data_17081 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17081 _Entry.Title ; Mouse Prion Protein (121-231) with mutation Y169G ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-07-28 _Entry.Accession_date 2010-07-28 _Entry.Last_release_date 2012-03-09 _Entry.Original_release_date 2012-03-09 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'NMR, 20 STRUCTURES' _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Barbara Christen . . . 17081 2 Fred Damberger . F. . 17081 3 Daniel Perez . R. . 17081 4 Simone Hornemann . . . 17081 5 Kurt Wuthrich . . . 17081 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 17081 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID mouse . 17081 mutation . 17081 NMR . 17081 prion . 17081 temperature . 17081 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17081 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 480 17081 '15N chemical shifts' 135 17081 '1H chemical shifts' 787 17081 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2012-03-09 2010-07-28 original author . 17081 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 17082 'Prion Protein with 175A mutation' 17081 BMRB 17084 'Prion Protein' 17081 BMRB 17087 'Prion Protein with Y169A, Y225A, Y226A mutation' 17081 PDB 2L1D 'BMRB Entry Tracking System' 17081 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 17081 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21987789 _Citation.Full_citation . _Citation.Title 'Cellular prion protein conformation and function.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full 'Proceedings of the National Academy of Sciences of the United States of America' _Citation.Journal_volume 108 _Citation.Journal_issue 42 _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 17308 _Citation.Page_last 17313 _Citation.Year 2011 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Fred Damberger . F. . 17081 1 2 Barbara Christen . . . 17081 1 3 Daniel Perez . R. . 17081 1 4 Simone Hornemann . . . 17081 1 5 Kurt Wuthrich . . . 17081 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17081 _Assembly.ID 1 _Assembly.Name 'Prion with Y169G mutation' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _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 prion 1 $prion A . yes native no no . . . 17081 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 61 61 SG . 1 . 1 CYS 96 96 SG 1 . 179 CYS SG 1 . 213 CYS SG 17081 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_prion _Entity.Sf_category entity _Entity.Sf_framecode prion _Entity.Entry_ID 17081 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Prion with Y169G mutation' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSVVGGLGGYMLGSAMSRPM IHFGNDWEDRYYRENMYRYP NQVYYRPVDQGSNQNNFVHD CVNITIKQHTVTTTTKGENF TETDVKMMERVVEQMCVTQY QKESQAYYDGRRSS ; _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 114 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation Y169G _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 BMRB 15845 . Prion_Protein . . . . . 100.00 114 98.25 99.12 8.55e-77 . . . . 17081 1 2 no BMRB 16071 . mPrP90 . . . . . 99.12 144 98.23 99.12 1.90e-76 . . . . 17081 1 3 no BMRB 16075 . mPrP90_M129V . . . . . 99.12 141 97.35 99.12 7.13e-76 . . . . 17081 1 4 no BMRB 16076 . mPrP90_P102L . . . . . 99.12 141 98.23 99.12 1.05e-76 . . . . 17081 1 5 no BMRB 16077 . mPrP90_P105L . . . . . 99.12 141 98.23 99.12 1.05e-76 . . . . 17081 1 6 no BMRB 16078 . mPrP90_A117V . . . . . 99.12 142 98.23 99.12 2.15e-76 . . . . 17081 1 7 no BMRB 16079 . mPrP90_3AV . . . . . 99.12 142 98.23 99.12 3.32e-76 . . . . 17081 1 8 no BMRB 16080 . mPrP90_2II . . . . . 99.12 142 98.23 99.12 2.06e-76 . . . . 17081 1 9 no BMRB 16184 . mpp_121-231 . . . . . 100.00 114 97.37 97.37 1.37e-75 . . . . 17081 1 10 no BMRB 16185 . mpp_121-231 . . . . . 100.00 114 98.25 98.25 5.83e-77 . . . . 17081 1 11 no BMRB 16722 . "mouse prion protein double mutant D167S, N173K" . . . . . 99.12 113 98.23 98.23 7.03e-76 . . . . 17081 1 12 no BMRB 16723 . "mouse prion protein double mutant D167S, N173K" . . . . . 99.12 113 97.35 97.35 4.26e-75 . . . . 17081 1 13 no BMRB 17082 . mPrP121-231_F175A . . . . . 100.00 114 98.25 98.25 2.46e-76 . . . . 17081 1 14 no BMRB 17084 . prion . . . . . 100.00 114 99.12 99.12 1.66e-77 . . . . 17081 1 15 no BMRB 17087 . "Prion with Y169A, Y225A, Y226A mutation" . . . . . 100.00 114 97.37 97.37 1.49e-76 . . . . 17081 1 16 no BMRB 17174 . Mouse_prion . . . . . 100.00 114 99.12 99.12 1.66e-77 . . . . 17081 1 17 no BMRB 17213 . entity . . . . . 100.00 114 99.12 99.12 2.54e-78 . . . . 17081 1 18 no BMRB 17758 . mPrP(121-232) . . . . . 100.00 114 99.12 99.12 1.66e-77 . . . . 17081 1 19 no BMRB 17759 . mPrP(121-232) . . . . . 100.00 114 97.37 97.37 1.11e-74 . . . . 17081 1 20 no PDB 1AG2 . "Prion Protein Domain Prp(121-231) From Mouse, Nmr, 2 Minimized Average Structure" . . . . . 89.47 103 99.02 99.02 1.65e-68 . . . . 17081 1 21 no PDB 1XYX . "Mouse Prion Protein Fragment 121-231" . . . . . 98.25 112 99.11 99.11 5.19e-76 . . . . 17081 1 22 no PDB 1Y15 . "Mouse Prion Protein With Mutation N174t" . . . . . 98.25 112 98.21 98.21 4.04e-75 . . . . 17081 1 23 no PDB 1Y16 . "Mouse Prion Protein With Mutations S170n And N174t" . . . . . 98.25 112 97.32 98.21 1.72e-74 . . . . 17081 1 24 no PDB 2K5O . "Mouse Prion Protein (121-231) With Mutation S170n" . . . . . 100.00 114 98.25 99.12 8.55e-77 . . . . 17081 1 25 no PDB 2KFM . "Mouse Prion Protein (121-231) With Mutations Y225a And Y226a" . . . . . 100.00 114 97.37 97.37 1.37e-75 . . . . 17081 1 26 no PDB 2KFO . "Mouse Prion Protein (121-231) With Mutation V166a" . . . . . 100.00 114 98.25 98.25 5.83e-77 . . . . 17081 1 27 no PDB 2KU5 . "Mouse Prion Protein (121-231) With Mutation D167s" . . . . . 99.12 113 98.23 98.23 7.03e-76 . . . . 17081 1 28 no PDB 2KU6 . "Mouse Prion Protein (121-231) With Mutations D167s And N173k" . . . . . 99.12 113 97.35 97.35 4.26e-75 . . . . 17081 1 29 no PDB 2L1D . "Mouse Prion Protein (121-231) Containing The Substitution Y169g" . . . . . 100.00 114 100.00 100.00 8.26e-79 . . . . 17081 1 30 no PDB 2L1E . "Mouse Prion Protein (121-231) Containing The Substitution F175a" . . . . . 100.00 114 98.25 98.25 2.46e-76 . . . . 17081 1 31 no PDB 2L1H . "Mouse Prion Protein Fragment 121-231 At 20 C" . . . . . 100.00 114 99.12 99.12 1.66e-77 . . . . 17081 1 32 no PDB 2L1K . "Mouse Prion Protein (121-231) Containing The Substitutions Y169a, Y225a, And Y226a" . . . . . 100.00 114 97.37 97.37 1.49e-76 . . . . 17081 1 33 no PDB 2L39 . "Mouse Prion Protein Fragment 121-231 At 37 C" . . . . . 100.00 114 99.12 99.12 1.66e-77 . . . . 17081 1 34 no PDB 2L40 . "Mouse Prion Protein (121-231) Containing The Substitution Y169a" . . . . . 100.00 114 99.12 99.12 2.54e-78 . . . . 17081 1 35 no PDB 4H88 . "Structure Of Pom1 Fab Fragment Complexed With Mouse Prpc Fragment 120- 230" . . . . . 97.37 111 98.20 98.20 1.48e-74 . . . . 17081 1 36 no PDB 4MA7 . "Crystal Structure Of Mouse Prion Protein Complexed With Promazine" . . . . . 98.25 114 98.21 99.11 6.30e-76 . . . . 17081 1 37 no PDB 4MA8 . "Crystal Structure Of Mouse Prion Protein Complexed With Chlorpromazine" . . . . . 98.25 114 98.21 99.11 6.30e-76 . . . . 17081 1 38 no DBJ BAA08790 . "prion protein [Rattus norvegicus]" . . . . . 100.00 254 97.37 99.12 2.20e-75 . . . . 17081 1 39 no DBJ BAE28320 . "unnamed protein product [Mus musculus]" . . . . . 100.00 254 97.37 99.12 1.62e-75 . . . . 17081 1 40 no DBJ BAE28693 . "unnamed protein product [Mus musculus]" . . . . . 100.00 254 97.37 98.25 4.55e-75 . . . . 17081 1 41 no DBJ BAE29994 . "unnamed protein product [Mus musculus]" . . . . . 100.00 254 97.37 98.25 5.72e-75 . . . . 17081 1 42 no DBJ BAE34221 . "unnamed protein product [Mus musculus]" . . . . . 100.00 254 98.25 99.12 9.52e-76 . . . . 17081 1 43 no EMBL CAJ18553 . "Prnp [Mus musculus]" . . . . . 100.00 254 98.25 99.12 7.83e-76 . . . . 17081 1 44 no GB AAA39996 . "prion protein [Mus musculus]" . . . . . 100.00 254 97.37 99.12 4.27e-75 . . . . 17081 1 45 no GB AAA39997 . "prion protein [Mus musculus]" . . . . . 100.00 254 98.25 99.12 7.83e-76 . . . . 17081 1 46 no GB AAA39998 . "prion protein [Mus musculus]" . . . . . 100.00 254 97.37 98.25 5.84e-75 . . . . 17081 1 47 no GB AAA41947 . "prion-related protein, partial [Rattus norvegicus]" . . . . . 100.00 226 97.37 99.12 7.61e-76 . . . . 17081 1 48 no GB AAB30728 . "prion protein [Rattus norvegicus]" . . . . . 100.00 254 97.37 99.12 2.20e-75 . . . . 17081 1 49 no REF NP_001265185 . "major prion protein precursor [Mus musculus]" . . . . . 100.00 254 98.25 99.12 7.83e-76 . . . . 17081 1 50 no REF NP_035300 . "major prion protein precursor [Mus musculus]" . . . . . 100.00 254 98.25 99.12 7.83e-76 . . . . 17081 1 51 no REF NP_036763 . "major prion protein precursor [Rattus norvegicus]" . . . . . 100.00 254 97.37 99.12 2.20e-75 . . . . 17081 1 52 no REF XP_006235124 . "PREDICTED: major prion protein isoform X1 [Rattus norvegicus]" . . . . . 100.00 254 97.37 99.12 2.20e-75 . . . . 17081 1 53 no SP P04925 . "RecName: Full=Major prion protein; Short=PrP; AltName: Full=PrP27-30; AltName: Full=PrP33-35C; AltName: CD_antigen=CD230; Flags" . . . . . 100.00 254 98.25 99.12 7.83e-76 . . . . 17081 1 54 no SP P13852 . "RecName: Full=Major prion protein; Short=PrP; AltName: CD_antigen=CD230; Flags: Precursor" . . . . . 100.00 254 97.37 99.12 2.20e-75 . . . . 17081 1 55 no SP Q9Z0T3 . "RecName: Full=Major prion protein; Short=PrP; AltName: CD_antigen=CD230; Flags: Precursor" . . . . . 100.00 254 97.37 99.12 3.11e-75 . . . . 17081 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 1 119 GLY . 17081 1 2 120 SER . 17081 1 3 121 VAL . 17081 1 4 122 VAL . 17081 1 5 123 GLY . 17081 1 6 124 GLY . 17081 1 7 125 LEU . 17081 1 8 126 GLY . 17081 1 9 127 GLY . 17081 1 10 128 TYR . 17081 1 11 129 MET . 17081 1 12 130 LEU . 17081 1 13 131 GLY . 17081 1 14 132 SER . 17081 1 15 133 ALA . 17081 1 16 134 MET . 17081 1 17 135 SER . 17081 1 18 136 ARG . 17081 1 19 137 PRO . 17081 1 20 138 MET . 17081 1 21 139 ILE . 17081 1 22 140 HIS . 17081 1 23 141 PHE . 17081 1 24 142 GLY . 17081 1 25 143 ASN . 17081 1 26 144 ASP . 17081 1 27 145 TRP . 17081 1 28 146 GLU . 17081 1 29 147 ASP . 17081 1 30 148 ARG . 17081 1 31 149 TYR . 17081 1 32 150 TYR . 17081 1 33 151 ARG . 17081 1 34 152 GLU . 17081 1 35 153 ASN . 17081 1 36 154 MET . 17081 1 37 155 TYR . 17081 1 38 156 ARG . 17081 1 39 157 TYR . 17081 1 40 158 PRO . 17081 1 41 159 ASN . 17081 1 42 160 GLN . 17081 1 43 161 VAL . 17081 1 44 162 TYR . 17081 1 45 163 TYR . 17081 1 46 164 ARG . 17081 1 47 165 PRO . 17081 1 48 166 VAL . 17081 1 49 167 ASP . 17081 1 50 168 GLN . 17081 1 51 169 GLY . 17081 1 52 170 SER . 17081 1 53 171 ASN . 17081 1 54 172 GLN . 17081 1 55 173 ASN . 17081 1 56 174 ASN . 17081 1 57 175 PHE . 17081 1 58 176 VAL . 17081 1 59 177 HIS . 17081 1 60 178 ASP . 17081 1 61 179 CYS . 17081 1 62 180 VAL . 17081 1 63 181 ASN . 17081 1 64 182 ILE . 17081 1 65 183 THR . 17081 1 66 184 ILE . 17081 1 67 185 LYS . 17081 1 68 186 GLN . 17081 1 69 187 HIS . 17081 1 70 188 THR . 17081 1 71 189 VAL . 17081 1 72 190 THR . 17081 1 73 191 THR . 17081 1 74 192 THR . 17081 1 75 193 THR . 17081 1 76 194 LYS . 17081 1 77 195 GLY . 17081 1 78 196 GLU . 17081 1 79 197 ASN . 17081 1 80 198 PHE . 17081 1 81 199 THR . 17081 1 82 200 GLU . 17081 1 83 201 THR . 17081 1 84 202 ASP . 17081 1 85 203 VAL . 17081 1 86 204 LYS . 17081 1 87 205 MET . 17081 1 88 206 MET . 17081 1 89 207 GLU . 17081 1 90 208 ARG . 17081 1 91 209 VAL . 17081 1 92 210 VAL . 17081 1 93 211 GLU . 17081 1 94 212 GLN . 17081 1 95 213 MET . 17081 1 96 214 CYS . 17081 1 97 215 VAL . 17081 1 98 216 THR . 17081 1 99 217 GLN . 17081 1 100 218 TYR . 17081 1 101 219 GLN . 17081 1 102 220 LYS . 17081 1 103 221 GLU . 17081 1 104 222 SER . 17081 1 105 223 GLN . 17081 1 106 224 ALA . 17081 1 107 225 TYR . 17081 1 108 226 TYR . 17081 1 109 227 ASP . 17081 1 110 228 GLY . 17081 1 111 229 ARG . 17081 1 112 230 ARG . 17081 1 113 231 SER . 17081 1 114 232 SER . 17081 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 . GLY 1 1 17081 1 . SER 2 2 17081 1 . VAL 3 3 17081 1 . VAL 4 4 17081 1 . GLY 5 5 17081 1 . GLY 6 6 17081 1 . LEU 7 7 17081 1 . GLY 8 8 17081 1 . GLY 9 9 17081 1 . TYR 10 10 17081 1 . MET 11 11 17081 1 . LEU 12 12 17081 1 . GLY 13 13 17081 1 . SER 14 14 17081 1 . ALA 15 15 17081 1 . MET 16 16 17081 1 . SER 17 17 17081 1 . ARG 18 18 17081 1 . PRO 19 19 17081 1 . MET 20 20 17081 1 . ILE 21 21 17081 1 . HIS 22 22 17081 1 . PHE 23 23 17081 1 . GLY 24 24 17081 1 . ASN 25 25 17081 1 . ASP 26 26 17081 1 . TRP 27 27 17081 1 . GLU 28 28 17081 1 . ASP 29 29 17081 1 . ARG 30 30 17081 1 . TYR 31 31 17081 1 . TYR 32 32 17081 1 . ARG 33 33 17081 1 . GLU 34 34 17081 1 . ASN 35 35 17081 1 . MET 36 36 17081 1 . TYR 37 37 17081 1 . ARG 38 38 17081 1 . TYR 39 39 17081 1 . PRO 40 40 17081 1 . ASN 41 41 17081 1 . GLN 42 42 17081 1 . VAL 43 43 17081 1 . TYR 44 44 17081 1 . TYR 45 45 17081 1 . ARG 46 46 17081 1 . PRO 47 47 17081 1 . VAL 48 48 17081 1 . ASP 49 49 17081 1 . GLN 50 50 17081 1 . GLY 51 51 17081 1 . SER 52 52 17081 1 . ASN 53 53 17081 1 . GLN 54 54 17081 1 . ASN 55 55 17081 1 . ASN 56 56 17081 1 . PHE 57 57 17081 1 . VAL 58 58 17081 1 . HIS 59 59 17081 1 . ASP 60 60 17081 1 . CYS 61 61 17081 1 . VAL 62 62 17081 1 . ASN 63 63 17081 1 . ILE 64 64 17081 1 . THR 65 65 17081 1 . ILE 66 66 17081 1 . LYS 67 67 17081 1 . GLN 68 68 17081 1 . HIS 69 69 17081 1 . THR 70 70 17081 1 . VAL 71 71 17081 1 . THR 72 72 17081 1 . THR 73 73 17081 1 . THR 74 74 17081 1 . THR 75 75 17081 1 . LYS 76 76 17081 1 . GLY 77 77 17081 1 . GLU 78 78 17081 1 . ASN 79 79 17081 1 . PHE 80 80 17081 1 . THR 81 81 17081 1 . GLU 82 82 17081 1 . THR 83 83 17081 1 . ASP 84 84 17081 1 . VAL 85 85 17081 1 . LYS 86 86 17081 1 . MET 87 87 17081 1 . MET 88 88 17081 1 . GLU 89 89 17081 1 . ARG 90 90 17081 1 . VAL 91 91 17081 1 . VAL 92 92 17081 1 . GLU 93 93 17081 1 . GLN 94 94 17081 1 . MET 95 95 17081 1 . CYS 96 96 17081 1 . VAL 97 97 17081 1 . THR 98 98 17081 1 . GLN 99 99 17081 1 . TYR 100 100 17081 1 . GLN 101 101 17081 1 . LYS 102 102 17081 1 . GLU 103 103 17081 1 . SER 104 104 17081 1 . GLN 105 105 17081 1 . ALA 106 106 17081 1 . TYR 107 107 17081 1 . TYR 108 108 17081 1 . ASP 109 109 17081 1 . GLY 110 110 17081 1 . ARG 111 111 17081 1 . ARG 112 112 17081 1 . SER 113 113 17081 1 . SER 114 114 17081 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 17081 _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 $prion . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 17081 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 17081 _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 $prion . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pRSETA . . . . . . 17081 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17081 _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 prion '[U-99% 13C; U-99% 15N]' . . 1 $prion . . 1.9 . . mM . . . . 17081 1 2 'sodium acetate' [U-2H] . . . . . . 10 . . mM . . . . 17081 1 3 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 17081 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17081 1 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17081 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 17081 _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' 0.01 . M 17081 1 pH 4.5 . pH 17081 1 pressure 1 . atm 17081 1 temperature 293.2 . K 17081 1 stop_ save_ ############################ # Computer software used # ############################ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 17081 _Software.ID 1 _Software.Name xwinnmr _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17081 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17081 1 processing 17081 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 17081 _Software.ID 2 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 17081 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17081 2 stop_ save_ save_ATNOS-CANDID _Software.Sf_category software _Software.Sf_framecode ATNOS-CANDID _Software.Entry_ID 17081 _Software.ID 3 _Software.Name ATHNOS-CANDID _Software.Version 1.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Herrmann, Guntert and Wuthrich' . . 17081 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17081 3 'peak picking' 17081 3 stop_ save_ save_DYANA _Software.Sf_category software _Software.Sf_framecode DYANA _Software.Entry_ID 17081 _Software.ID 4 _Software.Name DYANA _Software.Version 1.0.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17081 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17081 4 stop_ save_ save_OPALP _Software.Sf_category software _Software.Sf_framecode OPALP _Software.Entry_ID 17081 _Software.ID 5 _Software.Name OPALP _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Luginbuhl, Guntert, Billeter and Wuthrich' . . 17081 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17081 5 stop_ save_ save_Molmol _Software.Sf_category software _Software.Sf_framecode Molmol _Software.Entry_ID 17081 _Software.ID 6 _Software.Name Molmol _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Koradi, Billeter and Wuthrich' . . 17081 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17081 6 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 17081 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17081 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 17081 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 17081 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17081 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 500 . . . 17081 1 2 spectrometer_2 Bruker Avance . 900 . . . 17081 1 3 spectrometer_3 Bruker DRX . 750 . . . 17081 1 4 spectrometer_4 Bruker DRX . 600 . . . 17081 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 17081 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17081 1 2 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 17081 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 17081 _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 internal indirect 0.251449530 'insert at outer edge of experimental sample tube' cylindrical parallel 1 $citations . . 1 $citations 17081 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1.0000 'insert at outer edge of experimental sample tube' cylindrical parallel 1 $citations . . 1 $citations 17081 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.101329118 'insert at outer edge of experimental sample tube' cylindrical parallel 1 $citations . . 1 $citations 17081 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 17081 _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 1 '3D 1H-15N NOESY' . . . 17081 1 2 '3D 1H-13C NOESY' . . . 17081 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.920 0.020 . 1 . . . . 119 GLY HA2 . 17081 1 2 . 1 1 1 1 GLY HA3 H 1 3.920 0.020 . 1 . . . . 119 GLY HA3 . 17081 1 3 . 1 1 1 1 GLY C C 13 167.403 0.3 . 1 . . . . 119 GLY C . 17081 1 4 . 1 1 1 1 GLY CA C 13 42.909 0.3 . 1 . . . . 119 GLY CA . 17081 1 5 . 1 1 2 2 SER H H 1 8.686 0.020 . 1 . . . . 120 SER H . 17081 1 6 . 1 1 2 2 SER HA H 1 4.613 0.020 . 1 . . . . 120 SER HA . 17081 1 7 . 1 1 2 2 SER HB2 H 1 3.844 0.020 . 1 . . . . 120 SER HB2 . 17081 1 8 . 1 1 2 2 SER HB3 H 1 3.844 0.020 . 1 . . . . 120 SER HB3 . 17081 1 9 . 1 1 2 2 SER C C 13 171.624 0.3 . 1 . . . . 120 SER C . 17081 1 10 . 1 1 2 2 SER CA C 13 57.547 0.3 . 1 . . . . 120 SER CA . 17081 1 11 . 1 1 2 2 SER CB C 13 63.686 0.3 . 1 . . . . 120 SER CB . 17081 1 12 . 1 1 2 2 SER N N 15 115.698 0.3 . 1 . . . . 120 SER N . 17081 1 13 . 1 1 3 3 VAL H H 1 8.420 0.020 . 1 . . . . 121 VAL H . 17081 1 14 . 1 1 3 3 VAL HA H 1 4.195 0.020 . 1 . . . . 121 VAL HA . 17081 1 15 . 1 1 3 3 VAL HB H 1 2.061 0.020 . 1 . . . . 121 VAL HB . 17081 1 16 . 1 1 3 3 VAL HG11 H 1 0.927 0.020 . 2 . . . . 121 VAL HG1 . 17081 1 17 . 1 1 3 3 VAL HG12 H 1 0.927 0.020 . 2 . . . . 121 VAL HG1 . 17081 1 18 . 1 1 3 3 VAL HG13 H 1 0.927 0.020 . 2 . . . . 121 VAL HG1 . 17081 1 19 . 1 1 3 3 VAL HG21 H 1 0.893 0.020 . 2 . . . . 121 VAL HG2 . 17081 1 20 . 1 1 3 3 VAL HG22 H 1 0.893 0.020 . 2 . . . . 121 VAL HG2 . 17081 1 21 . 1 1 3 3 VAL HG23 H 1 0.893 0.020 . 2 . . . . 121 VAL HG2 . 17081 1 22 . 1 1 3 3 VAL C C 13 173.658 0.3 . 1 . . . . 121 VAL C . 17081 1 23 . 1 1 3 3 VAL CA C 13 61.875 0.3 . 1 . . . . 121 VAL CA . 17081 1 24 . 1 1 3 3 VAL CB C 13 32.324 0.3 . 1 . . . . 121 VAL CB . 17081 1 25 . 1 1 3 3 VAL CG1 C 13 20.177 0.3 . 1 . . . . 121 VAL CG1 . 17081 1 26 . 1 1 3 3 VAL CG2 C 13 20.728 0.3 . 1 . . . . 121 VAL CG2 . 17081 1 27 . 1 1 3 3 VAL N N 15 122.291 0.3 . 1 . . . . 121 VAL N . 17081 1 28 . 1 1 4 4 VAL H H 1 8.355 0.020 . 1 . . . . 122 VAL H . 17081 1 29 . 1 1 4 4 VAL HA H 1 4.103 0.020 . 1 . . . . 122 VAL HA . 17081 1 30 . 1 1 4 4 VAL HB H 1 2.036 0.020 . 1 . . . . 122 VAL HB . 17081 1 31 . 1 1 4 4 VAL HG11 H 1 0.927 0.020 . 2 . . . . 122 VAL HG1 . 17081 1 32 . 1 1 4 4 VAL HG12 H 1 0.927 0.020 . 2 . . . . 122 VAL HG1 . 17081 1 33 . 1 1 4 4 VAL HG13 H 1 0.927 0.020 . 2 . . . . 122 VAL HG1 . 17081 1 34 . 1 1 4 4 VAL HG21 H 1 0.920 0.020 . 2 . . . . 122 VAL HG2 . 17081 1 35 . 1 1 4 4 VAL HG22 H 1 0.920 0.020 . 2 . . . . 122 VAL HG2 . 17081 1 36 . 1 1 4 4 VAL HG23 H 1 0.920 0.020 . 2 . . . . 122 VAL HG2 . 17081 1 37 . 1 1 4 4 VAL C C 13 174.018 0.3 . 1 . . . . 122 VAL C . 17081 1 38 . 1 1 4 4 VAL CA C 13 62.051 0.3 . 1 . . . . 122 VAL CA . 17081 1 39 . 1 1 4 4 VAL CB C 13 32.188 0.3 . 1 . . . . 122 VAL CB . 17081 1 40 . 1 1 4 4 VAL CG1 C 13 20.727 0.3 . 1 . . . . 122 VAL CG1 . 17081 1 41 . 1 1 4 4 VAL CG2 C 13 20.723 0.3 . 1 . . . . 122 VAL CG2 . 17081 1 42 . 1 1 4 4 VAL N N 15 125.171 0.3 . 1 . . . . 122 VAL N . 17081 1 43 . 1 1 5 5 GLY H H 1 8.625 0.020 . 1 . . . . 123 GLY H . 17081 1 44 . 1 1 5 5 GLY HA2 H 1 3.961 0.020 . 1 . . . . 123 GLY HA2 . 17081 1 45 . 1 1 5 5 GLY HA3 H 1 3.961 0.020 . 1 . . . . 123 GLY HA3 . 17081 1 46 . 1 1 5 5 GLY C C 13 172.044 0.3 . 1 . . . . 123 GLY C . 17081 1 47 . 1 1 5 5 GLY CA C 13 44.920 0.3 . 1 . . . . 123 GLY CA . 17081 1 48 . 1 1 5 5 GLY N N 15 113.649 0.3 . 1 . . . . 123 GLY N . 17081 1 49 . 1 1 6 6 GLY H H 1 8.342 0.020 . 1 . . . . 124 GLY H . 17081 1 50 . 1 1 6 6 GLY HA2 H 1 3.964 0.020 . 1 . . . . 124 GLY HA2 . 17081 1 51 . 1 1 6 6 GLY HA3 H 1 3.964 0.020 . 1 . . . . 124 GLY HA3 . 17081 1 52 . 1 1 6 6 GLY C C 13 171.739 0.3 . 1 . . . . 124 GLY C . 17081 1 53 . 1 1 6 6 GLY CA C 13 44.976 0.3 . 1 . . . . 124 GLY CA . 17081 1 54 . 1 1 6 6 GLY N N 15 108.765 0.3 . 1 . . . . 124 GLY N . 17081 1 55 . 1 1 7 7 LEU H H 1 8.257 0.020 . 1 . . . . 125 LEU H . 17081 1 56 . 1 1 7 7 LEU HA H 1 4.393 0.020 . 1 . . . . 125 LEU HA . 17081 1 57 . 1 1 7 7 LEU HB2 H 1 1.514 0.020 . 2 . . . . 125 LEU HB2 . 17081 1 58 . 1 1 7 7 LEU HB3 H 1 1.625 0.020 . 2 . . . . 125 LEU HB3 . 17081 1 59 . 1 1 7 7 LEU HD11 H 1 0.653 0.020 . 2 . . . . 125 LEU HD1 . 17081 1 60 . 1 1 7 7 LEU HD12 H 1 0.653 0.020 . 2 . . . . 125 LEU HD1 . 17081 1 61 . 1 1 7 7 LEU HD13 H 1 0.653 0.020 . 2 . . . . 125 LEU HD1 . 17081 1 62 . 1 1 7 7 LEU HD21 H 1 0.517 0.020 . 2 . . . . 125 LEU HD2 . 17081 1 63 . 1 1 7 7 LEU HD22 H 1 0.517 0.020 . 2 . . . . 125 LEU HD2 . 17081 1 64 . 1 1 7 7 LEU HD23 H 1 0.517 0.020 . 2 . . . . 125 LEU HD2 . 17081 1 65 . 1 1 7 7 LEU HG H 1 1.477 0.020 . 1 . . . . 125 LEU HG . 17081 1 66 . 1 1 7 7 LEU C C 13 175.304 0.3 . 1 . . . . 125 LEU C . 17081 1 67 . 1 1 7 7 LEU CA C 13 54.244 0.3 . 1 . . . . 125 LEU CA . 17081 1 68 . 1 1 7 7 LEU CB C 13 42.073 0.3 . 1 . . . . 125 LEU CB . 17081 1 69 . 1 1 7 7 LEU CD1 C 13 24.229 0.3 . 1 . . . . 125 LEU CD1 . 17081 1 70 . 1 1 7 7 LEU CD2 C 13 23.061 0.3 . 1 . . . . 125 LEU CD2 . 17081 1 71 . 1 1 7 7 LEU CG C 13 26.458 0.3 . 1 . . . . 125 LEU CG . 17081 1 72 . 1 1 7 7 LEU N N 15 121.826 0.3 . 1 . . . . 125 LEU N . 17081 1 73 . 1 1 8 8 GLY H H 1 8.572 0.020 . 1 . . . . 126 GLY H . 17081 1 74 . 1 1 8 8 GLY HA2 H 1 3.852 0.020 . 1 . . . . 126 GLY HA2 . 17081 1 75 . 1 1 8 8 GLY C C 13 172.297 0.3 . 1 . . . . 126 GLY C . 17081 1 76 . 1 1 8 8 GLY CA C 13 46.037 0.3 . 1 . . . . 126 GLY CA . 17081 1 77 . 1 1 8 8 GLY N N 15 110.113 0.3 . 1 . . . . 126 GLY N . 17081 1 78 . 1 1 9 9 GLY H H 1 8.457 0.020 . 1 . . . . 127 GLY H . 17081 1 79 . 1 1 9 9 GLY HA2 H 1 3.727 0.020 . 1 . . . . 127 GLY HA2 . 17081 1 80 . 1 1 9 9 GLY C C 13 171.179 0.3 . 1 . . . . 127 GLY C . 17081 1 81 . 1 1 9 9 GLY CA C 13 44.648 0.3 . 1 . . . . 127 GLY CA . 17081 1 82 . 1 1 9 9 GLY N N 15 109.683 0.3 . 1 . . . . 127 GLY N . 17081 1 83 . 1 1 10 10 TYR H H 1 7.715 0.020 . 1 . . . . 128 TYR H . 17081 1 84 . 1 1 10 10 TYR HA H 1 4.523 0.020 . 1 . . . . 128 TYR HA . 17081 1 85 . 1 1 10 10 TYR HB2 H 1 2.875 0.020 . 2 . . . . 128 TYR HB2 . 17081 1 86 . 1 1 10 10 TYR HB3 H 1 2.774 0.020 . 2 . . . . 128 TYR HB3 . 17081 1 87 . 1 1 10 10 TYR HD1 H 1 6.781 0.020 . 1 . . . . 128 TYR HD1 . 17081 1 88 . 1 1 10 10 TYR HD2 H 1 6.781 0.020 . 1 . . . . 128 TYR HD2 . 17081 1 89 . 1 1 10 10 TYR HE1 H 1 6.682 0.020 . 1 . . . . 128 TYR HE1 . 17081 1 90 . 1 1 10 10 TYR HE2 H 1 6.682 0.020 . 1 . . . . 128 TYR HE2 . 17081 1 91 . 1 1 10 10 TYR C C 13 172.948 0.3 . 1 . . . . 128 TYR C . 17081 1 92 . 1 1 10 10 TYR CA C 13 57.627 0.3 . 1 . . . . 128 TYR CA . 17081 1 93 . 1 1 10 10 TYR CB C 13 39.936 0.3 . 1 . . . . 128 TYR CB . 17081 1 94 . 1 1 10 10 TYR CD1 C 13 132.321 0.3 . 1 . . . . 128 TYR CD1 . 17081 1 95 . 1 1 10 10 TYR CE1 C 13 118.034 0.3 . 1 . . . . 128 TYR CE1 . 17081 1 96 . 1 1 10 10 TYR N N 15 117.491 0.3 . 1 . . . . 128 TYR N . 17081 1 97 . 1 1 11 11 MET H H 1 9.036 0.020 . 1 . . . . 129 MET H . 17081 1 98 . 1 1 11 11 MET HA H 1 4.577 0.020 . 1 . . . . 129 MET HA . 17081 1 99 . 1 1 11 11 MET HB2 H 1 0.925 0.020 . 2 . . . . 129 MET HB2 . 17081 1 100 . 1 1 11 11 MET HB3 H 1 1.596 0.020 . 2 . . . . 129 MET HB3 . 17081 1 101 . 1 1 11 11 MET HE1 H 1 2.040 0.020 . 1 . . . . 129 MET HE . 17081 1 102 . 1 1 11 11 MET HE2 H 1 2.040 0.020 . 1 . . . . 129 MET HE . 17081 1 103 . 1 1 11 11 MET HE3 H 1 2.040 0.020 . 1 . . . . 129 MET HE . 17081 1 104 . 1 1 11 11 MET HG2 H 1 2.246 0.020 . 2 . . . . 129 MET HG2 . 17081 1 105 . 1 1 11 11 MET HG3 H 1 2.214 0.020 . 2 . . . . 129 MET HG3 . 17081 1 106 . 1 1 11 11 MET C C 13 170.338 0.3 . 1 . . . . 129 MET C . 17081 1 107 . 1 1 11 11 MET CA C 13 53.003 0.3 . 1 . . . . 129 MET CA . 17081 1 108 . 1 1 11 11 MET CB C 13 34.333 0.3 . 1 . . . . 129 MET CB . 17081 1 109 . 1 1 11 11 MET CE C 13 16.797 0.3 . 1 . . . . 129 MET CE . 17081 1 110 . 1 1 11 11 MET CG C 13 31.790 0.3 . 1 . . . . 129 MET CG . 17081 1 111 . 1 1 11 11 MET N N 15 120.640 0.3 . 1 . . . . 129 MET N . 17081 1 112 . 1 1 12 12 LEU H H 1 8.128 0.020 . 1 . . . . 130 LEU H . 17081 1 113 . 1 1 12 12 LEU HA H 1 4.457 0.020 . 1 . . . . 130 LEU HA . 17081 1 114 . 1 1 12 12 LEU HB2 H 1 0.949 0.020 . 2 . . . . 130 LEU HB2 . 17081 1 115 . 1 1 12 12 LEU HB3 H 1 1.619 0.020 . 2 . . . . 130 LEU HB3 . 17081 1 116 . 1 1 12 12 LEU HD11 H 1 -0.066 0.020 . 2 . . . . 130 LEU HD1 . 17081 1 117 . 1 1 12 12 LEU HD12 H 1 -0.066 0.020 . 2 . . . . 130 LEU HD1 . 17081 1 118 . 1 1 12 12 LEU HD13 H 1 -0.066 0.020 . 2 . . . . 130 LEU HD1 . 17081 1 119 . 1 1 12 12 LEU HD21 H 1 0.627 0.020 . 2 . . . . 130 LEU HD2 . 17081 1 120 . 1 1 12 12 LEU HD22 H 1 0.627 0.020 . 2 . . . . 130 LEU HD2 . 17081 1 121 . 1 1 12 12 LEU HD23 H 1 0.627 0.020 . 2 . . . . 130 LEU HD2 . 17081 1 122 . 1 1 12 12 LEU HG H 1 1.391 0.020 . 1 . . . . 130 LEU HG . 17081 1 123 . 1 1 12 12 LEU C C 13 175.495 0.3 . 1 . . . . 130 LEU C . 17081 1 124 . 1 1 12 12 LEU CA C 13 52.928 0.3 . 1 . . . . 130 LEU CA . 17081 1 125 . 1 1 12 12 LEU CB C 13 43.038 0.3 . 1 . . . . 130 LEU CB . 17081 1 126 . 1 1 12 12 LEU CD1 C 13 20.975 0.3 . 1 . . . . 130 LEU CD1 . 17081 1 127 . 1 1 12 12 LEU CD2 C 13 25.418 0.3 . 1 . . . . 130 LEU CD2 . 17081 1 128 . 1 1 12 12 LEU CG C 13 25.508 0.3 . 1 . . . . 130 LEU CG . 17081 1 129 . 1 1 12 12 LEU N N 15 121.274 0.3 . 1 . . . . 130 LEU N . 17081 1 130 . 1 1 13 13 GLY H H 1 9.396 0.020 . 1 . . . . 131 GLY H . 17081 1 131 . 1 1 13 13 GLY HA2 H 1 4.087 0.020 . 1 . . . . 131 GLY HA2 . 17081 1 132 . 1 1 13 13 GLY C C 13 170.109 0.3 . 1 . . . . 131 GLY C . 17081 1 133 . 1 1 13 13 GLY CA C 13 44.477 0.3 . 1 . . . . 131 GLY CA . 17081 1 134 . 1 1 13 13 GLY N N 15 115.327 0.3 . 1 . . . . 131 GLY N . 17081 1 135 . 1 1 14 14 SER H H 1 8.355 0.020 . 1 . . . . 132 SER H . 17081 1 136 . 1 1 14 14 SER HA H 1 4.405 0.020 . 1 . . . . 132 SER HA . 17081 1 137 . 1 1 14 14 SER HB2 H 1 3.916 0.020 . 2 . . . . 132 SER HB2 . 17081 1 138 . 1 1 14 14 SER HB3 H 1 3.990 0.020 . 2 . . . . 132 SER HB3 . 17081 1 139 . 1 1 14 14 SER C C 13 172.337 0.3 . 1 . . . . 132 SER C . 17081 1 140 . 1 1 14 14 SER CA C 13 58.063 0.3 . 1 . . . . 132 SER CA . 17081 1 141 . 1 1 14 14 SER CB C 13 63.543 0.3 . 1 . . . . 132 SER CB . 17081 1 142 . 1 1 14 14 SER N N 15 113.618 0.3 . 1 . . . . 132 SER N . 17081 1 143 . 1 1 15 15 ALA H H 1 8.774 0.020 . 1 . . . . 133 ALA H . 17081 1 144 . 1 1 15 15 ALA HA H 1 4.428 0.020 . 1 . . . . 133 ALA HA . 17081 1 145 . 1 1 15 15 ALA HB1 H 1 1.270 0.020 . 1 . . . . 133 ALA HB . 17081 1 146 . 1 1 15 15 ALA HB2 H 1 1.270 0.020 . 1 . . . . 133 ALA HB . 17081 1 147 . 1 1 15 15 ALA HB3 H 1 1.270 0.020 . 1 . . . . 133 ALA HB . 17081 1 148 . 1 1 15 15 ALA C C 13 174.896 0.3 . 1 . . . . 133 ALA C . 17081 1 149 . 1 1 15 15 ALA CA C 13 52.524 0.3 . 1 . . . . 133 ALA CA . 17081 1 150 . 1 1 15 15 ALA CB C 13 17.972 0.3 . 1 . . . . 133 ALA CB . 17081 1 151 . 1 1 15 15 ALA N N 15 125.446 0.3 . 1 . . . . 133 ALA N . 17081 1 152 . 1 1 16 16 MET H H 1 8.844 0.020 . 1 . . . . 134 MET H . 17081 1 153 . 1 1 16 16 MET HA H 1 4.751 0.020 . 1 . . . . 134 MET HA . 17081 1 154 . 1 1 16 16 MET HB2 H 1 2.054 0.020 . 2 . . . . 134 MET HB2 . 17081 1 155 . 1 1 16 16 MET HB3 H 1 1.999 0.020 . 2 . . . . 134 MET HB3 . 17081 1 156 . 1 1 16 16 MET HE1 H 1 2.217 0.020 . 1 . . . . 134 MET HE . 17081 1 157 . 1 1 16 16 MET HE2 H 1 2.217 0.020 . 1 . . . . 134 MET HE . 17081 1 158 . 1 1 16 16 MET HE3 H 1 2.217 0.020 . 1 . . . . 134 MET HE . 17081 1 159 . 1 1 16 16 MET HG2 H 1 2.544 0.020 . 2 . . . . 134 MET HG2 . 17081 1 160 . 1 1 16 16 MET HG3 H 1 2.453 0.020 . 2 . . . . 134 MET HG3 . 17081 1 161 . 1 1 16 16 MET C C 13 172.961 0.3 . 1 . . . . 134 MET C . 17081 1 162 . 1 1 16 16 MET CA C 13 53.445 0.3 . 1 . . . . 134 MET CA . 17081 1 163 . 1 1 16 16 MET CB C 13 36.459 0.3 . 1 . . . . 134 MET CB . 17081 1 164 . 1 1 16 16 MET CE C 13 17.498 0.3 . 1 . . . . 134 MET CE . 17081 1 165 . 1 1 16 16 MET CG C 13 31.072 0.3 . 1 . . . . 134 MET CG . 17081 1 166 . 1 1 16 16 MET N N 15 121.551 0.3 . 1 . . . . 134 MET N . 17081 1 167 . 1 1 17 17 SER H H 1 8.469 0.020 . 1 . . . . 135 SER H . 17081 1 168 . 1 1 17 17 SER HA H 1 4.338 0.020 . 1 . . . . 135 SER HA . 17081 1 169 . 1 1 17 17 SER HB2 H 1 3.843 0.020 . 2 . . . . 135 SER HB2 . 17081 1 170 . 1 1 17 17 SER HB3 H 1 3.754 0.020 . 2 . . . . 135 SER HB3 . 17081 1 171 . 1 1 17 17 SER C C 13 171.815 0.3 . 1 . . . . 135 SER C . 17081 1 172 . 1 1 17 17 SER CA C 13 58.264 0.3 . 1 . . . . 135 SER CA . 17081 1 173 . 1 1 17 17 SER CB C 13 62.615 0.3 . 1 . . . . 135 SER CB . 17081 1 174 . 1 1 17 17 SER N N 15 116.110 0.3 . 1 . . . . 135 SER N . 17081 1 175 . 1 1 18 18 ARG H H 1 8.708 0.020 . 1 . . . . 136 ARG H . 17081 1 176 . 1 1 18 18 ARG HA H 1 4.388 0.020 . 1 . . . . 136 ARG HA . 17081 1 177 . 1 1 18 18 ARG HB2 H 1 1.860 0.020 . 2 . . . . 136 ARG HB2 . 17081 1 178 . 1 1 18 18 ARG HB3 H 1 1.801 0.020 . 2 . . . . 136 ARG HB3 . 17081 1 179 . 1 1 18 18 ARG HD2 H 1 3.071 0.020 . 2 . . . . 136 ARG HD2 . 17081 1 180 . 1 1 18 18 ARG HD3 H 1 2.953 0.020 . 2 . . . . 136 ARG HD3 . 17081 1 181 . 1 1 18 18 ARG HE H 1 6.861 0.020 . 1 . . . . 136 ARG HE . 17081 1 182 . 1 1 18 18 ARG HG2 H 1 1.697 0.020 . 2 . . . . 136 ARG HG2 . 17081 1 183 . 1 1 18 18 ARG HG3 H 1 1.617 0.020 . 2 . . . . 136 ARG HG3 . 17081 1 184 . 1 1 18 18 ARG C C 13 172.083 0.3 . 1 . . . . 136 ARG C . 17081 1 185 . 1 1 18 18 ARG CA C 13 54.443 0.3 . 1 . . . . 136 ARG CA . 17081 1 186 . 1 1 18 18 ARG CB C 13 28.433 0.3 . 1 . . . . 136 ARG CB . 17081 1 187 . 1 1 18 18 ARG CD C 13 43.449 0.3 . 1 . . . . 136 ARG CD . 17081 1 188 . 1 1 18 18 ARG CG C 13 28.926 0.3 . 1 . . . . 136 ARG CG . 17081 1 189 . 1 1 18 18 ARG N N 15 126.555 0.3 . 1 . . . . 136 ARG N . 17081 1 190 . 1 1 18 18 ARG NE N 15 85.699 0.3 . 1 . . . . 136 ARG NE . 17081 1 191 . 1 1 19 19 PRO HA H 1 4.425 0.020 . 1 . . . . 137 PRO HA . 17081 1 192 . 1 1 19 19 PRO HB2 H 1 1.780 0.020 . 2 . . . . 137 PRO HB2 . 17081 1 193 . 1 1 19 19 PRO HB3 H 1 2.248 0.020 . 2 . . . . 137 PRO HB3 . 17081 1 194 . 1 1 19 19 PRO HD2 H 1 3.661 0.020 . 2 . . . . 137 PRO HD2 . 17081 1 195 . 1 1 19 19 PRO HD3 H 1 3.929 0.020 . 2 . . . . 137 PRO HD3 . 17081 1 196 . 1 1 19 19 PRO HG2 H 1 2.046 0.020 . 2 . . . . 137 PRO HG2 . 17081 1 197 . 1 1 19 19 PRO HG3 H 1 2.040 0.020 . 2 . . . . 137 PRO HG3 . 17081 1 198 . 1 1 19 19 PRO C C 13 173.127 0.3 . 1 . . . . 137 PRO C . 17081 1 199 . 1 1 19 19 PRO CA C 13 61.848 0.3 . 1 . . . . 137 PRO CA . 17081 1 200 . 1 1 19 19 PRO CB C 13 31.878 0.3 . 1 . . . . 137 PRO CB . 17081 1 201 . 1 1 19 19 PRO CD C 13 50.204 0.3 . 1 . . . . 137 PRO CD . 17081 1 202 . 1 1 19 19 PRO CG C 13 26.934 0.3 . 1 . . . . 137 PRO CG . 17081 1 203 . 1 1 20 20 MET H H 1 8.774 0.020 . 1 . . . . 138 MET H . 17081 1 204 . 1 1 20 20 MET HA H 1 4.879 0.020 . 1 . . . . 138 MET HA . 17081 1 205 . 1 1 20 20 MET HB2 H 1 2.024 0.020 . 2 . . . . 138 MET HB2 . 17081 1 206 . 1 1 20 20 MET HB3 H 1 2.005 0.020 . 2 . . . . 138 MET HB3 . 17081 1 207 . 1 1 20 20 MET HE1 H 1 2.136 0.020 . 1 . . . . 138 MET HE . 17081 1 208 . 1 1 20 20 MET HE2 H 1 2.136 0.020 . 1 . . . . 138 MET HE . 17081 1 209 . 1 1 20 20 MET HE3 H 1 2.136 0.020 . 1 . . . . 138 MET HE . 17081 1 210 . 1 1 20 20 MET HG2 H 1 2.697 0.020 . 2 . . . . 138 MET HG2 . 17081 1 211 . 1 1 20 20 MET HG3 H 1 2.334 0.020 . 2 . . . . 138 MET HG3 . 17081 1 212 . 1 1 20 20 MET C C 13 172.401 0.3 . 1 . . . . 138 MET C . 17081 1 213 . 1 1 20 20 MET CA C 13 53.573 0.3 . 1 . . . . 138 MET CA . 17081 1 214 . 1 1 20 20 MET CB C 13 29.797 0.3 . 1 . . . . 138 MET CB . 17081 1 215 . 1 1 20 20 MET CE C 13 16.030 0.3 . 1 . . . . 138 MET CE . 17081 1 216 . 1 1 20 20 MET CG C 13 31.431 0.3 . 1 . . . . 138 MET CG . 17081 1 217 . 1 1 20 20 MET N N 15 122.117 0.3 . 1 . . . . 138 MET N . 17081 1 218 . 1 1 21 21 ILE H H 1 6.567 0.020 . 1 . . . . 139 ILE H . 17081 1 219 . 1 1 21 21 ILE HA H 1 3.829 0.020 . 1 . . . . 139 ILE HA . 17081 1 220 . 1 1 21 21 ILE HB H 1 0.785 0.020 . 1 . . . . 139 ILE HB . 17081 1 221 . 1 1 21 21 ILE HD11 H 1 0.444 0.020 . 1 . . . . 139 ILE HD1 . 17081 1 222 . 1 1 21 21 ILE HD12 H 1 0.444 0.020 . 1 . . . . 139 ILE HD1 . 17081 1 223 . 1 1 21 21 ILE HD13 H 1 0.444 0.020 . 1 . . . . 139 ILE HD1 . 17081 1 224 . 1 1 21 21 ILE HG12 H 1 0.898 0.020 . 2 . . . . 139 ILE HG12 . 17081 1 225 . 1 1 21 21 ILE HG13 H 1 0.740 0.020 . 2 . . . . 139 ILE HG13 . 17081 1 226 . 1 1 21 21 ILE HG21 H 1 -0.109 0.020 . 1 . . . . 139 ILE HG2 . 17081 1 227 . 1 1 21 21 ILE HG22 H 1 -0.109 0.020 . 1 . . . . 139 ILE HG2 . 17081 1 228 . 1 1 21 21 ILE HG23 H 1 -0.109 0.020 . 1 . . . . 139 ILE HG2 . 17081 1 229 . 1 1 21 21 ILE C C 13 170.724 0.3 . 1 . . . . 139 ILE C . 17081 1 230 . 1 1 21 21 ILE CA C 13 59.045 0.3 . 1 . . . . 139 ILE CA . 17081 1 231 . 1 1 21 21 ILE CB C 13 38.498 0.3 . 1 . . . . 139 ILE CB . 17081 1 232 . 1 1 21 21 ILE CD1 C 13 12.067 0.3 . 1 . . . . 139 ILE CD1 . 17081 1 233 . 1 1 21 21 ILE CG1 C 13 26.195 0.3 . 1 . . . . 139 ILE CG1 . 17081 1 234 . 1 1 21 21 ILE CG2 C 13 16.772 0.3 . 1 . . . . 139 ILE CG2 . 17081 1 235 . 1 1 21 21 ILE N N 15 124.730 0.3 . 1 . . . . 139 ILE N . 17081 1 236 . 1 1 22 22 HIS H H 1 8.238 0.020 . 1 . . . . 140 HIS H . 17081 1 237 . 1 1 22 22 HIS HA H 1 4.924 0.020 . 1 . . . . 140 HIS HA . 17081 1 238 . 1 1 22 22 HIS HB2 H 1 3.303 0.020 . 2 . . . . 140 HIS HB2 . 17081 1 239 . 1 1 22 22 HIS HB3 H 1 2.951 0.020 . 2 . . . . 140 HIS HB3 . 17081 1 240 . 1 1 22 22 HIS HD2 H 1 7.224 0.020 . 1 . . . . 140 HIS HD2 . 17081 1 241 . 1 1 22 22 HIS HE1 H 1 8.579 0.020 . 1 . . . . 140 HIS HE1 . 17081 1 242 . 1 1 22 22 HIS C C 13 172.045 0.3 . 1 . . . . 140 HIS C . 17081 1 243 . 1 1 22 22 HIS CA C 13 53.597 0.3 . 1 . . . . 140 HIS CA . 17081 1 244 . 1 1 22 22 HIS CB C 13 29.103 0.3 . 1 . . . . 140 HIS CB . 17081 1 245 . 1 1 22 22 HIS CD2 C 13 119.546 0.3 . 1 . . . . 140 HIS CD2 . 17081 1 246 . 1 1 22 22 HIS CE1 C 13 136.082 0.3 . 1 . . . . 140 HIS CE1 . 17081 1 247 . 1 1 22 22 HIS N N 15 121.909 0.3 . 1 . . . . 140 HIS N . 17081 1 248 . 1 1 23 23 PHE H H 1 10.453 0.020 . 1 . . . . 141 PHE H . 17081 1 249 . 1 1 23 23 PHE HA H 1 4.272 0.020 . 1 . . . . 141 PHE HA . 17081 1 250 . 1 1 23 23 PHE HB2 H 1 2.792 0.020 . 2 . . . . 141 PHE HB2 . 17081 1 251 . 1 1 23 23 PHE HB3 H 1 3.313 0.020 . 2 . . . . 141 PHE HB3 . 17081 1 252 . 1 1 23 23 PHE HD1 H 1 7.303 0.020 . 1 . . . . 141 PHE HD1 . 17081 1 253 . 1 1 23 23 PHE HD2 H 1 7.303 0.020 . 1 . . . . 141 PHE HD2 . 17081 1 254 . 1 1 23 23 PHE HE1 H 1 6.898 0.020 . 1 . . . . 141 PHE HE1 . 17081 1 255 . 1 1 23 23 PHE HE2 H 1 6.898 0.020 . 1 . . . . 141 PHE HE2 . 17081 1 256 . 1 1 23 23 PHE HZ H 1 6.756 0.020 . 1 . . . . 141 PHE HZ . 17081 1 257 . 1 1 23 23 PHE C C 13 174.300 0.3 . 1 . . . . 141 PHE C . 17081 1 258 . 1 1 23 23 PHE CA C 13 59.208 0.3 . 1 . . . . 141 PHE CA . 17081 1 259 . 1 1 23 23 PHE CB C 13 40.467 0.3 . 1 . . . . 141 PHE CB . 17081 1 260 . 1 1 23 23 PHE CD1 C 13 131.689 0.3 . 1 . . . . 141 PHE CD1 . 17081 1 261 . 1 1 23 23 PHE CE1 C 13 130.763 0.3 . 1 . . . . 141 PHE CE1 . 17081 1 262 . 1 1 23 23 PHE CZ C 13 128.738 0.3 . 1 . . . . 141 PHE CZ . 17081 1 263 . 1 1 23 23 PHE N N 15 124.702 0.3 . 1 . . . . 141 PHE N . 17081 1 264 . 1 1 24 24 GLY H H 1 9.048 0.020 . 1 . . . . 142 GLY H . 17081 1 265 . 1 1 24 24 GLY HA2 H 1 3.758 0.020 . 1 . . . . 142 GLY HA2 . 17081 1 266 . 1 1 24 24 GLY C C 13 170.630 0.3 . 1 . . . . 142 GLY C . 17081 1 267 . 1 1 24 24 GLY CA C 13 45.251 0.3 . 1 . . . . 142 GLY CA . 17081 1 268 . 1 1 24 24 GLY N N 15 109.080 0.3 . 1 . . . . 142 GLY N . 17081 1 269 . 1 1 25 25 ASN H H 1 7.226 0.020 . 1 . . . . 143 ASN H . 17081 1 270 . 1 1 25 25 ASN HA H 1 4.892 0.020 . 1 . . . . 143 ASN HA . 17081 1 271 . 1 1 25 25 ASN HB2 H 1 2.722 0.020 . 2 . . . . 143 ASN HB2 . 17081 1 272 . 1 1 25 25 ASN HB3 H 1 2.694 0.020 . 2 . . . . 143 ASN HB3 . 17081 1 273 . 1 1 25 25 ASN HD21 H 1 7.593 0.020 . 1 . . . . 143 ASN HD21 . 17081 1 274 . 1 1 25 25 ASN HD22 H 1 7.503 0.020 . 1 . . . . 143 ASN HD22 . 17081 1 275 . 1 1 25 25 ASN C C 13 171.790 0.3 . 1 . . . . 143 ASN C . 17081 1 276 . 1 1 25 25 ASN CA C 13 52.072 0.3 . 1 . . . . 143 ASN CA . 17081 1 277 . 1 1 25 25 ASN CB C 13 41.136 0.3 . 1 . . . . 143 ASN CB . 17081 1 278 . 1 1 25 25 ASN N N 15 114.319 0.3 . 1 . . . . 143 ASN N . 17081 1 279 . 1 1 25 25 ASN ND2 N 15 116.153 0.3 . 1 . . . . 143 ASN ND2 . 17081 1 280 . 1 1 26 26 ASP H H 1 9.053 0.020 . 1 . . . . 144 ASP H . 17081 1 281 . 1 1 26 26 ASP HA H 1 4.441 0.020 . 1 . . . . 144 ASP HA . 17081 1 282 . 1 1 26 26 ASP HB2 H 1 2.779 0.020 . 1 . . . . 144 ASP HB2 . 17081 1 283 . 1 1 26 26 ASP HB3 H 1 2.779 0.020 . 1 . . . . 144 ASP HB3 . 17081 1 284 . 1 1 26 26 ASP C C 13 175.287 0.3 . 1 . . . . 144 ASP C . 17081 1 285 . 1 1 26 26 ASP CA C 13 57.412 0.3 . 1 . . . . 144 ASP CA . 17081 1 286 . 1 1 26 26 ASP CB C 13 40.626 0.3 . 1 . . . . 144 ASP CB . 17081 1 287 . 1 1 26 26 ASP N N 15 123.341 0.3 . 1 . . . . 144 ASP N . 17081 1 288 . 1 1 27 27 TRP H H 1 8.556 0.020 . 1 . . . . 145 TRP H . 17081 1 289 . 1 1 27 27 TRP HA H 1 4.241 0.020 . 1 . . . . 145 TRP HA . 17081 1 290 . 1 1 27 27 TRP HB2 H 1 3.419 0.020 . 1 . . . . 145 TRP HB2 . 17081 1 291 . 1 1 27 27 TRP HB3 H 1 3.419 0.020 . 1 . . . . 145 TRP HB3 . 17081 1 292 . 1 1 27 27 TRP HD1 H 1 7.339 0.020 . 1 . . . . 145 TRP HD1 . 17081 1 293 . 1 1 27 27 TRP HE1 H 1 10.248 0.020 . 1 . . . . 145 TRP HE1 . 17081 1 294 . 1 1 27 27 TRP HE3 H 1 7.358 0.020 . 1 . . . . 145 TRP HE3 . 17081 1 295 . 1 1 27 27 TRP HH2 H 1 6.898 0.020 . 1 . . . . 145 TRP HH2 . 17081 1 296 . 1 1 27 27 TRP HZ2 H 1 7.436 0.020 . 1 . . . . 145 TRP HZ2 . 17081 1 297 . 1 1 27 27 TRP HZ3 H 1 6.723 0.020 . 1 . . . . 145 TRP HZ3 . 17081 1 298 . 1 1 27 27 TRP C C 13 176.541 0.3 . 1 . . . . 145 TRP C . 17081 1 299 . 1 1 27 27 TRP CA C 13 61.413 0.3 . 1 . . . . 145 TRP CA . 17081 1 300 . 1 1 27 27 TRP CB C 13 27.925 0.3 . 1 . . . . 145 TRP CB . 17081 1 301 . 1 1 27 27 TRP CD1 C 13 127.253 0.3 . 1 . . . . 145 TRP CD1 . 17081 1 302 . 1 1 27 27 TRP CE3 C 13 120.256 0.3 . 1 . . . . 145 TRP CE3 . 17081 1 303 . 1 1 27 27 TRP CH2 C 13 124.602 0.3 . 1 . . . . 145 TRP CH2 . 17081 1 304 . 1 1 27 27 TRP CZ2 C 13 114.294 0.3 . 1 . . . . 145 TRP CZ2 . 17081 1 305 . 1 1 27 27 TRP CZ3 C 13 120.924 0.3 . 1 . . . . 145 TRP CZ3 . 17081 1 306 . 1 1 27 27 TRP N N 15 120.599 0.3 . 1 . . . . 145 TRP N . 17081 1 307 . 1 1 27 27 TRP NE1 N 15 129.592 0.3 . 1 . . . . 145 TRP NE1 . 17081 1 308 . 1 1 28 28 GLU H H 1 8.217 0.020 . 1 . . . . 146 GLU H . 17081 1 309 . 1 1 28 28 GLU HA H 1 3.459 0.020 . 1 . . . . 146 GLU HA . 17081 1 310 . 1 1 28 28 GLU HB2 H 1 1.851 0.020 . 2 . . . . 146 GLU HB2 . 17081 1 311 . 1 1 28 28 GLU HB3 H 1 1.276 0.020 . 2 . . . . 146 GLU HB3 . 17081 1 312 . 1 1 28 28 GLU HG2 H 1 2.143 0.020 . 2 . . . . 146 GLU HG2 . 17081 1 313 . 1 1 28 28 GLU HG3 H 1 1.596 0.020 . 2 . . . . 146 GLU HG3 . 17081 1 314 . 1 1 28 28 GLU C C 13 175.020 0.3 . 1 . . . . 146 GLU C . 17081 1 315 . 1 1 28 28 GLU CA C 13 59.431 0.3 . 1 . . . . 146 GLU CA . 17081 1 316 . 1 1 28 28 GLU CB C 13 29.149 0.3 . 1 . . . . 146 GLU CB . 17081 1 317 . 1 1 28 28 GLU CG C 13 36.897 0.3 . 1 . . . . 146 GLU CG . 17081 1 318 . 1 1 28 28 GLU N N 15 120.410 0.3 . 1 . . . . 146 GLU N . 17081 1 319 . 1 1 29 29 ASP H H 1 7.964 0.020 . 1 . . . . 147 ASP H . 17081 1 320 . 1 1 29 29 ASP HA H 1 4.677 0.020 . 1 . . . . 147 ASP HA . 17081 1 321 . 1 1 29 29 ASP HB2 H 1 2.838 0.020 . 2 . . . . 147 ASP HB2 . 17081 1 322 . 1 1 29 29 ASP HB3 H 1 2.933 0.020 . 2 . . . . 147 ASP HB3 . 17081 1 323 . 1 1 29 29 ASP C C 13 176.424 0.3 . 1 . . . . 147 ASP C . 17081 1 324 . 1 1 29 29 ASP CA C 13 58.106 0.3 . 1 . . . . 147 ASP CA . 17081 1 325 . 1 1 29 29 ASP CB C 13 40.023 0.3 . 1 . . . . 147 ASP CB . 17081 1 326 . 1 1 29 29 ASP N N 15 119.086 0.3 . 1 . . . . 147 ASP N . 17081 1 327 . 1 1 30 30 ARG H H 1 8.048 0.020 . 1 . . . . 148 ARG H . 17081 1 328 . 1 1 30 30 ARG HA H 1 3.974 0.020 . 1 . . . . 148 ARG HA . 17081 1 329 . 1 1 30 30 ARG HB2 H 1 1.869 0.020 . 1 . . . . 148 ARG HB2 . 17081 1 330 . 1 1 30 30 ARG HB3 H 1 1.869 0.020 . 1 . . . . 148 ARG HB3 . 17081 1 331 . 1 1 30 30 ARG HD2 H 1 3.203 0.020 . 2 . . . . 148 ARG HD2 . 17081 1 332 . 1 1 30 30 ARG HD3 H 1 3.187 0.020 . 2 . . . . 148 ARG HD3 . 17081 1 333 . 1 1 30 30 ARG HE H 1 7.463 0.020 . 1 . . . . 148 ARG HE . 17081 1 334 . 1 1 30 30 ARG HG2 H 1 1.718 0.020 . 2 . . . . 148 ARG HG2 . 17081 1 335 . 1 1 30 30 ARG HG3 H 1 1.485 0.020 . 2 . . . . 148 ARG HG3 . 17081 1 336 . 1 1 30 30 ARG C C 13 174.913 0.3 . 1 . . . . 148 ARG C . 17081 1 337 . 1 1 30 30 ARG CA C 13 59.143 0.3 . 1 . . . . 148 ARG CA . 17081 1 338 . 1 1 30 30 ARG CB C 13 29.417 0.3 . 1 . . . . 148 ARG CB . 17081 1 339 . 1 1 30 30 ARG CD C 13 43.144 0.3 . 1 . . . . 148 ARG CD . 17081 1 340 . 1 1 30 30 ARG CG C 13 27.308 0.3 . 1 . . . . 148 ARG CG . 17081 1 341 . 1 1 30 30 ARG N N 15 120.034 0.3 . 1 . . . . 148 ARG N . 17081 1 342 . 1 1 30 30 ARG NE N 15 85.223 0.3 . 1 . . . . 148 ARG NE . 17081 1 343 . 1 1 31 31 TYR H H 1 8.274 0.020 . 1 . . . . 149 TYR H . 17081 1 344 . 1 1 31 31 TYR HA H 1 3.744 0.020 . 1 . . . . 149 TYR HA . 17081 1 345 . 1 1 31 31 TYR HB2 H 1 2.684 0.020 . 2 . . . . 149 TYR HB2 . 17081 1 346 . 1 1 31 31 TYR HB3 H 1 2.311 0.020 . 2 . . . . 149 TYR HB3 . 17081 1 347 . 1 1 31 31 TYR HD1 H 1 6.876 0.020 . 1 . . . . 149 TYR HD1 . 17081 1 348 . 1 1 31 31 TYR HD2 H 1 6.876 0.020 . 1 . . . . 149 TYR HD2 . 17081 1 349 . 1 1 31 31 TYR HE1 H 1 6.885 0.020 . 1 . . . . 149 TYR HE1 . 17081 1 350 . 1 1 31 31 TYR HE2 H 1 6.885 0.020 . 1 . . . . 149 TYR HE2 . 17081 1 351 . 1 1 31 31 TYR C C 13 176.900 0.3 . 1 . . . . 149 TYR C . 17081 1 352 . 1 1 31 31 TYR CA C 13 61.739 0.3 . 1 . . . . 149 TYR CA . 17081 1 353 . 1 1 31 31 TYR CB C 13 37.772 0.3 . 1 . . . . 149 TYR CB . 17081 1 354 . 1 1 31 31 TYR CD1 C 13 133.265 0.3 . 1 . . . . 149 TYR CD1 . 17081 1 355 . 1 1 31 31 TYR CE1 C 13 117.586 0.3 . 1 . . . . 149 TYR CE1 . 17081 1 356 . 1 1 31 31 TYR N N 15 120.932 0.3 . 1 . . . . 149 TYR N . 17081 1 357 . 1 1 32 32 TYR H H 1 9.007 0.020 . 1 . . . . 150 TYR H . 17081 1 358 . 1 1 32 32 TYR HA H 1 4.093 0.020 . 1 . . . . 150 TYR HA . 17081 1 359 . 1 1 32 32 TYR HB2 H 1 3.570 0.020 . 2 . . . . 150 TYR HB2 . 17081 1 360 . 1 1 32 32 TYR HB3 H 1 3.215 0.020 . 2 . . . . 150 TYR HB3 . 17081 1 361 . 1 1 32 32 TYR HD1 H 1 7.491 0.020 . 1 . . . . 150 TYR HD1 . 17081 1 362 . 1 1 32 32 TYR HD2 H 1 7.491 0.020 . 1 . . . . 150 TYR HD2 . 17081 1 363 . 1 1 32 32 TYR HE1 H 1 7.026 0.020 . 1 . . . . 150 TYR HE1 . 17081 1 364 . 1 1 32 32 TYR HE2 H 1 7.026 0.020 . 1 . . . . 150 TYR HE2 . 17081 1 365 . 1 1 32 32 TYR C C 13 174.285 0.3 . 1 . . . . 150 TYR C . 17081 1 366 . 1 1 32 32 TYR CA C 13 62.712 0.3 . 1 . . . . 150 TYR CA . 17081 1 367 . 1 1 32 32 TYR CB C 13 37.988 0.3 . 1 . . . . 150 TYR CB . 17081 1 368 . 1 1 32 32 TYR CD1 C 13 133.164 0.3 . 1 . . . . 150 TYR CD1 . 17081 1 369 . 1 1 32 32 TYR CE1 C 13 118.051 0.3 . 1 . . . . 150 TYR CE1 . 17081 1 370 . 1 1 32 32 TYR N N 15 120.393 0.3 . 1 . . . . 150 TYR N . 17081 1 371 . 1 1 33 33 ARG H H 1 7.903 0.020 . 1 . . . . 151 ARG H . 17081 1 372 . 1 1 33 33 ARG HA H 1 3.869 0.020 . 1 . . . . 151 ARG HA . 17081 1 373 . 1 1 33 33 ARG HB2 H 1 1.963 0.020 . 2 . . . . 151 ARG HB2 . 17081 1 374 . 1 1 33 33 ARG HB3 H 1 2.035 0.020 . 2 . . . . 151 ARG HB3 . 17081 1 375 . 1 1 33 33 ARG HD2 H 1 3.363 0.020 . 2 . . . . 151 ARG HD2 . 17081 1 376 . 1 1 33 33 ARG HD3 H 1 3.282 0.020 . 2 . . . . 151 ARG HD3 . 17081 1 377 . 1 1 33 33 ARG HE H 1 7.491 0.020 . 1 . . . . 151 ARG HE . 17081 1 378 . 1 1 33 33 ARG HG2 H 1 1.997 0.020 . 2 . . . . 151 ARG HG2 . 17081 1 379 . 1 1 33 33 ARG HG3 H 1 1.756 0.020 . 2 . . . . 151 ARG HG3 . 17081 1 380 . 1 1 33 33 ARG C C 13 176.386 0.3 . 1 . . . . 151 ARG C . 17081 1 381 . 1 1 33 33 ARG CA C 13 59.599 0.3 . 1 . . . . 151 ARG CA . 17081 1 382 . 1 1 33 33 ARG CB C 13 29.455 0.3 . 1 . . . . 151 ARG CB . 17081 1 383 . 1 1 33 33 ARG CD C 13 43.150 0.3 . 1 . . . . 151 ARG CD . 17081 1 384 . 1 1 33 33 ARG CG C 13 28.012 0.3 . 1 . . . . 151 ARG CG . 17081 1 385 . 1 1 33 33 ARG N N 15 117.290 0.3 . 1 . . . . 151 ARG N . 17081 1 386 . 1 1 33 33 ARG NE N 15 84.819 0.3 . 1 . . . . 151 ARG NE . 17081 1 387 . 1 1 34 34 GLU H H 1 7.880 0.020 . 1 . . . . 152 GLU H . 17081 1 388 . 1 1 34 34 GLU HA H 1 4.103 0.020 . 1 . . . . 152 GLU HA . 17081 1 389 . 1 1 34 34 GLU HB2 H 1 1.869 0.020 . 1 . . . . 152 GLU HB2 . 17081 1 390 . 1 1 34 34 GLU HB3 H 1 1.869 0.020 . 1 . . . . 152 GLU HB3 . 17081 1 391 . 1 1 34 34 GLU HG2 H 1 2.455 0.020 . 2 . . . . 152 GLU HG2 . 17081 1 392 . 1 1 34 34 GLU HG3 H 1 2.242 0.020 . 2 . . . . 152 GLU HG3 . 17081 1 393 . 1 1 34 34 GLU C C 13 174.859 0.3 . 1 . . . . 152 GLU C . 17081 1 394 . 1 1 34 34 GLU CA C 13 57.325 0.3 . 1 . . . . 152 GLU CA . 17081 1 395 . 1 1 34 34 GLU CB C 13 29.420 0.3 . 1 . . . . 152 GLU CB . 17081 1 396 . 1 1 34 34 GLU CG C 13 35.593 0.3 . 1 . . . . 152 GLU CG . 17081 1 397 . 1 1 34 34 GLU N N 15 115.453 0.3 . 1 . . . . 152 GLU N . 17081 1 398 . 1 1 35 35 ASN H H 1 7.564 0.020 . 1 . . . . 153 ASN H . 17081 1 399 . 1 1 35 35 ASN HA H 1 4.507 0.020 . 1 . . . . 153 ASN HA . 17081 1 400 . 1 1 35 35 ASN HB2 H 1 2.240 0.020 . 2 . . . . 153 ASN HB2 . 17081 1 401 . 1 1 35 35 ASN HB3 H 1 2.143 0.020 . 2 . . . . 153 ASN HB3 . 17081 1 402 . 1 1 35 35 ASN HD21 H 1 6.761 0.020 . 1 . . . . 153 ASN HD21 . 17081 1 403 . 1 1 35 35 ASN HD22 H 1 6.533 0.020 . 1 . . . . 153 ASN HD22 . 17081 1 404 . 1 1 35 35 ASN C C 13 172.844 0.3 . 1 . . . . 153 ASN C . 17081 1 405 . 1 1 35 35 ASN CA C 13 54.433 0.3 . 1 . . . . 153 ASN CA . 17081 1 406 . 1 1 35 35 ASN CB C 13 40.775 0.3 . 1 . . . . 153 ASN CB . 17081 1 407 . 1 1 35 35 ASN N N 15 115.304 0.3 . 1 . . . . 153 ASN N . 17081 1 408 . 1 1 35 35 ASN ND2 N 15 116.779 0.3 . 1 . . . . 153 ASN ND2 . 17081 1 409 . 1 1 36 36 MET H H 1 7.850 0.020 . 1 . . . . 154 MET H . 17081 1 410 . 1 1 36 36 MET HA H 1 3.481 0.020 . 1 . . . . 154 MET HA . 17081 1 411 . 1 1 36 36 MET HB2 H 1 1.586 0.020 . 2 . . . . 154 MET HB2 . 17081 1 412 . 1 1 36 36 MET HB3 H 1 1.265 0.020 . 2 . . . . 154 MET HB3 . 17081 1 413 . 1 1 36 36 MET HE1 H 1 1.931 0.020 . 1 . . . . 154 MET HE . 17081 1 414 . 1 1 36 36 MET HE2 H 1 1.931 0.020 . 1 . . . . 154 MET HE . 17081 1 415 . 1 1 36 36 MET HE3 H 1 1.931 0.020 . 1 . . . . 154 MET HE . 17081 1 416 . 1 1 36 36 MET HG2 H 1 2.292 0.020 . 2 . . . . 154 MET HG2 . 17081 1 417 . 1 1 36 36 MET HG3 H 1 1.793 0.020 . 2 . . . . 154 MET HG3 . 17081 1 418 . 1 1 36 36 MET C C 13 173.738 0.3 . 1 . . . . 154 MET C . 17081 1 419 . 1 1 36 36 MET CA C 13 58.751 0.3 . 1 . . . . 154 MET CA . 17081 1 420 . 1 1 36 36 MET CB C 13 30.177 0.3 . 1 . . . . 154 MET CB . 17081 1 421 . 1 1 36 36 MET CE C 13 16.913 0.3 . 1 . . . . 154 MET CE . 17081 1 422 . 1 1 36 36 MET CG C 13 29.818 0.3 . 1 . . . . 154 MET CG . 17081 1 423 . 1 1 36 36 MET N N 15 118.308 0.3 . 1 . . . . 154 MET N . 17081 1 424 . 1 1 37 37 TYR H H 1 7.604 0.020 . 1 . . . . 155 TYR H . 17081 1 425 . 1 1 37 37 TYR HA H 1 4.142 0.020 . 1 . . . . 155 TYR HA . 17081 1 426 . 1 1 37 37 TYR HB2 H 1 2.945 0.020 . 2 . . . . 155 TYR HB2 . 17081 1 427 . 1 1 37 37 TYR HB3 H 1 3.006 0.020 . 2 . . . . 155 TYR HB3 . 17081 1 428 . 1 1 37 37 TYR HD1 H 1 7.073 0.020 . 1 . . . . 155 TYR HD1 . 17081 1 429 . 1 1 37 37 TYR HD2 H 1 7.073 0.020 . 1 . . . . 155 TYR HD2 . 17081 1 430 . 1 1 37 37 TYR HE1 H 1 6.884 0.020 . 1 . . . . 155 TYR HE1 . 17081 1 431 . 1 1 37 37 TYR HE2 H 1 6.884 0.020 . 1 . . . . 155 TYR HE2 . 17081 1 432 . 1 1 37 37 TYR C C 13 173.216 0.3 . 1 . . . . 155 TYR C . 17081 1 433 . 1 1 37 37 TYR CA C 13 58.927 0.3 . 1 . . . . 155 TYR CA . 17081 1 434 . 1 1 37 37 TYR CB C 13 35.803 0.3 . 1 . . . . 155 TYR CB . 17081 1 435 . 1 1 37 37 TYR CD1 C 13 132.935 0.3 . 1 . . . . 155 TYR CD1 . 17081 1 436 . 1 1 37 37 TYR CE1 C 13 118.216 0.3 . 1 . . . . 155 TYR CE1 . 17081 1 437 . 1 1 37 37 TYR N N 15 116.256 0.3 . 1 . . . . 155 TYR N . 17081 1 438 . 1 1 38 38 ARG H H 1 7.526 0.020 . 1 . . . . 156 ARG H . 17081 1 439 . 1 1 38 38 ARG HA H 1 4.023 0.020 . 1 . . . . 156 ARG HA . 17081 1 440 . 1 1 38 38 ARG HB2 H 1 1.318 0.020 . 2 . . . . 156 ARG HB2 . 17081 1 441 . 1 1 38 38 ARG HB3 H 1 1.975 0.020 . 2 . . . . 156 ARG HB3 . 17081 1 442 . 1 1 38 38 ARG HD2 H 1 3.202 0.020 . 2 . . . . 156 ARG HD2 . 17081 1 443 . 1 1 38 38 ARG HD3 H 1 3.075 0.020 . 2 . . . . 156 ARG HD3 . 17081 1 444 . 1 1 38 38 ARG HE H 1 7.321 0.020 . 1 . . . . 156 ARG HE . 17081 1 445 . 1 1 38 38 ARG HG2 H 1 1.270 0.020 . 2 . . . . 156 ARG HG2 . 17081 1 446 . 1 1 38 38 ARG HG3 H 1 0.604 0.020 . 2 . . . . 156 ARG HG3 . 17081 1 447 . 1 1 38 38 ARG HH21 H 1 6.453 0.020 . 1 . . . . 156 ARG HH21 . 17081 1 448 . 1 1 38 38 ARG C C 13 174.018 0.3 . 1 . . . . 156 ARG C . 17081 1 449 . 1 1 38 38 ARG CA C 13 55.969 0.3 . 1 . . . . 156 ARG CA . 17081 1 450 . 1 1 38 38 ARG CB C 13 30.284 0.3 . 1 . . . . 156 ARG CB . 17081 1 451 . 1 1 38 38 ARG CD C 13 43.965 0.3 . 1 . . . . 156 ARG CD . 17081 1 452 . 1 1 38 38 ARG CG C 13 26.986 0.3 . 1 . . . . 156 ARG CG . 17081 1 453 . 1 1 38 38 ARG N N 15 118.595 0.3 . 1 . . . . 156 ARG N . 17081 1 454 . 1 1 38 38 ARG NE N 15 84.627 0.3 . 1 . . . . 156 ARG NE . 17081 1 455 . 1 1 39 39 TYR H H 1 7.349 0.020 . 1 . . . . 157 TYR H . 17081 1 456 . 1 1 39 39 TYR HA H 1 5.043 0.020 . 1 . . . . 157 TYR HA . 17081 1 457 . 1 1 39 39 TYR HB2 H 1 3.122 0.020 . 2 . . . . 157 TYR HB2 . 17081 1 458 . 1 1 39 39 TYR HB3 H 1 3.082 0.020 . 2 . . . . 157 TYR HB3 . 17081 1 459 . 1 1 39 39 TYR HD1 H 1 6.920 0.020 . 1 . . . . 157 TYR HD1 . 17081 1 460 . 1 1 39 39 TYR HD2 H 1 6.920 0.020 . 1 . . . . 157 TYR HD2 . 17081 1 461 . 1 1 39 39 TYR HE1 H 1 6.520 0.020 . 1 . . . . 157 TYR HE1 . 17081 1 462 . 1 1 39 39 TYR HE2 H 1 6.520 0.020 . 1 . . . . 157 TYR HE2 . 17081 1 463 . 1 1 39 39 TYR C C 13 170.256 0.3 . 1 . . . . 157 TYR C . 17081 1 464 . 1 1 39 39 TYR CA C 13 52.439 0.3 . 1 . . . . 157 TYR CA . 17081 1 465 . 1 1 39 39 TYR CB C 13 34.805 0.3 . 1 . . . . 157 TYR CB . 17081 1 466 . 1 1 39 39 TYR CD1 C 13 131.012 0.3 . 1 . . . . 157 TYR CD1 . 17081 1 467 . 1 1 39 39 TYR CE1 C 13 116.985 0.3 . 1 . . . . 157 TYR CE1 . 17081 1 468 . 1 1 39 39 TYR N N 15 120.600 0.3 . 1 . . . . 157 TYR N . 17081 1 469 . 1 1 40 40 PRO HA H 1 4.468 0.020 . 1 . . . . 158 PRO HA . 17081 1 470 . 1 1 40 40 PRO HB2 H 1 1.735 0.020 . 2 . . . . 158 PRO HB2 . 17081 1 471 . 1 1 40 40 PRO HB3 H 1 2.459 0.020 . 2 . . . . 158 PRO HB3 . 17081 1 472 . 1 1 40 40 PRO HD2 H 1 3.184 0.020 . 2 . . . . 158 PRO HD2 . 17081 1 473 . 1 1 40 40 PRO HD3 H 1 3.397 0.020 . 2 . . . . 158 PRO HD3 . 17081 1 474 . 1 1 40 40 PRO HG2 H 1 1.584 0.020 . 2 . . . . 158 PRO HG2 . 17081 1 475 . 1 1 40 40 PRO HG3 H 1 1.378 0.020 . 2 . . . . 158 PRO HG3 . 17081 1 476 . 1 1 40 40 PRO C C 13 172.044 0.3 . 1 . . . . 158 PRO C . 17081 1 477 . 1 1 40 40 PRO CA C 13 63.092 0.3 . 1 . . . . 158 PRO CA . 17081 1 478 . 1 1 40 40 PRO CB C 13 31.989 0.3 . 1 . . . . 158 PRO CB . 17081 1 479 . 1 1 40 40 PRO CD C 13 49.661 0.3 . 1 . . . . 158 PRO CD . 17081 1 480 . 1 1 40 40 PRO CG C 13 26.874 0.3 . 1 . . . . 158 PRO CG . 17081 1 481 . 1 1 41 41 ASN H H 1 8.456 0.020 . 1 . . . . 159 ASN H . 17081 1 482 . 1 1 41 41 ASN HA H 1 4.732 0.020 . 1 . . . . 159 ASN HA . 17081 1 483 . 1 1 41 41 ASN HB2 H 1 3.757 0.020 . 2 . . . . 159 ASN HB2 . 17081 1 484 . 1 1 41 41 ASN HB3 H 1 2.395 0.020 . 2 . . . . 159 ASN HB3 . 17081 1 485 . 1 1 41 41 ASN HD21 H 1 7.519 0.020 . 1 . . . . 159 ASN HD21 . 17081 1 486 . 1 1 41 41 ASN HD22 H 1 6.823 0.020 . 1 . . . . 159 ASN HD22 . 17081 1 487 . 1 1 41 41 ASN C C 13 170.364 0.3 . 1 . . . . 159 ASN C . 17081 1 488 . 1 1 41 41 ASN CA C 13 51.273 0.3 . 1 . . . . 159 ASN CA . 17081 1 489 . 1 1 41 41 ASN CB C 13 37.704 0.3 . 1 . . . . 159 ASN CB . 17081 1 490 . 1 1 41 41 ASN N N 15 115.601 0.3 . 1 . . . . 159 ASN N . 17081 1 491 . 1 1 41 41 ASN ND2 N 15 109.046 0.3 . 1 . . . . 159 ASN ND2 . 17081 1 492 . 1 1 42 42 GLN H H 1 7.252 0.020 . 1 . . . . 160 GLN H . 17081 1 493 . 1 1 42 42 GLN HA H 1 4.594 0.020 . 1 . . . . 160 GLN HA . 17081 1 494 . 1 1 42 42 GLN HB2 H 1 1.974 0.020 . 2 . . . . 160 GLN HB2 . 17081 1 495 . 1 1 42 42 GLN HB3 H 1 1.706 0.020 . 2 . . . . 160 GLN HB3 . 17081 1 496 . 1 1 42 42 GLN HE21 H 1 7.959 0.020 . 1 . . . . 160 GLN HE21 . 17081 1 497 . 1 1 42 42 GLN HE22 H 1 7.045 0.020 . 1 . . . . 160 GLN HE22 . 17081 1 498 . 1 1 42 42 GLN HG2 H 1 2.169 0.020 . 2 . . . . 160 GLN HG2 . 17081 1 499 . 1 1 42 42 GLN HG3 H 1 2.033 0.020 . 2 . . . . 160 GLN HG3 . 17081 1 500 . 1 1 42 42 GLN C C 13 172.431 0.3 . 1 . . . . 160 GLN C . 17081 1 501 . 1 1 42 42 GLN CA C 13 53.739 0.3 . 1 . . . . 160 GLN CA . 17081 1 502 . 1 1 42 42 GLN CB C 13 33.220 0.3 . 1 . . . . 160 GLN CB . 17081 1 503 . 1 1 42 42 GLN CG C 13 33.753 0.3 . 1 . . . . 160 GLN CG . 17081 1 504 . 1 1 42 42 GLN N N 15 113.685 0.3 . 1 . . . . 160 GLN N . 17081 1 505 . 1 1 42 42 GLN NE2 N 15 112.872 0.3 . 1 . . . . 160 GLN NE2 . 17081 1 506 . 1 1 43 43 VAL H H 1 8.558 0.020 . 1 . . . . 161 VAL H . 17081 1 507 . 1 1 43 43 VAL HA H 1 4.935 0.020 . 1 . . . . 161 VAL HA . 17081 1 508 . 1 1 43 43 VAL HB H 1 2.653 0.020 . 1 . . . . 161 VAL HB . 17081 1 509 . 1 1 43 43 VAL HG11 H 1 0.981 0.020 . 2 . . . . 161 VAL HG1 . 17081 1 510 . 1 1 43 43 VAL HG12 H 1 0.981 0.020 . 2 . . . . 161 VAL HG1 . 17081 1 511 . 1 1 43 43 VAL HG13 H 1 0.981 0.020 . 2 . . . . 161 VAL HG1 . 17081 1 512 . 1 1 43 43 VAL HG21 H 1 0.772 0.020 . 2 . . . . 161 VAL HG2 . 17081 1 513 . 1 1 43 43 VAL HG22 H 1 0.772 0.020 . 2 . . . . 161 VAL HG2 . 17081 1 514 . 1 1 43 43 VAL HG23 H 1 0.772 0.020 . 2 . . . . 161 VAL HG2 . 17081 1 515 . 1 1 43 43 VAL C C 13 171.509 0.3 . 1 . . . . 161 VAL C . 17081 1 516 . 1 1 43 43 VAL CA C 13 58.297 0.3 . 1 . . . . 161 VAL CA . 17081 1 517 . 1 1 43 43 VAL CB C 13 33.616 0.3 . 1 . . . . 161 VAL CB . 17081 1 518 . 1 1 43 43 VAL CG1 C 13 23.220 0.3 . 1 . . . . 161 VAL CG1 . 17081 1 519 . 1 1 43 43 VAL CG2 C 13 17.789 0.3 . 1 . . . . 161 VAL CG2 . 17081 1 520 . 1 1 43 43 VAL N N 15 112.912 0.3 . 1 . . . . 161 VAL N . 17081 1 521 . 1 1 44 44 TYR H H 1 8.473 0.020 . 1 . . . . 162 TYR H . 17081 1 522 . 1 1 44 44 TYR HA H 1 5.528 0.020 . 1 . . . . 162 TYR HA . 17081 1 523 . 1 1 44 44 TYR HB2 H 1 2.621 0.020 . 2 . . . . 162 TYR HB2 . 17081 1 524 . 1 1 44 44 TYR HB3 H 1 2.526 0.020 . 2 . . . . 162 TYR HB3 . 17081 1 525 . 1 1 44 44 TYR HD1 H 1 6.890 0.020 . 1 . . . . 162 TYR HD1 . 17081 1 526 . 1 1 44 44 TYR HD2 H 1 6.890 0.020 . 1 . . . . 162 TYR HD2 . 17081 1 527 . 1 1 44 44 TYR HE1 H 1 6.762 0.020 . 1 . . . . 162 TYR HE1 . 17081 1 528 . 1 1 44 44 TYR HE2 H 1 6.762 0.020 . 1 . . . . 162 TYR HE2 . 17081 1 529 . 1 1 44 44 TYR C C 13 171.981 0.3 . 1 . . . . 162 TYR C . 17081 1 530 . 1 1 44 44 TYR CA C 13 56.545 0.3 . 1 . . . . 162 TYR CA . 17081 1 531 . 1 1 44 44 TYR CB C 13 41.452 0.3 . 1 . . . . 162 TYR CB . 17081 1 532 . 1 1 44 44 TYR CD1 C 13 132.612 0.3 . 1 . . . . 162 TYR CD1 . 17081 1 533 . 1 1 44 44 TYR CE1 C 13 118.140 0.3 . 1 . . . . 162 TYR CE1 . 17081 1 534 . 1 1 44 44 TYR N N 15 121.465 0.3 . 1 . . . . 162 TYR N . 17081 1 535 . 1 1 45 45 TYR H H 1 8.600 0.020 . 1 . . . . 163 TYR H . 17081 1 536 . 1 1 45 45 TYR HA H 1 4.700 0.020 . 1 . . . . 163 TYR HA . 17081 1 537 . 1 1 45 45 TYR HB2 H 1 2.593 0.020 . 2 . . . . 163 TYR HB2 . 17081 1 538 . 1 1 45 45 TYR HB3 H 1 2.581 0.020 . 2 . . . . 163 TYR HB3 . 17081 1 539 . 1 1 45 45 TYR HD1 H 1 6.938 0.020 . 1 . . . . 163 TYR HD1 . 17081 1 540 . 1 1 45 45 TYR HD2 H 1 6.938 0.020 . 1 . . . . 163 TYR HD2 . 17081 1 541 . 1 1 45 45 TYR HE1 H 1 6.474 0.020 . 1 . . . . 163 TYR HE1 . 17081 1 542 . 1 1 45 45 TYR HE2 H 1 6.474 0.020 . 1 . . . . 163 TYR HE2 . 17081 1 543 . 1 1 45 45 TYR C C 13 170.339 0.3 . 1 . . . . 163 TYR C . 17081 1 544 . 1 1 45 45 TYR CA C 13 55.346 0.3 . 1 . . . . 163 TYR CA . 17081 1 545 . 1 1 45 45 TYR CB C 13 40.393 0.3 . 1 . . . . 163 TYR CB . 17081 1 546 . 1 1 45 45 TYR CD1 C 13 133.555 0.3 . 1 . . . . 163 TYR CD1 . 17081 1 547 . 1 1 45 45 TYR CE1 C 13 117.260 0.3 . 1 . . . . 163 TYR CE1 . 17081 1 548 . 1 1 45 45 TYR N N 15 110.787 0.3 . 1 . . . . 163 TYR N . 17081 1 549 . 1 1 46 46 ARG H H 1 8.070 0.020 . 1 . . . . 164 ARG H . 17081 1 550 . 1 1 46 46 ARG HA H 1 4.651 0.020 . 1 . . . . 164 ARG HA . 17081 1 551 . 1 1 46 46 ARG HB2 H 1 1.489 0.020 . 2 . . . . 164 ARG HB2 . 17081 1 552 . 1 1 46 46 ARG HB3 H 1 1.612 0.020 . 2 . . . . 164 ARG HB3 . 17081 1 553 . 1 1 46 46 ARG HD2 H 1 2.854 0.020 . 2 . . . . 164 ARG HD2 . 17081 1 554 . 1 1 46 46 ARG HD3 H 1 2.929 0.020 . 2 . . . . 164 ARG HD3 . 17081 1 555 . 1 1 46 46 ARG HE H 1 7.004 0.020 . 1 . . . . 164 ARG HE . 17081 1 556 . 1 1 46 46 ARG HG2 H 1 1.226 0.020 . 2 . . . . 164 ARG HG2 . 17081 1 557 . 1 1 46 46 ARG HG3 H 1 1.109 0.020 . 2 . . . . 164 ARG HG3 . 17081 1 558 . 1 1 46 46 ARG C C 13 171.443 0.3 . 1 . . . . 164 ARG C . 17081 1 559 . 1 1 46 46 ARG CA C 13 52.272 0.3 . 1 . . . . 164 ARG CA . 17081 1 560 . 1 1 46 46 ARG CB C 13 30.242 0.3 . 1 . . . . 164 ARG CB . 17081 1 561 . 1 1 46 46 ARG CD C 13 42.984 0.3 . 1 . . . . 164 ARG CD . 17081 1 562 . 1 1 46 46 ARG CG C 13 26.731 0.3 . 1 . . . . 164 ARG CG . 17081 1 563 . 1 1 46 46 ARG N N 15 121.269 0.3 . 1 . . . . 164 ARG N . 17081 1 564 . 1 1 46 46 ARG NE N 15 85.094 0.3 . 1 . . . . 164 ARG NE . 17081 1 565 . 1 1 47 47 PRO HA H 1 4.592 0.020 . 1 . . . . 165 PRO HA . 17081 1 566 . 1 1 47 47 PRO HB2 H 1 1.888 0.020 . 2 . . . . 165 PRO HB2 . 17081 1 567 . 1 1 47 47 PRO HB3 H 1 2.493 0.020 . 2 . . . . 165 PRO HB3 . 17081 1 568 . 1 1 47 47 PRO HD2 H 1 3.657 0.020 . 2 . . . . 165 PRO HD2 . 17081 1 569 . 1 1 47 47 PRO HD3 H 1 3.555 0.020 . 2 . . . . 165 PRO HD3 . 17081 1 570 . 1 1 47 47 PRO HG2 H 1 2.081 0.020 . 2 . . . . 165 PRO HG2 . 17081 1 571 . 1 1 47 47 PRO HG3 H 1 1.959 0.020 . 2 . . . . 165 PRO HG3 . 17081 1 572 . 1 1 47 47 PRO C C 13 174.605 0.3 . 1 . . . . 165 PRO C . 17081 1 573 . 1 1 47 47 PRO CA C 13 62.672 0.3 . 1 . . . . 165 PRO CA . 17081 1 574 . 1 1 47 47 PRO CB C 13 32.061 0.3 . 1 . . . . 165 PRO CB . 17081 1 575 . 1 1 47 47 PRO CD C 13 50.304 0.3 . 1 . . . . 165 PRO CD . 17081 1 576 . 1 1 47 47 PRO CG C 13 27.476 0.3 . 1 . . . . 165 PRO CG . 17081 1 577 . 1 1 48 48 VAL H H 1 8.465 0.020 . 1 . . . . 166 VAL H . 17081 1 578 . 1 1 48 48 VAL HA H 1 4.150 0.020 . 1 . . . . 166 VAL HA . 17081 1 579 . 1 1 48 48 VAL HB H 1 1.871 0.020 . 1 . . . . 166 VAL HB . 17081 1 580 . 1 1 48 48 VAL HG11 H 1 0.719 0.020 . 2 . . . . 166 VAL HG1 . 17081 1 581 . 1 1 48 48 VAL HG12 H 1 0.719 0.020 . 2 . . . . 166 VAL HG1 . 17081 1 582 . 1 1 48 48 VAL HG13 H 1 0.719 0.020 . 2 . . . . 166 VAL HG1 . 17081 1 583 . 1 1 48 48 VAL HG21 H 1 0.861 0.020 . 2 . . . . 166 VAL HG2 . 17081 1 584 . 1 1 48 48 VAL HG22 H 1 0.861 0.020 . 2 . . . . 166 VAL HG2 . 17081 1 585 . 1 1 48 48 VAL HG23 H 1 0.861 0.020 . 2 . . . . 166 VAL HG2 . 17081 1 586 . 1 1 48 48 VAL C C 13 172.541 0.3 . 1 . . . . 166 VAL C . 17081 1 587 . 1 1 48 48 VAL CA C 13 62.152 0.3 . 1 . . . . 166 VAL CA . 17081 1 588 . 1 1 48 48 VAL CB C 13 32.430 0.3 . 1 . . . . 166 VAL CB . 17081 1 589 . 1 1 48 48 VAL CG1 C 13 21.684 0.3 . 1 . . . . 166 VAL CG1 . 17081 1 590 . 1 1 48 48 VAL CG2 C 13 22.389 0.3 . 1 . . . . 166 VAL CG2 . 17081 1 591 . 1 1 48 48 VAL N N 15 120.698 0.3 . 1 . . . . 166 VAL N . 17081 1 592 . 1 1 49 49 ASP H H 1 8.530 0.020 . 1 . . . . 167 ASP H . 17081 1 593 . 1 1 49 49 ASP HA H 1 4.262 0.020 . 1 . . . . 167 ASP HA . 17081 1 594 . 1 1 49 49 ASP HB2 H 1 2.988 0.020 . 2 . . . . 167 ASP HB2 . 17081 1 595 . 1 1 49 49 ASP HB3 H 1 2.654 0.020 . 2 . . . . 167 ASP HB3 . 17081 1 596 . 1 1 49 49 ASP C C 13 173.992 0.3 . 1 . . . . 167 ASP C . 17081 1 597 . 1 1 49 49 ASP CA C 13 51.979 0.3 . 1 . . . . 167 ASP CA . 17081 1 598 . 1 1 49 49 ASP CB C 13 41.832 0.3 . 1 . . . . 167 ASP CB . 17081 1 599 . 1 1 49 49 ASP N N 15 123.910 0.3 . 1 . . . . 167 ASP N . 17081 1 600 . 1 1 50 50 GLN H H 1 8.529 0.020 . 1 . . . . 168 GLN H . 17081 1 601 . 1 1 50 50 GLN HA H 1 4.115 0.020 . 1 . . . . 168 GLN HA . 17081 1 602 . 1 1 50 50 GLN HB2 H 1 2.200 0.020 . 2 . . . . 168 GLN HB2 . 17081 1 603 . 1 1 50 50 GLN HB3 H 1 2.193 0.020 . 2 . . . . 168 GLN HB3 . 17081 1 604 . 1 1 50 50 GLN HE21 H 1 7.645 0.020 . 1 . . . . 168 GLN HE21 . 17081 1 605 . 1 1 50 50 GLN HE22 H 1 6.939 0.020 . 1 . . . . 168 GLN HE22 . 17081 1 606 . 1 1 50 50 GLN HG2 H 1 2.465 0.020 . 2 . . . . 168 GLN HG2 . 17081 1 607 . 1 1 50 50 GLN HG3 H 1 2.512 0.020 . 2 . . . . 168 GLN HG3 . 17081 1 608 . 1 1 50 50 GLN C C 13 174.068 0.3 . 1 . . . . 168 GLN C . 17081 1 609 . 1 1 50 50 GLN CA C 13 57.842 0.3 . 1 . . . . 168 GLN CA . 17081 1 610 . 1 1 50 50 GLN CB C 13 27.929 0.3 . 1 . . . . 168 GLN CB . 17081 1 611 . 1 1 50 50 GLN CG C 13 33.115 0.3 . 1 . . . . 168 GLN CG . 17081 1 612 . 1 1 50 50 GLN N N 15 118.297 0.3 . 1 . . . . 168 GLN N . 17081 1 613 . 1 1 50 50 GLN NE2 N 15 112.368 0.3 . 1 . . . . 168 GLN NE2 . 17081 1 614 . 1 1 51 51 GLY H H 1 8.666 0.020 . 1 . . . . 169 GLY H . 17081 1 615 . 1 1 51 51 GLY HA2 H 1 3.831 0.020 . 1 . . . . 169 GLY HA2 . 17081 1 616 . 1 1 51 51 GLY C C 13 172.719 0.3 . 1 . . . . 169 GLY C . 17081 1 617 . 1 1 51 51 GLY CA C 13 44.580 0.3 . 1 . . . . 169 GLY CA . 17081 1 618 . 1 1 51 51 GLY N N 15 108.097 0.3 . 1 . . . . 169 GLY N . 17081 1 619 . 1 1 52 52 SER H H 1 7.792 0.020 . 1 . . . . 170 SER H . 17081 1 620 . 1 1 52 52 SER HA H 1 4.717 0.020 . 1 . . . . 170 SER HA . 17081 1 621 . 1 1 52 52 SER HB2 H 1 4.143 0.020 . 2 . . . . 170 SER HB2 . 17081 1 622 . 1 1 52 52 SER HB3 H 1 4.048 0.020 . 2 . . . . 170 SER HB3 . 17081 1 623 . 1 1 52 52 SER C C 13 170.695 0.3 . 1 . . . . 170 SER C . 17081 1 624 . 1 1 52 52 SER CA C 13 59.353 0.3 . 1 . . . . 170 SER CA . 17081 1 625 . 1 1 52 52 SER CB C 13 63.543 0.3 . 1 . . . . 170 SER CB . 17081 1 626 . 1 1 52 52 SER N N 15 117.464 0.3 . 1 . . . . 170 SER N . 17081 1 627 . 1 1 53 53 ASN H H 1 8.607 0.020 . 1 . . . . 171 ASN H . 17081 1 628 . 1 1 53 53 ASN HA H 1 4.890 0.020 . 1 . . . . 171 ASN HA . 17081 1 629 . 1 1 53 53 ASN HB2 H 1 2.939 0.020 . 2 . . . . 171 ASN HB2 . 17081 1 630 . 1 1 53 53 ASN HB3 H 1 2.951 0.020 . 2 . . . . 171 ASN HB3 . 17081 1 631 . 1 1 53 53 ASN HD21 H 1 7.726 0.020 . 1 . . . . 171 ASN HD21 . 17081 1 632 . 1 1 53 53 ASN HD22 H 1 6.755 0.020 . 1 . . . . 171 ASN HD22 . 17081 1 633 . 1 1 53 53 ASN C C 13 171.293 0.3 . 1 . . . . 171 ASN C . 17081 1 634 . 1 1 53 53 ASN CA C 13 51.674 0.3 . 1 . . . . 171 ASN CA . 17081 1 635 . 1 1 53 53 ASN CB C 13 40.331 0.3 . 1 . . . . 171 ASN CB . 17081 1 636 . 1 1 53 53 ASN N N 15 119.092 0.3 . 1 . . . . 171 ASN N . 17081 1 637 . 1 1 53 53 ASN ND2 N 15 114.537 0.3 . 1 . . . . 171 ASN ND2 . 17081 1 638 . 1 1 54 54 GLN H H 1 8.752 0.020 . 1 . . . . 172 GLN H . 17081 1 639 . 1 1 54 54 GLN HA H 1 2.443 0.020 . 1 . . . . 172 GLN HA . 17081 1 640 . 1 1 54 54 GLN HB2 H 1 1.800 0.020 . 2 . . . . 172 GLN HB2 . 17081 1 641 . 1 1 54 54 GLN HB3 H 1 1.666 0.020 . 2 . . . . 172 GLN HB3 . 17081 1 642 . 1 1 54 54 GLN HE21 H 1 7.498 0.020 . 1 . . . . 172 GLN HE21 . 17081 1 643 . 1 1 54 54 GLN HE22 H 1 6.957 0.020 . 1 . . . . 172 GLN HE22 . 17081 1 644 . 1 1 54 54 GLN HG2 H 1 2.050 0.020 . 2 . . . . 172 GLN HG2 . 17081 1 645 . 1 1 54 54 GLN HG3 H 1 1.541 0.020 . 2 . . . . 172 GLN HG3 . 17081 1 646 . 1 1 54 54 GLN C C 13 174.107 0.3 . 1 . . . . 172 GLN C . 17081 1 647 . 1 1 54 54 GLN CA C 13 59.572 0.3 . 1 . . . . 172 GLN CA . 17081 1 648 . 1 1 54 54 GLN CB C 13 28.640 0.3 . 1 . . . . 172 GLN CB . 17081 1 649 . 1 1 54 54 GLN CG C 13 33.613 0.3 . 1 . . . . 172 GLN CG . 17081 1 650 . 1 1 54 54 GLN N N 15 121.618 0.3 . 1 . . . . 172 GLN N . 17081 1 651 . 1 1 54 54 GLN NE2 N 15 112.304 0.3 . 1 . . . . 172 GLN NE2 . 17081 1 652 . 1 1 55 55 ASN H H 1 8.393 0.020 . 1 . . . . 173 ASN H . 17081 1 653 . 1 1 55 55 ASN HA H 1 4.306 0.020 . 1 . . . . 173 ASN HA . 17081 1 654 . 1 1 55 55 ASN HB2 H 1 2.718 0.020 . 2 . . . . 173 ASN HB2 . 17081 1 655 . 1 1 55 55 ASN HB3 H 1 2.781 0.020 . 2 . . . . 173 ASN HB3 . 17081 1 656 . 1 1 55 55 ASN HD21 H 1 7.638 0.020 . 1 . . . . 173 ASN HD21 . 17081 1 657 . 1 1 55 55 ASN HD22 H 1 7.001 0.020 . 1 . . . . 173 ASN HD22 . 17081 1 658 . 1 1 55 55 ASN C C 13 175.486 0.3 . 1 . . . . 173 ASN C . 17081 1 659 . 1 1 55 55 ASN CA C 13 56.157 0.3 . 1 . . . . 173 ASN CA . 17081 1 660 . 1 1 55 55 ASN CB C 13 37.689 0.3 . 1 . . . . 173 ASN CB . 17081 1 661 . 1 1 55 55 ASN N N 15 116.013 0.3 . 1 . . . . 173 ASN N . 17081 1 662 . 1 1 55 55 ASN ND2 N 15 113.034 0.3 . 1 . . . . 173 ASN ND2 . 17081 1 663 . 1 1 56 56 ASN H H 1 8.650 0.020 . 1 . . . . 174 ASN H . 17081 1 664 . 1 1 56 56 ASN HA H 1 4.528 0.020 . 1 . . . . 174 ASN HA . 17081 1 665 . 1 1 56 56 ASN HB2 H 1 2.977 0.020 . 2 . . . . 174 ASN HB2 . 17081 1 666 . 1 1 56 56 ASN HB3 H 1 2.953 0.020 . 2 . . . . 174 ASN HB3 . 17081 1 667 . 1 1 56 56 ASN HD21 H 1 7.782 0.020 . 1 . . . . 174 ASN HD21 . 17081 1 668 . 1 1 56 56 ASN HD22 H 1 7.039 0.020 . 1 . . . . 174 ASN HD22 . 17081 1 669 . 1 1 56 56 ASN C C 13 174.934 0.3 . 1 . . . . 174 ASN C . 17081 1 670 . 1 1 56 56 ASN CA C 13 55.478 0.3 . 1 . . . . 174 ASN CA . 17081 1 671 . 1 1 56 56 ASN CB C 13 37.254 0.3 . 1 . . . . 174 ASN CB . 17081 1 672 . 1 1 56 56 ASN N N 15 118.955 0.3 . 1 . . . . 174 ASN N . 17081 1 673 . 1 1 56 56 ASN ND2 N 15 112.084 0.3 . 1 . . . . 174 ASN ND2 . 17081 1 674 . 1 1 57 57 PHE H H 1 8.443 0.020 . 1 . . . . 175 PHE H . 17081 1 675 . 1 1 57 57 PHE HA H 1 4.455 0.020 . 1 . . . . 175 PHE HA . 17081 1 676 . 1 1 57 57 PHE HB2 H 1 3.258 0.020 . 2 . . . . 175 PHE HB2 . 17081 1 677 . 1 1 57 57 PHE HB3 H 1 3.146 0.020 . 2 . . . . 175 PHE HB3 . 17081 1 678 . 1 1 57 57 PHE HD1 H 1 7.367 0.020 . 1 . . . . 175 PHE HD1 . 17081 1 679 . 1 1 57 57 PHE HD2 H 1 7.367 0.020 . 1 . . . . 175 PHE HD2 . 17081 1 680 . 1 1 57 57 PHE HE1 H 1 7.729 0.020 . 1 . . . . 175 PHE HE1 . 17081 1 681 . 1 1 57 57 PHE HE2 H 1 7.729 0.020 . 1 . . . . 175 PHE HE2 . 17081 1 682 . 1 1 57 57 PHE HZ H 1 6.679 0.020 . 1 . . . . 175 PHE HZ . 17081 1 683 . 1 1 57 57 PHE C C 13 176.335 0.3 . 1 . . . . 175 PHE C . 17081 1 684 . 1 1 57 57 PHE CA C 13 60.865 0.3 . 1 . . . . 175 PHE CA . 17081 1 685 . 1 1 57 57 PHE CB C 13 39.643 0.3 . 1 . . . . 175 PHE CB . 17081 1 686 . 1 1 57 57 PHE CD1 C 13 132.975 0.3 . 1 . . . . 175 PHE CD1 . 17081 1 687 . 1 1 57 57 PHE CE1 C 13 131.700 0.3 . 1 . . . . 175 PHE CE1 . 17081 1 688 . 1 1 57 57 PHE CZ C 13 128.926 0.3 . 1 . . . . 175 PHE CZ . 17081 1 689 . 1 1 57 57 PHE N N 15 122.281 0.3 . 1 . . . . 175 PHE N . 17081 1 690 . 1 1 58 58 VAL H H 1 9.189 0.020 . 1 . . . . 176 VAL H . 17081 1 691 . 1 1 58 58 VAL HA H 1 3.635 0.020 . 1 . . . . 176 VAL HA . 17081 1 692 . 1 1 58 58 VAL HB H 1 2.342 0.020 . 1 . . . . 176 VAL HB . 17081 1 693 . 1 1 58 58 VAL HG11 H 1 1.066 0.020 . 2 . . . . 176 VAL HG1 . 17081 1 694 . 1 1 58 58 VAL HG12 H 1 1.066 0.020 . 2 . . . . 176 VAL HG1 . 17081 1 695 . 1 1 58 58 VAL HG13 H 1 1.066 0.020 . 2 . . . . 176 VAL HG1 . 17081 1 696 . 1 1 58 58 VAL HG21 H 1 1.157 0.020 . 2 . . . . 176 VAL HG2 . 17081 1 697 . 1 1 58 58 VAL HG22 H 1 1.157 0.020 . 2 . . . . 176 VAL HG2 . 17081 1 698 . 1 1 58 58 VAL HG23 H 1 1.157 0.020 . 2 . . . . 176 VAL HG2 . 17081 1 699 . 1 1 58 58 VAL C C 13 174.311 0.3 . 1 . . . . 176 VAL C . 17081 1 700 . 1 1 58 58 VAL CA C 13 67.485 0.3 . 1 . . . . 176 VAL CA . 17081 1 701 . 1 1 58 58 VAL CB C 13 31.371 0.3 . 1 . . . . 176 VAL CB . 17081 1 702 . 1 1 58 58 VAL CG1 C 13 21.318 0.3 . 1 . . . . 176 VAL CG1 . 17081 1 703 . 1 1 58 58 VAL CG2 C 13 24.469 0.3 . 1 . . . . 176 VAL CG2 . 17081 1 704 . 1 1 58 58 VAL N N 15 120.405 0.3 . 1 . . . . 176 VAL N . 17081 1 705 . 1 1 59 59 HIS H H 1 8.251 0.020 . 1 . . . . 177 HIS H . 17081 1 706 . 1 1 59 59 HIS HA H 1 4.335 0.020 . 1 . . . . 177 HIS HA . 17081 1 707 . 1 1 59 59 HIS HB2 H 1 3.414 0.020 . 2 . . . . 177 HIS HB2 . 17081 1 708 . 1 1 59 59 HIS HB3 H 1 3.361 0.020 . 2 . . . . 177 HIS HB3 . 17081 1 709 . 1 1 59 59 HIS HD2 H 1 7.401 0.020 . 1 . . . . 177 HIS HD2 . 17081 1 710 . 1 1 59 59 HIS HE1 H 1 8.626 0.020 . 1 . . . . 177 HIS HE1 . 17081 1 711 . 1 1 59 59 HIS C C 13 174.425 0.3 . 1 . . . . 177 HIS C . 17081 1 712 . 1 1 59 59 HIS CA C 13 59.204 0.3 . 1 . . . . 177 HIS CA . 17081 1 713 . 1 1 59 59 HIS CB C 13 27.791 0.3 . 1 . . . . 177 HIS CB . 17081 1 714 . 1 1 59 59 HIS CD2 C 13 119.948 0.3 . 1 . . . . 177 HIS CD2 . 17081 1 715 . 1 1 59 59 HIS CE1 C 13 136.102 0.3 . 1 . . . . 177 HIS CE1 . 17081 1 716 . 1 1 59 59 HIS N N 15 117.199 0.3 . 1 . . . . 177 HIS N . 17081 1 717 . 1 1 60 60 ASP H H 1 7.836 0.020 . 1 . . . . 178 ASP H . 17081 1 718 . 1 1 60 60 ASP HA H 1 4.483 0.020 . 1 . . . . 178 ASP HA . 17081 1 719 . 1 1 60 60 ASP HB2 H 1 2.915 0.020 . 2 . . . . 178 ASP HB2 . 17081 1 720 . 1 1 60 60 ASP HB3 H 1 2.847 0.020 . 2 . . . . 178 ASP HB3 . 17081 1 721 . 1 1 60 60 ASP C C 13 173.244 0.3 . 1 . . . . 178 ASP C . 17081 1 722 . 1 1 60 60 ASP CA C 13 56.938 0.3 . 1 . . . . 178 ASP CA . 17081 1 723 . 1 1 60 60 ASP CB C 13 41.046 0.3 . 1 . . . . 178 ASP CB . 17081 1 724 . 1 1 60 60 ASP N N 15 118.684 0.3 . 1 . . . . 178 ASP N . 17081 1 725 . 1 1 61 61 CYS H H 1 8.292 0.020 . 1 . . . . 179 CYS H . 17081 1 726 . 1 1 61 61 CYS HA H 1 4.778 0.020 . 1 . . . . 179 CYS HA . 17081 1 727 . 1 1 61 61 CYS HB2 H 1 3.399 0.020 . 2 . . . . 179 CYS HB2 . 17081 1 728 . 1 1 61 61 CYS HB3 H 1 3.001 0.020 . 2 . . . . 179 CYS HB3 . 17081 1 729 . 1 1 61 61 CYS C C 13 174.654 0.3 . 1 . . . . 179 CYS C . 17081 1 730 . 1 1 61 61 CYS CA C 13 58.050 0.3 . 1 . . . . 179 CYS CA . 17081 1 731 . 1 1 61 61 CYS CB C 13 40.573 0.3 . 1 . . . . 179 CYS CB . 17081 1 732 . 1 1 61 61 CYS N N 15 119.407 0.3 . 1 . . . . 179 CYS N . 17081 1 733 . 1 1 62 62 VAL H H 1 9.289 0.020 . 1 . . . . 180 VAL H . 17081 1 734 . 1 1 62 62 VAL HA H 1 3.662 0.020 . 1 . . . . 180 VAL HA . 17081 1 735 . 1 1 62 62 VAL HB H 1 2.186 0.020 . 1 . . . . 180 VAL HB . 17081 1 736 . 1 1 62 62 VAL HG11 H 1 0.989 0.020 . 2 . . . . 180 VAL HG1 . 17081 1 737 . 1 1 62 62 VAL HG12 H 1 0.989 0.020 . 2 . . . . 180 VAL HG1 . 17081 1 738 . 1 1 62 62 VAL HG13 H 1 0.989 0.020 . 2 . . . . 180 VAL HG1 . 17081 1 739 . 1 1 62 62 VAL HG21 H 1 1.114 0.020 . 2 . . . . 180 VAL HG2 . 17081 1 740 . 1 1 62 62 VAL HG22 H 1 1.114 0.020 . 2 . . . . 180 VAL HG2 . 17081 1 741 . 1 1 62 62 VAL HG23 H 1 1.114 0.020 . 2 . . . . 180 VAL HG2 . 17081 1 742 . 1 1 62 62 VAL C C 13 174.565 0.3 . 1 . . . . 180 VAL C . 17081 1 743 . 1 1 62 62 VAL CA C 13 65.853 0.3 . 1 . . . . 180 VAL CA . 17081 1 744 . 1 1 62 62 VAL CB C 13 31.585 0.3 . 1 . . . . 180 VAL CB . 17081 1 745 . 1 1 62 62 VAL CG1 C 13 21.318 0.3 . 1 . . . . 180 VAL CG1 . 17081 1 746 . 1 1 62 62 VAL CG2 C 13 23.347 0.3 . 1 . . . . 180 VAL CG2 . 17081 1 747 . 1 1 62 62 VAL N N 15 124.954 0.3 . 1 . . . . 180 VAL N . 17081 1 748 . 1 1 63 63 ASN H H 1 7.651 0.020 . 1 . . . . 181 ASN H . 17081 1 749 . 1 1 63 63 ASN HA H 1 4.324 0.020 . 1 . . . . 181 ASN HA . 17081 1 750 . 1 1 63 63 ASN HB2 H 1 2.849 0.020 . 2 . . . . 181 ASN HB2 . 17081 1 751 . 1 1 63 63 ASN HB3 H 1 2.789 0.020 . 2 . . . . 181 ASN HB3 . 17081 1 752 . 1 1 63 63 ASN HD21 H 1 7.674 0.020 . 1 . . . . 181 ASN HD21 . 17081 1 753 . 1 1 63 63 ASN HD22 H 1 6.829 0.020 . 1 . . . . 181 ASN HD22 . 17081 1 754 . 1 1 63 63 ASN C C 13 175.826 0.3 . 1 . . . . 181 ASN C . 17081 1 755 . 1 1 63 63 ASN CA C 13 56.236 0.3 . 1 . . . . 181 ASN CA . 17081 1 756 . 1 1 63 63 ASN CB C 13 38.443 0.3 . 1 . . . . 181 ASN CB . 17081 1 757 . 1 1 63 63 ASN N N 15 116.022 0.3 . 1 . . . . 181 ASN N . 17081 1 758 . 1 1 63 63 ASN ND2 N 15 112.222 0.3 . 1 . . . . 181 ASN ND2 . 17081 1 759 . 1 1 64 64 ILE H H 1 8.573 0.020 . 1 . . . . 182 ILE H . 17081 1 760 . 1 1 64 64 ILE HA H 1 3.814 0.020 . 1 . . . . 182 ILE HA . 17081 1 761 . 1 1 64 64 ILE HB H 1 1.552 0.020 . 1 . . . . 182 ILE HB . 17081 1 762 . 1 1 64 64 ILE HD11 H 1 0.374 0.020 . 1 . . . . 182 ILE HD1 . 17081 1 763 . 1 1 64 64 ILE HD12 H 1 0.374 0.020 . 1 . . . . 182 ILE HD1 . 17081 1 764 . 1 1 64 64 ILE HD13 H 1 0.374 0.020 . 1 . . . . 182 ILE HD1 . 17081 1 765 . 1 1 64 64 ILE HG12 H 1 0.776 0.020 . 1 . . . . 182 ILE HG12 . 17081 1 766 . 1 1 64 64 ILE HG13 H 1 0.776 0.020 . 1 . . . . 182 ILE HG13 . 17081 1 767 . 1 1 64 64 ILE HG21 H 1 0.325 0.020 . 1 . . . . 182 ILE HG2 . 17081 1 768 . 1 1 64 64 ILE HG22 H 1 0.325 0.020 . 1 . . . . 182 ILE HG2 . 17081 1 769 . 1 1 64 64 ILE HG23 H 1 0.325 0.020 . 1 . . . . 182 ILE HG2 . 17081 1 770 . 1 1 64 64 ILE C C 13 174.973 0.3 . 1 . . . . 182 ILE C . 17081 1 771 . 1 1 64 64 ILE CA C 13 61.400 0.3 . 1 . . . . 182 ILE CA . 17081 1 772 . 1 1 64 64 ILE CB C 13 36.145 0.3 . 1 . . . . 182 ILE CB . 17081 1 773 . 1 1 64 64 ILE CD1 C 13 10.961 0.3 . 1 . . . . 182 ILE CD1 . 17081 1 774 . 1 1 64 64 ILE CG1 C 13 27.117 0.3 . 1 . . . . 182 ILE CG1 . 17081 1 775 . 1 1 64 64 ILE CG2 C 13 18.217 0.3 . 1 . . . . 182 ILE CG2 . 17081 1 776 . 1 1 64 64 ILE N N 15 118.329 0.3 . 1 . . . . 182 ILE N . 17081 1 777 . 1 1 65 65 THR H H 1 8.167 0.020 . 1 . . . . 183 THR H . 17081 1 778 . 1 1 65 65 THR HA H 1 4.078 0.020 . 1 . . . . 183 THR HA . 17081 1 779 . 1 1 65 65 THR HB H 1 4.496 0.020 . 1 . . . . 183 THR HB . 17081 1 780 . 1 1 65 65 THR HG1 H 1 6.400 0.020 . 1 . . . . 183 THR HG1 . 17081 1 781 . 1 1 65 65 THR HG21 H 1 1.509 0.020 . 1 . . . . 183 THR HG2 . 17081 1 782 . 1 1 65 65 THR HG22 H 1 1.509 0.020 . 1 . . . . 183 THR HG2 . 17081 1 783 . 1 1 65 65 THR HG23 H 1 1.509 0.020 . 1 . . . . 183 THR HG2 . 17081 1 784 . 1 1 65 65 THR C C 13 174.973 0.3 . 1 . . . . 183 THR C . 17081 1 785 . 1 1 65 65 THR CA C 13 68.319 0.3 . 1 . . . . 183 THR CA . 17081 1 786 . 1 1 65 65 THR CB C 13 67.800 0.3 . 1 . . . . 183 THR CB . 17081 1 787 . 1 1 65 65 THR CG2 C 13 21.887 0.3 . 1 . . . . 183 THR CG2 . 17081 1 788 . 1 1 65 65 THR N N 15 118.699 0.3 . 1 . . . . 183 THR N . 17081 1 789 . 1 1 66 66 ILE H H 1 8.525 0.020 . 1 . . . . 184 ILE H . 17081 1 790 . 1 1 66 66 ILE HA H 1 3.740 0.020 . 1 . . . . 184 ILE HA . 17081 1 791 . 1 1 66 66 ILE HB H 1 2.122 0.020 . 1 . . . . 184 ILE HB . 17081 1 792 . 1 1 66 66 ILE HD11 H 1 0.798 0.020 . 1 . . . . 184 ILE HD1 . 17081 1 793 . 1 1 66 66 ILE HD12 H 1 0.798 0.020 . 1 . . . . 184 ILE HD1 . 17081 1 794 . 1 1 66 66 ILE HD13 H 1 0.798 0.020 . 1 . . . . 184 ILE HD1 . 17081 1 795 . 1 1 66 66 ILE HG12 H 1 1.831 0.020 . 2 . . . . 184 ILE HG12 . 17081 1 796 . 1 1 66 66 ILE HG13 H 1 1.265 0.020 . 2 . . . . 184 ILE HG13 . 17081 1 797 . 1 1 66 66 ILE HG21 H 1 0.905 0.020 . 1 . . . . 184 ILE HG2 . 17081 1 798 . 1 1 66 66 ILE HG22 H 1 0.905 0.020 . 1 . . . . 184 ILE HG2 . 17081 1 799 . 1 1 66 66 ILE HG23 H 1 0.905 0.020 . 1 . . . . 184 ILE HG2 . 17081 1 800 . 1 1 66 66 ILE C C 13 176.322 0.3 . 1 . . . . 184 ILE C . 17081 1 801 . 1 1 66 66 ILE CA C 13 65.177 0.3 . 1 . . . . 184 ILE CA . 17081 1 802 . 1 1 66 66 ILE CB C 13 36.202 0.3 . 1 . . . . 184 ILE CB . 17081 1 803 . 1 1 66 66 ILE CD1 C 13 12.414 0.3 . 1 . . . . 184 ILE CD1 . 17081 1 804 . 1 1 66 66 ILE CG1 C 13 29.316 0.3 . 1 . . . . 184 ILE CG1 . 17081 1 805 . 1 1 66 66 ILE CG2 C 13 16.420 0.3 . 1 . . . . 184 ILE CG2 . 17081 1 806 . 1 1 66 66 ILE N N 15 120.882 0.3 . 1 . . . . 184 ILE N . 17081 1 807 . 1 1 67 67 LYS H H 1 8.015 0.020 . 1 . . . . 185 LYS H . 17081 1 808 . 1 1 67 67 LYS HA H 1 4.062 0.020 . 1 . . . . 185 LYS HA . 17081 1 809 . 1 1 67 67 LYS HB2 H 1 1.950 0.020 . 2 . . . . 185 LYS HB2 . 17081 1 810 . 1 1 67 67 LYS HB3 H 1 1.871 0.020 . 2 . . . . 185 LYS HB3 . 17081 1 811 . 1 1 67 67 LYS HD2 H 1 1.603 0.020 . 1 . . . . 185 LYS HD2 . 17081 1 812 . 1 1 67 67 LYS HD3 H 1 1.603 0.020 . 1 . . . . 185 LYS HD3 . 17081 1 813 . 1 1 67 67 LYS HE2 H 1 2.913 0.020 . 1 . . . . 185 LYS HE2 . 17081 1 814 . 1 1 67 67 LYS HE3 H 1 2.913 0.020 . 1 . . . . 185 LYS HE3 . 17081 1 815 . 1 1 67 67 LYS HG2 H 1 1.499 0.020 . 2 . . . . 185 LYS HG2 . 17081 1 816 . 1 1 67 67 LYS HG3 H 1 1.386 0.020 . 2 . . . . 185 LYS HG3 . 17081 1 817 . 1 1 67 67 LYS C C 13 176.450 0.3 . 1 . . . . 185 LYS C . 17081 1 818 . 1 1 67 67 LYS CA C 13 59.601 0.3 . 1 . . . . 185 LYS CA . 17081 1 819 . 1 1 67 67 LYS CB C 13 31.867 0.3 . 1 . . . . 185 LYS CB . 17081 1 820 . 1 1 67 67 LYS CD C 13 28.757 0.3 . 1 . . . . 185 LYS CD . 17081 1 821 . 1 1 67 67 LYS CE C 13 41.571 0.3 . 1 . . . . 185 LYS CE . 17081 1 822 . 1 1 67 67 LYS CG C 13 24.677 0.3 . 1 . . . . 185 LYS CG . 17081 1 823 . 1 1 67 67 LYS N N 15 122.748 0.3 . 1 . . . . 185 LYS N . 17081 1 824 . 1 1 68 68 GLN H H 1 8.366 0.020 . 1 . . . . 186 GLN H . 17081 1 825 . 1 1 68 68 GLN HA H 1 4.040 0.020 . 1 . . . . 186 GLN HA . 17081 1 826 . 1 1 68 68 GLN HB2 H 1 2.013 0.020 . 2 . . . . 186 GLN HB2 . 17081 1 827 . 1 1 68 68 GLN HB3 H 1 1.904 0.020 . 2 . . . . 186 GLN HB3 . 17081 1 828 . 1 1 68 68 GLN HE21 H 1 6.781 0.020 . 1 . . . . 186 GLN HE21 . 17081 1 829 . 1 1 68 68 GLN HE22 H 1 6.741 0.020 . 1 . . . . 186 GLN HE22 . 17081 1 830 . 1 1 68 68 GLN HG2 H 1 2.095 0.020 . 2 . . . . 186 GLN HG2 . 17081 1 831 . 1 1 68 68 GLN HG3 H 1 1.549 0.020 . 2 . . . . 186 GLN HG3 . 17081 1 832 . 1 1 68 68 GLN C C 13 175.329 0.3 . 1 . . . . 186 GLN C . 17081 1 833 . 1 1 68 68 GLN CA C 13 57.195 0.3 . 1 . . . . 186 GLN CA . 17081 1 834 . 1 1 68 68 GLN CB C 13 27.858 0.3 . 1 . . . . 186 GLN CB . 17081 1 835 . 1 1 68 68 GLN CG C 13 33.134 0.3 . 1 . . . . 186 GLN CG . 17081 1 836 . 1 1 68 68 GLN N N 15 116.233 0.3 . 1 . . . . 186 GLN N . 17081 1 837 . 1 1 68 68 GLN NE2 N 15 110.136 0.3 . 1 . . . . 186 GLN NE2 . 17081 1 838 . 1 1 69 69 HIS H H 1 8.110 0.020 . 1 . . . . 187 HIS H . 17081 1 839 . 1 1 69 69 HIS HA H 1 4.610 0.020 . 1 . . . . 187 HIS HA . 17081 1 840 . 1 1 69 69 HIS HB2 H 1 3.345 0.020 . 2 . . . . 187 HIS HB2 . 17081 1 841 . 1 1 69 69 HIS HB3 H 1 3.319 0.020 . 2 . . . . 187 HIS HB3 . 17081 1 842 . 1 1 69 69 HIS HD2 H 1 7.284 0.020 . 1 . . . . 187 HIS HD2 . 17081 1 843 . 1 1 69 69 HIS HE1 H 1 8.164 0.020 . 1 . . . . 187 HIS HE1 . 17081 1 844 . 1 1 69 69 HIS C C 13 173.980 0.3 . 1 . . . . 187 HIS C . 17081 1 845 . 1 1 69 69 HIS CA C 13 58.255 0.3 . 1 . . . . 187 HIS CA . 17081 1 846 . 1 1 69 69 HIS CB C 13 29.717 0.3 . 1 . . . . 187 HIS CB . 17081 1 847 . 1 1 69 69 HIS CD2 C 13 118.686 0.3 . 1 . . . . 187 HIS CD2 . 17081 1 848 . 1 1 69 69 HIS CE1 C 13 137.716 0.3 . 1 . . . . 187 HIS CE1 . 17081 1 849 . 1 1 69 69 HIS N N 15 117.919 0.3 . 1 . . . . 187 HIS N . 17081 1 850 . 1 1 70 70 THR H H 1 8.223 0.020 . 1 . . . . 188 THR H . 17081 1 851 . 1 1 70 70 THR HA H 1 4.224 0.020 . 1 . . . . 188 THR HA . 17081 1 852 . 1 1 70 70 THR HB H 1 4.428 0.020 . 1 . . . . 188 THR HB . 17081 1 853 . 1 1 70 70 THR HG21 H 1 1.256 0.020 . 1 . . . . 188 THR HG2 . 17081 1 854 . 1 1 70 70 THR HG22 H 1 1.256 0.020 . 1 . . . . 188 THR HG2 . 17081 1 855 . 1 1 70 70 THR HG23 H 1 1.256 0.020 . 1 . . . . 188 THR HG2 . 17081 1 856 . 1 1 70 70 THR C C 13 173.076 0.3 . 1 . . . . 188 THR C . 17081 1 857 . 1 1 70 70 THR CA C 13 64.538 0.3 . 1 . . . . 188 THR CA . 17081 1 858 . 1 1 70 70 THR CB C 13 68.857 0.3 . 1 . . . . 188 THR CB . 17081 1 859 . 1 1 70 70 THR CG2 C 13 21.116 0.3 . 1 . . . . 188 THR CG2 . 17081 1 860 . 1 1 70 70 THR N N 15 114.122 0.3 . 1 . . . . 188 THR N . 17081 1 861 . 1 1 71 71 VAL H H 1 8.001 0.020 . 1 . . . . 189 VAL H . 17081 1 862 . 1 1 71 71 VAL HA H 1 4.019 0.020 . 1 . . . . 189 VAL HA . 17081 1 863 . 1 1 71 71 VAL HB H 1 2.215 0.020 . 1 . . . . 189 VAL HB . 17081 1 864 . 1 1 71 71 VAL HG11 H 1 0.961 0.020 . 2 . . . . 189 VAL HG1 . 17081 1 865 . 1 1 71 71 VAL HG12 H 1 0.961 0.020 . 2 . . . . 189 VAL HG1 . 17081 1 866 . 1 1 71 71 VAL HG13 H 1 0.961 0.020 . 2 . . . . 189 VAL HG1 . 17081 1 867 . 1 1 71 71 VAL HG21 H 1 1.026 0.020 . 2 . . . . 189 VAL HG2 . 17081 1 868 . 1 1 71 71 VAL HG22 H 1 1.026 0.020 . 2 . . . . 189 VAL HG2 . 17081 1 869 . 1 1 71 71 VAL HG23 H 1 1.026 0.020 . 2 . . . . 189 VAL HG2 . 17081 1 870 . 1 1 71 71 VAL C C 13 175.024 0.3 . 1 . . . . 189 VAL C . 17081 1 871 . 1 1 71 71 VAL CA C 13 64.384 0.3 . 1 . . . . 189 VAL CA . 17081 1 872 . 1 1 71 71 VAL CB C 13 31.698 0.3 . 1 . . . . 189 VAL CB . 17081 1 873 . 1 1 71 71 VAL CG1 C 13 20.677 0.3 . 1 . . . . 189 VAL CG1 . 17081 1 874 . 1 1 71 71 VAL CG2 C 13 21.083 0.3 . 1 . . . . 189 VAL CG2 . 17081 1 875 . 1 1 71 71 VAL N N 15 122.059 0.3 . 1 . . . . 189 VAL N . 17081 1 876 . 1 1 72 72 THR H H 1 8.109 0.020 . 1 . . . . 190 THR H . 17081 1 877 . 1 1 72 72 THR HA H 1 4.254 0.020 . 1 . . . . 190 THR HA . 17081 1 878 . 1 1 72 72 THR HB H 1 4.280 0.020 . 1 . . . . 190 THR HB . 17081 1 879 . 1 1 72 72 THR HG21 H 1 1.270 0.020 . 1 . . . . 190 THR HG2 . 17081 1 880 . 1 1 72 72 THR HG22 H 1 1.270 0.020 . 1 . . . . 190 THR HG2 . 17081 1 881 . 1 1 72 72 THR HG23 H 1 1.270 0.020 . 1 . . . . 190 THR HG2 . 17081 1 882 . 1 1 72 72 THR C C 13 173.190 0.3 . 1 . . . . 190 THR C . 17081 1 883 . 1 1 72 72 THR CA C 13 63.403 0.3 . 1 . . . . 190 THR CA . 17081 1 884 . 1 1 72 72 THR CB C 13 68.898 0.3 . 1 . . . . 190 THR CB . 17081 1 885 . 1 1 72 72 THR CG2 C 13 21.282 0.3 . 1 . . . . 190 THR CG2 . 17081 1 886 . 1 1 72 72 THR N N 15 115.376 0.3 . 1 . . . . 190 THR N . 17081 1 887 . 1 1 73 73 THR H H 1 8.039 0.020 . 1 . . . . 191 THR H . 17081 1 888 . 1 1 73 73 THR HA H 1 4.237 0.020 . 1 . . . . 191 THR HA . 17081 1 889 . 1 1 73 73 THR HB H 1 4.186 0.020 . 1 . . . . 191 THR HB . 17081 1 890 . 1 1 73 73 THR HG21 H 1 1.038 0.020 . 1 . . . . 191 THR HG2 . 17081 1 891 . 1 1 73 73 THR HG22 H 1 1.038 0.020 . 1 . . . . 191 THR HG2 . 17081 1 892 . 1 1 73 73 THR HG23 H 1 1.038 0.020 . 1 . . . . 191 THR HG2 . 17081 1 893 . 1 1 73 73 THR C C 13 173.381 0.3 . 1 . . . . 191 THR C . 17081 1 894 . 1 1 73 73 THR CA C 13 63.334 0.3 . 1 . . . . 191 THR CA . 17081 1 895 . 1 1 73 73 THR CB C 13 68.749 0.3 . 1 . . . . 191 THR CB . 17081 1 896 . 1 1 73 73 THR CG2 C 13 21.110 0.3 . 1 . . . . 191 THR CG2 . 17081 1 897 . 1 1 73 73 THR N N 15 115.011 0.3 . 1 . . . . 191 THR N . 17081 1 898 . 1 1 74 74 THR H H 1 8.210 0.020 . 1 . . . . 192 THR H . 17081 1 899 . 1 1 74 74 THR HA H 1 4.389 0.020 . 1 . . . . 192 THR HA . 17081 1 900 . 1 1 74 74 THR HB H 1 4.374 0.020 . 1 . . . . 192 THR HB . 17081 1 901 . 1 1 74 74 THR HG21 H 1 1.288 0.020 . 1 . . . . 192 THR HG2 . 17081 1 902 . 1 1 74 74 THR HG22 H 1 1.288 0.020 . 1 . . . . 192 THR HG2 . 17081 1 903 . 1 1 74 74 THR HG23 H 1 1.288 0.020 . 1 . . . . 192 THR HG2 . 17081 1 904 . 1 1 74 74 THR C C 13 173.929 0.3 . 1 . . . . 192 THR C . 17081 1 905 . 1 1 74 74 THR CA C 13 63.509 0.3 . 1 . . . . 192 THR CA . 17081 1 906 . 1 1 74 74 THR CB C 13 68.878 0.3 . 1 . . . . 192 THR CB . 17081 1 907 . 1 1 74 74 THR CG2 C 13 21.143 0.3 . 1 . . . . 192 THR CG2 . 17081 1 908 . 1 1 74 74 THR N N 15 116.570 0.3 . 1 . . . . 192 THR N . 17081 1 909 . 1 1 75 75 THR H H 1 8.004 0.020 . 1 . . . . 193 THR H . 17081 1 910 . 1 1 75 75 THR HA H 1 4.251 0.020 . 1 . . . . 193 THR HA . 17081 1 911 . 1 1 75 75 THR HB H 1 4.288 0.020 . 1 . . . . 193 THR HB . 17081 1 912 . 1 1 75 75 THR HG21 H 1 1.272 0.020 . 1 . . . . 193 THR HG2 . 17081 1 913 . 1 1 75 75 THR HG22 H 1 1.272 0.020 . 1 . . . . 193 THR HG2 . 17081 1 914 . 1 1 75 75 THR HG23 H 1 1.272 0.020 . 1 . . . . 193 THR HG2 . 17081 1 915 . 1 1 75 75 THR C C 13 172.377 0.3 . 1 . . . . 193 THR C . 17081 1 916 . 1 1 75 75 THR CA C 13 63.346 0.3 . 1 . . . . 193 THR CA . 17081 1 917 . 1 1 75 75 THR CB C 13 68.918 0.3 . 1 . . . . 193 THR CB . 17081 1 918 . 1 1 75 75 THR CG2 C 13 21.318 0.3 . 1 . . . . 193 THR CG2 . 17081 1 919 . 1 1 75 75 THR N N 15 116.277 0.3 . 1 . . . . 193 THR N . 17081 1 920 . 1 1 76 76 LYS H H 1 7.924 0.020 . 1 . . . . 194 LYS H . 17081 1 921 . 1 1 76 76 LYS HA H 1 4.349 0.020 . 1 . . . . 194 LYS HA . 17081 1 922 . 1 1 76 76 LYS HB2 H 1 1.945 0.020 . 2 . . . . 194 LYS HB2 . 17081 1 923 . 1 1 76 76 LYS HB3 H 1 1.829 0.020 . 2 . . . . 194 LYS HB3 . 17081 1 924 . 1 1 76 76 LYS HD2 H 1 1.676 0.020 . 1 . . . . 194 LYS HD2 . 17081 1 925 . 1 1 76 76 LYS HD3 H 1 1.676 0.020 . 1 . . . . 194 LYS HD3 . 17081 1 926 . 1 1 76 76 LYS HE2 H 1 2.979 0.020 . 1 . . . . 194 LYS HE2 . 17081 1 927 . 1 1 76 76 LYS HE3 H 1 2.979 0.020 . 1 . . . . 194 LYS HE3 . 17081 1 928 . 1 1 76 76 LYS HG2 H 1 1.511 0.020 . 2 . . . . 194 LYS HG2 . 17081 1 929 . 1 1 76 76 LYS HG3 H 1 1.453 0.020 . 2 . . . . 194 LYS HG3 . 17081 1 930 . 1 1 76 76 LYS C C 13 174.245 0.3 . 1 . . . . 194 LYS C . 17081 1 931 . 1 1 76 76 LYS CA C 13 56.164 0.3 . 1 . . . . 194 LYS CA . 17081 1 932 . 1 1 76 76 LYS CB C 13 32.164 0.3 . 1 . . . . 194 LYS CB . 17081 1 933 . 1 1 76 76 LYS CD C 13 28.694 0.3 . 1 . . . . 194 LYS CD . 17081 1 934 . 1 1 76 76 LYS CE C 13 41.653 0.3 . 1 . . . . 194 LYS CE . 17081 1 935 . 1 1 76 76 LYS CG C 13 24.445 0.3 . 1 . . . . 194 LYS CG . 17081 1 936 . 1 1 76 76 LYS N N 15 121.275 0.3 . 1 . . . . 194 LYS N . 17081 1 937 . 1 1 77 77 GLY H H 1 8.164 0.020 . 1 . . . . 195 GLY H . 17081 1 938 . 1 1 77 77 GLY HA2 H 1 3.873 0.020 . 1 . . . . 195 GLY HA2 . 17081 1 939 . 1 1 77 77 GLY C C 13 171.563 0.3 . 1 . . . . 195 GLY C . 17081 1 940 . 1 1 77 77 GLY CA C 13 45.040 0.3 . 1 . . . . 195 GLY CA . 17081 1 941 . 1 1 77 77 GLY N N 15 109.131 0.3 . 1 . . . . 195 GLY N . 17081 1 942 . 1 1 78 78 GLU H H 1 7.806 0.020 . 1 . . . . 196 GLU H . 17081 1 943 . 1 1 78 78 GLU HA H 1 4.263 0.020 . 1 . . . . 196 GLU HA . 17081 1 944 . 1 1 78 78 GLU HB2 H 1 1.724 0.020 . 1 . . . . 196 GLU HB2 . 17081 1 945 . 1 1 78 78 GLU HB3 H 1 1.724 0.020 . 1 . . . . 196 GLU HB3 . 17081 1 946 . 1 1 78 78 GLU HG2 H 1 2.114 0.020 . 2 . . . . 196 GLU HG2 . 17081 1 947 . 1 1 78 78 GLU HG3 H 1 2.139 0.020 . 2 . . . . 196 GLU HG3 . 17081 1 948 . 1 1 78 78 GLU C C 13 172.668 0.3 . 1 . . . . 196 GLU C . 17081 1 949 . 1 1 78 78 GLU CA C 13 55.400 0.3 . 1 . . . . 196 GLU CA . 17081 1 950 . 1 1 78 78 GLU CB C 13 30.160 0.3 . 1 . . . . 196 GLU CB . 17081 1 951 . 1 1 78 78 GLU CG C 13 35.137 0.3 . 1 . . . . 196 GLU CG . 17081 1 952 . 1 1 78 78 GLU N N 15 120.047 0.3 . 1 . . . . 196 GLU N . 17081 1 953 . 1 1 79 79 ASN H H 1 8.530 0.020 . 1 . . . . 197 ASN H . 17081 1 954 . 1 1 79 79 ASN HA H 1 4.676 0.020 . 1 . . . . 197 ASN HA . 17081 1 955 . 1 1 79 79 ASN HB2 H 1 2.730 0.020 . 2 . . . . 197 ASN HB2 . 17081 1 956 . 1 1 79 79 ASN HB3 H 1 2.652 0.020 . 2 . . . . 197 ASN HB3 . 17081 1 957 . 1 1 79 79 ASN HD21 H 1 7.590 0.020 . 1 . . . . 197 ASN HD21 . 17081 1 958 . 1 1 79 79 ASN HD22 H 1 6.873 0.020 . 1 . . . . 197 ASN HD22 . 17081 1 959 . 1 1 79 79 ASN C C 13 171.433 0.3 . 1 . . . . 197 ASN C . 17081 1 960 . 1 1 79 79 ASN CA C 13 52.500 0.3 . 1 . . . . 197 ASN CA . 17081 1 961 . 1 1 79 79 ASN CB C 13 39.538 0.3 . 1 . . . . 197 ASN CB . 17081 1 962 . 1 1 79 79 ASN N N 15 119.935 0.3 . 1 . . . . 197 ASN N . 17081 1 963 . 1 1 79 79 ASN ND2 N 15 113.180 0.3 . 1 . . . . 197 ASN ND2 . 17081 1 964 . 1 1 80 80 PHE H H 1 8.666 0.020 . 1 . . . . 198 PHE H . 17081 1 965 . 1 1 80 80 PHE HA H 1 5.270 0.020 . 1 . . . . 198 PHE HA . 17081 1 966 . 1 1 80 80 PHE HB2 H 1 3.012 0.020 . 2 . . . . 198 PHE HB2 . 17081 1 967 . 1 1 80 80 PHE HB3 H 1 3.200 0.020 . 2 . . . . 198 PHE HB3 . 17081 1 968 . 1 1 80 80 PHE HD1 H 1 7.367 0.020 . 1 . . . . 198 PHE HD1 . 17081 1 969 . 1 1 80 80 PHE HD2 H 1 7.367 0.020 . 1 . . . . 198 PHE HD2 . 17081 1 970 . 1 1 80 80 PHE HE1 H 1 7.460 0.020 . 1 . . . . 198 PHE HE1 . 17081 1 971 . 1 1 80 80 PHE HE2 H 1 7.460 0.020 . 1 . . . . 198 PHE HE2 . 17081 1 972 . 1 1 80 80 PHE C C 13 174.120 0.3 . 1 . . . . 198 PHE C . 17081 1 973 . 1 1 80 80 PHE CA C 13 56.375 0.3 . 1 . . . . 198 PHE CA . 17081 1 974 . 1 1 80 80 PHE CB C 13 39.587 0.3 . 1 . . . . 198 PHE CB . 17081 1 975 . 1 1 80 80 PHE CD1 C 13 131.130 0.3 . 1 . . . . 198 PHE CD1 . 17081 1 976 . 1 1 80 80 PHE CE1 C 13 129.647 0.3 . 1 . . . . 198 PHE CE1 . 17081 1 977 . 1 1 80 80 PHE N N 15 122.205 0.3 . 1 . . . . 198 PHE N . 17081 1 978 . 1 1 81 81 THR H H 1 9.508 0.020 . 1 . . . . 199 THR H . 17081 1 979 . 1 1 81 81 THR HA H 1 4.633 0.020 . 1 . . . . 199 THR HA . 17081 1 980 . 1 1 81 81 THR HB H 1 4.861 0.020 . 1 . . . . 199 THR HB . 17081 1 981 . 1 1 81 81 THR HG21 H 1 1.456 0.020 . 1 . . . . 199 THR HG2 . 17081 1 982 . 1 1 81 81 THR HG22 H 1 1.456 0.020 . 1 . . . . 199 THR HG2 . 17081 1 983 . 1 1 81 81 THR HG23 H 1 1.456 0.020 . 1 . . . . 199 THR HG2 . 17081 1 984 . 1 1 81 81 THR C C 13 172.808 0.3 . 1 . . . . 199 THR C . 17081 1 985 . 1 1 81 81 THR CA C 13 60.226 0.3 . 1 . . . . 199 THR CA . 17081 1 986 . 1 1 81 81 THR CB C 13 71.695 0.3 . 1 . . . . 199 THR CB . 17081 1 987 . 1 1 81 81 THR CG2 C 13 21.348 0.3 . 1 . . . . 199 THR CG2 . 17081 1 988 . 1 1 81 81 THR N N 15 116.369 0.3 . 1 . . . . 199 THR N . 17081 1 989 . 1 1 82 82 GLU H H 1 9.159 0.020 . 1 . . . . 200 GLU H . 17081 1 990 . 1 1 82 82 GLU HA H 1 4.101 0.020 . 1 . . . . 200 GLU HA . 17081 1 991 . 1 1 82 82 GLU HB2 H 1 2.147 0.020 . 2 . . . . 200 GLU HB2 . 17081 1 992 . 1 1 82 82 GLU HB3 H 1 2.091 0.020 . 2 . . . . 200 GLU HB3 . 17081 1 993 . 1 1 82 82 GLU HG2 H 1 2.446 0.020 . 2 . . . . 200 GLU HG2 . 17081 1 994 . 1 1 82 82 GLU HG3 H 1 2.384 0.020 . 2 . . . . 200 GLU HG3 . 17081 1 995 . 1 1 82 82 GLU C C 13 176.487 0.3 . 1 . . . . 200 GLU C . 17081 1 996 . 1 1 82 82 GLU CA C 13 59.376 0.3 . 1 . . . . 200 GLU CA . 17081 1 997 . 1 1 82 82 GLU CB C 13 28.354 0.3 . 1 . . . . 200 GLU CB . 17081 1 998 . 1 1 82 82 GLU CG C 13 35.265 0.3 . 1 . . . . 200 GLU CG . 17081 1 999 . 1 1 82 82 GLU N N 15 119.904 0.3 . 1 . . . . 200 GLU N . 17081 1 1000 . 1 1 83 83 THR H H 1 7.983 0.020 . 1 . . . . 201 THR H . 17081 1 1001 . 1 1 83 83 THR HA H 1 3.827 0.020 . 1 . . . . 201 THR HA . 17081 1 1002 . 1 1 83 83 THR HB H 1 3.773 0.020 . 1 . . . . 201 THR HB . 17081 1 1003 . 1 1 83 83 THR HG21 H 1 0.772 0.020 . 1 . . . . 201 THR HG2 . 17081 1 1004 . 1 1 83 83 THR HG22 H 1 0.772 0.020 . 1 . . . . 201 THR HG2 . 17081 1 1005 . 1 1 83 83 THR HG23 H 1 0.772 0.020 . 1 . . . . 201 THR HG2 . 17081 1 1006 . 1 1 83 83 THR C C 13 173.050 0.3 . 1 . . . . 201 THR C . 17081 1 1007 . 1 1 83 83 THR CA C 13 66.454 0.3 . 1 . . . . 201 THR CA . 17081 1 1008 . 1 1 83 83 THR CB C 13 68.270 0.3 . 1 . . . . 201 THR CB . 17081 1 1009 . 1 1 83 83 THR CG2 C 13 21.004 0.3 . 1 . . . . 201 THR CG2 . 17081 1 1010 . 1 1 83 83 THR N N 15 116.467 0.3 . 1 . . . . 201 THR N . 17081 1 1011 . 1 1 84 84 ASP H H 1 7.516 0.020 . 1 . . . . 202 ASP H . 17081 1 1012 . 1 1 84 84 ASP HA H 1 4.568 0.020 . 1 . . . . 202 ASP HA . 17081 1 1013 . 1 1 84 84 ASP HB2 H 1 3.265 0.020 . 2 . . . . 202 ASP HB2 . 17081 1 1014 . 1 1 84 84 ASP HB3 H 1 2.502 0.020 . 2 . . . . 202 ASP HB3 . 17081 1 1015 . 1 1 84 84 ASP C C 13 174.896 0.3 . 1 . . . . 202 ASP C . 17081 1 1016 . 1 1 84 84 ASP CA C 13 57.592 0.3 . 1 . . . . 202 ASP CA . 17081 1 1017 . 1 1 84 84 ASP CB C 13 40.919 0.3 . 1 . . . . 202 ASP CB . 17081 1 1018 . 1 1 84 84 ASP N N 15 120.223 0.3 . 1 . . . . 202 ASP N . 17081 1 1019 . 1 1 85 85 VAL H H 1 8.254 0.020 . 1 . . . . 203 VAL H . 17081 1 1020 . 1 1 85 85 VAL HA H 1 3.366 0.020 . 1 . . . . 203 VAL HA . 17081 1 1021 . 1 1 85 85 VAL HB H 1 2.148 0.020 . 1 . . . . 203 VAL HB . 17081 1 1022 . 1 1 85 85 VAL HG11 H 1 1.035 0.020 . 2 . . . . 203 VAL HG1 . 17081 1 1023 . 1 1 85 85 VAL HG12 H 1 1.035 0.020 . 2 . . . . 203 VAL HG1 . 17081 1 1024 . 1 1 85 85 VAL HG13 H 1 1.035 0.020 . 2 . . . . 203 VAL HG1 . 17081 1 1025 . 1 1 85 85 VAL HG21 H 1 0.924 0.020 . 2 . . . . 203 VAL HG2 . 17081 1 1026 . 1 1 85 85 VAL HG22 H 1 0.924 0.020 . 2 . . . . 203 VAL HG2 . 17081 1 1027 . 1 1 85 85 VAL HG23 H 1 0.924 0.020 . 2 . . . . 203 VAL HG2 . 17081 1 1028 . 1 1 85 85 VAL C C 13 175.189 0.3 . 1 . . . . 203 VAL C . 17081 1 1029 . 1 1 85 85 VAL CA C 13 67.181 0.3 . 1 . . . . 203 VAL CA . 17081 1 1030 . 1 1 85 85 VAL CB C 13 31.190 0.3 . 1 . . . . 203 VAL CB . 17081 1 1031 . 1 1 85 85 VAL CG1 C 13 22.398 0.3 . 1 . . . . 203 VAL CG1 . 17081 1 1032 . 1 1 85 85 VAL CG2 C 13 20.750 0.3 . 1 . . . . 203 VAL CG2 . 17081 1 1033 . 1 1 85 85 VAL N N 15 119.732 0.3 . 1 . . . . 203 VAL N . 17081 1 1034 . 1 1 86 86 LYS H H 1 7.708 0.020 . 1 . . . . 204 LYS H . 17081 1 1035 . 1 1 86 86 LYS HA H 1 4.088 0.020 . 1 . . . . 204 LYS HA . 17081 1 1036 . 1 1 86 86 LYS HB2 H 1 1.995 0.020 . 2 . . . . 204 LYS HB2 . 17081 1 1037 . 1 1 86 86 LYS HB3 H 1 1.952 0.020 . 2 . . . . 204 LYS HB3 . 17081 1 1038 . 1 1 86 86 LYS HD2 H 1 1.697 0.020 . 1 . . . . 204 LYS HD2 . 17081 1 1039 . 1 1 86 86 LYS HD3 H 1 1.697 0.020 . 1 . . . . 204 LYS HD3 . 17081 1 1040 . 1 1 86 86 LYS HE2 H 1 2.948 0.020 . 1 . . . . 204 LYS HE2 . 17081 1 1041 . 1 1 86 86 LYS HE3 H 1 2.948 0.020 . 1 . . . . 204 LYS HE3 . 17081 1 1042 . 1 1 86 86 LYS HG2 H 1 1.638 0.020 . 2 . . . . 204 LYS HG2 . 17081 1 1043 . 1 1 86 86 LYS HG3 H 1 1.443 0.020 . 2 . . . . 204 LYS HG3 . 17081 1 1044 . 1 1 86 86 LYS C C 13 177.392 0.3 . 1 . . . . 204 LYS C . 17081 1 1045 . 1 1 86 86 LYS CA C 13 58.979 0.3 . 1 . . . . 204 LYS CA . 17081 1 1046 . 1 1 86 86 LYS CB C 13 31.693 0.3 . 1 . . . . 204 LYS CB . 17081 1 1047 . 1 1 86 86 LYS CD C 13 28.875 0.3 . 1 . . . . 204 LYS CD . 17081 1 1048 . 1 1 86 86 LYS CE C 13 41.582 0.3 . 1 . . . . 204 LYS CE . 17081 1 1049 . 1 1 86 86 LYS CG C 13 24.711 0.3 . 1 . . . . 204 LYS CG . 17081 1 1050 . 1 1 86 86 LYS N N 15 119.287 0.3 . 1 . . . . 204 LYS N . 17081 1 1051 . 1 1 87 87 MET H H 1 8.237 0.020 . 1 . . . . 205 MET H . 17081 1 1052 . 1 1 87 87 MET HA H 1 4.157 0.020 . 1 . . . . 205 MET HA . 17081 1 1053 . 1 1 87 87 MET HB2 H 1 2.332 0.020 . 2 . . . . 205 MET HB2 . 17081 1 1054 . 1 1 87 87 MET HB3 H 1 1.910 0.020 . 2 . . . . 205 MET HB3 . 17081 1 1055 . 1 1 87 87 MET HE1 H 1 1.503 0.020 . 1 . . . . 205 MET HE . 17081 1 1056 . 1 1 87 87 MET HE2 H 1 1.503 0.020 . 1 . . . . 205 MET HE . 17081 1 1057 . 1 1 87 87 MET HE3 H 1 1.503 0.020 . 1 . . . . 205 MET HE . 17081 1 1058 . 1 1 87 87 MET HG2 H 1 3.032 0.020 . 2 . . . . 205 MET HG2 . 17081 1 1059 . 1 1 87 87 MET HG3 H 1 2.352 0.020 . 2 . . . . 205 MET HG3 . 17081 1 1060 . 1 1 87 87 MET C C 13 175.367 0.3 . 1 . . . . 205 MET C . 17081 1 1061 . 1 1 87 87 MET CA C 13 59.388 0.3 . 1 . . . . 205 MET CA . 17081 1 1062 . 1 1 87 87 MET CB C 13 32.481 0.3 . 1 . . . . 205 MET CB . 17081 1 1063 . 1 1 87 87 MET CE C 13 17.772 0.3 . 1 . . . . 205 MET CE . 17081 1 1064 . 1 1 87 87 MET CG C 13 33.596 0.3 . 1 . . . . 205 MET CG . 17081 1 1065 . 1 1 87 87 MET N N 15 118.719 0.3 . 1 . . . . 205 MET N . 17081 1 1066 . 1 1 88 88 MET H H 1 8.747 0.020 . 1 . . . . 206 MET H . 17081 1 1067 . 1 1 88 88 MET HA H 1 3.552 0.020 . 1 . . . . 206 MET HA . 17081 1 1068 . 1 1 88 88 MET HB2 H 1 1.909 0.020 . 2 . . . . 206 MET HB2 . 17081 1 1069 . 1 1 88 88 MET HB3 H 1 1.788 0.020 . 2 . . . . 206 MET HB3 . 17081 1 1070 . 1 1 88 88 MET HE1 H 1 1.524 0.020 . 1 . . . . 206 MET HE . 17081 1 1071 . 1 1 88 88 MET HE2 H 1 1.524 0.020 . 1 . . . . 206 MET HE . 17081 1 1072 . 1 1 88 88 MET HE3 H 1 1.524 0.020 . 1 . . . . 206 MET HE . 17081 1 1073 . 1 1 88 88 MET HG2 H 1 2.012 0.020 . 2 . . . . 206 MET HG2 . 17081 1 1074 . 1 1 88 88 MET HG3 H 1 1.854 0.020 . 2 . . . . 206 MET HG3 . 17081 1 1075 . 1 1 88 88 MET C C 13 175.062 0.3 . 1 . . . . 206 MET C . 17081 1 1076 . 1 1 88 88 MET CA C 13 59.154 0.3 . 1 . . . . 206 MET CA . 17081 1 1077 . 1 1 88 88 MET CB C 13 32.815 0.3 . 1 . . . . 206 MET CB . 17081 1 1078 . 1 1 88 88 MET CE C 13 15.850 0.3 . 1 . . . . 206 MET CE . 17081 1 1079 . 1 1 88 88 MET CG C 13 32.141 0.3 . 1 . . . . 206 MET CG . 17081 1 1080 . 1 1 88 88 MET N N 15 118.366 0.3 . 1 . . . . 206 MET N . 17081 1 1081 . 1 1 89 89 GLU H H 1 8.388 0.020 . 1 . . . . 207 GLU H . 17081 1 1082 . 1 1 89 89 GLU HA H 1 3.698 0.020 . 1 . . . . 207 GLU HA . 17081 1 1083 . 1 1 89 89 GLU HB2 H 1 2.226 0.020 . 2 . . . . 207 GLU HB2 . 17081 1 1084 . 1 1 89 89 GLU HB3 H 1 2.092 0.020 . 2 . . . . 207 GLU HB3 . 17081 1 1085 . 1 1 89 89 GLU HG2 H 1 2.560 0.020 . 2 . . . . 207 GLU HG2 . 17081 1 1086 . 1 1 89 89 GLU HG3 H 1 2.235 0.020 . 2 . . . . 207 GLU HG3 . 17081 1 1087 . 1 1 89 89 GLU C C 13 175.558 0.3 . 1 . . . . 207 GLU C . 17081 1 1088 . 1 1 89 89 GLU CA C 13 60.134 0.3 . 1 . . . . 207 GLU CA . 17081 1 1089 . 1 1 89 89 GLU CB C 13 27.765 0.3 . 1 . . . . 207 GLU CB . 17081 1 1090 . 1 1 89 89 GLU CG C 13 34.772 0.3 . 1 . . . . 207 GLU CG . 17081 1 1091 . 1 1 89 89 GLU N N 15 118.329 0.3 . 1 . . . . 207 GLU N . 17081 1 1092 . 1 1 90 90 ARG H H 1 7.339 0.020 . 1 . . . . 208 ARG H . 17081 1 1093 . 1 1 90 90 ARG HA H 1 4.180 0.020 . 1 . . . . 208 ARG HA . 17081 1 1094 . 1 1 90 90 ARG HB2 H 1 1.920 0.020 . 2 . . . . 208 ARG HB2 . 17081 1 1095 . 1 1 90 90 ARG HB3 H 1 2.086 0.020 . 2 . . . . 208 ARG HB3 . 17081 1 1096 . 1 1 90 90 ARG HD2 H 1 3.223 0.020 . 2 . . . . 208 ARG HD2 . 17081 1 1097 . 1 1 90 90 ARG HD3 H 1 3.145 0.020 . 2 . . . . 208 ARG HD3 . 17081 1 1098 . 1 1 90 90 ARG HE H 1 7.313 0.020 . 1 . . . . 208 ARG HE . 17081 1 1099 . 1 1 90 90 ARG HG2 H 1 1.805 0.020 . 2 . . . . 208 ARG HG2 . 17081 1 1100 . 1 1 90 90 ARG HG3 H 1 1.760 0.020 . 2 . . . . 208 ARG HG3 . 17081 1 1101 . 1 1 90 90 ARG C C 13 176.615 0.3 . 1 . . . . 208 ARG C . 17081 1 1102 . 1 1 90 90 ARG CA C 13 57.978 0.3 . 1 . . . . 208 ARG CA . 17081 1 1103 . 1 1 90 90 ARG CB C 13 29.457 0.3 . 1 . . . . 208 ARG CB . 17081 1 1104 . 1 1 90 90 ARG CD C 13 42.050 0.3 . 1 . . . . 208 ARG CD . 17081 1 1105 . 1 1 90 90 ARG CG C 13 26.449 0.3 . 1 . . . . 208 ARG CG . 17081 1 1106 . 1 1 90 90 ARG N N 15 117.014 0.3 . 1 . . . . 208 ARG N . 17081 1 1107 . 1 1 90 90 ARG NE N 15 83.251 0.3 . 1 . . . . 208 ARG NE . 17081 1 1108 . 1 1 91 91 VAL H H 1 8.240 0.020 . 1 . . . . 209 VAL H . 17081 1 1109 . 1 1 91 91 VAL HA H 1 3.750 0.020 . 1 . . . . 209 VAL HA . 17081 1 1110 . 1 1 91 91 VAL HB H 1 2.325 0.020 . 1 . . . . 209 VAL HB . 17081 1 1111 . 1 1 91 91 VAL HG11 H 1 1.338 0.020 . 2 . . . . 209 VAL HG1 . 17081 1 1112 . 1 1 91 91 VAL HG12 H 1 1.338 0.020 . 2 . . . . 209 VAL HG1 . 17081 1 1113 . 1 1 91 91 VAL HG13 H 1 1.338 0.020 . 2 . . . . 209 VAL HG1 . 17081 1 1114 . 1 1 91 91 VAL HG21 H 1 1.261 0.020 . 2 . . . . 209 VAL HG2 . 17081 1 1115 . 1 1 91 91 VAL HG22 H 1 1.261 0.020 . 2 . . . . 209 VAL HG2 . 17081 1 1116 . 1 1 91 91 VAL HG23 H 1 1.261 0.020 . 2 . . . . 209 VAL HG2 . 17081 1 1117 . 1 1 91 91 VAL C C 13 174.553 0.3 . 1 . . . . 209 VAL C . 17081 1 1118 . 1 1 91 91 VAL CA C 13 65.584 0.3 . 1 . . . . 209 VAL CA . 17081 1 1119 . 1 1 91 91 VAL CB C 13 31.901 0.3 . 1 . . . . 209 VAL CB . 17081 1 1120 . 1 1 91 91 VAL CG1 C 13 23.763 0.3 . 1 . . . . 209 VAL CG1 . 17081 1 1121 . 1 1 91 91 VAL CG2 C 13 20.615 0.3 . 1 . . . . 209 VAL CG2 . 17081 1 1122 . 1 1 91 91 VAL N N 15 119.379 0.3 . 1 . . . . 209 VAL N . 17081 1 1123 . 1 1 92 92 VAL H H 1 8.958 0.020 . 1 . . . . 210 VAL H . 17081 1 1124 . 1 1 92 92 VAL HA H 1 3.640 0.020 . 1 . . . . 210 VAL HA . 17081 1 1125 . 1 1 92 92 VAL HB H 1 2.276 0.020 . 1 . . . . 210 VAL HB . 17081 1 1126 . 1 1 92 92 VAL HG11 H 1 1.232 0.020 . 2 . . . . 210 VAL HG1 . 17081 1 1127 . 1 1 92 92 VAL HG12 H 1 1.232 0.020 . 2 . . . . 210 VAL HG1 . 17081 1 1128 . 1 1 92 92 VAL HG13 H 1 1.232 0.020 . 2 . . . . 210 VAL HG1 . 17081 1 1129 . 1 1 92 92 VAL HG21 H 1 0.979 0.020 . 2 . . . . 210 VAL HG2 . 17081 1 1130 . 1 1 92 92 VAL HG22 H 1 0.979 0.020 . 2 . . . . 210 VAL HG2 . 17081 1 1131 . 1 1 92 92 VAL HG23 H 1 0.979 0.020 . 2 . . . . 210 VAL HG2 . 17081 1 1132 . 1 1 92 92 VAL C C 13 174.847 0.3 . 1 . . . . 210 VAL C . 17081 1 1133 . 1 1 92 92 VAL CA C 13 66.159 0.3 . 1 . . . . 210 VAL CA . 17081 1 1134 . 1 1 92 92 VAL CB C 13 30.950 0.3 . 1 . . . . 210 VAL CB . 17081 1 1135 . 1 1 92 92 VAL CG1 C 13 24.107 0.3 . 1 . . . . 210 VAL CG1 . 17081 1 1136 . 1 1 92 92 VAL CG2 C 13 23.782 0.3 . 1 . . . . 210 VAL CG2 . 17081 1 1137 . 1 1 92 92 VAL N N 15 120.758 0.3 . 1 . . . . 210 VAL N . 17081 1 1138 . 1 1 93 93 GLU H H 1 8.226 0.020 . 1 . . . . 211 GLU H . 17081 1 1139 . 1 1 93 93 GLU HA H 1 3.625 0.020 . 1 . . . . 211 GLU HA . 17081 1 1140 . 1 1 93 93 GLU HB2 H 1 2.247 0.020 . 2 . . . . 211 GLU HB2 . 17081 1 1141 . 1 1 93 93 GLU HB3 H 1 2.144 0.020 . 2 . . . . 211 GLU HB3 . 17081 1 1142 . 1 1 93 93 GLU HG2 H 1 2.270 0.020 . 2 . . . . 211 GLU HG2 . 17081 1 1143 . 1 1 93 93 GLU HG3 H 1 2.204 0.020 . 2 . . . . 211 GLU HG3 . 17081 1 1144 . 1 1 93 93 GLU C C 13 174.973 0.3 . 1 . . . . 211 GLU C . 17081 1 1145 . 1 1 93 93 GLU CA C 13 60.692 0.3 . 1 . . . . 211 GLU CA . 17081 1 1146 . 1 1 93 93 GLU CB C 13 28.247 0.3 . 1 . . . . 211 GLU CB . 17081 1 1147 . 1 1 93 93 GLU CG C 13 35.093 0.3 . 1 . . . . 211 GLU CG . 17081 1 1148 . 1 1 93 93 GLU N N 15 120.307 0.3 . 1 . . . . 211 GLU N . 17081 1 1149 . 1 1 94 94 GLN H H 1 7.260 0.020 . 1 . . . . 212 GLN H . 17081 1 1150 . 1 1 94 94 GLN HA H 1 4.012 0.020 . 1 . . . . 212 GLN HA . 17081 1 1151 . 1 1 94 94 GLN HB2 H 1 2.147 0.020 . 2 . . . . 212 GLN HB2 . 17081 1 1152 . 1 1 94 94 GLN HB3 H 1 2.169 0.020 . 2 . . . . 212 GLN HB3 . 17081 1 1153 . 1 1 94 94 GLN HE21 H 1 7.450 0.020 . 1 . . . . 212 GLN HE21 . 17081 1 1154 . 1 1 94 94 GLN HE22 H 1 6.827 0.020 . 1 . . . . 212 GLN HE22 . 17081 1 1155 . 1 1 94 94 GLN HG2 H 1 2.479 0.020 . 2 . . . . 212 GLN HG2 . 17081 1 1156 . 1 1 94 94 GLN HG3 H 1 2.420 0.020 . 2 . . . . 212 GLN HG3 . 17081 1 1157 . 1 1 94 94 GLN C C 13 176.564 0.3 . 1 . . . . 212 GLN C . 17081 1 1158 . 1 1 94 94 GLN CA C 13 58.805 0.3 . 1 . . . . 212 GLN CA . 17081 1 1159 . 1 1 94 94 GLN CB C 13 27.570 0.3 . 1 . . . . 212 GLN CB . 17081 1 1160 . 1 1 94 94 GLN CG C 13 33.562 0.3 . 1 . . . . 212 GLN CG . 17081 1 1161 . 1 1 94 94 GLN N N 15 115.551 0.3 . 1 . . . . 212 GLN N . 17081 1 1162 . 1 1 94 94 GLN NE2 N 15 111.856 0.3 . 1 . . . . 212 GLN NE2 . 17081 1 1163 . 1 1 95 95 MET H H 1 8.313 0.020 . 1 . . . . 213 MET H . 17081 1 1164 . 1 1 95 95 MET HA H 1 4.169 0.020 . 1 . . . . 213 MET HA . 17081 1 1165 . 1 1 95 95 MET HB2 H 1 2.232 0.020 . 2 . . . . 213 MET HB2 . 17081 1 1166 . 1 1 95 95 MET HB3 H 1 2.073 0.020 . 2 . . . . 213 MET HB3 . 17081 1 1167 . 1 1 95 95 MET HE1 H 1 1.922 0.020 . 1 . . . . 213 MET HE . 17081 1 1168 . 1 1 95 95 MET HE2 H 1 1.922 0.020 . 1 . . . . 213 MET HE . 17081 1 1169 . 1 1 95 95 MET HE3 H 1 1.922 0.020 . 1 . . . . 213 MET HE . 17081 1 1170 . 1 1 95 95 MET HG2 H 1 2.867 0.020 . 2 . . . . 213 MET HG2 . 17081 1 1171 . 1 1 95 95 MET HG3 H 1 2.505 0.020 . 2 . . . . 213 MET HG3 . 17081 1 1172 . 1 1 95 95 MET C C 13 176.080 0.3 . 1 . . . . 213 MET C . 17081 1 1173 . 1 1 95 95 MET CA C 13 59.604 0.3 . 1 . . . . 213 MET CA . 17081 1 1174 . 1 1 95 95 MET CB C 13 34.059 0.3 . 1 . . . . 213 MET CB . 17081 1 1175 . 1 1 95 95 MET CE C 13 16.466 0.3 . 1 . . . . 213 MET CE . 17081 1 1176 . 1 1 95 95 MET CG C 13 32.207 0.3 . 1 . . . . 213 MET CG . 17081 1 1177 . 1 1 95 95 MET N N 15 119.365 0.3 . 1 . . . . 213 MET N . 17081 1 1178 . 1 1 96 96 CYS H H 1 9.236 0.020 . 1 . . . . 214 CYS H . 17081 1 1179 . 1 1 96 96 CYS HA H 1 4.469 0.020 . 1 . . . . 214 CYS HA . 17081 1 1180 . 1 1 96 96 CYS HB2 H 1 3.593 0.020 . 2 . . . . 214 CYS HB2 . 17081 1 1181 . 1 1 96 96 CYS HB3 H 1 2.951 0.020 . 2 . . . . 214 CYS HB3 . 17081 1 1182 . 1 1 96 96 CYS C C 13 174.311 0.3 . 1 . . . . 214 CYS C . 17081 1 1183 . 1 1 96 96 CYS CA C 13 59.376 0.3 . 1 . . . . 214 CYS CA . 17081 1 1184 . 1 1 96 96 CYS CB C 13 41.150 0.3 . 1 . . . . 214 CYS CB . 17081 1 1185 . 1 1 96 96 CYS N N 15 118.981 0.3 . 1 . . . . 214 CYS N . 17081 1 1186 . 1 1 97 97 VAL H H 1 8.356 0.020 . 1 . . . . 215 VAL H . 17081 1 1187 . 1 1 97 97 VAL HA H 1 3.530 0.020 . 1 . . . . 215 VAL HA . 17081 1 1188 . 1 1 97 97 VAL HB H 1 2.341 0.020 . 1 . . . . 215 VAL HB . 17081 1 1189 . 1 1 97 97 VAL HG11 H 1 1.141 0.020 . 2 . . . . 215 VAL HG1 . 17081 1 1190 . 1 1 97 97 VAL HG12 H 1 1.141 0.020 . 2 . . . . 215 VAL HG1 . 17081 1 1191 . 1 1 97 97 VAL HG13 H 1 1.141 0.020 . 2 . . . . 215 VAL HG1 . 17081 1 1192 . 1 1 97 97 VAL HG21 H 1 0.943 0.020 . 2 . . . . 215 VAL HG2 . 17081 1 1193 . 1 1 97 97 VAL HG22 H 1 0.943 0.020 . 2 . . . . 215 VAL HG2 . 17081 1 1194 . 1 1 97 97 VAL HG23 H 1 0.943 0.020 . 2 . . . . 215 VAL HG2 . 17081 1 1195 . 1 1 97 97 VAL C C 13 175.533 0.3 . 1 . . . . 215 VAL C . 17081 1 1196 . 1 1 97 97 VAL CA C 13 67.304 0.3 . 1 . . . . 215 VAL CA . 17081 1 1197 . 1 1 97 97 VAL CB C 13 31.174 0.3 . 1 . . . . 215 VAL CB . 17081 1 1198 . 1 1 97 97 VAL CG1 C 13 23.486 0.3 . 1 . . . . 215 VAL CG1 . 17081 1 1199 . 1 1 97 97 VAL CG2 C 13 20.935 0.3 . 1 . . . . 215 VAL CG2 . 17081 1 1200 . 1 1 97 97 VAL N N 15 123.536 0.3 . 1 . . . . 215 VAL N . 17081 1 1201 . 1 1 98 98 THR H H 1 8.102 0.020 . 1 . . . . 216 THR H . 17081 1 1202 . 1 1 98 98 THR HA H 1 3.914 0.020 . 1 . . . . 216 THR HA . 17081 1 1203 . 1 1 98 98 THR HB H 1 4.313 0.020 . 1 . . . . 216 THR HB . 17081 1 1204 . 1 1 98 98 THR HG21 H 1 1.261 0.020 . 1 . . . . 216 THR HG2 . 17081 1 1205 . 1 1 98 98 THR HG22 H 1 1.261 0.020 . 1 . . . . 216 THR HG2 . 17081 1 1206 . 1 1 98 98 THR HG23 H 1 1.261 0.020 . 1 . . . . 216 THR HG2 . 17081 1 1207 . 1 1 98 98 THR C C 13 174.158 0.3 . 1 . . . . 216 THR C . 17081 1 1208 . 1 1 98 98 THR CA C 13 66.581 0.3 . 1 . . . . 216 THR CA . 17081 1 1209 . 1 1 98 98 THR CB C 13 67.936 0.3 . 1 . . . . 216 THR CB . 17081 1 1210 . 1 1 98 98 THR CG2 C 13 21.928 0.3 . 1 . . . . 216 THR CG2 . 17081 1 1211 . 1 1 98 98 THR N N 15 118.412 0.3 . 1 . . . . 216 THR N . 17081 1 1212 . 1 1 99 99 GLN H H 1 8.875 0.020 . 1 . . . . 217 GLN H . 17081 1 1213 . 1 1 99 99 GLN HA H 1 3.636 0.020 . 1 . . . . 217 GLN HA . 17081 1 1214 . 1 1 99 99 GLN HB2 H 1 2.383 0.020 . 2 . . . . 217 GLN HB2 . 17081 1 1215 . 1 1 99 99 GLN HB3 H 1 2.136 0.020 . 2 . . . . 217 GLN HB3 . 17081 1 1216 . 1 1 99 99 GLN HE21 H 1 7.251 0.020 . 1 . . . . 217 GLN HE21 . 17081 1 1217 . 1 1 99 99 GLN HE22 H 1 6.961 0.020 . 1 . . . . 217 GLN HE22 . 17081 1 1218 . 1 1 99 99 GLN HG2 H 1 1.744 0.020 . 2 . . . . 217 GLN HG2 . 17081 1 1219 . 1 1 99 99 GLN HG3 H 1 1.682 0.020 . 2 . . . . 217 GLN HG3 . 17081 1 1220 . 1 1 99 99 GLN C C 13 174.845 0.3 . 1 . . . . 217 GLN C . 17081 1 1221 . 1 1 99 99 GLN CA C 13 58.171 0.3 . 1 . . . . 217 GLN CA . 17081 1 1222 . 1 1 99 99 GLN CB C 13 27.899 0.3 . 1 . . . . 217 GLN CB . 17081 1 1223 . 1 1 99 99 GLN CG C 13 32.305 0.3 . 1 . . . . 217 GLN CG . 17081 1 1224 . 1 1 99 99 GLN N N 15 122.484 0.3 . 1 . . . . 217 GLN N . 17081 1 1225 . 1 1 99 99 GLN NE2 N 15 115.048 0.3 . 1 . . . . 217 GLN NE2 . 17081 1 1226 . 1 1 100 100 TYR H H 1 8.620 0.020 . 1 . . . . 218 TYR H . 17081 1 1227 . 1 1 100 100 TYR HA H 1 2.850 0.020 . 1 . . . . 218 TYR HA . 17081 1 1228 . 1 1 100 100 TYR HB2 H 1 2.974 0.020 . 2 . . . . 218 TYR HB2 . 17081 1 1229 . 1 1 100 100 TYR HB3 H 1 2.802 0.020 . 2 . . . . 218 TYR HB3 . 17081 1 1230 . 1 1 100 100 TYR HD1 H 1 6.243 0.020 . 1 . . . . 218 TYR HD1 . 17081 1 1231 . 1 1 100 100 TYR HD2 H 1 6.243 0.020 . 1 . . . . 218 TYR HD2 . 17081 1 1232 . 1 1 100 100 TYR HE1 H 1 6.540 0.020 . 1 . . . . 218 TYR HE1 . 17081 1 1233 . 1 1 100 100 TYR HE2 H 1 6.540 0.020 . 1 . . . . 218 TYR HE2 . 17081 1 1234 . 1 1 100 100 TYR C C 13 175.227 0.3 . 1 . . . . 218 TYR C . 17081 1 1235 . 1 1 100 100 TYR CA C 13 61.415 0.3 . 1 . . . . 218 TYR CA . 17081 1 1236 . 1 1 100 100 TYR CB C 13 36.626 0.3 . 1 . . . . 218 TYR CB . 17081 1 1237 . 1 1 100 100 TYR CD1 C 13 132.130 0.3 . 1 . . . . 218 TYR CD1 . 17081 1 1238 . 1 1 100 100 TYR CE1 C 13 117.424 0.3 . 1 . . . . 218 TYR CE1 . 17081 1 1239 . 1 1 100 100 TYR N N 15 120.281 0.3 . 1 . . . . 218 TYR N . 17081 1 1240 . 1 1 101 101 GLN H H 1 8.143 0.020 . 1 . . . . 219 GLN H . 17081 1 1241 . 1 1 101 101 GLN HA H 1 3.630 0.020 . 1 . . . . 219 GLN HA . 17081 1 1242 . 1 1 101 101 GLN HB2 H 1 2.307 0.020 . 2 . . . . 219 GLN HB2 . 17081 1 1243 . 1 1 101 101 GLN HB3 H 1 2.069 0.020 . 2 . . . . 219 GLN HB3 . 17081 1 1244 . 1 1 101 101 GLN HE21 H 1 7.431 0.020 . 1 . . . . 219 GLN HE21 . 17081 1 1245 . 1 1 101 101 GLN HE22 H 1 6.847 0.020 . 1 . . . . 219 GLN HE22 . 17081 1 1246 . 1 1 101 101 GLN HG2 H 1 2.677 0.020 . 2 . . . . 219 GLN HG2 . 17081 1 1247 . 1 1 101 101 GLN HG3 H 1 2.474 0.020 . 2 . . . . 219 GLN HG3 . 17081 1 1248 . 1 1 101 101 GLN C C 13 175.826 0.3 . 1 . . . . 219 GLN C . 17081 1 1249 . 1 1 101 101 GLN CA C 13 58.676 0.3 . 1 . . . . 219 GLN CA . 17081 1 1250 . 1 1 101 101 GLN CB C 13 27.033 0.3 . 1 . . . . 219 GLN CB . 17081 1 1251 . 1 1 101 101 GLN CG C 13 33.351 0.3 . 1 . . . . 219 GLN CG . 17081 1 1252 . 1 1 101 101 GLN N N 15 119.551 0.3 . 1 . . . . 219 GLN N . 17081 1 1253 . 1 1 101 101 GLN NE2 N 15 111.036 0.3 . 1 . . . . 219 GLN NE2 . 17081 1 1254 . 1 1 102 102 LYS H H 1 7.666 0.020 . 1 . . . . 220 LYS H . 17081 1 1255 . 1 1 102 102 LYS HA H 1 3.989 0.020 . 1 . . . . 220 LYS HA . 17081 1 1256 . 1 1 102 102 LYS HB2 H 1 1.874 0.020 . 2 . . . . 220 LYS HB2 . 17081 1 1257 . 1 1 102 102 LYS HB3 H 1 1.837 0.020 . 2 . . . . 220 LYS HB3 . 17081 1 1258 . 1 1 102 102 LYS HD2 H 1 1.596 0.020 . 1 . . . . 220 LYS HD2 . 17081 1 1259 . 1 1 102 102 LYS HD3 H 1 1.596 0.020 . 1 . . . . 220 LYS HD3 . 17081 1 1260 . 1 1 102 102 LYS HE2 H 1 2.903 0.020 . 1 . . . . 220 LYS HE2 . 17081 1 1261 . 1 1 102 102 LYS HE3 H 1 2.903 0.020 . 1 . . . . 220 LYS HE3 . 17081 1 1262 . 1 1 102 102 LYS HG2 H 1 1.540 0.020 . 2 . . . . 220 LYS HG2 . 17081 1 1263 . 1 1 102 102 LYS HG3 H 1 1.366 0.020 . 2 . . . . 220 LYS HG3 . 17081 1 1264 . 1 1 102 102 LYS C C 13 177.023 0.3 . 1 . . . . 220 LYS C . 17081 1 1265 . 1 1 102 102 LYS CA C 13 58.909 0.3 . 1 . . . . 220 LYS CA . 17081 1 1266 . 1 1 102 102 LYS CB C 13 32.049 0.3 . 1 . . . . 220 LYS CB . 17081 1 1267 . 1 1 102 102 LYS CD C 13 29.039 0.3 . 1 . . . . 220 LYS CD . 17081 1 1268 . 1 1 102 102 LYS CE C 13 41.550 0.3 . 1 . . . . 220 LYS CE . 17081 1 1269 . 1 1 102 102 LYS CG C 13 24.481 0.3 . 1 . . . . 220 LYS CG . 17081 1 1270 . 1 1 102 102 LYS N N 15 118.667 0.3 . 1 . . . . 220 LYS N . 17081 1 1271 . 1 1 103 103 GLU H H 1 8.418 0.020 . 1 . . . . 221 GLU H . 17081 1 1272 . 1 1 103 103 GLU HA H 1 4.041 0.020 . 1 . . . . 221 GLU HA . 17081 1 1273 . 1 1 103 103 GLU HB2 H 1 2.198 0.020 . 2 . . . . 221 GLU HB2 . 17081 1 1274 . 1 1 103 103 GLU HB3 H 1 1.589 0.020 . 2 . . . . 221 GLU HB3 . 17081 1 1275 . 1 1 103 103 GLU HG2 H 1 2.132 0.020 . 2 . . . . 221 GLU HG2 . 17081 1 1276 . 1 1 103 103 GLU HG3 H 1 2.416 0.020 . 2 . . . . 221 GLU HG3 . 17081 1 1277 . 1 1 103 103 GLU C C 13 176.462 0.3 . 1 . . . . 221 GLU C . 17081 1 1278 . 1 1 103 103 GLU CA C 13 57.313 0.3 . 1 . . . . 221 GLU CA . 17081 1 1279 . 1 1 103 103 GLU CB C 13 29.073 0.3 . 1 . . . . 221 GLU CB . 17081 1 1280 . 1 1 103 103 GLU CG C 13 35.708 0.3 . 1 . . . . 221 GLU CG . 17081 1 1281 . 1 1 103 103 GLU N N 15 118.552 0.3 . 1 . . . . 221 GLU N . 17081 1 1282 . 1 1 104 104 SER H H 1 8.554 0.020 . 1 . . . . 222 SER H . 17081 1 1283 . 1 1 104 104 SER HA H 1 3.901 0.020 . 1 . . . . 222 SER HA . 17081 1 1284 . 1 1 104 104 SER HB2 H 1 3.413 0.020 . 2 . . . . 222 SER HB2 . 17081 1 1285 . 1 1 104 104 SER HB3 H 1 3.257 0.020 . 2 . . . . 222 SER HB3 . 17081 1 1286 . 1 1 104 104 SER C C 13 173.343 0.3 . 1 . . . . 222 SER C . 17081 1 1287 . 1 1 104 104 SER CA C 13 60.767 0.3 . 1 . . . . 222 SER CA . 17081 1 1288 . 1 1 104 104 SER CB C 13 61.996 0.3 . 1 . . . . 222 SER CB . 17081 1 1289 . 1 1 104 104 SER N N 15 115.407 0.3 . 1 . . . . 222 SER N . 17081 1 1290 . 1 1 105 105 GLN H H 1 7.563 0.020 . 1 . . . . 223 GLN H . 17081 1 1291 . 1 1 105 105 GLN HA H 1 4.083 0.020 . 1 . . . . 223 GLN HA . 17081 1 1292 . 1 1 105 105 GLN HB2 H 1 2.080 0.020 . 2 . . . . 223 GLN HB2 . 17081 1 1293 . 1 1 105 105 GLN HB3 H 1 2.148 0.020 . 2 . . . . 223 GLN HB3 . 17081 1 1294 . 1 1 105 105 GLN HE21 H 1 7.683 0.020 . 1 . . . . 223 GLN HE21 . 17081 1 1295 . 1 1 105 105 GLN HE22 H 1 6.837 0.020 . 1 . . . . 223 GLN HE22 . 17081 1 1296 . 1 1 105 105 GLN HG2 H 1 2.468 0.020 . 2 . . . . 223 GLN HG2 . 17081 1 1297 . 1 1 105 105 GLN HG3 H 1 2.383 0.020 . 2 . . . . 223 GLN HG3 . 17081 1 1298 . 1 1 105 105 GLN C C 13 174.858 0.3 . 1 . . . . 223 GLN C . 17081 1 1299 . 1 1 105 105 GLN CA C 13 57.999 0.3 . 1 . . . . 223 GLN CA . 17081 1 1300 . 1 1 105 105 GLN CB C 13 27.897 0.3 . 1 . . . . 223 GLN CB . 17081 1 1301 . 1 1 105 105 GLN CG C 13 33.384 0.3 . 1 . . . . 223 GLN CG . 17081 1 1302 . 1 1 105 105 GLN N N 15 120.765 0.3 . 1 . . . . 223 GLN N . 17081 1 1303 . 1 1 105 105 GLN NE2 N 15 113.161 0.3 . 1 . . . . 223 GLN NE2 . 17081 1 1304 . 1 1 106 106 ALA H H 1 7.572 0.020 . 1 . . . . 224 ALA H . 17081 1 1305 . 1 1 106 106 ALA HA H 1 4.177 0.020 . 1 . . . . 224 ALA HA . 17081 1 1306 . 1 1 106 106 ALA HB1 H 1 1.436 0.020 . 1 . . . . 224 ALA HB . 17081 1 1307 . 1 1 106 106 ALA HB2 H 1 1.436 0.020 . 1 . . . . 224 ALA HB . 17081 1 1308 . 1 1 106 106 ALA HB3 H 1 1.436 0.020 . 1 . . . . 224 ALA HB . 17081 1 1309 . 1 1 106 106 ALA C C 13 176.742 0.3 . 1 . . . . 224 ALA C . 17081 1 1310 . 1 1 106 106 ALA CA C 13 53.973 0.3 . 1 . . . . 224 ALA CA . 17081 1 1311 . 1 1 106 106 ALA CB C 13 17.858 0.3 . 1 . . . . 224 ALA CB . 17081 1 1312 . 1 1 106 106 ALA N N 15 120.241 0.3 . 1 . . . . 224 ALA N . 17081 1 1313 . 1 1 107 107 TYR H H 1 7.933 0.020 . 1 . . . . 225 TYR H . 17081 1 1314 . 1 1 107 107 TYR HA H 1 4.180 0.020 . 1 . . . . 225 TYR HA . 17081 1 1315 . 1 1 107 107 TYR HB2 H 1 2.969 0.020 . 2 . . . . 225 TYR HB2 . 17081 1 1316 . 1 1 107 107 TYR HB3 H 1 2.847 0.020 . 2 . . . . 225 TYR HB3 . 17081 1 1317 . 1 1 107 107 TYR HD1 H 1 6.641 0.020 . 1 . . . . 225 TYR HD1 . 17081 1 1318 . 1 1 107 107 TYR HD2 H 1 6.641 0.020 . 1 . . . . 225 TYR HD2 . 17081 1 1319 . 1 1 107 107 TYR HE1 H 1 6.626 0.020 . 1 . . . . 225 TYR HE1 . 17081 1 1320 . 1 1 107 107 TYR HE2 H 1 6.626 0.020 . 1 . . . . 225 TYR HE2 . 17081 1 1321 . 1 1 107 107 TYR C C 13 174.985 0.3 . 1 . . . . 225 TYR C . 17081 1 1322 . 1 1 107 107 TYR CA C 13 59.959 0.3 . 1 . . . . 225 TYR CA . 17081 1 1323 . 1 1 107 107 TYR CB C 13 38.123 0.3 . 1 . . . . 225 TYR CB . 17081 1 1324 . 1 1 107 107 TYR CD1 C 13 132.911 0.3 . 1 . . . . 225 TYR CD1 . 17081 1 1325 . 1 1 107 107 TYR CE1 C 13 117.241 0.3 . 1 . . . . 225 TYR CE1 . 17081 1 1326 . 1 1 107 107 TYR N N 15 119.547 0.3 . 1 . . . . 225 TYR N . 17081 1 1327 . 1 1 108 108 TYR H H 1 8.094 0.020 . 1 . . . . 226 TYR H . 17081 1 1328 . 1 1 108 108 TYR HA H 1 4.168 0.020 . 1 . . . . 226 TYR HA . 17081 1 1329 . 1 1 108 108 TYR HB2 H 1 3.146 0.020 . 2 . . . . 226 TYR HB2 . 17081 1 1330 . 1 1 108 108 TYR HB3 H 1 2.956 0.020 . 2 . . . . 226 TYR HB3 . 17081 1 1331 . 1 1 108 108 TYR HD1 H 1 7.234 0.020 . 1 . . . . 226 TYR HD1 . 17081 1 1332 . 1 1 108 108 TYR HD2 H 1 7.234 0.020 . 1 . . . . 226 TYR HD2 . 17081 1 1333 . 1 1 108 108 TYR HE1 H 1 6.876 0.020 . 1 . . . . 226 TYR HE1 . 17081 1 1334 . 1 1 108 108 TYR HE2 H 1 6.876 0.020 . 1 . . . . 226 TYR HE2 . 17081 1 1335 . 1 1 108 108 TYR C C 13 174.731 0.3 . 1 . . . . 226 TYR C . 17081 1 1336 . 1 1 108 108 TYR CA C 13 59.977 0.3 . 1 . . . . 226 TYR CA . 17081 1 1337 . 1 1 108 108 TYR CB C 13 37.637 0.3 . 1 . . . . 226 TYR CB . 17081 1 1338 . 1 1 108 108 TYR CD1 C 13 133.087 0.3 . 1 . . . . 226 TYR CD1 . 17081 1 1339 . 1 1 108 108 TYR CE1 C 13 117.864 0.3 . 1 . . . . 226 TYR CE1 . 17081 1 1340 . 1 1 108 108 TYR N N 15 119.174 0.3 . 1 . . . . 226 TYR N . 17081 1 1341 . 1 1 109 109 ASP H H 1 8.321 0.020 . 1 . . . . 227 ASP H . 17081 1 1342 . 1 1 109 109 ASP HA H 1 4.519 0.020 . 1 . . . . 227 ASP HA . 17081 1 1343 . 1 1 109 109 ASP HB2 H 1 2.777 0.020 . 2 . . . . 227 ASP HB2 . 17081 1 1344 . 1 1 109 109 ASP HB3 H 1 2.758 0.020 . 2 . . . . 227 ASP HB3 . 17081 1 1345 . 1 1 109 109 ASP C C 13 174.680 0.3 . 1 . . . . 227 ASP C . 17081 1 1346 . 1 1 109 109 ASP CA C 13 54.911 0.3 . 1 . . . . 227 ASP CA . 17081 1 1347 . 1 1 109 109 ASP CB C 13 39.870 0.3 . 1 . . . . 227 ASP CB . 17081 1 1348 . 1 1 109 109 ASP N N 15 120.337 0.3 . 1 . . . . 227 ASP N . 17081 1 1349 . 1 1 110 110 GLY H H 1 7.848 0.020 . 1 . . . . 228 GLY H . 17081 1 1350 . 1 1 110 110 GLY HA2 H 1 3.922 0.020 . 1 . . . . 228 GLY HA2 . 17081 1 1351 . 1 1 110 110 GLY HA3 H 1 3.922 0.020 . 1 . . . . 228 GLY HA3 . 17081 1 1352 . 1 1 110 110 GLY C C 13 171.904 0.3 . 1 . . . . 228 GLY C . 17081 1 1353 . 1 1 110 110 GLY CA C 13 45.273 0.3 . 1 . . . . 228 GLY CA . 17081 1 1354 . 1 1 110 110 GLY N N 15 107.709 0.3 . 1 . . . . 228 GLY N . 17081 1 1355 . 1 1 111 111 ARG H H 1 7.777 0.020 . 1 . . . . 229 ARG H . 17081 1 1356 . 1 1 111 111 ARG HA H 1 4.305 0.020 . 1 . . . . 229 ARG HA . 17081 1 1357 . 1 1 111 111 ARG HB2 H 1 1.705 0.020 . 2 . . . . 229 ARG HB2 . 17081 1 1358 . 1 1 111 111 ARG HB3 H 1 1.847 0.020 . 2 . . . . 229 ARG HB3 . 17081 1 1359 . 1 1 111 111 ARG HD2 H 1 3.027 0.020 . 1 . . . . 229 ARG HD2 . 17081 1 1360 . 1 1 111 111 ARG HD3 H 1 3.027 0.020 . 1 . . . . 229 ARG HD3 . 17081 1 1361 . 1 1 111 111 ARG HE H 1 7.206 0.020 . 1 . . . . 229 ARG HE . 17081 1 1362 . 1 1 111 111 ARG HG2 H 1 1.534 0.020 . 1 . . . . 229 ARG HG2 . 17081 1 1363 . 1 1 111 111 ARG HG3 H 1 1.534 0.020 . 1 . . . . 229 ARG HG3 . 17081 1 1364 . 1 1 111 111 ARG C C 13 173.658 0.3 . 1 . . . . 229 ARG C . 17081 1 1365 . 1 1 111 111 ARG CA C 13 55.615 0.3 . 1 . . . . 229 ARG CA . 17081 1 1366 . 1 1 111 111 ARG CB C 13 30.150 0.3 . 1 . . . . 229 ARG CB . 17081 1 1367 . 1 1 111 111 ARG CD C 13 42.820 0.3 . 1 . . . . 229 ARG CD . 17081 1 1368 . 1 1 111 111 ARG CG C 13 26.482 0.3 . 1 . . . . 229 ARG CG . 17081 1 1369 . 1 1 111 111 ARG N N 15 119.807 0.3 . 1 . . . . 229 ARG N . 17081 1 1370 . 1 1 111 111 ARG NE N 15 84.518 0.3 . 1 . . . . 229 ARG NE . 17081 1 1371 . 1 1 112 112 ARG H H 1 8.177 0.020 . 1 . . . . 230 ARG H . 17081 1 1372 . 1 1 112 112 ARG HA H 1 4.398 0.020 . 1 . . . . 230 ARG HA . 17081 1 1373 . 1 1 112 112 ARG HB2 H 1 1.793 0.020 . 2 . . . . 230 ARG HB2 . 17081 1 1374 . 1 1 112 112 ARG HB3 H 1 1.903 0.020 . 2 . . . . 230 ARG HB3 . 17081 1 1375 . 1 1 112 112 ARG HD2 H 1 3.181 0.020 . 1 . . . . 230 ARG HD2 . 17081 1 1376 . 1 1 112 112 ARG HD3 H 1 3.181 0.020 . 1 . . . . 230 ARG HD3 . 17081 1 1377 . 1 1 112 112 ARG HE H 1 7.225 0.020 . 1 . . . . 230 ARG HE . 17081 1 1378 . 1 1 112 112 ARG HG2 H 1 1.666 0.020 . 2 . . . . 230 ARG HG2 . 17081 1 1379 . 1 1 112 112 ARG HG3 H 1 1.620 0.020 . 2 . . . . 230 ARG HG3 . 17081 1 1380 . 1 1 112 112 ARG C C 13 173.671 0.3 . 1 . . . . 230 ARG C . 17081 1 1381 . 1 1 112 112 ARG CA C 13 55.645 0.3 . 1 . . . . 230 ARG CA . 17081 1 1382 . 1 1 112 112 ARG CB C 13 30.550 0.3 . 1 . . . . 230 ARG CB . 17081 1 1383 . 1 1 112 112 ARG CD C 13 42.855 0.3 . 1 . . . . 230 ARG CD . 17081 1 1384 . 1 1 112 112 ARG CG C 13 26.648 0.3 . 1 . . . . 230 ARG CG . 17081 1 1385 . 1 1 112 112 ARG N N 15 121.709 0.3 . 1 . . . . 230 ARG N . 17081 1 1386 . 1 1 112 112 ARG NE N 15 84.658 0.3 . 1 . . . . 230 ARG NE . 17081 1 1387 . 1 1 113 113 SER H H 1 8.418 0.020 . 1 . . . . 231 SER H . 17081 1 1388 . 1 1 113 113 SER HA H 1 4.516 0.020 . 1 . . . . 231 SER HA . 17081 1 1389 . 1 1 113 113 SER HB2 H 1 3.924 0.020 . 2 . . . . 231 SER HB2 . 17081 1 1390 . 1 1 113 113 SER HB3 H 1 3.888 0.020 . 2 . . . . 231 SER HB3 . 17081 1 1391 . 1 1 113 113 SER C C 13 171.043 0.3 . 1 . . . . 231 SER C . 17081 1 1392 . 1 1 113 113 SER CA C 13 57.894 0.3 . 1 . . . . 231 SER CA . 17081 1 1393 . 1 1 113 113 SER CB C 13 63.602 0.3 . 1 . . . . 231 SER CB . 17081 1 1394 . 1 1 113 113 SER N N 15 117.380 0.3 . 1 . . . . 231 SER N . 17081 1 1395 . 1 1 114 114 SER H H 1 8.033 0.020 . 1 . . . . 232 SER H . 17081 1 1396 . 1 1 114 114 SER HA H 1 4.296 0.020 . 1 . . . . 232 SER HA . 17081 1 1397 . 1 1 114 114 SER HB2 H 1 3.879 0.020 . 1 . . . . 232 SER HB2 . 17081 1 1398 . 1 1 114 114 SER HB3 H 1 3.879 0.020 . 1 . . . . 232 SER HB3 . 17081 1 1399 . 1 1 114 114 SER C C 13 175.913 0.3 . 1 . . . . 232 SER C . 17081 1 1400 . 1 1 114 114 SER CA C 13 59.533 0.3 . 1 . . . . 232 SER CA . 17081 1 1401 . 1 1 114 114 SER CB C 13 64.334 0.3 . 1 . . . . 232 SER CB . 17081 1 1402 . 1 1 114 114 SER N N 15 122.802 0.3 . 1 . . . . 232 SER N . 17081 1 stop_ save_