data_19490 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19490 _Entry.Title ; Human cytosolic dNT-1 nucleotidase ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-09-11 _Entry.Accession_date 2013-09-11 _Entry.Last_release_date 2014-02-12 _Entry.Original_release_date 2014-02-12 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Ales Hnizda . . . 19490 2 Radka Sklenickova . . . 19490 3 Petr Pachl . . . 19490 4 Milan Fabry . . . 19490 5 Zdenek Tosner . . . 19490 6 Pavlina Rezacova . . . 19490 7 Jiri Brynda . . . 19490 8 Vaclav Veverka . . . 19490 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19490 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 565 19490 '15N chemical shifts' 188 19490 '1H chemical shifts' 188 19490 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 . . 2014-02-12 2013-09-11 original author . 19490 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19490 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24234349 _Citation.Full_citation . _Citation.Title 'Backbone resonance assignments of human cytosolic dNT-1 nucleotidase.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Ale Hnizda . . . 19490 1 2 Radka Sklenikova . . . 19490 1 3 Petr Pachl . . . 19490 1 4 Milan Fabry . . . 19490 1 5 Zdenk Toner . . . 19490 1 6 Jii Brynda . . . 19490 1 7 Vaclav Veverka . . . 19490 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19490 _Assembly.ID 1 _Assembly.Name 'cdN dimer' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _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 'cdN, chain 1' 1 $cdN A . yes native no no . . . 19490 1 2 'cdN, chain 2' 1 $cdN B . no native no no . . . 19490 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_cdN _Entity.Sf_category entity _Entity.Sf_framecode cdN _Entity.Entry_ID 19490 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name cdN _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SNAASARSVRVLVDMDGVLA DFEAGLLRGFRRRFPEEPHV PLEQRRGFLAREQYRALRPD LADKVASVYEAPGFFLDLEP IPGALDAVREMNDLPDTQVF ICTSPLLKYHHCVGEKYRWV EQHLGPQFVERIILTRDKTV VLGDLLIDDKDTVRGQEETP SWEHILFTCCHNRHLVLPPT RRRLLSWSDNWREILDSKRG AAQRE ; _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 205 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2I7D . "Structure Of Human Cytosolic Deoxyribonucleotidase In Complex With Deoxyuridine, Alf4 And Mg2+" . . . . . 94.15 193 100.00 100.00 1.83e-137 . . . . 19490 1 2 no PDB 4L57 . "High Resolutin Structure Of Human Cytosolic 5'(3')- Deoxyribonucleotidase" . . . . . 94.63 195 100.00 100.00 2.68e-138 . . . . 19490 1 3 no PDB 4YIH . "Crystal Structure Of Human Cytosolic 5'(3')-deoxyribonucleotidase In Complex With The Inhibitor Pb-pvu" . . . . . 94.63 195 100.00 100.00 2.68e-138 . . . . 19490 1 4 no DBJ BAA91151 . "unnamed protein product [Homo sapiens]" . . . . . 97.56 201 100.00 100.00 8.02e-143 . . . . 19490 1 5 no GB AAF36534 . "deoxy-5'-nucleotidase [Homo sapiens]" . . . . . 97.56 201 100.00 100.00 8.02e-143 . . . . 19490 1 6 no GB AAH17454 . "5', 3'-nucleotidase, cytosolic [Homo sapiens]" . . . . . 97.56 201 100.00 100.00 8.02e-143 . . . . 19490 1 7 no GB AAH22334 . "5', 3'-nucleotidase, cytosolic [Homo sapiens]" . . . . . 97.56 201 99.50 99.50 1.59e-141 . . . . 19490 1 8 no GB ACJ13694 . "epididymis luminal protein 74 [Homo sapiens]" . . . . . 97.56 201 100.00 100.00 8.02e-143 . . . . 19490 1 9 no GB ADQ32487 . "5', 3'-nucleotidase, cytosolic [synthetic construct]" . . . . . 97.56 201 100.00 100.00 8.02e-143 . . . . 19490 1 10 no REF NP_055410 . "5'(3')-deoxyribonucleotidase, cytosolic type isoform 1 [Homo sapiens]" . . . . . 97.56 201 100.00 100.00 8.02e-143 . . . . 19490 1 11 no REF XP_001139013 . "PREDICTED: 5'(3')-deoxyribonucleotidase, cytosolic type [Pan troglodytes]" . . . . . 97.56 201 99.00 100.00 1.97e-142 . . . . 19490 1 12 no REF XP_002827866 . "PREDICTED: 5'(3')-deoxyribonucleotidase, cytosolic type isoform X1 [Pongo abelii]" . . . . . 100.00 245 97.07 98.05 3.56e-142 . . . . 19490 1 13 no REF XP_003279118 . "PREDICTED: 5'(3')-deoxyribonucleotidase, cytosolic type isoform X1 [Nomascus leucogenys]" . . . . . 99.02 245 97.54 99.01 1.29e-141 . . . . 19490 1 14 no REF XP_004041011 . "PREDICTED: 5'(3')-deoxyribonucleotidase, cytosolic type isoform 1 [Gorilla gorilla gorilla]" . . . . . 97.56 201 99.00 100.00 3.40e-142 . . . . 19490 1 15 no SP Q8TCD5 . "RecName: Full=5'(3')-deoxyribonucleotidase, cytosolic type; AltName: Full=Cytosolic 5',3'-pyrimidine nucleotidase; AltName: Ful" . . . . . 97.56 201 100.00 100.00 8.02e-143 . . . . 19490 1 16 no TPG DAA00070 . "TPA_exp: cytosolic 5'(3')-deoxyribonucleotidase [Homo sapiens]" . . . . . 97.56 201 100.00 100.00 8.02e-143 . . . . 19490 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 . SER . 19490 1 2 . ASN . 19490 1 3 . ALA . 19490 1 4 . ALA . 19490 1 5 . SER . 19490 1 6 . ALA . 19490 1 7 . ARG . 19490 1 8 . SER . 19490 1 9 . VAL . 19490 1 10 . ARG . 19490 1 11 . VAL . 19490 1 12 . LEU . 19490 1 13 . VAL . 19490 1 14 . ASP . 19490 1 15 . MET . 19490 1 16 . ASP . 19490 1 17 . GLY . 19490 1 18 . VAL . 19490 1 19 . LEU . 19490 1 20 . ALA . 19490 1 21 . ASP . 19490 1 22 . PHE . 19490 1 23 . GLU . 19490 1 24 . ALA . 19490 1 25 . GLY . 19490 1 26 . LEU . 19490 1 27 . LEU . 19490 1 28 . ARG . 19490 1 29 . GLY . 19490 1 30 . PHE . 19490 1 31 . ARG . 19490 1 32 . ARG . 19490 1 33 . ARG . 19490 1 34 . PHE . 19490 1 35 . PRO . 19490 1 36 . GLU . 19490 1 37 . GLU . 19490 1 38 . PRO . 19490 1 39 . HIS . 19490 1 40 . VAL . 19490 1 41 . PRO . 19490 1 42 . LEU . 19490 1 43 . GLU . 19490 1 44 . GLN . 19490 1 45 . ARG . 19490 1 46 . ARG . 19490 1 47 . GLY . 19490 1 48 . PHE . 19490 1 49 . LEU . 19490 1 50 . ALA . 19490 1 51 . ARG . 19490 1 52 . GLU . 19490 1 53 . GLN . 19490 1 54 . TYR . 19490 1 55 . ARG . 19490 1 56 . ALA . 19490 1 57 . LEU . 19490 1 58 . ARG . 19490 1 59 . PRO . 19490 1 60 . ASP . 19490 1 61 . LEU . 19490 1 62 . ALA . 19490 1 63 . ASP . 19490 1 64 . LYS . 19490 1 65 . VAL . 19490 1 66 . ALA . 19490 1 67 . SER . 19490 1 68 . VAL . 19490 1 69 . TYR . 19490 1 70 . GLU . 19490 1 71 . ALA . 19490 1 72 . PRO . 19490 1 73 . GLY . 19490 1 74 . PHE . 19490 1 75 . PHE . 19490 1 76 . LEU . 19490 1 77 . ASP . 19490 1 78 . LEU . 19490 1 79 . GLU . 19490 1 80 . PRO . 19490 1 81 . ILE . 19490 1 82 . PRO . 19490 1 83 . GLY . 19490 1 84 . ALA . 19490 1 85 . LEU . 19490 1 86 . ASP . 19490 1 87 . ALA . 19490 1 88 . VAL . 19490 1 89 . ARG . 19490 1 90 . GLU . 19490 1 91 . MET . 19490 1 92 . ASN . 19490 1 93 . ASP . 19490 1 94 . LEU . 19490 1 95 . PRO . 19490 1 96 . ASP . 19490 1 97 . THR . 19490 1 98 . GLN . 19490 1 99 . VAL . 19490 1 100 . PHE . 19490 1 101 . ILE . 19490 1 102 . CYS . 19490 1 103 . THR . 19490 1 104 . SER . 19490 1 105 . PRO . 19490 1 106 . LEU . 19490 1 107 . LEU . 19490 1 108 . LYS . 19490 1 109 . TYR . 19490 1 110 . HIS . 19490 1 111 . HIS . 19490 1 112 . CYS . 19490 1 113 . VAL . 19490 1 114 . GLY . 19490 1 115 . GLU . 19490 1 116 . LYS . 19490 1 117 . TYR . 19490 1 118 . ARG . 19490 1 119 . TRP . 19490 1 120 . VAL . 19490 1 121 . GLU . 19490 1 122 . GLN . 19490 1 123 . HIS . 19490 1 124 . LEU . 19490 1 125 . GLY . 19490 1 126 . PRO . 19490 1 127 . GLN . 19490 1 128 . PHE . 19490 1 129 . VAL . 19490 1 130 . GLU . 19490 1 131 . ARG . 19490 1 132 . ILE . 19490 1 133 . ILE . 19490 1 134 . LEU . 19490 1 135 . THR . 19490 1 136 . ARG . 19490 1 137 . ASP . 19490 1 138 . LYS . 19490 1 139 . THR . 19490 1 140 . VAL . 19490 1 141 . VAL . 19490 1 142 . LEU . 19490 1 143 . GLY . 19490 1 144 . ASP . 19490 1 145 . LEU . 19490 1 146 . LEU . 19490 1 147 . ILE . 19490 1 148 . ASP . 19490 1 149 . ASP . 19490 1 150 . LYS . 19490 1 151 . ASP . 19490 1 152 . THR . 19490 1 153 . VAL . 19490 1 154 . ARG . 19490 1 155 . GLY . 19490 1 156 . GLN . 19490 1 157 . GLU . 19490 1 158 . GLU . 19490 1 159 . THR . 19490 1 160 . PRO . 19490 1 161 . SER . 19490 1 162 . TRP . 19490 1 163 . GLU . 19490 1 164 . HIS . 19490 1 165 . ILE . 19490 1 166 . LEU . 19490 1 167 . PHE . 19490 1 168 . THR . 19490 1 169 . CYS . 19490 1 170 . CYS . 19490 1 171 . HIS . 19490 1 172 . ASN . 19490 1 173 . ARG . 19490 1 174 . HIS . 19490 1 175 . LEU . 19490 1 176 . VAL . 19490 1 177 . LEU . 19490 1 178 . PRO . 19490 1 179 . PRO . 19490 1 180 . THR . 19490 1 181 . ARG . 19490 1 182 . ARG . 19490 1 183 . ARG . 19490 1 184 . LEU . 19490 1 185 . LEU . 19490 1 186 . SER . 19490 1 187 . TRP . 19490 1 188 . SER . 19490 1 189 . ASP . 19490 1 190 . ASN . 19490 1 191 . TRP . 19490 1 192 . ARG . 19490 1 193 . GLU . 19490 1 194 . ILE . 19490 1 195 . LEU . 19490 1 196 . ASP . 19490 1 197 . SER . 19490 1 198 . LYS . 19490 1 199 . ARG . 19490 1 200 . GLY . 19490 1 201 . ALA . 19490 1 202 . ALA . 19490 1 203 . GLN . 19490 1 204 . ARG . 19490 1 205 . GLU . 19490 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 . SER 1 1 19490 1 . ASN 2 2 19490 1 . ALA 3 3 19490 1 . ALA 4 4 19490 1 . SER 5 5 19490 1 . ALA 6 6 19490 1 . ARG 7 7 19490 1 . SER 8 8 19490 1 . VAL 9 9 19490 1 . ARG 10 10 19490 1 . VAL 11 11 19490 1 . LEU 12 12 19490 1 . VAL 13 13 19490 1 . ASP 14 14 19490 1 . MET 15 15 19490 1 . ASP 16 16 19490 1 . GLY 17 17 19490 1 . VAL 18 18 19490 1 . LEU 19 19 19490 1 . ALA 20 20 19490 1 . ASP 21 21 19490 1 . PHE 22 22 19490 1 . GLU 23 23 19490 1 . ALA 24 24 19490 1 . GLY 25 25 19490 1 . LEU 26 26 19490 1 . LEU 27 27 19490 1 . ARG 28 28 19490 1 . GLY 29 29 19490 1 . PHE 30 30 19490 1 . ARG 31 31 19490 1 . ARG 32 32 19490 1 . ARG 33 33 19490 1 . PHE 34 34 19490 1 . PRO 35 35 19490 1 . GLU 36 36 19490 1 . GLU 37 37 19490 1 . PRO 38 38 19490 1 . HIS 39 39 19490 1 . VAL 40 40 19490 1 . PRO 41 41 19490 1 . LEU 42 42 19490 1 . GLU 43 43 19490 1 . GLN 44 44 19490 1 . ARG 45 45 19490 1 . ARG 46 46 19490 1 . GLY 47 47 19490 1 . PHE 48 48 19490 1 . LEU 49 49 19490 1 . ALA 50 50 19490 1 . ARG 51 51 19490 1 . GLU 52 52 19490 1 . GLN 53 53 19490 1 . TYR 54 54 19490 1 . ARG 55 55 19490 1 . ALA 56 56 19490 1 . LEU 57 57 19490 1 . ARG 58 58 19490 1 . PRO 59 59 19490 1 . ASP 60 60 19490 1 . LEU 61 61 19490 1 . ALA 62 62 19490 1 . ASP 63 63 19490 1 . LYS 64 64 19490 1 . VAL 65 65 19490 1 . ALA 66 66 19490 1 . SER 67 67 19490 1 . VAL 68 68 19490 1 . TYR 69 69 19490 1 . GLU 70 70 19490 1 . ALA 71 71 19490 1 . PRO 72 72 19490 1 . GLY 73 73 19490 1 . PHE 74 74 19490 1 . PHE 75 75 19490 1 . LEU 76 76 19490 1 . ASP 77 77 19490 1 . LEU 78 78 19490 1 . GLU 79 79 19490 1 . PRO 80 80 19490 1 . ILE 81 81 19490 1 . PRO 82 82 19490 1 . GLY 83 83 19490 1 . ALA 84 84 19490 1 . LEU 85 85 19490 1 . ASP 86 86 19490 1 . ALA 87 87 19490 1 . VAL 88 88 19490 1 . ARG 89 89 19490 1 . GLU 90 90 19490 1 . MET 91 91 19490 1 . ASN 92 92 19490 1 . ASP 93 93 19490 1 . LEU 94 94 19490 1 . PRO 95 95 19490 1 . ASP 96 96 19490 1 . THR 97 97 19490 1 . GLN 98 98 19490 1 . VAL 99 99 19490 1 . PHE 100 100 19490 1 . ILE 101 101 19490 1 . CYS 102 102 19490 1 . THR 103 103 19490 1 . SER 104 104 19490 1 . PRO 105 105 19490 1 . LEU 106 106 19490 1 . LEU 107 107 19490 1 . LYS 108 108 19490 1 . TYR 109 109 19490 1 . HIS 110 110 19490 1 . HIS 111 111 19490 1 . CYS 112 112 19490 1 . VAL 113 113 19490 1 . GLY 114 114 19490 1 . GLU 115 115 19490 1 . LYS 116 116 19490 1 . TYR 117 117 19490 1 . ARG 118 118 19490 1 . TRP 119 119 19490 1 . VAL 120 120 19490 1 . GLU 121 121 19490 1 . GLN 122 122 19490 1 . HIS 123 123 19490 1 . LEU 124 124 19490 1 . GLY 125 125 19490 1 . PRO 126 126 19490 1 . GLN 127 127 19490 1 . PHE 128 128 19490 1 . VAL 129 129 19490 1 . GLU 130 130 19490 1 . ARG 131 131 19490 1 . ILE 132 132 19490 1 . ILE 133 133 19490 1 . LEU 134 134 19490 1 . THR 135 135 19490 1 . ARG 136 136 19490 1 . ASP 137 137 19490 1 . LYS 138 138 19490 1 . THR 139 139 19490 1 . VAL 140 140 19490 1 . VAL 141 141 19490 1 . LEU 142 142 19490 1 . GLY 143 143 19490 1 . ASP 144 144 19490 1 . LEU 145 145 19490 1 . LEU 146 146 19490 1 . ILE 147 147 19490 1 . ASP 148 148 19490 1 . ASP 149 149 19490 1 . LYS 150 150 19490 1 . ASP 151 151 19490 1 . THR 152 152 19490 1 . VAL 153 153 19490 1 . ARG 154 154 19490 1 . GLY 155 155 19490 1 . GLN 156 156 19490 1 . GLU 157 157 19490 1 . GLU 158 158 19490 1 . THR 159 159 19490 1 . PRO 160 160 19490 1 . SER 161 161 19490 1 . TRP 162 162 19490 1 . GLU 163 163 19490 1 . HIS 164 164 19490 1 . ILE 165 165 19490 1 . LEU 166 166 19490 1 . PHE 167 167 19490 1 . THR 168 168 19490 1 . CYS 169 169 19490 1 . CYS 170 170 19490 1 . HIS 171 171 19490 1 . ASN 172 172 19490 1 . ARG 173 173 19490 1 . HIS 174 174 19490 1 . LEU 175 175 19490 1 . VAL 176 176 19490 1 . LEU 177 177 19490 1 . PRO 178 178 19490 1 . PRO 179 179 19490 1 . THR 180 180 19490 1 . ARG 181 181 19490 1 . ARG 182 182 19490 1 . ARG 183 183 19490 1 . LEU 184 184 19490 1 . LEU 185 185 19490 1 . SER 186 186 19490 1 . TRP 187 187 19490 1 . SER 188 188 19490 1 . ASP 189 189 19490 1 . ASN 190 190 19490 1 . TRP 191 191 19490 1 . ARG 192 192 19490 1 . GLU 193 193 19490 1 . ILE 194 194 19490 1 . LEU 195 195 19490 1 . ASP 196 196 19490 1 . SER 197 197 19490 1 . LYS 198 198 19490 1 . ARG 199 199 19490 1 . GLY 200 200 19490 1 . ALA 201 201 19490 1 . ALA 202 202 19490 1 . GLN 203 203 19490 1 . ARG 204 204 19490 1 . GLU 205 205 19490 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 19490 _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 $cdN . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 19490 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 19490 _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 $cdN . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . . . . . . . . 19490 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19490 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 cdN '[U-13C; U-15N]' . . 1 $cdN . . 0.3 . . mM . . . . 19490 1 2 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 19490 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 19490 1 4 'magnesium chloride' 'natural abundance' . . . . . . 5 . . mM . . . . 19490 1 5 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 19490 1 6 'sodium azide' 'natural abundance' . . . . . . 0.01 . . % . . . . 19490 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 19490 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 cdN '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 1 $cdN . . 0.3 . . mM . . . . 19490 2 2 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 19490 2 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 19490 2 4 'magnesium chloride' 'natural abundance' . . . . . . 5 . . mM . . . . 19490 2 5 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 19490 2 6 'sodium azide' 'natural abundance' . . . . . . 0.01 . . % . . . . 19490 2 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 19490 _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' 175 . mM 19490 1 pH 6.5 . pH 19490 1 pressure 1 . atm 19490 1 temperature 308 . K 19490 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 19490 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 19490 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 19490 1 processing 19490 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 19490 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 19490 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19490 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 19490 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 19490 _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 Avance . 600 . . . 19490 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 19490 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19490 1 2 '2D 1H-15N HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19490 1 3 '3D HN(CO)CA' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19490 1 4 '3D HNCA' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19490 1 5 '3D HNCO' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19490 1 6 '3D HN(CA)CO' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19490 1 7 '3D HNCO' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19490 1 8 '3D HNCACB' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19490 1 9 '3D HN(CO)CACB' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19490 1 stop_ save_ save_NMR_spectrometer_expt _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt _NMR_spec_expt.Entry_ID 19490 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . 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 19490 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 19490 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 19490 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 19490 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 19490 _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 '2D 1H-15N HSQC' . . . 19490 1 3 '3D HN(CO)CA' . . . 19490 1 4 '3D HNCA' . . . 19490 1 5 '3D HNCO' . . . 19490 1 6 '3D HN(CA)CO' . . . 19490 1 7 '3D HNCO' . . . 19490 1 8 '3D HNCACB' . . . 19490 1 9 '3D HN(CO)CACB' . . . 19490 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 4 4 ALA H H 1 8.305 0.015 . 1 . . . . 4 ALA H . 19490 1 2 . 1 1 4 4 ALA C C 13 178.758 0.150 . 1 . . . . 4 ALA C . 19490 1 3 . 1 1 4 4 ALA CA C 13 53.018 0.150 . 1 . . . . 4 ALA CA . 19490 1 4 . 1 1 4 4 ALA CB C 13 19.270 0.150 . 1 . . . . 4 ALA CB . 19490 1 5 . 1 1 4 4 ALA N N 15 125.323 0.150 . 1 . . . . 4 ALA N . 19490 1 6 . 1 1 5 5 SER H H 1 8.080 0.015 . 1 . . . . 5 SER H . 19490 1 7 . 1 1 5 5 SER C C 13 175.195 0.150 . 1 . . . . 5 SER C . 19490 1 8 . 1 1 5 5 SER CA C 13 58.744 0.150 . 1 . . . . 5 SER CA . 19490 1 9 . 1 1 5 5 SER CB C 13 64.639 0.150 . 1 . . . . 5 SER CB . 19490 1 10 . 1 1 5 5 SER N N 15 115.433 0.150 . 1 . . . . 5 SER N . 19490 1 11 . 1 1 6 6 ALA H H 1 8.180 0.015 . 1 . . . . 6 ALA H . 19490 1 12 . 1 1 6 6 ALA C C 13 178.129 0.150 . 1 . . . . 6 ALA C . 19490 1 13 . 1 1 6 6 ALA CA C 13 52.962 0.150 . 1 . . . . 6 ALA CA . 19490 1 14 . 1 1 6 6 ALA CB C 13 19.608 0.150 . 1 . . . . 6 ALA CB . 19490 1 15 . 1 1 6 6 ALA N N 15 126.422 0.150 . 1 . . . . 6 ALA N . 19490 1 16 . 1 1 7 7 ARG H H 1 8.139 0.015 . 1 . . . . 7 ARG H . 19490 1 17 . 1 1 7 7 ARG C C 13 176.575 0.150 . 1 . . . . 7 ARG C . 19490 1 18 . 1 1 7 7 ARG CA C 13 56.121 0.150 . 1 . . . . 7 ARG CA . 19490 1 19 . 1 1 7 7 ARG CB C 13 31.107 0.150 . 1 . . . . 7 ARG CB . 19490 1 20 . 1 1 7 7 ARG N N 15 120.047 0.150 . 1 . . . . 7 ARG N . 19490 1 21 . 1 1 8 8 SER H H 1 8.037 0.015 . 1 . . . . 8 SER H . 19490 1 22 . 1 1 8 8 SER C C 13 175.087 0.150 . 1 . . . . 8 SER C . 19490 1 23 . 1 1 8 8 SER CA C 13 58.615 0.150 . 1 . . . . 8 SER CA . 19490 1 24 . 1 1 8 8 SER CB C 13 64.791 0.150 . 1 . . . . 8 SER CB . 19490 1 25 . 1 1 8 8 SER N N 15 117.649 0.150 . 1 . . . . 8 SER N . 19490 1 26 . 1 1 9 9 VAL H H 1 7.977 0.015 . 1 . . . . 9 VAL H . 19490 1 27 . 1 1 9 9 VAL C C 13 174.457 0.150 . 1 . . . . 9 VAL C . 19490 1 28 . 1 1 9 9 VAL CA C 13 61.499 0.150 . 1 . . . . 9 VAL CA . 19490 1 29 . 1 1 9 9 VAL CB C 13 34.796 0.150 . 1 . . . . 9 VAL CB . 19490 1 30 . 1 1 9 9 VAL N N 15 123.188 0.150 . 1 . . . . 9 VAL N . 19490 1 31 . 1 1 10 10 ARG H H 1 9.954 0.015 . 1 . . . . 10 ARG H . 19490 1 32 . 1 1 10 10 ARG C C 13 176.142 0.150 . 1 . . . . 10 ARG C . 19490 1 33 . 1 1 10 10 ARG CA C 13 55.139 0.150 . 1 . . . . 10 ARG CA . 19490 1 34 . 1 1 10 10 ARG CB C 13 31.273 0.150 . 1 . . . . 10 ARG CB . 19490 1 35 . 1 1 10 10 ARG N N 15 130.021 0.150 . 1 . . . . 10 ARG N . 19490 1 36 . 1 1 11 11 VAL H H 1 9.560 0.015 . 1 . . . . 11 VAL H . 19490 1 37 . 1 1 11 11 VAL C C 13 174.058 0.150 . 1 . . . . 11 VAL C . 19490 1 38 . 1 1 11 11 VAL CA C 13 61.917 0.150 . 1 . . . . 11 VAL CA . 19490 1 39 . 1 1 11 11 VAL N N 15 131.053 0.150 . 1 . . . . 11 VAL N . 19490 1 40 . 1 1 12 12 LEU H H 1 8.942 0.015 . 1 . . . . 12 LEU H . 19490 1 41 . 1 1 12 12 LEU C C 13 175.763 0.150 . 1 . . . . 12 LEU C . 19490 1 42 . 1 1 12 12 LEU CA C 13 52.754 0.150 . 1 . . . . 12 LEU CA . 19490 1 43 . 1 1 12 12 LEU N N 15 126.921 0.150 . 1 . . . . 12 LEU N . 19490 1 44 . 1 1 13 13 VAL H H 1 9.356 0.015 . 1 . . . . 13 VAL H . 19490 1 45 . 1 1 13 13 VAL C C 13 175.436 0.150 . 1 . . . . 13 VAL C . 19490 1 46 . 1 1 13 13 VAL CA C 13 62.299 0.150 . 1 . . . . 13 VAL CA . 19490 1 47 . 1 1 13 13 VAL CB C 13 33.420 0.150 . 1 . . . . 13 VAL CB . 19490 1 48 . 1 1 13 13 VAL N N 15 125.160 0.150 . 1 . . . . 13 VAL N . 19490 1 49 . 1 1 14 14 ASP H H 1 7.814 0.015 . 1 . . . . 14 ASP H . 19490 1 50 . 1 1 14 14 ASP CA C 13 53.251 0.150 . 1 . . . . 14 ASP CA . 19490 1 51 . 1 1 14 14 ASP N N 15 125.509 0.150 . 1 . . . . 14 ASP N . 19490 1 52 . 1 1 16 16 ASP C C 13 177.165 0.150 . 1 . . . . 16 ASP C . 19490 1 53 . 1 1 16 16 ASP CA C 13 58.671 0.150 . 1 . . . . 16 ASP CA . 19490 1 54 . 1 1 16 16 ASP CB C 13 38.773 0.150 . 1 . . . . 16 ASP CB . 19490 1 55 . 1 1 17 17 GLY H H 1 9.884 0.015 . 1 . . . . 17 GLY H . 19490 1 56 . 1 1 17 17 GLY C C 13 171.978 0.150 . 1 . . . . 17 GLY C . 19490 1 57 . 1 1 17 17 GLY CA C 13 46.692 0.150 . 1 . . . . 17 GLY CA . 19490 1 58 . 1 1 17 17 GLY N N 15 118.596 0.150 . 1 . . . . 17 GLY N . 19490 1 59 . 1 1 18 18 VAL H H 1 6.921 0.015 . 1 . . . . 18 VAL H . 19490 1 60 . 1 1 18 18 VAL C C 13 173.286 0.150 . 1 . . . . 18 VAL C . 19490 1 61 . 1 1 18 18 VAL CA C 13 66.411 0.150 . 1 . . . . 18 VAL CA . 19490 1 62 . 1 1 18 18 VAL N N 15 118.856 0.150 . 1 . . . . 18 VAL N . 19490 1 63 . 1 1 19 19 LEU H H 1 7.018 0.015 . 1 . . . . 19 LEU H . 19490 1 64 . 1 1 19 19 LEU CA C 13 57.918 0.150 . 1 . . . . 19 LEU CA . 19490 1 65 . 1 1 19 19 LEU CB C 13 43.181 0.150 . 1 . . . . 19 LEU CB . 19490 1 66 . 1 1 19 19 LEU N N 15 117.307 0.150 . 1 . . . . 19 LEU N . 19490 1 67 . 1 1 20 20 ALA H H 1 7.519 0.015 . 1 . . . . 20 ALA H . 19490 1 68 . 1 1 20 20 ALA C C 13 177.750 0.150 . 1 . . . . 20 ALA C . 19490 1 69 . 1 1 20 20 ALA CA C 13 50.265 0.150 . 1 . . . . 20 ALA CA . 19490 1 70 . 1 1 20 20 ALA CB C 13 21.681 0.150 . 1 . . . . 20 ALA CB . 19490 1 71 . 1 1 20 20 ALA N N 15 121.083 0.150 . 1 . . . . 20 ALA N . 19490 1 72 . 1 1 21 21 ASP H H 1 9.398 0.015 . 1 . . . . 21 ASP H . 19490 1 73 . 1 1 21 21 ASP C C 13 176.271 0.150 . 1 . . . . 21 ASP C . 19490 1 74 . 1 1 21 21 ASP CA C 13 53.805 0.150 . 1 . . . . 21 ASP CA . 19490 1 75 . 1 1 21 21 ASP CB C 13 39.532 0.150 . 1 . . . . 21 ASP CB . 19490 1 76 . 1 1 21 21 ASP N N 15 124.726 0.150 . 1 . . . . 21 ASP N . 19490 1 77 . 1 1 22 22 PHE H H 1 7.988 0.015 . 1 . . . . 22 PHE H . 19490 1 78 . 1 1 22 22 PHE C C 13 177.665 0.150 . 1 . . . . 22 PHE C . 19490 1 79 . 1 1 22 22 PHE CA C 13 61.928 0.150 . 1 . . . . 22 PHE CA . 19490 1 80 . 1 1 22 22 PHE CB C 13 39.807 0.150 . 1 . . . . 22 PHE CB . 19490 1 81 . 1 1 22 22 PHE N N 15 131.606 0.150 . 1 . . . . 22 PHE N . 19490 1 82 . 1 1 23 23 GLU H H 1 9.873 0.015 . 1 . . . . 23 GLU H . 19490 1 83 . 1 1 23 23 GLU C C 13 180.926 0.150 . 1 . . . . 23 GLU C . 19490 1 84 . 1 1 23 23 GLU CA C 13 60.184 0.150 . 1 . . . . 23 GLU CA . 19490 1 85 . 1 1 23 23 GLU CB C 13 28.294 0.150 . 1 . . . . 23 GLU CB . 19490 1 86 . 1 1 23 23 GLU N N 15 120.967 0.150 . 1 . . . . 23 GLU N . 19490 1 87 . 1 1 24 24 ALA H H 1 8.334 0.015 . 1 . . . . 24 ALA H . 19490 1 88 . 1 1 24 24 ALA C C 13 172.996 0.150 . 1 . . . . 24 ALA C . 19490 1 89 . 1 1 24 24 ALA CA C 13 55.618 0.150 . 1 . . . . 24 ALA CA . 19490 1 90 . 1 1 24 24 ALA CB C 13 19.284 0.150 . 1 . . . . 24 ALA CB . 19490 1 91 . 1 1 24 24 ALA N N 15 122.046 0.150 . 1 . . . . 24 ALA N . 19490 1 92 . 1 1 25 25 GLY H H 1 7.590 0.015 . 1 . . . . 25 GLY H . 19490 1 93 . 1 1 25 25 GLY C C 13 177.656 0.150 . 1 . . . . 25 GLY C . 19490 1 94 . 1 1 25 25 GLY CA C 13 47.237 0.150 . 1 . . . . 25 GLY CA . 19490 1 95 . 1 1 25 25 GLY N N 15 106.368 0.150 . 1 . . . . 25 GLY N . 19490 1 96 . 1 1 26 26 LEU H H 1 8.991 0.015 . 1 . . . . 26 LEU H . 19490 1 97 . 1 1 26 26 LEU C C 13 178.359 0.150 . 1 . . . . 26 LEU C . 19490 1 98 . 1 1 26 26 LEU CA C 13 58.615 0.150 . 1 . . . . 26 LEU CA . 19490 1 99 . 1 1 26 26 LEU CB C 13 41.574 0.150 . 1 . . . . 26 LEU CB . 19490 1 100 . 1 1 26 26 LEU N N 15 127.486 0.150 . 1 . . . . 26 LEU N . 19490 1 101 . 1 1 27 27 LEU H H 1 7.654 0.015 . 1 . . . . 27 LEU H . 19490 1 102 . 1 1 27 27 LEU C C 13 179.124 0.150 . 1 . . . . 27 LEU C . 19490 1 103 . 1 1 27 27 LEU CA C 13 58.658 0.150 . 1 . . . . 27 LEU CA . 19490 1 104 . 1 1 27 27 LEU CB C 13 41.084 0.150 . 1 . . . . 27 LEU CB . 19490 1 105 . 1 1 27 27 LEU N N 15 120.060 0.150 . 1 . . . . 27 LEU N . 19490 1 106 . 1 1 28 28 ARG H H 1 8.070 0.015 . 1 . . . . 28 ARG H . 19490 1 107 . 1 1 28 28 ARG C C 13 180.726 0.150 . 1 . . . . 28 ARG C . 19490 1 108 . 1 1 28 28 ARG CA C 13 59.851 0.150 . 1 . . . . 28 ARG CA . 19490 1 109 . 1 1 28 28 ARG CB C 13 30.226 0.150 . 1 . . . . 28 ARG CB . 19490 1 110 . 1 1 28 28 ARG N N 15 117.911 0.150 . 1 . . . . 28 ARG N . 19490 1 111 . 1 1 29 29 GLY H H 1 8.343 0.015 . 1 . . . . 29 GLY H . 19490 1 112 . 1 1 29 29 GLY C C 13 176.464 0.150 . 1 . . . . 29 GLY C . 19490 1 113 . 1 1 29 29 GLY CA C 13 47.641 0.150 . 1 . . . . 29 GLY CA . 19490 1 114 . 1 1 29 29 GLY N N 15 106.559 0.150 . 1 . . . . 29 GLY N . 19490 1 115 . 1 1 30 30 PHE H H 1 9.102 0.015 . 1 . . . . 30 PHE H . 19490 1 116 . 1 1 30 30 PHE C C 13 177.550 0.150 . 1 . . . . 30 PHE C . 19490 1 117 . 1 1 30 30 PHE CA C 13 63.272 0.150 . 1 . . . . 30 PHE CA . 19490 1 118 . 1 1 30 30 PHE CB C 13 40.158 0.150 . 1 . . . . 30 PHE CB . 19490 1 119 . 1 1 30 30 PHE N N 15 125.528 0.150 . 1 . . . . 30 PHE N . 19490 1 120 . 1 1 31 31 ARG H H 1 8.651 0.015 . 1 . . . . 31 ARG H . 19490 1 121 . 1 1 31 31 ARG C C 13 179.099 0.150 . 1 . . . . 31 ARG C . 19490 1 122 . 1 1 31 31 ARG CA C 13 59.255 0.150 . 1 . . . . 31 ARG CA . 19490 1 123 . 1 1 31 31 ARG CB C 13 28.830 0.150 . 1 . . . . 31 ARG CB . 19490 1 124 . 1 1 31 31 ARG N N 15 116.721 0.150 . 1 . . . . 31 ARG N . 19490 1 125 . 1 1 32 32 ARG H H 1 7.321 0.015 . 1 . . . . 32 ARG H . 19490 1 126 . 1 1 32 32 ARG C C 13 178.597 0.150 . 1 . . . . 32 ARG C . 19490 1 127 . 1 1 32 32 ARG CA C 13 58.644 0.150 . 1 . . . . 32 ARG CA . 19490 1 128 . 1 1 32 32 ARG CB C 13 30.459 0.150 . 1 . . . . 32 ARG CB . 19490 1 129 . 1 1 32 32 ARG N N 15 115.847 0.150 . 1 . . . . 32 ARG N . 19490 1 130 . 1 1 33 33 ARG H H 1 7.408 0.015 . 1 . . . . 33 ARG H . 19490 1 131 . 1 1 33 33 ARG C C 13 176.655 0.150 . 1 . . . . 33 ARG C . 19490 1 132 . 1 1 33 33 ARG CA C 13 57.878 0.150 . 1 . . . . 33 ARG CA . 19490 1 133 . 1 1 33 33 ARG CB C 13 31.015 0.150 . 1 . . . . 33 ARG CB . 19490 1 134 . 1 1 33 33 ARG N N 15 118.241 0.150 . 1 . . . . 33 ARG N . 19490 1 135 . 1 1 34 34 PHE H H 1 8.132 0.015 . 1 . . . . 34 PHE H . 19490 1 136 . 1 1 34 34 PHE C C 13 174.665 0.150 . 1 . . . . 34 PHE C . 19490 1 137 . 1 1 34 34 PHE CA C 13 54.915 0.150 . 1 . . . . 34 PHE CA . 19490 1 138 . 1 1 34 34 PHE CB C 13 37.766 0.150 . 1 . . . . 34 PHE CB . 19490 1 139 . 1 1 34 34 PHE N N 15 117.013 0.150 . 1 . . . . 34 PHE N . 19490 1 140 . 1 1 35 35 PRO C C 13 178.960 0.150 . 1 . . . . 35 PRO C . 19490 1 141 . 1 1 35 35 PRO CA C 13 65.739 0.150 . 1 . . . . 35 PRO CA . 19490 1 142 . 1 1 35 35 PRO CB C 13 31.936 0.150 . 1 . . . . 35 PRO CB . 19490 1 143 . 1 1 36 36 GLU H H 1 8.759 0.015 . 1 . . . . 36 GLU H . 19490 1 144 . 1 1 36 36 GLU C C 13 178.043 0.150 . 1 . . . . 36 GLU C . 19490 1 145 . 1 1 36 36 GLU CA C 13 56.497 0.150 . 1 . . . . 36 GLU CA . 19490 1 146 . 1 1 36 36 GLU CB C 13 29.520 0.150 . 1 . . . . 36 GLU CB . 19490 1 147 . 1 1 36 36 GLU N N 15 116.155 0.150 . 1 . . . . 36 GLU N . 19490 1 148 . 1 1 37 37 GLU H H 1 7.292 0.015 . 1 . . . . 37 GLU H . 19490 1 149 . 1 1 37 37 GLU C C 13 176.276 0.150 . 1 . . . . 37 GLU C . 19490 1 150 . 1 1 37 37 GLU CA C 13 54.120 0.150 . 1 . . . . 37 GLU CA . 19490 1 151 . 1 1 37 37 GLU CB C 13 28.922 0.150 . 1 . . . . 37 GLU CB . 19490 1 152 . 1 1 37 37 GLU N N 15 120.099 0.150 . 1 . . . . 37 GLU N . 19490 1 153 . 1 1 38 38 PRO C C 13 173.243 0.150 . 1 . . . . 38 PRO C . 19490 1 154 . 1 1 38 38 PRO CA C 13 63.759 0.150 . 1 . . . . 38 PRO CA . 19490 1 155 . 1 1 38 38 PRO CB C 13 32.113 0.150 . 1 . . . . 38 PRO CB . 19490 1 156 . 1 1 39 39 HIS H H 1 7.259 0.015 . 1 . . . . 39 HIS H . 19490 1 157 . 1 1 39 39 HIS C C 13 173.865 0.150 . 1 . . . . 39 HIS C . 19490 1 158 . 1 1 39 39 HIS CA C 13 54.115 0.150 . 1 . . . . 39 HIS CA . 19490 1 159 . 1 1 39 39 HIS CB C 13 32.700 0.150 . 1 . . . . 39 HIS CB . 19490 1 160 . 1 1 39 39 HIS N N 15 112.113 0.150 . 1 . . . . 39 HIS N . 19490 1 161 . 1 1 40 40 VAL H H 1 7.093 0.015 . 1 . . . . 40 VAL H . 19490 1 162 . 1 1 40 40 VAL C C 13 173.933 0.150 . 1 . . . . 40 VAL C . 19490 1 163 . 1 1 40 40 VAL CA C 13 59.146 0.150 . 1 . . . . 40 VAL CA . 19490 1 164 . 1 1 40 40 VAL CB C 13 32.262 0.150 . 1 . . . . 40 VAL CB . 19490 1 165 . 1 1 40 40 VAL N N 15 119.327 0.150 . 1 . . . . 40 VAL N . 19490 1 166 . 1 1 41 41 PRO C C 13 178.532 0.150 . 1 . . . . 41 PRO C . 19490 1 167 . 1 1 41 41 PRO CA C 13 62.962 0.150 . 1 . . . . 41 PRO CA . 19490 1 168 . 1 1 41 41 PRO CB C 13 32.549 0.150 . 1 . . . . 41 PRO CB . 19490 1 169 . 1 1 42 42 LEU H H 1 8.606 0.015 . 1 . . . . 42 LEU H . 19490 1 170 . 1 1 42 42 LEU C C 13 181.198 0.150 . 1 . . . . 42 LEU C . 19490 1 171 . 1 1 42 42 LEU CA C 13 59.422 0.150 . 1 . . . . 42 LEU CA . 19490 1 172 . 1 1 42 42 LEU CB C 13 39.791 0.150 . 1 . . . . 42 LEU CB . 19490 1 173 . 1 1 42 42 LEU N N 15 122.804 0.150 . 1 . . . . 42 LEU N . 19490 1 174 . 1 1 43 43 GLU H H 1 9.164 0.015 . 1 . . . . 43 GLU H . 19490 1 175 . 1 1 43 43 GLU C C 13 178.326 0.150 . 1 . . . . 43 GLU C . 19490 1 176 . 1 1 43 43 GLU CA C 13 59.380 0.150 . 1 . . . . 43 GLU CA . 19490 1 177 . 1 1 43 43 GLU CB C 13 28.837 0.150 . 1 . . . . 43 GLU CB . 19490 1 178 . 1 1 43 43 GLU N N 15 115.499 0.150 . 1 . . . . 43 GLU N . 19490 1 179 . 1 1 44 44 GLN H H 1 7.882 0.015 . 1 . . . . 44 GLN H . 19490 1 180 . 1 1 44 44 GLN C C 13 177.423 0.150 . 1 . . . . 44 GLN C . 19490 1 181 . 1 1 44 44 GLN CA C 13 55.124 0.150 . 1 . . . . 44 GLN CA . 19490 1 182 . 1 1 44 44 GLN CB C 13 29.957 0.150 . 1 . . . . 44 GLN CB . 19490 1 183 . 1 1 44 44 GLN N N 15 116.834 0.150 . 1 . . . . 44 GLN N . 19490 1 184 . 1 1 45 45 ARG H H 1 7.446 0.015 . 1 . . . . 45 ARG H . 19490 1 185 . 1 1 45 45 ARG C C 13 176.821 0.150 . 1 . . . . 45 ARG C . 19490 1 186 . 1 1 45 45 ARG CA C 13 56.210 0.150 . 1 . . . . 45 ARG CA . 19490 1 187 . 1 1 45 45 ARG CB C 13 28.681 0.150 . 1 . . . . 45 ARG CB . 19490 1 188 . 1 1 45 45 ARG N N 15 123.905 0.150 . 1 . . . . 45 ARG N . 19490 1 189 . 1 1 46 46 ARG H H 1 8.171 0.015 . 1 . . . . 46 ARG H . 19490 1 190 . 1 1 46 46 ARG C C 13 177.572 0.150 . 1 . . . . 46 ARG C . 19490 1 191 . 1 1 46 46 ARG CA C 13 55.892 0.150 . 1 . . . . 46 ARG CA . 19490 1 192 . 1 1 46 46 ARG CB C 13 33.325 0.150 . 1 . . . . 46 ARG CB . 19490 1 193 . 1 1 46 46 ARG N N 15 121.392 0.150 . 1 . . . . 46 ARG N . 19490 1 194 . 1 1 47 47 GLY H H 1 8.286 0.015 . 1 . . . . 47 GLY H . 19490 1 195 . 1 1 47 47 GLY C C 13 174.678 0.150 . 1 . . . . 47 GLY C . 19490 1 196 . 1 1 47 47 GLY CA C 13 44.901 0.150 . 1 . . . . 47 GLY CA . 19490 1 197 . 1 1 47 47 GLY N N 15 114.379 0.150 . 1 . . . . 47 GLY N . 19490 1 198 . 1 1 48 48 PHE H H 1 8.947 0.015 . 1 . . . . 48 PHE H . 19490 1 199 . 1 1 48 48 PHE C C 13 176.154 0.150 . 1 . . . . 48 PHE C . 19490 1 200 . 1 1 48 48 PHE CA C 13 62.318 0.150 . 1 . . . . 48 PHE CA . 19490 1 201 . 1 1 48 48 PHE CB C 13 40.084 0.150 . 1 . . . . 48 PHE CB . 19490 1 202 . 1 1 48 48 PHE N N 15 125.902 0.150 . 1 . . . . 48 PHE N . 19490 1 203 . 1 1 49 49 LEU H H 1 8.138 0.015 . 1 . . . . 49 LEU H . 19490 1 204 . 1 1 49 49 LEU C C 13 178.829 0.150 . 1 . . . . 49 LEU C . 19490 1 205 . 1 1 49 49 LEU CA C 13 53.348 0.150 . 1 . . . . 49 LEU CA . 19490 1 206 . 1 1 49 49 LEU CB C 13 41.360 0.150 . 1 . . . . 49 LEU CB . 19490 1 207 . 1 1 49 49 LEU N N 15 114.928 0.150 . 1 . . . . 49 LEU N . 19490 1 208 . 1 1 50 50 ALA H H 1 8.991 0.015 . 1 . . . . 50 ALA H . 19490 1 209 . 1 1 50 50 ALA C C 13 181.038 0.150 . 1 . . . . 50 ALA C . 19490 1 210 . 1 1 50 50 ALA CA C 13 56.306 0.150 . 1 . . . . 50 ALA CA . 19490 1 211 . 1 1 50 50 ALA CB C 13 18.199 0.150 . 1 . . . . 50 ALA CB . 19490 1 212 . 1 1 50 50 ALA N N 15 135.518 0.150 . 1 . . . . 50 ALA N . 19490 1 213 . 1 1 51 51 ARG H H 1 9.354 0.015 . 1 . . . . 51 ARG H . 19490 1 214 . 1 1 51 51 ARG C C 13 178.057 0.150 . 1 . . . . 51 ARG C . 19490 1 215 . 1 1 51 51 ARG CA C 13 60.519 0.150 . 1 . . . . 51 ARG CA . 19490 1 216 . 1 1 51 51 ARG CB C 13 30.152 0.150 . 1 . . . . 51 ARG CB . 19490 1 217 . 1 1 51 51 ARG N N 15 115.219 0.150 . 1 . . . . 51 ARG N . 19490 1 218 . 1 1 52 52 GLU H H 1 6.855 0.015 . 1 . . . . 52 GLU H . 19490 1 219 . 1 1 52 52 GLU C C 13 179.378 0.150 . 1 . . . . 52 GLU C . 19490 1 220 . 1 1 52 52 GLU CA C 13 58.302 0.150 . 1 . . . . 52 GLU CA . 19490 1 221 . 1 1 52 52 GLU CB C 13 29.135 0.150 . 1 . . . . 52 GLU CB . 19490 1 222 . 1 1 52 52 GLU N N 15 115.072 0.150 . 1 . . . . 52 GLU N . 19490 1 223 . 1 1 53 53 GLN H H 1 7.310 0.015 . 1 . . . . 53 GLN H . 19490 1 224 . 1 1 53 53 GLN C C 13 180.053 0.150 . 1 . . . . 53 GLN C . 19490 1 225 . 1 1 53 53 GLN CA C 13 59.679 0.150 . 1 . . . . 53 GLN CA . 19490 1 226 . 1 1 53 53 GLN CB C 13 27.637 0.150 . 1 . . . . 53 GLN CB . 19490 1 227 . 1 1 53 53 GLN N N 15 122.992 0.150 . 1 . . . . 53 GLN N . 19490 1 228 . 1 1 54 54 TYR H H 1 8.169 0.015 . 1 . . . . 54 TYR H . 19490 1 229 . 1 1 54 54 TYR C C 13 178.228 0.150 . 1 . . . . 54 TYR C . 19490 1 230 . 1 1 54 54 TYR CA C 13 63.437 0.150 . 1 . . . . 54 TYR CA . 19490 1 231 . 1 1 54 54 TYR CB C 13 37.389 0.150 . 1 . . . . 54 TYR CB . 19490 1 232 . 1 1 54 54 TYR N N 15 119.345 0.150 . 1 . . . . 54 TYR N . 19490 1 233 . 1 1 55 55 ARG H H 1 7.977 0.015 . 1 . . . . 55 ARG H . 19490 1 234 . 1 1 55 55 ARG C C 13 178.081 0.150 . 1 . . . . 55 ARG C . 19490 1 235 . 1 1 55 55 ARG CA C 13 59.122 0.150 . 1 . . . . 55 ARG CA . 19490 1 236 . 1 1 55 55 ARG CB C 13 30.419 0.150 . 1 . . . . 55 ARG CB . 19490 1 237 . 1 1 55 55 ARG N N 15 119.384 0.150 . 1 . . . . 55 ARG N . 19490 1 238 . 1 1 56 56 ALA H H 1 6.955 0.015 . 1 . . . . 56 ALA H . 19490 1 239 . 1 1 56 56 ALA C C 13 179.930 0.150 . 1 . . . . 56 ALA C . 19490 1 240 . 1 1 56 56 ALA CA C 13 53.920 0.150 . 1 . . . . 56 ALA CA . 19490 1 241 . 1 1 56 56 ALA CB C 13 18.230 0.150 . 1 . . . . 56 ALA CB . 19490 1 242 . 1 1 56 56 ALA N N 15 116.968 0.150 . 1 . . . . 56 ALA N . 19490 1 243 . 1 1 57 57 LEU H H 1 7.147 0.015 . 1 . . . . 57 LEU H . 19490 1 244 . 1 1 57 57 LEU C C 13 178.780 0.150 . 1 . . . . 57 LEU C . 19490 1 245 . 1 1 57 57 LEU CA C 13 58.164 0.150 . 1 . . . . 57 LEU CA . 19490 1 246 . 1 1 57 57 LEU CB C 13 41.828 0.150 . 1 . . . . 57 LEU CB . 19490 1 247 . 1 1 57 57 LEU N N 15 121.202 0.150 . 1 . . . . 57 LEU N . 19490 1 248 . 1 1 58 58 ARG H H 1 7.708 0.015 . 1 . . . . 58 ARG H . 19490 1 249 . 1 1 58 58 ARG C C 13 177.075 0.150 . 1 . . . . 58 ARG C . 19490 1 250 . 1 1 58 58 ARG CA C 13 56.561 0.150 . 1 . . . . 58 ARG CA . 19490 1 251 . 1 1 58 58 ARG CB C 13 34.238 0.150 . 1 . . . . 58 ARG CB . 19490 1 252 . 1 1 58 58 ARG N N 15 120.376 0.150 . 1 . . . . 58 ARG N . 19490 1 253 . 1 1 59 59 PRO C C 13 179.944 0.150 . 1 . . . . 59 PRO C . 19490 1 254 . 1 1 59 59 PRO CA C 13 67.428 0.150 . 1 . . . . 59 PRO CA . 19490 1 255 . 1 1 59 59 PRO CB C 13 32.090 0.150 . 1 . . . . 59 PRO CB . 19490 1 256 . 1 1 60 60 ASP H H 1 8.495 0.015 . 1 . . . . 60 ASP H . 19490 1 257 . 1 1 60 60 ASP C C 13 178.514 0.150 . 1 . . . . 60 ASP C . 19490 1 258 . 1 1 60 60 ASP CA C 13 56.259 0.150 . 1 . . . . 60 ASP CA . 19490 1 259 . 1 1 60 60 ASP CB C 13 40.613 0.150 . 1 . . . . 60 ASP CB . 19490 1 260 . 1 1 60 60 ASP N N 15 114.139 0.150 . 1 . . . . 60 ASP N . 19490 1 261 . 1 1 61 61 LEU H H 1 8.343 0.015 . 1 . . . . 61 LEU H . 19490 1 262 . 1 1 61 61 LEU C C 13 179.698 0.150 . 1 . . . . 61 LEU C . 19490 1 263 . 1 1 61 61 LEU CA C 13 57.291 0.150 . 1 . . . . 61 LEU CA . 19490 1 264 . 1 1 61 61 LEU CB C 13 41.263 0.150 . 1 . . . . 61 LEU CB . 19490 1 265 . 1 1 61 61 LEU N N 15 119.283 0.150 . 1 . . . . 61 LEU N . 19490 1 266 . 1 1 62 62 ALA H H 1 7.219 0.015 . 1 . . . . 62 ALA H . 19490 1 267 . 1 1 62 62 ALA C C 13 179.812 0.150 . 1 . . . . 62 ALA C . 19490 1 268 . 1 1 62 62 ALA CA C 13 55.777 0.150 . 1 . . . . 62 ALA CA . 19490 1 269 . 1 1 62 62 ALA CB C 13 18.273 0.150 . 1 . . . . 62 ALA CB . 19490 1 270 . 1 1 62 62 ALA N N 15 120.993 0.150 . 1 . . . . 62 ALA N . 19490 1 271 . 1 1 63 63 ASP H H 1 7.607 0.015 . 1 . . . . 63 ASP H . 19490 1 272 . 1 1 63 63 ASP C C 13 179.964 0.150 . 1 . . . . 63 ASP C . 19490 1 273 . 1 1 63 63 ASP CA C 13 56.920 0.150 . 1 . . . . 63 ASP CA . 19490 1 274 . 1 1 63 63 ASP CB C 13 40.307 0.150 . 1 . . . . 63 ASP CB . 19490 1 275 . 1 1 63 63 ASP N N 15 117.114 0.150 . 1 . . . . 63 ASP N . 19490 1 276 . 1 1 64 64 LYS H H 1 7.038 0.015 . 1 . . . . 64 LYS H . 19490 1 277 . 1 1 64 64 LYS C C 13 179.677 0.150 . 1 . . . . 64 LYS C . 19490 1 278 . 1 1 64 64 LYS CA C 13 60.388 0.150 . 1 . . . . 64 LYS CA . 19490 1 279 . 1 1 64 64 LYS CB C 13 32.015 0.150 . 1 . . . . 64 LYS CB . 19490 1 280 . 1 1 64 64 LYS N N 15 121.089 0.150 . 1 . . . . 64 LYS N . 19490 1 281 . 1 1 65 65 VAL H H 1 8.151 0.015 . 1 . . . . 65 VAL H . 19490 1 282 . 1 1 65 65 VAL C C 13 177.423 0.150 . 1 . . . . 65 VAL C . 19490 1 283 . 1 1 65 65 VAL CA C 13 66.792 0.150 . 1 . . . . 65 VAL CA . 19490 1 284 . 1 1 65 65 VAL CB C 13 31.235 0.150 . 1 . . . . 65 VAL CB . 19490 1 285 . 1 1 65 65 VAL N N 15 120.596 0.150 . 1 . . . . 65 VAL N . 19490 1 286 . 1 1 66 66 ALA H H 1 7.033 0.015 . 1 . . . . 66 ALA H . 19490 1 287 . 1 1 66 66 ALA C C 13 178.806 0.150 . 1 . . . . 66 ALA C . 19490 1 288 . 1 1 66 66 ALA CA C 13 54.354 0.150 . 1 . . . . 66 ALA CA . 19490 1 289 . 1 1 66 66 ALA CB C 13 17.851 0.150 . 1 . . . . 66 ALA CB . 19490 1 290 . 1 1 66 66 ALA N N 15 121.937 0.150 . 1 . . . . 66 ALA N . 19490 1 291 . 1 1 67 67 SER H H 1 7.300 0.015 . 1 . . . . 67 SER H . 19490 1 292 . 1 1 67 67 SER C C 13 176.704 0.150 . 1 . . . . 67 SER C . 19490 1 293 . 1 1 67 67 SER CA C 13 61.489 0.150 . 1 . . . . 67 SER CA . 19490 1 294 . 1 1 67 67 SER CB C 13 63.485 0.150 . 1 . . . . 67 SER CB . 19490 1 295 . 1 1 67 67 SER N N 15 111.008 0.150 . 1 . . . . 67 SER N . 19490 1 296 . 1 1 68 68 VAL H H 1 7.155 0.015 . 1 . . . . 68 VAL H . 19490 1 297 . 1 1 68 68 VAL C C 13 178.280 0.150 . 1 . . . . 68 VAL C . 19490 1 298 . 1 1 68 68 VAL CA C 13 65.894 0.150 . 1 . . . . 68 VAL CA . 19490 1 299 . 1 1 68 68 VAL CB C 13 31.300 0.150 . 1 . . . . 68 VAL CB . 19490 1 300 . 1 1 68 68 VAL N N 15 121.304 0.150 . 1 . . . . 68 VAL N . 19490 1 301 . 1 1 69 69 TYR H H 1 6.219 0.015 . 1 . . . . 69 TYR H . 19490 1 302 . 1 1 69 69 TYR C C 13 176.777 0.150 . 1 . . . . 69 TYR C . 19490 1 303 . 1 1 69 69 TYR CA C 13 57.186 0.150 . 1 . . . . 69 TYR CA . 19490 1 304 . 1 1 69 69 TYR CB C 13 37.079 0.150 . 1 . . . . 69 TYR CB . 19490 1 305 . 1 1 69 69 TYR N N 15 112.062 0.150 . 1 . . . . 69 TYR N . 19490 1 306 . 1 1 70 70 GLU H H 1 7.500 0.015 . 1 . . . . 70 GLU H . 19490 1 307 . 1 1 70 70 GLU C C 13 176.381 0.150 . 1 . . . . 70 GLU C . 19490 1 308 . 1 1 70 70 GLU CA C 13 56.879 0.150 . 1 . . . . 70 GLU CA . 19490 1 309 . 1 1 70 70 GLU CB C 13 29.929 0.150 . 1 . . . . 70 GLU CB . 19490 1 310 . 1 1 70 70 GLU N N 15 118.981 0.150 . 1 . . . . 70 GLU N . 19490 1 311 . 1 1 71 71 ALA H H 1 6.806 0.015 . 1 . . . . 71 ALA H . 19490 1 312 . 1 1 71 71 ALA C C 13 176.669 0.150 . 1 . . . . 71 ALA C . 19490 1 313 . 1 1 71 71 ALA CA C 13 50.821 0.150 . 1 . . . . 71 ALA CA . 19490 1 314 . 1 1 71 71 ALA CB C 13 18.467 0.150 . 1 . . . . 71 ALA CB . 19490 1 315 . 1 1 71 71 ALA N N 15 123.845 0.150 . 1 . . . . 71 ALA N . 19490 1 316 . 1 1 72 72 PRO C C 13 178.319 0.150 . 1 . . . . 72 PRO C . 19490 1 317 . 1 1 72 72 PRO CA C 13 64.078 0.150 . 1 . . . . 72 PRO CA . 19490 1 318 . 1 1 72 72 PRO CB C 13 30.896 0.150 . 1 . . . . 72 PRO CB . 19490 1 319 . 1 1 73 73 GLY H H 1 11.613 0.015 . 1 . . . . 73 GLY H . 19490 1 320 . 1 1 73 73 GLY C C 13 175.162 0.150 . 1 . . . . 73 GLY C . 19490 1 321 . 1 1 73 73 GLY CA C 13 46.047 0.150 . 1 . . . . 73 GLY CA . 19490 1 322 . 1 1 73 73 GLY N N 15 119.720 0.150 . 1 . . . . 73 GLY N . 19490 1 323 . 1 1 74 74 PHE H H 1 7.417 0.015 . 1 . . . . 74 PHE H . 19490 1 324 . 1 1 74 74 PHE C C 13 178.299 0.150 . 1 . . . . 74 PHE C . 19490 1 325 . 1 1 74 74 PHE CA C 13 62.617 0.150 . 1 . . . . 74 PHE CA . 19490 1 326 . 1 1 74 74 PHE CB C 13 39.201 0.150 . 1 . . . . 74 PHE CB . 19490 1 327 . 1 1 74 74 PHE N N 15 120.831 0.150 . 1 . . . . 74 PHE N . 19490 1 328 . 1 1 75 75 PHE H H 1 8.011 0.015 . 1 . . . . 75 PHE H . 19490 1 329 . 1 1 75 75 PHE C C 13 180.240 0.150 . 1 . . . . 75 PHE C . 19490 1 330 . 1 1 75 75 PHE CA C 13 62.886 0.150 . 1 . . . . 75 PHE CA . 19490 1 331 . 1 1 75 75 PHE CB C 13 39.318 0.150 . 1 . . . . 75 PHE CB . 19490 1 332 . 1 1 75 75 PHE N N 15 114.007 0.150 . 1 . . . . 75 PHE N . 19490 1 333 . 1 1 76 76 LEU H H 1 8.052 0.015 . 1 . . . . 76 LEU H . 19490 1 334 . 1 1 76 76 LEU C C 13 178.268 0.150 . 1 . . . . 76 LEU C . 19490 1 335 . 1 1 76 76 LEU CA C 13 57.898 0.150 . 1 . . . . 76 LEU CA . 19490 1 336 . 1 1 76 76 LEU CB C 13 42.179 0.150 . 1 . . . . 76 LEU CB . 19490 1 337 . 1 1 76 76 LEU N N 15 122.244 0.150 . 1 . . . . 76 LEU N . 19490 1 338 . 1 1 77 77 ASP H H 1 7.238 0.015 . 1 . . . . 77 ASP H . 19490 1 339 . 1 1 77 77 ASP C C 13 177.665 0.150 . 1 . . . . 77 ASP C . 19490 1 340 . 1 1 77 77 ASP CA C 13 54.671 0.150 . 1 . . . . 77 ASP CA . 19490 1 341 . 1 1 77 77 ASP CB C 13 41.399 0.150 . 1 . . . . 77 ASP CB . 19490 1 342 . 1 1 77 77 ASP N N 15 114.938 0.150 . 1 . . . . 77 ASP N . 19490 1 343 . 1 1 78 78 LEU H H 1 6.776 0.015 . 1 . . . . 78 LEU H . 19490 1 344 . 1 1 78 78 LEU C C 13 179.297 0.150 . 1 . . . . 78 LEU C . 19490 1 345 . 1 1 78 78 LEU CA C 13 55.888 0.150 . 1 . . . . 78 LEU CA . 19490 1 346 . 1 1 78 78 LEU CB C 13 41.597 0.150 . 1 . . . . 78 LEU CB . 19490 1 347 . 1 1 78 78 LEU N N 15 118.347 0.150 . 1 . . . . 78 LEU N . 19490 1 348 . 1 1 79 79 GLU H H 1 9.438 0.015 . 1 . . . . 79 GLU H . 19490 1 349 . 1 1 79 79 GLU C C 13 175.548 0.150 . 1 . . . . 79 GLU C . 19490 1 350 . 1 1 79 79 GLU CA C 13 54.600 0.150 . 1 . . . . 79 GLU CA . 19490 1 351 . 1 1 79 79 GLU CB C 13 30.098 0.150 . 1 . . . . 79 GLU CB . 19490 1 352 . 1 1 79 79 GLU N N 15 126.106 0.150 . 1 . . . . 79 GLU N . 19490 1 353 . 1 1 80 80 PRO C C 13 178.137 0.150 . 1 . . . . 80 PRO C . 19490 1 354 . 1 1 81 81 ILE H H 1 7.938 0.015 . 1 . . . . 81 ILE H . 19490 1 355 . 1 1 81 81 ILE N N 15 128.680 0.150 . 1 . . . . 81 ILE N . 19490 1 356 . 1 1 82 82 PRO C C 13 178.250 0.150 . 1 . . . . 82 PRO C . 19490 1 357 . 1 1 82 82 PRO CA C 13 65.067 0.150 . 1 . . . . 82 PRO CA . 19490 1 358 . 1 1 82 82 PRO CB C 13 31.681 0.150 . 1 . . . . 82 PRO CB . 19490 1 359 . 1 1 83 83 GLY H H 1 8.708 0.015 . 1 . . . . 83 GLY H . 19490 1 360 . 1 1 83 83 GLY C C 13 175.777 0.150 . 1 . . . . 83 GLY C . 19490 1 361 . 1 1 83 83 GLY CA C 13 46.718 0.150 . 1 . . . . 83 GLY CA . 19490 1 362 . 1 1 83 83 GLY N N 15 113.637 0.150 . 1 . . . . 83 GLY N . 19490 1 363 . 1 1 84 84 ALA H H 1 7.782 0.015 . 1 . . . . 84 ALA H . 19490 1 364 . 1 1 84 84 ALA C C 13 178.969 0.150 . 1 . . . . 84 ALA C . 19490 1 365 . 1 1 84 84 ALA CA C 13 55.195 0.150 . 1 . . . . 84 ALA CA . 19490 1 366 . 1 1 84 84 ALA CB C 13 22.459 0.150 . 1 . . . . 84 ALA CB . 19490 1 367 . 1 1 84 84 ALA N N 15 124.279 0.150 . 1 . . . . 84 ALA N . 19490 1 368 . 1 1 85 85 LEU H H 1 7.789 0.015 . 1 . . . . 85 LEU H . 19490 1 369 . 1 1 85 85 LEU C C 13 179.891 0.150 . 1 . . . . 85 LEU C . 19490 1 370 . 1 1 85 85 LEU CA C 13 57.817 0.150 . 1 . . . . 85 LEU CA . 19490 1 371 . 1 1 85 85 LEU CB C 13 39.151 0.150 . 1 . . . . 85 LEU CB . 19490 1 372 . 1 1 85 85 LEU N N 15 114.290 0.150 . 1 . . . . 85 LEU N . 19490 1 373 . 1 1 86 86 ASP H H 1 8.277 0.015 . 1 . . . . 86 ASP H . 19490 1 374 . 1 1 86 86 ASP C C 13 179.420 0.150 . 1 . . . . 86 ASP C . 19490 1 375 . 1 1 86 86 ASP CA C 13 57.385 0.150 . 1 . . . . 86 ASP CA . 19490 1 376 . 1 1 86 86 ASP CB C 13 40.522 0.150 . 1 . . . . 86 ASP CB . 19490 1 377 . 1 1 86 86 ASP N N 15 117.469 0.150 . 1 . . . . 86 ASP N . 19490 1 378 . 1 1 87 87 ALA H H 1 7.343 0.015 . 1 . . . . 87 ALA H . 19490 1 379 . 1 1 87 87 ALA C C 13 179.591 0.150 . 1 . . . . 87 ALA C . 19490 1 380 . 1 1 87 87 ALA CA C 13 55.854 0.150 . 1 . . . . 87 ALA CA . 19490 1 381 . 1 1 87 87 ALA CB C 13 18.502 0.150 . 1 . . . . 87 ALA CB . 19490 1 382 . 1 1 87 87 ALA N N 15 122.304 0.150 . 1 . . . . 87 ALA N . 19490 1 383 . 1 1 88 88 VAL H H 1 7.485 0.015 . 1 . . . . 88 VAL H . 19490 1 384 . 1 1 88 88 VAL C C 13 178.732 0.150 . 1 . . . . 88 VAL C . 19490 1 385 . 1 1 88 88 VAL CA C 13 66.668 0.150 . 1 . . . . 88 VAL CA . 19490 1 386 . 1 1 88 88 VAL N N 15 116.029 0.150 . 1 . . . . 88 VAL N . 19490 1 387 . 1 1 89 89 ARG H H 1 7.559 0.015 . 1 . . . . 89 ARG H . 19490 1 388 . 1 1 89 89 ARG C C 13 179.810 0.150 . 1 . . . . 89 ARG C . 19490 1 389 . 1 1 89 89 ARG CA C 13 60.799 0.150 . 1 . . . . 89 ARG CA . 19490 1 390 . 1 1 89 89 ARG CB C 13 30.158 0.150 . 1 . . . . 89 ARG CB . 19490 1 391 . 1 1 89 89 ARG N N 15 120.066 0.150 . 1 . . . . 89 ARG N . 19490 1 392 . 1 1 90 90 GLU H H 1 7.976 0.015 . 1 . . . . 90 GLU H . 19490 1 393 . 1 1 90 90 GLU C C 13 180.702 0.150 . 1 . . . . 90 GLU C . 19490 1 394 . 1 1 90 90 GLU CA C 13 60.042 0.150 . 1 . . . . 90 GLU CA . 19490 1 395 . 1 1 90 90 GLU CB C 13 29.615 0.150 . 1 . . . . 90 GLU CB . 19490 1 396 . 1 1 90 90 GLU N N 15 120.037 0.150 . 1 . . . . 90 GLU N . 19490 1 397 . 1 1 91 91 MET H H 1 8.716 0.015 . 1 . . . . 91 MET H . 19490 1 398 . 1 1 91 91 MET C C 13 178.028 0.150 . 1 . . . . 91 MET C . 19490 1 399 . 1 1 91 91 MET CA C 13 59.870 0.150 . 1 . . . . 91 MET CA . 19490 1 400 . 1 1 91 91 MET CB C 13 34.369 0.150 . 1 . . . . 91 MET CB . 19490 1 401 . 1 1 91 91 MET N N 15 120.064 0.150 . 1 . . . . 91 MET N . 19490 1 402 . 1 1 92 92 ASN H H 1 7.853 0.015 . 1 . . . . 92 ASN H . 19490 1 403 . 1 1 92 92 ASN C C 13 175.983 0.150 . 1 . . . . 92 ASN C . 19490 1 404 . 1 1 92 92 ASN CA C 13 56.182 0.150 . 1 . . . . 92 ASN CA . 19490 1 405 . 1 1 92 92 ASN CB C 13 40.525 0.150 . 1 . . . . 92 ASN CB . 19490 1 406 . 1 1 92 92 ASN N N 15 113.194 0.150 . 1 . . . . 92 ASN N . 19490 1 407 . 1 1 93 93 ASP H H 1 7.336 0.015 . 1 . . . . 93 ASP H . 19490 1 408 . 1 1 93 93 ASP C C 13 177.702 0.150 . 1 . . . . 93 ASP C . 19490 1 409 . 1 1 93 93 ASP CA C 13 54.587 0.150 . 1 . . . . 93 ASP CA . 19490 1 410 . 1 1 93 93 ASP CB C 13 42.104 0.150 . 1 . . . . 93 ASP CB . 19490 1 411 . 1 1 93 93 ASP N N 15 116.575 0.150 . 1 . . . . 93 ASP N . 19490 1 412 . 1 1 94 94 LEU H H 1 7.419 0.015 . 1 . . . . 94 LEU H . 19490 1 413 . 1 1 94 94 LEU C C 13 176.335 0.150 . 1 . . . . 94 LEU C . 19490 1 414 . 1 1 94 94 LEU CA C 13 53.924 0.150 . 1 . . . . 94 LEU CA . 19490 1 415 . 1 1 94 94 LEU CB C 13 41.187 0.150 . 1 . . . . 94 LEU CB . 19490 1 416 . 1 1 94 94 LEU N N 15 124.824 0.150 . 1 . . . . 94 LEU N . 19490 1 417 . 1 1 95 95 PRO C C 13 179.238 0.150 . 1 . . . . 95 PRO C . 19490 1 418 . 1 1 95 95 PRO CA C 13 63.645 0.150 . 1 . . . . 95 PRO CA . 19490 1 419 . 1 1 95 95 PRO CB C 13 31.694 0.150 . 1 . . . . 95 PRO CB . 19490 1 420 . 1 1 96 96 ASP H H 1 8.997 0.015 . 1 . . . . 96 ASP H . 19490 1 421 . 1 1 96 96 ASP C C 13 176.174 0.150 . 1 . . . . 96 ASP C . 19490 1 422 . 1 1 96 96 ASP CA C 13 55.759 0.150 . 1 . . . . 96 ASP CA . 19490 1 423 . 1 1 96 96 ASP CB C 13 40.414 0.150 . 1 . . . . 96 ASP CB . 19490 1 424 . 1 1 96 96 ASP N N 15 121.462 0.150 . 1 . . . . 96 ASP N . 19490 1 425 . 1 1 97 97 THR H H 1 7.503 0.015 . 1 . . . . 97 THR H . 19490 1 426 . 1 1 97 97 THR C C 13 173.493 0.150 . 1 . . . . 97 THR C . 19490 1 427 . 1 1 97 97 THR CA C 13 62.942 0.150 . 1 . . . . 97 THR CA . 19490 1 428 . 1 1 97 97 THR CB C 13 71.790 0.150 . 1 . . . . 97 THR CB . 19490 1 429 . 1 1 97 97 THR N N 15 115.227 0.150 . 1 . . . . 97 THR N . 19490 1 430 . 1 1 98 98 GLN H H 1 8.951 0.015 . 1 . . . . 98 GLN H . 19490 1 431 . 1 1 98 98 GLN C C 13 175.380 0.150 . 1 . . . . 98 GLN C . 19490 1 432 . 1 1 98 98 GLN CA C 13 54.257 0.150 . 1 . . . . 98 GLN CA . 19490 1 433 . 1 1 98 98 GLN CB C 13 31.611 0.150 . 1 . . . . 98 GLN CB . 19490 1 434 . 1 1 98 98 GLN N N 15 125.180 0.150 . 1 . . . . 98 GLN N . 19490 1 435 . 1 1 99 99 VAL H H 1 8.232 0.015 . 1 . . . . 99 VAL H . 19490 1 436 . 1 1 99 99 VAL C C 13 175.678 0.150 . 1 . . . . 99 VAL C . 19490 1 437 . 1 1 99 99 VAL CA C 13 61.566 0.150 . 1 . . . . 99 VAL CA . 19490 1 438 . 1 1 99 99 VAL CB C 13 34.585 0.150 . 1 . . . . 99 VAL CB . 19490 1 439 . 1 1 99 99 VAL N N 15 123.153 0.150 . 1 . . . . 99 VAL N . 19490 1 440 . 1 1 100 100 PHE H H 1 8.906 0.015 . 1 . . . . 100 PHE H . 19490 1 441 . 1 1 100 100 PHE C C 13 175.496 0.150 . 1 . . . . 100 PHE C . 19490 1 442 . 1 1 100 100 PHE CA C 13 57.206 0.150 . 1 . . . . 100 PHE CA . 19490 1 443 . 1 1 100 100 PHE N N 15 124.185 0.150 . 1 . . . . 100 PHE N . 19490 1 444 . 1 1 101 101 ILE H H 1 8.735 0.015 . 1 . . . . 101 ILE H . 19490 1 445 . 1 1 101 101 ILE C C 13 175.089 0.150 . 1 . . . . 101 ILE C . 19490 1 446 . 1 1 101 101 ILE CA C 13 60.123 0.150 . 1 . . . . 101 ILE CA . 19490 1 447 . 1 1 101 101 ILE N N 15 124.456 0.150 . 1 . . . . 101 ILE N . 19490 1 448 . 1 1 102 102 CYS H H 1 8.467 0.015 . 1 . . . . 102 CYS H . 19490 1 449 . 1 1 102 102 CYS C C 13 173.995 0.150 . 1 . . . . 102 CYS C . 19490 1 450 . 1 1 102 102 CYS CA C 13 57.902 0.150 . 1 . . . . 102 CYS CA . 19490 1 451 . 1 1 102 102 CYS CB C 13 29.288 0.150 . 1 . . . . 102 CYS CB . 19490 1 452 . 1 1 102 102 CYS N N 15 128.733 0.150 . 1 . . . . 102 CYS N . 19490 1 453 . 1 1 103 103 THR H H 1 8.701 0.015 . 1 . . . . 103 THR H . 19490 1 454 . 1 1 103 103 THR CA C 13 59.163 0.150 . 1 . . . . 103 THR CA . 19490 1 455 . 1 1 103 103 THR CB C 13 70.805 0.150 . 1 . . . . 103 THR CB . 19490 1 456 . 1 1 103 103 THR N N 15 124.067 0.150 . 1 . . . . 103 THR N . 19490 1 457 . 1 1 105 105 PRO C C 13 176.558 0.150 . 1 . . . . 105 PRO C . 19490 1 458 . 1 1 105 105 PRO CA C 13 62.251 0.150 . 1 . . . . 105 PRO CA . 19490 1 459 . 1 1 105 105 PRO CB C 13 32.408 0.150 . 1 . . . . 105 PRO CB . 19490 1 460 . 1 1 106 106 LEU H H 1 6.459 0.015 . 1 . . . . 106 LEU H . 19490 1 461 . 1 1 106 106 LEU C C 13 178.194 0.150 . 1 . . . . 106 LEU C . 19490 1 462 . 1 1 106 106 LEU CA C 13 54.896 0.150 . 1 . . . . 106 LEU CA . 19490 1 463 . 1 1 106 106 LEU CB C 13 42.724 0.150 . 1 . . . . 106 LEU CB . 19490 1 464 . 1 1 106 106 LEU N N 15 118.743 0.150 . 1 . . . . 106 LEU N . 19490 1 465 . 1 1 107 107 LEU H H 1 8.240 0.015 . 1 . . . . 107 LEU H . 19490 1 466 . 1 1 107 107 LEU C C 13 181.269 0.150 . 1 . . . . 107 LEU C . 19490 1 467 . 1 1 107 107 LEU CA C 13 58.348 0.150 . 1 . . . . 107 LEU CA . 19490 1 468 . 1 1 107 107 LEU CB C 13 41.001 0.150 . 1 . . . . 107 LEU CB . 19490 1 469 . 1 1 107 107 LEU N N 15 121.421 0.150 . 1 . . . . 107 LEU N . 19490 1 470 . 1 1 108 108 LYS H H 1 7.848 0.015 . 1 . . . . 108 LYS H . 19490 1 471 . 1 1 108 108 LYS C C 13 175.849 0.150 . 1 . . . . 108 LYS C . 19490 1 472 . 1 1 108 108 LYS CA C 13 55.666 0.150 . 1 . . . . 108 LYS CA . 19490 1 473 . 1 1 108 108 LYS CB C 13 29.256 0.150 . 1 . . . . 108 LYS CB . 19490 1 474 . 1 1 108 108 LYS N N 15 118.991 0.150 . 1 . . . . 108 LYS N . 19490 1 475 . 1 1 109 109 TYR H H 1 6.646 0.015 . 1 . . . . 109 TYR H . 19490 1 476 . 1 1 109 109 TYR C C 13 178.259 0.150 . 1 . . . . 109 TYR C . 19490 1 477 . 1 1 109 109 TYR CA C 13 59.533 0.150 . 1 . . . . 109 TYR CA . 19490 1 478 . 1 1 109 109 TYR CB C 13 38.960 0.150 . 1 . . . . 109 TYR CB . 19490 1 479 . 1 1 109 109 TYR N N 15 123.566 0.150 . 1 . . . . 109 TYR N . 19490 1 480 . 1 1 110 110 HIS H H 1 7.544 0.015 . 1 . . . . 110 HIS H . 19490 1 481 . 1 1 110 110 HIS C C 13 177.164 0.150 . 1 . . . . 110 HIS C . 19490 1 482 . 1 1 110 110 HIS CA C 13 61.412 0.150 . 1 . . . . 110 HIS CA . 19490 1 483 . 1 1 110 110 HIS CB C 13 31.465 0.150 . 1 . . . . 110 HIS CB . 19490 1 484 . 1 1 110 110 HIS N N 15 118.597 0.150 . 1 . . . . 110 HIS N . 19490 1 485 . 1 1 111 111 HIS H H 1 8.408 0.015 . 1 . . . . 111 HIS H . 19490 1 486 . 1 1 111 111 HIS C C 13 176.293 0.150 . 1 . . . . 111 HIS C . 19490 1 487 . 1 1 111 111 HIS CA C 13 56.904 0.150 . 1 . . . . 111 HIS CA . 19490 1 488 . 1 1 111 111 HIS CB C 13 31.358 0.150 . 1 . . . . 111 HIS CB . 19490 1 489 . 1 1 111 111 HIS N N 15 116.640 0.150 . 1 . . . . 111 HIS N . 19490 1 490 . 1 1 112 112 CYS H H 1 8.252 0.015 . 1 . . . . 112 CYS H . 19490 1 491 . 1 1 112 112 CYS C C 13 175.886 0.150 . 1 . . . . 112 CYS C . 19490 1 492 . 1 1 112 112 CYS CA C 13 61.222 0.150 . 1 . . . . 112 CYS CA . 19490 1 493 . 1 1 112 112 CYS CB C 13 28.502 0.150 . 1 . . . . 112 CYS CB . 19490 1 494 . 1 1 112 112 CYS N N 15 117.688 0.150 . 1 . . . . 112 CYS N . 19490 1 495 . 1 1 113 113 VAL H H 1 7.338 0.015 . 1 . . . . 113 VAL H . 19490 1 496 . 1 1 113 113 VAL C C 13 177.309 0.150 . 1 . . . . 113 VAL C . 19490 1 497 . 1 1 113 113 VAL CA C 13 67.897 0.150 . 1 . . . . 113 VAL CA . 19490 1 498 . 1 1 113 113 VAL CB C 13 30.520 0.150 . 1 . . . . 113 VAL CB . 19490 1 499 . 1 1 113 113 VAL N N 15 114.345 0.150 . 1 . . . . 113 VAL N . 19490 1 500 . 1 1 114 114 GLY H H 1 8.299 0.015 . 1 . . . . 114 GLY H . 19490 1 501 . 1 1 114 114 GLY C C 13 178.264 0.150 . 1 . . . . 114 GLY C . 19490 1 502 . 1 1 114 114 GLY CA C 13 47.420 0.150 . 1 . . . . 114 GLY CA . 19490 1 503 . 1 1 114 114 GLY N N 15 105.952 0.150 . 1 . . . . 114 GLY N . 19490 1 504 . 1 1 115 115 GLU H H 1 7.509 0.015 . 1 . . . . 115 GLU H . 19490 1 505 . 1 1 115 115 GLU C C 13 179.728 0.150 . 1 . . . . 115 GLU C . 19490 1 506 . 1 1 115 115 GLU CA C 13 60.540 0.150 . 1 . . . . 115 GLU CA . 19490 1 507 . 1 1 115 115 GLU CB C 13 31.148 0.150 . 1 . . . . 115 GLU CB . 19490 1 508 . 1 1 115 115 GLU N N 15 120.012 0.150 . 1 . . . . 115 GLU N . 19490 1 509 . 1 1 116 116 LYS H H 1 8.103 0.015 . 1 . . . . 116 LYS H . 19490 1 510 . 1 1 116 116 LYS C C 13 179.459 0.150 . 1 . . . . 116 LYS C . 19490 1 511 . 1 1 116 116 LYS CA C 13 61.548 0.150 . 1 . . . . 116 LYS CA . 19490 1 512 . 1 1 116 116 LYS CB C 13 33.084 0.150 . 1 . . . . 116 LYS CB . 19490 1 513 . 1 1 116 116 LYS N N 15 119.085 0.150 . 1 . . . . 116 LYS N . 19490 1 514 . 1 1 117 117 TYR H H 1 7.046 0.015 . 1 . . . . 117 TYR H . 19490 1 515 . 1 1 117 117 TYR C C 13 178.529 0.150 . 1 . . . . 117 TYR C . 19490 1 516 . 1 1 117 117 TYR CA C 13 63.276 0.150 . 1 . . . . 117 TYR CA . 19490 1 517 . 1 1 117 117 TYR CB C 13 39.340 0.150 . 1 . . . . 117 TYR CB . 19490 1 518 . 1 1 117 117 TYR N N 15 118.481 0.150 . 1 . . . . 117 TYR N . 19490 1 519 . 1 1 118 118 ARG H H 1 7.759 0.015 . 1 . . . . 118 ARG H . 19490 1 520 . 1 1 118 118 ARG C C 13 179.526 0.150 . 1 . . . . 118 ARG C . 19490 1 521 . 1 1 118 118 ARG CA C 13 58.962 0.150 . 1 . . . . 118 ARG CA . 19490 1 522 . 1 1 118 118 ARG CB C 13 30.376 0.150 . 1 . . . . 118 ARG CB . 19490 1 523 . 1 1 118 118 ARG N N 15 118.549 0.150 . 1 . . . . 118 ARG N . 19490 1 524 . 1 1 119 119 TRP H H 1 8.969 0.015 . 1 . . . . 119 TRP H . 19490 1 525 . 1 1 119 119 TRP HE1 H 1 9.283 0.015 . 1 . . . . 119 TRP HE1 . 19490 1 526 . 1 1 119 119 TRP C C 13 180.796 0.150 . 1 . . . . 119 TRP C . 19490 1 527 . 1 1 119 119 TRP CA C 13 63.150 0.150 . 1 . . . . 119 TRP CA . 19490 1 528 . 1 1 119 119 TRP N N 15 122.486 0.150 . 1 . . . . 119 TRP N . 19490 1 529 . 1 1 119 119 TRP NE1 N 15 127.837 0.150 . 1 . . . . 119 TRP NE1 . 19490 1 530 . 1 1 120 120 VAL H H 1 8.035 0.015 . 1 . . . . 120 VAL H . 19490 1 531 . 1 1 120 120 VAL C C 13 178.584 0.150 . 1 . . . . 120 VAL C . 19490 1 532 . 1 1 120 120 VAL CA C 13 68.284 0.150 . 1 . . . . 120 VAL CA . 19490 1 533 . 1 1 120 120 VAL CB C 13 31.431 0.150 . 1 . . . . 120 VAL CB . 19490 1 534 . 1 1 120 120 VAL N N 15 119.146 0.150 . 1 . . . . 120 VAL N . 19490 1 535 . 1 1 121 121 GLU H H 1 8.437 0.015 . 1 . . . . 121 GLU H . 19490 1 536 . 1 1 121 121 GLU C C 13 178.583 0.150 . 1 . . . . 121 GLU C . 19490 1 537 . 1 1 121 121 GLU CA C 13 60.914 0.150 . 1 . . . . 121 GLU CA . 19490 1 538 . 1 1 121 121 GLU CB C 13 29.234 0.150 . 1 . . . . 121 GLU CB . 19490 1 539 . 1 1 121 121 GLU N N 15 122.995 0.150 . 1 . . . . 121 GLU N . 19490 1 540 . 1 1 122 122 GLN H H 1 8.358 0.015 . 1 . . . . 122 GLN H . 19490 1 541 . 1 1 122 122 GLN C C 13 178.106 0.150 . 1 . . . . 122 GLN C . 19490 1 542 . 1 1 122 122 GLN CA C 13 58.642 0.150 . 1 . . . . 122 GLN CA . 19490 1 543 . 1 1 122 122 GLN CB C 13 28.989 0.150 . 1 . . . . 122 GLN CB . 19490 1 544 . 1 1 122 122 GLN N N 15 115.564 0.150 . 1 . . . . 122 GLN N . 19490 1 545 . 1 1 123 123 HIS H H 1 7.735 0.015 . 1 . . . . 123 HIS H . 19490 1 546 . 1 1 123 123 HIS C C 13 176.150 0.150 . 1 . . . . 123 HIS C . 19490 1 547 . 1 1 123 123 HIS CA C 13 59.024 0.150 . 1 . . . . 123 HIS CA . 19490 1 548 . 1 1 123 123 HIS CB C 13 30.029 0.150 . 1 . . . . 123 HIS CB . 19490 1 549 . 1 1 123 123 HIS N N 15 113.906 0.150 . 1 . . . . 123 HIS N . 19490 1 550 . 1 1 124 124 LEU H H 1 8.236 0.015 . 1 . . . . 124 LEU H . 19490 1 551 . 1 1 124 124 LEU C C 13 177.546 0.150 . 1 . . . . 124 LEU C . 19490 1 552 . 1 1 124 124 LEU CA C 13 55.692 0.150 . 1 . . . . 124 LEU CA . 19490 1 553 . 1 1 124 124 LEU CB C 13 42.743 0.150 . 1 . . . . 124 LEU CB . 19490 1 554 . 1 1 124 124 LEU N N 15 118.729 0.150 . 1 . . . . 124 LEU N . 19490 1 555 . 1 1 125 125 GLY H H 1 7.699 0.015 . 1 . . . . 125 GLY H . 19490 1 556 . 1 1 125 125 GLY C C 13 174.342 0.150 . 1 . . . . 125 GLY C . 19490 1 557 . 1 1 125 125 GLY CA C 13 45.156 0.150 . 1 . . . . 125 GLY CA . 19490 1 558 . 1 1 125 125 GLY N N 15 109.232 0.150 . 1 . . . . 125 GLY N . 19490 1 559 . 1 1 126 126 PRO C C 13 180.302 0.150 . 1 . . . . 126 PRO C . 19490 1 560 . 1 1 126 126 PRO CA C 13 66.041 0.150 . 1 . . . . 126 PRO CA . 19490 1 561 . 1 1 126 126 PRO CB C 13 32.133 0.150 . 1 . . . . 126 PRO CB . 19490 1 562 . 1 1 127 127 GLN H H 1 9.320 0.015 . 1 . . . . 127 GLN H . 19490 1 563 . 1 1 127 127 GLN C C 13 178.680 0.150 . 1 . . . . 127 GLN C . 19490 1 564 . 1 1 127 127 GLN CA C 13 58.877 0.150 . 1 . . . . 127 GLN CA . 19490 1 565 . 1 1 127 127 GLN CB C 13 27.448 0.150 . 1 . . . . 127 GLN CB . 19490 1 566 . 1 1 127 127 GLN N N 15 118.894 0.150 . 1 . . . . 127 GLN N . 19490 1 567 . 1 1 128 128 PHE H H 1 7.574 0.015 . 1 . . . . 128 PHE H . 19490 1 568 . 1 1 128 128 PHE C C 13 178.936 0.150 . 1 . . . . 128 PHE C . 19490 1 569 . 1 1 128 128 PHE CA C 13 61.359 0.150 . 1 . . . . 128 PHE CA . 19490 1 570 . 1 1 128 128 PHE CB C 13 40.189 0.150 . 1 . . . . 128 PHE CB . 19490 1 571 . 1 1 128 128 PHE N N 15 116.368 0.150 . 1 . . . . 128 PHE N . 19490 1 572 . 1 1 129 129 VAL H H 1 7.481 0.015 . 1 . . . . 129 VAL H . 19490 1 573 . 1 1 129 129 VAL C C 13 179.928 0.150 . 1 . . . . 129 VAL C . 19490 1 574 . 1 1 129 129 VAL CA C 13 66.476 0.150 . 1 . . . . 129 VAL CA . 19490 1 575 . 1 1 129 129 VAL CB C 13 31.171 0.150 . 1 . . . . 129 VAL CB . 19490 1 576 . 1 1 129 129 VAL N N 15 122.999 0.150 . 1 . . . . 129 VAL N . 19490 1 577 . 1 1 130 130 GLU H H 1 7.266 0.015 . 1 . . . . 130 GLU H . 19490 1 578 . 1 1 130 130 GLU C C 13 177.085 0.150 . 1 . . . . 130 GLU C . 19490 1 579 . 1 1 130 130 GLU CA C 13 58.523 0.150 . 1 . . . . 130 GLU CA . 19490 1 580 . 1 1 130 130 GLU CB C 13 29.990 0.150 . 1 . . . . 130 GLU CB . 19490 1 581 . 1 1 130 130 GLU N N 15 115.666 0.150 . 1 . . . . 130 GLU N . 19490 1 582 . 1 1 131 131 ARG H H 1 7.368 0.015 . 1 . . . . 131 ARG H . 19490 1 583 . 1 1 131 131 ARG C C 13 175.748 0.150 . 1 . . . . 131 ARG C . 19490 1 584 . 1 1 131 131 ARG CA C 13 54.126 0.150 . 1 . . . . 131 ARG CA . 19490 1 585 . 1 1 131 131 ARG CB C 13 29.498 0.150 . 1 . . . . 131 ARG CB . 19490 1 586 . 1 1 131 131 ARG N N 15 117.727 0.150 . 1 . . . . 131 ARG N . 19490 1 587 . 1 1 132 132 ILE H H 1 6.959 0.015 . 1 . . . . 132 ILE H . 19490 1 588 . 1 1 132 132 ILE C C 13 177.006 0.150 . 1 . . . . 132 ILE C . 19490 1 589 . 1 1 132 132 ILE CA C 13 63.553 0.150 . 1 . . . . 132 ILE CA . 19490 1 590 . 1 1 132 132 ILE CB C 13 39.141 0.150 . 1 . . . . 132 ILE CB . 19490 1 591 . 1 1 132 132 ILE N N 15 121.198 0.150 . 1 . . . . 132 ILE N . 19490 1 592 . 1 1 133 133 ILE H H 1 9.393 0.015 . 1 . . . . 133 ILE H . 19490 1 593 . 1 1 133 133 ILE C C 13 175.552 0.150 . 1 . . . . 133 ILE C . 19490 1 594 . 1 1 133 133 ILE CA C 13 61.481 0.150 . 1 . . . . 133 ILE CA . 19490 1 595 . 1 1 133 133 ILE CB C 13 40.959 0.150 . 1 . . . . 133 ILE CB . 19490 1 596 . 1 1 133 133 ILE N N 15 132.058 0.150 . 1 . . . . 133 ILE N . 19490 1 597 . 1 1 134 134 LEU H H 1 8.837 0.015 . 1 . . . . 134 LEU H . 19490 1 598 . 1 1 134 134 LEU C C 13 176.838 0.150 . 1 . . . . 134 LEU C . 19490 1 599 . 1 1 134 134 LEU CA C 13 53.639 0.150 . 1 . . . . 134 LEU CA . 19490 1 600 . 1 1 134 134 LEU CB C 13 43.452 0.150 . 1 . . . . 134 LEU CB . 19490 1 601 . 1 1 134 134 LEU N N 15 130.122 0.150 . 1 . . . . 134 LEU N . 19490 1 602 . 1 1 135 135 THR H H 1 8.323 0.015 . 1 . . . . 135 THR H . 19490 1 603 . 1 1 135 135 THR C C 13 174.164 0.150 . 1 . . . . 135 THR C . 19490 1 604 . 1 1 135 135 THR CA C 13 59.287 0.150 . 1 . . . . 135 THR CA . 19490 1 605 . 1 1 135 135 THR CB C 13 69.289 0.150 . 1 . . . . 135 THR CB . 19490 1 606 . 1 1 135 135 THR N N 15 115.088 0.150 . 1 . . . . 135 THR N . 19490 1 607 . 1 1 136 136 ARG H H 1 9.856 0.015 . 1 . . . . 136 ARG H . 19490 1 608 . 1 1 136 136 ARG C C 13 175.858 0.150 . 1 . . . . 136 ARG C . 19490 1 609 . 1 1 136 136 ARG CA C 13 57.035 0.150 . 1 . . . . 136 ARG CA . 19490 1 610 . 1 1 136 136 ARG CB C 13 28.969 0.150 . 1 . . . . 136 ARG CB . 19490 1 611 . 1 1 136 136 ARG N N 15 127.883 0.150 . 1 . . . . 136 ARG N . 19490 1 612 . 1 1 137 137 ASP H H 1 8.525 0.015 . 1 . . . . 137 ASP H . 19490 1 613 . 1 1 137 137 ASP C C 13 177.162 0.150 . 1 . . . . 137 ASP C . 19490 1 614 . 1 1 137 137 ASP CA C 13 52.975 0.150 . 1 . . . . 137 ASP CA . 19490 1 615 . 1 1 137 137 ASP CB C 13 42.346 0.150 . 1 . . . . 137 ASP CB . 19490 1 616 . 1 1 137 137 ASP N N 15 121.732 0.150 . 1 . . . . 137 ASP N . 19490 1 617 . 1 1 138 138 LYS H H 1 9.890 0.015 . 1 . . . . 138 LYS H . 19490 1 618 . 1 1 138 138 LYS C C 13 178.726 0.150 . 1 . . . . 138 LYS C . 19490 1 619 . 1 1 138 138 LYS CA C 13 58.358 0.150 . 1 . . . . 138 LYS CA . 19490 1 620 . 1 1 138 138 LYS CB C 13 31.412 0.150 . 1 . . . . 138 LYS CB . 19490 1 621 . 1 1 138 138 LYS N N 15 124.660 0.150 . 1 . . . . 138 LYS N . 19490 1 622 . 1 1 139 139 THR H H 1 8.983 0.015 . 1 . . . . 139 THR H . 19490 1 623 . 1 1 139 139 THR C C 13 175.468 0.150 . 1 . . . . 139 THR C . 19490 1 624 . 1 1 139 139 THR CA C 13 65.227 0.150 . 1 . . . . 139 THR CA . 19490 1 625 . 1 1 139 139 THR CB C 13 68.374 0.150 . 1 . . . . 139 THR CB . 19490 1 626 . 1 1 139 139 THR N N 15 112.404 0.150 . 1 . . . . 139 THR N . 19490 1 627 . 1 1 140 140 VAL H H 1 6.178 0.015 . 1 . . . . 140 VAL H . 19490 1 628 . 1 1 140 140 VAL C C 13 173.044 0.150 . 1 . . . . 140 VAL C . 19490 1 629 . 1 1 140 140 VAL CA C 13 60.749 0.150 . 1 . . . . 140 VAL CA . 19490 1 630 . 1 1 140 140 VAL CB C 13 29.691 0.150 . 1 . . . . 140 VAL CB . 19490 1 631 . 1 1 140 140 VAL N N 15 109.404 0.150 . 1 . . . . 140 VAL N . 19490 1 632 . 1 1 141 141 VAL H H 1 6.986 0.015 . 1 . . . . 141 VAL H . 19490 1 633 . 1 1 141 141 VAL C C 13 175.940 0.150 . 1 . . . . 141 VAL C . 19490 1 634 . 1 1 141 141 VAL CA C 13 61.942 0.150 . 1 . . . . 141 VAL CA . 19490 1 635 . 1 1 141 141 VAL CB C 13 31.479 0.150 . 1 . . . . 141 VAL CB . 19490 1 636 . 1 1 141 141 VAL N N 15 121.421 0.150 . 1 . . . . 141 VAL N . 19490 1 637 . 1 1 142 142 LEU H H 1 8.944 0.015 . 1 . . . . 142 LEU H . 19490 1 638 . 1 1 142 142 LEU C C 13 177.188 0.150 . 1 . . . . 142 LEU C . 19490 1 639 . 1 1 142 142 LEU CA C 13 54.493 0.150 . 1 . . . . 142 LEU CA . 19490 1 640 . 1 1 142 142 LEU CB C 13 42.977 0.150 . 1 . . . . 142 LEU CB . 19490 1 641 . 1 1 142 142 LEU N N 15 129.016 0.150 . 1 . . . . 142 LEU N . 19490 1 642 . 1 1 143 143 GLY H H 1 7.446 0.015 . 1 . . . . 143 GLY H . 19490 1 643 . 1 1 143 143 GLY C C 13 171.854 0.150 . 1 . . . . 143 GLY C . 19490 1 644 . 1 1 143 143 GLY CA C 13 45.056 0.150 . 1 . . . . 143 GLY CA . 19490 1 645 . 1 1 143 143 GLY N N 15 107.767 0.150 . 1 . . . . 143 GLY N . 19490 1 646 . 1 1 144 144 ASP H H 1 9.059 0.015 . 1 . . . . 144 ASP H . 19490 1 647 . 1 1 144 144 ASP C C 13 178.733 0.150 . 1 . . . . 144 ASP C . 19490 1 648 . 1 1 144 144 ASP CA C 13 57.389 0.150 . 1 . . . . 144 ASP CA . 19490 1 649 . 1 1 144 144 ASP N N 15 117.759 0.150 . 1 . . . . 144 ASP N . 19490 1 650 . 1 1 145 145 LEU H H 1 7.773 0.015 . 1 . . . . 145 LEU H . 19490 1 651 . 1 1 145 145 LEU C C 13 174.440 0.150 . 1 . . . . 145 LEU C . 19490 1 652 . 1 1 145 145 LEU CA C 13 53.617 0.150 . 1 . . . . 145 LEU CA . 19490 1 653 . 1 1 145 145 LEU N N 15 119.694 0.150 . 1 . . . . 145 LEU N . 19490 1 654 . 1 1 146 146 LEU H H 1 8.654 0.015 . 1 . . . . 146 LEU H . 19490 1 655 . 1 1 146 146 LEU C C 13 175.639 0.150 . 1 . . . . 146 LEU C . 19490 1 656 . 1 1 146 146 LEU CA C 13 54.061 0.150 . 1 . . . . 146 LEU CA . 19490 1 657 . 1 1 146 146 LEU N N 15 124.811 0.150 . 1 . . . . 146 LEU N . 19490 1 658 . 1 1 147 147 ILE H H 1 8.752 0.015 . 1 . . . . 147 ILE H . 19490 1 659 . 1 1 147 147 ILE C C 13 174.654 0.150 . 1 . . . . 147 ILE C . 19490 1 660 . 1 1 147 147 ILE CA C 13 61.256 0.150 . 1 . . . . 147 ILE CA . 19490 1 661 . 1 1 147 147 ILE N N 15 129.811 0.150 . 1 . . . . 147 ILE N . 19490 1 662 . 1 1 148 148 ASP H H 1 8.056 0.015 . 1 . . . . 148 ASP H . 19490 1 663 . 1 1 148 148 ASP C C 13 177.079 0.150 . 1 . . . . 148 ASP C . 19490 1 664 . 1 1 148 148 ASP CA C 13 55.260 0.150 . 1 . . . . 148 ASP CA . 19490 1 665 . 1 1 148 148 ASP CB C 13 46.032 0.150 . 1 . . . . 148 ASP CB . 19490 1 666 . 1 1 148 148 ASP N N 15 126.701 0.150 . 1 . . . . 148 ASP N . 19490 1 667 . 1 1 149 149 ASP H H 1 9.306 0.015 . 1 . . . . 149 ASP H . 19490 1 668 . 1 1 149 149 ASP C C 13 175.386 0.150 . 1 . . . . 149 ASP C . 19490 1 669 . 1 1 149 149 ASP CA C 13 55.658 0.150 . 1 . . . . 149 ASP CA . 19490 1 670 . 1 1 149 149 ASP CB C 13 41.471 0.150 . 1 . . . . 149 ASP CB . 19490 1 671 . 1 1 149 149 ASP N N 15 128.848 0.150 . 1 . . . . 149 ASP N . 19490 1 672 . 1 1 150 150 LYS H H 1 9.569 0.015 . 1 . . . . 150 LYS H . 19490 1 673 . 1 1 150 150 LYS C C 13 176.324 0.150 . 1 . . . . 150 LYS C . 19490 1 674 . 1 1 150 150 LYS CA C 13 58.847 0.150 . 1 . . . . 150 LYS CA . 19490 1 675 . 1 1 150 150 LYS CB C 13 32.585 0.150 . 1 . . . . 150 LYS CB . 19490 1 676 . 1 1 150 150 LYS N N 15 128.468 0.150 . 1 . . . . 150 LYS N . 19490 1 677 . 1 1 151 151 ASP H H 1 8.001 0.015 . 1 . . . . 151 ASP H . 19490 1 678 . 1 1 151 151 ASP C C 13 176.756 0.150 . 1 . . . . 151 ASP C . 19490 1 679 . 1 1 151 151 ASP CA C 13 57.529 0.150 . 1 . . . . 151 ASP CA . 19490 1 680 . 1 1 151 151 ASP CB C 13 41.190 0.150 . 1 . . . . 151 ASP CB . 19490 1 681 . 1 1 151 151 ASP N N 15 119.318 0.150 . 1 . . . . 151 ASP N . 19490 1 682 . 1 1 152 152 THR H H 1 6.874 0.015 . 1 . . . . 152 THR H . 19490 1 683 . 1 1 152 152 THR C C 13 172.996 0.150 . 1 . . . . 152 THR C . 19490 1 684 . 1 1 152 152 THR CA C 13 61.334 0.150 . 1 . . . . 152 THR CA . 19490 1 685 . 1 1 152 152 THR CB C 13 71.751 0.150 . 1 . . . . 152 THR CB . 19490 1 686 . 1 1 152 152 THR N N 15 112.444 0.150 . 1 . . . . 152 THR N . 19490 1 687 . 1 1 153 153 VAL H H 1 8.623 0.015 . 1 . . . . 153 VAL H . 19490 1 688 . 1 1 153 153 VAL C C 13 175.169 0.150 . 1 . . . . 153 VAL C . 19490 1 689 . 1 1 153 153 VAL CA C 13 62.545 0.150 . 1 . . . . 153 VAL CA . 19490 1 690 . 1 1 153 153 VAL CB C 13 31.513 0.150 . 1 . . . . 153 VAL CB . 19490 1 691 . 1 1 153 153 VAL N N 15 129.027 0.150 . 1 . . . . 153 VAL N . 19490 1 692 . 1 1 154 154 ARG H H 1 8.542 0.015 . 1 . . . . 154 ARG H . 19490 1 693 . 1 1 154 154 ARG C C 13 176.631 0.150 . 1 . . . . 154 ARG C . 19490 1 694 . 1 1 154 154 ARG CA C 13 54.191 0.150 . 1 . . . . 154 ARG CA . 19490 1 695 . 1 1 154 154 ARG CB C 13 33.939 0.150 . 1 . . . . 154 ARG CB . 19490 1 696 . 1 1 154 154 ARG N N 15 125.689 0.150 . 1 . . . . 154 ARG N . 19490 1 697 . 1 1 155 155 GLY H H 1 8.130 0.015 . 1 . . . . 155 GLY H . 19490 1 698 . 1 1 155 155 GLY C C 13 173.968 0.150 . 1 . . . . 155 GLY C . 19490 1 699 . 1 1 155 155 GLY CA C 13 46.032 0.150 . 1 . . . . 155 GLY CA . 19490 1 700 . 1 1 155 155 GLY N N 15 110.698 0.150 . 1 . . . . 155 GLY N . 19490 1 701 . 1 1 156 156 GLN H H 1 10.661 0.015 . 1 . . . . 156 GLN H . 19490 1 702 . 1 1 156 156 GLN C C 13 177.669 0.150 . 1 . . . . 156 GLN C . 19490 1 703 . 1 1 156 156 GLN CA C 13 58.369 0.150 . 1 . . . . 156 GLN CA . 19490 1 704 . 1 1 156 156 GLN CB C 13 29.127 0.150 . 1 . . . . 156 GLN CB . 19490 1 705 . 1 1 156 156 GLN N N 15 122.599 0.150 . 1 . . . . 156 GLN N . 19490 1 706 . 1 1 157 157 GLU H H 1 8.284 0.015 . 1 . . . . 157 GLU H . 19490 1 707 . 1 1 157 157 GLU C C 13 176.153 0.150 . 1 . . . . 157 GLU C . 19490 1 708 . 1 1 157 157 GLU CA C 13 54.731 0.150 . 1 . . . . 157 GLU CA . 19490 1 709 . 1 1 157 157 GLU CB C 13 29.120 0.150 . 1 . . . . 157 GLU CB . 19490 1 710 . 1 1 157 157 GLU N N 15 121.432 0.150 . 1 . . . . 157 GLU N . 19490 1 711 . 1 1 158 158 GLU H H 1 8.309 0.015 . 1 . . . . 158 GLU H . 19490 1 712 . 1 1 158 158 GLU C C 13 177.874 0.150 . 1 . . . . 158 GLU C . 19490 1 713 . 1 1 158 158 GLU CA C 13 59.297 0.150 . 1 . . . . 158 GLU CA . 19490 1 714 . 1 1 158 158 GLU CB C 13 29.913 0.150 . 1 . . . . 158 GLU CB . 19490 1 715 . 1 1 158 158 GLU N N 15 127.902 0.150 . 1 . . . . 158 GLU N . 19490 1 716 . 1 1 159 159 THR H H 1 8.571 0.015 . 1 . . . . 159 THR H . 19490 1 717 . 1 1 159 159 THR C C 13 172.493 0.150 . 1 . . . . 159 THR C . 19490 1 718 . 1 1 159 159 THR CA C 13 58.323 0.150 . 1 . . . . 159 THR CA . 19490 1 719 . 1 1 159 159 THR CB C 13 69.574 0.150 . 1 . . . . 159 THR CB . 19490 1 720 . 1 1 159 159 THR N N 15 113.815 0.150 . 1 . . . . 159 THR N . 19490 1 721 . 1 1 160 160 PRO C C 13 176.243 0.150 . 1 . . . . 160 PRO C . 19490 1 722 . 1 1 160 160 PRO CA C 13 62.192 0.150 . 1 . . . . 160 PRO CA . 19490 1 723 . 1 1 160 160 PRO CB C 13 30.919 0.150 . 1 . . . . 160 PRO CB . 19490 1 724 . 1 1 161 161 SER H H 1 8.908 0.015 . 1 . . . . 161 SER H . 19490 1 725 . 1 1 161 161 SER C C 13 175.371 0.150 . 1 . . . . 161 SER C . 19490 1 726 . 1 1 161 161 SER CA C 13 60.968 0.150 . 1 . . . . 161 SER CA . 19490 1 727 . 1 1 161 161 SER CB C 13 64.396 0.150 . 1 . . . . 161 SER CB . 19490 1 728 . 1 1 161 161 SER N N 15 116.659 0.150 . 1 . . . . 161 SER N . 19490 1 729 . 1 1 162 162 TRP H H 1 6.173 0.015 . 1 . . . . 162 TRP H . 19490 1 730 . 1 1 162 162 TRP HE1 H 1 9.840 0.015 . 1 . . . . 162 TRP HE1 . 19490 1 731 . 1 1 162 162 TRP C C 13 177.488 0.150 . 1 . . . . 162 TRP C . 19490 1 732 . 1 1 162 162 TRP CA C 13 52.683 0.150 . 1 . . . . 162 TRP CA . 19490 1 733 . 1 1 162 162 TRP CB C 13 31.238 0.150 . 1 . . . . 162 TRP CB . 19490 1 734 . 1 1 162 162 TRP N N 15 117.415 0.150 . 1 . . . . 162 TRP N . 19490 1 735 . 1 1 162 162 TRP NE1 N 15 130.066 0.150 . 1 . . . . 162 TRP NE1 . 19490 1 736 . 1 1 163 163 GLU H H 1 7.703 0.015 . 1 . . . . 163 GLU H . 19490 1 737 . 1 1 163 163 GLU C C 13 177.494 0.150 . 1 . . . . 163 GLU C . 19490 1 738 . 1 1 163 163 GLU CA C 13 55.009 0.150 . 1 . . . . 163 GLU CA . 19490 1 739 . 1 1 163 163 GLU CB C 13 30.715 0.150 . 1 . . . . 163 GLU CB . 19490 1 740 . 1 1 163 163 GLU N N 15 120.008 0.150 . 1 . . . . 163 GLU N . 19490 1 741 . 1 1 164 164 HIS H H 1 9.550 0.015 . 1 . . . . 164 HIS H . 19490 1 742 . 1 1 164 164 HIS C C 13 175.724 0.150 . 1 . . . . 164 HIS C . 19490 1 743 . 1 1 164 164 HIS CA C 13 54.450 0.150 . 1 . . . . 164 HIS CA . 19490 1 744 . 1 1 164 164 HIS CB C 13 32.633 0.150 . 1 . . . . 164 HIS CB . 19490 1 745 . 1 1 164 164 HIS N N 15 130.633 0.150 . 1 . . . . 164 HIS N . 19490 1 746 . 1 1 165 165 ILE H H 1 9.641 0.015 . 1 . . . . 165 ILE H . 19490 1 747 . 1 1 165 165 ILE C C 13 174.119 0.150 . 1 . . . . 165 ILE C . 19490 1 748 . 1 1 165 165 ILE CA C 13 57.713 0.150 . 1 . . . . 165 ILE CA . 19490 1 749 . 1 1 165 165 ILE CB C 13 36.183 0.150 . 1 . . . . 165 ILE CB . 19490 1 750 . 1 1 165 165 ILE N N 15 134.978 0.150 . 1 . . . . 165 ILE N . 19490 1 751 . 1 1 166 166 LEU H H 1 7.697 0.015 . 1 . . . . 166 LEU H . 19490 1 752 . 1 1 166 166 LEU C C 13 175.344 0.150 . 1 . . . . 166 LEU C . 19490 1 753 . 1 1 166 166 LEU CA C 13 54.977 0.150 . 1 . . . . 166 LEU CA . 19490 1 754 . 1 1 166 166 LEU CB C 13 42.252 0.150 . 1 . . . . 166 LEU CB . 19490 1 755 . 1 1 166 166 LEU N N 15 128.981 0.150 . 1 . . . . 166 LEU N . 19490 1 756 . 1 1 167 167 PHE H H 1 7.511 0.015 . 1 . . . . 167 PHE H . 19490 1 757 . 1 1 167 167 PHE C C 13 176.370 0.150 . 1 . . . . 167 PHE C . 19490 1 758 . 1 1 167 167 PHE CA C 13 58.279 0.150 . 1 . . . . 167 PHE CA . 19490 1 759 . 1 1 167 167 PHE CB C 13 41.587 0.150 . 1 . . . . 167 PHE CB . 19490 1 760 . 1 1 167 167 PHE N N 15 132.215 0.150 . 1 . . . . 167 PHE N . 19490 1 761 . 1 1 168 168 THR H H 1 7.131 0.015 . 1 . . . . 168 THR H . 19490 1 762 . 1 1 168 168 THR C C 13 172.439 0.150 . 1 . . . . 168 THR C . 19490 1 763 . 1 1 168 168 THR CA C 13 65.966 0.150 . 1 . . . . 168 THR CA . 19490 1 764 . 1 1 168 168 THR CB C 13 68.354 0.150 . 1 . . . . 168 THR CB . 19490 1 765 . 1 1 168 168 THR N N 15 126.174 0.150 . 1 . . . . 168 THR N . 19490 1 766 . 1 1 169 169 CYS H H 1 8.645 0.015 . 1 . . . . 169 CYS H . 19490 1 767 . 1 1 169 169 CYS C C 13 174.958 0.150 . 1 . . . . 169 CYS C . 19490 1 768 . 1 1 169 169 CYS CA C 13 57.585 0.150 . 1 . . . . 169 CYS CA . 19490 1 769 . 1 1 169 169 CYS CB C 13 31.611 0.150 . 1 . . . . 169 CYS CB . 19490 1 770 . 1 1 169 169 CYS N N 15 128.082 0.150 . 1 . . . . 169 CYS N . 19490 1 771 . 1 1 170 170 CYS C C 13 175.769 0.150 . 1 . . . . 170 CYS C . 19490 1 772 . 1 1 170 170 CYS CA C 13 60.645 0.150 . 1 . . . . 170 CYS CA . 19490 1 773 . 1 1 170 170 CYS CB C 13 27.160 0.150 . 1 . . . . 170 CYS CB . 19490 1 774 . 1 1 171 171 HIS H H 1 6.392 0.015 . 1 . . . . 171 HIS H . 19490 1 775 . 1 1 171 171 HIS C C 13 176.223 0.150 . 1 . . . . 171 HIS C . 19490 1 776 . 1 1 171 171 HIS CA C 13 56.810 0.150 . 1 . . . . 171 HIS CA . 19490 1 777 . 1 1 171 171 HIS CB C 13 32.515 0.150 . 1 . . . . 171 HIS CB . 19490 1 778 . 1 1 171 171 HIS N N 15 115.466 0.150 . 1 . . . . 171 HIS N . 19490 1 779 . 1 1 172 172 ASN H H 1 7.204 0.015 . 1 . . . . 172 ASN H . 19490 1 780 . 1 1 172 172 ASN C C 13 179.379 0.150 . 1 . . . . 172 ASN C . 19490 1 781 . 1 1 172 172 ASN CA C 13 52.579 0.150 . 1 . . . . 172 ASN CA . 19490 1 782 . 1 1 172 172 ASN CB C 13 39.699 0.150 . 1 . . . . 172 ASN CB . 19490 1 783 . 1 1 172 172 ASN N N 15 114.797 0.150 . 1 . . . . 172 ASN N . 19490 1 784 . 1 1 173 173 ARG H H 1 7.310 0.015 . 1 . . . . 173 ARG H . 19490 1 785 . 1 1 173 173 ARG C C 13 176.791 0.150 . 1 . . . . 173 ARG C . 19490 1 786 . 1 1 173 173 ARG CB C 13 29.892 0.150 . 1 . . . . 173 ARG CB . 19490 1 787 . 1 1 173 173 ARG N N 15 123.216 0.150 . 1 . . . . 173 ARG N . 19490 1 788 . 1 1 174 174 HIS C C 13 176.244 0.150 . 1 . . . . 174 HIS C . 19490 1 789 . 1 1 174 174 HIS CA C 13 56.921 0.150 . 1 . . . . 174 HIS CA . 19490 1 790 . 1 1 174 174 HIS CB C 13 30.358 0.150 . 1 . . . . 174 HIS CB . 19490 1 791 . 1 1 175 175 LEU H H 1 6.744 0.015 . 1 . . . . 175 LEU H . 19490 1 792 . 1 1 175 175 LEU C C 13 177.260 0.150 . 1 . . . . 175 LEU C . 19490 1 793 . 1 1 175 175 LEU CA C 13 55.624 0.150 . 1 . . . . 175 LEU CA . 19490 1 794 . 1 1 175 175 LEU CB C 13 42.196 0.150 . 1 . . . . 175 LEU CB . 19490 1 795 . 1 1 175 175 LEU N N 15 122.193 0.150 . 1 . . . . 175 LEU N . 19490 1 796 . 1 1 176 176 VAL H H 1 8.428 0.015 . 1 . . . . 176 VAL H . 19490 1 797 . 1 1 176 176 VAL C C 13 176.766 0.150 . 1 . . . . 176 VAL C . 19490 1 798 . 1 1 176 176 VAL CA C 13 62.586 0.150 . 1 . . . . 176 VAL CA . 19490 1 799 . 1 1 176 176 VAL CB C 13 31.436 0.150 . 1 . . . . 176 VAL CB . 19490 1 800 . 1 1 176 176 VAL N N 15 127.607 0.150 . 1 . . . . 176 VAL N . 19490 1 801 . 1 1 177 177 LEU H H 1 8.255 0.015 . 1 . . . . 177 LEU H . 19490 1 802 . 1 1 177 177 LEU C C 13 175.698 0.150 . 1 . . . . 177 LEU C . 19490 1 803 . 1 1 177 177 LEU CA C 13 52.833 0.150 . 1 . . . . 177 LEU CA . 19490 1 804 . 1 1 177 177 LEU CB C 13 41.451 0.150 . 1 . . . . 177 LEU CB . 19490 1 805 . 1 1 177 177 LEU N N 15 129.617 0.150 . 1 . . . . 177 LEU N . 19490 1 806 . 1 1 179 179 PRO C C 13 177.887 0.150 . 1 . . . . 179 PRO C . 19490 1 807 . 1 1 179 179 PRO CA C 13 65.113 0.150 . 1 . . . . 179 PRO CA . 19490 1 808 . 1 1 179 179 PRO CB C 13 31.840 0.150 . 1 . . . . 179 PRO CB . 19490 1 809 . 1 1 180 180 THR H H 1 7.013 0.015 . 1 . . . . 180 THR H . 19490 1 810 . 1 1 180 180 THR C C 13 175.459 0.150 . 1 . . . . 180 THR C . 19490 1 811 . 1 1 180 180 THR CA C 13 62.471 0.150 . 1 . . . . 180 THR CA . 19490 1 812 . 1 1 180 180 THR CB C 13 69.292 0.150 . 1 . . . . 180 THR CB . 19490 1 813 . 1 1 180 180 THR N N 15 105.866 0.150 . 1 . . . . 180 THR N . 19490 1 814 . 1 1 181 181 ARG H H 1 7.750 0.015 . 1 . . . . 181 ARG H . 19490 1 815 . 1 1 181 181 ARG C C 13 175.706 0.150 . 1 . . . . 181 ARG C . 19490 1 816 . 1 1 181 181 ARG CA C 13 55.075 0.150 . 1 . . . . 181 ARG CA . 19490 1 817 . 1 1 181 181 ARG CB C 13 32.105 0.150 . 1 . . . . 181 ARG CB . 19490 1 818 . 1 1 181 181 ARG N N 15 122.760 0.150 . 1 . . . . 181 ARG N . 19490 1 819 . 1 1 182 182 ARG H H 1 9.336 0.015 . 1 . . . . 182 ARG H . 19490 1 820 . 1 1 182 182 ARG C C 13 175.805 0.150 . 1 . . . . 182 ARG C . 19490 1 821 . 1 1 182 182 ARG CA C 13 56.762 0.150 . 1 . . . . 182 ARG CA . 19490 1 822 . 1 1 182 182 ARG CB C 13 33.861 0.150 . 1 . . . . 182 ARG CB . 19490 1 823 . 1 1 182 182 ARG N N 15 121.619 0.150 . 1 . . . . 182 ARG N . 19490 1 824 . 1 1 183 183 ARG H H 1 8.360 0.015 . 1 . . . . 183 ARG H . 19490 1 825 . 1 1 183 183 ARG C C 13 175.922 0.150 . 1 . . . . 183 ARG C . 19490 1 826 . 1 1 183 183 ARG CA C 13 54.117 0.150 . 1 . . . . 183 ARG CA . 19490 1 827 . 1 1 183 183 ARG CB C 13 35.097 0.150 . 1 . . . . 183 ARG CB . 19490 1 828 . 1 1 183 183 ARG N N 15 122.678 0.150 . 1 . . . . 183 ARG N . 19490 1 829 . 1 1 184 184 LEU H H 1 8.302 0.015 . 1 . . . . 184 LEU H . 19490 1 830 . 1 1 184 184 LEU C C 13 178.879 0.150 . 1 . . . . 184 LEU C . 19490 1 831 . 1 1 184 184 LEU CA C 13 52.971 0.150 . 1 . . . . 184 LEU CA . 19490 1 832 . 1 1 184 184 LEU CB C 13 44.672 0.150 . 1 . . . . 184 LEU CB . 19490 1 833 . 1 1 184 184 LEU N N 15 124.359 0.150 . 1 . . . . 184 LEU N . 19490 1 834 . 1 1 185 185 LEU H H 1 10.481 0.015 . 1 . . . . 185 LEU H . 19490 1 835 . 1 1 185 185 LEU C C 13 177.824 0.150 . 1 . . . . 185 LEU C . 19490 1 836 . 1 1 185 185 LEU CA C 13 58.002 0.150 . 1 . . . . 185 LEU CA . 19490 1 837 . 1 1 185 185 LEU CB C 13 41.775 0.150 . 1 . . . . 185 LEU CB . 19490 1 838 . 1 1 185 185 LEU N N 15 130.548 0.150 . 1 . . . . 185 LEU N . 19490 1 839 . 1 1 186 186 SER H H 1 7.330 0.015 . 1 . . . . 186 SER H . 19490 1 840 . 1 1 186 186 SER C C 13 175.173 0.150 . 1 . . . . 186 SER C . 19490 1 841 . 1 1 186 186 SER CA C 13 58.406 0.150 . 1 . . . . 186 SER CA . 19490 1 842 . 1 1 186 186 SER CB C 13 63.616 0.150 . 1 . . . . 186 SER CB . 19490 1 843 . 1 1 186 186 SER N N 15 109.094 0.150 . 1 . . . . 186 SER N . 19490 1 844 . 1 1 187 187 TRP H H 1 9.578 0.015 . 1 . . . . 187 TRP H . 19490 1 845 . 1 1 187 187 TRP HE1 H 1 10.724 0.015 . 1 . . . . 187 TRP HE1 . 19490 1 846 . 1 1 187 187 TRP C C 13 176.723 0.150 . 1 . . . . 187 TRP C . 19490 1 847 . 1 1 187 187 TRP CA C 13 60.078 0.150 . 1 . . . . 187 TRP CA . 19490 1 848 . 1 1 187 187 TRP CB C 13 29.337 0.150 . 1 . . . . 187 TRP CB . 19490 1 849 . 1 1 187 187 TRP N N 15 119.585 0.150 . 1 . . . . 187 TRP N . 19490 1 850 . 1 1 187 187 TRP NE1 N 15 134.231 0.150 . 1 . . . . 187 TRP NE1 . 19490 1 851 . 1 1 188 188 SER H H 1 8.528 0.015 . 1 . . . . 188 SER H . 19490 1 852 . 1 1 188 188 SER C C 13 175.632 0.150 . 1 . . . . 188 SER C . 19490 1 853 . 1 1 188 188 SER CA C 13 59.589 0.150 . 1 . . . . 188 SER CA . 19490 1 854 . 1 1 188 188 SER CB C 13 64.171 0.150 . 1 . . . . 188 SER CB . 19490 1 855 . 1 1 188 188 SER N N 15 113.736 0.150 . 1 . . . . 188 SER N . 19490 1 856 . 1 1 189 189 ASP H H 1 7.196 0.015 . 1 . . . . 189 ASP H . 19490 1 857 . 1 1 189 189 ASP C C 13 176.348 0.150 . 1 . . . . 189 ASP C . 19490 1 858 . 1 1 189 189 ASP CA C 13 53.335 0.150 . 1 . . . . 189 ASP CA . 19490 1 859 . 1 1 189 189 ASP CB C 13 42.897 0.150 . 1 . . . . 189 ASP CB . 19490 1 860 . 1 1 189 189 ASP N N 15 122.731 0.150 . 1 . . . . 189 ASP N . 19490 1 861 . 1 1 190 190 ASN H H 1 8.975 0.015 . 1 . . . . 190 ASN H . 19490 1 862 . 1 1 190 190 ASN C C 13 176.712 0.150 . 1 . . . . 190 ASN C . 19490 1 863 . 1 1 190 190 ASN CA C 13 53.238 0.150 . 1 . . . . 190 ASN CA . 19490 1 864 . 1 1 190 190 ASN CB C 13 36.714 0.150 . 1 . . . . 190 ASN CB . 19490 1 865 . 1 1 190 190 ASN N N 15 120.154 0.150 . 1 . . . . 190 ASN N . 19490 1 866 . 1 1 191 191 TRP H H 1 8.350 0.015 . 1 . . . . 191 TRP H . 19490 1 867 . 1 1 191 191 TRP HE1 H 1 10.754 0.015 . 1 . . . . 191 TRP HE1 . 19490 1 868 . 1 1 191 191 TRP C C 13 179.229 0.150 . 1 . . . . 191 TRP C . 19490 1 869 . 1 1 191 191 TRP CA C 13 58.588 0.150 . 1 . . . . 191 TRP CA . 19490 1 870 . 1 1 191 191 TRP CB C 13 29.008 0.150 . 1 . . . . 191 TRP CB . 19490 1 871 . 1 1 191 191 TRP N N 15 123.839 0.150 . 1 . . . . 191 TRP N . 19490 1 872 . 1 1 191 191 TRP NE1 N 15 132.359 0.150 . 1 . . . . 191 TRP NE1 . 19490 1 873 . 1 1 192 192 ARG H H 1 7.714 0.015 . 1 . . . . 192 ARG H . 19490 1 874 . 1 1 192 192 ARG C C 13 179.154 0.150 . 1 . . . . 192 ARG C . 19490 1 875 . 1 1 192 192 ARG CA C 13 60.647 0.150 . 1 . . . . 192 ARG CA . 19490 1 876 . 1 1 192 192 ARG CB C 13 28.620 0.150 . 1 . . . . 192 ARG CB . 19490 1 877 . 1 1 192 192 ARG N N 15 125.939 0.150 . 1 . . . . 192 ARG N . 19490 1 878 . 1 1 193 193 GLU H H 1 7.396 0.015 . 1 . . . . 193 GLU H . 19490 1 879 . 1 1 193 193 GLU C C 13 180.224 0.150 . 1 . . . . 193 GLU C . 19490 1 880 . 1 1 193 193 GLU CA C 13 59.339 0.150 . 1 . . . . 193 GLU CA . 19490 1 881 . 1 1 193 193 GLU CB C 13 29.502 0.150 . 1 . . . . 193 GLU CB . 19490 1 882 . 1 1 193 193 GLU N N 15 118.626 0.150 . 1 . . . . 193 GLU N . 19490 1 883 . 1 1 194 194 ILE H H 1 6.996 0.015 . 1 . . . . 194 ILE H . 19490 1 884 . 1 1 194 194 ILE C C 13 180.363 0.150 . 1 . . . . 194 ILE C . 19490 1 885 . 1 1 194 194 ILE CA C 13 65.253 0.150 . 1 . . . . 194 ILE CA . 19490 1 886 . 1 1 194 194 ILE CB C 13 37.239 0.150 . 1 . . . . 194 ILE CB . 19490 1 887 . 1 1 194 194 ILE N N 15 119.580 0.150 . 1 . . . . 194 ILE N . 19490 1 888 . 1 1 195 195 LEU H H 1 7.946 0.015 . 1 . . . . 195 LEU H . 19490 1 889 . 1 1 195 195 LEU C C 13 179.875 0.150 . 1 . . . . 195 LEU C . 19490 1 890 . 1 1 195 195 LEU CA C 13 60.545 0.150 . 1 . . . . 195 LEU CA . 19490 1 891 . 1 1 195 195 LEU CB C 13 41.703 0.150 . 1 . . . . 195 LEU CB . 19490 1 892 . 1 1 195 195 LEU N N 15 123.418 0.150 . 1 . . . . 195 LEU N . 19490 1 893 . 1 1 196 196 ASP H H 1 8.370 0.015 . 1 . . . . 196 ASP H . 19490 1 894 . 1 1 196 196 ASP C C 13 180.343 0.150 . 1 . . . . 196 ASP C . 19490 1 895 . 1 1 196 196 ASP CA C 13 57.997 0.150 . 1 . . . . 196 ASP CA . 19490 1 896 . 1 1 196 196 ASP CB C 13 39.891 0.150 . 1 . . . . 196 ASP CB . 19490 1 897 . 1 1 196 196 ASP N N 15 117.398 0.150 . 1 . . . . 196 ASP N . 19490 1 898 . 1 1 197 197 SER H H 1 7.942 0.015 . 1 . . . . 197 SER H . 19490 1 899 . 1 1 197 197 SER C C 13 176.187 0.150 . 1 . . . . 197 SER C . 19490 1 900 . 1 1 197 197 SER CA C 13 61.485 0.150 . 1 . . . . 197 SER CA . 19490 1 901 . 1 1 197 197 SER CB C 13 63.843 0.150 . 1 . . . . 197 SER CB . 19490 1 902 . 1 1 197 197 SER N N 15 116.672 0.150 . 1 . . . . 197 SER N . 19490 1 903 . 1 1 198 198 LYS H H 1 7.577 0.015 . 1 . . . . 198 LYS H . 19490 1 904 . 1 1 198 198 LYS C C 13 177.537 0.150 . 1 . . . . 198 LYS C . 19490 1 905 . 1 1 198 198 LYS CA C 13 54.143 0.150 . 1 . . . . 198 LYS CA . 19490 1 906 . 1 1 198 198 LYS CB C 13 31.031 0.150 . 1 . . . . 198 LYS CB . 19490 1 907 . 1 1 198 198 LYS N N 15 120.318 0.150 . 1 . . . . 198 LYS N . 19490 1 908 . 1 1 199 199 ARG H H 1 7.469 0.015 . 1 . . . . 199 ARG H . 19490 1 909 . 1 1 199 199 ARG C C 13 177.918 0.150 . 1 . . . . 199 ARG C . 19490 1 910 . 1 1 199 199 ARG CA C 13 57.909 0.150 . 1 . . . . 199 ARG CA . 19490 1 911 . 1 1 199 199 ARG CB C 13 30.197 0.150 . 1 . . . . 199 ARG CB . 19490 1 912 . 1 1 199 199 ARG N N 15 119.462 0.150 . 1 . . . . 199 ARG N . 19490 1 913 . 1 1 200 200 GLY H H 1 8.182 0.015 . 1 . . . . 200 GLY H . 19490 1 914 . 1 1 200 200 GLY C C 13 174.797 0.150 . 1 . . . . 200 GLY C . 19490 1 915 . 1 1 200 200 GLY CA C 13 45.886 0.150 . 1 . . . . 200 GLY CA . 19490 1 916 . 1 1 200 200 GLY N N 15 109.168 0.150 . 1 . . . . 200 GLY N . 19490 1 917 . 1 1 201 201 ALA H H 1 7.948 0.015 . 1 . . . . 201 ALA H . 19490 1 918 . 1 1 201 201 ALA C C 13 178.471 0.150 . 1 . . . . 201 ALA C . 19490 1 919 . 1 1 201 201 ALA CA C 13 52.939 0.150 . 1 . . . . 201 ALA CA . 19490 1 920 . 1 1 201 201 ALA CB C 13 19.480 0.150 . 1 . . . . 201 ALA CB . 19490 1 921 . 1 1 201 201 ALA N N 15 123.990 0.150 . 1 . . . . 201 ALA N . 19490 1 922 . 1 1 202 202 ALA H H 1 8.172 0.015 . 1 . . . . 202 ALA H . 19490 1 923 . 1 1 202 202 ALA C C 13 178.559 0.150 . 1 . . . . 202 ALA C . 19490 1 924 . 1 1 202 202 ALA CA C 13 52.953 0.150 . 1 . . . . 202 ALA CA . 19490 1 925 . 1 1 202 202 ALA CB C 13 19.331 0.150 . 1 . . . . 202 ALA CB . 19490 1 926 . 1 1 202 202 ALA N N 15 123.428 0.150 . 1 . . . . 202 ALA N . 19490 1 927 . 1 1 203 203 GLN H H 1 8.161 0.015 . 1 . . . . 203 GLN H . 19490 1 928 . 1 1 203 203 GLN C C 13 176.605 0.150 . 1 . . . . 203 GLN C . 19490 1 929 . 1 1 203 203 GLN CA C 13 56.166 0.150 . 1 . . . . 203 GLN CA . 19490 1 930 . 1 1 203 203 GLN CB C 13 29.471 0.150 . 1 . . . . 203 GLN CB . 19490 1 931 . 1 1 203 203 GLN N N 15 119.940 0.150 . 1 . . . . 203 GLN N . 19490 1 932 . 1 1 204 204 ARG H H 1 8.213 0.015 . 1 . . . . 204 ARG H . 19490 1 933 . 1 1 204 204 ARG C C 13 176.141 0.150 . 1 . . . . 204 ARG C . 19490 1 934 . 1 1 204 204 ARG CA C 13 56.469 0.150 . 1 . . . . 204 ARG CA . 19490 1 935 . 1 1 204 204 ARG CB C 13 30.912 0.150 . 1 . . . . 204 ARG CB . 19490 1 936 . 1 1 204 204 ARG N N 15 123.309 0.150 . 1 . . . . 204 ARG N . 19490 1 937 . 1 1 205 205 GLU H H 1 7.932 0.015 . 1 . . . . 205 GLU H . 19490 1 938 . 1 1 205 205 GLU C C 13 181.884 0.150 . 1 . . . . 205 GLU C . 19490 1 939 . 1 1 205 205 GLU CA C 13 58.431 0.150 . 1 . . . . 205 GLU CA . 19490 1 940 . 1 1 205 205 GLU CB C 13 31.038 0.150 . 1 . . . . 205 GLU CB . 19490 1 941 . 1 1 205 205 GLU N N 15 127.711 0.150 . 1 . . . . 205 GLU N . 19490 1 stop_ save_