data_18647 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18647 _Entry.Title ; 1H, 13C, and 15N backbone resonance assignments of the L124D mutant of StAR-related lipid transfer domain protein 4 (StARD4) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-08-07 _Entry.Accession_date 2012-08-07 _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 Igor Dikiy . . . 18647 2 Trudy Ramlall . F. . 18647 3 David Eliezer . . . 18647 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18647 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 619 18647 '15N chemical shifts' 200 18647 '1H chemical shifts' 524 18647 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 . . 2014-02-19 2012-08-07 update BMRB 'update entry citation' 18647 1 . . 2012-10-18 2012-08-07 original author 'original release' 18647 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18647 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22918595 _Citation.Full_citation . _Citation.Title '1H, 13C, and 15N backbone resonance assignments of the L124D mutant of StAR-related lipid transfer domain protein 4 (StARD4).' _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 2 _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 245 _Citation.Page_last 248 _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 Igor Dikiy . . . 18647 1 2 Trudy Ramlall . F. . 18647 1 3 David Eliezer . . . 18647 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID cholesterol 18647 1 StARD4 18647 1 'START domain' 18647 1 'sterol transport' 18647 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18647 _Assembly.ID 1 _Assembly.Name mStARD4L124D _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _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 mStARD4L124D 1 $mStARD4L124D A . yes native no no . . . 18647 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_mStARD4L124D _Entity.Sf_category entity _Entity.Sf_framecode mStARD4L124D _Entity.Entry_ID 18647 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name mStARD4L124D _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MADPESPWSQIGRKIKLEGL SDVASISTKLQNTLIQYHSI KEDEWRVAKKVKDVTVWRKP SEEFNGYLYKAQGVMDDVVN NVIDHIRPGPWRLDWDRLMT SLDVLEHFEENCCVMRYTTA GQLDNIISPREFVDFSYTVG YEEGLLSCGVSVEWSETRPE FVRGYNHPCGWFCVPLKDSP SQSLLTGYIQTDLRGMIPQS AVDTAMASTLANFYSDLRKG LRKA ; _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 224 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation L124D _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1JSS . "Crystal Structure Of The Mus Musculus Cholesterol-Regulated Start Protein 4 (Stard4)." . . . . . 100.00 224 98.66 99.11 4.06e-163 . . . . 18647 1 2 no PDB 5BRL . "Crystal Structure Of L124d Stard4" . . . . . 93.75 210 100.00 100.00 2.80e-154 . . . . 18647 1 3 no DBJ BAC31233 . "unnamed protein product [Mus musculus]" . . . . . 100.00 224 98.66 99.11 4.06e-163 . . . . 18647 1 4 no DBJ BAC31335 . "unnamed protein product [Mus musculus]" . . . . . 100.00 224 98.66 99.11 4.06e-163 . . . . 18647 1 5 no DBJ BAC35805 . "unnamed protein product [Mus musculus]" . . . . . 100.00 224 98.66 99.11 4.06e-163 . . . . 18647 1 6 no DBJ BAC37423 . "unnamed protein product [Mus musculus]" . . . . . 100.00 224 98.66 99.11 4.06e-163 . . . . 18647 1 7 no DBJ BAC39424 . "unnamed protein product [Mus musculus]" . . . . . 100.00 224 98.66 99.11 4.06e-163 . . . . 18647 1 8 no GB AAH05642 . "StAR-related lipid transfer (START) domain containing 4 [Mus musculus]" . . . . . 100.00 224 99.55 99.55 2.87e-164 . . . . 18647 1 9 no GB AAL87127 . "StAR-related lipid transfer protein 4 [Mus musculus]" . . . . . 100.00 224 98.66 99.11 4.06e-163 . . . . 18647 1 10 no GB AAL87128 . "StAR-related lipid transfer protein 4 [Mus musculus]" . . . . . 100.00 224 99.55 99.55 2.87e-164 . . . . 18647 1 11 no GB EDK97071 . "StAR-related lipid transfer (START) domain containing 4 [Mus musculus]" . . . . . 100.00 224 98.21 98.66 2.05e-162 . . . . 18647 1 12 no REF NP_598535 . "stAR-related lipid transfer protein 4 [Mus musculus]" . . . . . 100.00 224 98.66 99.11 4.06e-163 . . . . 18647 1 13 no SP Q99JV5 . "RecName: Full=StAR-related lipid transfer protein 4; AltName: Full=START domain-containing protein 4; Short=StARD4" . . . . . 100.00 224 99.55 99.55 2.87e-164 . . . . 18647 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 . 18647 1 2 . ALA . 18647 1 3 . ASP . 18647 1 4 . PRO . 18647 1 5 . GLU . 18647 1 6 . SER . 18647 1 7 . PRO . 18647 1 8 . TRP . 18647 1 9 . SER . 18647 1 10 . GLN . 18647 1 11 . ILE . 18647 1 12 . GLY . 18647 1 13 . ARG . 18647 1 14 . LYS . 18647 1 15 . ILE . 18647 1 16 . LYS . 18647 1 17 . LEU . 18647 1 18 . GLU . 18647 1 19 . GLY . 18647 1 20 . LEU . 18647 1 21 . SER . 18647 1 22 . ASP . 18647 1 23 . VAL . 18647 1 24 . ALA . 18647 1 25 . SER . 18647 1 26 . ILE . 18647 1 27 . SER . 18647 1 28 . THR . 18647 1 29 . LYS . 18647 1 30 . LEU . 18647 1 31 . GLN . 18647 1 32 . ASN . 18647 1 33 . THR . 18647 1 34 . LEU . 18647 1 35 . ILE . 18647 1 36 . GLN . 18647 1 37 . TYR . 18647 1 38 . HIS . 18647 1 39 . SER . 18647 1 40 . ILE . 18647 1 41 . LYS . 18647 1 42 . GLU . 18647 1 43 . ASP . 18647 1 44 . GLU . 18647 1 45 . TRP . 18647 1 46 . ARG . 18647 1 47 . VAL . 18647 1 48 . ALA . 18647 1 49 . LYS . 18647 1 50 . LYS . 18647 1 51 . VAL . 18647 1 52 . LYS . 18647 1 53 . ASP . 18647 1 54 . VAL . 18647 1 55 . THR . 18647 1 56 . VAL . 18647 1 57 . TRP . 18647 1 58 . ARG . 18647 1 59 . LYS . 18647 1 60 . PRO . 18647 1 61 . SER . 18647 1 62 . GLU . 18647 1 63 . GLU . 18647 1 64 . PHE . 18647 1 65 . ASN . 18647 1 66 . GLY . 18647 1 67 . TYR . 18647 1 68 . LEU . 18647 1 69 . TYR . 18647 1 70 . LYS . 18647 1 71 . ALA . 18647 1 72 . GLN . 18647 1 73 . GLY . 18647 1 74 . VAL . 18647 1 75 . MET . 18647 1 76 . ASP . 18647 1 77 . ASP . 18647 1 78 . VAL . 18647 1 79 . VAL . 18647 1 80 . ASN . 18647 1 81 . ASN . 18647 1 82 . VAL . 18647 1 83 . ILE . 18647 1 84 . ASP . 18647 1 85 . HIS . 18647 1 86 . ILE . 18647 1 87 . ARG . 18647 1 88 . PRO . 18647 1 89 . GLY . 18647 1 90 . PRO . 18647 1 91 . TRP . 18647 1 92 . ARG . 18647 1 93 . LEU . 18647 1 94 . ASP . 18647 1 95 . TRP . 18647 1 96 . ASP . 18647 1 97 . ARG . 18647 1 98 . LEU . 18647 1 99 . MET . 18647 1 100 . THR . 18647 1 101 . SER . 18647 1 102 . LEU . 18647 1 103 . ASP . 18647 1 104 . VAL . 18647 1 105 . LEU . 18647 1 106 . GLU . 18647 1 107 . HIS . 18647 1 108 . PHE . 18647 1 109 . GLU . 18647 1 110 . GLU . 18647 1 111 . ASN . 18647 1 112 . CYS . 18647 1 113 . CYS . 18647 1 114 . VAL . 18647 1 115 . MET . 18647 1 116 . ARG . 18647 1 117 . TYR . 18647 1 118 . THR . 18647 1 119 . THR . 18647 1 120 . ALA . 18647 1 121 . GLY . 18647 1 122 . GLN . 18647 1 123 . LEU . 18647 1 124 . ASP . 18647 1 125 . ASN . 18647 1 126 . ILE . 18647 1 127 . ILE . 18647 1 128 . SER . 18647 1 129 . PRO . 18647 1 130 . ARG . 18647 1 131 . GLU . 18647 1 132 . PHE . 18647 1 133 . VAL . 18647 1 134 . ASP . 18647 1 135 . PHE . 18647 1 136 . SER . 18647 1 137 . TYR . 18647 1 138 . THR . 18647 1 139 . VAL . 18647 1 140 . GLY . 18647 1 141 . TYR . 18647 1 142 . GLU . 18647 1 143 . GLU . 18647 1 144 . GLY . 18647 1 145 . LEU . 18647 1 146 . LEU . 18647 1 147 . SER . 18647 1 148 . CYS . 18647 1 149 . GLY . 18647 1 150 . VAL . 18647 1 151 . SER . 18647 1 152 . VAL . 18647 1 153 . GLU . 18647 1 154 . TRP . 18647 1 155 . SER . 18647 1 156 . GLU . 18647 1 157 . THR . 18647 1 158 . ARG . 18647 1 159 . PRO . 18647 1 160 . GLU . 18647 1 161 . PHE . 18647 1 162 . VAL . 18647 1 163 . ARG . 18647 1 164 . GLY . 18647 1 165 . TYR . 18647 1 166 . ASN . 18647 1 167 . HIS . 18647 1 168 . PRO . 18647 1 169 . CYS . 18647 1 170 . GLY . 18647 1 171 . TRP . 18647 1 172 . PHE . 18647 1 173 . CYS . 18647 1 174 . VAL . 18647 1 175 . PRO . 18647 1 176 . LEU . 18647 1 177 . LYS . 18647 1 178 . ASP . 18647 1 179 . SER . 18647 1 180 . PRO . 18647 1 181 . SER . 18647 1 182 . GLN . 18647 1 183 . SER . 18647 1 184 . LEU . 18647 1 185 . LEU . 18647 1 186 . THR . 18647 1 187 . GLY . 18647 1 188 . TYR . 18647 1 189 . ILE . 18647 1 190 . GLN . 18647 1 191 . THR . 18647 1 192 . ASP . 18647 1 193 . LEU . 18647 1 194 . ARG . 18647 1 195 . GLY . 18647 1 196 . MET . 18647 1 197 . ILE . 18647 1 198 . PRO . 18647 1 199 . GLN . 18647 1 200 . SER . 18647 1 201 . ALA . 18647 1 202 . VAL . 18647 1 203 . ASP . 18647 1 204 . THR . 18647 1 205 . ALA . 18647 1 206 . MET . 18647 1 207 . ALA . 18647 1 208 . SER . 18647 1 209 . THR . 18647 1 210 . LEU . 18647 1 211 . ALA . 18647 1 212 . ASN . 18647 1 213 . PHE . 18647 1 214 . TYR . 18647 1 215 . SER . 18647 1 216 . ASP . 18647 1 217 . LEU . 18647 1 218 . ARG . 18647 1 219 . LYS . 18647 1 220 . GLY . 18647 1 221 . LEU . 18647 1 222 . ARG . 18647 1 223 . LYS . 18647 1 224 . ALA . 18647 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 18647 1 . ALA 2 2 18647 1 . ASP 3 3 18647 1 . PRO 4 4 18647 1 . GLU 5 5 18647 1 . SER 6 6 18647 1 . PRO 7 7 18647 1 . TRP 8 8 18647 1 . SER 9 9 18647 1 . GLN 10 10 18647 1 . ILE 11 11 18647 1 . GLY 12 12 18647 1 . ARG 13 13 18647 1 . LYS 14 14 18647 1 . ILE 15 15 18647 1 . LYS 16 16 18647 1 . LEU 17 17 18647 1 . GLU 18 18 18647 1 . GLY 19 19 18647 1 . LEU 20 20 18647 1 . SER 21 21 18647 1 . ASP 22 22 18647 1 . VAL 23 23 18647 1 . ALA 24 24 18647 1 . SER 25 25 18647 1 . ILE 26 26 18647 1 . SER 27 27 18647 1 . THR 28 28 18647 1 . LYS 29 29 18647 1 . LEU 30 30 18647 1 . GLN 31 31 18647 1 . ASN 32 32 18647 1 . THR 33 33 18647 1 . LEU 34 34 18647 1 . ILE 35 35 18647 1 . GLN 36 36 18647 1 . TYR 37 37 18647 1 . HIS 38 38 18647 1 . SER 39 39 18647 1 . ILE 40 40 18647 1 . LYS 41 41 18647 1 . GLU 42 42 18647 1 . ASP 43 43 18647 1 . GLU 44 44 18647 1 . TRP 45 45 18647 1 . ARG 46 46 18647 1 . VAL 47 47 18647 1 . ALA 48 48 18647 1 . LYS 49 49 18647 1 . LYS 50 50 18647 1 . VAL 51 51 18647 1 . LYS 52 52 18647 1 . ASP 53 53 18647 1 . VAL 54 54 18647 1 . THR 55 55 18647 1 . VAL 56 56 18647 1 . TRP 57 57 18647 1 . ARG 58 58 18647 1 . LYS 59 59 18647 1 . PRO 60 60 18647 1 . SER 61 61 18647 1 . GLU 62 62 18647 1 . GLU 63 63 18647 1 . PHE 64 64 18647 1 . ASN 65 65 18647 1 . GLY 66 66 18647 1 . TYR 67 67 18647 1 . LEU 68 68 18647 1 . TYR 69 69 18647 1 . LYS 70 70 18647 1 . ALA 71 71 18647 1 . GLN 72 72 18647 1 . GLY 73 73 18647 1 . VAL 74 74 18647 1 . MET 75 75 18647 1 . ASP 76 76 18647 1 . ASP 77 77 18647 1 . VAL 78 78 18647 1 . VAL 79 79 18647 1 . ASN 80 80 18647 1 . ASN 81 81 18647 1 . VAL 82 82 18647 1 . ILE 83 83 18647 1 . ASP 84 84 18647 1 . HIS 85 85 18647 1 . ILE 86 86 18647 1 . ARG 87 87 18647 1 . PRO 88 88 18647 1 . GLY 89 89 18647 1 . PRO 90 90 18647 1 . TRP 91 91 18647 1 . ARG 92 92 18647 1 . LEU 93 93 18647 1 . ASP 94 94 18647 1 . TRP 95 95 18647 1 . ASP 96 96 18647 1 . ARG 97 97 18647 1 . LEU 98 98 18647 1 . MET 99 99 18647 1 . THR 100 100 18647 1 . SER 101 101 18647 1 . LEU 102 102 18647 1 . ASP 103 103 18647 1 . VAL 104 104 18647 1 . LEU 105 105 18647 1 . GLU 106 106 18647 1 . HIS 107 107 18647 1 . PHE 108 108 18647 1 . GLU 109 109 18647 1 . GLU 110 110 18647 1 . ASN 111 111 18647 1 . CYS 112 112 18647 1 . CYS 113 113 18647 1 . VAL 114 114 18647 1 . MET 115 115 18647 1 . ARG 116 116 18647 1 . TYR 117 117 18647 1 . THR 118 118 18647 1 . THR 119 119 18647 1 . ALA 120 120 18647 1 . GLY 121 121 18647 1 . GLN 122 122 18647 1 . LEU 123 123 18647 1 . ASP 124 124 18647 1 . ASN 125 125 18647 1 . ILE 126 126 18647 1 . ILE 127 127 18647 1 . SER 128 128 18647 1 . PRO 129 129 18647 1 . ARG 130 130 18647 1 . GLU 131 131 18647 1 . PHE 132 132 18647 1 . VAL 133 133 18647 1 . ASP 134 134 18647 1 . PHE 135 135 18647 1 . SER 136 136 18647 1 . TYR 137 137 18647 1 . THR 138 138 18647 1 . VAL 139 139 18647 1 . GLY 140 140 18647 1 . TYR 141 141 18647 1 . GLU 142 142 18647 1 . GLU 143 143 18647 1 . GLY 144 144 18647 1 . LEU 145 145 18647 1 . LEU 146 146 18647 1 . SER 147 147 18647 1 . CYS 148 148 18647 1 . GLY 149 149 18647 1 . VAL 150 150 18647 1 . SER 151 151 18647 1 . VAL 152 152 18647 1 . GLU 153 153 18647 1 . TRP 154 154 18647 1 . SER 155 155 18647 1 . GLU 156 156 18647 1 . THR 157 157 18647 1 . ARG 158 158 18647 1 . PRO 159 159 18647 1 . GLU 160 160 18647 1 . PHE 161 161 18647 1 . VAL 162 162 18647 1 . ARG 163 163 18647 1 . GLY 164 164 18647 1 . TYR 165 165 18647 1 . ASN 166 166 18647 1 . HIS 167 167 18647 1 . PRO 168 168 18647 1 . CYS 169 169 18647 1 . GLY 170 170 18647 1 . TRP 171 171 18647 1 . PHE 172 172 18647 1 . CYS 173 173 18647 1 . VAL 174 174 18647 1 . PRO 175 175 18647 1 . LEU 176 176 18647 1 . LYS 177 177 18647 1 . ASP 178 178 18647 1 . SER 179 179 18647 1 . PRO 180 180 18647 1 . SER 181 181 18647 1 . GLN 182 182 18647 1 . SER 183 183 18647 1 . LEU 184 184 18647 1 . LEU 185 185 18647 1 . THR 186 186 18647 1 . GLY 187 187 18647 1 . TYR 188 188 18647 1 . ILE 189 189 18647 1 . GLN 190 190 18647 1 . THR 191 191 18647 1 . ASP 192 192 18647 1 . LEU 193 193 18647 1 . ARG 194 194 18647 1 . GLY 195 195 18647 1 . MET 196 196 18647 1 . ILE 197 197 18647 1 . PRO 198 198 18647 1 . GLN 199 199 18647 1 . SER 200 200 18647 1 . ALA 201 201 18647 1 . VAL 202 202 18647 1 . ASP 203 203 18647 1 . THR 204 204 18647 1 . ALA 205 205 18647 1 . MET 206 206 18647 1 . ALA 207 207 18647 1 . SER 208 208 18647 1 . THR 209 209 18647 1 . LEU 210 210 18647 1 . ALA 211 211 18647 1 . ASN 212 212 18647 1 . PHE 213 213 18647 1 . TYR 214 214 18647 1 . SER 215 215 18647 1 . ASP 216 216 18647 1 . LEU 217 217 18647 1 . ARG 218 218 18647 1 . LYS 219 219 18647 1 . GLY 220 220 18647 1 . LEU 221 221 18647 1 . ARG 222 222 18647 1 . LYS 223 223 18647 1 . ALA 224 224 18647 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 18647 _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 $mStARD4L124D . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 18647 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 18647 _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 $mStARD4L124D . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 DE3 . . . . . . . . . . . . . . pET-SUMO-MSTR . . . . . . 18647 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18647 _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 mStARD4L124D '[U-99% 13C; U-99% 15N]' . . 1 $mStARD4L124D . . . 0.5 1 mM . . . . 18647 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18647 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18647 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 18647 _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' 0.04 . M 18647 1 pH 6.4 . pH 18647 1 pressure 1 . atm 18647 1 temperature 296 . K 18647 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 18647 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 18647 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 18647 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 18647 _Software.ID 2 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 18647 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18647 2 'data analysis' 18647 2 'peak picking' 18647 2 stop_ save_ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID 18647 _Software.ID 3 _Software.Name VNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 18647 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 18647 3 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 18647 _Software.ID 4 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 18647 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 18647 4 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 18647 _Software.ID 5 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 18647 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 18647 5 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 18647 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18647 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 18647 _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 INOVA . 600 . . . 18647 1 2 spectrometer_2 Bruker Avance . 800 . . . 18647 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 18647 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18647 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18647 1 3 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18647 1 4 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18647 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18647 1 6 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18647 1 7 '3D HN(COCA)CB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18647 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 18647 _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 external indirect 0.25144952 'separate tube (no insert) similar to the experimental sample tube' cylindrical parallel . . . . . . 18647 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1.0 'separate tube (no insert) similar to the experimental sample tube' cylindrical parallel . . . . . . 18647 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.10132905 'separate tube (no insert) similar to the experimental sample tube' cylindrical parallel . . . . . . 18647 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 18647 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '3D HNCA' . . . 18647 1 3 '3D HN(CO)CA' . . . 18647 1 4 '3D HBHA(CO)NH' . . . 18647 1 5 '3D HNCO' . . . 18647 1 6 '3D HNCACB' . . . 18647 1 7 '3D HN(COCA)CB' . . . 18647 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 2 2 ALA HA H 1 4.2953 0.0000 . 1 . . . . 2 ALA HA . 18647 1 2 . 1 1 2 2 ALA HB1 H 1 1.3224 0.0000 . 1 . . . . 2 ALA HB1 . 18647 1 3 . 1 1 2 2 ALA HB2 H 1 1.3224 0.0000 . 1 . . . . 2 ALA HB1 . 18647 1 4 . 1 1 2 2 ALA HB3 H 1 1.3224 0.0000 . 1 . . . . 2 ALA HB1 . 18647 1 5 . 1 1 2 2 ALA C C 13 176.7609 0.0000 . 1 . . . . 2 ALA C . 18647 1 6 . 1 1 2 2 ALA CA C 13 52.3594 0.0000 . 1 . . . . 2 ALA CA . 18647 1 7 . 1 1 2 2 ALA CB C 13 18.6796 0.0000 . 1 . . . . 2 ALA CB . 18647 1 8 . 1 1 3 3 ASP H H 1 8.4203 0.0000 . 1 . . . . 3 ASP H . 18647 1 9 . 1 1 3 3 ASP CA C 13 52.3594 0.0000 . 1 . . . . 3 ASP CA . 18647 1 10 . 1 1 3 3 ASP CB C 13 40.4275 0.0000 . 1 . . . . 3 ASP CB . 18647 1 11 . 1 1 3 3 ASP N N 15 121.9640 0.0000 . 1 . . . . 3 ASP N . 18647 1 12 . 1 1 4 4 PRO HA H 1 4.3589 0.0000 . 1 . . . . 4 PRO HA . 18647 1 13 . 1 1 4 4 PRO C C 13 176.9329 0.0000 . 1 . . . . 4 PRO C . 18647 1 14 . 1 1 4 4 PRO CA C 13 63.2992 0.0000 . 1 . . . . 4 PRO CA . 18647 1 15 . 1 1 4 4 PRO CB C 13 31.6394 0.0000 . 1 . . . . 4 PRO CB . 18647 1 16 . 1 1 5 5 GLU H H 1 8.4191 0.0000 . 1 . . . . 5 GLU H . 18647 1 17 . 1 1 5 5 GLU HA H 1 4.2595 0.0000 . 1 . . . . 5 GLU HA . 18647 1 18 . 1 1 5 5 GLU HB2 H 1 1.9673 0.0000 . 2 . . . . 5 GLU HB2 . 18647 1 19 . 1 1 5 5 GLU C C 13 176.3849 0.0000 . 1 . . . . 5 GLU C . 18647 1 20 . 1 1 5 5 GLU CA C 13 56.2409 0.0000 . 1 . . . . 5 GLU CA . 18647 1 21 . 1 1 5 5 GLU CB C 13 29.4847 0.0000 . 1 . . . . 5 GLU CB . 18647 1 22 . 1 1 5 5 GLU N N 15 119.6968 0.0000 . 1 . . . . 5 GLU N . 18647 1 23 . 1 1 6 6 SER H H 1 8.2149 0.0000 . 1 . . . . 6 SER H . 18647 1 24 . 1 1 6 6 SER CA C 13 56.2159 0.0000 . 1 . . . . 6 SER CA . 18647 1 25 . 1 1 6 6 SER CB C 13 62.9842 0.0000 . 1 . . . . 6 SER CB . 18647 1 26 . 1 1 6 6 SER N N 15 118.1986 0.0000 . 1 . . . . 6 SER N . 18647 1 27 . 1 1 7 7 PRO CA C 13 63.5537 0.0000 . 1 . . . . 7 PRO CA . 18647 1 28 . 1 1 7 7 PRO CB C 13 31.0557 0.0000 . 1 . . . . 7 PRO CB . 18647 1 29 . 1 1 8 8 TRP CA C 13 57.1081 0.0000 . 1 . . . . 8 TRP CA . 18647 1 30 . 1 1 8 8 TRP CB C 13 28.5215 0.0000 . 1 . . . . 8 TRP CB . 18647 1 31 . 1 1 9 9 SER HA H 1 4.3720 0.0000 . 1 . . . . 9 SER HA . 18647 1 32 . 1 1 9 9 SER C C 13 176.4274 0.0000 . 1 . . . . 9 SER C . 18647 1 33 . 1 1 9 9 SER CA C 13 58.3881 0.0000 . 1 . . . . 9 SER CA . 18647 1 34 . 1 1 9 9 SER CB C 13 63.6694 0.0000 . 1 . . . . 9 SER CB . 18647 1 35 . 1 1 10 10 GLN H H 1 8.0617 0.0000 . 1 . . . . 10 GLN H . 18647 1 36 . 1 1 10 10 GLN HA H 1 4.1458 0.0000 . 1 . . . . 10 GLN HA . 18647 1 37 . 1 1 10 10 GLN C C 13 177.0096 0.0000 . 1 . . . . 10 GLN C . 18647 1 38 . 1 1 10 10 GLN CA C 13 56.1116 0.0000 . 1 . . . . 10 GLN CA . 18647 1 39 . 1 1 10 10 GLN CB C 13 28.8266 0.0000 . 1 . . . . 10 GLN CB . 18647 1 40 . 1 1 10 10 GLN N N 15 121.1946 0.0000 . 1 . . . . 10 GLN N . 18647 1 41 . 1 1 11 11 ILE H H 1 7.8267 0.0000 . 1 . . . . 11 ILE H . 18647 1 42 . 1 1 11 11 ILE HA H 1 3.9478 0.0000 . 1 . . . . 11 ILE HA . 18647 1 43 . 1 1 11 11 ILE HB H 1 1.7800 0.0000 . 1 . . . . 11 ILE HB . 18647 1 44 . 1 1 11 11 ILE C C 13 177.1622 0.0000 . 1 . . . . 11 ILE C . 18647 1 45 . 1 1 11 11 ILE CA C 13 61.4635 0.0000 . 1 . . . . 11 ILE CA . 18647 1 46 . 1 1 11 11 ILE CB C 13 37.7928 0.0000 . 1 . . . . 11 ILE CB . 18647 1 47 . 1 1 11 11 ILE N N 15 120.2378 0.0000 . 1 . . . . 11 ILE N . 18647 1 48 . 1 1 12 12 GLY H H 1 8.3318 0.0000 . 1 . . . . 12 GLY H . 18647 1 49 . 1 1 12 12 GLY HA2 H 1 3.8712 0.0000 . 2 . . . . 12 GLY HA2 . 18647 1 50 . 1 1 12 12 GLY C C 13 174.5734 0.0000 . 1 . . . . 12 GLY C . 18647 1 51 . 1 1 12 12 GLY CA C 13 45.4681 0.0000 . 1 . . . . 12 GLY CA . 18647 1 52 . 1 1 12 12 GLY N N 15 110.1260 0.0000 . 1 . . . . 12 GLY N . 18647 1 53 . 1 1 13 13 ARG H H 1 7.8977 0.0000 . 1 . . . . 13 ARG H . 18647 1 54 . 1 1 13 13 ARG CA C 13 56.3921 0.0000 . 1 . . . . 13 ARG CA . 18647 1 55 . 1 1 13 13 ARG CB C 13 29.4321 0.0000 . 1 . . . . 13 ARG CB . 18647 1 56 . 1 1 13 13 ARG N N 15 119.4864 0.0000 . 1 . . . . 13 ARG N . 18647 1 57 . 1 1 18 18 GLU HA H 1 4.3764 0.0000 . 1 . . . . 18 GLU HA . 18647 1 58 . 1 1 18 18 GLU HB2 H 1 2.0383 0.0000 . 2 . . . . 18 GLU HB2 . 18647 1 59 . 1 1 18 18 GLU C C 13 176.6791 0.0000 . 1 . . . . 18 GLU C . 18647 1 60 . 1 1 18 18 GLU CA C 13 56.6477 0.0000 . 1 . . . . 18 GLU CA . 18647 1 61 . 1 1 18 18 GLU CB C 13 29.6396 0.0000 . 1 . . . . 18 GLU CB . 18647 1 62 . 1 1 19 19 GLY H H 1 8.1106 0.0000 . 1 . . . . 19 GLY H . 18647 1 63 . 1 1 19 19 GLY HA2 H 1 4.0817 0.0000 . 2 . . . . 19 GLY HA2 . 18647 1 64 . 1 1 19 19 GLY C C 13 173.9850 0.0000 . 1 . . . . 19 GLY C . 18647 1 65 . 1 1 19 19 GLY CA C 13 44.9593 0.0000 . 1 . . . . 19 GLY CA . 18647 1 66 . 1 1 19 19 GLY N N 15 108.5517 0.0000 . 1 . . . . 19 GLY N . 18647 1 67 . 1 1 20 20 LEU H H 1 8.4315 0.0000 . 1 . . . . 20 LEU H . 18647 1 68 . 1 1 20 20 LEU CA C 13 56.4279 0.0000 . 1 . . . . 20 LEU CA . 18647 1 69 . 1 1 20 20 LEU CB C 13 41.0348 0.0000 . 1 . . . . 20 LEU CB . 18647 1 70 . 1 1 20 20 LEU N N 15 121.0501 0.0000 . 1 . . . . 20 LEU N . 18647 1 71 . 1 1 21 21 SER HA H 1 4.2880 0.0000 . 1 . . . . 21 SER HA . 18647 1 72 . 1 1 21 21 SER HB2 H 1 3.8600 0.0000 . 2 . . . . 21 SER HB2 . 18647 1 73 . 1 1 21 21 SER C C 13 175.4876 0.0000 . 1 . . . . 21 SER C . 18647 1 74 . 1 1 21 21 SER CA C 13 60.3876 0.0000 . 1 . . . . 21 SER CA . 18647 1 75 . 1 1 21 21 SER CB C 13 62.2972 0.0000 . 1 . . . . 21 SER CB . 18647 1 76 . 1 1 22 22 ASP H H 1 7.8578 0.0000 . 1 . . . . 22 ASP H . 18647 1 77 . 1 1 22 22 ASP HA H 1 4.6102 0.0000 . 1 . . . . 22 ASP HA . 18647 1 78 . 1 1 22 22 ASP C C 13 176.8624 0.0000 . 1 . . . . 22 ASP C . 18647 1 79 . 1 1 22 22 ASP CA C 13 55.6577 0.0000 . 1 . . . . 22 ASP CA . 18647 1 80 . 1 1 22 22 ASP CB C 13 41.4106 0.0000 . 1 . . . . 22 ASP CB . 18647 1 81 . 1 1 22 22 ASP N N 15 121.5719 0.0000 . 1 . . . . 22 ASP N . 18647 1 82 . 1 1 23 23 VAL H H 1 7.6812 0.0000 . 1 . . . . 23 VAL H . 18647 1 83 . 1 1 23 23 VAL HA H 1 3.2507 0.0000 . 1 . . . . 23 VAL HA . 18647 1 84 . 1 1 23 23 VAL HB H 1 1.9428 0.0000 . 1 . . . . 23 VAL HB . 18647 1 85 . 1 1 23 23 VAL C C 13 178.0807 0.0000 . 1 . . . . 23 VAL C . 18647 1 86 . 1 1 23 23 VAL CA C 13 65.6757 0.0000 . 1 . . . . 23 VAL CA . 18647 1 87 . 1 1 23 23 VAL CB C 13 31.0374 0.0000 . 1 . . . . 23 VAL CB . 18647 1 88 . 1 1 23 23 VAL N N 15 120.0631 0.0000 . 1 . . . . 23 VAL N . 18647 1 89 . 1 1 24 24 ALA H H 1 8.2815 0.0000 . 1 . . . . 24 ALA H . 18647 1 90 . 1 1 24 24 ALA HA H 1 4.0459 0.0000 . 1 . . . . 24 ALA HA . 18647 1 91 . 1 1 24 24 ALA HB1 H 1 1.4141 0.0000 . 1 . . . . 24 ALA HB1 . 18647 1 92 . 1 1 24 24 ALA HB2 H 1 1.4141 0.0000 . 1 . . . . 24 ALA HB1 . 18647 1 93 . 1 1 24 24 ALA HB3 H 1 1.4141 0.0000 . 1 . . . . 24 ALA HB1 . 18647 1 94 . 1 1 24 24 ALA C C 13 179.8505 0.0000 . 1 . . . . 24 ALA C . 18647 1 95 . 1 1 24 24 ALA CA C 13 55.1680 0.0000 . 1 . . . . 24 ALA CA . 18647 1 96 . 1 1 24 24 ALA CB C 13 17.4621 0.0000 . 1 . . . . 24 ALA CB . 18647 1 97 . 1 1 24 24 ALA N N 15 124.1676 0.0000 . 1 . . . . 24 ALA N . 18647 1 98 . 1 1 25 25 SER H H 1 7.7759 0.0000 . 1 . . . . 25 SER H . 18647 1 99 . 1 1 25 25 SER HA H 1 4.1458 0.0000 . 1 . . . . 25 SER HA . 18647 1 100 . 1 1 25 25 SER C C 13 176.9714 0.0000 . 1 . . . . 25 SER C . 18647 1 101 . 1 1 25 25 SER CA C 13 60.7202 0.0000 . 1 . . . . 25 SER CA . 18647 1 102 . 1 1 25 25 SER CB C 13 62.3022 0.0000 . 1 . . . . 25 SER CB . 18647 1 103 . 1 1 25 25 SER N N 15 113.2988 0.0000 . 1 . . . . 25 SER N . 18647 1 104 . 1 1 26 26 ILE H H 1 7.7798 0.0000 . 1 . . . . 26 ILE H . 18647 1 105 . 1 1 26 26 ILE HA H 1 3.6963 0.0000 . 1 . . . . 26 ILE HA . 18647 1 106 . 1 1 26 26 ILE C C 13 177.3644 0.0000 . 1 . . . . 26 ILE C . 18647 1 107 . 1 1 26 26 ILE CA C 13 63.9126 0.0000 . 1 . . . . 26 ILE CA . 18647 1 108 . 1 1 26 26 ILE CB C 13 36.8390 0.0000 . 1 . . . . 26 ILE CB . 18647 1 109 . 1 1 26 26 ILE N N 15 120.5607 0.0000 . 1 . . . . 26 ILE N . 18647 1 110 . 1 1 27 27 SER H H 1 8.0742 0.0000 . 1 . . . . 27 SER H . 18647 1 111 . 1 1 27 27 SER HA H 1 3.6376 0.0000 . 1 . . . . 27 SER HA . 18647 1 112 . 1 1 27 27 SER HB2 H 1 2.8943 0.0000 . 2 . . . . 27 SER HB2 . 18647 1 113 . 1 1 27 27 SER C C 13 175.3245 0.0000 . 1 . . . . 27 SER C . 18647 1 114 . 1 1 27 27 SER CA C 13 63.0904 0.0000 . 1 . . . . 27 SER CA . 18647 1 115 . 1 1 27 27 SER CB C 13 60.9109 0.0000 . 1 . . . . 27 SER CB . 18647 1 116 . 1 1 27 27 SER N N 15 116.5132 0.0000 . 1 . . . . 27 SER N . 18647 1 117 . 1 1 28 28 THR H H 1 7.6510 0.0000 . 1 . . . . 28 THR H . 18647 1 118 . 1 1 28 28 THR HA H 1 4.0506 0.0000 . 1 . . . . 28 THR HA . 18647 1 119 . 1 1 28 28 THR C C 13 176.0443 0.0000 . 1 . . . . 28 THR C . 18647 1 120 . 1 1 28 28 THR CA C 13 66.5283 0.0000 . 1 . . . . 28 THR CA . 18647 1 121 . 1 1 28 28 THR CB C 13 68.6420 0.0000 . 1 . . . . 28 THR CB . 18647 1 122 . 1 1 28 28 THR N N 15 117.6718 0.0000 . 1 . . . . 28 THR N . 18647 1 123 . 1 1 29 29 LYS H H 1 7.6872 0.0000 . 1 . . . . 29 LYS H . 18647 1 124 . 1 1 29 29 LYS C C 13 179.8855 0.0000 . 1 . . . . 29 LYS C . 18647 1 125 . 1 1 29 29 LYS CA C 13 59.4710 0.0000 . 1 . . . . 29 LYS CA . 18647 1 126 . 1 1 29 29 LYS CB C 13 31.6025 0.0000 . 1 . . . . 29 LYS CB . 18647 1 127 . 1 1 29 29 LYS N N 15 121.6870 0.0000 . 1 . . . . 29 LYS N . 18647 1 128 . 1 1 30 30 LEU H H 1 8.8040 0.0000 . 1 . . . . 30 LEU H . 18647 1 129 . 1 1 30 30 LEU C C 13 177.6961 0.0000 . 1 . . . . 30 LEU C . 18647 1 130 . 1 1 30 30 LEU CA C 13 58.7968 0.0000 . 1 . . . . 30 LEU CA . 18647 1 131 . 1 1 30 30 LEU CB C 13 41.8966 0.0000 . 1 . . . . 30 LEU CB . 18647 1 132 . 1 1 30 30 LEU N N 15 122.9288 0.0000 . 1 . . . . 30 LEU N . 18647 1 133 . 1 1 31 31 GLN H H 1 8.4157 0.0000 . 1 . . . . 31 GLN H . 18647 1 134 . 1 1 31 31 GLN HA H 1 3.9227 0.0000 . 1 . . . . 31 GLN HA . 18647 1 135 . 1 1 31 31 GLN C C 13 177.1545 0.0000 . 1 . . . . 31 GLN C . 18647 1 136 . 1 1 31 31 GLN CA C 13 59.5246 0.0000 . 1 . . . . 31 GLN CA . 18647 1 137 . 1 1 31 31 GLN CB C 13 27.8557 0.0000 . 1 . . . . 31 GLN CB . 18647 1 138 . 1 1 31 31 GLN N N 15 119.5361 0.0000 . 1 . . . . 31 GLN N . 18647 1 139 . 1 1 32 32 ASN H H 1 8.2041 0.0000 . 1 . . . . 32 ASN H . 18647 1 140 . 1 1 32 32 ASN HA H 1 4.3916 0.0000 . 1 . . . . 32 ASN HA . 18647 1 141 . 1 1 32 32 ASN HB2 H 1 2.9189 0.0000 . 2 . . . . 32 ASN HB2 . 18647 1 142 . 1 1 32 32 ASN C C 13 178.3455 0.0000 . 1 . . . . 32 ASN C . 18647 1 143 . 1 1 32 32 ASN CA C 13 56.2313 0.0000 . 1 . . . . 32 ASN CA . 18647 1 144 . 1 1 32 32 ASN CB C 13 37.5844 0.0000 . 1 . . . . 32 ASN CB . 18647 1 145 . 1 1 32 32 ASN N N 15 115.6166 0.0000 . 1 . . . . 32 ASN N . 18647 1 146 . 1 1 33 33 THR H H 1 8.2082 0.0000 . 1 . . . . 33 THR H . 18647 1 147 . 1 1 33 33 THR HA H 1 3.6894 0.0000 . 1 . . . . 33 THR HA . 18647 1 148 . 1 1 33 33 THR C C 13 173.9044 0.0000 . 1 . . . . 33 THR C . 18647 1 149 . 1 1 33 33 THR CA C 13 66.8628 0.0000 . 1 . . . . 33 THR CA . 18647 1 150 . 1 1 33 33 THR CB C 13 68.4881 0.0000 . 1 . . . . 33 THR CB . 18647 1 151 . 1 1 33 33 THR N N 15 120.0587 0.0000 . 1 . . . . 33 THR N . 18647 1 152 . 1 1 34 34 LEU H H 1 7.7958 0.0000 . 1 . . . . 34 LEU H . 18647 1 153 . 1 1 34 34 LEU HA H 1 3.4330 0.0000 . 1 . . . . 34 LEU HA . 18647 1 154 . 1 1 34 34 LEU C C 13 179.2473 0.0000 . 1 . . . . 34 LEU C . 18647 1 155 . 1 1 34 34 LEU CA C 13 54.8844 0.0000 . 1 . . . . 34 LEU CA . 18647 1 156 . 1 1 34 34 LEU CB C 13 37.6955 0.0000 . 1 . . . . 34 LEU CB . 18647 1 157 . 1 1 34 34 LEU N N 15 124.8806 0.0000 . 1 . . . . 34 LEU N . 18647 1 158 . 1 1 35 35 ILE H H 1 8.1887 0.0000 . 1 . . . . 35 ILE H . 18647 1 159 . 1 1 35 35 ILE HA H 1 3.5588 0.0000 . 1 . . . . 35 ILE HA . 18647 1 160 . 1 1 35 35 ILE C C 13 178.7962 0.0000 . 1 . . . . 35 ILE C . 18647 1 161 . 1 1 35 35 ILE CA C 13 66.6165 0.0000 . 1 . . . . 35 ILE CA . 18647 1 162 . 1 1 35 35 ILE CB C 13 37.5034 0.0000 . 1 . . . . 35 ILE CB . 18647 1 163 . 1 1 35 35 ILE N N 15 119.1632 0.0000 . 1 . . . . 35 ILE N . 18647 1 164 . 1 1 36 36 GLN H H 1 7.7181 0.0000 . 1 . . . . 36 GLN H . 18647 1 165 . 1 1 36 36 GLN HA H 1 4.0148 0.0000 . 1 . . . . 36 GLN HA . 18647 1 166 . 1 1 36 36 GLN HB2 H 1 2.3208 0.0000 . 2 . . . . 36 GLN HB2 . 18647 1 167 . 1 1 36 36 GLN C C 13 180.8329 0.0000 . 1 . . . . 36 GLN C . 18647 1 168 . 1 1 36 36 GLN CA C 13 59.4976 0.0000 . 1 . . . . 36 GLN CA . 18647 1 169 . 1 1 36 36 GLN CB C 13 26.6500 0.0000 . 1 . . . . 36 GLN CB . 18647 1 170 . 1 1 36 36 GLN N N 15 121.9447 0.0000 . 1 . . . . 36 GLN N . 18647 1 171 . 1 1 37 37 TYR H H 1 8.1919 0.0000 . 1 . . . . 37 TYR H . 18647 1 172 . 1 1 37 37 TYR HA H 1 4.5064 0.0000 . 1 . . . . 37 TYR HA . 18647 1 173 . 1 1 37 37 TYR HB2 H 1 2.6551 0.0000 . 2 . . . . 37 TYR HB2 . 18647 1 174 . 1 1 37 37 TYR C C 13 178.4523 0.0000 . 1 . . . . 37 TYR C . 18647 1 175 . 1 1 37 37 TYR CA C 13 56.9842 0.0000 . 1 . . . . 37 TYR CA . 18647 1 176 . 1 1 37 37 TYR CB C 13 34.2694 0.0000 . 1 . . . . 37 TYR CB . 18647 1 177 . 1 1 37 37 TYR N N 15 121.9977 0.0000 . 1 . . . . 37 TYR N . 18647 1 178 . 1 1 38 38 HIS H H 1 7.9728 0.0000 . 1 . . . . 38 HIS H . 18647 1 179 . 1 1 38 38 HIS HA H 1 5.2111 0.0000 . 1 . . . . 38 HIS HA . 18647 1 180 . 1 1 38 38 HIS HB2 H 1 2.6602 0.0000 . 2 . . . . 38 HIS HB2 . 18647 1 181 . 1 1 38 38 HIS C C 13 176.0756 0.0000 . 1 . . . . 38 HIS C . 18647 1 182 . 1 1 38 38 HIS CA C 13 55.1264 0.0000 . 1 . . . . 38 HIS CA . 18647 1 183 . 1 1 38 38 HIS CB C 13 31.4250 0.0000 . 1 . . . . 38 HIS CB . 18647 1 184 . 1 1 38 38 HIS N N 15 119.5992 0.0000 . 1 . . . . 38 HIS N . 18647 1 185 . 1 1 39 39 SER H H 1 7.6218 0.0000 . 1 . . . . 39 SER H . 18647 1 186 . 1 1 39 39 SER HA H 1 4.3999 0.0000 . 1 . . . . 39 SER HA . 18647 1 187 . 1 1 39 39 SER HB2 H 1 3.9571 0.0000 . 2 . . . . 39 SER HB2 . 18647 1 188 . 1 1 39 39 SER C C 13 174.5827 0.0000 . 1 . . . . 39 SER C . 18647 1 189 . 1 1 39 39 SER CA C 13 57.7307 0.0000 . 1 . . . . 39 SER CA . 18647 1 190 . 1 1 39 39 SER CB C 13 64.1404 0.0000 . 1 . . . . 39 SER CB . 18647 1 191 . 1 1 39 39 SER N N 15 112.3443 0.0000 . 1 . . . . 39 SER N . 18647 1 192 . 1 1 40 40 ILE H H 1 7.4638 0.0000 . 1 . . . . 40 ILE H . 18647 1 193 . 1 1 40 40 ILE HA H 1 3.7536 0.0000 . 1 . . . . 40 ILE HA . 18647 1 194 . 1 1 40 40 ILE HB H 1 2.0729 0.0000 . 1 . . . . 40 ILE HB . 18647 1 195 . 1 1 40 40 ILE C C 13 177.4930 0.0000 . 1 . . . . 40 ILE C . 18647 1 196 . 1 1 40 40 ILE CA C 13 63.5002 0.0000 . 1 . . . . 40 ILE CA . 18647 1 197 . 1 1 40 40 ILE CB C 13 36.8838 0.0000 . 1 . . . . 40 ILE CB . 18647 1 198 . 1 1 40 40 ILE N N 15 125.0746 0.0000 . 1 . . . . 40 ILE N . 18647 1 199 . 1 1 41 41 LYS H H 1 8.7205 0.0000 . 1 . . . . 41 LYS H . 18647 1 200 . 1 1 41 41 LYS HA H 1 4.0905 0.0000 . 1 . . . . 41 LYS HA . 18647 1 201 . 1 1 41 41 LYS HB2 H 1 1.9424 0.0000 . 2 . . . . 41 LYS HB2 . 18647 1 202 . 1 1 41 41 LYS C C 13 177.0088 0.0000 . 1 . . . . 41 LYS C . 18647 1 203 . 1 1 41 41 LYS CA C 13 57.0629 0.0000 . 1 . . . . 41 LYS CA . 18647 1 204 . 1 1 41 41 LYS CB C 13 32.4747 0.0000 . 1 . . . . 41 LYS CB . 18647 1 205 . 1 1 41 41 LYS N N 15 130.0803 0.0000 . 1 . . . . 41 LYS N . 18647 1 206 . 1 1 42 42 GLU H H 1 8.4769 0.0000 . 1 . . . . 42 GLU H . 18647 1 207 . 1 1 42 42 GLU HA H 1 3.8796 0.0000 . 1 . . . . 42 GLU HA . 18647 1 208 . 1 1 42 42 GLU HB2 H 1 1.9734 0.0000 . 2 . . . . 42 GLU HB2 . 18647 1 209 . 1 1 42 42 GLU C C 13 177.8439 0.0000 . 1 . . . . 42 GLU C . 18647 1 210 . 1 1 42 42 GLU CA C 13 59.9804 0.0000 . 1 . . . . 42 GLU CA . 18647 1 211 . 1 1 42 42 GLU CB C 13 29.2960 0.0000 . 1 . . . . 42 GLU CB . 18647 1 212 . 1 1 42 42 GLU N N 15 119.6968 0.0000 . 1 . . . . 42 GLU N . 18647 1 213 . 1 1 43 43 ASP H H 1 8.2298 0.0000 . 1 . . . . 43 ASP H . 18647 1 214 . 1 1 43 43 ASP HA H 1 4.4496 0.0000 . 1 . . . . 43 ASP HA . 18647 1 215 . 1 1 43 43 ASP HB2 H 1 2.6682 0.0000 . 2 . . . . 43 ASP HB2 . 18647 1 216 . 1 1 43 43 ASP C C 13 177.0083 0.0000 . 1 . . . . 43 ASP C . 18647 1 217 . 1 1 43 43 ASP CA C 13 55.5079 0.0000 . 1 . . . . 43 ASP CA . 18647 1 218 . 1 1 43 43 ASP CB C 13 39.6706 0.0000 . 1 . . . . 43 ASP CB . 18647 1 219 . 1 1 43 43 ASP N N 15 113.5573 0.0000 . 1 . . . . 43 ASP N . 18647 1 220 . 1 1 44 44 GLU H H 1 7.6253 0.0000 . 1 . . . . 44 GLU H . 18647 1 221 . 1 1 44 44 GLU HA H 1 4.1111 0.0000 . 1 . . . . 44 GLU HA . 18647 1 222 . 1 1 44 44 GLU HB2 H 1 1.6526 0.0000 . 2 . . . . 44 GLU HB2 . 18647 1 223 . 1 1 44 44 GLU C C 13 175.8236 0.0000 . 1 . . . . 44 GLU C . 18647 1 224 . 1 1 44 44 GLU CA C 13 56.7968 0.0000 . 1 . . . . 44 GLU CA . 18647 1 225 . 1 1 44 44 GLU CB C 13 28.9422 0.0000 . 1 . . . . 44 GLU CB . 18647 1 226 . 1 1 44 44 GLU N N 15 117.2066 0.0000 . 1 . . . . 44 GLU N . 18647 1 227 . 1 1 45 45 TRP H H 1 7.3761 0.0000 . 1 . . . . 45 TRP H . 18647 1 228 . 1 1 45 45 TRP HA H 1 4.5606 0.0000 . 1 . . . . 45 TRP HA . 18647 1 229 . 1 1 45 45 TRP C C 13 176.2444 0.0000 . 1 . . . . 45 TRP C . 18647 1 230 . 1 1 45 45 TRP CA C 13 55.7694 0.0000 . 1 . . . . 45 TRP CA . 18647 1 231 . 1 1 45 45 TRP CB C 13 31.2288 0.0000 . 1 . . . . 45 TRP CB . 18647 1 232 . 1 1 45 45 TRP N N 15 118.4706 0.0000 . 1 . . . . 45 TRP N . 18647 1 233 . 1 1 46 46 ARG H H 1 8.7013 0.0000 . 1 . . . . 46 ARG H . 18647 1 234 . 1 1 46 46 ARG HA H 1 5.0745 0.0000 . 1 . . . . 46 ARG HA . 18647 1 235 . 1 1 46 46 ARG HB2 H 1 1.9160 0.0000 . 2 . . . . 46 ARG HB2 . 18647 1 236 . 1 1 46 46 ARG C C 13 176.8530 0.0000 . 1 . . . . 46 ARG C . 18647 1 237 . 1 1 46 46 ARG CA C 13 53.7063 0.0000 . 1 . . . . 46 ARG CA . 18647 1 238 . 1 1 46 46 ARG CB C 13 31.3382 0.0000 . 1 . . . . 46 ARG CB . 18647 1 239 . 1 1 46 46 ARG N N 15 119.8580 0.0000 . 1 . . . . 46 ARG N . 18647 1 240 . 1 1 47 47 VAL H H 1 9.2131 0.0000 . 1 . . . . 47 VAL H . 18647 1 241 . 1 1 47 47 VAL HA H 1 3.7190 0.0000 . 1 . . . . 47 VAL HA . 18647 1 242 . 1 1 47 47 VAL HB H 1 1.9481 0.0000 . 1 . . . . 47 VAL HB . 18647 1 243 . 1 1 47 47 VAL C C 13 175.4404 0.0000 . 1 . . . . 47 VAL C . 18647 1 244 . 1 1 47 47 VAL CA C 13 65.2030 0.0000 . 1 . . . . 47 VAL CA . 18647 1 245 . 1 1 47 47 VAL CB C 13 31.3496 0.0000 . 1 . . . . 47 VAL CB . 18647 1 246 . 1 1 47 47 VAL N N 15 125.2999 0.0000 . 1 . . . . 47 VAL N . 18647 1 247 . 1 1 48 48 ALA H H 1 9.8758 0.0000 . 1 . . . . 48 ALA H . 18647 1 248 . 1 1 48 48 ALA HA H 1 4.5944 0.0000 . 1 . . . . 48 ALA HA . 18647 1 249 . 1 1 48 48 ALA HB1 H 1 1.2362 0.0000 . 1 . . . . 48 ALA HB1 . 18647 1 250 . 1 1 48 48 ALA HB2 H 1 1.2362 0.0000 . 1 . . . . 48 ALA HB1 . 18647 1 251 . 1 1 48 48 ALA HB3 H 1 1.2362 0.0000 . 1 . . . . 48 ALA HB1 . 18647 1 252 . 1 1 48 48 ALA C C 13 177.0029 0.0000 . 1 . . . . 48 ALA C . 18647 1 253 . 1 1 48 48 ALA CA C 13 52.1654 0.0000 . 1 . . . . 48 ALA CA . 18647 1 254 . 1 1 48 48 ALA CB C 13 19.5968 0.0000 . 1 . . . . 48 ALA CB . 18647 1 255 . 1 1 48 48 ALA N N 15 131.5046 0.0000 . 1 . . . . 48 ALA N . 18647 1 256 . 1 1 49 49 LYS H H 1 8.0580 0.0000 . 1 . . . . 49 LYS H . 18647 1 257 . 1 1 49 49 LYS HA H 1 4.2532 0.0000 . 1 . . . . 49 LYS HA . 18647 1 258 . 1 1 49 49 LYS HB2 H 1 1.7418 0.0000 . 2 . . . . 49 LYS HB2 . 18647 1 259 . 1 1 49 49 LYS HB3 H 1 1.3300 0.0000 . 2 . . . . 49 LYS HB3 . 18647 1 260 . 1 1 49 49 LYS C C 13 172.6253 0.0000 . 1 . . . . 49 LYS C . 18647 1 261 . 1 1 49 49 LYS CA C 13 56.3045 0.0000 . 1 . . . . 49 LYS CA . 18647 1 262 . 1 1 49 49 LYS CB C 13 35.2443 0.0000 . 1 . . . . 49 LYS CB . 18647 1 263 . 1 1 49 49 LYS N N 15 118.3911 0.0000 . 1 . . . . 49 LYS N . 18647 1 264 . 1 1 50 50 LYS H H 1 8.6767 0.0000 . 1 . . . . 50 LYS H . 18647 1 265 . 1 1 50 50 LYS HA H 1 4.7506 0.0000 . 1 . . . . 50 LYS HA . 18647 1 266 . 1 1 50 50 LYS HB2 H 1 1.7356 0.0000 . 2 . . . . 50 LYS HB2 . 18647 1 267 . 1 1 50 50 LYS C C 13 175.1744 0.0000 . 1 . . . . 50 LYS C . 18647 1 268 . 1 1 50 50 LYS CA C 13 56.1639 0.0000 . 1 . . . . 50 LYS CA . 18647 1 269 . 1 1 50 50 LYS CB C 13 33.9122 0.0000 . 1 . . . . 50 LYS CB . 18647 1 270 . 1 1 50 50 LYS N N 15 127.0378 0.0000 . 1 . . . . 50 LYS N . 18647 1 271 . 1 1 51 51 VAL H H 1 8.2937 0.0000 . 1 . . . . 51 VAL H . 18647 1 272 . 1 1 51 51 VAL HA H 1 4.4154 0.0000 . 1 . . . . 51 VAL HA . 18647 1 273 . 1 1 51 51 VAL HB H 1 2.2003 0.0000 . 1 . . . . 51 VAL HB . 18647 1 274 . 1 1 51 51 VAL C C 13 175.3136 0.0000 . 1 . . . . 51 VAL C . 18647 1 275 . 1 1 51 51 VAL CA C 13 60.3090 0.0000 . 1 . . . . 51 VAL CA . 18647 1 276 . 1 1 51 51 VAL CB C 13 32.9509 0.0000 . 1 . . . . 51 VAL CB . 18647 1 277 . 1 1 51 51 VAL N N 15 122.4552 0.0000 . 1 . . . . 51 VAL N . 18647 1 278 . 1 1 52 52 LYS H H 1 8.7009 0.0000 . 1 . . . . 52 LYS H . 18647 1 279 . 1 1 52 52 LYS HA H 1 3.8002 0.0000 . 1 . . . . 52 LYS HA . 18647 1 280 . 1 1 52 52 LYS HB2 H 1 1.8312 0.0000 . 2 . . . . 52 LYS HB2 . 18647 1 281 . 1 1 52 52 LYS C C 13 176.3565 0.0000 . 1 . . . . 52 LYS C . 18647 1 282 . 1 1 52 52 LYS CA C 13 59.2836 0.0000 . 1 . . . . 52 LYS CA . 18647 1 283 . 1 1 52 52 LYS CB C 13 30.4246 0.0000 . 1 . . . . 52 LYS CB . 18647 1 284 . 1 1 52 52 LYS N N 15 123.2987 0.0000 . 1 . . . . 52 LYS N . 18647 1 285 . 1 1 53 53 ASP H H 1 8.3138 0.0000 . 1 . . . . 53 ASP H . 18647 1 286 . 1 1 53 53 ASP HA H 1 4.5374 0.0000 . 1 . . . . 53 ASP HA . 18647 1 287 . 1 1 53 53 ASP HB2 H 1 2.8594 0.0000 . 2 . . . . 53 ASP HB2 . 18647 1 288 . 1 1 53 53 ASP HB3 H 1 2.6657 0.0000 . 2 . . . . 53 ASP HB3 . 18647 1 289 . 1 1 53 53 ASP C C 13 175.5886 0.0000 . 1 . . . . 53 ASP C . 18647 1 290 . 1 1 53 53 ASP CA C 13 54.7430 0.0000 . 1 . . . . 53 ASP CA . 18647 1 291 . 1 1 53 53 ASP CB C 13 40.3943 0.0000 . 1 . . . . 53 ASP CB . 18647 1 292 . 1 1 53 53 ASP N N 15 117.1699 0.0000 . 1 . . . . 53 ASP N . 18647 1 293 . 1 1 54 54 VAL H H 1 7.6028 0.0000 . 1 . . . . 54 VAL H . 18647 1 294 . 1 1 54 54 VAL HA H 1 4.3633 0.0000 . 1 . . . . 54 VAL HA . 18647 1 295 . 1 1 54 54 VAL HB H 1 1.8021 0.0000 . 1 . . . . 54 VAL HB . 18647 1 296 . 1 1 54 54 VAL C C 13 173.8198 0.0000 . 1 . . . . 54 VAL C . 18647 1 297 . 1 1 54 54 VAL CA C 13 61.8622 0.0000 . 1 . . . . 54 VAL CA . 18647 1 298 . 1 1 54 54 VAL CB C 13 33.4310 0.0000 . 1 . . . . 54 VAL CB . 18647 1 299 . 1 1 54 54 VAL N N 15 120.7523 0.0000 . 1 . . . . 54 VAL N . 18647 1 300 . 1 1 55 55 THR H H 1 7.5235 0.0000 . 1 . . . . 55 THR H . 18647 1 301 . 1 1 55 55 THR HA H 1 4.3440 0.0000 . 1 . . . . 55 THR HA . 18647 1 302 . 1 1 55 55 THR HB H 1 2.9469 0.0000 . 1 . . . . 55 THR HB . 18647 1 303 . 1 1 55 55 THR C C 13 171.1497 0.0000 . 1 . . . . 55 THR C . 18647 1 304 . 1 1 55 55 THR CA C 13 61.7733 0.0000 . 1 . . . . 55 THR CA . 18647 1 305 . 1 1 55 55 THR CB C 13 69.7473 0.0000 . 1 . . . . 55 THR CB . 18647 1 306 . 1 1 55 55 THR N N 15 122.2027 0.0000 . 1 . . . . 55 THR N . 18647 1 307 . 1 1 56 56 VAL H H 1 8.4644 0.0000 . 1 . . . . 56 VAL H . 18647 1 308 . 1 1 56 56 VAL HA H 1 5.0569 0.0000 . 1 . . . . 56 VAL HA . 18647 1 309 . 1 1 56 56 VAL HB H 1 2.0271 0.0000 . 1 . . . . 56 VAL HB . 18647 1 310 . 1 1 56 56 VAL C C 13 175.1971 0.0000 . 1 . . . . 56 VAL C . 18647 1 311 . 1 1 56 56 VAL CA C 13 60.2950 0.0000 . 1 . . . . 56 VAL CA . 18647 1 312 . 1 1 56 56 VAL CB C 13 33.4312 0.0000 . 1 . . . . 56 VAL CB . 18647 1 313 . 1 1 56 56 VAL N N 15 123.9505 0.0000 . 1 . . . . 56 VAL N . 18647 1 314 . 1 1 57 57 TRP H H 1 10.5755 0.0000 . 1 . . . . 57 TRP H . 18647 1 315 . 1 1 57 57 TRP HA H 1 5.5764 0.0000 . 1 . . . . 57 TRP HA . 18647 1 316 . 1 1 57 57 TRP HB2 H 1 2.8266 0.0000 . 2 . . . . 57 TRP HB2 . 18647 1 317 . 1 1 57 57 TRP C C 13 174.9423 0.0000 . 1 . . . . 57 TRP C . 18647 1 318 . 1 1 57 57 TRP CA C 13 57.3860 0.0000 . 1 . . . . 57 TRP CA . 18647 1 319 . 1 1 57 57 TRP CB C 13 35.3547 0.0000 . 1 . . . . 57 TRP CB . 18647 1 320 . 1 1 57 57 TRP N N 15 129.1551 0.0000 . 1 . . . . 57 TRP N . 18647 1 321 . 1 1 58 58 ARG H H 1 9.7931 0.0000 . 1 . . . . 58 ARG H . 18647 1 322 . 1 1 58 58 ARG HA H 1 5.9134 0.0000 . 1 . . . . 58 ARG HA . 18647 1 323 . 1 1 58 58 ARG C C 13 174.8725 0.0000 . 1 . . . . 58 ARG C . 18647 1 324 . 1 1 58 58 ARG CA C 13 54.6615 0.0000 . 1 . . . . 58 ARG CA . 18647 1 325 . 1 1 58 58 ARG CB C 13 34.3091 0.0000 . 1 . . . . 58 ARG CB . 18647 1 326 . 1 1 58 58 ARG N N 15 115.0256 0.0000 . 1 . . . . 58 ARG N . 18647 1 327 . 1 1 59 59 LYS H H 1 9.3521 0.0000 . 1 . . . . 59 LYS H . 18647 1 328 . 1 1 59 59 LYS CA C 13 54.5270 0.0000 . 1 . . . . 59 LYS CA . 18647 1 329 . 1 1 59 59 LYS CB C 13 31.3068 0.0000 . 1 . . . . 59 LYS CB . 18647 1 330 . 1 1 59 59 LYS N N 15 119.5596 0.0000 . 1 . . . . 59 LYS N . 18647 1 331 . 1 1 60 60 PRO HA H 1 3.8656 0.0000 . 1 . . . . 60 PRO HA . 18647 1 332 . 1 1 60 60 PRO C C 13 176.1582 0.0000 . 1 . . . . 60 PRO C . 18647 1 333 . 1 1 60 60 PRO CA C 13 64.4819 0.0000 . 1 . . . . 60 PRO CA . 18647 1 334 . 1 1 60 60 PRO CB C 13 31.0200 0.0000 . 1 . . . . 60 PRO CB . 18647 1 335 . 1 1 61 61 SER H H 1 8.4701 0.0000 . 1 . . . . 61 SER H . 18647 1 336 . 1 1 61 61 SER HA H 1 4.1915 0.0000 . 1 . . . . 61 SER HA . 18647 1 337 . 1 1 61 61 SER C C 13 175.7998 0.0000 . 1 . . . . 61 SER C . 18647 1 338 . 1 1 61 61 SER CA C 13 57.9115 0.0000 . 1 . . . . 61 SER CA . 18647 1 339 . 1 1 61 61 SER CB C 13 62.9627 0.0000 . 1 . . . . 61 SER CB . 18647 1 340 . 1 1 61 61 SER N N 15 116.9941 0.0000 . 1 . . . . 61 SER N . 18647 1 341 . 1 1 62 62 GLU H H 1 9.1598 0.0000 . 1 . . . . 62 GLU H . 18647 1 342 . 1 1 62 62 GLU HA H 1 4.4295 0.0000 . 1 . . . . 62 GLU HA . 18647 1 343 . 1 1 62 62 GLU HB2 H 1 2.2628 0.0000 . 2 . . . . 62 GLU HB2 . 18647 1 344 . 1 1 62 62 GLU C C 13 176.6734 0.0000 . 1 . . . . 62 GLU C . 18647 1 345 . 1 1 62 62 GLU CA C 13 56.8510 0.0000 . 1 . . . . 62 GLU CA . 18647 1 346 . 1 1 62 62 GLU CB C 13 29.3539 0.0000 . 1 . . . . 62 GLU CB . 18647 1 347 . 1 1 62 62 GLU N N 15 124.8983 0.0000 . 1 . . . . 62 GLU N . 18647 1 348 . 1 1 63 63 GLU H H 1 8.8283 0.0000 . 1 . . . . 63 GLU H . 18647 1 349 . 1 1 63 63 GLU HA H 1 4.3313 0.0000 . 1 . . . . 63 GLU HA . 18647 1 350 . 1 1 63 63 GLU C C 13 175.0731 0.0000 . 1 . . . . 63 GLU C . 18647 1 351 . 1 1 63 63 GLU CA C 13 55.8219 0.0000 . 1 . . . . 63 GLU CA . 18647 1 352 . 1 1 63 63 GLU CB C 13 30.2035 0.0000 . 1 . . . . 63 GLU CB . 18647 1 353 . 1 1 63 63 GLU N N 15 116.0179 0.0000 . 1 . . . . 63 GLU N . 18647 1 354 . 1 1 64 64 PHE H H 1 7.3984 0.0000 . 1 . . . . 64 PHE H . 18647 1 355 . 1 1 64 64 PHE HA H 1 4.5893 0.0000 . 1 . . . . 64 PHE HA . 18647 1 356 . 1 1 64 64 PHE HB2 H 1 3.0552 0.0000 . 2 . . . . 64 PHE HB2 . 18647 1 357 . 1 1 64 64 PHE C C 13 172.5361 0.0000 . 1 . . . . 64 PHE C . 18647 1 358 . 1 1 64 64 PHE CA C 13 54.7250 0.0000 . 1 . . . . 64 PHE CA . 18647 1 359 . 1 1 64 64 PHE CB C 13 38.3949 0.0000 . 1 . . . . 64 PHE CB . 18647 1 360 . 1 1 64 64 PHE N N 15 115.6302 0.0000 . 1 . . . . 64 PHE N . 18647 1 361 . 1 1 65 65 ASN H H 1 8.4230 0.0000 . 1 . . . . 65 ASN H . 18647 1 362 . 1 1 65 65 ASN HA H 1 4.5208 0.0000 . 1 . . . . 65 ASN HA . 18647 1 363 . 1 1 65 65 ASN HB2 H 1 2.7203 0.0000 . 2 . . . . 65 ASN HB2 . 18647 1 364 . 1 1 65 65 ASN C C 13 173.4439 0.0000 . 1 . . . . 65 ASN C . 18647 1 365 . 1 1 65 65 ASN CA C 13 52.2730 0.0000 . 1 . . . . 65 ASN CA . 18647 1 366 . 1 1 65 65 ASN CB C 13 36.0292 0.0000 . 1 . . . . 65 ASN CB . 18647 1 367 . 1 1 65 65 ASN N N 15 117.5641 0.0000 . 1 . . . . 65 ASN N . 18647 1 368 . 1 1 66 66 GLY H H 1 6.4107 0.0000 . 1 . . . . 66 GLY H . 18647 1 369 . 1 1 66 66 GLY HA2 H 1 3.6061 0.0000 . 2 . . . . 66 GLY HA2 . 18647 1 370 . 1 1 66 66 GLY HA3 H 1 3.0886 0.0000 . 2 . . . . 66 GLY HA3 . 18647 1 371 . 1 1 66 66 GLY C C 13 171.7304 0.0000 . 1 . . . . 66 GLY C . 18647 1 372 . 1 1 66 66 GLY CA C 13 44.7406 0.0000 . 1 . . . . 66 GLY CA . 18647 1 373 . 1 1 66 66 GLY N N 15 111.2723 0.0000 . 1 . . . . 66 GLY N . 18647 1 374 . 1 1 67 67 TYR H H 1 8.6051 0.0000 . 1 . . . . 67 TYR H . 18647 1 375 . 1 1 67 67 TYR HA H 1 4.3734 0.0000 . 1 . . . . 67 TYR HA . 18647 1 376 . 1 1 67 67 TYR C C 13 174.0310 0.0000 . 1 . . . . 67 TYR C . 18647 1 377 . 1 1 67 67 TYR CA C 13 58.8382 0.0000 . 1 . . . . 67 TYR CA . 18647 1 378 . 1 1 67 67 TYR CB C 13 40.8638 0.0000 . 1 . . . . 67 TYR CB . 18647 1 379 . 1 1 67 67 TYR N N 15 120.0188 0.0000 . 1 . . . . 67 TYR N . 18647 1 380 . 1 1 68 68 LEU H H 1 8.9770 0.0000 . 1 . . . . 68 LEU H . 18647 1 381 . 1 1 68 68 LEU HA H 1 4.9695 0.0000 . 1 . . . . 68 LEU HA . 18647 1 382 . 1 1 68 68 LEU C C 13 174.4993 0.0000 . 1 . . . . 68 LEU C . 18647 1 383 . 1 1 68 68 LEU CA C 13 54.7334 0.0000 . 1 . . . . 68 LEU CA . 18647 1 384 . 1 1 68 68 LEU CB C 13 43.2724 0.0000 . 1 . . . . 68 LEU CB . 18647 1 385 . 1 1 68 68 LEU N N 15 123.3678 0.0000 . 1 . . . . 68 LEU N . 18647 1 386 . 1 1 69 69 TYR H H 1 9.6662 0.0000 . 1 . . . . 69 TYR H . 18647 1 387 . 1 1 69 69 TYR HA H 1 5.4229 0.0000 . 1 . . . . 69 TYR HA . 18647 1 388 . 1 1 69 69 TYR C C 13 174.2014 0.0000 . 1 . . . . 69 TYR C . 18647 1 389 . 1 1 69 69 TYR CA C 13 57.4795 0.0000 . 1 . . . . 69 TYR CA . 18647 1 390 . 1 1 69 69 TYR CB C 13 44.6048 0.0000 . 1 . . . . 69 TYR CB . 18647 1 391 . 1 1 69 69 TYR N N 15 125.3630 0.0000 . 1 . . . . 69 TYR N . 18647 1 392 . 1 1 70 70 LYS H H 1 8.6144 0.0000 . 1 . . . . 70 LYS H . 18647 1 393 . 1 1 70 70 LYS HA H 1 5.2344 0.0000 . 1 . . . . 70 LYS HA . 18647 1 394 . 1 1 70 70 LYS C C 13 174.4486 0.0000 . 1 . . . . 70 LYS C . 18647 1 395 . 1 1 70 70 LYS CA C 13 52.8389 0.0000 . 1 . . . . 70 LYS CA . 18647 1 396 . 1 1 70 70 LYS CB C 13 35.2815 0.0000 . 1 . . . . 70 LYS CB . 18647 1 397 . 1 1 70 70 LYS N N 15 121.9086 0.0000 . 1 . . . . 70 LYS N . 18647 1 398 . 1 1 71 71 ALA H H 1 9.1689 0.0000 . 1 . . . . 71 ALA H . 18647 1 399 . 1 1 71 71 ALA HA H 1 5.8468 0.0000 . 1 . . . . 71 ALA HA . 18647 1 400 . 1 1 71 71 ALA HB1 H 1 1.4101 0.0000 . 1 . . . . 71 ALA HB1 . 18647 1 401 . 1 1 71 71 ALA HB2 H 1 1.4101 0.0000 . 1 . . . . 71 ALA HB1 . 18647 1 402 . 1 1 71 71 ALA HB3 H 1 1.4101 0.0000 . 1 . . . . 71 ALA HB1 . 18647 1 403 . 1 1 71 71 ALA C C 13 175.5582 0.0000 . 1 . . . . 71 ALA C . 18647 1 404 . 1 1 71 71 ALA CA C 13 49.4116 0.0000 . 1 . . . . 71 ALA CA . 18647 1 405 . 1 1 71 71 ALA CB C 13 24.1417 0.0000 . 1 . . . . 71 ALA CB . 18647 1 406 . 1 1 71 71 ALA N N 15 128.4353 0.0000 . 1 . . . . 71 ALA N . 18647 1 407 . 1 1 72 72 GLN H H 1 8.3754 0.0000 . 1 . . . . 72 GLN H . 18647 1 408 . 1 1 72 72 GLN HA H 1 5.7030 0.0000 . 1 . . . . 72 GLN HA . 18647 1 409 . 1 1 72 72 GLN C C 13 174.0188 0.0000 . 1 . . . . 72 GLN C . 18647 1 410 . 1 1 72 72 GLN CA C 13 55.9570 0.0000 . 1 . . . . 72 GLN CA . 18647 1 411 . 1 1 72 72 GLN CB C 13 35.5546 0.0000 . 1 . . . . 72 GLN CB . 18647 1 412 . 1 1 72 72 GLN N N 15 117.5766 0.0000 . 1 . . . . 72 GLN N . 18647 1 413 . 1 1 73 73 GLY H H 1 8.4455 0.0000 . 1 . . . . 73 GLY H . 18647 1 414 . 1 1 73 73 GLY HA2 H 1 4.3831 0.0000 . 2 . . . . 73 GLY HA2 . 18647 1 415 . 1 1 73 73 GLY HA3 H 1 3.8528 0.0000 . 2 . . . . 73 GLY HA3 . 18647 1 416 . 1 1 73 73 GLY C C 13 171.0069 0.0000 . 1 . . . . 73 GLY C . 18647 1 417 . 1 1 73 73 GLY CA C 13 45.0836 0.0000 . 1 . . . . 73 GLY CA . 18647 1 418 . 1 1 73 73 GLY N N 15 111.8529 0.0000 . 1 . . . . 73 GLY N . 18647 1 419 . 1 1 74 74 VAL H H 1 9.0138 0.0000 . 1 . . . . 74 VAL H . 18647 1 420 . 1 1 74 74 VAL HA H 1 4.6896 0.0000 . 1 . . . . 74 VAL HA . 18647 1 421 . 1 1 74 74 VAL C C 13 176.5990 0.0000 . 1 . . . . 74 VAL C . 18647 1 422 . 1 1 74 74 VAL CA C 13 62.9964 0.0000 . 1 . . . . 74 VAL CA . 18647 1 423 . 1 1 74 74 VAL CB C 13 32.6862 0.0000 . 1 . . . . 74 VAL CB . 18647 1 424 . 1 1 74 74 VAL N N 15 122.5029 0.0000 . 1 . . . . 74 VAL N . 18647 1 425 . 1 1 75 75 MET H H 1 9.6454 0.0000 . 1 . . . . 75 MET H . 18647 1 426 . 1 1 75 75 MET HA H 1 5.0708 0.0000 . 1 . . . . 75 MET HA . 18647 1 427 . 1 1 75 75 MET C C 13 176.0896 0.0000 . 1 . . . . 75 MET C . 18647 1 428 . 1 1 75 75 MET CA C 13 51.5631 0.0000 . 1 . . . . 75 MET CA . 18647 1 429 . 1 1 75 75 MET CB C 13 32.3713 0.0000 . 1 . . . . 75 MET CB . 18647 1 430 . 1 1 75 75 MET N N 15 125.3661 0.0000 . 1 . . . . 75 MET N . 18647 1 431 . 1 1 76 76 ASP H H 1 9.5212 0.0000 . 1 . . . . 76 ASP H . 18647 1 432 . 1 1 76 76 ASP HA H 1 4.9462 0.0000 . 1 . . . . 76 ASP HA . 18647 1 433 . 1 1 76 76 ASP HB2 H 1 2.8128 0.0000 . 2 . . . . 76 ASP HB2 . 18647 1 434 . 1 1 76 76 ASP HB3 H 1 2.4068 0.0000 . 2 . . . . 76 ASP HB3 . 18647 1 435 . 1 1 76 76 ASP C C 13 175.0084 0.0000 . 1 . . . . 76 ASP C . 18647 1 436 . 1 1 76 76 ASP CA C 13 53.4512 0.0000 . 1 . . . . 76 ASP CA . 18647 1 437 . 1 1 76 76 ASP CB C 13 38.7006 0.0000 . 1 . . . . 76 ASP CB . 18647 1 438 . 1 1 76 76 ASP N N 15 128.5205 0.0000 . 1 . . . . 76 ASP N . 18647 1 439 . 1 1 77 77 ASP H H 1 8.0300 0.0000 . 1 . . . . 77 ASP H . 18647 1 440 . 1 1 77 77 ASP HA H 1 4.6251 0.0000 . 1 . . . . 77 ASP HA . 18647 1 441 . 1 1 77 77 ASP HB2 H 1 2.3203 0.0000 . 2 . . . . 77 ASP HB2 . 18647 1 442 . 1 1 77 77 ASP C C 13 174.8004 0.0000 . 1 . . . . 77 ASP C . 18647 1 443 . 1 1 77 77 ASP CA C 13 52.1524 0.0000 . 1 . . . . 77 ASP CA . 18647 1 444 . 1 1 77 77 ASP CB C 13 44.3215 0.0000 . 1 . . . . 77 ASP CB . 18647 1 445 . 1 1 77 77 ASP N N 15 118.3507 0.0000 . 1 . . . . 77 ASP N . 18647 1 446 . 1 1 78 78 VAL H H 1 9.5829 0.0000 . 1 . . . . 78 VAL H . 18647 1 447 . 1 1 78 78 VAL HA H 1 4.3407 0.0000 . 1 . . . . 78 VAL HA . 18647 1 448 . 1 1 78 78 VAL C C 13 177.7274 0.0000 . 1 . . . . 78 VAL C . 18647 1 449 . 1 1 78 78 VAL CA C 13 60.1150 0.0000 . 1 . . . . 78 VAL CA . 18647 1 450 . 1 1 78 78 VAL CB C 13 32.0345 0.0000 . 1 . . . . 78 VAL CB . 18647 1 451 . 1 1 78 78 VAL N N 15 113.4154 0.0000 . 1 . . . . 78 VAL N . 18647 1 452 . 1 1 79 79 VAL H H 1 7.7582 0.0000 . 1 . . . . 79 VAL H . 18647 1 453 . 1 1 79 79 VAL HA H 1 3.6101 0.0000 . 1 . . . . 79 VAL HA . 18647 1 454 . 1 1 79 79 VAL HB H 1 1.9957 0.0000 . 1 . . . . 79 VAL HB . 18647 1 455 . 1 1 79 79 VAL C C 13 177.9572 0.0000 . 1 . . . . 79 VAL C . 18647 1 456 . 1 1 79 79 VAL CA C 13 65.6897 0.0000 . 1 . . . . 79 VAL CA . 18647 1 457 . 1 1 79 79 VAL CB C 13 31.6736 0.0000 . 1 . . . . 79 VAL CB . 18647 1 458 . 1 1 79 79 VAL N N 15 120.2263 0.0000 . 1 . . . . 79 VAL N . 18647 1 459 . 1 1 80 80 ASN H H 1 8.7672 0.0000 . 1 . . . . 80 ASN H . 18647 1 460 . 1 1 80 80 ASN HA H 1 4.0333 0.0000 . 1 . . . . 80 ASN HA . 18647 1 461 . 1 1 80 80 ASN HB2 H 1 2.6920 0.0000 . 2 . . . . 80 ASN HB2 . 18647 1 462 . 1 1 80 80 ASN C C 13 176.9882 0.0000 . 1 . . . . 80 ASN C . 18647 1 463 . 1 1 80 80 ASN CA C 13 56.9994 0.0000 . 1 . . . . 80 ASN CA . 18647 1 464 . 1 1 80 80 ASN CB C 13 37.1088 0.0000 . 1 . . . . 80 ASN CB . 18647 1 465 . 1 1 80 80 ASN N N 15 114.3193 0.0000 . 1 . . . . 80 ASN N . 18647 1 466 . 1 1 81 81 ASN H H 1 6.7650 0.0000 . 1 . . . . 81 ASN H . 18647 1 467 . 1 1 81 81 ASN HA H 1 4.5846 0.0000 . 1 . . . . 81 ASN HA . 18647 1 468 . 1 1 81 81 ASN C C 13 178.3213 0.0000 . 1 . . . . 81 ASN C . 18647 1 469 . 1 1 81 81 ASN CA C 13 55.1550 0.0000 . 1 . . . . 81 ASN CA . 18647 1 470 . 1 1 81 81 ASN CB C 13 37.3039 0.0000 . 1 . . . . 81 ASN CB . 18647 1 471 . 1 1 81 81 ASN N N 15 115.2365 0.0000 . 1 . . . . 81 ASN N . 18647 1 472 . 1 1 82 82 VAL H H 1 7.6976 0.0000 . 1 . . . . 82 VAL H . 18647 1 473 . 1 1 82 82 VAL HA H 1 3.1507 0.0000 . 1 . . . . 82 VAL HA . 18647 1 474 . 1 1 82 82 VAL C C 13 177.9080 0.0000 . 1 . . . . 82 VAL C . 18647 1 475 . 1 1 82 82 VAL CA C 13 67.0304 0.0000 . 1 . . . . 82 VAL CA . 18647 1 476 . 1 1 82 82 VAL CB C 13 30.7818 0.0000 . 1 . . . . 82 VAL CB . 18647 1 477 . 1 1 82 82 VAL N N 15 121.6739 0.0000 . 1 . . . . 82 VAL N . 18647 1 478 . 1 1 83 83 ILE H H 1 8.2839 0.0000 . 1 . . . . 83 ILE H . 18647 1 479 . 1 1 83 83 ILE HA H 1 3.7470 0.0000 . 1 . . . . 83 ILE HA . 18647 1 480 . 1 1 83 83 ILE HB H 1 2.0742 0.0000 . 1 . . . . 83 ILE HB . 18647 1 481 . 1 1 83 83 ILE C C 13 178.6154 0.0000 . 1 . . . . 83 ILE C . 18647 1 482 . 1 1 83 83 ILE CA C 13 61.2989 0.0000 . 1 . . . . 83 ILE CA . 18647 1 483 . 1 1 83 83 ILE CB C 13 33.3835 0.0000 . 1 . . . . 83 ILE CB . 18647 1 484 . 1 1 83 83 ILE N N 15 117.9606 0.0000 . 1 . . . . 83 ILE N . 18647 1 485 . 1 1 84 84 ASP H H 1 8.4859 0.0000 . 1 . . . . 84 ASP H . 18647 1 486 . 1 1 84 84 ASP HA H 1 4.2652 0.0000 . 1 . . . . 84 ASP HA . 18647 1 487 . 1 1 84 84 ASP HB2 H 1 2.3404 0.0000 . 2 . . . . 84 ASP HB2 . 18647 1 488 . 1 1 84 84 ASP C C 13 177.6772 0.0000 . 1 . . . . 84 ASP C . 18647 1 489 . 1 1 84 84 ASP CA C 13 57.3988 0.0000 . 1 . . . . 84 ASP CA . 18647 1 490 . 1 1 84 84 ASP CB C 13 39.3425 0.0000 . 1 . . . . 84 ASP CB . 18647 1 491 . 1 1 84 84 ASP N N 15 120.8782 0.0000 . 1 . . . . 84 ASP N . 18647 1 492 . 1 1 85 85 HIS H H 1 7.2962 0.0000 . 1 . . . . 85 HIS H . 18647 1 493 . 1 1 85 85 HIS HA H 1 4.2806 0.0000 . 1 . . . . 85 HIS HA . 18647 1 494 . 1 1 85 85 HIS C C 13 174.6486 0.0000 . 1 . . . . 85 HIS C . 18647 1 495 . 1 1 85 85 HIS CA C 13 59.5822 0.0000 . 1 . . . . 85 HIS CA . 18647 1 496 . 1 1 85 85 HIS CB C 13 27.9405 0.0000 . 1 . . . . 85 HIS CB . 18647 1 497 . 1 1 85 85 HIS N N 15 112.8491 0.0000 . 1 . . . . 85 HIS N . 18647 1 498 . 1 1 86 86 ILE H H 1 7.4577 0.0000 . 1 . . . . 86 ILE H . 18647 1 499 . 1 1 86 86 ILE HA H 1 4.2880 0.0000 . 1 . . . . 86 ILE HA . 18647 1 500 . 1 1 86 86 ILE HB H 1 1.3170 0.0000 . 1 . . . . 86 ILE HB . 18647 1 501 . 1 1 86 86 ILE C C 13 175.5989 0.0000 . 1 . . . . 86 ILE C . 18647 1 502 . 1 1 86 86 ILE CA C 13 64.3883 0.0000 . 1 . . . . 86 ILE CA . 18647 1 503 . 1 1 86 86 ILE CB C 13 39.8899 0.0000 . 1 . . . . 86 ILE CB . 18647 1 504 . 1 1 86 86 ILE N N 15 120.8743 0.0000 . 1 . . . . 86 ILE N . 18647 1 505 . 1 1 87 87 ARG H H 1 8.0167 0.0000 . 1 . . . . 87 ARG H . 18647 1 506 . 1 1 87 87 ARG CA C 13 55.1467 0.0000 . 1 . . . . 87 ARG CA . 18647 1 507 . 1 1 87 87 ARG CB C 13 28.4975 0.0000 . 1 . . . . 87 ARG CB . 18647 1 508 . 1 1 87 87 ARG N N 15 119.2820 0.0000 . 1 . . . . 87 ARG N . 18647 1 509 . 1 1 88 88 PRO HA H 1 3.7819 0.0000 . 1 . . . . 88 PRO HA . 18647 1 510 . 1 1 88 88 PRO C C 13 176.1460 0.0000 . 1 . . . . 88 PRO C . 18647 1 511 . 1 1 88 88 PRO CA C 13 64.4220 0.0000 . 1 . . . . 88 PRO CA . 18647 1 512 . 1 1 88 88 PRO CB C 13 31.4062 0.0000 . 1 . . . . 88 PRO CB . 18647 1 513 . 1 1 89 89 GLY H H 1 6.5680 0.0000 . 1 . . . . 89 GLY H . 18647 1 514 . 1 1 89 89 GLY CA C 13 43.7968 0.0000 . 1 . . . . 89 GLY CA . 18647 1 515 . 1 1 89 89 GLY N N 15 110.0240 0.0000 . 1 . . . . 89 GLY N . 18647 1 516 . 1 1 90 90 PRO HA H 1 4.0346 0.0000 . 1 . . . . 90 PRO HA . 18647 1 517 . 1 1 90 90 PRO C C 13 177.9845 0.0000 . 1 . . . . 90 PRO C . 18647 1 518 . 1 1 90 90 PRO CA C 13 64.5956 0.0000 . 1 . . . . 90 PRO CA . 18647 1 519 . 1 1 90 90 PRO CB C 13 31.1184 0.0000 . 1 . . . . 90 PRO CB . 18647 1 520 . 1 1 91 91 TRP H H 1 7.3842 0.0000 . 1 . . . . 91 TRP H . 18647 1 521 . 1 1 91 91 TRP HA H 1 4.6232 0.0000 . 1 . . . . 91 TRP HA . 18647 1 522 . 1 1 91 91 TRP C C 13 177.7942 0.0000 . 1 . . . . 91 TRP C . 18647 1 523 . 1 1 91 91 TRP CA C 13 58.1987 0.0000 . 1 . . . . 91 TRP CA . 18647 1 524 . 1 1 91 91 TRP CB C 13 27.5986 0.0000 . 1 . . . . 91 TRP CB . 18647 1 525 . 1 1 91 91 TRP N N 15 116.4758 0.0000 . 1 . . . . 91 TRP N . 18647 1 526 . 1 1 92 92 ARG H H 1 7.1364 0.0000 . 1 . . . . 92 ARG H . 18647 1 527 . 1 1 92 92 ARG HA H 1 4.1338 0.0000 . 1 . . . . 92 ARG HA . 18647 1 528 . 1 1 92 92 ARG C C 13 176.0873 0.0000 . 1 . . . . 92 ARG C . 18647 1 529 . 1 1 92 92 ARG CA C 13 57.4318 0.0000 . 1 . . . . 92 ARG CA . 18647 1 530 . 1 1 92 92 ARG CB C 13 28.3585 0.0000 . 1 . . . . 92 ARG CB . 18647 1 531 . 1 1 92 92 ARG N N 15 121.5604 0.0000 . 1 . . . . 92 ARG N . 18647 1 532 . 1 1 93 93 LEU H H 1 6.8543 0.0000 . 1 . . . . 93 LEU H . 18647 1 533 . 1 1 93 93 LEU HA H 1 3.6719 0.0000 . 1 . . . . 93 LEU HA . 18647 1 534 . 1 1 93 93 LEU HB2 H 1 1.4865 0.0000 . 2 . . . . 93 LEU HB2 . 18647 1 535 . 1 1 93 93 LEU C C 13 177.4353 0.0000 . 1 . . . . 93 LEU C . 18647 1 536 . 1 1 93 93 LEU CA C 13 56.2134 0.0000 . 1 . . . . 93 LEU CA . 18647 1 537 . 1 1 93 93 LEU CB C 13 40.9484 0.0000 . 1 . . . . 93 LEU CB . 18647 1 538 . 1 1 93 93 LEU N N 15 114.8610 0.0000 . 1 . . . . 93 LEU N . 18647 1 539 . 1 1 94 94 ASP H H 1 7.3357 0.0000 . 1 . . . . 94 ASP H . 18647 1 540 . 1 1 94 94 ASP HA H 1 4.3037 0.0000 . 1 . . . . 94 ASP HA . 18647 1 541 . 1 1 94 94 ASP HB2 H 1 2.8121 0.0000 . 2 . . . . 94 ASP HB2 . 18647 1 542 . 1 1 94 94 ASP C C 13 177.0013 0.0000 . 1 . . . . 94 ASP C . 18647 1 543 . 1 1 94 94 ASP CA C 13 57.0272 0.0000 . 1 . . . . 94 ASP CA . 18647 1 544 . 1 1 94 94 ASP CB C 13 41.0797 0.0000 . 1 . . . . 94 ASP CB . 18647 1 545 . 1 1 94 94 ASP N N 15 115.2156 0.0000 . 1 . . . . 94 ASP N . 18647 1 546 . 1 1 95 95 TRP H H 1 6.7322 0.0000 . 1 . . . . 95 TRP H . 18647 1 547 . 1 1 95 95 TRP HA H 1 4.8009 0.0000 . 1 . . . . 95 TRP HA . 18647 1 548 . 1 1 95 95 TRP C C 13 175.8194 0.0000 . 1 . . . . 95 TRP C . 18647 1 549 . 1 1 95 95 TRP CA C 13 55.7056 0.0000 . 1 . . . . 95 TRP CA . 18647 1 550 . 1 1 95 95 TRP CB C 13 30.4303 0.0000 . 1 . . . . 95 TRP CB . 18647 1 551 . 1 1 95 95 TRP N N 15 110.7676 0.0000 . 1 . . . . 95 TRP N . 18647 1 552 . 1 1 96 96 ASP H H 1 6.5104 0.0000 . 1 . . . . 96 ASP H . 18647 1 553 . 1 1 96 96 ASP HA H 1 3.8625 0.0000 . 1 . . . . 96 ASP HA . 18647 1 554 . 1 1 96 96 ASP C C 13 176.6561 0.0000 . 1 . . . . 96 ASP C . 18647 1 555 . 1 1 96 96 ASP CA C 13 54.7289 0.0000 . 1 . . . . 96 ASP CA . 18647 1 556 . 1 1 96 96 ASP CB C 13 38.5920 0.0000 . 1 . . . . 96 ASP CB . 18647 1 557 . 1 1 96 96 ASP N N 15 123.2458 0.0000 . 1 . . . . 96 ASP N . 18647 1 558 . 1 1 97 97 ARG H H 1 7.4010 0.0000 . 1 . . . . 97 ARG H . 18647 1 559 . 1 1 97 97 ARG C C 13 177.3156 0.0000 . 1 . . . . 97 ARG C . 18647 1 560 . 1 1 97 97 ARG CA C 13 57.1781 0.0000 . 1 . . . . 97 ARG CA . 18647 1 561 . 1 1 97 97 ARG CB C 13 28.6260 0.0000 . 1 . . . . 97 ARG CB . 18647 1 562 . 1 1 97 97 ARG N N 15 123.6732 0.0000 . 1 . . . . 97 ARG N . 18647 1 563 . 1 1 98 98 LEU H H 1 7.8995 0.0000 . 1 . . . . 98 LEU H . 18647 1 564 . 1 1 98 98 LEU HA H 1 4.2505 0.0000 . 1 . . . . 98 LEU HA . 18647 1 565 . 1 1 98 98 LEU HB2 H 1 1.9902 0.0000 . 2 . . . . 98 LEU HB2 . 18647 1 566 . 1 1 98 98 LEU C C 13 176.5699 0.0000 . 1 . . . . 98 LEU C . 18647 1 567 . 1 1 98 98 LEU CA C 13 55.7702 0.0000 . 1 . . . . 98 LEU CA . 18647 1 568 . 1 1 98 98 LEU CB C 13 41.8388 0.0000 . 1 . . . . 98 LEU CB . 18647 1 569 . 1 1 98 98 LEU N N 15 120.8789 0.0000 . 1 . . . . 98 LEU N . 18647 1 570 . 1 1 99 99 MET H H 1 7.0156 0.0000 . 1 . . . . 99 MET H . 18647 1 571 . 1 1 99 99 MET HA H 1 4.7637 0.0000 . 1 . . . . 99 MET HA . 18647 1 572 . 1 1 99 99 MET HB2 H 1 1.7502 0.0000 . 2 . . . . 99 MET HB2 . 18647 1 573 . 1 1 99 99 MET C C 13 176.5506 0.0000 . 1 . . . . 99 MET C . 18647 1 574 . 1 1 99 99 MET CA C 13 55.5643 0.0000 . 1 . . . . 99 MET CA . 18647 1 575 . 1 1 99 99 MET CB C 13 34.2966 0.0000 . 1 . . . . 99 MET CB . 18647 1 576 . 1 1 99 99 MET N N 15 116.8406 0.0000 . 1 . . . . 99 MET N . 18647 1 577 . 1 1 100 100 THR H H 1 8.7962 0.0000 . 1 . . . . 100 THR H . 18647 1 578 . 1 1 100 100 THR HA H 1 4.4327 0.0000 . 1 . . . . 100 THR HA . 18647 1 579 . 1 1 100 100 THR C C 13 175.2499 0.0000 . 1 . . . . 100 THR C . 18647 1 580 . 1 1 100 100 THR CA C 13 60.8744 0.0000 . 1 . . . . 100 THR CA . 18647 1 581 . 1 1 100 100 THR CB C 13 69.5499 0.0000 . 1 . . . . 100 THR CB . 18647 1 582 . 1 1 100 100 THR N N 15 110.8812 0.0000 . 1 . . . . 100 THR N . 18647 1 583 . 1 1 101 101 SER H H 1 7.6001 0.0000 . 1 . . . . 101 SER H . 18647 1 584 . 1 1 101 101 SER HA H 1 4.2993 0.0000 . 1 . . . . 101 SER HA . 18647 1 585 . 1 1 101 101 SER C C 13 170.9891 0.0000 . 1 . . . . 101 SER C . 18647 1 586 . 1 1 101 101 SER CA C 13 59.2142 0.0000 . 1 . . . . 101 SER CA . 18647 1 587 . 1 1 101 101 SER CB C 13 64.6574 0.0000 . 1 . . . . 101 SER CB . 18647 1 588 . 1 1 101 101 SER N N 15 115.0714 0.0000 . 1 . . . . 101 SER N . 18647 1 589 . 1 1 102 102 LEU H H 1 8.3137 0.0000 . 1 . . . . 102 LEU H . 18647 1 590 . 1 1 102 102 LEU HA H 1 4.6896 0.0000 . 1 . . . . 102 LEU HA . 18647 1 591 . 1 1 102 102 LEU C C 13 174.0863 0.0000 . 1 . . . . 102 LEU C . 18647 1 592 . 1 1 102 102 LEU CA C 13 56.8586 0.0000 . 1 . . . . 102 LEU CA . 18647 1 593 . 1 1 102 102 LEU CB C 13 42.8261 0.0000 . 1 . . . . 102 LEU CB . 18647 1 594 . 1 1 102 102 LEU N N 15 120.7248 0.0000 . 1 . . . . 102 LEU N . 18647 1 595 . 1 1 103 103 ASP H H 1 9.6523 0.0000 . 1 . . . . 103 ASP H . 18647 1 596 . 1 1 103 103 ASP HA H 1 4.9155 0.0000 . 1 . . . . 103 ASP HA . 18647 1 597 . 1 1 103 103 ASP HB2 H 1 2.5105 0.0000 . 2 . . . . 103 ASP HB2 . 18647 1 598 . 1 1 103 103 ASP C C 13 174.6195 0.0000 . 1 . . . . 103 ASP C . 18647 1 599 . 1 1 103 103 ASP CA C 13 52.6470 0.0000 . 1 . . . . 103 ASP CA . 18647 1 600 . 1 1 103 103 ASP CB C 13 44.4262 0.0000 . 1 . . . . 103 ASP CB . 18647 1 601 . 1 1 103 103 ASP N N 15 125.3580 0.0000 . 1 . . . . 103 ASP N . 18647 1 602 . 1 1 104 104 VAL H H 1 8.9946 0.0000 . 1 . . . . 104 VAL H . 18647 1 603 . 1 1 104 104 VAL HA H 1 3.8648 0.0000 . 1 . . . . 104 VAL HA . 18647 1 604 . 1 1 104 104 VAL HB H 1 1.9062 0.0000 . 1 . . . . 104 VAL HB . 18647 1 605 . 1 1 104 104 VAL C C 13 175.7817 0.0000 . 1 . . . . 104 VAL C . 18647 1 606 . 1 1 104 104 VAL CA C 13 63.5115 0.0000 . 1 . . . . 104 VAL CA . 18647 1 607 . 1 1 104 104 VAL CB C 13 29.8315 0.0000 . 1 . . . . 104 VAL CB . 18647 1 608 . 1 1 104 104 VAL N N 15 124.1650 0.0000 . 1 . . . . 104 VAL N . 18647 1 609 . 1 1 105 105 LEU H H 1 8.4803 0.0000 . 1 . . . . 105 LEU H . 18647 1 610 . 1 1 105 105 LEU HA H 1 4.0514 0.0000 . 1 . . . . 105 LEU HA . 18647 1 611 . 1 1 105 105 LEU C C 13 177.2544 0.0000 . 1 . . . . 105 LEU C . 18647 1 612 . 1 1 105 105 LEU CA C 13 56.3199 0.0000 . 1 . . . . 105 LEU CA . 18647 1 613 . 1 1 105 105 LEU CB C 13 41.6376 0.0000 . 1 . . . . 105 LEU CB . 18647 1 614 . 1 1 105 105 LEU N N 15 129.0381 0.0000 . 1 . . . . 105 LEU N . 18647 1 615 . 1 1 106 106 GLU H H 1 7.1953 0.0000 . 1 . . . . 106 GLU H . 18647 1 616 . 1 1 106 106 GLU HA H 1 4.3734 0.0000 . 1 . . . . 106 GLU HA . 18647 1 617 . 1 1 106 106 GLU C C 13 173.9513 0.0000 . 1 . . . . 106 GLU C . 18647 1 618 . 1 1 106 106 GLU CA C 13 55.2616 0.0000 . 1 . . . . 106 GLU CA . 18647 1 619 . 1 1 106 106 GLU CB C 13 32.3287 0.0000 . 1 . . . . 106 GLU CB . 18647 1 620 . 1 1 106 106 GLU N N 15 114.9129 0.0000 . 1 . . . . 106 GLU N . 18647 1 621 . 1 1 107 107 HIS H H 1 8.9770 0.0000 . 1 . . . . 107 HIS H . 18647 1 622 . 1 1 107 107 HIS HA H 1 4.4603 0.0000 . 1 . . . . 107 HIS HA . 18647 1 623 . 1 1 107 107 HIS HB2 H 1 2.9394 0.0000 . 2 . . . . 107 HIS HB2 . 18647 1 624 . 1 1 107 107 HIS C C 13 173.6887 0.0000 . 1 . . . . 107 HIS C . 18647 1 625 . 1 1 107 107 HIS CA C 13 55.3504 0.0000 . 1 . . . . 107 HIS CA . 18647 1 626 . 1 1 107 107 HIS CB C 13 29.8963 0.0000 . 1 . . . . 107 HIS CB . 18647 1 627 . 1 1 107 107 HIS N N 15 123.3678 0.0000 . 1 . . . . 107 HIS N . 18647 1 628 . 1 1 108 108 PHE H H 1 8.0352 0.0000 . 1 . . . . 108 PHE H . 18647 1 629 . 1 1 108 108 PHE HA H 1 4.8688 0.0000 . 1 . . . . 108 PHE HA . 18647 1 630 . 1 1 108 108 PHE HB2 H 1 3.3870 0.0000 . 2 . . . . 108 PHE HB2 . 18647 1 631 . 1 1 108 108 PHE HB3 H 1 2.7600 0.0000 . 2 . . . . 108 PHE HB3 . 18647 1 632 . 1 1 108 108 PHE C C 13 175.4910 0.0000 . 1 . . . . 108 PHE C . 18647 1 633 . 1 1 108 108 PHE CA C 13 58.2086 0.0000 . 1 . . . . 108 PHE CA . 18647 1 634 . 1 1 108 108 PHE CB C 13 39.4403 0.0000 . 1 . . . . 108 PHE CB . 18647 1 635 . 1 1 108 108 PHE N N 15 122.7777 0.0000 . 1 . . . . 108 PHE N . 18647 1 636 . 1 1 109 109 GLU H H 1 8.4278 0.0000 . 1 . . . . 109 GLU H . 18647 1 637 . 1 1 109 109 GLU HA H 1 4.4647 0.0000 . 1 . . . . 109 GLU HA . 18647 1 638 . 1 1 109 109 GLU HB2 H 1 2.3073 0.0000 . 2 . . . . 109 GLU HB2 . 18647 1 639 . 1 1 109 109 GLU C C 13 176.2722 0.0000 . 1 . . . . 109 GLU C . 18647 1 640 . 1 1 109 109 GLU CA C 13 55.9767 0.0000 . 1 . . . . 109 GLU CA . 18647 1 641 . 1 1 109 109 GLU CB C 13 31.1929 0.0000 . 1 . . . . 109 GLU CB . 18647 1 642 . 1 1 109 109 GLU N N 15 116.2444 0.0000 . 1 . . . . 109 GLU N . 18647 1 643 . 1 1 110 110 GLU H H 1 9.1330 0.0000 . 1 . . . . 110 GLU H . 18647 1 644 . 1 1 110 110 GLU HA H 1 4.0757 0.0000 . 1 . . . . 110 GLU HA . 18647 1 645 . 1 1 110 110 GLU HB2 H 1 2.0768 0.0000 . 2 . . . . 110 GLU HB2 . 18647 1 646 . 1 1 110 110 GLU C C 13 176.8886 0.0000 . 1 . . . . 110 GLU C . 18647 1 647 . 1 1 110 110 GLU CA C 13 59.3823 0.0000 . 1 . . . . 110 GLU CA . 18647 1 648 . 1 1 110 110 GLU CB C 13 28.5266 0.0000 . 1 . . . . 110 GLU CB . 18647 1 649 . 1 1 110 110 GLU N N 15 120.3708 0.0000 . 1 . . . . 110 GLU N . 18647 1 650 . 1 1 111 111 ASN H H 1 8.5328 0.0000 . 1 . . . . 111 ASN H . 18647 1 651 . 1 1 111 111 ASN HA H 1 4.7435 0.0000 . 1 . . . . 111 ASN HA . 18647 1 652 . 1 1 111 111 ASN HB2 H 1 3.3331 0.0000 . 2 . . . . 111 ASN HB2 . 18647 1 653 . 1 1 111 111 ASN C C 13 175.3908 0.0000 . 1 . . . . 111 ASN C . 18647 1 654 . 1 1 111 111 ASN CA C 13 53.4925 0.0000 . 1 . . . . 111 ASN CA . 18647 1 655 . 1 1 111 111 ASN CB C 13 38.2677 0.0000 . 1 . . . . 111 ASN CB . 18647 1 656 . 1 1 111 111 ASN N N 15 112.5441 0.0000 . 1 . . . . 111 ASN N . 18647 1 657 . 1 1 112 112 CYS H H 1 7.6879 0.0000 . 1 . . . . 112 CYS H . 18647 1 658 . 1 1 112 112 CYS HA H 1 5.7558 0.0000 . 1 . . . . 112 CYS HA . 18647 1 659 . 1 1 112 112 CYS HB2 H 1 3.0952 0.0000 . 2 . . . . 112 CYS HB2 . 18647 1 660 . 1 1 112 112 CYS C C 13 173.3037 0.0000 . 1 . . . . 112 CYS C . 18647 1 661 . 1 1 112 112 CYS CA C 13 57.8429 0.0000 . 1 . . . . 112 CYS CA . 18647 1 662 . 1 1 112 112 CYS CB C 13 30.0216 0.0000 . 1 . . . . 112 CYS CB . 18647 1 663 . 1 1 112 112 CYS N N 15 119.0792 0.0000 . 1 . . . . 112 CYS N . 18647 1 664 . 1 1 113 113 CYS H H 1 8.9764 0.0000 . 1 . . . . 113 CYS H . 18647 1 665 . 1 1 113 113 CYS HA H 1 5.0664 0.0000 . 1 . . . . 113 CYS HA . 18647 1 666 . 1 1 113 113 CYS C C 13 171.1199 0.0000 . 1 . . . . 113 CYS C . 18647 1 667 . 1 1 113 113 CYS CA C 13 56.1729 0.0000 . 1 . . . . 113 CYS CA . 18647 1 668 . 1 1 113 113 CYS CB C 13 30.6787 0.0000 . 1 . . . . 113 CYS CB . 18647 1 669 . 1 1 113 113 CYS N N 15 121.0707 0.0000 . 1 . . . . 113 CYS N . 18647 1 670 . 1 1 114 114 VAL H H 1 8.2149 0.0000 . 1 . . . . 114 VAL H . 18647 1 671 . 1 1 114 114 VAL HA H 1 4.9695 0.0000 . 1 . . . . 114 VAL HA . 18647 1 672 . 1 1 114 114 VAL C C 13 174.4993 0.0000 . 1 . . . . 114 VAL C . 18647 1 673 . 1 1 114 114 VAL CA C 13 61.7125 0.0000 . 1 . . . . 114 VAL CA . 18647 1 674 . 1 1 114 114 VAL CB C 13 33.3107 0.0000 . 1 . . . . 114 VAL CB . 18647 1 675 . 1 1 114 114 VAL N N 15 116.9137 0.0000 . 1 . . . . 114 VAL N . 18647 1 676 . 1 1 115 115 MET H H 1 9.6662 0.0000 . 1 . . . . 115 MET H . 18647 1 677 . 1 1 115 115 MET HA H 1 5.1397 0.0000 . 1 . . . . 115 MET HA . 18647 1 678 . 1 1 115 115 MET C C 13 181.0481 0.0000 . 1 . . . . 115 MET C . 18647 1 679 . 1 1 115 115 MET CA C 13 52.7650 0.0000 . 1 . . . . 115 MET CA . 18647 1 680 . 1 1 115 115 MET CB C 13 35.1021 0.0000 . 1 . . . . 115 MET CB . 18647 1 681 . 1 1 115 115 MET N N 15 125.3630 0.0000 . 1 . . . . 115 MET N . 18647 1 682 . 1 1 116 116 ARG H H 1 9.2026 0.0000 . 1 . . . . 116 ARG H . 18647 1 683 . 1 1 116 116 ARG HA H 1 5.7220 0.0000 . 1 . . . . 116 ARG HA . 18647 1 684 . 1 1 116 116 ARG C C 13 173.8805 0.0000 . 1 . . . . 116 ARG C . 18647 1 685 . 1 1 116 116 ARG CA C 13 52.9992 0.0000 . 1 . . . . 116 ARG CA . 18647 1 686 . 1 1 116 116 ARG CB C 13 33.9155 0.0000 . 1 . . . . 116 ARG CB . 18647 1 687 . 1 1 116 116 ARG N N 15 121.7634 0.0000 . 1 . . . . 116 ARG N . 18647 1 688 . 1 1 117 117 TYR H H 1 8.8507 0.0000 . 1 . . . . 117 TYR H . 18647 1 689 . 1 1 117 117 TYR HA H 1 5.2098 0.0000 . 1 . . . . 117 TYR HA . 18647 1 690 . 1 1 117 117 TYR C C 13 173.1617 0.0000 . 1 . . . . 117 TYR C . 18647 1 691 . 1 1 117 117 TYR CA C 13 55.9101 0.0000 . 1 . . . . 117 TYR CA . 18647 1 692 . 1 1 117 117 TYR CB C 13 40.8494 0.0000 . 1 . . . . 117 TYR CB . 18647 1 693 . 1 1 117 117 TYR N N 15 121.5381 0.0000 . 1 . . . . 117 TYR N . 18647 1 694 . 1 1 118 118 THR H H 1 7.5993 0.0000 . 1 . . . . 118 THR H . 18647 1 695 . 1 1 118 118 THR HA H 1 5.5268 0.0000 . 1 . . . . 118 THR HA . 18647 1 696 . 1 1 118 118 THR HB H 1 3.8914 0.0000 . 1 . . . . 118 THR HB . 18647 1 697 . 1 1 118 118 THR C C 13 175.0894 0.0000 . 1 . . . . 118 THR C . 18647 1 698 . 1 1 118 118 THR CA C 13 57.7238 0.0000 . 1 . . . . 118 THR CA . 18647 1 699 . 1 1 118 118 THR CB C 13 72.4788 0.0000 . 1 . . . . 118 THR CB . 18647 1 700 . 1 1 118 118 THR N N 15 107.4223 0.0000 . 1 . . . . 118 THR N . 18647 1 701 . 1 1 119 119 THR H H 1 9.1022 0.0000 . 1 . . . . 119 THR H . 18647 1 702 . 1 1 119 119 THR HA H 1 5.6668 0.0000 . 1 . . . . 119 THR HA . 18647 1 703 . 1 1 119 119 THR C C 13 175.8824 0.0000 . 1 . . . . 119 THR C . 18647 1 704 . 1 1 119 119 THR CA C 13 58.7971 0.0000 . 1 . . . . 119 THR CA . 18647 1 705 . 1 1 119 119 THR CB C 13 71.5582 0.0000 . 1 . . . . 119 THR CB . 18647 1 706 . 1 1 119 119 THR N N 15 111.1512 0.0000 . 1 . . . . 119 THR N . 18647 1 707 . 1 1 120 120 ALA H H 1 8.6656 0.0000 . 1 . . . . 120 ALA H . 18647 1 708 . 1 1 120 120 ALA HA H 1 4.3562 0.0000 . 1 . . . . 120 ALA HA . 18647 1 709 . 1 1 120 120 ALA HB1 H 1 1.4334 0.0000 . 1 . . . . 120 ALA HB1 . 18647 1 710 . 1 1 120 120 ALA HB2 H 1 1.4334 0.0000 . 1 . . . . 120 ALA HB1 . 18647 1 711 . 1 1 120 120 ALA HB3 H 1 1.4334 0.0000 . 1 . . . . 120 ALA HB1 . 18647 1 712 . 1 1 120 120 ALA C C 13 178.2119 0.0000 . 1 . . . . 120 ALA C . 18647 1 713 . 1 1 120 120 ALA CA C 13 51.2527 0.0000 . 1 . . . . 120 ALA CA . 18647 1 714 . 1 1 120 120 ALA CB C 13 18.9679 0.0000 . 1 . . . . 120 ALA CB . 18647 1 715 . 1 1 120 120 ALA N N 15 124.0165 0.0000 . 1 . . . . 120 ALA N . 18647 1 716 . 1 1 121 121 GLY H H 1 8.6764 0.0000 . 1 . . . . 121 GLY H . 18647 1 717 . 1 1 121 121 GLY HA2 H 1 3.8805 0.0000 . 2 . . . . 121 GLY HA2 . 18647 1 718 . 1 1 121 121 GLY C C 13 173.8604 0.0000 . 1 . . . . 121 GLY C . 18647 1 719 . 1 1 121 121 GLY CA C 13 45.1166 0.0000 . 1 . . . . 121 GLY CA . 18647 1 720 . 1 1 121 121 GLY N N 15 107.1680 0.0000 . 1 . . . . 121 GLY N . 18647 1 721 . 1 1 122 122 GLN H H 1 9.0859 0.0000 . 1 . . . . 122 GLN H . 18647 1 722 . 1 1 122 122 GLN HA H 1 4.7156 0.0000 . 1 . . . . 122 GLN HA . 18647 1 723 . 1 1 122 122 GLN C C 13 175.1100 0.0000 . 1 . . . . 122 GLN C . 18647 1 724 . 1 1 122 122 GLN CA C 13 54.7994 0.0000 . 1 . . . . 122 GLN CA . 18647 1 725 . 1 1 122 122 GLN CB C 13 33.9422 0.0000 . 1 . . . . 122 GLN CB . 18647 1 726 . 1 1 122 122 GLN N N 15 119.5947 0.0000 . 1 . . . . 122 GLN N . 18647 1 727 . 1 1 123 123 LEU H H 1 9.0876 0.0000 . 1 . . . . 123 LEU H . 18647 1 728 . 1 1 123 123 LEU HA H 1 3.8809 0.0000 . 1 . . . . 123 LEU HA . 18647 1 729 . 1 1 123 123 LEU HB2 H 1 1.7343 0.0000 . 2 . . . . 123 LEU HB2 . 18647 1 730 . 1 1 123 123 LEU C C 13 177.0812 0.0000 . 1 . . . . 123 LEU C . 18647 1 731 . 1 1 123 123 LEU CA C 13 54.8652 0.0000 . 1 . . . . 123 LEU CA . 18647 1 732 . 1 1 123 123 LEU CB C 13 38.6633 0.0000 . 1 . . . . 123 LEU CB . 18647 1 733 . 1 1 123 123 LEU N N 15 119.7857 0.0000 . 1 . . . . 123 LEU N . 18647 1 734 . 1 1 124 124 ASP H H 1 8.6371 0.0000 . 1 . . . . 124 ASP H . 18647 1 735 . 1 1 124 124 ASP HA H 1 4.1154 0.0000 . 1 . . . . 124 ASP HA . 18647 1 736 . 1 1 124 124 ASP HB2 H 1 2.8481 0.0000 . 2 . . . . 124 ASP HB2 . 18647 1 737 . 1 1 124 124 ASP HB3 H 1 2.6082 0.0000 . 2 . . . . 124 ASP HB3 . 18647 1 738 . 1 1 124 124 ASP C C 13 175.4184 0.0000 . 1 . . . . 124 ASP C . 18647 1 739 . 1 1 124 124 ASP CA C 13 55.9101 0.0000 . 1 . . . . 124 ASP CA . 18647 1 740 . 1 1 124 124 ASP CB C 13 38.7412 0.0000 . 1 . . . . 124 ASP CB . 18647 1 741 . 1 1 124 124 ASP N N 15 119.4776 0.0000 . 1 . . . . 124 ASP N . 18647 1 742 . 1 1 125 125 ASN H H 1 7.8030 0.0000 . 1 . . . . 125 ASN H . 18647 1 743 . 1 1 125 125 ASN HA H 1 3.9591 0.0000 . 1 . . . . 125 ASN HA . 18647 1 744 . 1 1 125 125 ASN HB2 H 1 2.8374 0.0000 . 2 . . . . 125 ASN HB2 . 18647 1 745 . 1 1 125 125 ASN C C 13 175.2430 0.0000 . 1 . . . . 125 ASN C . 18647 1 746 . 1 1 125 125 ASN CA C 13 54.8861 0.0000 . 1 . . . . 125 ASN CA . 18647 1 747 . 1 1 125 125 ASN CB C 13 37.7751 0.0000 . 1 . . . . 125 ASN CB . 18647 1 748 . 1 1 125 125 ASN N N 15 110.6639 0.0000 . 1 . . . . 125 ASN N . 18647 1 749 . 1 1 126 126 ILE H H 1 7.9084 0.0000 . 1 . . . . 126 ILE H . 18647 1 750 . 1 1 126 126 ILE HA H 1 3.9323 0.0000 . 1 . . . . 126 ILE HA . 18647 1 751 . 1 1 126 126 ILE HB H 1 2.0632 0.0000 . 1 . . . . 126 ILE HB . 18647 1 752 . 1 1 126 126 ILE C C 13 177.4547 0.0000 . 1 . . . . 126 ILE C . 18647 1 753 . 1 1 126 126 ILE CA C 13 64.1434 0.0000 . 1 . . . . 126 ILE CA . 18647 1 754 . 1 1 126 126 ILE CB C 13 36.7367 0.0000 . 1 . . . . 126 ILE CB . 18647 1 755 . 1 1 126 126 ILE N N 15 120.9630 0.0000 . 1 . . . . 126 ILE N . 18647 1 756 . 1 1 127 127 ILE H H 1 7.7431 0.0000 . 1 . . . . 127 ILE H . 18647 1 757 . 1 1 127 127 ILE HA H 1 4.1010 0.0000 . 1 . . . . 127 ILE HA . 18647 1 758 . 1 1 127 127 ILE C C 13 174.5712 0.0000 . 1 . . . . 127 ILE C . 18647 1 759 . 1 1 127 127 ILE CA C 13 60.4943 0.0000 . 1 . . . . 127 ILE CA . 18647 1 760 . 1 1 127 127 ILE CB C 13 37.0562 0.0000 . 1 . . . . 127 ILE CB . 18647 1 761 . 1 1 127 127 ILE N N 15 118.9511 0.0000 . 1 . . . . 127 ILE N . 18647 1 762 . 1 1 128 128 SER H H 1 8.3053 0.0000 . 1 . . . . 128 SER H . 18647 1 763 . 1 1 128 128 SER CA C 13 58.5465 0.0000 . 1 . . . . 128 SER CA . 18647 1 764 . 1 1 128 128 SER CB C 13 60.6924 0.0000 . 1 . . . . 128 SER CB . 18647 1 765 . 1 1 128 128 SER N N 15 123.4326 0.0000 . 1 . . . . 128 SER N . 18647 1 766 . 1 1 129 129 PRO HA H 1 4.1965 0.0000 . 1 . . . . 129 PRO HA . 18647 1 767 . 1 1 129 129 PRO C C 13 175.5288 0.0000 . 1 . . . . 129 PRO C . 18647 1 768 . 1 1 129 129 PRO CA C 13 66.1215 0.0000 . 1 . . . . 129 PRO CA . 18647 1 769 . 1 1 129 129 PRO CB C 13 33.0357 0.0000 . 1 . . . . 129 PRO CB . 18647 1 770 . 1 1 130 130 ARG H H 1 7.7388 0.0000 . 1 . . . . 130 ARG H . 18647 1 771 . 1 1 130 130 ARG HA H 1 5.4295 0.0000 . 1 . . . . 130 ARG HA . 18647 1 772 . 1 1 130 130 ARG C C 13 175.2968 0.0000 . 1 . . . . 130 ARG C . 18647 1 773 . 1 1 130 130 ARG CA C 13 53.0757 0.0000 . 1 . . . . 130 ARG CA . 18647 1 774 . 1 1 130 130 ARG CB C 13 35.1951 0.0000 . 1 . . . . 130 ARG CB . 18647 1 775 . 1 1 130 130 ARG N N 15 126.0586 0.0000 . 1 . . . . 130 ARG N . 18647 1 776 . 1 1 131 131 GLU H H 1 8.3271 0.0000 . 1 . . . . 131 GLU H . 18647 1 777 . 1 1 131 131 GLU HA H 1 4.9429 0.0000 . 1 . . . . 131 GLU HA . 18647 1 778 . 1 1 131 131 GLU HB2 H 1 2.4722 0.0000 . 2 . . . . 131 GLU HB2 . 18647 1 779 . 1 1 131 131 GLU C C 13 172.7435 0.0000 . 1 . . . . 131 GLU C . 18647 1 780 . 1 1 131 131 GLU CA C 13 52.9622 0.0000 . 1 . . . . 131 GLU CA . 18647 1 781 . 1 1 131 131 GLU CB C 13 33.9871 0.0000 . 1 . . . . 131 GLU CB . 18647 1 782 . 1 1 131 131 GLU N N 15 116.0320 0.0000 . 1 . . . . 131 GLU N . 18647 1 783 . 1 1 132 132 PHE H H 1 8.4131 0.0000 . 1 . . . . 132 PHE H . 18647 1 784 . 1 1 132 132 PHE HA H 1 4.4732 0.0000 . 1 . . . . 132 PHE HA . 18647 1 785 . 1 1 132 132 PHE C C 13 174.1541 0.0000 . 1 . . . . 132 PHE C . 18647 1 786 . 1 1 132 132 PHE CA C 13 55.9044 0.0000 . 1 . . . . 132 PHE CA . 18647 1 787 . 1 1 132 132 PHE CB C 13 41.7508 0.0000 . 1 . . . . 132 PHE CB . 18647 1 788 . 1 1 132 132 PHE N N 15 122.3693 0.0000 . 1 . . . . 132 PHE N . 18647 1 789 . 1 1 133 133 VAL H H 1 8.2361 0.0000 . 1 . . . . 133 VAL H . 18647 1 790 . 1 1 133 133 VAL HA H 1 4.5904 0.0000 . 1 . . . . 133 VAL HA . 18647 1 791 . 1 1 133 133 VAL C C 13 174.0570 0.0000 . 1 . . . . 133 VAL C . 18647 1 792 . 1 1 133 133 VAL CA C 13 62.4814 0.0000 . 1 . . . . 133 VAL CA . 18647 1 793 . 1 1 133 133 VAL CB C 13 31.3048 0.0000 . 1 . . . . 133 VAL CB . 18647 1 794 . 1 1 133 133 VAL N N 15 121.3325 0.0000 . 1 . . . . 133 VAL N . 18647 1 795 . 1 1 134 134 ASP H H 1 8.8216 0.0000 . 1 . . . . 134 ASP H . 18647 1 796 . 1 1 134 134 ASP HA H 1 5.4786 0.0000 . 1 . . . . 134 ASP HA . 18647 1 797 . 1 1 134 134 ASP C C 13 175.7098 0.0000 . 1 . . . . 134 ASP C . 18647 1 798 . 1 1 134 134 ASP CA C 13 52.9123 0.0000 . 1 . . . . 134 ASP CA . 18647 1 799 . 1 1 134 134 ASP CB C 13 43.5458 0.0000 . 1 . . . . 134 ASP CB . 18647 1 800 . 1 1 134 134 ASP N N 15 123.2329 0.0000 . 1 . . . . 134 ASP N . 18647 1 801 . 1 1 135 135 PHE H H 1 9.4178 0.0000 . 1 . . . . 135 PHE H . 18647 1 802 . 1 1 135 135 PHE HA H 1 4.3314 0.0000 . 1 . . . . 135 PHE HA . 18647 1 803 . 1 1 135 135 PHE C C 13 173.6768 0.0000 . 1 . . . . 135 PHE C . 18647 1 804 . 1 1 135 135 PHE CA C 13 57.6371 0.0000 . 1 . . . . 135 PHE CA . 18647 1 805 . 1 1 135 135 PHE CB C 13 40.9368 0.0000 . 1 . . . . 135 PHE CB . 18647 1 806 . 1 1 135 135 PHE N N 15 122.8846 0.0000 . 1 . . . . 135 PHE N . 18647 1 807 . 1 1 136 136 SER H H 1 8.4400 0.0000 . 1 . . . . 136 SER H . 18647 1 808 . 1 1 136 136 SER HA H 1 5.2687 0.0000 . 1 . . . . 136 SER HA . 18647 1 809 . 1 1 136 136 SER C C 13 172.4376 0.0000 . 1 . . . . 136 SER C . 18647 1 810 . 1 1 136 136 SER CA C 13 56.1408 0.0000 . 1 . . . . 136 SER CA . 18647 1 811 . 1 1 136 136 SER CB C 13 64.2411 0.0000 . 1 . . . . 136 SER CB . 18647 1 812 . 1 1 136 136 SER N N 15 120.8028 0.0000 . 1 . . . . 136 SER N . 18647 1 813 . 1 1 137 137 TYR H H 1 8.8515 0.0000 . 1 . . . . 137 TYR H . 18647 1 814 . 1 1 137 137 TYR HA H 1 5.5371 0.0000 . 1 . . . . 137 TYR HA . 18647 1 815 . 1 1 137 137 TYR HB2 H 1 2.8752 0.0000 . 2 . . . . 137 TYR HB2 . 18647 1 816 . 1 1 137 137 TYR C C 13 173.7657 0.0000 . 1 . . . . 137 TYR C . 18647 1 817 . 1 1 137 137 TYR CA C 13 55.2803 0.0000 . 1 . . . . 137 TYR CA . 18647 1 818 . 1 1 137 137 TYR CB C 13 41.9950 0.0000 . 1 . . . . 137 TYR CB . 18647 1 819 . 1 1 137 137 TYR N N 15 128.6833 0.0000 . 1 . . . . 137 TYR N . 18647 1 820 . 1 1 138 138 THR H H 1 7.8142 0.0000 . 1 . . . . 138 THR H . 18647 1 821 . 1 1 138 138 THR HA H 1 5.4838 0.0000 . 1 . . . . 138 THR HA . 18647 1 822 . 1 1 138 138 THR HB H 1 3.7061 0.0000 . 1 . . . . 138 THR HB . 18647 1 823 . 1 1 138 138 THR C C 13 171.8393 0.0000 . 1 . . . . 138 THR C . 18647 1 824 . 1 1 138 138 THR CA C 13 61.7452 0.0000 . 1 . . . . 138 THR CA . 18647 1 825 . 1 1 138 138 THR CB C 13 70.3743 0.0000 . 1 . . . . 138 THR CB . 18647 1 826 . 1 1 138 138 THR N N 15 125.0553 0.0000 . 1 . . . . 138 THR N . 18647 1 827 . 1 1 139 139 VAL H H 1 9.2888 0.0000 . 1 . . . . 139 VAL H . 18647 1 828 . 1 1 139 139 VAL HA H 1 4.3396 0.0000 . 1 . . . . 139 VAL HA . 18647 1 829 . 1 1 139 139 VAL HB H 1 1.2333 0.0000 . 1 . . . . 139 VAL HB . 18647 1 830 . 1 1 139 139 VAL C C 13 172.2648 0.0000 . 1 . . . . 139 VAL C . 18647 1 831 . 1 1 139 139 VAL CA C 13 59.2712 0.0000 . 1 . . . . 139 VAL CA . 18647 1 832 . 1 1 139 139 VAL CB C 13 35.3732 0.0000 . 1 . . . . 139 VAL CB . 18647 1 833 . 1 1 139 139 VAL N N 15 126.4897 0.0000 . 1 . . . . 139 VAL N . 18647 1 834 . 1 1 140 140 GLY H H 1 8.2188 0.0000 . 1 . . . . 140 GLY H . 18647 1 835 . 1 1 140 140 GLY HA2 H 1 4.2817 0.0000 . 2 . . . . 140 GLY HA2 . 18647 1 836 . 1 1 140 140 GLY HA3 H 1 3.7651 0.0000 . 2 . . . . 140 GLY HA3 . 18647 1 837 . 1 1 140 140 GLY C C 13 173.5788 0.0000 . 1 . . . . 140 GLY C . 18647 1 838 . 1 1 140 140 GLY CA C 13 46.2253 0.0000 . 1 . . . . 140 GLY CA . 18647 1 839 . 1 1 140 140 GLY N N 15 111.7588 0.0000 . 1 . . . . 140 GLY N . 18647 1 840 . 1 1 141 141 TYR H H 1 8.0130 0.0000 . 1 . . . . 141 TYR H . 18647 1 841 . 1 1 141 141 TYR HA H 1 4.4589 0.0000 . 1 . . . . 141 TYR HA . 18647 1 842 . 1 1 141 141 TYR HB2 H 1 2.9684 0.0000 . 2 . . . . 141 TYR HB2 . 18647 1 843 . 1 1 141 141 TYR HB3 H 1 2.5233 0.0000 . 2 . . . . 141 TYR HB3 . 18647 1 844 . 1 1 141 141 TYR C C 13 172.5994 0.0000 . 1 . . . . 141 TYR C . 18647 1 845 . 1 1 141 141 TYR CA C 13 58.2124 0.0000 . 1 . . . . 141 TYR CA . 18647 1 846 . 1 1 141 141 TYR CB C 13 40.2136 0.0000 . 1 . . . . 141 TYR CB . 18647 1 847 . 1 1 141 141 TYR N N 15 124.6256 0.0000 . 1 . . . . 141 TYR N . 18647 1 848 . 1 1 142 142 GLU H H 1 8.8245 0.0000 . 1 . . . . 142 GLU H . 18647 1 849 . 1 1 142 142 GLU HA H 1 3.4591 0.0000 . 1 . . . . 142 GLU HA . 18647 1 850 . 1 1 142 142 GLU C C 13 176.7043 0.0000 . 1 . . . . 142 GLU C . 18647 1 851 . 1 1 142 142 GLU CA C 13 58.0357 0.0000 . 1 . . . . 142 GLU CA . 18647 1 852 . 1 1 142 142 GLU CB C 13 26.3032 0.0000 . 1 . . . . 142 GLU CB . 18647 1 853 . 1 1 142 142 GLU N N 15 125.1511 0.0000 . 1 . . . . 142 GLU N . 18647 1 854 . 1 1 143 143 GLU H H 1 8.3136 0.0000 . 1 . . . . 143 GLU H . 18647 1 855 . 1 1 143 143 GLU HA H 1 4.5269 0.0000 . 1 . . . . 143 GLU HA . 18647 1 856 . 1 1 143 143 GLU HB2 H 1 1.9756 0.0000 . 2 . . . . 143 GLU HB2 . 18647 1 857 . 1 1 143 143 GLU HB3 H 1 2.4161 0.0000 . 2 . . . . 143 GLU HB3 . 18647 1 858 . 1 1 143 143 GLU C C 13 175.7022 0.0000 . 1 . . . . 143 GLU C . 18647 1 859 . 1 1 143 143 GLU CA C 13 57.0328 0.0000 . 1 . . . . 143 GLU CA . 18647 1 860 . 1 1 143 143 GLU CB C 13 28.9327 0.0000 . 1 . . . . 143 GLU CB . 18647 1 861 . 1 1 143 143 GLU N N 15 120.7815 0.0000 . 1 . . . . 143 GLU N . 18647 1 862 . 1 1 144 144 GLY H H 1 9.1114 0.0000 . 1 . . . . 144 GLY H . 18647 1 863 . 1 1 144 144 GLY HA2 H 1 4.7880 0.0000 . 2 . . . . 144 GLY HA2 . 18647 1 864 . 1 1 144 144 GLY HA3 H 1 4.7880 0.0000 . 2 . . . . 144 GLY HA3 . 18647 1 865 . 1 1 144 144 GLY C C 13 174.0620 0.0000 . 1 . . . . 144 GLY C . 18647 1 866 . 1 1 144 144 GLY CA C 13 44.5640 0.0000 . 1 . . . . 144 GLY CA . 18647 1 867 . 1 1 144 144 GLY N N 15 109.3954 0.0000 . 1 . . . . 144 GLY N . 18647 1 868 . 1 1 145 145 LEU H H 1 9.0848 0.0000 . 1 . . . . 145 LEU H . 18647 1 869 . 1 1 145 145 LEU HA H 1 5.1272 0.0000 . 1 . . . . 145 LEU HA . 18647 1 870 . 1 1 145 145 LEU C C 13 173.0170 0.0000 . 1 . . . . 145 LEU C . 18647 1 871 . 1 1 145 145 LEU CA C 13 54.6448 0.0000 . 1 . . . . 145 LEU CA . 18647 1 872 . 1 1 145 145 LEU CB C 13 49.7115 0.0000 . 1 . . . . 145 LEU CB . 18647 1 873 . 1 1 145 145 LEU N N 15 126.0355 0.0000 . 1 . . . . 145 LEU N . 18647 1 874 . 1 1 146 146 LEU H H 1 9.0896 0.0000 . 1 . . . . 146 LEU H . 18647 1 875 . 1 1 146 146 LEU HA H 1 5.0402 0.0000 . 1 . . . . 146 LEU HA . 18647 1 876 . 1 1 146 146 LEU C C 13 174.5383 0.0000 . 1 . . . . 146 LEU C . 18647 1 877 . 1 1 146 146 LEU CA C 13 53.0411 0.0000 . 1 . . . . 146 LEU CA . 18647 1 878 . 1 1 146 146 LEU CB C 13 43.3595 0.0000 . 1 . . . . 146 LEU CB . 18647 1 879 . 1 1 146 146 LEU N N 15 122.1716 0.0000 . 1 . . . . 146 LEU N . 18647 1 880 . 1 1 147 147 SER H H 1 8.9345 0.0000 . 1 . . . . 147 SER H . 18647 1 881 . 1 1 147 147 SER HA H 1 5.4320 0.0000 . 1 . . . . 147 SER HA . 18647 1 882 . 1 1 147 147 SER C C 13 174.3960 0.0000 . 1 . . . . 147 SER C . 18647 1 883 . 1 1 147 147 SER CA C 13 56.3962 0.0000 . 1 . . . . 147 SER CA . 18647 1 884 . 1 1 147 147 SER CB C 13 64.5745 0.0000 . 1 . . . . 147 SER CB . 18647 1 885 . 1 1 147 147 SER N N 15 120.3242 0.0000 . 1 . . . . 147 SER N . 18647 1 886 . 1 1 148 148 CYS H H 1 5.8487 0.0000 . 1 . . . . 148 CYS H . 18647 1 887 . 1 1 148 148 CYS HB2 H 1 2.7700 0.0000 . 2 . . . . 148 CYS HB2 . 18647 1 888 . 1 1 148 148 CYS C C 13 173.3114 0.0000 . 1 . . . . 148 CYS C . 18647 1 889 . 1 1 148 148 CYS CA C 13 55.4627 0.0000 . 1 . . . . 148 CYS CA . 18647 1 890 . 1 1 148 148 CYS CB C 13 32.8227 0.0000 . 1 . . . . 148 CYS CB . 18647 1 891 . 1 1 148 148 CYS N N 15 123.9020 0.0000 . 1 . . . . 148 CYS N . 18647 1 892 . 1 1 149 149 GLY H H 1 9.1177 0.0000 . 1 . . . . 149 GLY H . 18647 1 893 . 1 1 149 149 GLY HA2 H 1 4.0130 0.0000 . 2 . . . . 149 GLY HA2 . 18647 1 894 . 1 1 149 149 GLY HA3 H 1 5.1196 0.0000 . 2 . . . . 149 GLY HA3 . 18647 1 895 . 1 1 149 149 GLY C C 13 170.7506 0.0000 . 1 . . . . 149 GLY C . 18647 1 896 . 1 1 149 149 GLY CA C 13 46.4871 0.0000 . 1 . . . . 149 GLY CA . 18647 1 897 . 1 1 149 149 GLY N N 15 108.1618 0.0000 . 1 . . . . 149 GLY N . 18647 1 898 . 1 1 150 150 VAL H H 1 7.9540 0.0000 . 1 . . . . 150 VAL H . 18647 1 899 . 1 1 150 150 VAL HA H 1 4.0398 0.0000 . 1 . . . . 150 VAL HA . 18647 1 900 . 1 1 150 150 VAL HB H 1 2.3154 0.0000 . 1 . . . . 150 VAL HB . 18647 1 901 . 1 1 150 150 VAL C C 13 172.3072 0.0000 . 1 . . . . 150 VAL C . 18647 1 902 . 1 1 150 150 VAL CA C 13 60.5973 0.0000 . 1 . . . . 150 VAL CA . 18647 1 903 . 1 1 150 150 VAL CB C 13 32.6079 0.0000 . 1 . . . . 150 VAL CB . 18647 1 904 . 1 1 150 150 VAL N N 15 114.4162 0.0000 . 1 . . . . 150 VAL N . 18647 1 905 . 1 1 151 151 SER H H 1 8.9776 0.0000 . 1 . . . . 151 SER H . 18647 1 906 . 1 1 151 151 SER HA H 1 5.8817 0.0000 . 1 . . . . 151 SER HA . 18647 1 907 . 1 1 151 151 SER C C 13 172.4187 0.0000 . 1 . . . . 151 SER C . 18647 1 908 . 1 1 151 151 SER CA C 13 59.8612 0.0000 . 1 . . . . 151 SER CA . 18647 1 909 . 1 1 151 151 SER CB C 13 64.3519 0.0000 . 1 . . . . 151 SER CB . 18647 1 910 . 1 1 151 151 SER N N 15 124.0220 0.0000 . 1 . . . . 151 SER N . 18647 1 911 . 1 1 152 152 VAL H H 1 8.3532 0.0000 . 1 . . . . 152 VAL H . 18647 1 912 . 1 1 152 152 VAL HA H 1 4.9610 0.0000 . 1 . . . . 152 VAL HA . 18647 1 913 . 1 1 152 152 VAL C C 13 175.1590 0.0000 . 1 . . . . 152 VAL C . 18647 1 914 . 1 1 152 152 VAL CA C 13 58.6516 0.0000 . 1 . . . . 152 VAL CA . 18647 1 915 . 1 1 152 152 VAL CB C 13 34.9900 0.0000 . 1 . . . . 152 VAL CB . 18647 1 916 . 1 1 152 152 VAL N N 15 110.5175 0.0000 . 1 . . . . 152 VAL N . 18647 1 917 . 1 1 153 153 GLU H H 1 8.4241 0.0000 . 1 . . . . 153 GLU H . 18647 1 918 . 1 1 153 153 GLU HA H 1 4.2858 0.0000 . 1 . . . . 153 GLU HA . 18647 1 919 . 1 1 153 153 GLU HB2 H 1 1.9761 0.0000 . 2 . . . . 153 GLU HB2 . 18647 1 920 . 1 1 153 153 GLU C C 13 176.2602 0.0000 . 1 . . . . 153 GLU C . 18647 1 921 . 1 1 153 153 GLU CA C 13 56.6460 0.0000 . 1 . . . . 153 GLU CA . 18647 1 922 . 1 1 153 153 GLU CB C 13 29.5280 0.0000 . 1 . . . . 153 GLU CB . 18647 1 923 . 1 1 153 153 GLU N N 15 120.5573 0.0000 . 1 . . . . 153 GLU N . 18647 1 924 . 1 1 154 154 TRP H H 1 8.6542 0.0000 . 1 . . . . 154 TRP H . 18647 1 925 . 1 1 154 154 TRP CA C 13 58.5560 0.0000 . 1 . . . . 154 TRP CA . 18647 1 926 . 1 1 154 154 TRP CB C 13 31.7452 0.0000 . 1 . . . . 154 TRP CB . 18647 1 927 . 1 1 154 154 TRP N N 15 123.9169 0.0000 . 1 . . . . 154 TRP N . 18647 1 928 . 1 1 156 156 GLU C C 13 176.0220 0.0000 . 1 . . . . 156 GLU C . 18647 1 929 . 1 1 156 156 GLU CA C 13 57.1747 0.0000 . 1 . . . . 156 GLU CA . 18647 1 930 . 1 1 156 156 GLU CB C 13 29.2605 0.0000 . 1 . . . . 156 GLU CB . 18647 1 931 . 1 1 157 157 THR H H 1 8.4242 0.0000 . 1 . . . . 157 THR H . 18647 1 932 . 1 1 157 157 THR HA H 1 4.5490 0.0000 . 1 . . . . 157 THR HA . 18647 1 933 . 1 1 157 157 THR C C 13 173.9649 0.0000 . 1 . . . . 157 THR C . 18647 1 934 . 1 1 157 157 THR CA C 13 60.8233 0.0000 . 1 . . . . 157 THR CA . 18647 1 935 . 1 1 157 157 THR CB C 13 70.4046 0.0000 . 1 . . . . 157 THR CB . 18647 1 936 . 1 1 157 157 THR N N 15 119.3413 0.0000 . 1 . . . . 157 THR N . 18647 1 937 . 1 1 158 158 ARG H H 1 9.1719 0.0000 . 1 . . . . 158 ARG H . 18647 1 938 . 1 1 158 158 ARG CA C 13 53.7304 0.0000 . 1 . . . . 158 ARG CA . 18647 1 939 . 1 1 158 158 ARG CB C 13 31.5216 0.0000 . 1 . . . . 158 ARG CB . 18647 1 940 . 1 1 158 158 ARG N N 15 125.0962 0.0000 . 1 . . . . 158 ARG N . 18647 1 941 . 1 1 159 159 PRO HA H 1 4.2973 0.0000 . 1 . . . . 159 PRO HA . 18647 1 942 . 1 1 159 159 PRO HB2 H 1 2.2520 0.0000 . 2 . . . . 159 PRO HB2 . 18647 1 943 . 1 1 159 159 PRO HB3 H 1 1.9113 0.0000 . 2 . . . . 159 PRO HB3 . 18647 1 944 . 1 1 159 159 PRO C C 13 177.0724 0.0000 . 1 . . . . 159 PRO C . 18647 1 945 . 1 1 159 159 PRO CA C 13 64.4491 0.0000 . 1 . . . . 159 PRO CA . 18647 1 946 . 1 1 159 159 PRO CB C 13 31.3583 0.0000 . 1 . . . . 159 PRO CB . 18647 1 947 . 1 1 160 160 GLU H H 1 9.1558 0.0000 . 1 . . . . 160 GLU H . 18647 1 948 . 1 1 160 160 GLU HA H 1 3.8559 0.0000 . 1 . . . . 160 GLU HA . 18647 1 949 . 1 1 160 160 GLU HB2 H 1 1.4092 0.0000 . 2 . . . . 160 GLU HB2 . 18647 1 950 . 1 1 160 160 GLU C C 13 175.1167 0.0000 . 1 . . . . 160 GLU C . 18647 1 951 . 1 1 160 160 GLU CA C 13 57.8501 0.0000 . 1 . . . . 160 GLU CA . 18647 1 952 . 1 1 160 160 GLU CB C 13 27.2689 0.0000 . 1 . . . . 160 GLU CB . 18647 1 953 . 1 1 160 160 GLU N N 15 117.9668 0.0000 . 1 . . . . 160 GLU N . 18647 1 954 . 1 1 161 161 PHE H H 1 7.7410 0.0000 . 1 . . . . 161 PHE H . 18647 1 955 . 1 1 161 161 PHE HA H 1 4.5578 0.0000 . 1 . . . . 161 PHE HA . 18647 1 956 . 1 1 161 161 PHE C C 13 174.9681 0.0000 . 1 . . . . 161 PHE C . 18647 1 957 . 1 1 161 161 PHE CA C 13 56.3890 0.0000 . 1 . . . . 161 PHE CA . 18647 1 958 . 1 1 161 161 PHE CB C 13 42.5834 0.0000 . 1 . . . . 161 PHE CB . 18647 1 959 . 1 1 161 161 PHE N N 15 116.9704 0.0000 . 1 . . . . 161 PHE N . 18647 1 960 . 1 1 162 162 VAL H H 1 7.5498 0.0000 . 1 . . . . 162 VAL H . 18647 1 961 . 1 1 162 162 VAL HA H 1 3.8689 0.0000 . 1 . . . . 162 VAL HA . 18647 1 962 . 1 1 162 162 VAL HB H 1 1.4904 0.0000 . 1 . . . . 162 VAL HB . 18647 1 963 . 1 1 162 162 VAL C C 13 175.7376 0.0000 . 1 . . . . 162 VAL C . 18647 1 964 . 1 1 162 162 VAL CA C 13 62.3404 0.0000 . 1 . . . . 162 VAL CA . 18647 1 965 . 1 1 162 162 VAL CB C 13 32.7379 0.0000 . 1 . . . . 162 VAL CB . 18647 1 966 . 1 1 162 162 VAL N N 15 123.3372 0.0000 . 1 . . . . 162 VAL N . 18647 1 967 . 1 1 163 163 ARG H H 1 8.7764 0.0000 . 1 . . . . 163 ARG H . 18647 1 968 . 1 1 163 163 ARG HA H 1 4.7108 0.0000 . 1 . . . . 163 ARG HA . 18647 1 969 . 1 1 163 163 ARG C C 13 176.3331 0.0000 . 1 . . . . 163 ARG C . 18647 1 970 . 1 1 163 163 ARG CA C 13 53.9269 0.0000 . 1 . . . . 163 ARG CA . 18647 1 971 . 1 1 163 163 ARG CB C 13 26.6788 0.0000 . 1 . . . . 163 ARG CB . 18647 1 972 . 1 1 163 163 ARG N N 15 129.2664 0.0000 . 1 . . . . 163 ARG N . 18647 1 973 . 1 1 164 164 GLY H H 1 8.0780 0.0000 . 1 . . . . 164 GLY H . 18647 1 974 . 1 1 164 164 GLY HA2 H 1 4.2612 0.0000 . 2 . . . . 164 GLY HA2 . 18647 1 975 . 1 1 164 164 GLY C C 13 171.3536 0.0000 . 1 . . . . 164 GLY C . 18647 1 976 . 1 1 164 164 GLY CA C 13 43.7609 0.0000 . 1 . . . . 164 GLY CA . 18647 1 977 . 1 1 164 164 GLY N N 15 116.5512 0.0000 . 1 . . . . 164 GLY N . 18647 1 978 . 1 1 165 165 TYR H H 1 9.1194 0.0000 . 1 . . . . 165 TYR H . 18647 1 979 . 1 1 165 165 TYR HA H 1 4.3540 0.0000 . 1 . . . . 165 TYR HA . 18647 1 980 . 1 1 165 165 TYR C C 13 173.4206 0.0000 . 1 . . . . 165 TYR C . 18647 1 981 . 1 1 165 165 TYR CA C 13 59.3644 0.0000 . 1 . . . . 165 TYR CA . 18647 1 982 . 1 1 165 165 TYR CB C 13 42.5129 0.0000 . 1 . . . . 165 TYR CB . 18647 1 983 . 1 1 165 165 TYR N N 15 120.3964 0.0000 . 1 . . . . 165 TYR N . 18647 1 984 . 1 1 166 166 ASN H H 1 9.4129 0.0000 . 1 . . . . 166 ASN H . 18647 1 985 . 1 1 166 166 ASN HA H 1 4.9437 0.0000 . 1 . . . . 166 ASN HA . 18647 1 986 . 1 1 166 166 ASN HB2 H 1 3.0042 0.0000 . 2 . . . . 166 ASN HB2 . 18647 1 987 . 1 1 166 166 ASN C C 13 174.9023 0.0000 . 1 . . . . 166 ASN C . 18647 1 988 . 1 1 166 166 ASN CA C 13 53.4094 0.0000 . 1 . . . . 166 ASN CA . 18647 1 989 . 1 1 166 166 ASN CB C 13 37.4737 0.0000 . 1 . . . . 166 ASN CB . 18647 1 990 . 1 1 166 166 ASN N N 15 127.1599 0.0000 . 1 . . . . 166 ASN N . 18647 1 991 . 1 1 167 167 HIS H H 1 7.0722 0.0000 . 1 . . . . 167 HIS H . 18647 1 992 . 1 1 167 167 HIS CA C 13 58.1829 0.0000 . 1 . . . . 167 HIS CA . 18647 1 993 . 1 1 167 167 HIS CB C 13 27.0501 0.0000 . 1 . . . . 167 HIS CB . 18647 1 994 . 1 1 167 167 HIS N N 15 125.6134 0.0000 . 1 . . . . 167 HIS N . 18647 1 995 . 1 1 168 168 PRO C C 13 173.8610 0.0000 . 1 . . . . 168 PRO C . 18647 1 996 . 1 1 168 168 PRO CA C 13 66.1538 0.0000 . 1 . . . . 168 PRO CA . 18647 1 997 . 1 1 168 168 PRO CB C 13 29.9679 0.0000 . 1 . . . . 168 PRO CB . 18647 1 998 . 1 1 169 169 CYS H H 1 8.7116 0.0000 . 1 . . . . 169 CYS H . 18647 1 999 . 1 1 169 169 CYS HA H 1 5.1186 0.0000 . 1 . . . . 169 CYS HA . 18647 1 1000 . 1 1 169 169 CYS HB2 H 1 3.2640 0.0000 . 2 . . . . 169 CYS HB2 . 18647 1 1001 . 1 1 169 169 CYS C C 13 173.2125 0.0000 . 1 . . . . 169 CYS C . 18647 1 1002 . 1 1 169 169 CYS CA C 13 54.8585 0.0000 . 1 . . . . 169 CYS CA . 18647 1 1003 . 1 1 169 169 CYS CB C 13 32.0742 0.0000 . 1 . . . . 169 CYS CB . 18647 1 1004 . 1 1 169 169 CYS N N 15 115.9798 0.0000 . 1 . . . . 169 CYS N . 18647 1 1005 . 1 1 170 170 GLY H H 1 9.1005 0.0000 . 1 . . . . 170 GLY H . 18647 1 1006 . 1 1 170 170 GLY C C 13 169.2273 0.0000 . 1 . . . . 170 GLY C . 18647 1 1007 . 1 1 170 170 GLY CA C 13 46.8435 0.0000 . 1 . . . . 170 GLY CA . 18647 1 1008 . 1 1 170 170 GLY N N 15 107.0862 0.0000 . 1 . . . . 170 GLY N . 18647 1 1009 . 1 1 171 171 TRP H H 1 8.6427 0.0000 . 1 . . . . 171 TRP H . 18647 1 1010 . 1 1 171 171 TRP HA H 1 5.2084 0.0000 . 1 . . . . 171 TRP HA . 18647 1 1011 . 1 1 171 171 TRP C C 13 174.8714 0.0000 . 1 . . . . 171 TRP C . 18647 1 1012 . 1 1 171 171 TRP CA C 13 56.1250 0.0000 . 1 . . . . 171 TRP CA . 18647 1 1013 . 1 1 171 171 TRP CB C 13 32.8702 0.0000 . 1 . . . . 171 TRP CB . 18647 1 1014 . 1 1 171 171 TRP N N 15 117.1675 0.0000 . 1 . . . . 171 TRP N . 18647 1 1015 . 1 1 172 172 PHE H H 1 9.9890 0.0000 . 1 . . . . 172 PHE H . 18647 1 1016 . 1 1 172 172 PHE HA H 1 4.9292 0.0000 . 1 . . . . 172 PHE HA . 18647 1 1017 . 1 1 172 172 PHE C C 13 176.2422 0.0000 . 1 . . . . 172 PHE C . 18647 1 1018 . 1 1 172 172 PHE CA C 13 57.1367 0.0000 . 1 . . . . 172 PHE CA . 18647 1 1019 . 1 1 172 172 PHE CB C 13 41.7953 0.0000 . 1 . . . . 172 PHE CB . 18647 1 1020 . 1 1 172 172 PHE N N 15 121.5623 0.0000 . 1 . . . . 172 PHE N . 18647 1 1021 . 1 1 173 173 CYS H H 1 9.4912 0.0000 . 1 . . . . 173 CYS H . 18647 1 1022 . 1 1 173 173 CYS CA C 13 57.7016 0.0000 . 1 . . . . 173 CYS CA . 18647 1 1023 . 1 1 173 173 CYS CB C 13 28.7845 0.0000 . 1 . . . . 173 CYS CB . 18647 1 1024 . 1 1 173 173 CYS N N 15 123.8294 0.0000 . 1 . . . . 173 CYS N . 18647 1 1025 . 1 1 175 175 PRO HA H 1 4.7195 0.0000 . 1 . . . . 175 PRO HA . 18647 1 1026 . 1 1 175 175 PRO HB2 H 1 2.5268 0.0000 . 2 . . . . 175 PRO HB2 . 18647 1 1027 . 1 1 175 175 PRO HB3 H 1 1.8601 0.0000 . 2 . . . . 175 PRO HB3 . 18647 1 1028 . 1 1 175 175 PRO C C 13 177.0552 0.0000 . 1 . . . . 175 PRO C . 18647 1 1029 . 1 1 175 175 PRO CA C 13 62.8046 0.0000 . 1 . . . . 175 PRO CA . 18647 1 1030 . 1 1 175 175 PRO CB C 13 31.3812 0.0000 . 1 . . . . 175 PRO CB . 18647 1 1031 . 1 1 176 176 LEU H H 1 7.8357 0.0000 . 1 . . . . 176 LEU H . 18647 1 1032 . 1 1 176 176 LEU HA H 1 4.3161 0.0000 . 1 . . . . 176 LEU HA . 18647 1 1033 . 1 1 176 176 LEU HB2 H 1 1.6484 0.0000 . 2 . . . . 176 LEU HB2 . 18647 1 1034 . 1 1 176 176 LEU C C 13 177.9115 0.0000 . 1 . . . . 176 LEU C . 18647 1 1035 . 1 1 176 176 LEU CA C 13 54.8089 0.0000 . 1 . . . . 176 LEU CA . 18647 1 1036 . 1 1 176 176 LEU CB C 13 40.9209 0.0000 . 1 . . . . 176 LEU CB . 18647 1 1037 . 1 1 176 176 LEU N N 15 124.0671 0.0000 . 1 . . . . 176 LEU N . 18647 1 1038 . 1 1 177 177 LYS H H 1 8.5776 0.0000 . 1 . . . . 177 LYS H . 18647 1 1039 . 1 1 177 177 LYS HA H 1 3.9017 0.0000 . 1 . . . . 177 LYS HA . 18647 1 1040 . 1 1 177 177 LYS HB2 H 1 1.7650 0.0000 . 2 . . . . 177 LYS HB2 . 18647 1 1041 . 1 1 177 177 LYS C C 13 177.2328 0.0000 . 1 . . . . 177 LYS C . 18647 1 1042 . 1 1 177 177 LYS CA C 13 58.8321 0.0000 . 1 . . . . 177 LYS CA . 18647 1 1043 . 1 1 177 177 LYS CB C 13 31.3509 0.0000 . 1 . . . . 177 LYS CB . 18647 1 1044 . 1 1 177 177 LYS N N 15 127.0186 0.0000 . 1 . . . . 177 LYS N . 18647 1 1045 . 1 1 178 178 ASP H H 1 8.5583 0.0000 . 1 . . . . 178 ASP H . 18647 1 1046 . 1 1 178 178 ASP HA H 1 4.5244 0.0000 . 1 . . . . 178 ASP HA . 18647 1 1047 . 1 1 178 178 ASP HB2 H 1 2.7608 0.0000 . 2 . . . . 178 ASP HB2 . 18647 1 1048 . 1 1 178 178 ASP C C 13 175.7807 0.0000 . 1 . . . . 178 ASP C . 18647 1 1049 . 1 1 178 178 ASP CA C 13 54.8477 0.0000 . 1 . . . . 178 ASP CA . 18647 1 1050 . 1 1 178 178 ASP CB C 13 40.0492 0.0000 . 1 . . . . 178 ASP CB . 18647 1 1051 . 1 1 178 178 ASP N N 15 115.8166 0.0000 . 1 . . . . 178 ASP N . 18647 1 1052 . 1 1 179 179 SER H H 1 7.2934 0.0000 . 1 . . . . 179 SER H . 18647 1 1053 . 1 1 179 179 SER CA C 13 54.8540 0.0000 . 1 . . . . 179 SER CA . 18647 1 1054 . 1 1 179 179 SER CB C 13 62.5142 0.0000 . 1 . . . . 179 SER CB . 18647 1 1055 . 1 1 179 179 SER N N 15 111.7717 0.0000 . 1 . . . . 179 SER N . 18647 1 1056 . 1 1 180 180 PRO HA H 1 4.6090 0.0000 . 1 . . . . 180 PRO HA . 18647 1 1057 . 1 1 180 180 PRO HB2 H 1 2.3606 0.0000 . 2 . . . . 180 PRO HB2 . 18647 1 1058 . 1 1 180 180 PRO HB3 H 1 2.0591 0.0000 . 2 . . . . 180 PRO HB3 . 18647 1 1059 . 1 1 180 180 PRO C C 13 177.4649 0.0000 . 1 . . . . 180 PRO C . 18647 1 1060 . 1 1 180 180 PRO CA C 13 64.6608 0.0000 . 1 . . . . 180 PRO CA . 18647 1 1061 . 1 1 180 180 PRO CB C 13 31.3225 0.0000 . 1 . . . . 180 PRO CB . 18647 1 1062 . 1 1 181 181 SER H H 1 8.1701 0.0000 . 1 . . . . 181 SER H . 18647 1 1063 . 1 1 181 181 SER HA H 1 4.3434 0.0000 . 1 . . . . 181 SER HA . 18647 1 1064 . 1 1 181 181 SER HB2 H 1 3.8549 0.0000 . 2 . . . . 181 SER HB2 . 18647 1 1065 . 1 1 181 181 SER C C 13 172.5078 0.0000 . 1 . . . . 181 SER C . 18647 1 1066 . 1 1 181 181 SER CA C 13 58.9307 0.0000 . 1 . . . . 181 SER CA . 18647 1 1067 . 1 1 181 181 SER CB C 13 62.7541 0.0000 . 1 . . . . 181 SER CB . 18647 1 1068 . 1 1 181 181 SER N N 15 114.6106 0.0000 . 1 . . . . 181 SER N . 18647 1 1069 . 1 1 182 182 GLN H H 1 8.1280 0.0000 . 1 . . . . 182 GLN H . 18647 1 1070 . 1 1 182 182 GLN HA H 1 4.9621 0.0000 . 1 . . . . 182 GLN HA . 18647 1 1071 . 1 1 182 182 GLN HB2 H 1 2.0072 0.0000 . 2 . . . . 182 GLN HB2 . 18647 1 1072 . 1 1 182 182 GLN C C 13 175.7018 0.0000 . 1 . . . . 182 GLN C . 18647 1 1073 . 1 1 182 182 GLN CA C 13 54.7057 0.0000 . 1 . . . . 182 GLN CA . 18647 1 1074 . 1 1 182 182 GLN CB C 13 33.8018 0.0000 . 1 . . . . 182 GLN CB . 18647 1 1075 . 1 1 182 182 GLN N N 15 118.3657 0.0000 . 1 . . . . 182 GLN N . 18647 1 1076 . 1 1 183 183 SER H H 1 9.0176 0.0000 . 1 . . . . 183 SER H . 18647 1 1077 . 1 1 183 183 SER HA H 1 5.1650 0.0000 . 1 . . . . 183 SER HA . 18647 1 1078 . 1 1 183 183 SER HB2 H 1 3.3976 0.0000 . 2 . . . . 183 SER HB2 . 18647 1 1079 . 1 1 183 183 SER C C 13 171.8630 0.0000 . 1 . . . . 183 SER C . 18647 1 1080 . 1 1 183 183 SER CA C 13 57.9955 0.0000 . 1 . . . . 183 SER CA . 18647 1 1081 . 1 1 183 183 SER CB C 13 67.0126 0.0000 . 1 . . . . 183 SER CB . 18647 1 1082 . 1 1 183 183 SER N N 15 113.1209 0.0000 . 1 . . . . 183 SER N . 18647 1 1083 . 1 1 184 184 LEU H H 1 9.4957 0.0000 . 1 . . . . 184 LEU H . 18647 1 1084 . 1 1 184 184 LEU HA H 1 4.7680 0.0000 . 1 . . . . 184 LEU HA . 18647 1 1085 . 1 1 184 184 LEU HB2 H 1 1.2253 0.0000 . 2 . . . . 184 LEU HB2 . 18647 1 1086 . 1 1 184 184 LEU C C 13 175.3042 0.0000 . 1 . . . . 184 LEU C . 18647 1 1087 . 1 1 184 184 LEU CA C 13 54.2373 0.0000 . 1 . . . . 184 LEU CA . 18647 1 1088 . 1 1 184 184 LEU CB C 13 43.2113 0.0000 . 1 . . . . 184 LEU CB . 18647 1 1089 . 1 1 184 184 LEU N N 15 124.8402 0.0000 . 1 . . . . 184 LEU N . 18647 1 1090 . 1 1 185 185 LEU H H 1 8.9256 0.0000 . 1 . . . . 185 LEU H . 18647 1 1091 . 1 1 185 185 LEU HA H 1 5.7460 0.0000 . 1 . . . . 185 LEU HA . 18647 1 1092 . 1 1 185 185 LEU C C 13 176.5022 0.0000 . 1 . . . . 185 LEU C . 18647 1 1093 . 1 1 185 185 LEU CA C 13 53.9635 0.0000 . 1 . . . . 185 LEU CA . 18647 1 1094 . 1 1 185 185 LEU CB C 13 44.8640 0.0000 . 1 . . . . 185 LEU CB . 18647 1 1095 . 1 1 185 185 LEU N N 15 132.2638 0.0000 . 1 . . . . 185 LEU N . 18647 1 1096 . 1 1 186 186 THR H H 1 10.0054 0.0000 . 1 . . . . 186 THR H . 18647 1 1097 . 1 1 186 186 THR HA H 1 5.7868 0.0000 . 1 . . . . 186 THR HA . 18647 1 1098 . 1 1 186 186 THR C C 13 172.5731 0.0000 . 1 . . . . 186 THR C . 18647 1 1099 . 1 1 186 186 THR CA C 13 62.1085 0.0000 . 1 . . . . 186 THR CA . 18647 1 1100 . 1 1 186 186 THR CB C 13 69.9685 0.0000 . 1 . . . . 186 THR CB . 18647 1 1101 . 1 1 186 186 THR N N 15 100.8151 0.0000 . 1 . . . . 186 THR N . 18647 1 1102 . 1 1 187 187 GLY H H 1 9.1504 0.0000 . 1 . . . . 187 GLY H . 18647 1 1103 . 1 1 187 187 GLY HA2 H 1 1.7459 0.0000 . 2 . . . . 187 GLY HA2 . 18647 1 1104 . 1 1 187 187 GLY C C 13 170.7718 0.0000 . 1 . . . . 187 GLY C . 18647 1 1105 . 1 1 187 187 GLY CA C 13 43.8784 0.0000 . 1 . . . . 187 GLY CA . 18647 1 1106 . 1 1 187 187 GLY N N 15 115.8230 0.0000 . 1 . . . . 187 GLY N . 18647 1 1107 . 1 1 188 188 TYR H H 1 8.3356 0.0000 . 1 . . . . 188 TYR H . 18647 1 1108 . 1 1 188 188 TYR HA H 1 5.5013 0.0000 . 1 . . . . 188 TYR HA . 18647 1 1109 . 1 1 188 188 TYR C C 13 175.4895 0.0000 . 1 . . . . 188 TYR C . 18647 1 1110 . 1 1 188 188 TYR CA C 13 56.3100 0.0000 . 1 . . . . 188 TYR CA . 18647 1 1111 . 1 1 188 188 TYR CB C 13 40.1523 0.0000 . 1 . . . . 188 TYR CB . 18647 1 1112 . 1 1 188 188 TYR N N 15 117.0682 0.0000 . 1 . . . . 188 TYR N . 18647 1 1113 . 1 1 189 189 ILE H H 1 9.0277 0.0000 . 1 . . . . 189 ILE H . 18647 1 1114 . 1 1 189 189 ILE HA H 1 4.4505 0.0000 . 1 . . . . 189 ILE HA . 18647 1 1115 . 1 1 189 189 ILE C C 13 174.3200 0.0000 . 1 . . . . 189 ILE C . 18647 1 1116 . 1 1 189 189 ILE CA C 13 59.6632 0.0000 . 1 . . . . 189 ILE CA . 18647 1 1117 . 1 1 189 189 ILE CB C 13 40.2453 0.0000 . 1 . . . . 189 ILE CB . 18647 1 1118 . 1 1 189 189 ILE N N 15 121.3362 0.0000 . 1 . . . . 189 ILE N . 18647 1 1119 . 1 1 190 190 GLN H H 1 8.9880 0.0000 . 1 . . . . 190 GLN H . 18647 1 1120 . 1 1 190 190 GLN HA H 1 5.2065 0.0000 . 1 . . . . 190 GLN HA . 18647 1 1121 . 1 1 190 190 GLN C C 13 174.9387 0.0000 . 1 . . . . 190 GLN C . 18647 1 1122 . 1 1 190 190 GLN CA C 13 54.5950 0.0000 . 1 . . . . 190 GLN CA . 18647 1 1123 . 1 1 190 190 GLN CB C 13 31.3598 0.0000 . 1 . . . . 190 GLN CB . 18647 1 1124 . 1 1 190 190 GLN N N 15 134.1132 0.0000 . 1 . . . . 190 GLN N . 18647 1 1125 . 1 1 191 191 THR H H 1 7.5317 0.0000 . 1 . . . . 191 THR H . 18647 1 1126 . 1 1 191 191 THR HA H 1 4.2842 0.0000 . 1 . . . . 191 THR HA . 18647 1 1127 . 1 1 191 191 THR C C 13 173.0906 0.0000 . 1 . . . . 191 THR C . 18647 1 1128 . 1 1 191 191 THR CA C 13 64.4841 0.0000 . 1 . . . . 191 THR CA . 18647 1 1129 . 1 1 191 191 THR CB C 13 71.3393 0.0000 . 1 . . . . 191 THR CB . 18647 1 1130 . 1 1 191 191 THR N N 15 117.4177 0.0000 . 1 . . . . 191 THR N . 18647 1 1131 . 1 1 192 192 ASP H H 1 9.3143 0.0000 . 1 . . . . 192 ASP H . 18647 1 1132 . 1 1 192 192 ASP HA H 1 5.1251 0.0000 . 1 . . . . 192 ASP HA . 18647 1 1133 . 1 1 192 192 ASP C C 13 176.2821 0.0000 . 1 . . . . 192 ASP C . 18647 1 1134 . 1 1 192 192 ASP CA C 13 51.9938 0.0000 . 1 . . . . 192 ASP CA . 18647 1 1135 . 1 1 192 192 ASP CB C 13 41.6482 0.0000 . 1 . . . . 192 ASP CB . 18647 1 1136 . 1 1 192 192 ASP N N 15 125.2479 0.0000 . 1 . . . . 192 ASP N . 18647 1 1137 . 1 1 193 193 LEU H H 1 9.2158 0.0000 . 1 . . . . 193 LEU H . 18647 1 1138 . 1 1 193 193 LEU HA H 1 3.9694 0.0000 . 1 . . . . 193 LEU HA . 18647 1 1139 . 1 1 193 193 LEU C C 13 177.0031 0.0000 . 1 . . . . 193 LEU C . 18647 1 1140 . 1 1 193 193 LEU CA C 13 56.5891 0.0000 . 1 . . . . 193 LEU CA . 18647 1 1141 . 1 1 193 193 LEU CB C 13 41.8430 0.0000 . 1 . . . . 193 LEU CB . 18647 1 1142 . 1 1 193 193 LEU N N 15 126.0740 0.0000 . 1 . . . . 193 LEU N . 18647 1 1143 . 1 1 194 194 ARG H H 1 8.5413 0.0000 . 1 . . . . 194 ARG H . 18647 1 1144 . 1 1 194 194 ARG HA H 1 3.9654 0.0000 . 1 . . . . 194 ARG HA . 18647 1 1145 . 1 1 194 194 ARG C C 13 175.8344 0.0000 . 1 . . . . 194 ARG C . 18647 1 1146 . 1 1 194 194 ARG CA C 13 57.4326 0.0000 . 1 . . . . 194 ARG CA . 18647 1 1147 . 1 1 194 194 ARG CB C 13 26.3836 0.0000 . 1 . . . . 194 ARG CB . 18647 1 1148 . 1 1 194 194 ARG N N 15 111.4796 0.0000 . 1 . . . . 194 ARG N . 18647 1 1149 . 1 1 195 195 GLY H H 1 8.3208 0.0000 . 1 . . . . 195 GLY H . 18647 1 1150 . 1 1 195 195 GLY HA2 H 1 3.7868 0.0000 . 2 . . . . 195 GLY HA2 . 18647 1 1151 . 1 1 195 195 GLY C C 13 173.3430 0.0000 . 1 . . . . 195 GLY C . 18647 1 1152 . 1 1 195 195 GLY CA C 13 45.4248 0.0000 . 1 . . . . 195 GLY CA . 18647 1 1153 . 1 1 195 195 GLY N N 15 106.4684 0.0000 . 1 . . . . 195 GLY N . 18647 1 1154 . 1 1 196 196 MET H H 1 8.4852 0.0000 . 1 . . . . 196 MET H . 18647 1 1155 . 1 1 196 196 MET HA H 1 4.6950 0.0000 . 1 . . . . 196 MET HA . 18647 1 1156 . 1 1 196 196 MET HB2 H 1 2.4986 0.0000 . 2 . . . . 196 MET HB2 . 18647 1 1157 . 1 1 196 196 MET C C 13 174.6444 0.0000 . 1 . . . . 196 MET C . 18647 1 1158 . 1 1 196 196 MET CA C 13 54.7420 0.0000 . 1 . . . . 196 MET CA . 18647 1 1159 . 1 1 196 196 MET CB C 13 31.4643 0.0000 . 1 . . . . 196 MET CB . 18647 1 1160 . 1 1 196 196 MET N N 15 122.4142 0.0000 . 1 . . . . 196 MET N . 18647 1 1161 . 1 1 197 197 ILE H H 1 7.9113 0.0000 . 1 . . . . 197 ILE H . 18647 1 1162 . 1 1 197 197 ILE CA C 13 57.7530 0.0000 . 1 . . . . 197 ILE CA . 18647 1 1163 . 1 1 197 197 ILE CB C 13 40.0856 0.0000 . 1 . . . . 197 ILE CB . 18647 1 1164 . 1 1 197 197 ILE N N 15 124.0730 0.0000 . 1 . . . . 197 ILE N . 18647 1 1165 . 1 1 198 198 PRO HA H 1 4.4729 0.0000 . 1 . . . . 198 PRO HA . 18647 1 1166 . 1 1 198 198 PRO HB2 H 1 2.4610 0.0000 . 2 . . . . 198 PRO HB2 . 18647 1 1167 . 1 1 198 198 PRO HB3 H 1 1.9875 0.0000 . 2 . . . . 198 PRO HB3 . 18647 1 1168 . 1 1 198 198 PRO C C 13 178.0924 0.0000 . 1 . . . . 198 PRO C . 18647 1 1169 . 1 1 198 198 PRO CA C 13 63.2019 0.0000 . 1 . . . . 198 PRO CA . 18647 1 1170 . 1 1 198 198 PRO CB C 13 31.5580 0.0000 . 1 . . . . 198 PRO CB . 18647 1 1171 . 1 1 199 199 GLN H H 1 8.9880 0.0000 . 1 . . . . 199 GLN H . 18647 1 1172 . 1 1 199 199 GLN HA H 1 3.8640 0.0000 . 1 . . . . 199 GLN HA . 18647 1 1173 . 1 1 199 199 GLN HB2 H 1 2.0879 0.0000 . 2 . . . . 199 GLN HB2 . 18647 1 1174 . 1 1 199 199 GLN HB3 H 1 2.3220 0.0000 . 2 . . . . 199 GLN HB3 . 18647 1 1175 . 1 1 199 199 GLN C C 13 177.3979 0.0000 . 1 . . . . 199 GLN C . 18647 1 1176 . 1 1 199 199 GLN CA C 13 59.1123 0.0000 . 1 . . . . 199 GLN CA . 18647 1 1177 . 1 1 199 199 GLN CB C 13 27.8224 0.0000 . 1 . . . . 199 GLN CB . 18647 1 1178 . 1 1 199 199 GLN N N 15 125.4498 0.0000 . 1 . . . . 199 GLN N . 18647 1 1179 . 1 1 200 200 SER H H 1 8.7233 0.0000 . 1 . . . . 200 SER H . 18647 1 1180 . 1 1 200 200 SER HA H 1 4.2100 0.0000 . 1 . . . . 200 SER HA . 18647 1 1181 . 1 1 200 200 SER HB2 H 1 3.9284 0.0000 . 2 . . . . 200 SER HB2 . 18647 1 1182 . 1 1 200 200 SER C C 13 176.8407 0.0000 . 1 . . . . 200 SER C . 18647 1 1183 . 1 1 200 200 SER CA C 13 60.2223 0.0000 . 1 . . . . 200 SER CA . 18647 1 1184 . 1 1 200 200 SER CB C 13 61.6179 0.0000 . 1 . . . . 200 SER CB . 18647 1 1185 . 1 1 200 200 SER N N 15 111.7516 0.0000 . 1 . . . . 200 SER N . 18647 1 1186 . 1 1 201 201 ALA H H 1 7.1354 0.0000 . 1 . . . . 201 ALA H . 18647 1 1187 . 1 1 201 201 ALA HA H 1 4.2575 0.0000 . 1 . . . . 201 ALA HA . 18647 1 1188 . 1 1 201 201 ALA HB1 H 1 1.4740 0.0000 . 1 . . . . 201 ALA HB1 . 18647 1 1189 . 1 1 201 201 ALA HB2 H 1 1.4740 0.0000 . 1 . . . . 201 ALA HB1 . 18647 1 1190 . 1 1 201 201 ALA HB3 H 1 1.4740 0.0000 . 1 . . . . 201 ALA HB1 . 18647 1 1191 . 1 1 201 201 ALA C C 13 178.7963 0.0000 . 1 . . . . 201 ALA C . 18647 1 1192 . 1 1 201 201 ALA CA C 13 54.3625 0.0000 . 1 . . . . 201 ALA CA . 18647 1 1193 . 1 1 201 201 ALA CB C 13 17.8225 0.0000 . 1 . . . . 201 ALA CB . 18647 1 1194 . 1 1 201 201 ALA N N 15 124.9837 0.0000 . 1 . . . . 201 ALA N . 18647 1 1195 . 1 1 202 202 VAL H H 1 7.6248 0.0000 . 1 . . . . 202 VAL H . 18647 1 1196 . 1 1 202 202 VAL HA H 1 3.3192 0.0000 . 1 . . . . 202 VAL HA . 18647 1 1197 . 1 1 202 202 VAL C C 13 177.8169 0.0000 . 1 . . . . 202 VAL C . 18647 1 1198 . 1 1 202 202 VAL CA C 13 67.5517 0.0000 . 1 . . . . 202 VAL CA . 18647 1 1199 . 1 1 202 202 VAL CB C 13 30.9708 0.0000 . 1 . . . . 202 VAL CB . 18647 1 1200 . 1 1 202 202 VAL N N 15 119.3898 0.0000 . 1 . . . . 202 VAL N . 18647 1 1201 . 1 1 203 203 ASP H H 1 8.5685 0.0000 . 1 . . . . 203 ASP H . 18647 1 1202 . 1 1 203 203 ASP HA H 1 4.4068 0.0000 . 1 . . . . 203 ASP HA . 18647 1 1203 . 1 1 203 203 ASP HB2 H 1 2.7421 0.0000 . 2 . . . . 203 ASP HB2 . 18647 1 1204 . 1 1 203 203 ASP C C 13 179.1937 0.0000 . 1 . . . . 203 ASP C . 18647 1 1205 . 1 1 203 203 ASP CA C 13 57.6580 0.0000 . 1 . . . . 203 ASP CA . 18647 1 1206 . 1 1 203 203 ASP CB C 13 40.1879 0.0000 . 1 . . . . 203 ASP CB . 18647 1 1207 . 1 1 203 203 ASP N N 15 118.4387 0.0000 . 1 . . . . 203 ASP N . 18647 1 1208 . 1 1 204 204 THR H H 1 7.7851 0.0000 . 1 . . . . 204 THR H . 18647 1 1209 . 1 1 204 204 THR HA H 1 3.9556 0.0000 . 1 . . . . 204 THR HA . 18647 1 1210 . 1 1 204 204 THR C C 13 176.7102 0.0000 . 1 . . . . 204 THR C . 18647 1 1211 . 1 1 204 204 THR CA C 13 66.1386 0.0000 . 1 . . . . 204 THR CA . 18647 1 1212 . 1 1 204 204 THR CB C 13 68.5133 0.0000 . 1 . . . . 204 THR CB . 18647 1 1213 . 1 1 204 204 THR N N 15 116.4697 0.0000 . 1 . . . . 204 THR N . 18647 1 1214 . 1 1 205 205 ALA H H 1 8.6924 0.0000 . 1 . . . . 205 ALA H . 18647 1 1215 . 1 1 205 205 ALA HA H 1 4.0932 0.0000 . 1 . . . . 205 ALA HA . 18647 1 1216 . 1 1 205 205 ALA HB1 H 1 1.4141 0.0000 . 1 . . . . 205 ALA HB1 . 18647 1 1217 . 1 1 205 205 ALA HB2 H 1 1.4141 0.0000 . 1 . . . . 205 ALA HB1 . 18647 1 1218 . 1 1 205 205 ALA HB3 H 1 1.4141 0.0000 . 1 . . . . 205 ALA HB1 . 18647 1 1219 . 1 1 205 205 ALA C C 13 180.8916 0.0000 . 1 . . . . 205 ALA C . 18647 1 1220 . 1 1 205 205 ALA CA C 13 55.2954 0.0000 . 1 . . . . 205 ALA CA . 18647 1 1221 . 1 1 205 205 ALA CB C 13 17.5663 0.0000 . 1 . . . . 205 ALA CB . 18647 1 1222 . 1 1 205 205 ALA N N 15 125.1830 0.0000 . 1 . . . . 205 ALA N . 18647 1 1223 . 1 1 206 206 MET H H 1 9.0488 0.0000 . 1 . . . . 206 MET H . 18647 1 1224 . 1 1 206 206 MET HA H 1 4.2388 0.0000 . 1 . . . . 206 MET HA . 18647 1 1225 . 1 1 206 206 MET C C 13 178.0692 0.0000 . 1 . . . . 206 MET C . 18647 1 1226 . 1 1 206 206 MET CA C 13 56.4979 0.0000 . 1 . . . . 206 MET CA . 18647 1 1227 . 1 1 206 206 MET CB C 13 28.0576 0.0000 . 1 . . . . 206 MET CB . 18647 1 1228 . 1 1 206 206 MET N N 15 118.6720 0.0000 . 1 . . . . 206 MET N . 18647 1 1229 . 1 1 207 207 ALA H H 1 7.4901 0.0000 . 1 . . . . 207 ALA H . 18647 1 1230 . 1 1 207 207 ALA HA H 1 3.9736 0.0000 . 1 . . . . 207 ALA HA . 18647 1 1231 . 1 1 207 207 ALA HB1 H 1 2.6669 0.0000 . 1 . . . . 207 ALA HB1 . 18647 1 1232 . 1 1 207 207 ALA HB2 H 1 2.6669 0.0000 . 1 . . . . 207 ALA HB1 . 18647 1 1233 . 1 1 207 207 ALA HB3 H 1 2.6669 0.0000 . 1 . . . . 207 ALA HB1 . 18647 1 1234 . 1 1 207 207 ALA C C 13 177.8392 0.0000 . 1 . . . . 207 ALA C . 18647 1 1235 . 1 1 207 207 ALA CA C 13 55.7321 0.0000 . 1 . . . . 207 ALA CA . 18647 1 1236 . 1 1 207 207 ALA CB C 13 17.4162 0.0000 . 1 . . . . 207 ALA CB . 18647 1 1237 . 1 1 207 207 ALA N N 15 119.0987 0.0000 . 1 . . . . 207 ALA N . 18647 1 1238 . 1 1 208 208 SER H H 1 8.3216 0.0000 . 1 . . . . 208 SER H . 18647 1 1239 . 1 1 208 208 SER CA C 13 61.2022 0.0000 . 1 . . . . 208 SER CA . 18647 1 1240 . 1 1 208 208 SER CB C 13 62.6056 0.0000 . 1 . . . . 208 SER CB . 18647 1 1241 . 1 1 208 208 SER N N 15 115.5346 0.0000 . 1 . . . . 208 SER N . 18647 1 1242 . 1 1 209 209 THR H H 1 8.6767 0.0000 . 1 . . . . 209 THR H . 18647 1 1243 . 1 1 209 209 THR HA H 1 4.0166 0.0000 . 1 . . . . 209 THR HA . 18647 1 1244 . 1 1 209 209 THR C C 13 177.5370 0.0000 . 1 . . . . 209 THR C . 18647 1 1245 . 1 1 209 209 THR CA C 13 66.5174 0.0000 . 1 . . . . 209 THR CA . 18647 1 1246 . 1 1 209 209 THR CB C 13 68.4129 0.0000 . 1 . . . . 209 THR CB . 18647 1 1247 . 1 1 209 209 THR N N 15 119.3346 0.0000 . 1 . . . . 209 THR N . 18647 1 1248 . 1 1 210 210 LEU H H 1 7.5486 0.0000 . 1 . . . . 210 LEU H . 18647 1 1249 . 1 1 210 210 LEU HA H 1 4.3407 0.0000 . 1 . . . . 210 LEU HA . 18647 1 1250 . 1 1 210 210 LEU C C 13 177.7274 0.0000 . 1 . . . . 210 LEU C . 18647 1 1251 . 1 1 210 210 LEU CA C 13 57.8287 0.0000 . 1 . . . . 210 LEU CA . 18647 1 1252 . 1 1 210 210 LEU CB C 13 41.1355 0.0000 . 1 . . . . 210 LEU CB . 18647 1 1253 . 1 1 210 210 LEU N N 15 121.9801 0.0000 . 1 . . . . 210 LEU N . 18647 1 1254 . 1 1 211 211 ALA H H 1 7.7582 0.0000 . 1 . . . . 211 ALA H . 18647 1 1255 . 1 1 211 211 ALA HA H 1 4.0274 0.0000 . 1 . . . . 211 ALA HA . 18647 1 1256 . 1 1 211 211 ALA HB1 H 1 1.3937 0.0000 . 1 . . . . 211 ALA HB1 . 18647 1 1257 . 1 1 211 211 ALA HB2 H 1 1.3937 0.0000 . 1 . . . . 211 ALA HB1 . 18647 1 1258 . 1 1 211 211 ALA HB3 H 1 1.3937 0.0000 . 1 . . . . 211 ALA HB1 . 18647 1 1259 . 1 1 211 211 ALA C C 13 180.7952 0.0000 . 1 . . . . 211 ALA C . 18647 1 1260 . 1 1 211 211 ALA CA C 13 56.0250 0.0000 . 1 . . . . 211 ALA CA . 18647 1 1261 . 1 1 211 211 ALA CB C 13 17.1801 0.0000 . 1 . . . . 211 ALA CB . 18647 1 1262 . 1 1 211 211 ALA N N 15 120.2263 0.0000 . 1 . . . . 211 ALA N . 18647 1 1263 . 1 1 212 212 ASN H H 1 8.8930 0.0000 . 1 . . . . 212 ASN H . 18647 1 1264 . 1 1 212 212 ASN HA H 1 4.4854 0.0000 . 1 . . . . 212 ASN HA . 18647 1 1265 . 1 1 212 212 ASN C C 13 176.0562 0.0000 . 1 . . . . 212 ASN C . 18647 1 1266 . 1 1 212 212 ASN CA C 13 54.9844 0.0000 . 1 . . . . 212 ASN CA . 18647 1 1267 . 1 1 212 212 ASN CB C 13 37.2177 0.0000 . 1 . . . . 212 ASN CB . 18647 1 1268 . 1 1 212 212 ASN N N 15 117.2835 0.0000 . 1 . . . . 212 ASN N . 18647 1 1269 . 1 1 213 213 PHE H H 1 8.1601 0.0000 . 1 . . . . 213 PHE H . 18647 1 1270 . 1 1 213 213 PHE HA H 1 4.6879 0.0000 . 1 . . . . 213 PHE HA . 18647 1 1271 . 1 1 213 213 PHE C C 13 177.1288 0.0000 . 1 . . . . 213 PHE C . 18647 1 1272 . 1 1 213 213 PHE CA C 13 61.2702 0.0000 . 1 . . . . 213 PHE CA . 18647 1 1273 . 1 1 213 213 PHE CB C 13 38.6227 0.0000 . 1 . . . . 213 PHE CB . 18647 1 1274 . 1 1 213 213 PHE N N 15 122.8343 0.0000 . 1 . . . . 213 PHE N . 18647 1 1275 . 1 1 214 214 TYR H H 1 7.5914 0.0000 . 1 . . . . 214 TYR H . 18647 1 1276 . 1 1 214 214 TYR HA H 1 3.6188 0.0000 . 1 . . . . 214 TYR HA . 18647 1 1277 . 1 1 214 214 TYR C C 13 178.3428 0.0000 . 1 . . . . 214 TYR C . 18647 1 1278 . 1 1 214 214 TYR CA C 13 63.4821 0.0000 . 1 . . . . 214 TYR CA . 18647 1 1279 . 1 1 214 214 TYR CB C 13 38.7000 0.0000 . 1 . . . . 214 TYR CB . 18647 1 1280 . 1 1 214 214 TYR N N 15 115.4168 0.0000 . 1 . . . . 214 TYR N . 18647 1 1281 . 1 1 215 215 SER H H 1 7.6490 0.0000 . 1 . . . . 215 SER H . 18647 1 1282 . 1 1 215 215 SER HA H 1 4.1589 0.0000 . 1 . . . . 215 SER HA . 18647 1 1283 . 1 1 215 215 SER C C 13 177.7079 0.0000 . 1 . . . . 215 SER C . 18647 1 1284 . 1 1 215 215 SER CA C 13 60.9704 0.0000 . 1 . . . . 215 SER CA . 18647 1 1285 . 1 1 215 215 SER CB C 13 62.6713 0.0000 . 1 . . . . 215 SER CB . 18647 1 1286 . 1 1 215 215 SER N N 15 113.0579 0.0000 . 1 . . . . 215 SER N . 18647 1 1287 . 1 1 216 216 ASP H H 1 9.2905 0.0000 . 1 . . . . 216 ASP H . 18647 1 1288 . 1 1 216 216 ASP HA H 1 4.5022 0.0000 . 1 . . . . 216 ASP HA . 18647 1 1289 . 1 1 216 216 ASP HB2 H 1 3.5870 0.0000 . 2 . . . . 216 ASP HB2 . 18647 1 1290 . 1 1 216 216 ASP C C 13 179.1269 0.0000 . 1 . . . . 216 ASP C . 18647 1 1291 . 1 1 216 216 ASP CA C 13 57.3413 0.0000 . 1 . . . . 216 ASP CA . 18647 1 1292 . 1 1 216 216 ASP CB C 13 38.5897 0.0000 . 1 . . . . 216 ASP CB . 18647 1 1293 . 1 1 216 216 ASP N N 15 123.1746 0.0000 . 1 . . . . 216 ASP N . 18647 1 1294 . 1 1 217 217 LEU H H 1 8.3936 0.0000 . 1 . . . . 217 LEU H . 18647 1 1295 . 1 1 217 217 LEU HA H 1 2.4873 0.0000 . 1 . . . . 217 LEU HA . 18647 1 1296 . 1 1 217 217 LEU C C 13 177.7402 0.0000 . 1 . . . . 217 LEU C . 18647 1 1297 . 1 1 217 217 LEU CA C 13 57.3675 0.0000 . 1 . . . . 217 LEU CA . 18647 1 1298 . 1 1 217 217 LEU CB C 13 38.5058 0.0000 . 1 . . . . 217 LEU CB . 18647 1 1299 . 1 1 217 217 LEU N N 15 125.5126 0.0000 . 1 . . . . 217 LEU N . 18647 1 1300 . 1 1 218 218 ARG H H 1 7.8715 0.0000 . 1 . . . . 218 ARG H . 18647 1 1301 . 1 1 218 218 ARG HA H 1 3.5523 0.0000 . 1 . . . . 218 ARG HA . 18647 1 1302 . 1 1 218 218 ARG C C 13 179.8132 0.0000 . 1 . . . . 218 ARG C . 18647 1 1303 . 1 1 218 218 ARG CA C 13 60.2850 0.0000 . 1 . . . . 218 ARG CA . 18647 1 1304 . 1 1 218 218 ARG CB C 13 29.2117 0.0000 . 1 . . . . 218 ARG CB . 18647 1 1305 . 1 1 218 218 ARG N N 15 116.8346 0.0000 . 1 . . . . 218 ARG N . 18647 1 1306 . 1 1 219 219 LYS H H 1 7.3374 0.0000 . 1 . . . . 219 LYS H . 18647 1 1307 . 1 1 219 219 LYS HA H 1 3.9594 0.0000 . 1 . . . . 219 LYS HA . 18647 1 1308 . 1 1 219 219 LYS HB2 H 1 1.9126 0.0000 . 2 . . . . 219 LYS HB2 . 18647 1 1309 . 1 1 219 219 LYS C C 13 178.9832 0.0000 . 1 . . . . 219 LYS C . 18647 1 1310 . 1 1 219 219 LYS CA C 13 59.0834 0.0000 . 1 . . . . 219 LYS CA . 18647 1 1311 . 1 1 219 219 LYS CB C 13 31.6491 0.0000 . 1 . . . . 219 LYS CB . 18647 1 1312 . 1 1 219 219 LYS N N 15 117.2564 0.0000 . 1 . . . . 219 LYS N . 18647 1 1313 . 1 1 220 220 GLY H H 1 8.0978 0.0000 . 1 . . . . 220 GLY H . 18647 1 1314 . 1 1 220 220 GLY HA2 H 1 3.9441 0.0000 . 2 . . . . 220 GLY HA2 . 18647 1 1315 . 1 1 220 220 GLY HA3 H 1 3.2365 0.0000 . 2 . . . . 220 GLY HA3 . 18647 1 1316 . 1 1 220 220 GLY C C 13 174.8626 0.0000 . 1 . . . . 220 GLY C . 18647 1 1317 . 1 1 220 220 GLY CA C 13 46.0444 0.0000 . 1 . . . . 220 GLY CA . 18647 1 1318 . 1 1 220 220 GLY N N 15 108.1629 0.0000 . 1 . . . . 220 GLY N . 18647 1 1319 . 1 1 221 221 LEU H H 1 7.4260 0.0000 . 1 . . . . 221 LEU H . 18647 1 1320 . 1 1 221 221 LEU HA H 1 3.4579 0.0000 . 1 . . . . 221 LEU HA . 18647 1 1321 . 1 1 221 221 LEU HB2 H 1 1.3070 0.0000 . 2 . . . . 221 LEU HB2 . 18647 1 1322 . 1 1 221 221 LEU C C 13 177.2506 0.0000 . 1 . . . . 221 LEU C . 18647 1 1323 . 1 1 221 221 LEU CA C 13 55.3508 0.0000 . 1 . . . . 221 LEU CA . 18647 1 1324 . 1 1 221 221 LEU CB C 13 40.6755 0.0000 . 1 . . . . 221 LEU CB . 18647 1 1325 . 1 1 221 221 LEU N N 15 118.7189 0.0000 . 1 . . . . 221 LEU N . 18647 1 1326 . 1 1 222 222 ARG H H 1 7.1700 0.0000 . 1 . . . . 222 ARG H . 18647 1 1327 . 1 1 222 222 ARG HA H 1 4.1388 0.0000 . 1 . . . . 222 ARG HA . 18647 1 1328 . 1 1 222 222 ARG HB2 H 1 1.8067 0.0000 . 2 . . . . 222 ARG HB2 . 18647 1 1329 . 1 1 222 222 ARG C C 13 175.8366 0.0000 . 1 . . . . 222 ARG C . 18647 1 1330 . 1 1 222 222 ARG CA C 13 56.2302 0.0000 . 1 . . . . 222 ARG CA . 18647 1 1331 . 1 1 222 222 ARG CB C 13 29.7835 0.0000 . 1 . . . . 222 ARG CB . 18647 1 1332 . 1 1 222 222 ARG N N 15 118.4677 0.0000 . 1 . . . . 222 ARG N . 18647 1 1333 . 1 1 223 223 LYS H H 1 8.0395 0.0000 . 1 . . . . 223 LYS H . 18647 1 1334 . 1 1 223 223 LYS HA H 1 4.2427 0.0000 . 1 . . . . 223 LYS HA . 18647 1 1335 . 1 1 223 223 LYS HB2 H 1 1.7805 0.0000 . 2 . . . . 223 LYS HB2 . 18647 1 1336 . 1 1 223 223 LYS C C 13 175.3654 0.0000 . 1 . . . . 223 LYS C . 18647 1 1337 . 1 1 223 223 LYS CA C 13 56.2124 0.0000 . 1 . . . . 223 LYS CA . 18647 1 1338 . 1 1 223 223 LYS CB C 13 32.0005 0.0000 . 1 . . . . 223 LYS CB . 18647 1 1339 . 1 1 223 223 LYS N N 15 123.0765 0.0000 . 1 . . . . 223 LYS N . 18647 1 1340 . 1 1 224 224 ALA H H 1 7.9419 0.0000 . 1 . . . . 224 ALA H . 18647 1 1341 . 1 1 224 224 ALA CA C 13 53.6118 0.0000 . 1 . . . . 224 ALA CA . 18647 1 1342 . 1 1 224 224 ALA CB C 13 19.5886 0.0000 . 1 . . . . 224 ALA CB . 18647 1 1343 . 1 1 224 224 ALA N N 15 131.0633 0.0000 . 1 . . . . 224 ALA N . 18647 1 stop_ save_