0.206 . 1 . 213 . . 102 SER N . 17909 1 603 . 1 1 103 103 THR H H 1 8.839 0.014 . 1 . 81 . . 103 THR H . 17909 1 604 . 1 1 103 103 THR HA H 1 5.233 0.05 . 1 . 1168 . . 103 THR HA . 17909 1 605 . 1 1 103 103 THR CA C 13 58.922 0.2 . 1 . 317 . . 103 THR CA . 17909 1 606 . 1 1 103 103 THR CB C 13 69.096 0.2 . 1 . 316 . . 103 THR CB . 17909 1 607 . 1 1 103 103 THR N N 15 115.208 0.118 . 1 . 80 . . 103 THR N . 17909 1 608 . 1 1 104 104 PRO C C 13 176.920 0.2 . 1 . 741 . . 104 PRO C . 17909 1 609 . 1 1 104 104 PRO CA C 13 61.588 0.2 . 1 . 614 . . 104 PRO CA . 17909 1 610 . 1 1 104 104 PRO CB C 13 31.962 0.2 . 1 . 613 . . 104 PRO CB . 17909 1 611 . 1 1 105 105 SER H H 1 8.309 0.02 . 1 . 104 . . 105 SER H . 17909 1 612 . 1 1 105 105 SER HA H 1 4.487 0.05 . 1 . 1170 . . 105 SER HA . 17909 1 613 . 1 1 105 105 SER C C 13 172.049 0.2 . 1 . 1073 . . 105 SER C . 17909 1 614 . 1 1 105 105 SER CA C 13 58.541 0.2 . 1 . 467 . . 105 SER CA . 17909 1 615 . 1 1 105 105 SER CB C 13 63.508 0.2 . 1 . 468 . . 105 SER CB . 17909 1 616 . 1 1 105 105 SER N N 15 114.050 0.202 . 1 . 103 . . 105 SER N . 17909 1 617 . 1 1 106 106 ALA H H 1 8.923 0.011 . 1 . 470 . . 106 ALA H . 17909 1 618 . 1 1 106 106 ALA C C 13 175.818 0.2 . 1 . 810 . . 106 ALA C . 17909 1 619 . 1 1 106 106 ALA CA C 13 50.463 0.2 . 1 . 469 . . 106 ALA CA . 17909 1 620 . 1 1 106 106 ALA CB C 13 22.701 0.2 . 1 . 471 . . 106 ALA CB . 17909 1 621 . 1 1 106 106 ALA N N 15 125.920 0.037 . 1 . 1236 . . 106 ALA N . 17909 1 622 . 1 1 107 107 ALA H H 1 8.741 0.018 . 1 . 38 . . 107 ALA H . 17909 1 623 . 1 1 107 107 ALA C C 13 177.715 0.2 . 1 . 732 . . 107 ALA C . 17909 1 624 . 1 1 107 107 ALA CA C 13 51.259 0.2 . 1 . 473 . . 107 ALA CA . 17909 1 625 . 1 1 107 107 ALA CB C 13 16.214 0.2 . 1 . 472 . . 107 ALA CB . 17909 1 626 . 1 1 107 107 ALA N N 15 120.759 0.116 . 1 . 37 . . 107 ALA N . 17909 1 627 . 1 1 108 108 MET H H 1 8.695 0.027 . 1 . 172 . . 108 MET H . 17909 1 628 . 1 1 108 108 MET C C 13 175.245 0.2 . 1 . 809 . . 108 MET C . 17909 1 629 . 1 1 108 108 MET CA C 13 55.690 0.2 . 1 . 474 . . 108 MET CA . 17909 1 630 . 1 1 108 108 MET CB C 13 29.305 0.2 . 1 . 475 . . 108 MET CB . 17909 1 631 . 1 1 108 108 MET N N 15 117.176 0.137 . 1 . 171 . . 108 MET N . 17909 1 632 . 1 1 109 109 LYS H H 1 7.637 0.003 . 1 . 90 . . 109 LYS H . 17909 1 633 . 1 1 109 109 LYS C C 13 176.249 0.2 . 1 . 760 . . 109 LYS C . 17909 1 634 . 1 1 109 109 LYS CA C 13 57.901 0.2 . 1 . 477 . . 109 LYS CA . 17909 1 635 . 1 1 109 109 LYS CB C 13 29.328 0.2 . 1 . 476 . . 109 LYS CB . 17909 1 636 . 1 1 109 109 LYS N N 15 109.716 0.124 . 1 . 89 . . 109 LYS N . 17909 1 637 . 1 1 110 110 LEU H H 1 7.824 0.019 . 1 . 222 . . 110 LEU H . 17909 1 638 . 1 1 110 110 LEU HA H 1 4.657 0.05 . 1 . 1171 . . 110 LEU HA . 17909 1 639 . 1 1 110 110 LEU C C 13 177.713 0.2 . 1 . 726 . . 110 LEU C . 17909 1 640 . 1 1 110 110 LEU CA C 13 56.739 0.2 . 1 . 479 . . 110 LEU CA . 17909 1 641 . 1 1 110 110 LEU CB C 13 41.253 0.2 . 1 . 478 . . 110 LEU CB . 17909 1 642 . 1 1 110 110 LEU N N 15 120.234 0.164 . 1 . 221 . . 110 LEU N . 17909 1 643 . 1 1 111 111 ILE H H 1 7.780 0.01 . 1 . 639 . . 111 ILE H . 17909 1 644 . 1 1 111 111 ILE HA H 1 3.957 0.05 . 1 . 1175 . . 111 ILE HA . 17909 1 645 . 1 1 111 111 ILE C C 13 174.276 0.2 . 1 . 764 . . 111 ILE C . 17909 1 646 . 1 1 111 111 ILE CA C 13 60.038 0.2 . 1 . 637 . . 111 ILE CA . 17909 1 647 . 1 1 111 111 ILE CB C 13 37.480 0.2 . 1 . 640 . . 111 ILE CB . 17909 1 648 . 1 1 111 111 ILE N N 15 117.455 0.067 . 1 . 638 . . 111 ILE N . 17909 1 649 . 1 1 112 112 SER H H 1 8.072 0.016 . 1 . 210 . . 112 SER H . 17909 1 650 . 1 1 112 112 SER CA C 13 58.124 0.2 . 1 . 641 . . 112 SER CA . 17909 1 651 . 1 1 112 112 SER CB C 13 60.230 0.2 . 1 . 642 . . 112 SER CB . 17909 1 652 . 1 1 112 112 SER N N 15 122.641 0.124 . 1 . 209 . . 112 SER N . 17909 1 653 . 1 1 113 113 PRO C C 13 175.058 0.2 . 1 . 799 . . 113 PRO C . 17909 1 654 . 1 1 113 113 PRO CA C 13 65.508 0.2 . 1 . 643 . . 113 PRO CA . 17909 1 655 . 1 1 113 113 PRO CB C 13 31.849 0.2 . 1 . 644 . . 113 PRO CB . 17909 1 656 . 1 1 114 114 ARG H H 1 7.596 0.019 . 1 . 71 . . 114 ARG H . 17909 1 657 . 1 1 114 114 ARG C C 13 176.497 0.2 . 1 . 700 . . 114 ARG C . 17909 1 658 . 1 1 114 114 ARG CA C 13 52.722 0.2 . 1 . 529 . . 114 ARG CA . 17909 1 659 . 1 1 114 114 ARG CB C 13 35.887 0.2 . 1 . 530 . . 114 ARG CB . 17909 1 660 . 1 1 114 114 ARG N N 15 126.146 0.111 . 1 . 70 . . 114 ARG N . 17909 1 661 . 1 1 115 115 ASP H H 1 8.524 0.004 . 1 . 533 . . 115 ASP H . 17909 1 662 . 1 1 115 115 ASP C C 13 172.164 0.2 . 1 . 834 . . 115 ASP C . 17909 1 663 . 1 1 115 115 ASP CA C 13 52.048 0.2 . 1 . 531 . . 115 ASP CA . 17909 1 664 . 1 1 115 115 ASP CB C 13 41.880 0.2 . 1 . 532 . . 115 ASP CB . 17909 1 665 . 1 1 115 115 ASP N N 15 117.014 0.027 . 1 . 534 . . 115 ASP N . 17909 1 666 . 1 1 116 116 PHE H H 1 8.011 0.012 . 1 . 281 . . 116 PHE H . 17909 1 667 . 1 1 116 116 PHE HA H 1 4.551 0.05 . 1 . 1177 . . 116 PHE HA . 17909 1 668 . 1 1 116 116 PHE C C 13 174.868 0.2 . 1 . 715 . . 116 PHE C . 17909 1 669 . 1 1 116 116 PHE CA C 13 57.105 0.2 . 1 . 535 . . 116 PHE CA . 17909 1 670 . 1 1 116 116 PHE CB C 13 42.153 0.2 . 1 . 536 . . 116 PHE CB . 17909 1 671 . 1 1 116 116 PHE N N 15 113.686 0.17 . 1 . 280 . . 116 PHE N . 17909 1 672 . 1 1 117 117 VAL H H 1 9.564 0.01 . 1 . 234 . . 117 VAL H . 17909 1 673 . 1 1 117 117 VAL C C 13 173.847 0.2 . 1 . 1070 . . 117 VAL C . 17909 1 674 . 1 1 117 117 VAL CA C 13 61.513 0.2 . 1 . 538 . . 117 VAL CA . 17909 1 675 . 1 1 117 117 VAL CB C 13 31.784 0.2 . 1 . 537 . . 117 VAL CB . 17909 1 676 . 1 1 117 117 VAL CG1 C 13 21.011 0.2 . 1 . 987 . . 117 VAL CG1 . 17909 1 677 . 1 1 117 117 VAL CG2 C 13 21.011 0.2 . 1 . 988 . . 117 VAL CG2 . 17909 1 678 . 1 1 117 117 VAL N N 15 127.760 0.115 . 1 . 233 . . 117 VAL N . 17909 1 679 . 1 1 118 118 ASP H H 1 8.528 0.016 . 1 . 216 . . 118 ASP H . 17909 1 680 . 1 1 118 118 ASP HA H 1 5.029 0.05 . 1 . 1178 . . 118 ASP HA . 17909 1 681 . 1 1 118 118 ASP C C 13 174.450 0.2 . 1 . 873 . . 118 ASP C . 17909 1 682 . 1 1 118 118 ASP CA C 13 52.693 0.2 . 1 . 863 . . 118 ASP CA . 17909 1 683 . 1 1 118 118 ASP CB C 13 45.878 0.2 . 1 . 539 . . 118 ASP CB . 17909 1 684 . 1 1 118 118 ASP N N 15 122.406 0.2 . 1 . 215 . . 118 ASP N . 17909 1 685 . 1 1 119 119 LEU H H 1 9.220 0.0 . 1 . 871 . . 119 LEU H . 17909 1 686 . 1 1 119 119 LEU C C 13 175.941 0.2 . 1 . 714 . . 119 LEU C . 17909 1 687 . 1 1 119 119 LEU CA C 13 53.229 0.2 . 1 . 870 . . 119 LEU CA . 17909 1 688 . 1 1 119 119 LEU CB C 13 43.711 0.2 . 1 . 869 . . 119 LEU CB . 17909 1 689 . 1 1 119 119 LEU CG C 13 27.427 0.2 . 1 . 874 . . 119 LEU CG . 17909 1 690 . 1 1 119 119 LEU N N 15 121.848 0.081 . 1 . 872 . . 119 LEU N . 17909 1 691 . 1 1 120 120 VAL H H 1 9.387 0.022 . 1 . 59 . . 120 VAL H . 17909 1 692 . 1 1 120 120 VAL HA H 1 4.488 0.05 . 1 . 1116 . . 120 VAL HA . 17909 1 693 . 1 1 120 120 VAL C C 13 175.196 0.2 . 1 . 751 . . 120 VAL C . 17909 1 694 . 1 1 120 120 VAL CA C 13 60.247 0.2 . 1 . 864 . . 120 VAL CA . 17909 1 695 . 1 1 120 120 VAL CB C 13 33.543 0.2 . 1 . 527 . . 120 VAL CB . 17909 1 696 . 1 1 120 120 VAL CG1 C 13 21.066 0.2 . 1 . 1238 . . 120 VAL CG1 . 17909 1 697 . 1 1 120 120 VAL CG2 C 13 21.066 0.2 . 1 . 1237 . . 120 VAL CG2 . 17909 1 698 . 1 1 120 120 VAL N N 15 127.983 0.043 . 1 . 528 . . 120 VAL N . 17909 1 699 . 1 1 121 121 LEU H H 1 9.038 0.024 . 1 . 11 . . 121 LEU H . 17909 1 700 . 1 1 121 121 LEU C C 13 177.046 0.2 . 1 . 824 . . 121 LEU C . 17909 1 701 . 1 1 121 121 LEU CA C 13 52.294 0.2 . 1 . 387 . . 121 LEU CA . 17909 1 702 . 1 1 121 121 LEU CB C 13 46.003 0.2 . 1 . 386 . . 121 LEU CB . 17909 1 703 . 1 1 121 121 LEU CG C 13 25.874 0.2 . 1 . 875 . . 121 LEU CG . 17909 1 704 . 1 1 121 121 LEU N N 15 128.634 0.148 . 1 . 10 . . 121 LEU N . 17909 1 705 . 1 1 122 122 VAL H H 1 9.103 0.018 . 1 . 110 . . 122 VAL H . 17909 1 706 . 1 1 122 122 VAL C C 13 174.721 0.2 . 1 . 765 . . 122 VAL C . 17909 1 707 . 1 1 122 122 VAL CA C 13 60.976 0.2 . 1 . 389 . . 122 VAL CA . 17909 1 708 . 1 1 122 122 VAL CB C 13 32.618 0.2 . 1 . 388 . . 122 VAL CB . 17909 1 709 . 1 1 122 122 VAL CG1 C 13 20.870 0.2 . 1 . 876 . . 122 VAL CG1 . 17909 1 710 . 1 1 122 122 VAL CG2 C 13 20.870 0.2 . 1 . 877 . . 122 VAL CG2 . 17909 1 711 . 1 1 122 122 VAL N N 15 131.024 0.088 . 1 . 109 . . 122 VAL N . 17909 1 712 . 1 1 123 123 LYS H H 1 8.478 0.02 . 1 . 206 . . 123 LYS H . 17909 1 713 . 1 1 123 123 LYS HA H 1 4.312 0.05 . 1 . 1179 . . 123 LYS HA . 17909 1 714 . 1 1 123 123 LYS C C 13 174.447 0.2 . 1 . 806 . . 123 LYS C . 17909 1 715 . 1 1 123 123 LYS CA C 13 54.903 0.2 . 1 . 390 . . 123 LYS CA . 17909 1 716 . 1 1 123 123 LYS CB C 13 35.639 0.2 . 1 . 391 . . 123 LYS CB . 17909 1 717 . 1 1 123 123 LYS CG C 13 24.869 0.2 . 1 . 879 . . 123 LYS CG . 17909 1 718 . 1 1 123 123 LYS CD C 13 28.547 0.2 . 1 . 880 . . 123 LYS CD . 17909 1 719 . 1 1 123 123 LYS CE C 13 39.994 0.2 . 1 . 878 . . 123 LYS CE . 17909 1 720 . 1 1 123 123 LYS N N 15 126.792 0.184 . 1 . 205 . . 123 LYS N . 17909 1 721 . 1 1 124 124 ARG H H 1 8.575 0.02 . 1 . 21 . . 124 ARG H . 17909 1 722 . 1 1 124 124 ARG HA H 1 4.836 0.05 . 1 . 1225 . . 124 ARG HA . 17909 1 723 . 1 1 124 124 ARG C C 13 175.244 0.2 . 1 . 767 . . 124 ARG C . 17909 1 724 . 1 1 124 124 ARG CA C 13 54.352 0.2 . 1 . 392 . . 124 ARG CA . 17909 1 725 . 1 1 124 124 ARG CB C 13 30.752 0.2 . 1 . 393 . . 124 ARG CB . 17909 1 726 . 1 1 124 124 ARG CG C 13 27.821 0.2 . 1 . 881 . . 124 ARG CG . 17909 1 727 . 1 1 124 124 ARG CD C 13 42.425 0.2 . 1 . 882 . . 124 ARG CD . 17909 1 728 . 1 1 124 124 ARG N N 15 129.302 0.143 . 1 . 20 . . 124 ARG N . 17909 1 729 . 1 1 125 125 TYR H H 1 8.783 0.007 . 1 . 894 . . 125 TYR H . 17909 1 730 . 1 1 125 125 TYR HA H 1 4.588 0.05 . 1 . 1129 . . 125 TYR HA . 17909 1 731 . 1 1 125 125 TYR C C 13 177.925 0.2 . 1 . 812 . . 125 TYR C . 17909 1 732 . 1 1 125 125 TYR CA C 13 57.716 0.2 . 1 . 896 . . 125 TYR CA . 17909 1 733 . 1 1 125 125 TYR CB C 13 40.828 0.2 . 1 . 893 . . 125 TYR CB . 17909 1 734 . 1 1 125 125 TYR N N 15 122.579 0.073 . 1 . 895 . . 125 TYR N . 17909 1 735 . 1 1 126 126 GLU H H 1 9.231 0.013 . 1 . 263 . . 126 GLU H . 17909 1 736 . 1 1 126 126 GLU C C 13 176.531 0.2 . 1 . 839 . . 126 GLU C . 17909 1 737 . 1 1 126 126 GLU CA C 13 58.635 0.2 . 1 . 419 . . 126 GLU CA . 17909 1 738 . 1 1 126 126 GLU CB C 13 28.380 0.2 . 1 . 422 . . 126 GLU CB . 17909 1 739 . 1 1 126 126 GLU CG C 13 36.022 0.2 . 1 . 883 . . 126 GLU CG . 17909 1 740 . 1 1 126 126 GLU N N 15 121.220 0.161 . 1 . 262 . . 126 GLU N . 17909 1 741 . 1 1 127 127 ASP H H 1 8.072 0.018 . 1 . 228 . . 127 ASP H . 17909 1 742 . 1 1 127 127 ASP HA H 1 4.353 0.05 . 1 . 1180 . . 127 ASP HA . 17909 1 743 . 1 1 127 127 ASP C C 13 175.924 0.2 . 1 . 790 . . 127 ASP C . 17909 1 744 . 1 1 127 127 ASP CA C 13 53.489 0.2 . 1 . 420 . . 127 ASP CA . 17909 1 745 . 1 1 127 127 ASP CB C 13 39.091 0.2 . 1 . 421 . . 127 ASP CB . 17909 1 746 . 1 1 127 127 ASP N N 15 116.636 0.161 . 1 . 227 . . 127 ASP N . 17909 1 747 . 1 1 128 128 GLY H H 1 7.966 0.016 . 1 . 156 . . 128 GLY H . 17909 1 748 . 1 1 128 128 GLY HA2 H 1 4.304 0.006 . 1 . 1076 . . 128 GLY HA2 . 17909 1 749 . 1 1 128 128 GLY HA3 H 1 4.304 0.006 . 1 . 1077 . . 128 GLY HA3 . 17909 1 750 . 1 1 128 128 GLY C C 13 173.562 0.2 . 1 . 704 . . 128 GLY C . 17909 1 751 . 1 1 128 128 GLY CA C 13 43.760 0.2 . 1 . 292 . . 128 GLY CA . 17909 1 752 . 1 1 128 128 GLY N N 15 107.968 0.076 . 1 . 155 . . 128 GLY N . 17909 1 753 . 1 1 129 129 THR H H 1 7.878 0.008 . 1 . 166 . . 129 THR H . 17909 1 754 . 1 1 129 129 THR HA H 1 4.510 0.05 . 1 . 1183 . . 129 THR HA . 17909 1 755 . 1 1 129 129 THR C C 13 173.464 0.2 . 1 . 803 . . 129 THR C . 17909 1 756 . 1 1 129 129 THR CA C 13 64.328 0.2 . 1 . 338 . . 129 THR CA . 17909 1 757 . 1 1 129 129 THR CB C 13 68.527 0.2 . 1 . 339 . . 129 THR CB . 17909 1 758 . 1 1 129 129 THR CG2 C 13 21.898 0.2 . 1 . 884 . . 129 THR CG2 . 17909 1 759 . 1 1 129 129 THR N N 15 117.323 0.127 . 1 . 165 . . 129 THR N . 17909 1 760 . 1 1 130 130 ILE H H 1 8.487 0.017 . 1 . 261 . . 130 ILE H . 17909 1 761 . 1 1 130 130 ILE HA H 1 4.310 0.05 . 1 . 1184 . . 130 ILE HA . 17909 1 762 . 1 1 130 130 ILE C C 13 172.997 0.2 . 1 . 781 . . 130 ILE C . 17909 1 763 . 1 1 130 130 ILE CA C 13 60.185 0.2 . 1 . 334 . . 130 ILE CA . 17909 1 764 . 1 1 130 130 ILE CB C 13 40.461 0.2 . 1 . 335 . . 130 ILE CB . 17909 1 765 . 1 1 130 130 ILE CG1 C 13 27.849 0.2 . 1 . 885 . . 130 ILE CG1 . 17909 1 766 . 1 1 130 130 ILE CD1 C 13 15.107 0.2 . 1 . 886 . . 130 ILE CD1 . 17909 1 767 . 1 1 130 130 ILE N N 15 125.743 0.144 . 1 . 260 . . 130 ILE N . 17909 1 768 . 1 1 131 131 SER H H 1 7.916 0.012 . 1 . 154 . . 131 SER H . 17909 1 769 . 1 1 131 131 SER C C 13 172.375 0.2 . 1 . 755 . . 131 SER C . 17909 1 770 . 1 1 131 131 SER CA C 13 55.136 0.2 . 1 . 336 . . 131 SER CA . 17909 1 771 . 1 1 131 131 SER CB C 13 68.619 0.2 . 1 . 337 . . 131 SER CB . 17909 1 772 . 1 1 131 131 SER N N 15 119.924 0.161 . 1 . 153 . . 131 SER N . 17909 1 773 . 1 1 132 132 SER H H 1 8.797 0.015 . 1 . 186 . . 132 SER H . 17909 1 774 . 1 1 132 132 SER HA H 1 5.174 0.05 . 1 . 1169 . . 132 SER HA . 17909 1 775 . 1 1 132 132 SER C C 13 173.317 0.2 . 1 . 822 . . 132 SER C . 17909 1 776 . 1 1 132 132 SER CA C 13 55.569 0.2 . 1 . 332 . . 132 SER CA . 17909 1 777 . 1 1 132 132 SER CB C 13 65.189 0.2 . 1 . 333 . . 132 SER CB . 17909 1 778 . 1 1 132 132 SER N N 15 115.630 0.115 . 1 . 185 . . 132 SER N . 17909 1 779 . 1 1 133 133 ASN H H 1 8.156 0.019 . 1 . 138 . . 133 ASN H . 17909 1 780 . 1 1 133 133 ASN C C 13 173.155 0.2 . 1 . 705 . . 133 ASN C . 17909 1 781 . 1 1 133 133 ASN CA C 13 52.432 0.2 . 1 . 331 . . 133 ASN CA . 17909 1 782 . 1 1 133 133 ASN CB C 13 41.671 0.2 . 1 . 330 . . 133 ASN CB . 17909 1 783 . 1 1 133 133 ASN N N 15 119.363 0.214 . 1 . 137 . . 133 ASN N . 17909 1 784 . 1 1 134 134 ALA H H 1 9.733 0.019 . 1 . 100 . . 134 ALA H . 17909 1 785 . 1 1 134 134 ALA HA H 1 5.903 0.05 . 1 . 1186 . . 134 ALA HA . 17909 1 786 . 1 1 134 134 ALA C C 13 175.121 0.2 . 1 . 701 . . 134 ALA C . 17909 1 787 . 1 1 134 134 ALA CA C 13 50.058 0.2 . 1 . 328 . . 134 ALA CA . 17909 1 788 . 1 1 134 134 ALA CB C 13 23.205 0.2 . 1 . 329 . . 134 ALA CB . 17909 1 789 . 1 1 134 134 ALA N N 15 128.826 0.127 . 1 . 99 . . 134 ALA N . 17909 1 790 . 1 1 135 135 THR H H 1 7.748 0.013 . 1 . 198 . . 135 THR H . 17909 1 791 . 1 1 135 135 THR HA H 1 4.001 0.05 . 1 . 1187 . . 135 THR HA . 17909 1 792 . 1 1 135 135 THR C C 13 171.059 0.2 . 1 . 1029 . . 135 THR C . 17909 1 793 . 1 1 135 135 THR CA C 13 60.287 0.2 . 1 . 326 . . 135 THR CA . 17909 1 794 . 1 1 135 135 THR CB C 13 70.313 0.2 . 1 . 327 . . 135 THR CB . 17909 1 795 . 1 1 135 135 THR N N 15 110.113 0.147 . 1 . 197 . . 135 THR N . 17909 1 796 . 1 1 136 136 HIS H H 1 8.436 0.018 . 1 . 75 . . 136 HIS H . 17909 1 797 . 1 1 136 136 HIS HA H 1 4.639 0.05 . 1 . 1188 . . 136 HIS HA . 17909 1 798 . 1 1 136 136 HIS C C 13 174.019 0.2 . 1 . 800 . . 136 HIS C . 17909 1 799 . 1 1 136 136 HIS CA C 13 55.981 0.2 . 1 . 396 . . 136 HIS CA . 17909 1 800 . 1 1 136 136 HIS CB C 13 29.958 0.2 . 1 . 397 . . 136 HIS CB . 17909 1 801 . 1 1 136 136 HIS N N 15 122.746 0.238 . 1 . 74 . . 136 HIS N . 17909 1 802 . 1 1 137 137 VAL H H 1 8.509 0.017 . 1 . 184 . . 137 VAL H . 17909 1 803 . 1 1 137 137 VAL HA H 1 4.308 0.05 . 1 . 1191 . . 137 VAL HA . 17909 1 804 . 1 1 137 137 VAL C C 13 174.047 0.2 . 1 . 807 . . 137 VAL C . 17909 1 805 . 1 1 137 137 VAL CA C 13 59.583 0.2 . 1 . 571 . . 137 VAL CA . 17909 1 806 . 1 1 137 137 VAL CB C 13 35.347 0.2 . 1 . 570 . . 137 VAL CB . 17909 1 807 . 1 1 137 137 VAL CG1 C 13 22.901 0.2 . 2 . 888 . . 137 VAL CG1 . 17909 1 808 . 1 1 137 137 VAL CG2 C 13 20.249 0.2 . 2 . 887 . . 137 VAL CG2 . 17909 1 809 . 1 1 137 137 VAL N N 15 115.613 0.197 . 1 . 183 . . 137 VAL N . 17909 1 810 . 1 1 138 138 GLU H H 1 8.010 0.003 . 1 . 997 . . 138 GLU H . 17909 1 811 . 1 1 138 138 GLU HA H 1 4.541 0.05 . 1 . 1192 . . 138 GLU HA . 17909 1 812 . 1 1 138 138 GLU C C 13 175.458 0.2 . 1 . 819 . . 138 GLU C . 17909 1 813 . 1 1 138 138 GLU CA C 13 55.608 0.2 . 1 . 999 . . 138 GLU CA . 17909 1 814 . 1 1 138 138 GLU CB C 13 29.296 0.2 . 1 . 572 . . 138 GLU CB . 17909 1 815 . 1 1 138 138 GLU CG C 13 37.580 0.2 . 1 . 1065 . . 138 GLU CG . 17909 1 816 . 1 1 138 138 GLU N N 15 125.040 0.005 . 1 . 998 . . 138 GLU N . 17909 1 817 . 1 1 139 139 HIS H H 1 8.903 0.002 . 1 . 1163 . . 139 HIS H . 17909 1 818 . 1 1 139 139 HIS HA H 1 4.645 0.05 . 1 . 1231 . . 139 HIS HA . 17909 1 819 . 1 1 139 139 HIS CA C 13 54.625 0.2 . 1 . 996 . . 139 HIS CA . 17909 1 820 . 1 1 139 139 HIS CB C 13 34.984 0.2 . 1 . 290 . . 139 HIS CB . 17909 1 821 . 1 1 139 139 HIS N N 15 125.739 0.029 . 1 . 1162 . . 139 HIS N . 17909 1 822 . 1 1 140 140 PRO C C 13 177.965 0.2 . 1 . 698 . . 140 PRO C . 17909 1 823 . 1 1 140 140 PRO CA C 13 63.808 0.2 . 1 . 611 . . 140 PRO CA . 17909 1 824 . 1 1 140 140 PRO CB C 13 31.859 0.2 . 1 . 612 . . 140 PRO CB . 17909 1 825 . 1 1 140 140 PRO CG C 13 26.312 0.2 . 1 . 889 . . 140 PRO CG . 17909 1 826 . 1 1 140 140 PRO CD C 13 50.718 0.2 . 1 . 890 . . 140 PRO CD . 17909 1 827 . 1 1 141 141 LEU H H 1 10.195 0.014 . 1 . 168 . . 141 LEU H . 17909 1 828 . 1 1 141 141 LEU HA H 1 4.424 0.05 . 1 . 1193 . . 141 LEU HA . 17909 1 829 . 1 1 141 141 LEU C C 13 178.561 0.2 . 1 . 848 . . 141 LEU C . 17909 1 830 . 1 1 141 141 LEU CA C 13 54.426 0.2 . 1 . 610 . . 141 LEU CA . 17909 1 831 . 1 1 141 141 LEU CB C 13 40.212 0.2 . 1 . 609 . . 141 LEU CB . 17909 1 832 . 1 1 141 141 LEU N N 15 117.994 0.119 . 1 . 167 . . 141 LEU N . 17909 1 833 . 1 1 142 142 CYS H H 1 8.365 0.003 . 1 . 608 . . 142 CYS H . 17909 1 834 . 1 1 142 142 CYS HA H 1 4.669 0.05 . 1 . 1140 . . 142 CYS HA . 17909 1 835 . 1 1 142 142 CYS CA C 13 57.468 0.2 . 1 . 606 . . 142 CYS CA . 17909 1 836 . 1 1 142 142 CYS CB C 13 27.634 0.2 . 1 . 605 . . 142 CYS CB . 17909 1 837 . 1 1 142 142 CYS N N 15 119.750 0.029 . 1 . 607 . . 142 CYS N . 17909 1 838 . 1 1 144 144 PRO C C 13 175.631 0.2 . 1 . 795 . . 144 PRO C . 17909 1 839 . 1 1 144 144 PRO CA C 13 63.712 0.2 . 1 . 964 . . 144 PRO CA . 17909 1 840 . 1 1 144 144 PRO CB C 13 30.925 0.2 . 1 . 963 . . 144 PRO CB . 17909 1 841 . 1 1 144 144 PRO CG C 13 28.228 0.2 . 1 . 962 . . 144 PRO CG . 17909 1 842 . 1 1 145 145 LYS H H 1 9.866 0.016 . 1 . 150 . . 145 LYS H . 17909 1 843 . 1 1 145 145 LYS HA H 1 4.141 0.05 . 1 . 1194 . . 145 LYS HA . 17909 1 844 . 1 1 145 145 LYS CA C 13 51.870 0.2 . 1 . 961 . . 145 LYS CA . 17909 1 845 . 1 1 145 145 LYS CB C 13 34.057 0.2 . 1 . 960 . . 145 LYS CB . 17909 1 846 . 1 1 145 145 LYS N N 15 127.623 0.133 . 1 . 149 . . 145 LYS N . 17909 1 847 . 1 1 146 146 PRO C C 13 177.539 0.2 . 1 . 1066 . . 146 PRO C . 17909 1 848 . 1 1 146 146 PRO CA C 13 63.221 0.2 . 1 . 624 . . 146 PRO CA . 17909 1 849 . 1 1 146 146 PRO CB C 13 30.939 0.2 . 1 . 623 . . 146 PRO CB . 17909 1 850 . 1 1 147 147 GLY H H 1 8.548 0.016 . 1 . 27 . . 147 GLY H . 17909 1 851 . 1 1 147 147 GLY HA3 H 1 3.981 0.05 . 1 . 1195 . . 147 GLY HA3 . 17909 1 852 . 1 1 147 147 GLY C C 13 173.343 0.2 . 1 . 861 . . 147 GLY C . 17909 1 853 . 1 1 147 147 GLY CA C 13 44.153 0.2 . 1 . 622 . . 147 GLY CA . 17909 1 854 . 1 1 147 147 GLY N N 15 110.627 0.109 . 1 . 26 . . 147 GLY N . 17909 1 855 . 1 1 148 148 PHE H H 1 7.751 0.015 . 1 . 247 . . 148 PHE H . 17909 1 856 . 1 1 148 148 PHE HA H 1 4.251 0.05 . 1 . 1173 . . 148 PHE HA . 17909 1 857 . 1 1 148 148 PHE C C 13 175.709 0.2 . 1 . 763 . . 148 PHE C . 17909 1 858 . 1 1 148 148 PHE CA C 13 56.710 0.2 . 1 . 429 . . 148 PHE CA . 17909 1 859 . 1 1 148 148 PHE CB C 13 41.723 0.2 . 1 . 428 . . 148 PHE CB . 17909 1 860 . 1 1 148 148 PHE N N 15 117.543 0.105 . 1 . 246 . . 148 PHE N . 17909 1 861 . 1 1 149 149 VAL H H 1 8.335 0.016 . 1 . 86 . . 149 VAL H . 17909 1 862 . 1 1 149 149 VAL HA H 1 4.475 0.05 . 1 . 1196 . . 149 VAL HA . 17909 1 863 . 1 1 149 149 VAL C C 13 174.496 0.2 . 1 . 710 . . 149 VAL C . 17909 1 864 . 1 1 149 149 VAL CA C 13 61.854 0.2 . 1 . 426 . . 149 VAL CA . 17909 1 865 . 1 1 149 149 VAL CB C 13 31.969 0.2 . 1 . 427 . . 149 VAL CB . 17909 1 866 . 1 1 149 149 VAL CG1 C 13 20.890 0.2 . 1 . 892 . . 149 VAL CG1 . 17909 1 867 . 1 1 149 149 VAL CG2 C 13 20.890 0.2 . 1 . 891 . . 149 VAL CG2 . 17909 1 868 . 1 1 149 149 VAL N N 15 126.242 0.176 . 1 . 85 . . 149 VAL N . 17909 1 869 . 1 1 150 150 ARG H H 1 8.213 0.016 . 1 . 204 . . 150 ARG H . 17909 1 870 . 1 1 150 150 ARG C C 13 174.198 0.2 . 1 . 702 . . 150 ARG C . 17909 1 871 . 1 1 150 150 ARG CA C 13 52.751 0.2 . 1 . 425 . . 150 ARG CA . 17909 1 872 . 1 1 150 150 ARG CB C 13 25.398 0.2 . 1 . 424 . . 150 ARG CB . 17909 1 873 . 1 1 150 150 ARG N N 15 129.871 0.13 . 1 . 203 . . 150 ARG N . 17909 1 874 . 1 1 151 151 GLY H H 1 7.905 0.013 . 1 . 7 . . 151 GLY H . 17909 1 875 . 1 1 151 151 GLY C C 13 172.063 0.2 . 1 . 815 . . 151 GLY C . 17909 1 876 . 1 1 151 151 GLY CA C 13 42.578 0.2 . 1 . 423 . . 151 GLY CA . 17909 1 877 . 1 1 151 151 GLY N N 15 116.155 0.147 . 1 . 6 . . 151 GLY N . 17909 1 878 . 1 1 152 152 PHE H H 1 8.759 0.02 . 1 . 241 . . 152 PHE H . 17909 1 879 . 1 1 152 152 PHE HA H 1 4.778 0.05 . 1 . 1137 . . 152 PHE HA . 17909 1 880 . 1 1 152 152 PHE C C 13 174.007 0.2 . 1 . 766 . . 152 PHE C . 17909 1 881 . 1 1 152 152 PHE CA C 13 56.389 0.2 . 1 . 430 . . 152 PHE CA . 17909 1 882 . 1 1 152 152 PHE CB C 13 41.095 0.2 . 1 . 431 . . 152 PHE CB . 17909 1 883 . 1 1 152 152 PHE N N 15 111.802 0.085 . 1 . 1136 . . 152 PHE N . 17909 1 884 . 1 1 153 153 ASN H H 1 10.543 0.012 . 1 . 162 . . 153 ASN H . 17909 1 885 . 1 1 153 153 ASN C C 13 174.540 0.2 . 1 . 813 . . 153 ASN C . 17909 1 886 . 1 1 153 153 ASN CA C 13 52.798 0.2 . 1 . 900 . . 153 ASN CA . 17909 1 887 . 1 1 153 153 ASN CB C 13 37.793 0.2 . 1 . 898 . . 153 ASN CB . 17909 1 888 . 1 1 153 153 ASN N N 15 124.914 0.049 . 1 . 161 . . 153 ASN N . 17909 1 889 . 1 1 154 154 HIS H H 1 8.671 0.02 . 1 . 257 . . 154 HIS H . 17909 1 890 . 1 1 154 154 HIS HA H 1 4.787 0.05 . 1 . 1197 . . 154 HIS HA . 17909 1 891 . 1 1 154 154 HIS CA C 13 55.943 0.2 . 1 . 899 . . 154 HIS CA . 17909 1 892 . 1 1 154 154 HIS CB C 13 26.749 0.2 . 1 . 901 . . 154 HIS CB . 17909 1 893 . 1 1 154 154 HIS N N 15 126.328 0.136 . 1 . 256 . . 154 HIS N . 17909 1 894 . 1 1 155 155 PRO C C 13 175.764 0.2 . 1 . 695 . . 155 PRO C . 17909 1 895 . 1 1 155 155 PRO CA C 13 65.242 0.2 . 1 . 683 . . 155 PRO CA . 17909 1 896 . 1 1 156 156 CYS H H 1 8.879 0.024 . 1 . 102 . . 156 CYS H . 17909 1 897 . 1 1 156 156 CYS HA H 1 4.323 0.05 . 1 . 1198 . . 156 CYS HA . 17909 1 898 . 1 1 156 156 CYS C C 13 171.945 0.2 . 1 . 1041 . . 156 CYS C . 17909 1 899 . 1 1 156 156 CYS CA C 13 57.378 0.2 . 1 . 553 . . 156 CYS CA . 17909 1 900 . 1 1 156 156 CYS CB C 13 30.301 0.2 . 1 . 552 . . 156 CYS CB . 17909 1 901 . 1 1 156 156 CYS N N 15 117.131 0.185 . 1 . 101 . . 156 CYS N . 17909 1 902 . 1 1 157 157 GLY H H 1 7.876 0.0 . 1 . 659 . . 157 GLY H . 17909 1 903 . 1 1 157 157 GLY HA3 H 1 4.129 0.05 . 1 . 1199 . . 157 GLY HA3 . 17909 1 904 . 1 1 157 157 GLY C C 13 173.401 0.2 . 1 . 745 . . 157 GLY C . 17909 1 905 . 1 1 157 157 GLY CA C 13 43.664 0.2 . 1 . 981 . . 157 GLY CA . 17909 1 906 . 1 1 157 157 GLY N N 15 103.692 0.167 . 1 . 657 . . 157 GLY N . 17909 1 907 . 1 1 158 158 CYS H H 1 8.300 0.011 . 1 . 544 . . 158 CYS H . 17909 1 908 . 1 1 158 158 CYS HA H 1 5.550 0.05 . 1 . 1148 . . 158 CYS HA . 17909 1 909 . 1 1 158 158 CYS C C 13 171.872 0.2 . 1 . 843 . . 158 CYS C . 17909 1 910 . 1 1 158 158 CYS CA C 13 56.173 0.2 . 1 . 545 . . 158 CYS CA . 17909 1 911 . 1 1 158 158 CYS CB C 13 32.023 0.2 . 1 . 542 . . 158 CYS CB . 17909 1 912 . 1 1 158 158 CYS N N 15 116.390 0.093 . 1 . 543 . . 158 CYS N . 17909 1 913 . 1 1 159 159 PHE H H 1 9.704 0.005 . 1 . 170 . . 159 PHE H . 17909 1 914 . 1 1 159 159 PHE HA H 1 4.662 0.05 . 1 . 1200 . . 159 PHE HA . 17909 1 915 . 1 1 159 159 PHE C C 13 174.450 0.2 . 1 . 1067 . . 159 PHE C . 17909 1 916 . 1 1 159 159 PHE CA C 13 56.964 0.2 . 1 . 546 . . 159 PHE CA . 17909 1 917 . 1 1 159 159 PHE CB C 13 41.744 0.2 . 1 . 547 . . 159 PHE CB . 17909 1 918 . 1 1 159 159 PHE N N 15 117.659 0.114 . 1 . 169 . . 159 PHE N . 17909 1 919 . 1 1 160 160 CYS H H 1 9.214 0.004 . 1 . 774 . . 160 CYS H . 17909 1 920 . 1 1 160 160 CYS C C 13 172.819 0.2 . 1 . 707 . . 160 CYS C . 17909 1 921 . 1 1 160 160 CYS CA C 13 57.615 0.2 . 1 . 973 . . 160 CYS CA . 17909 1 922 . 1 1 160 160 CYS CB C 13 28.020 0.2 . 1 . 972 . . 160 CYS CB . 17909 1 923 . 1 1 160 160 CYS N N 15 121.581 0.122 . 1 . 776 . . 160 CYS N . 17909 1 924 . 1 1 161 161 GLU H H 1 9.140 0.021 . 1 . 220 . . 161 GLU H . 17909 1 925 . 1 1 161 161 GLU HA H 1 5.005 0.05 . 1 . 1201 . . 161 GLU HA . 17909 1 926 . 1 1 161 161 GLU CA C 13 51.838 0.2 . 1 . 550 . . 161 GLU CA . 17909 1 927 . 1 1 161 161 GLU CB C 13 30.969 0.2 . 1 . 551 . . 161 GLU CB . 17909 1 928 . 1 1 161 161 GLU N N 15 122.913 0.218 . 1 . 219 . . 161 GLU N . 17909 1 929 . 1 1 162 162 PRO C C 13 176.267 0.2 . 1 . 793 . . 162 PRO C . 17909 1 930 . 1 1 162 162 PRO CA C 13 61.509 0.2 . 1 . 1027 . . 162 PRO CA . 17909 1 931 . 1 1 162 162 PRO CB C 13 31.725 0.2 . 1 . 1025 . . 162 PRO CB . 17909 1 932 . 1 1 162 162 PRO CG C 13 26.011 0.2 . 1 . 1026 . . 162 PRO CG . 17909 1 933 . 1 1 163 163 LEU H H 1 8.901 0.011 . 1 . 836 . . 163 LEU H . 17909 1 934 . 1 1 163 163 LEU HA H 1 4.714 0.05 . 1 . 1167 . . 163 LEU HA . 17909 1 935 . 1 1 163 163 LEU CA C 13 51.182 0.2 . 1 . 1024 . . 163 LEU CA . 17909 1 936 . 1 1 163 163 LEU CB C 13 41.902 0.2 . 1 . 1023 . . 163 LEU CB . 17909 1 937 . 1 1 163 163 LEU N N 15 124.720 0.093 . 1 . 837 . . 163 LEU N . 17909 1 938 . 1 1 164 164 PRO C C 13 178.357 0.2 . 1 . 968 . . 164 PRO C . 17909 1 939 . 1 1 164 164 PRO CA C 13 63.553 0.2 . 1 . 966 . . 164 PRO CA . 17909 1 940 . 1 1 164 164 PRO CB C 13 30.951 0.2 . 1 . 967 . . 164 PRO CB . 17909 1 941 . 1 1 165 165 GLY H H 1 9.100 0.023 . 1 . 23 . . 165 GLY H . 17909 1 942 . 1 1 165 165 GLY C C 13 173.809 0.2 . 1 . 852 . . 165 GLY C . 17909 1 943 . 1 1 165 165 GLY CA C 13 45.355 0.2 . 1 . 965 . . 165 GLY CA . 17909 1 944 . 1 1 165 165 GLY N N 15 115.757 0.168 . 1 . 22 . . 165 GLY N . 17909 1 945 . 1 1 166 166 GLU H H 1 7.502 0.002 . 1 . 563 . . 166 GLU H . 17909 1 946 . 1 1 166 166 GLU HA H 1 4.940 0.05 . 1 . 1202 . . 166 GLU HA . 17909 1 947 . 1 1 166 166 GLU CA C 13 52.757 0.2 . 1 . 565 . . 166 GLU CA . 17909 1 948 . 1 1 166 166 GLU CB C 13 29.951 0.2 . 1 . 562 . . 166 GLU CB . 17909 1 949 . 1 1 166 166 GLU N N 15 118.164 0.068 . 1 . 564 . . 166 GLU N . 17909 1 950 . 1 1 167 167 PRO C C 13 177.703 0.2 . 1 . 786 . . 167 PRO C . 17909 1 951 . 1 1 167 167 PRO CA C 13 63.861 0.2 . 1 . 616 . . 167 PRO CA . 17909 1 952 . 1 1 167 167 PRO CB C 13 31.826 0.2 . 1 . 615 . . 167 PRO CB . 17909 1 953 . 1 1 167 167 PRO CG C 13 26.680 0.2 . 1 . 902 . . 167 PRO CG . 17909 1 954 . 1 1 167 167 PRO CD C 13 50.140 0.2 . 1 . 903 . . 167 PRO CD . 17909 1 955 . 1 1 168 168 THR H H 1 7.741 0.015 . 1 . 269 . . 168 THR H . 17909 1 956 . 1 1 168 168 THR HA H 1 4.030 0.05 . 1 . 1075 . . 168 THR HA . 17909 1 957 . 1 1 168 168 THR C C 13 172.296 0.2 . 1 . 814 . . 168 THR C . 17909 1 958 . 1 1 168 168 THR CA C 13 60.446 0.2 . 1 . 405 . . 168 THR CA . 17909 1 959 . 1 1 168 168 THR CB C 13 67.880 0.2 . 1 . 406 . . 168 THR CB . 17909 1 960 . 1 1 168 168 THR CG2 C 13 21.474 0.2 . 1 . 904 . . 168 THR CG2 . 17909 1 961 . 1 1 168 168 THR N N 15 107.001 0.076 . 1 . 268 . . 168 THR N . 17909 1 962 . 1 1 169 169 LYS H H 1 7.285 0.009 . 1 . 65 . . 169 LYS H . 17909 1 963 . 1 1 169 169 LYS HA H 1 4.804 0.05 . 1 . 1185 . . 169 LYS HA . 17909 1 964 . 1 1 169 169 LYS C C 13 173.957 0.2 . 1 . 785 . . 169 LYS C . 17909 1 965 . 1 1 169 169 LYS CA C 13 55.143 0.2 . 1 . 407 . . 169 LYS CA . 17909 1 966 . 1 1 169 169 LYS CB C 13 36.930 0.2 . 1 . 408 . . 169 LYS CB . 17909 1 967 . 1 1 169 169 LYS CG C 13 25.126 0.2 . 1 . 905 . . 169 LYS CG . 17909 1 968 . 1 1 169 169 LYS CD C 13 29.344 0.2 . 1 . 906 . . 169 LYS CD . 17909 1 969 . 1 1 169 169 LYS CE C 13 41.654 0.2 . 1 . 907 . . 169 LYS CE . 17909 1 970 . 1 1 169 169 LYS N N 15 119.122 0.135 . 1 . 64 . . 169 LYS N . 17909 1 971 . 1 1 170 170 THR H H 1 8.594 0.011 . 1 . 148 . . 170 THR H . 17909 1 972 . 1 1 170 170 THR HA H 1 4.435 0.05 . 1 . 1158 . . 170 THR HA . 17909 1 973 . 1 1 170 170 THR C C 13 173.138 0.2 . 1 . 823 . . 170 THR C . 17909 1 974 . 1 1 170 170 THR CA C 13 61.657 0.2 . 1 . 409 . . 170 THR CA . 17909 1 975 . 1 1 170 170 THR CB C 13 72.635 0.2 . 1 . 410 . . 170 THR CB . 17909 1 976 . 1 1 170 170 THR CG2 C 13 20.652 0.2 . 1 . 908 . . 170 THR CG2 . 17909 1 977 . 1 1 170 170 THR N N 15 116.214 0.155 . 1 . 147 . . 170 THR N . 17909 1 978 . 1 1 171 171 ASN H H 1 9.146 0.019 . 1 . 96 . . 171 ASN H . 17909 1 979 . 1 1 171 171 ASN HA H 1 4.963 0.05 . 1 . 1204 . . 171 ASN HA . 17909 1 980 . 1 1 171 171 ASN C C 13 172.776 0.2 . 1 . 855 . . 171 ASN C . 17909 1 981 . 1 1 171 171 ASN CA C 13 53.224 0.2 . 1 . 412 . . 171 ASN CA . 17909 1 982 . 1 1 171 171 ASN CB C 13 40.262 0.2 . 1 . 411 . . 171 ASN CB . 17909 1 983 . 1 1 171 171 ASN N N 15 125.789 0.14 . 1 . 95 . . 171 ASN N . 17909 1 984 . 1 1 172 172 LEU H H 1 8.644 0.016 . 1 . 52 . . 172 LEU H . 17909 1 985 . 1 1 172 172 LEU HA H 1 5.541 0.05 . 1 . 1205 . . 172 LEU HA . 17909 1 986 . 1 1 172 172 LEU C C 13 177.122 0.2 . 1 . 857 . . 172 LEU C . 17909 1 987 . 1 1 172 172 LEU CA C 13 52.922 0.2 . 1 . 413 . . 172 LEU CA . 17909 1 988 . 1 1 172 172 LEU CB C 13 44.344 0.2 . 1 . 414 . . 172 LEU CB . 17909 1 989 . 1 1 172 172 LEU CG C 13 27.169 0.2 . 1 . 909 . . 172 LEU CG . 17909 1 990 . 1 1 172 172 LEU N N 15 128.481 0.102 . 1 . 51 . . 172 LEU N . 17909 1 991 . 1 1 173 173 VAL H H 1 9.260 0.01 . 1 . 416 . . 173 VAL H . 17909 1 992 . 1 1 173 173 VAL HA H 1 5.172 0.05 . 1 . 1206 . . 173 VAL HA . 17909 1 993 . 1 1 173 173 VAL C C 13 174.717 0.2 . 1 . 853 . . 173 VAL C . 17909 1 994 . 1 1 173 173 VAL CA C 13 60.365 0.2 . 1 . 415 . . 173 VAL CA . 17909 1 995 . 1 1 173 173 VAL CB C 13 33.510 0.2 . 1 . 417 . . 173 VAL CB . 17909 1 996 . 1 1 173 173 VAL CG1 C 13 20.881 0.2 . 1 . 910 . . 173 VAL CG1 . 17909 1 997 . 1 1 173 173 VAL CG2 C 13 20.881 0.2 . 1 . 911 . . 173 VAL CG2 . 17909 1 998 . 1 1 173 173 VAL N N 15 134.810 0.148 . 1 . 418 . . 173 VAL N . 17909 1 999 . 1 1 174 174 THR H H 1 8.982 0.001 . 1 . 503 . . 174 THR H . 17909 1 1000 . 1 1 174 174 THR C C 13 172.321 0.2 . 1 . 696 . . 174 THR C . 17909 1 1001 . 1 1 174 174 THR CA C 13 60.984 0.2 . 1 . 501 . . 174 THR CA . 17909 1 1002 . 1 1 174 174 THR CB C 13 71.012 0.2 . 1 . 504 . . 174 THR CB . 17909 1 1003 . 1 1 174 174 THR CG2 C 13 21.897 0.2 . 1 . 912 . . 174 THR CG2 . 17909 1 1004 . 1 1 174 174 THR N N 15 123.115 0.103 . 1 . 502 . . 174 THR N . 17909 1 1005 . 1 1 175 175 PHE H H 1 9.117 0.01 . 1 . 144 . . 175 PHE H . 17909 1 1006 . 1 1 175 175 PHE HA H 1 5.306 0.05 . 1 . 1207 . . 175 PHE HA . 17909 1 1007 . 1 1 175 175 PHE C C 13 176.312 0.2 . 1 . 913 . . 175 PHE C . 17909 1 1008 . 1 1 175 175 PHE CA C 13 56.746 0.2 . 1 . 500 . . 175 PHE CA . 17909 1 1009 . 1 1 175 175 PHE CB C 13 41.451 0.2 . 1 . 499 . . 175 PHE CB . 17909 1 1010 . 1 1 175 175 PHE N N 15 121.124 0.155 . 1 . 143 . . 175 PHE N . 17909 1 1011 . 1 1 176 176 PHE H H 1 8.943 0.015 . 1 . 35 . . 176 PHE H . 17909 1 1012 . 1 1 176 176 PHE C C 13 174.100 0.2 . 1 . 712 . . 176 PHE C . 17909 1 1013 . 1 1 176 176 PHE CA C 13 53.379 0.2 . 1 . 432 . . 176 PHE CA . 17909 1 1014 . 1 1 176 176 PHE CB C 13 38.821 0.2 . 1 . 433 . . 176 PHE CB . 17909 1 1015 . 1 1 176 176 PHE N N 15 123.608 0.136 . 1 . 34 . . 176 PHE N . 17909 1 1016 . 1 1 177 177 HIS H H 1 8.845 0.012 . 1 . 132 . . 177 HIS H . 17909 1 1017 . 1 1 177 177 HIS C C 13 173.321 0.2 . 1 . 846 . . 177 HIS C . 17909 1 1018 . 1 1 177 177 HIS CA C 13 52.572 0.2 . 1 . 498 . . 177 HIS CA . 17909 1 1019 . 1 1 177 177 HIS CB C 13 32.541 0.2 . 1 . 497 . . 177 HIS CB . 17909 1 1020 . 1 1 177 177 HIS N N 15 129.035 0.137 . 1 . 131 . . 177 HIS N . 17909 1 1021 . 1 1 178 178 THR H H 1 9.142 0.017 . 1 . 140 . . 178 THR H . 17909 1 1022 . 1 1 178 178 THR HA H 1 4.514 0.05 . 1 . 1130 . . 178 THR HA . 17909 1 1023 . 1 1 178 178 THR C C 13 173.389 0.2 . 1 . 1072 . . 178 THR C . 17909 1 1024 . 1 1 178 178 THR CA C 13 64.075 0.2 . 1 . 495 . . 178 THR CA . 17909 1 1025 . 1 1 178 178 THR CB C 13 72.481 0.2 . 1 . 496 . . 178 THR CB . 17909 1 1026 . 1 1 178 178 THR N N 15 119.843 0.079 . 1 . 139 . . 178 THR N . 17909 1 1027 . 1 1 179 179 ASP H H 1 8.890 0.008 . 1 . 1165 . . 179 ASP H . 17909 1 1028 . 1 1 179 179 ASP HA H 1 4.664 0.05 . 1 . 1232 . . 179 ASP HA . 17909 1 1029 . 1 1 179 179 ASP C C 13 175.904 0.2 . 1 . 697 . . 179 ASP C . 17909 1 1030 . 1 1 179 179 ASP CA C 13 51.797 0.2 . 1 . 494 . . 179 ASP CA . 17909 1 1031 . 1 1 179 179 ASP CB C 13 41.053 0.2 . 1 . 291 . . 179 ASP CB . 17909 1 1032 . 1 1 179 179 ASP N N 15 125.736 0.068 . 1 . 1164 . . 179 ASP N . 17909 1 1033 . 1 1 180 180 LEU H H 1 9.057 0.002 . 1 . 493 . . 180 LEU H . 17909 1 1034 . 1 1 180 180 LEU HA H 1 4.990 0.05 . 1 . 1203 . . 180 LEU HA . 17909 1 1035 . 1 1 180 180 LEU C C 13 177.132 0.2 . 1 . 725 . . 180 LEU C . 17909 1 1036 . 1 1 180 180 LEU CA C 13 55.853 0.2 . 1 . 491 . . 180 LEU CA . 17909 1 1037 . 1 1 180 180 LEU CB C 13 41.333 0.2 . 1 . 490 . . 180 LEU CB . 17909 1 1038 . 1 1 180 180 LEU CG C 13 25.840 0.2 . 1 . 914 . . 180 LEU CG . 17909 1 1039 . 1 1 180 180 LEU CD1 C 13 25.840 0.2 . 1 . 916 . . 180 LEU CD1 . 17909 1 1040 . 1 1 180 180 LEU CD2 C 13 25.840 0.2 . 1 . 915 . . 180 LEU CD2 . 17909 1 1041 . 1 1 180 180 LEU N N 15 125.537 0.027 . 1 . 492 . . 180 LEU N . 17909 1 1042 . 1 1 181 181 SER H H 1 8.537 0.011 . 1 . 200 . . 181 SER H . 17909 1 1043 . 1 1 181 181 SER HA H 1 4.147 0.05 . 1 . 1208 . . 181 SER HA . 17909 1 1044 . 1 1 181 181 SER C C 13 175.041 0.2 . 1 . 753 . . 181 SER C . 17909 1 1045 . 1 1 181 181 SER CA C 13 57.807 0.2 . 1 . 385 . . 181 SER CA . 17909 1 1046 . 1 1 181 181 SER CB C 13 62.690 0.2 . 1 . 384 . . 181 SER CB . 17909 1 1047 . 1 1 181 181 SER N N 15 109.902 0.165 . 1 . 199 . . 181 SER N . 17909 1 1048 . 1 1 182 182 GLY H H 1 8.203 0.01 . 1 . 77 . . 182 GLY H . 17909 1 1049 . 1 1 182 182 GLY HA2 H 1 3.620 0.05 . 1 . 1083 . . 182 GLY HA2 . 17909 1 1050 . 1 1 182 182 GLY HA3 H 1 3.620 0.05 . 1 . 1084 . . 182 GLY HA3 . 17909 1 1051 . 1 1 182 182 GLY C C 13 173.166 0.2 . 1 . 728 . . 182 GLY C . 17909 1 1052 . 1 1 182 182 GLY CA C 13 45.231 0.2 . 1 . 489 . . 182 GLY CA . 17909 1 1053 . 1 1 182 182 GLY N N 15 107.279 0.109 . 1 . 76 . . 182 GLY N . 17909 1 1054 . 1 1 183 183 TYR H H 1 8.190 0.001 . 1 . 488 . . 183 TYR H . 17909 1 1055 . 1 1 183 183 TYR C C 13 174.983 0.2 . 1 . 797 . . 183 TYR C . 17909 1 1056 . 1 1 183 183 TYR CA C 13 57.082 0.2 . 1 . 541 . . 183 TYR CA . 17909 1 1057 . 1 1 183 183 TYR CB C 13 37.660 0.2 . 1 . 466 . . 183 TYR CB . 17909 1 1058 . 1 1 183 183 TYR N N 15 120.224 0.066 . 1 . 540 . . 183 TYR N . 17909 1 1059 . 1 1 184 184 LEU H H 1 7.784 0.017 . 1 . 33 . . 184 LEU H . 17909 1 1060 . 1 1 184 184 LEU CA C 13 51.679 0.2 . 1 . 381 . . 184 LEU CA . 17909 1 1061 . 1 1 184 184 LEU CB C 13 43.524 0.2 . 1 . 380 . . 184 LEU CB . 17909 1 1062 . 1 1 184 184 LEU N N 15 125.198 0.199 . 1 . 32 . . 184 LEU N . 17909 1 1063 . 1 1 185 185 PRO C C 13 178.178 0.2 . 1 . 840 . . 185 PRO C . 17909 1 1064 . 1 1 185 185 PRO CA C 13 61.740 0.2 . 1 . 921 . . 185 PRO CA . 17909 1 1065 . 1 1 185 185 PRO CB C 13 31.337 0.2 . 1 . 920 . . 185 PRO CB . 17909 1 1066 . 1 1 186 186 GLN H H 1 8.809 0.027 . 1 . 283 . . 186 GLN H . 17909 1 1067 . 1 1 186 186 GLN C C 13 176.956 0.2 . 1 . 838 . . 186 GLN C . 17909 1 1068 . 1 1 186 186 GLN CA C 13 58.316 0.2 . 1 . 919 . . 186 GLN CA . 17909 1 1069 . 1 1 186 186 GLN CB C 13 27.766 0.2 . 1 . 918 . . 186 GLN CB . 17909 1 1070 . 1 1 186 186 GLN CG C 13 32.740 0.2 . 1 . 917 . . 186 GLN CG . 17909 1 1071 . 1 1 186 186 GLN N N 15 125.548 0.21 . 1 . 282 . . 186 GLN N . 17909 1 1072 . 1 1 187 187 ASN H H 1 8.633 0.005 . 1 . 238 . . 187 ASN H . 17909 1 1073 . 1 1 187 187 ASN C C 13 177.706 0.2 . 1 . 758 . . 187 ASN C . 17909 1 1074 . 1 1 187 187 ASN CA C 13 55.657 0.2 . 1 . 588 . . 187 ASN CA . 17909 1 1075 . 1 1 187 187 ASN CB C 13 36.580 0.2 . 1 . 587 . . 187 ASN CB . 17909 1 1076 . 1 1 187 187 ASN N N 15 112.869 0.102 . 1 . 237 . . 187 ASN N . 17909 1 1077 . 1 1 188 188 VAL H H 1 7.126 0.013 . 1 . 277 . . 188 VAL H . 17909 1 1078 . 1 1 188 188 VAL HA H 1 3.440 0.05 . 1 . 1209 . . 188 VAL HA . 17909 1 1079 . 1 1 188 188 VAL C C 13 177.706 0.2 . 1 . 924 . . 188 VAL C . 17909 1 1080 . 1 1 188 188 VAL CA C 13 64.877 0.021 . 1 . 590 . . 188 VAL CA . 17909 1 1081 . 1 1 188 188 VAL CB C 13 31.529 0.2 . 1 . 589 . . 188 VAL CB . 17909 1 1082 . 1 1 188 188 VAL CG1 C 13 21.306 0.2 . 1 . 922 . . 188 VAL CG1 . 17909 1 1083 . 1 1 188 188 VAL CG2 C 13 21.306 0.2 . 1 . 923 . . 188 VAL CG2 . 17909 1 1084 . 1 1 188 188 VAL N N 15 120.624 0.113 . 1 . 276 . . 188 VAL N . 17909 1 1085 . 1 1 189 189 VAL H H 1 7.133 0.013 . 1 . 592 . . 189 VAL H . 17909 1 1086 . 1 1 189 189 VAL HA H 1 3.440 0.05 . 1 . 1210 . . 189 VAL HA . 17909 1 1087 . 1 1 189 189 VAL C C 13 177.268 0.2 . 1 . 689 . . 189 VAL C . 17909 1 1088 . 1 1 189 189 VAL CA C 13 66.802 0.2 . 1 . 594 . . 189 VAL CA . 17909 1 1089 . 1 1 189 189 VAL CB C 13 31.529 0.2 . 1 . 591 . . 189 VAL CB . 17909 1 1090 . 1 1 189 189 VAL CG1 C 13 22.470 0.2 . 1 . 925 . . 189 VAL CG1 . 17909 1 1091 . 1 1 189 189 VAL CG2 C 13 22.470 0.2 . 1 . 926 . . 189 VAL CG2 . 17909 1 1092 . 1 1 189 189 VAL N N 15 120.604 0.096 . 1 . 593 . . 189 VAL N . 17909 1 1093 . 1 1 190 190 ASP H H 1 8.514 0.022 . 1 . 178 . . 190 ASP H . 17909 1 1094 . 1 1 190 190 ASP HA H 1 4.316 0.05 . 1 . 1176 . . 190 ASP HA . 17909 1 1095 . 1 1 190 190 ASP C C 13 178.535 0.2 . 1 . 791 . . 190 ASP C . 17909 1 1096 . 1 1 190 190 ASP CA C 13 56.076 0.2 . 1 . 403 . . 190 ASP CA . 17909 1 1097 . 1 1 190 190 ASP CB C 13 39.498 0.2 . 1 . 402 . . 190 ASP CB . 17909 1 1098 . 1 1 190 190 ASP N N 15 116.481 0.162 . 1 . 177 . . 190 ASP N . 17909 1 1099 . 1 1 191 191 SER H H 1 7.240 0.021 . 1 . 253 . . 191 SER H . 17909 1 1100 . 1 1 191 191 SER HA H 1 4.422 0.05 . 1 . 1211 . . 191 SER HA . 17909 1 1101 . 1 1 191 191 SER C C 13 175.694 0.2 . 1 . 808 . . 191 SER C . 17909 1 1102 . 1 1 191 191 SER CA C 13 59.346 0.2 . 1 . 400 . . 191 SER CA . 17909 1 1103 . 1 1 191 191 SER CB C 13 63.302 0.2 . 1 . 401 . . 191 SER CB . 17909 1 1104 . 1 1 191 191 SER N N 15 110.898 0.157 . 1 . 252 . . 191 SER N . 17909 1 1105 . 1 1 192 192 PHE H H 1 7.858 0.011 . 1 . 243 . . 192 PHE H . 17909 1 1106 . 1 1 192 192 PHE HA H 1 4.163 0.05 . 1 . 1212 . . 192 PHE HA . 17909 1 1107 . 1 1 192 192 PHE CA C 13 60.011 0.2 . 1 . 398 . . 192 PHE CA . 17909 1 1108 . 1 1 192 192 PHE CB C 13 39.259 0.2 . 1 . 399 . . 192 PHE CB . 17909 1 1109 . 1 1 192 192 PHE N N 15 123.017 0.172 . 1 . 242 . . 192 PHE N . 17909 1 1110 . 1 1 194 194 PRO C C 13 178.164 0.2 . 1 . 721 . . 194 PRO C . 17909 1 1111 . 1 1 194 194 PRO CA C 13 65.929 0.2 . 1 . 684 . . 194 PRO CA . 17909 1 1112 . 1 1 194 194 PRO CB C 13 29.367 0.2 . 1 . 685 . . 194 PRO CB . 17909 1 1113 . 1 1 194 194 PRO CG C 13 26.781 0.2 . 1 . 927 . . 194 PRO CG . 17909 1 1114 . 1 1 194 194 PRO CD C 13 53.221 0.2 . 1 . 928 . . 194 PRO CD . 17909 1 1115 . 1 1 195 195 ARG H H 1 6.524 0.023 . 1 . 240 . . 195 ARG H . 17909 1 1116 . 1 1 195 195 ARG C C 13 178.003 0.2 . 1 . 854 . . 195 ARG C . 17909 1 1117 . 1 1 195 195 ARG CA C 13 58.457 0.2 . 1 . 569 . . 195 ARG CA . 17909 1 1118 . 1 1 195 195 ARG CB C 13 29.367 0.2 . 1 . 568 . . 195 ARG CB . 17909 1 1119 . 1 1 195 195 ARG CG C 13 27.514 0.2 . 1 . 929 . . 195 ARG CG . 17909 1 1120 . 1 1 195 195 ARG CD C 13 42.799 0.2 . 1 . 930 . . 195 ARG CD . 17909 1 1121 . 1 1 195 195 ARG N N 15 116.108 0.112 . 1 . 239 . . 195 ARG N . 17909 1 1122 . 1 1 196 196 SER H H 1 8.207 0.011 . 1 . 182 . . 196 SER H . 17909 1 1123 . 1 1 196 196 SER HA H 1 4.034 0.05 . 1 . 1213 . . 196 SER HA . 17909 1 1124 . 1 1 196 196 SER C C 13 177.496 0.2 . 1 . 686 . . 196 SER C . 17909 1 1125 . 1 1 196 196 SER CA C 13 60.292 0.2 . 1 . 566 . . 196 SER CA . 17909 1 1126 . 1 1 196 196 SER CB C 13 61.921 0.2 . 1 . 567 . . 196 SER CB . 17909 1 1127 . 1 1 196 196 SER N N 15 115.177 0.15 . 1 . 181 . . 196 SER N . 17909 1 1128 . 1 1 197 197 MET H H 1 8.221 0.005 . 1 . 584 . . 197 MET H . 17909 1 1129 . 1 1 197 197 MET HA H 1 4.151 0.05 . 1 . 1126 . . 197 MET HA . 17909 1 1130 . 1 1 197 197 MET C C 13 177.853 0.2 . 1 . 771 . . 197 MET C . 17909 1 1131 . 1 1 197 197 MET CA C 13 58.528 0.2 . 1 . 586 . . 197 MET CA . 17909 1 1132 . 1 1 197 197 MET CB C 13 30.960 0.2 . 1 . 583 . . 197 MET CB . 17909 1 1133 . 1 1 197 197 MET N N 15 121.250 0.1 . 1 . 585 . . 197 MET N . 17909 1 1134 . 1 1 198 198 THR H H 1 7.978 0.012 . 1 . 126 . . 198 THR H . 17909 1 1135 . 1 1 198 198 THR C C 13 178.015 0.2 . 1 . 722 . . 198 THR C . 17909 1 1136 . 1 1 198 198 THR CA C 13 66.226 0.2 . 1 . 932 . . 198 THR CA . 17909 1 1137 . 1 1 198 198 THR CB C 13 67.750 0.2 . 1 . 995 . . 198 THR CB . 17909 1 1138 . 1 1 198 198 THR CG2 C 13 21.695 0.2 . 1 . 934 . . 198 THR CG2 . 17909 1 1139 . 1 1 198 198 THR N N 15 112.444 0.122 . 1 . 125 . . 198 THR N . 17909 1 1140 . 1 1 199 199 ARG H H 1 8.137 0.003 . 1 . 935 . . 199 ARG H . 17909 1 1141 . 1 1 199 199 ARG C C 13 176.928 0.2 . 1 . 1068 . . 199 ARG C . 17909 1 1142 . 1 1 199 199 ARG CA C 13 58.657 0.2 . 1 . 970 . . 199 ARG CA . 17909 1 1143 . 1 1 199 199 ARG CB C 13 29.235 0.2 . 1 . 933 . . 199 ARG CB . 17909 1 1144 . 1 1 199 199 ARG CG C 13 27.033 0.2 . 1 . 993 . . 199 ARG CG . 17909 1 1145 . 1 1 199 199 ARG CD C 13 42.380 0.2 . 1 . 994 . . 199 ARG CD . 17909 1 1146 . 1 1 199 199 ARG N N 15 122.983 0.015 . 1 . 936 . . 199 ARG N . 17909 1 1147 . 1 1 200 200 PHE H H 1 8.185 0.002 . 1 . 989 . . 200 PHE H . 17909 1 1148 . 1 1 200 200 PHE HA H 1 4.149 0.05 . 1 . 1214 . . 200 PHE HA . 17909 1 1149 . 1 1 200 200 PHE C C 13 176.740 0.2 . 1 . 739 . . 200 PHE C . 17909 1 1150 . 1 1 200 200 PHE CA C 13 60.938 0.2 . 1 . 990 . . 200 PHE CA . 17909 1 1151 . 1 1 200 200 PHE CB C 13 38.535 0.2 . 1 . 992 . . 200 PHE CB . 17909 1 1152 . 1 1 200 200 PHE N N 15 122.188 0.095 . 1 . 991 . . 200 PHE N . 17909 1 1153 . 1 1 201 201 TYR H H 1 7.698 0.001 . 1 . 372 . . 201 TYR H . 17909 1 1154 . 1 1 201 201 TYR HA H 1 4.159 0.05 . 1 . 1216 . . 201 TYR HA . 17909 1 1155 . 1 1 201 201 TYR C C 13 178.348 0.2 . 1 . 735 . . 201 TYR C . 17909 1 1156 . 1 1 201 201 TYR CA C 13 62.644 0.2 . 1 . 371 . . 201 TYR CA . 17909 1 1157 . 1 1 201 201 TYR CB C 13 38.529 0.2 . 1 . 373 . . 201 TYR CB . 17909 1 1158 . 1 1 201 201 TYR N N 15 116.329 0.054 . 1 . 374 . . 201 TYR N . 17909 1 1159 . 1 1 202 202 ALA H H 1 7.774 0.02 . 1 . 249 . . 202 ALA H . 17909 1 1160 . 1 1 202 202 ALA HA H 1 4.095 0.05 . 1 . 1215 . . 202 ALA HA . 17909 1 1161 . 1 1 202 202 ALA C C 13 181.033 0.2 . 1 . 716 . . 202 ALA C . 17909 1 1162 . 1 1 202 202 ALA CA C 13 54.938 0.2 . 1 . 370 . . 202 ALA CA . 17909 1 1163 . 1 1 202 202 ALA CB C 13 17.814 0.2 . 1 . 369 . . 202 ALA CB . 17909 1 1164 . 1 1 202 202 ALA N N 15 121.494 0.184 . 1 . 248 . . 202 ALA N . 17909 1 1165 . 1 1 203 203 ASN H H 1 9.023 0.02 . 1 . 194 . . 203 ASN H . 17909 1 1166 . 1 1 203 203 ASN HA H 1 4.490 0.05 . 1 . 1217 . . 203 ASN HA . 17909 1 1167 . 1 1 203 203 ASN CA C 13 54.774 0.2 . 1 . 581 . . 203 ASN CA . 17909 1 1168 . 1 1 203 203 ASN CB C 13 37.295 0.2 . 1 . 582 . . 203 ASN CB . 17909 1 1169 . 1 1 203 203 ASN N N 15 118.032 0.123 . 1 . 193 . . 203 ASN N . 17909 1 1170 . 1 1 204 204 LEU C C 13 177.498 0.2 . 1 . 833 . . 204 LEU C . 17909 1 1171 . 1 1 204 204 LEU CA C 13 56.816 0.2 . 1 . 1011 . . 204 LEU CA . 17909 1 1172 . 1 1 204 204 LEU CB C 13 39.342 0.2 . 1 . 1007 . . 204 LEU CB . 17909 1 1173 . 1 1 204 204 LEU CG C 13 27.341 0.2 . 1 . 1010 . . 204 LEU CG . 17909 1 1174 . 1 1 204 204 LEU CD1 C 13 22.884 0.2 . 1 . 1009 . . 204 LEU CD1 . 17909 1 1175 . 1 1 204 204 LEU CD2 C 13 22.884 0.2 . 1 . 1008 . . 204 LEU CD2 . 17909 1 1176 . 1 1 205 205 GLN H H 1 7.808 0.003 . 1 . 939 . . 205 GLN H . 17909 1 1177 . 1 1 205 205 GLN HA H 1 4.265 0.05 . 1 . 1218 . . 205 GLN HA . 17909 1 1178 . 1 1 205 205 GLN C C 13 179.089 0.2 . 1 . 784 . . 205 GLN C . 17909 1 1179 . 1 1 205 205 GLN CA C 13 57.375 0.2 . 1 . 940 . . 205 GLN CA . 17909 1 1180 . 1 1 205 205 GLN CB C 13 28.455 0.2 . 1 . 938 . . 205 GLN CB . 17909 1 1181 . 1 1 205 205 GLN CG C 13 33.468 0.2 . 1 . 944 . . 205 GLN CG . 17909 1 1182 . 1 1 205 205 GLN N N 15 116.363 0.047 . 1 . 937 . . 205 GLN N . 17909 1 1183 . 1 1 206 206 LYS H H 1 7.106 0.012 . 1 . 5 . . 206 LYS H . 17909 1 1184 . 1 1 206 206 LYS HA H 1 3.892 0.05 . 1 . 1219 . . 206 LYS HA . 17909 1 1185 . 1 1 206 206 LYS C C 13 177.972 0.2 . 1 . 826 . . 206 LYS C . 17909 1 1186 . 1 1 206 206 LYS CA C 13 58.507 0.2 . 1 . 506 . . 206 LYS CA . 17909 1 1187 . 1 1 206 206 LYS CB C 13 31.768 0.2 . 1 . 505 . . 206 LYS CB . 17909 1 1188 . 1 1 206 206 LYS CG C 13 24.693 0.2 . 1 . 941 . . 206 LYS CG . 17909 1 1189 . 1 1 206 206 LYS CD C 13 28.789 0.2 . 1 . 942 . . 206 LYS CD . 17909 1 1190 . 1 1 206 206 LYS CE C 13 41.749 0.2 . 1 . 943 . . 206 LYS CE . 17909 1 1191 . 1 1 206 206 LYS N N 15 117.564 0.14 . 1 . 4 . . 206 LYS N . 17909 1 1192 . 1 1 207 207 ALA H H 1 7.652 0.027 . 1 . 146 . . 207 ALA H . 17909 1 1193 . 1 1 207 207 ALA HA H 1 3.791 0.05 . 1 . 1220 . . 207 ALA HA . 17909 1 1194 . 1 1 207 207 ALA C C 13 179.399 0.2 . 1 . 842 . . 207 ALA C . 17909 1 1195 . 1 1 207 207 ALA CA C 13 54.326 0.2 . 1 . 368 . . 207 ALA CA . 17909 1 1196 . 1 1 207 207 ALA CB C 13 17.472 0.2 . 1 . 507 . . 207 ALA CB . 17909 1 1197 . 1 1 207 207 ALA N N 15 123.592 0.122 . 1 . 145 . . 207 ALA N . 17909 1 1198 . 1 1 208 208 VAL H H 1 8.222 0.021 . 1 . 218 . . 208 VAL H . 17909 1 1199 . 1 1 208 208 VAL HA H 1 3.433 0.05 . 1 . 1221 . . 208 VAL HA . 17909 1 1200 . 1 1 208 208 VAL C C 13 177.960 0.2 . 1 . 718 . . 208 VAL C . 17909 1 1201 . 1 1 208 208 VAL CA C 13 65.286 0.2 . 1 . 356 . . 208 VAL CA . 17909 1 1202 . 1 1 208 208 VAL CB C 13 31.205 0.2 . 1 . 357 . . 208 VAL CB . 17909 1 1203 . 1 1 208 208 VAL CG1 C 13 21.601 0.2 . 1 . 1002 . . 208 VAL CG1 . 17909 1 1204 . 1 1 208 208 VAL CG2 C 13 21.601 0.2 . 1 . 1001 . . 208 VAL CG2 . 17909 1 1205 . 1 1 208 208 VAL N N 15 116.923 0.094 . 1 . 217 . . 208 VAL N . 17909 1 1206 . 1 1 209 209 LYS H H 1 6.948 0.004 . 1 . 717 . . 209 LYS H . 17909 1 1207 . 1 1 209 209 LYS HA H 1 3.933 0.05 . 1 . 1222 . . 209 LYS HA . 17909 1 1208 . 1 1 209 209 LYS C C 13 178.306 0.2 . 1 . 747 . . 209 LYS C . 17909 1 1209 . 1 1 209 209 LYS CA C 13 58.281 0.2 . 1 . 969 . . 209 LYS CA . 17909 1 1210 . 1 1 209 209 LYS CB C 13 31.624 0.2 . 1 . 971 . . 209 LYS CB . 17909 1 1211 . 1 1 209 209 LYS CG C 13 24.852 0.2 . 1 . 1003 . . 209 LYS CG . 17909 1 1212 . 1 1 209 209 LYS CD C 13 28.545 0.2 . 1 . 1004 . . 209 LYS CD . 17909 1 1213 . 1 1 209 209 LYS CE C 13 41.771 0.2 . 1 . 1005 . . 209 LYS CE . 17909 1 1214 . 1 1 209 209 LYS N N 15 117.959 0.109 . 1 . 719 . . 209 LYS N . 17909 1 1215 . 1 1 210 210 GLN H H 1 7.755 0.018 . 1 . 192 . . 210 GLN H . 17909 1 1216 . 1 1 210 210 GLN HA H 1 3.970 0.05 . 1 . 1174 . . 210 GLN HA . 17909 1 1217 . 1 1 210 210 GLN C C 13 178.022 0.2 . 1 . 729 . . 210 GLN C . 17909 1 1218 . 1 1 210 210 GLN CA C 13 57.625 0.2 . 1 . 548 . . 210 GLN CA . 17909 1 1219 . 1 1 210 210 GLN CB C 13 27.883 0.2 . 1 . 549 . . 210 GLN CB . 17909 1 1220 . 1 1 210 210 GLN CG C 13 33.456 0.2 . 1 . 1006 . . 210 GLN CG . 17909 1 1221 . 1 1 210 210 GLN N N 15 118.291 0.14 . 1 . 191 . . 210 GLN N . 17909 1 1222 . 1 1 211 211 PHE H H 1 8.041 0.001 . 1 . 648 . . 211 PHE H . 17909 1 1223 . 1 1 211 211 PHE HA H 1 4.358 0.05 . 1 . 1182 . . 211 PHE HA . 17909 1 1224 . 1 1 211 211 PHE C C 13 176.355 0.2 . 1 . 835 . . 211 PHE C . 17909 1 1225 . 1 1 211 211 PHE CA C 13 58.294 0.2 . 1 . 649 . . 211 PHE CA . 17909 1 1226 . 1 1 211 211 PHE CB C 13 38.419 0.2 . 1 . 646 . . 211 PHE CB . 17909 1 1227 . 1 1 211 211 PHE N N 15 116.285 0.019 . 1 . 647 . . 211 PHE N . 17909 1 1228 . 1 1 212 212 HIS H H 1 7.645 0.008 . 1 . 652 . . 212 HIS H . 17909 1 1229 . 1 1 212 212 HIS HA H 1 4.131 0.05 . 1 . 1142 . . 212 HIS HA . 17909 1 1230 . 1 1 212 212 HIS C C 13 175.444 0.2 . 1 . 821 . . 212 HIS C . 17909 1 1231 . 1 1 212 212 HIS CA C 13 57.101 0.2 . 1 . 653 . . 212 HIS CA . 17909 1 1232 . 1 1 212 212 HIS CB C 13 28.953 0.2 . 1 . 650 . . 212 HIS CB . 17909 1 1233 . 1 1 212 212 HIS N N 15 117.446 0.062 . 1 . 651 . . 212 HIS N . 17909 1 1234 . 1 1 213 213 GLU H H 1 7.952 0.026 . 1 . 655 . . 213 GLU H . 17909 1 1235 . 1 1 213 213 GLU HA H 1 3.984 0.05 . 1 . 1172 . . 213 GLU HA . 17909 1 1236 . 1 1 213 213 GLU C C 13 176.564 0.2 . 1 . 1000 . . 213 GLU C . 17909 1 1237 . 1 1 213 213 GLU CA C 13 56.924 0.2 . 1 . 656 . . 213 GLU CA . 17909 1 1238 . 1 1 213 213 GLU CB C 13 29.186 0.2 . 1 . 654 . . 213 GLU CB . 17909 1 1239 . 1 1 213 213 GLU N N 15 119.706 0.22 . 1 . 84 . . 213 GLU N . 17909 1 stop_ save_