data_4407 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4407 _Entry.Title ; NMR chemical shift assignment of human GAIP (Galpha Interacting Protein): A regulator of G protein signaling ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 1999-09-15 _Entry.Accession_date 1999-09-16 _Entry.Last_release_date 1999-11-11 _Entry.Original_release_date 1999-11-11 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 E. 'de Alba' . . . 4407 2 L. 'De Vries' . . . 4407 3 M. Farquhar . G. . 4407 4 N. Tjandra . . . 4407 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4407 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 452 4407 '15N chemical shifts' 125 4407 '1H chemical shifts' 899 4407 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 . . 1999-11-11 1999-09-15 original author . 4407 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4407 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 99384138 _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; de Alba, E., De Vries, L., Farquhar, M., and Tjandra, N., "Solution structure of human GAIP (G alpha interacting protein). A regulator of G protein signaling," J. Mol. Biol. 291, 927-939 (1999). ; _Citation.Title ; Solution structure of human GAIP (G alpha interacting protein). A regulator of G protein signaling ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of Molecular Biology' _Citation.Journal_volume 291 _Citation.Journal_issue 4 _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 927 _Citation.Page_last 939 _Citation.Year 1999 _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 E. 'de Alba' . . . 4407 1 2 L. 'De Vries' . . . 4407 1 3 M. Farquhar . . . 4407 1 4 N. Tjandra . . . 4407 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'dipolar couplings' 4407 1 GAIP 4407 1 'G protein' 4407 1 NMR 4407 1 RGS 4407 1 stop_ save_ save_ref_1 _Citation.Sf_category citations _Citation.Sf_framecode ref_1 _Citation.Entry_ID 4407 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 10452897 _Citation.Full_citation 'J. Mol. Biol. 1999. 291,927-939' _Citation.Title 'Solution structure of human GAIP (Galpha interacting protein): a regulator of G protein signaling.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 291 _Citation.Journal_issue 4 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0022-2836 _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 927 _Citation.Page_last 939 _Citation.Year 1999 _Citation.Details ; The solution structure of the human protein GAIP (Galpha interacting protein), a regulator of G protein signaling, has been determined by NMR techniques. Dipolar couplings of the oriented protein in two different liquid crystal media have been used in the structure calculation. The solution structure of GAIP is compared to the crystal structure of an homologous protein from rat (RGS4) complexed to the alpha-subunit of a G protein. Some of RGS4 residues involved in the Galpha-RGS binding interface have similar orientations in GAIP (free form), indicating that upon binding these residues do not suffer conformational rearrangements, and therefore, their role does not seem to be restricted to Galpha interaction but also to RGS folding and stability. We suggest that other structural differences between the two proteins may be related to the process of binding as well as to a distinct efficiency in their respective GTPase activating function. ; 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 E 'de Alba' E. . . 4407 2 2 L 'De Vries' L. . . 4407 2 3 'M G' Farquhar M. G. . 4407 2 4 N Tjandra N. . . 4407 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_GAIP _Assembly.Sf_category assembly _Assembly.Sf_framecode system_GAIP _Assembly.Entry_ID 4407 _Assembly.ID 1 _Assembly.Name 'Gaip protein' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not reported' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID unknown 4407 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 gaip 1 $GAIP . . . native . . . . . 4407 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 1CMZ . 'Chain A, Solution Structure Of Gaip (Galpha Interacting Protein): A Regulator Of G Protein Signaling' . . . . 4407 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID GAIP abbreviation 4407 1 'Gaip protein' system 4407 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'Regulator of G protein signaling' 4407 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_GAIP _Entity.Sf_category entity _Entity.Sf_framecode GAIP _Entity.Entry_ID 4407 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Gaip protein' _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 ; GSPGISGGGGGIPSPEEVQS WAQSFDKLMHSPAGRSVFRA FLRTEYSEENMLFWLACEEL KAEANQHVVDEKARLIYEDY VSILSPKEVSLDSRVREGIN KKMQEPSAHTFDDAQLQIYT LMHRDSYPRFLSSPTYRALL PWVDSSSSLIHRD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 153 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 17321 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details ; A 153 residue protein. Only 128 residues correspong to the native sequence of GAIP, the rest are artifacts from protein engineering ; _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-24 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 1CMZ . "Solution Structure Of Gaip (Galpha Interacting Protein): A Regulator Of G Protein Signaling" . . . . . 99.35 152 100.00 100.00 3.20e-107 . . . . 4407 1 2 no EMBL CAG33711 . "RGS19 [Homo sapiens]" . . . . . 84.97 217 97.69 97.69 1.16e-86 . . . . 4407 1 3 no GB AAI23822 . "Regulator of G-protein signaling 19 [Bos taurus]" . . . . . 81.70 223 97.60 98.40 2.20e-82 . . . . 4407 1 4 no GB EDL07441 . "regulator of G-protein signaling 19, isoform CRA_a [Mus musculus]" . . . . . 50.33 160 98.70 98.70 4.11e-46 . . . . 4407 1 5 no GB EDL07445 . "regulator of G-protein signaling 19, isoform CRA_e [Mus musculus]" . . . . . 50.33 103 98.70 98.70 1.04e-46 . . . . 4407 1 6 no GB EPY87810 . "regulator of G-protein signaling 19-like protein [Camelus ferus]" . . . . . 83.66 202 97.66 98.44 1.38e-84 . . . . 4407 1 7 no REF NP_001070383 . "regulator of G-protein signaling 19 [Bos taurus]" . . . . . 81.70 223 97.60 98.40 2.20e-82 . . . . 4407 1 8 no REF XP_003462829 . "PREDICTED: regulator of G-protein signaling 19 isoform X1 [Cavia porcellus]" . . . . . 83.66 264 98.44 99.22 2.76e-85 . . . . 4407 1 9 no REF XP_003787844 . "PREDICTED: regulator of G-protein signaling 19 isoform X1 [Otolemur garnettii]" . . . . . 84.97 217 96.92 97.69 3.32e-85 . . . . 4407 1 10 no REF XP_005214874 . "PREDICTED: regulator of G-protein signaling 19 isoform X1 [Bos taurus]" . . . . . 81.70 368 97.60 98.40 2.32e-80 . . . . 4407 1 11 no REF XP_006045501 . "PREDICTED: regulator of G-protein signaling 19 isoform X1 [Bubalus bubalis]" . . . . . 81.70 221 97.60 98.40 2.62e-82 . . . . 4407 1 12 no SP Q08DC7 . "RecName: Full=Regulator of G-protein signaling 19; Short=RGS19" . . . . . 81.70 223 97.60 98.40 2.20e-82 . . . . 4407 1 13 no TPG DAA23284 . "TPA: regulator of G-protein signaling 19 [Bos taurus]" . . . . . 81.70 223 97.60 98.40 2.20e-82 . . . . 4407 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID GAIP abbreviation 4407 1 'Gaip protein' common 4407 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 . GLY . 4407 1 2 . SER . 4407 1 3 . PRO . 4407 1 4 . GLY . 4407 1 5 . ILE . 4407 1 6 . SER . 4407 1 7 . GLY . 4407 1 8 . GLY . 4407 1 9 . GLY . 4407 1 10 . GLY . 4407 1 11 . GLY . 4407 1 12 . ILE . 4407 1 13 . PRO . 4407 1 14 . SER . 4407 1 15 . PRO . 4407 1 16 . GLU . 4407 1 17 . GLU . 4407 1 18 . VAL . 4407 1 19 . GLN . 4407 1 20 . SER . 4407 1 21 . TRP . 4407 1 22 . ALA . 4407 1 23 . GLN . 4407 1 24 . SER . 4407 1 25 . PHE . 4407 1 26 . ASP . 4407 1 27 . LYS . 4407 1 28 . LEU . 4407 1 29 . MET . 4407 1 30 . HIS . 4407 1 31 . SER . 4407 1 32 . PRO . 4407 1 33 . ALA . 4407 1 34 . GLY . 4407 1 35 . ARG . 4407 1 36 . SER . 4407 1 37 . VAL . 4407 1 38 . PHE . 4407 1 39 . ARG . 4407 1 40 . ALA . 4407 1 41 . PHE . 4407 1 42 . LEU . 4407 1 43 . ARG . 4407 1 44 . THR . 4407 1 45 . GLU . 4407 1 46 . TYR . 4407 1 47 . SER . 4407 1 48 . GLU . 4407 1 49 . GLU . 4407 1 50 . ASN . 4407 1 51 . MET . 4407 1 52 . LEU . 4407 1 53 . PHE . 4407 1 54 . TRP . 4407 1 55 . LEU . 4407 1 56 . ALA . 4407 1 57 . CYS . 4407 1 58 . GLU . 4407 1 59 . GLU . 4407 1 60 . LEU . 4407 1 61 . LYS . 4407 1 62 . ALA . 4407 1 63 . GLU . 4407 1 64 . ALA . 4407 1 65 . ASN . 4407 1 66 . GLN . 4407 1 67 . HIS . 4407 1 68 . VAL . 4407 1 69 . VAL . 4407 1 70 . ASP . 4407 1 71 . GLU . 4407 1 72 . LYS . 4407 1 73 . ALA . 4407 1 74 . ARG . 4407 1 75 . LEU . 4407 1 76 . ILE . 4407 1 77 . TYR . 4407 1 78 . GLU . 4407 1 79 . ASP . 4407 1 80 . TYR . 4407 1 81 . VAL . 4407 1 82 . SER . 4407 1 83 . ILE . 4407 1 84 . LEU . 4407 1 85 . SER . 4407 1 86 . PRO . 4407 1 87 . LYS . 4407 1 88 . GLU . 4407 1 89 . VAL . 4407 1 90 . SER . 4407 1 91 . LEU . 4407 1 92 . ASP . 4407 1 93 . SER . 4407 1 94 . ARG . 4407 1 95 . VAL . 4407 1 96 . ARG . 4407 1 97 . GLU . 4407 1 98 . GLY . 4407 1 99 . ILE . 4407 1 100 . ASN . 4407 1 101 . LYS . 4407 1 102 . LYS . 4407 1 103 . MET . 4407 1 104 . GLN . 4407 1 105 . GLU . 4407 1 106 . PRO . 4407 1 107 . SER . 4407 1 108 . ALA . 4407 1 109 . HIS . 4407 1 110 . THR . 4407 1 111 . PHE . 4407 1 112 . ASP . 4407 1 113 . ASP . 4407 1 114 . ALA . 4407 1 115 . GLN . 4407 1 116 . LEU . 4407 1 117 . GLN . 4407 1 118 . ILE . 4407 1 119 . TYR . 4407 1 120 . THR . 4407 1 121 . LEU . 4407 1 122 . MET . 4407 1 123 . HIS . 4407 1 124 . ARG . 4407 1 125 . ASP . 4407 1 126 . SER . 4407 1 127 . TYR . 4407 1 128 . PRO . 4407 1 129 . ARG . 4407 1 130 . PHE . 4407 1 131 . LEU . 4407 1 132 . SER . 4407 1 133 . SER . 4407 1 134 . PRO . 4407 1 135 . THR . 4407 1 136 . TYR . 4407 1 137 . ARG . 4407 1 138 . ALA . 4407 1 139 . LEU . 4407 1 140 . LEU . 4407 1 141 . PRO . 4407 1 142 . TRP . 4407 1 143 . VAL . 4407 1 144 . ASP . 4407 1 145 . SER . 4407 1 146 . SER . 4407 1 147 . SER . 4407 1 148 . SER . 4407 1 149 . LEU . 4407 1 150 . ILE . 4407 1 151 . HIS . 4407 1 152 . ARG . 4407 1 153 . ASP . 4407 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 4407 1 . SER 2 2 4407 1 . PRO 3 3 4407 1 . GLY 4 4 4407 1 . ILE 5 5 4407 1 . SER 6 6 4407 1 . GLY 7 7 4407 1 . GLY 8 8 4407 1 . GLY 9 9 4407 1 . GLY 10 10 4407 1 . GLY 11 11 4407 1 . ILE 12 12 4407 1 . PRO 13 13 4407 1 . SER 14 14 4407 1 . PRO 15 15 4407 1 . GLU 16 16 4407 1 . GLU 17 17 4407 1 . VAL 18 18 4407 1 . GLN 19 19 4407 1 . SER 20 20 4407 1 . TRP 21 21 4407 1 . ALA 22 22 4407 1 . GLN 23 23 4407 1 . SER 24 24 4407 1 . PHE 25 25 4407 1 . ASP 26 26 4407 1 . LYS 27 27 4407 1 . LEU 28 28 4407 1 . MET 29 29 4407 1 . HIS 30 30 4407 1 . SER 31 31 4407 1 . PRO 32 32 4407 1 . ALA 33 33 4407 1 . GLY 34 34 4407 1 . ARG 35 35 4407 1 . SER 36 36 4407 1 . VAL 37 37 4407 1 . PHE 38 38 4407 1 . ARG 39 39 4407 1 . ALA 40 40 4407 1 . PHE 41 41 4407 1 . LEU 42 42 4407 1 . ARG 43 43 4407 1 . THR 44 44 4407 1 . GLU 45 45 4407 1 . TYR 46 46 4407 1 . SER 47 47 4407 1 . GLU 48 48 4407 1 . GLU 49 49 4407 1 . ASN 50 50 4407 1 . MET 51 51 4407 1 . LEU 52 52 4407 1 . PHE 53 53 4407 1 . TRP 54 54 4407 1 . LEU 55 55 4407 1 . ALA 56 56 4407 1 . CYS 57 57 4407 1 . GLU 58 58 4407 1 . GLU 59 59 4407 1 . LEU 60 60 4407 1 . LYS 61 61 4407 1 . ALA 62 62 4407 1 . GLU 63 63 4407 1 . ALA 64 64 4407 1 . ASN 65 65 4407 1 . GLN 66 66 4407 1 . HIS 67 67 4407 1 . VAL 68 68 4407 1 . VAL 69 69 4407 1 . ASP 70 70 4407 1 . GLU 71 71 4407 1 . LYS 72 72 4407 1 . ALA 73 73 4407 1 . ARG 74 74 4407 1 . LEU 75 75 4407 1 . ILE 76 76 4407 1 . TYR 77 77 4407 1 . GLU 78 78 4407 1 . ASP 79 79 4407 1 . TYR 80 80 4407 1 . VAL 81 81 4407 1 . SER 82 82 4407 1 . ILE 83 83 4407 1 . LEU 84 84 4407 1 . SER 85 85 4407 1 . PRO 86 86 4407 1 . LYS 87 87 4407 1 . GLU 88 88 4407 1 . VAL 89 89 4407 1 . SER 90 90 4407 1 . LEU 91 91 4407 1 . ASP 92 92 4407 1 . SER 93 93 4407 1 . ARG 94 94 4407 1 . VAL 95 95 4407 1 . ARG 96 96 4407 1 . GLU 97 97 4407 1 . GLY 98 98 4407 1 . ILE 99 99 4407 1 . ASN 100 100 4407 1 . LYS 101 101 4407 1 . LYS 102 102 4407 1 . MET 103 103 4407 1 . GLN 104 104 4407 1 . GLU 105 105 4407 1 . PRO 106 106 4407 1 . SER 107 107 4407 1 . ALA 108 108 4407 1 . HIS 109 109 4407 1 . THR 110 110 4407 1 . PHE 111 111 4407 1 . ASP 112 112 4407 1 . ASP 113 113 4407 1 . ALA 114 114 4407 1 . GLN 115 115 4407 1 . LEU 116 116 4407 1 . GLN 117 117 4407 1 . ILE 118 118 4407 1 . TYR 119 119 4407 1 . THR 120 120 4407 1 . LEU 121 121 4407 1 . MET 122 122 4407 1 . HIS 123 123 4407 1 . ARG 124 124 4407 1 . ASP 125 125 4407 1 . SER 126 126 4407 1 . TYR 127 127 4407 1 . PRO 128 128 4407 1 . ARG 129 129 4407 1 . PHE 130 130 4407 1 . LEU 131 131 4407 1 . SER 132 132 4407 1 . SER 133 133 4407 1 . PRO 134 134 4407 1 . THR 135 135 4407 1 . TYR 136 136 4407 1 . ARG 137 137 4407 1 . ALA 138 138 4407 1 . LEU 139 139 4407 1 . LEU 140 140 4407 1 . PRO 141 141 4407 1 . TRP 142 142 4407 1 . VAL 143 143 4407 1 . ASP 144 144 4407 1 . SER 145 145 4407 1 . SER 146 146 4407 1 . SER 147 147 4407 1 . SER 148 148 4407 1 . LEU 149 149 4407 1 . ILE 150 150 4407 1 . HIS 151 151 4407 1 . ARG 152 152 4407 1 . ASP 153 153 4407 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 4407 _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 $GAIP . 9606 . . 'homo sapiens' human . . Eukaryota Metazoa homo sapiens . . . . . . . . . . . . . . . . . . . . . 4407 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 4407 _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 $GAIP . 'recombinant technology' 'Escherichia coli' 'Escherichia coli' . . Escherichia coli BL21 DE3 . . . . . . . . . . . plasmid . . pGEX-2T . . . . . . 4407 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 4407 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Gaip protein' '[U-13C; U-15N]' . . 1 $GAIP . . . 0.6 1.0 mM . . . . 4407 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_cond_1 _Sample_condition_list.Entry_ID 4407 _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' 5 . mM 4407 1 pH 7.2 0.0 n/a 4407 1 temperature 300 0.1 K 4407 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 4407 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 4407 _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 NMR_spectrometer Bruker DMX . 600 . . . 4407 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 4407 _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 CBCACONH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4407 1 2 CBCANH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4407 1 3 HBHACONH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4407 1 4 HNCA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4407 1 5 HCCH-TOCSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4407 1 6 C-CNOESY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4407 1 7 N-CNOESY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4407 1 8 H-HNOESY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4407 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 4407 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name CBCACONH _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 4407 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name CBCANH _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 4407 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HBHACONH _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 4407 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HNCA _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 4407 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name HCCH-TOCSY _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 4407 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name C-CNOESY _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 4407 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name N-CNOESY _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 4407 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name H-HNOESY _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 . _NMR_spec_expt.NMR_spectrometer_label . _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 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 4407 _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 0.0 . indirect 0.251449530 . . . . . . . . . 4407 1 H 1 TSP 'methyl protons' . . . . ppm 0.0 external direct 1.0 external_to_the_sample cylindrical parallel_to_Bo . . . . . . 4407 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 4407 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_chem_shift _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift _Assigned_chem_shift_list.Entry_ID 4407 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 4407 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 13 13 PRO HA H 1 4.60 . . 1 . . . . . . . . 4407 1 2 . 1 1 13 13 PRO HB2 H 1 2.22 . . 2 . . . . . . . . 4407 1 3 . 1 1 13 13 PRO HB3 H 1 1.81 . . 2 . . . . . . . . 4407 1 4 . 1 1 13 13 PRO HG2 H 1 1.97 . . 1 . . . . . . . . 4407 1 5 . 1 1 13 13 PRO HG3 H 1 1.97 . . 1 . . . . . . . . 4407 1 6 . 1 1 13 13 PRO HD2 H 1 3.89 . . 1 . . . . . . . . 4407 1 7 . 1 1 13 13 PRO HD3 H 1 3.89 . . 1 . . . . . . . . 4407 1 8 . 1 1 13 13 PRO CA C 13 62.53 . . 1 . . . . . . . . 4407 1 9 . 1 1 13 13 PRO CB C 13 32.17 . . 1 . . . . . . . . 4407 1 10 . 1 1 13 13 PRO CG C 13 29.22 . . 1 . . . . . . . . 4407 1 11 . 1 1 13 13 PRO CD C 13 50.34 . . 1 . . . . . . . . 4407 1 12 . 1 1 14 14 SER HA H 1 4.65 . . 1 . . . . . . . . 4407 1 13 . 1 1 14 14 SER HB2 H 1 4.35 . . 2 . . . . . . . . 4407 1 14 . 1 1 14 14 SER HB3 H 1 4.09 . . 2 . . . . . . . . 4407 1 15 . 1 1 14 14 SER H H 1 8.67 . . 1 . . . . . . . . 4407 1 16 . 1 1 14 14 SER CA C 13 56.66 . . 1 . . . . . . . . 4407 1 17 . 1 1 14 14 SER CB C 13 63.35 . . 1 . . . . . . . . 4407 1 18 . 1 1 14 14 SER N N 15 118.21 . . 1 . . . . . . . . 4407 1 19 . 1 1 15 15 PRO HA H 1 4.11 . . 1 . . . . . . . . 4407 1 20 . 1 1 15 15 PRO HB2 H 1 2.19 . . 2 . . . . . . . . 4407 1 21 . 1 1 15 15 PRO HB3 H 1 1.86 . . 2 . . . . . . . . 4407 1 22 . 1 1 15 15 PRO HG2 H 1 2.15 . . 2 . . . . . . . . 4407 1 23 . 1 1 15 15 PRO HG3 H 1 2.02 . . 2 . . . . . . . . 4407 1 24 . 1 1 15 15 PRO HD2 H 1 3.89 . . 1 . . . . . . . . 4407 1 25 . 1 1 15 15 PRO HD3 H 1 3.89 . . 1 . . . . . . . . 4407 1 26 . 1 1 15 15 PRO CA C 13 65.70 . . 1 . . . . . . . . 4407 1 27 . 1 1 15 15 PRO CB C 13 31.75 . . 1 . . . . . . . . 4407 1 28 . 1 1 15 15 PRO CG C 13 27.86 . . 1 . . . . . . . . 4407 1 29 . 1 1 15 15 PRO CD C 13 50.23 . . 1 . . . . . . . . 4407 1 30 . 1 1 16 16 GLU HA H 1 3.92 . . 1 . . . . . . . . 4407 1 31 . 1 1 16 16 GLU HB2 H 1 2.04 . . 2 . . . . . . . . 4407 1 32 . 1 1 16 16 GLU HB3 H 1 1.92 . . 2 . . . . . . . . 4407 1 33 . 1 1 16 16 GLU HG2 H 1 2.23 . . 2 . . . . . . . . 4407 1 34 . 1 1 16 16 GLU HG3 H 1 2.37 . . 2 . . . . . . . . 4407 1 35 . 1 1 16 16 GLU H H 1 8.59 . . 1 . . . . . . . . 4407 1 36 . 1 1 16 16 GLU CA C 13 60.12 . . 1 . . . . . . . . 4407 1 37 . 1 1 16 16 GLU CB C 13 28.87 . . 1 . . . . . . . . 4407 1 38 . 1 1 16 16 GLU CG C 13 36.90 . . 1 . . . . . . . . 4407 1 39 . 1 1 16 16 GLU N N 15 116.23 . . 1 . . . . . . . . 4407 1 40 . 1 1 17 17 GLU HA H 1 3.84 . . 1 . . . . . . . . 4407 1 41 . 1 1 17 17 GLU HB2 H 1 2.14 . . 2 . . . . . . . . 4407 1 42 . 1 1 17 17 GLU HB3 H 1 1.95 . . 2 . . . . . . . . 4407 1 43 . 1 1 17 17 GLU HG2 H 1 2.27 . . 1 . . . . . . . . 4407 1 44 . 1 1 17 17 GLU HG3 H 1 2.27 . . 1 . . . . . . . . 4407 1 45 . 1 1 17 17 GLU H H 1 7.77 . . 1 . . . . . . . . 4407 1 46 . 1 1 17 17 GLU CA C 13 59.20 . . 1 . . . . . . . . 4407 1 47 . 1 1 17 17 GLU CB C 13 29.37 . . 1 . . . . . . . . 4407 1 48 . 1 1 17 17 GLU CG C 13 36.36 . . 1 . . . . . . . . 4407 1 49 . 1 1 17 17 GLU N N 15 122.73 . . 1 . . . . . . . . 4407 1 50 . 1 1 18 18 VAL HA H 1 4.09 . . 1 . . . . . . . . 4407 1 51 . 1 1 18 18 VAL HB H 1 1.70 . . 1 . . . . . . . . 4407 1 52 . 1 1 18 18 VAL HG11 H 1 0.48 . . 2 . . . . . . . . 4407 1 53 . 1 1 18 18 VAL HG12 H 1 0.48 . . 2 . . . . . . . . 4407 1 54 . 1 1 18 18 VAL HG13 H 1 0.48 . . 2 . . . . . . . . 4407 1 55 . 1 1 18 18 VAL HG21 H 1 0.52 . . 2 . . . . . . . . 4407 1 56 . 1 1 18 18 VAL HG22 H 1 0.52 . . 2 . . . . . . . . 4407 1 57 . 1 1 18 18 VAL HG23 H 1 0.52 . . 2 . . . . . . . . 4407 1 58 . 1 1 18 18 VAL H H 1 7.71 . . 1 . . . . . . . . 4407 1 59 . 1 1 18 18 VAL CA C 13 65.42 . . 1 . . . . . . . . 4407 1 60 . 1 1 18 18 VAL CB C 13 31.84 . . 1 . . . . . . . . 4407 1 61 . 1 1 18 18 VAL CG1 C 13 22.11 . . 2 . . . . . . . . 4407 1 62 . 1 1 18 18 VAL CG2 C 13 22.87 . . 2 . . . . . . . . 4407 1 63 . 1 1 18 18 VAL N N 15 118.80 . . 1 . . . . . . . . 4407 1 64 . 1 1 19 19 GLN HA H 1 3.92 . . 1 . . . . . . . . 4407 1 65 . 1 1 19 19 GLN HB2 H 1 2.04 . . 1 . . . . . . . . 4407 1 66 . 1 1 19 19 GLN HB3 H 1 2.04 . . 1 . . . . . . . . 4407 1 67 . 1 1 19 19 GLN HG2 H 1 2.41 . . 2 . . . . . . . . 4407 1 68 . 1 1 19 19 GLN HG3 H 1 2.28 . . 2 . . . . . . . . 4407 1 69 . 1 1 19 19 GLN H H 1 8.24 . . 1 . . . . . . . . 4407 1 70 . 1 1 19 19 GLN HE21 H 1 7.19 . . 2 . . . . . . . . 4407 1 71 . 1 1 19 19 GLN HE22 H 1 6.79 . . 2 . . . . . . . . 4407 1 72 . 1 1 19 19 GLN CA C 13 59.30 . . 1 . . . . . . . . 4407 1 73 . 1 1 19 19 GLN CB C 13 28.61 . . 1 . . . . . . . . 4407 1 74 . 1 1 19 19 GLN CG C 13 34.21 . . 1 . . . . . . . . 4407 1 75 . 1 1 19 19 GLN N N 15 119.54 . . 1 . . . . . . . . 4407 1 76 . 1 1 19 19 GLN NE2 N 15 110.42 . . 1 . . . . . . . . 4407 1 77 . 1 1 20 20 SER HA H 1 4.27 . . 1 . . . . . . . . 4407 1 78 . 1 1 20 20 SER HB2 H 1 4.08 . . 2 . . . . . . . . 4407 1 79 . 1 1 20 20 SER HB3 H 1 4.02 . . 2 . . . . . . . . 4407 1 80 . 1 1 20 20 SER H H 1 7.79 . . 1 . . . . . . . . 4407 1 81 . 1 1 20 20 SER CA C 13 61.90 . . 1 . . . . . . . . 4407 1 82 . 1 1 20 20 SER CB C 13 63.12 . . 1 . . . . . . . . 4407 1 83 . 1 1 20 20 SER N N 15 117.74 . . 1 . . . . . . . . 4407 1 84 . 1 1 21 21 TRP HA H 1 4.76 . . 1 . . . . . . . . 4407 1 85 . 1 1 21 21 TRP HB2 H 1 3.70 . . 2 . . . . . . . . 4407 1 86 . 1 1 21 21 TRP HB3 H 1 3.40 . . 2 . . . . . . . . 4407 1 87 . 1 1 21 21 TRP HE1 H 1 10.24 . . 1 . . . . . . . . 4407 1 88 . 1 1 21 21 TRP HD1 H 1 6.80 . . 1 . . . . . . . . 4407 1 89 . 1 1 21 21 TRP HZ2 H 1 7.31 . . 1 . . . . . . . . 4407 1 90 . 1 1 21 21 TRP HE3 H 1 7.79 . . 1 . . . . . . . . 4407 1 91 . 1 1 21 21 TRP HH2 H 1 6.92 . . 1 . . . . . . . . 4407 1 92 . 1 1 21 21 TRP H H 1 7.45 . . 1 . . . . . . . . 4407 1 93 . 1 1 21 21 TRP CA C 13 56.73 . . 1 . . . . . . . . 4407 1 94 . 1 1 21 21 TRP CB C 13 29.91 . . 1 . . . . . . . . 4407 1 95 . 1 1 21 21 TRP CD1 C 13 125.68 . . 1 . . . . . . . . 4407 1 96 . 1 1 21 21 TRP CZ2 C 13 114.14 . . 1 . . . . . . . . 4407 1 97 . 1 1 21 21 TRP CE3 C 13 119.84 . . 1 . . . . . . . . 4407 1 98 . 1 1 21 21 TRP CH2 C 13 123.28 . . 1 . . . . . . . . 4407 1 99 . 1 1 21 21 TRP NE1 N 15 128.92 . . 1 . . . . . . . . 4407 1 100 . 1 1 21 21 TRP N N 15 122.21 . . 1 . . . . . . . . 4407 1 101 . 1 1 22 22 ALA HA H 1 4.40 . . 1 . . . . . . . . 4407 1 102 . 1 1 22 22 ALA HB1 H 1 1.60 . . 1 . . . . . . . . 4407 1 103 . 1 1 22 22 ALA HB2 H 1 1.60 . . 1 . . . . . . . . 4407 1 104 . 1 1 22 22 ALA HB3 H 1 1.60 . . 1 . . . . . . . . 4407 1 105 . 1 1 22 22 ALA H H 1 7.58 . . 1 . . . . . . . . 4407 1 106 . 1 1 22 22 ALA CA C 13 52.73 . . 1 . . . . . . . . 4407 1 107 . 1 1 22 22 ALA CB C 13 18.98 . . 1 . . . . . . . . 4407 1 108 . 1 1 22 22 ALA N N 15 117.62 . . 1 . . . . . . . . 4407 1 109 . 1 1 23 23 GLN HA H 1 4.35 . . 1 . . . . . . . . 4407 1 110 . 1 1 23 23 GLN HB2 H 1 2.25 . . 1 . . . . . . . . 4407 1 111 . 1 1 23 23 GLN HB3 H 1 2.25 . . 1 . . . . . . . . 4407 1 112 . 1 1 23 23 GLN HG2 H 1 2.46 . . 1 . . . . . . . . 4407 1 113 . 1 1 23 23 GLN HG3 H 1 2.46 . . 1 . . . . . . . . 4407 1 114 . 1 1 23 23 GLN H H 1 7.72 . . 1 . . . . . . . . 4407 1 115 . 1 1 23 23 GLN HE21 H 1 7.48 . . 2 . . . . . . . . 4407 1 116 . 1 1 23 23 GLN HE22 H 1 6.83 . . 2 . . . . . . . . 4407 1 117 . 1 1 23 23 GLN CA C 13 56.91 . . 1 . . . . . . . . 4407 1 118 . 1 1 23 23 GLN CB C 13 29.61 . . 1 . . . . . . . . 4407 1 119 . 1 1 23 23 GLN CG C 13 34.05 . . 1 . . . . . . . . 4407 1 120 . 1 1 23 23 GLN N N 15 116.23 . . 1 . . . . . . . . 4407 1 121 . 1 1 23 23 GLN NE2 N 15 111.31 . . 1 . . . . . . . . 4407 1 122 . 1 1 24 24 SER HA H 1 4.67 . . 1 . . . . . . . . 4407 1 123 . 1 1 24 24 SER HB2 H 1 4.08 . . 2 . . . . . . . . 4407 1 124 . 1 1 24 24 SER HB3 H 1 3.83 . . 2 . . . . . . . . 4407 1 125 . 1 1 24 24 SER H H 1 7.28 . . 1 . . . . . . . . 4407 1 126 . 1 1 24 24 SER CA C 13 57.28 . . 1 . . . . . . . . 4407 1 127 . 1 1 24 24 SER CB C 13 64.46 . . 1 . . . . . . . . 4407 1 128 . 1 1 24 24 SER N N 15 110.30 . . 1 . . . . . . . . 4407 1 129 . 1 1 25 25 PHE HA H 1 3.57 . . 1 . . . . . . . . 4407 1 130 . 1 1 25 25 PHE HB2 H 1 3.13 . . 2 . . . . . . . . 4407 1 131 . 1 1 25 25 PHE HB3 H 1 3.05 . . 2 . . . . . . . . 4407 1 132 . 1 1 25 25 PHE HE1 H 1 6.51 . . 1 . . . . . . . . 4407 1 133 . 1 1 25 25 PHE HE2 H 1 6.51 . . 1 . . . . . . . . 4407 1 134 . 1 1 25 25 PHE HD1 H 1 5.91 . . 1 . . . . . . . . 4407 1 135 . 1 1 25 25 PHE HD2 H 1 5.91 . . 1 . . . . . . . . 4407 1 136 . 1 1 25 25 PHE HZ H 1 5.70 . . 1 . . . . . . . . 4407 1 137 . 1 1 25 25 PHE H H 1 8.87 . . 1 . . . . . . . . 4407 1 138 . 1 1 25 25 PHE CA C 13 59.34 . . 1 . . . . . . . . 4407 1 139 . 1 1 25 25 PHE CB C 13 39.62 . . 1 . . . . . . . . 4407 1 140 . 1 1 25 25 PHE CD1 C 13 130.58 . . 1 . . . . . . . . 4407 1 141 . 1 1 25 25 PHE CD2 C 13 130.58 . . 1 . . . . . . . . 4407 1 142 . 1 1 25 25 PHE CZ C 13 129.12 . . 1 . . . . . . . . 4407 1 143 . 1 1 25 25 PHE N N 15 128.01 . . 1 . . . . . . . . 4407 1 144 . 1 1 26 26 ASP HA H 1 3.96 . . 1 . . . . . . . . 4407 1 145 . 1 1 26 26 ASP HB2 H 1 2.44 . . 1 . . . . . . . . 4407 1 146 . 1 1 26 26 ASP HB3 H 1 2.44 . . 1 . . . . . . . . 4407 1 147 . 1 1 26 26 ASP H H 1 7.87 . . 1 . . . . . . . . 4407 1 148 . 1 1 26 26 ASP CA C 13 56.93 . . 1 . . . . . . . . 4407 1 149 . 1 1 26 26 ASP CB C 13 40.63 . . 1 . . . . . . . . 4407 1 150 . 1 1 26 26 ASP N N 15 114.91 . . 1 . . . . . . . . 4407 1 151 . 1 1 27 27 LYS HA H 1 3.97 . . 1 . . . . . . . . 4407 1 152 . 1 1 27 27 LYS HB2 H 1 2.13 . . 2 . . . . . . . . 4407 1 153 . 1 1 27 27 LYS HB3 H 1 1.87 . . 2 . . . . . . . . 4407 1 154 . 1 1 27 27 LYS HG2 H 1 1.50 . . 1 . . . . . . . . 4407 1 155 . 1 1 27 27 LYS HG3 H 1 1.50 . . 1 . . . . . . . . 4407 1 156 . 1 1 27 27 LYS HD2 H 1 1.78 . . 1 . . . . . . . . 4407 1 157 . 1 1 27 27 LYS HD3 H 1 1.78 . . 1 . . . . . . . . 4407 1 158 . 1 1 27 27 LYS HE2 H 1 3.08 . . 2 . . . . . . . . 4407 1 159 . 1 1 27 27 LYS HE3 H 1 3.04 . . 2 . . . . . . . . 4407 1 160 . 1 1 27 27 LYS H H 1 7.48 . . 1 . . . . . . . . 4407 1 161 . 1 1 27 27 LYS CA C 13 58.99 . . 1 . . . . . . . . 4407 1 162 . 1 1 27 27 LYS CB C 13 32.41 . . 1 . . . . . . . . 4407 1 163 . 1 1 27 27 LYS CG C 13 25.77 . . 1 . . . . . . . . 4407 1 164 . 1 1 27 27 LYS CD C 13 28.89 . . 1 . . . . . . . . 4407 1 165 . 1 1 27 27 LYS CE C 13 42.03 . . 1 . . . . . . . . 4407 1 166 . 1 1 27 27 LYS N N 15 118.09 . . 1 . . . . . . . . 4407 1 167 . 1 1 28 28 LEU HA H 1 3.31 . . 1 . . . . . . . . 4407 1 168 . 1 1 28 28 LEU HB2 H 1 1.62 . . 2 . . . . . . . . 4407 1 169 . 1 1 28 28 LEU HB3 H 1 1.40 . . 2 . . . . . . . . 4407 1 170 . 1 1 28 28 LEU HG H 1 0.49 . . 1 . . . . . . . . 4407 1 171 . 1 1 28 28 LEU HD11 H 1 0.15 . . 2 . . . . . . . . 4407 1 172 . 1 1 28 28 LEU HD12 H 1 0.15 . . 2 . . . . . . . . 4407 1 173 . 1 1 28 28 LEU HD13 H 1 0.15 . . 2 . . . . . . . . 4407 1 174 . 1 1 28 28 LEU HD21 H 1 -0.01 . . 2 . . . . . . . . 4407 1 175 . 1 1 28 28 LEU HD22 H 1 -0.01 . . 2 . . . . . . . . 4407 1 176 . 1 1 28 28 LEU HD23 H 1 -0.01 . . 2 . . . . . . . . 4407 1 177 . 1 1 28 28 LEU H H 1 6.91 . . 1 . . . . . . . . 4407 1 178 . 1 1 28 28 LEU CA C 13 58.83 . . 1 . . . . . . . . 4407 1 179 . 1 1 28 28 LEU CB C 13 41.45 . . 1 . . . . . . . . 4407 1 180 . 1 1 28 28 LEU CG C 13 24.10 . . 1 . . . . . . . . 4407 1 181 . 1 1 28 28 LEU CD1 C 13 24.39 . . 2 . . . . . . . . 4407 1 182 . 1 1 28 28 LEU CD2 C 13 25.71 . . 2 . . . . . . . . 4407 1 183 . 1 1 28 28 LEU N N 15 119.98 . . 1 . . . . . . . . 4407 1 184 . 1 1 29 29 MET HA H 1 3.67 . . 1 . . . . . . . . 4407 1 185 . 1 1 29 29 MET HB2 H 1 1.05 . . 1 . . . . . . . . 4407 1 186 . 1 1 29 29 MET HB3 H 1 1.05 . . 1 . . . . . . . . 4407 1 187 . 1 1 29 29 MET HE1 H 1 0.45 . . 1 . . . . . . . . 4407 1 188 . 1 1 29 29 MET HE2 H 1 0.45 . . 1 . . . . . . . . 4407 1 189 . 1 1 29 29 MET HE3 H 1 0.45 . . 1 . . . . . . . . 4407 1 190 . 1 1 29 29 MET H H 1 7.36 . . 1 . . . . . . . . 4407 1 191 . 1 1 29 29 MET CA C 13 54.83 . . 1 . . . . . . . . 4407 1 192 . 1 1 29 29 MET CB C 13 30.32 . . 1 . . . . . . . . 4407 1 193 . 1 1 29 29 MET CE C 13 14.55 . . 1 . . . . . . . . 4407 1 194 . 1 1 29 29 MET N N 15 110.51 . . 1 . . . . . . . . 4407 1 195 . 1 1 30 30 HIS HA H 1 4.45 . . 1 . . . . . . . . 4407 1 196 . 1 1 30 30 HIS HB2 H 1 3.35 . . 2 . . . . . . . . 4407 1 197 . 1 1 30 30 HIS HB3 H 1 2.93 . . 2 . . . . . . . . 4407 1 198 . 1 1 30 30 HIS HD2 H 1 7.02 . . 1 . . . . . . . . 4407 1 199 . 1 1 30 30 HIS H H 1 7.43 . . 1 . . . . . . . . 4407 1 200 . 1 1 30 30 HIS CA C 13 57.00 . . 1 . . . . . . . . 4407 1 201 . 1 1 30 30 HIS CB C 13 30.30 . . 1 . . . . . . . . 4407 1 202 . 1 1 30 30 HIS CD2 C 13 120.20 . . 1 . . . . . . . . 4407 1 203 . 1 1 30 30 HIS N N 15 116.42 . . 1 . . . . . . . . 4407 1 204 . 1 1 31 31 SER HA H 1 5.12 . . 1 . . . . . . . . 4407 1 205 . 1 1 31 31 SER HB2 H 1 4.34 . . 2 . . . . . . . . 4407 1 206 . 1 1 31 31 SER HB3 H 1 3.94 . . 2 . . . . . . . . 4407 1 207 . 1 1 31 31 SER H H 1 7.21 . . 1 . . . . . . . . 4407 1 208 . 1 1 31 31 SER CA C 13 53.70 . . 1 . . . . . . . . 4407 1 209 . 1 1 31 31 SER CB C 13 64.74 . . 1 . . . . . . . . 4407 1 210 . 1 1 31 31 SER N N 15 115.58 . . 1 . . . . . . . . 4407 1 211 . 1 1 32 32 PRO HA H 1 4.13 . . 1 . . . . . . . . 4407 1 212 . 1 1 32 32 PRO HB2 H 1 2.41 . . 2 . . . . . . . . 4407 1 213 . 1 1 32 32 PRO HB3 H 1 2.05 . . 2 . . . . . . . . 4407 1 214 . 1 1 32 32 PRO HG2 H 1 2.27 . . 1 . . . . . . . . 4407 1 215 . 1 1 32 32 PRO HG3 H 1 2.27 . . 1 . . . . . . . . 4407 1 216 . 1 1 32 32 PRO HD2 H 1 4.14 . . 1 . . . . . . . . 4407 1 217 . 1 1 32 32 PRO HD3 H 1 4.14 . . 1 . . . . . . . . 4407 1 218 . 1 1 32 32 PRO CA C 13 66.09 . . 1 . . . . . . . . 4407 1 219 . 1 1 32 32 PRO CB C 13 32.03 . . 1 . . . . . . . . 4407 1 220 . 1 1 32 32 PRO CG C 13 27.96 . . 1 . . . . . . . . 4407 1 221 . 1 1 32 32 PRO CD C 13 50.29 . . 1 . . . . . . . . 4407 1 222 . 1 1 33 33 ALA HA H 1 4.26 . . 1 . . . . . . . . 4407 1 223 . 1 1 33 33 ALA HB1 H 1 1.61 . . 1 . . . . . . . . 4407 1 224 . 1 1 33 33 ALA HB2 H 1 1.61 . . 1 . . . . . . . . 4407 1 225 . 1 1 33 33 ALA HB3 H 1 1.61 . . 1 . . . . . . . . 4407 1 226 . 1 1 33 33 ALA H H 1 8.16 . . 1 . . . . . . . . 4407 1 227 . 1 1 33 33 ALA CA C 13 54.93 . . 1 . . . . . . . . 4407 1 228 . 1 1 33 33 ALA CB C 13 18.94 . . 1 . . . . . . . . 4407 1 229 . 1 1 33 33 ALA N N 15 120.06 . . 1 . . . . . . . . 4407 1 230 . 1 1 34 34 GLY HA2 H 1 2.61 . . 2 . . . . . . . . 4407 1 231 . 1 1 34 34 GLY HA3 H 1 2.03 . . 2 . . . . . . . . 4407 1 232 . 1 1 34 34 GLY H H 1 8.35 . . 1 . . . . . . . . 4407 1 233 . 1 1 34 34 GLY CA C 13 46.94 . . 1 . . . . . . . . 4407 1 234 . 1 1 34 34 GLY N N 15 109.47 . . 1 . . . . . . . . 4407 1 235 . 1 1 35 35 ARG HA H 1 3.59 . . 1 . . . . . . . . 4407 1 236 . 1 1 35 35 ARG HB2 H 1 1.97 . . 1 . . . . . . . . 4407 1 237 . 1 1 35 35 ARG HB3 H 1 1.97 . . 1 . . . . . . . . 4407 1 238 . 1 1 35 35 ARG HG2 H 1 1.56 . . 1 . . . . . . . . 4407 1 239 . 1 1 35 35 ARG HG3 H 1 1.56 . . 1 . . . . . . . . 4407 1 240 . 1 1 35 35 ARG HD2 H 1 2.95 . . 1 . . . . . . . . 4407 1 241 . 1 1 35 35 ARG HD3 H 1 2.95 . . 1 . . . . . . . . 4407 1 242 . 1 1 35 35 ARG H H 1 8.72 . . 1 . . . . . . . . 4407 1 243 . 1 1 35 35 ARG CA C 13 60.81 . . 1 . . . . . . . . 4407 1 244 . 1 1 35 35 ARG CB C 13 31.57 . . 1 . . . . . . . . 4407 1 245 . 1 1 35 35 ARG CG C 13 31.22 . . 1 . . . . . . . . 4407 1 246 . 1 1 35 35 ARG N N 15 119.87 . . 1 . . . . . . . . 4407 1 247 . 1 1 36 36 SER HA H 1 4.09 . . 1 . . . . . . . . 4407 1 248 . 1 1 36 36 SER HB2 H 1 4.09 . . 1 . . . . . . . . 4407 1 249 . 1 1 36 36 SER HB3 H 1 4.09 . . 1 . . . . . . . . 4407 1 250 . 1 1 36 36 SER H H 1 7.44 . . 1 . . . . . . . . 4407 1 251 . 1 1 36 36 SER CA C 13 63.00 . . 1 . . . . . . . . 4407 1 252 . 1 1 36 36 SER CB C 13 63.28 . . 1 . . . . . . . . 4407 1 253 . 1 1 36 36 SER N N 15 112.86 . . 1 . . . . . . . . 4407 1 254 . 1 1 37 37 VAL HA H 1 4.00 . . 1 . . . . . . . . 4407 1 255 . 1 1 37 37 VAL HB H 1 2.17 . . 1 . . . . . . . . 4407 1 256 . 1 1 37 37 VAL HG11 H 1 1.41 . . 2 . . . . . . . . 4407 1 257 . 1 1 37 37 VAL HG12 H 1 1.41 . . 2 . . . . . . . . 4407 1 258 . 1 1 37 37 VAL HG13 H 1 1.41 . . 2 . . . . . . . . 4407 1 259 . 1 1 37 37 VAL HG21 H 1 1.31 . . 2 . . . . . . . . 4407 1 260 . 1 1 37 37 VAL HG22 H 1 1.31 . . 2 . . . . . . . . 4407 1 261 . 1 1 37 37 VAL HG23 H 1 1.31 . . 2 . . . . . . . . 4407 1 262 . 1 1 37 37 VAL H H 1 8.02 . . 1 . . . . . . . . 4407 1 263 . 1 1 37 37 VAL CA C 13 66.13 . . 1 . . . . . . . . 4407 1 264 . 1 1 37 37 VAL CB C 13 32.01 . . 1 . . . . . . . . 4407 1 265 . 1 1 37 37 VAL CG1 C 13 22.53 . . 2 . . . . . . . . 4407 1 266 . 1 1 37 37 VAL CG2 C 13 22.86 . . 2 . . . . . . . . 4407 1 267 . 1 1 37 37 VAL N N 15 122.91 . . 1 . . . . . . . . 4407 1 268 . 1 1 38 38 PHE HA H 1 4.02 . . 1 . . . . . . . . 4407 1 269 . 1 1 38 38 PHE HB2 H 1 2.69 . . 2 . . . . . . . . 4407 1 270 . 1 1 38 38 PHE HB3 H 1 2.52 . . 2 . . . . . . . . 4407 1 271 . 1 1 38 38 PHE HD1 H 1 6.46 . . 1 . . . . . . . . 4407 1 272 . 1 1 38 38 PHE HD2 H 1 6.46 . . 1 . . . . . . . . 4407 1 273 . 1 1 38 38 PHE HE1 H 1 7.29 . . 1 . . . . . . . . 4407 1 274 . 1 1 38 38 PHE HE2 H 1 7.29 . . 1 . . . . . . . . 4407 1 275 . 1 1 38 38 PHE H H 1 8.75 . . 1 . . . . . . . . 4407 1 276 . 1 1 38 38 PHE CA C 13 59.59 . . 1 . . . . . . . . 4407 1 277 . 1 1 38 38 PHE CB C 13 39.76 . . 1 . . . . . . . . 4407 1 278 . 1 1 38 38 PHE CD1 C 13 131.91 . . 1 . . . . . . . . 4407 1 279 . 1 1 38 38 PHE CD2 C 13 131.91 . . 1 . . . . . . . . 4407 1 280 . 1 1 38 38 PHE CE1 C 13 131.63 . . 1 . . . . . . . . 4407 1 281 . 1 1 38 38 PHE CE2 C 13 131.63 . . 1 . . . . . . . . 4407 1 282 . 1 1 38 38 PHE N N 15 121.47 . . 1 . . . . . . . . 4407 1 283 . 1 1 39 39 ARG HA H 1 3.59 . . 1 . . . . . . . . 4407 1 284 . 1 1 39 39 ARG HB2 H 1 2.24 . . 2 . . . . . . . . 4407 1 285 . 1 1 39 39 ARG HB3 H 1 1.98 . . 2 . . . . . . . . 4407 1 286 . 1 1 39 39 ARG HG2 H 1 1.98 . . 1 . . . . . . . . 4407 1 287 . 1 1 39 39 ARG HG3 H 1 1.98 . . 1 . . . . . . . . 4407 1 288 . 1 1 39 39 ARG HD2 H 1 3.07 . . 1 . . . . . . . . 4407 1 289 . 1 1 39 39 ARG HD3 H 1 3.07 . . 1 . . . . . . . . 4407 1 290 . 1 1 39 39 ARG H H 1 8.56 . . 1 . . . . . . . . 4407 1 291 . 1 1 39 39 ARG CA C 13 60.95 . . 1 . . . . . . . . 4407 1 292 . 1 1 39 39 ARG CB C 13 30.86 . . 1 . . . . . . . . 4407 1 293 . 1 1 39 39 ARG CG C 13 29.29 . . 1 . . . . . . . . 4407 1 294 . 1 1 39 39 ARG CD C 13 43.80 . . 1 . . . . . . . . 4407 1 295 . 1 1 39 39 ARG N N 15 117.22 . . 1 . . . . . . . . 4407 1 296 . 1 1 40 40 ALA HA H 1 3.97 . . 1 . . . . . . . . 4407 1 297 . 1 1 40 40 ALA HB1 H 1 1.66 . . 1 . . . . . . . . 4407 1 298 . 1 1 40 40 ALA HB2 H 1 1.66 . . 1 . . . . . . . . 4407 1 299 . 1 1 40 40 ALA HB3 H 1 1.66 . . 1 . . . . . . . . 4407 1 300 . 1 1 40 40 ALA H H 1 7.56 . . 1 . . . . . . . . 4407 1 301 . 1 1 40 40 ALA CA C 13 55.68 . . 1 . . . . . . . . 4407 1 302 . 1 1 40 40 ALA CB C 13 17.47 . . 1 . . . . . . . . 4407 1 303 . 1 1 40 40 ALA N N 15 120.44 . . 1 . . . . . . . . 4407 1 304 . 1 1 41 41 PHE HA H 1 4.44 . . 1 . . . . . . . . 4407 1 305 . 1 1 41 41 PHE HB2 H 1 3.52 . . 1 . . . . . . . . 4407 1 306 . 1 1 41 41 PHE HB3 H 1 3.52 . . 1 . . . . . . . . 4407 1 307 . 1 1 41 41 PHE HD1 H 1 6.83 . . 1 . . . . . . . . 4407 1 308 . 1 1 41 41 PHE HD2 H 1 6.83 . . 1 . . . . . . . . 4407 1 309 . 1 1 41 41 PHE HE1 H 1 7.22 . . 1 . . . . . . . . 4407 1 310 . 1 1 41 41 PHE HE2 H 1 7.22 . . 1 . . . . . . . . 4407 1 311 . 1 1 41 41 PHE HZ H 1 7.15 . . 1 . . . . . . . . 4407 1 312 . 1 1 41 41 PHE H H 1 8.12 . . 1 . . . . . . . . 4407 1 313 . 1 1 41 41 PHE CA C 13 61.05 . . 1 . . . . . . . . 4407 1 314 . 1 1 41 41 PHE CB C 13 39.65 . . 1 . . . . . . . . 4407 1 315 . 1 1 41 41 PHE CD1 C 13 132.02 . . 1 . . . . . . . . 4407 1 316 . 1 1 41 41 PHE CD2 C 13 132.02 . . 1 . . . . . . . . 4407 1 317 . 1 1 41 41 PHE CE1 C 13 131.61 . . 1 . . . . . . . . 4407 1 318 . 1 1 41 41 PHE CE2 C 13 131.61 . . 1 . . . . . . . . 4407 1 319 . 1 1 41 41 PHE CZ C 13 131.02 . . 1 . . . . . . . . 4407 1 320 . 1 1 41 41 PHE N N 15 119.04 . . 1 . . . . . . . . 4407 1 321 . 1 1 42 42 LEU HA H 1 3.38 . . 1 . . . . . . . . 4407 1 322 . 1 1 42 42 LEU HB2 H 1 1.65 . . 1 . . . . . . . . 4407 1 323 . 1 1 42 42 LEU HB3 H 1 1.65 . . 1 . . . . . . . . 4407 1 324 . 1 1 42 42 LEU HG H 1 1.16 . . 1 . . . . . . . . 4407 1 325 . 1 1 42 42 LEU HD11 H 1 0.56 . . 2 . . . . . . . . 4407 1 326 . 1 1 42 42 LEU HD12 H 1 0.56 . . 2 . . . . . . . . 4407 1 327 . 1 1 42 42 LEU HD13 H 1 0.56 . . 2 . . . . . . . . 4407 1 328 . 1 1 42 42 LEU HD21 H 1 0.44 . . 2 . . . . . . . . 4407 1 329 . 1 1 42 42 LEU HD22 H 1 0.44 . . 2 . . . . . . . . 4407 1 330 . 1 1 42 42 LEU HD23 H 1 0.44 . . 2 . . . . . . . . 4407 1 331 . 1 1 42 42 LEU H H 1 8.87 . . 1 . . . . . . . . 4407 1 332 . 1 1 42 42 LEU CA C 13 57.67 . . 1 . . . . . . . . 4407 1 333 . 1 1 42 42 LEU CB C 13 40.64 . . 1 . . . . . . . . 4407 1 334 . 1 1 42 42 LEU CG C 13 25.63 . . 1 . . . . . . . . 4407 1 335 . 1 1 42 42 LEU CD1 C 13 21.49 . . 2 . . . . . . . . 4407 1 336 . 1 1 42 42 LEU CD2 C 13 27.39 . . 2 . . . . . . . . 4407 1 337 . 1 1 42 42 LEU N N 15 122.37 . . 1 . . . . . . . . 4407 1 338 . 1 1 43 43 ARG HA H 1 3.97 . . 1 . . . . . . . . 4407 1 339 . 1 1 43 43 ARG HB2 H 1 1.88 . . 1 . . . . . . . . 4407 1 340 . 1 1 43 43 ARG HB3 H 1 1.88 . . 1 . . . . . . . . 4407 1 341 . 1 1 43 43 ARG HG2 H 1 1.77 . . 2 . . . . . . . . 4407 1 342 . 1 1 43 43 ARG HG3 H 1 1.47 . . 2 . . . . . . . . 4407 1 343 . 1 1 43 43 ARG HD2 H 1 3.27 . . 1 . . . . . . . . 4407 1 344 . 1 1 43 43 ARG HD3 H 1 3.27 . . 1 . . . . . . . . 4407 1 345 . 1 1 43 43 ARG H H 1 8.20 . . 1 . . . . . . . . 4407 1 346 . 1 1 43 43 ARG CA C 13 60.21 . . 1 . . . . . . . . 4407 1 347 . 1 1 43 43 ARG CB C 13 30.27 . . 1 . . . . . . . . 4407 1 348 . 1 1 43 43 ARG CG C 13 28.42 . . 1 . . . . . . . . 4407 1 349 . 1 1 43 43 ARG CD C 13 43.66 . . 1 . . . . . . . . 4407 1 350 . 1 1 43 43 ARG N N 15 118.15 . . 1 . . . . . . . . 4407 1 351 . 1 1 44 44 THR HA H 1 4.01 . . 1 . . . . . . . . 4407 1 352 . 1 1 44 44 THR HB H 1 4.24 . . 1 . . . . . . . . 4407 1 353 . 1 1 44 44 THR HG21 H 1 1.38 . . 1 . . . . . . . . 4407 1 354 . 1 1 44 44 THR HG22 H 1 1.38 . . 1 . . . . . . . . 4407 1 355 . 1 1 44 44 THR HG23 H 1 1.38 . . 1 . . . . . . . . 4407 1 356 . 1 1 44 44 THR H H 1 7.47 . . 1 . . . . . . . . 4407 1 357 . 1 1 44 44 THR CA C 13 64.38 . . 1 . . . . . . . . 4407 1 358 . 1 1 44 44 THR CB C 13 69.49 . . 1 . . . . . . . . 4407 1 359 . 1 1 44 44 THR CG2 C 13 21.40 . . 1 . . . . . . . . 4407 1 360 . 1 1 44 44 THR N N 15 111.11 . . 1 . . . . . . . . 4407 1 361 . 1 1 45 45 GLU HA H 1 4.29 . . 1 . . . . . . . . 4407 1 362 . 1 1 45 45 GLU HB2 H 1 2.04 . . 2 . . . . . . . . 4407 1 363 . 1 1 45 45 GLU HB3 H 1 1.60 . . 2 . . . . . . . . 4407 1 364 . 1 1 45 45 GLU HG2 H 1 1.64 . . 1 . . . . . . . . 4407 1 365 . 1 1 45 45 GLU HG3 H 1 1.64 . . 1 . . . . . . . . 4407 1 366 . 1 1 45 45 GLU H H 1 6.74 . . 1 . . . . . . . . 4407 1 367 . 1 1 45 45 GLU CA C 13 55.37 . . 1 . . . . . . . . 4407 1 368 . 1 1 45 45 GLU CB C 13 29.83 . . 1 . . . . . . . . 4407 1 369 . 1 1 45 45 GLU CG C 13 36.17 . . 1 . . . . . . . . 4407 1 370 . 1 1 45 45 GLU N N 15 117.43 . . 1 . . . . . . . . 4407 1 371 . 1 1 46 46 TYR HA H 1 4.32 . . 1 . . . . . . . . 4407 1 372 . 1 1 46 46 TYR HB2 H 1 3.27 . . 2 . . . . . . . . 4407 1 373 . 1 1 46 46 TYR HB3 H 1 3.14 . . 2 . . . . . . . . 4407 1 374 . 1 1 46 46 TYR HD1 H 1 7.06 . . 1 . . . . . . . . 4407 1 375 . 1 1 46 46 TYR HD2 H 1 7.06 . . 1 . . . . . . . . 4407 1 376 . 1 1 46 46 TYR HE1 H 1 6.86 . . 1 . . . . . . . . 4407 1 377 . 1 1 46 46 TYR HE2 H 1 6.86 . . 1 . . . . . . . . 4407 1 378 . 1 1 46 46 TYR H H 1 7.33 . . 1 . . . . . . . . 4407 1 379 . 1 1 46 46 TYR CA C 13 59.24 . . 1 . . . . . . . . 4407 1 380 . 1 1 46 46 TYR CB C 13 35.28 . . 1 . . . . . . . . 4407 1 381 . 1 1 46 46 TYR CD1 C 13 133.12 . . 1 . . . . . . . . 4407 1 382 . 1 1 46 46 TYR CD2 C 13 133.12 . . 1 . . . . . . . . 4407 1 383 . 1 1 46 46 TYR CE1 C 13 117.97 . . 1 . . . . . . . . 4407 1 384 . 1 1 46 46 TYR CE2 C 13 117.97 . . 1 . . . . . . . . 4407 1 385 . 1 1 46 46 TYR N N 15 116.51 . . 1 . . . . . . . . 4407 1 386 . 1 1 47 47 SER HA H 1 5.05 . . 1 . . . . . . . . 4407 1 387 . 1 1 47 47 SER HB2 H 1 3.81 . . 1 . . . . . . . . 4407 1 388 . 1 1 47 47 SER HB3 H 1 3.81 . . 1 . . . . . . . . 4407 1 389 . 1 1 47 47 SER H H 1 8.01 . . 1 . . . . . . . . 4407 1 390 . 1 1 47 47 SER CA C 13 57.34 . . 1 . . . . . . . . 4407 1 391 . 1 1 47 47 SER CB C 13 64.65 . . 1 . . . . . . . . 4407 1 392 . 1 1 47 47 SER N N 15 111.49 . . 1 . . . . . . . . 4407 1 393 . 1 1 48 48 GLU HA H 1 3.67 . . 1 . . . . . . . . 4407 1 394 . 1 1 48 48 GLU HB2 H 1 2.09 . . 2 . . . . . . . . 4407 1 395 . 1 1 48 48 GLU HB3 H 1 1.62 . . 2 . . . . . . . . 4407 1 396 . 1 1 48 48 GLU HG2 H 1 2.47 . . 2 . . . . . . . . 4407 1 397 . 1 1 48 48 GLU HG3 H 1 2.33 . . 2 . . . . . . . . 4407 1 398 . 1 1 48 48 GLU H H 1 8.45 . . 1 . . . . . . . . 4407 1 399 . 1 1 48 48 GLU CA C 13 58.71 . . 1 . . . . . . . . 4407 1 400 . 1 1 48 48 GLU CB C 13 30.76 . . 1 . . . . . . . . 4407 1 401 . 1 1 48 48 GLU CG C 13 36.71 . . 1 . . . . . . . . 4407 1 402 . 1 1 48 48 GLU N N 15 122.67 . . 1 . . . . . . . . 4407 1 403 . 1 1 49 49 GLU HA H 1 4.07 . . 1 . . . . . . . . 4407 1 404 . 1 1 49 49 GLU HB2 H 1 2.14 . . 1 . . . . . . . . 4407 1 405 . 1 1 49 49 GLU HB3 H 1 2.14 . . 1 . . . . . . . . 4407 1 406 . 1 1 49 49 GLU HG2 H 1 2.34 . . 1 . . . . . . . . 4407 1 407 . 1 1 49 49 GLU HG3 H 1 2.34 . . 1 . . . . . . . . 4407 1 408 . 1 1 49 49 GLU H H 1 9.73 . . 1 . . . . . . . . 4407 1 409 . 1 1 49 49 GLU CA C 13 60.82 . . 1 . . . . . . . . 4407 1 410 . 1 1 49 49 GLU CB C 13 28.43 . . 1 . . . . . . . . 4407 1 411 . 1 1 49 49 GLU CG C 13 37.04 . . 1 . . . . . . . . 4407 1 412 . 1 1 49 49 GLU N N 15 118.54 . . 1 . . . . . . . . 4407 1 413 . 1 1 50 50 ASN HA H 1 4.55 . . 1 . . . . . . . . 4407 1 414 . 1 1 50 50 ASN HB2 H 1 2.82 . . 1 . . . . . . . . 4407 1 415 . 1 1 50 50 ASN HB3 H 1 2.82 . . 1 . . . . . . . . 4407 1 416 . 1 1 50 50 ASN HD21 H 1 7.71 . . 2 . . . . . . . . 4407 1 417 . 1 1 50 50 ASN HD22 H 1 6.89 . . 2 . . . . . . . . 4407 1 418 . 1 1 50 50 ASN H H 1 7.67 . . 1 . . . . . . . . 4407 1 419 . 1 1 50 50 ASN CA C 13 56.68 . . 1 . . . . . . . . 4407 1 420 . 1 1 50 50 ASN CB C 13 38.49 . . 1 . . . . . . . . 4407 1 421 . 1 1 50 50 ASN ND2 N 15 109.21 . . 1 . . . . . . . . 4407 1 422 . 1 1 50 50 ASN N N 15 116.60 . . 1 . . . . . . . . 4407 1 423 . 1 1 51 51 MET HA H 1 4.44 . . 1 . . . . . . . . 4407 1 424 . 1 1 51 51 MET HB2 H 1 2.10 . . 2 . . . . . . . . 4407 1 425 . 1 1 51 51 MET HB3 H 1 2.00 . . 2 . . . . . . . . 4407 1 426 . 1 1 51 51 MET HG2 H 1 2.49 . . 1 . . . . . . . . 4407 1 427 . 1 1 51 51 MET HG3 H 1 2.49 . . 1 . . . . . . . . 4407 1 428 . 1 1 51 51 MET HE1 H 1 2.10 . . 1 . . . . . . . . 4407 1 429 . 1 1 51 51 MET HE2 H 1 2.10 . . 1 . . . . . . . . 4407 1 430 . 1 1 51 51 MET HE3 H 1 2.10 . . 1 . . . . . . . . 4407 1 431 . 1 1 51 51 MET H H 1 7.06 . . 1 . . . . . . . . 4407 1 432 . 1 1 51 51 MET CA C 13 56.50 . . 1 . . . . . . . . 4407 1 433 . 1 1 51 51 MET CB C 13 32.56 . . 1 . . . . . . . . 4407 1 434 . 1 1 51 51 MET CG C 13 33.60 . . 1 . . . . . . . . 4407 1 435 . 1 1 51 51 MET CE C 13 18.63 . . 1 . . . . . . . . 4407 1 436 . 1 1 51 51 MET N N 15 117.51 . . 1 . . . . . . . . 4407 1 437 . 1 1 52 52 LEU HA H 1 4.01 . . 1 . . . . . . . . 4407 1 438 . 1 1 52 52 LEU HB2 H 1 2.05 . . 2 . . . . . . . . 4407 1 439 . 1 1 52 52 LEU HB3 H 1 1.82 . . 2 . . . . . . . . 4407 1 440 . 1 1 52 52 LEU HG H 1 1.65 . . 1 . . . . . . . . 4407 1 441 . 1 1 52 52 LEU HD11 H 1 0.77 . . 2 . . . . . . . . 4407 1 442 . 1 1 52 52 LEU HD12 H 1 0.77 . . 2 . . . . . . . . 4407 1 443 . 1 1 52 52 LEU HD13 H 1 0.77 . . 2 . . . . . . . . 4407 1 444 . 1 1 52 52 LEU HD21 H 1 0.87 . . 2 . . . . . . . . 4407 1 445 . 1 1 52 52 LEU HD22 H 1 0.87 . . 2 . . . . . . . . 4407 1 446 . 1 1 52 52 LEU HD23 H 1 0.87 . . 2 . . . . . . . . 4407 1 447 . 1 1 52 52 LEU H H 1 8.22 . . 1 . . . . . . . . 4407 1 448 . 1 1 52 52 LEU CA C 13 58.38 . . 1 . . . . . . . . 4407 1 449 . 1 1 52 52 LEU CB C 13 40.32 . . 1 . . . . . . . . 4407 1 450 . 1 1 52 52 LEU CG C 13 27.14 . . 1 . . . . . . . . 4407 1 451 . 1 1 52 52 LEU CD1 C 13 21.36 . . 2 . . . . . . . . 4407 1 452 . 1 1 52 52 LEU CD2 C 13 25.26 . . 2 . . . . . . . . 4407 1 453 . 1 1 52 52 LEU N N 15 119.85 . . 1 . . . . . . . . 4407 1 454 . 1 1 53 53 PHE HA H 1 3.33 . . 1 . . . . . . . . 4407 1 455 . 1 1 53 53 PHE HB2 H 1 2.91 . . 2 . . . . . . . . 4407 1 456 . 1 1 53 53 PHE HB3 H 1 2.59 . . 2 . . . . . . . . 4407 1 457 . 1 1 53 53 PHE HD1 H 1 6.76 . . 1 . . . . . . . . 4407 1 458 . 1 1 53 53 PHE HD2 H 1 6.76 . . 1 . . . . . . . . 4407 1 459 . 1 1 53 53 PHE HE1 H 1 6.68 . . 1 . . . . . . . . 4407 1 460 . 1 1 53 53 PHE HE2 H 1 6.68 . . 1 . . . . . . . . 4407 1 461 . 1 1 53 53 PHE HZ H 1 6.67 . . 1 . . . . . . . . 4407 1 462 . 1 1 53 53 PHE H H 1 8.51 . . 1 . . . . . . . . 4407 1 463 . 1 1 53 53 PHE CA C 13 60.60 . . 1 . . . . . . . . 4407 1 464 . 1 1 53 53 PHE CB C 13 39.16 . . 1 . . . . . . . . 4407 1 465 . 1 1 53 53 PHE CD1 C 13 131.65 . . 1 . . . . . . . . 4407 1 466 . 1 1 53 53 PHE CD2 C 13 131.65 . . 1 . . . . . . . . 4407 1 467 . 1 1 53 53 PHE CE1 C 13 131.46 . . 1 . . . . . . . . 4407 1 468 . 1 1 53 53 PHE CE2 C 13 131.46 . . 1 . . . . . . . . 4407 1 469 . 1 1 53 53 PHE CZ C 13 129.89 . . 1 . . . . . . . . 4407 1 470 . 1 1 53 53 PHE N N 15 120.18 . . 1 . . . . . . . . 4407 1 471 . 1 1 54 54 TRP HA H 1 3.45 . . 1 . . . . . . . . 4407 1 472 . 1 1 54 54 TRP HB2 H 1 3.79 . . 2 . . . . . . . . 4407 1 473 . 1 1 54 54 TRP HB3 H 1 3.33 . . 2 . . . . . . . . 4407 1 474 . 1 1 54 54 TRP HE1 H 1 10.64 . . 1 . . . . . . . . 4407 1 475 . 1 1 54 54 TRP HD1 H 1 7.35 . . 1 . . . . . . . . 4407 1 476 . 1 1 54 54 TRP HZ3 H 1 6.76 . . 1 . . . . . . . . 4407 1 477 . 1 1 54 54 TRP HH2 H 1 6.77 . . 1 . . . . . . . . 4407 1 478 . 1 1 54 54 TRP HE3 H 1 7.30 . . 1 . . . . . . . . 4407 1 479 . 1 1 54 54 TRP HZ2 H 1 7.17 . . 1 . . . . . . . . 4407 1 480 . 1 1 54 54 TRP H H 1 8.03 . . 1 . . . . . . . . 4407 1 481 . 1 1 54 54 TRP CA C 13 65.12 . . 1 . . . . . . . . 4407 1 482 . 1 1 54 54 TRP CB C 13 29.56 . . 1 . . . . . . . . 4407 1 483 . 1 1 54 54 TRP CD1 C 13 124.86 . . 1 . . . . . . . . 4407 1 484 . 1 1 54 54 TRP CZ2 C 13 114.53 . . 1 . . . . . . . . 4407 1 485 . 1 1 54 54 TRP CE3 C 13 120.18 . . 1 . . . . . . . . 4407 1 486 . 1 1 54 54 TRP CZ3 C 13 124.82 . . 1 . . . . . . . . 4407 1 487 . 1 1 54 54 TRP CH2 C 13 121.97 . . 1 . . . . . . . . 4407 1 488 . 1 1 54 54 TRP NE1 N 15 130.58 . . 1 . . . . . . . . 4407 1 489 . 1 1 54 54 TRP N N 15 121.57 . . 1 . . . . . . . . 4407 1 490 . 1 1 55 55 LEU HA H 1 3.65 . . 1 . . . . . . . . 4407 1 491 . 1 1 55 55 LEU HB2 H 1 1.95 . . 2 . . . . . . . . 4407 1 492 . 1 1 55 55 LEU HB3 H 1 1.49 . . 2 . . . . . . . . 4407 1 493 . 1 1 55 55 LEU HG H 1 2.14 . . 1 . . . . . . . . 4407 1 494 . 1 1 55 55 LEU HD11 H 1 0.90 . . 2 . . . . . . . . 4407 1 495 . 1 1 55 55 LEU HD12 H 1 0.90 . . 2 . . . . . . . . 4407 1 496 . 1 1 55 55 LEU HD13 H 1 0.90 . . 2 . . . . . . . . 4407 1 497 . 1 1 55 55 LEU HD21 H 1 1.04 . . 2 . . . . . . . . 4407 1 498 . 1 1 55 55 LEU HD22 H 1 1.04 . . 2 . . . . . . . . 4407 1 499 . 1 1 55 55 LEU HD23 H 1 1.04 . . 2 . . . . . . . . 4407 1 500 . 1 1 55 55 LEU H H 1 9.00 . . 1 . . . . . . . . 4407 1 501 . 1 1 55 55 LEU CA C 13 57.50 . . 1 . . . . . . . . 4407 1 502 . 1 1 55 55 LEU CB C 13 42.26 . . 1 . . . . . . . . 4407 1 503 . 1 1 55 55 LEU CG C 13 27.16 . . 1 . . . . . . . . 4407 1 504 . 1 1 55 55 LEU CD1 C 13 26.15 . . 2 . . . . . . . . 4407 1 505 . 1 1 55 55 LEU CD2 C 13 23.30 . . 2 . . . . . . . . 4407 1 506 . 1 1 55 55 LEU N N 15 117.05 . . 1 . . . . . . . . 4407 1 507 . 1 1 56 56 ALA HA H 1 4.01 . . 1 . . . . . . . . 4407 1 508 . 1 1 56 56 ALA HB1 H 1 1.35 . . 1 . . . . . . . . 4407 1 509 . 1 1 56 56 ALA HB2 H 1 1.35 . . 1 . . . . . . . . 4407 1 510 . 1 1 56 56 ALA HB3 H 1 1.35 . . 1 . . . . . . . . 4407 1 511 . 1 1 56 56 ALA H H 1 8.02 . . 1 . . . . . . . . 4407 1 512 . 1 1 56 56 ALA CA C 13 55.14 . . 1 . . . . . . . . 4407 1 513 . 1 1 56 56 ALA CB C 13 17.75 . . 1 . . . . . . . . 4407 1 514 . 1 1 56 56 ALA N N 15 123.39 . . 1 . . . . . . . . 4407 1 515 . 1 1 57 57 CYS HA H 1 3.61 . . 1 . . . . . . . . 4407 1 516 . 1 1 57 57 CYS HB2 H 1 2.52 . . 2 . . . . . . . . 4407 1 517 . 1 1 57 57 CYS HB3 H 1 2.03 . . 2 . . . . . . . . 4407 1 518 . 1 1 57 57 CYS H H 1 7.45 . . 1 . . . . . . . . 4407 1 519 . 1 1 57 57 CYS CA C 13 63.54 . . 1 . . . . . . . . 4407 1 520 . 1 1 57 57 CYS CB C 13 25.90 . . 1 . . . . . . . . 4407 1 521 . 1 1 57 57 CYS N N 15 116.43 . . 1 . . . . . . . . 4407 1 522 . 1 1 58 58 GLU HA H 1 3.55 . . 1 . . . . . . . . 4407 1 523 . 1 1 58 58 GLU HB2 H 1 1.55 . . 2 . . . . . . . . 4407 1 524 . 1 1 58 58 GLU HB3 H 1 1.26 . . 2 . . . . . . . . 4407 1 525 . 1 1 58 58 GLU HG2 H 1 1.44 . . 2 . . . . . . . . 4407 1 526 . 1 1 58 58 GLU HG3 H 1 1.06 . . 2 . . . . . . . . 4407 1 527 . 1 1 58 58 GLU H H 1 7.29 . . 1 . . . . . . . . 4407 1 528 . 1 1 58 58 GLU CA C 13 58.52 . . 1 . . . . . . . . 4407 1 529 . 1 1 58 58 GLU CB C 13 29.21 . . 1 . . . . . . . . 4407 1 530 . 1 1 58 58 GLU CG C 13 34.87 . . 1 . . . . . . . . 4407 1 531 . 1 1 58 58 GLU N N 15 119.25 . . 1 . . . . . . . . 4407 1 532 . 1 1 59 59 GLU HA H 1 3.86 . . 1 . . . . . . . . 4407 1 533 . 1 1 59 59 GLU HB2 H 1 1.99 . . 1 . . . . . . . . 4407 1 534 . 1 1 59 59 GLU HB3 H 1 1.99 . . 1 . . . . . . . . 4407 1 535 . 1 1 59 59 GLU HG2 H 1 2.36 . . 2 . . . . . . . . 4407 1 536 . 1 1 59 59 GLU HG3 H 1 2.09 . . 2 . . . . . . . . 4407 1 537 . 1 1 59 59 GLU H H 1 7.79 . . 1 . . . . . . . . 4407 1 538 . 1 1 59 59 GLU CA C 13 59.09 . . 1 . . . . . . . . 4407 1 539 . 1 1 59 59 GLU CB C 13 29.78 . . 1 . . . . . . . . 4407 1 540 . 1 1 59 59 GLU CG C 13 36.64 . . 1 . . . . . . . . 4407 1 541 . 1 1 59 59 GLU N N 15 118.58 . . 1 . . . . . . . . 4407 1 542 . 1 1 60 60 LEU HA H 1 3.88 . . 1 . . . . . . . . 4407 1 543 . 1 1 60 60 LEU HB2 H 1 1.98 . . 2 . . . . . . . . 4407 1 544 . 1 1 60 60 LEU HB3 H 1 1.46 . . 2 . . . . . . . . 4407 1 545 . 1 1 60 60 LEU HG H 1 1.98 . . 1 . . . . . . . . 4407 1 546 . 1 1 60 60 LEU HD11 H 1 0.98 . . 2 . . . . . . . . 4407 1 547 . 1 1 60 60 LEU HD12 H 1 0.98 . . 2 . . . . . . . . 4407 1 548 . 1 1 60 60 LEU HD13 H 1 0.98 . . 2 . . . . . . . . 4407 1 549 . 1 1 60 60 LEU HD21 H 1 1.09 . . 2 . . . . . . . . 4407 1 550 . 1 1 60 60 LEU HD22 H 1 1.09 . . 2 . . . . . . . . 4407 1 551 . 1 1 60 60 LEU HD23 H 1 1.09 . . 2 . . . . . . . . 4407 1 552 . 1 1 60 60 LEU H H 1 7.60 . . 1 . . . . . . . . 4407 1 553 . 1 1 60 60 LEU CA C 13 57.92 . . 1 . . . . . . . . 4407 1 554 . 1 1 60 60 LEU CB C 13 42.06 . . 1 . . . . . . . . 4407 1 555 . 1 1 60 60 LEU CG C 13 29.70 . . 1 . . . . . . . . 4407 1 556 . 1 1 60 60 LEU CD1 C 13 25.64 . . 2 . . . . . . . . 4407 1 557 . 1 1 60 60 LEU CD2 C 13 26.41 . . 2 . . . . . . . . 4407 1 558 . 1 1 60 60 LEU N N 15 120.99 . . 1 . . . . . . . . 4407 1 559 . 1 1 61 61 LYS HA H 1 3.78 . . 1 . . . . . . . . 4407 1 560 . 1 1 61 61 LYS HB2 H 1 1.63 . . 2 . . . . . . . . 4407 1 561 . 1 1 61 61 LYS HB3 H 1 1.52 . . 2 . . . . . . . . 4407 1 562 . 1 1 61 61 LYS HG2 H 1 1.43 . . 2 . . . . . . . . 4407 1 563 . 1 1 61 61 LYS HG3 H 1 1.09 . . 2 . . . . . . . . 4407 1 564 . 1 1 61 61 LYS HD2 H 1 1.44 . . 1 . . . . . . . . 4407 1 565 . 1 1 61 61 LYS HD3 H 1 1.44 . . 1 . . . . . . . . 4407 1 566 . 1 1 61 61 LYS HE2 H 1 2.72 . . 1 . . . . . . . . 4407 1 567 . 1 1 61 61 LYS HE3 H 1 2.72 . . 1 . . . . . . . . 4407 1 568 . 1 1 61 61 LYS H H 1 7.29 . . 1 . . . . . . . . 4407 1 569 . 1 1 61 61 LYS CA C 13 58.78 . . 1 . . . . . . . . 4407 1 570 . 1 1 61 61 LYS CB C 13 32.60 . . 1 . . . . . . . . 4407 1 571 . 1 1 61 61 LYS CG C 13 25.84 . . 1 . . . . . . . . 4407 1 572 . 1 1 61 61 LYS CD C 13 29.75 . . 1 . . . . . . . . 4407 1 573 . 1 1 61 61 LYS CE C 13 41.79 . . 1 . . . . . . . . 4407 1 574 . 1 1 61 61 LYS N N 15 113.69 . . 1 . . . . . . . . 4407 1 575 . 1 1 62 62 ALA HA H 1 4.30 . . 1 . . . . . . . . 4407 1 576 . 1 1 62 62 ALA HB1 H 1 1.39 . . 1 . . . . . . . . 4407 1 577 . 1 1 62 62 ALA HB2 H 1 1.39 . . 1 . . . . . . . . 4407 1 578 . 1 1 62 62 ALA HB3 H 1 1.39 . . 1 . . . . . . . . 4407 1 579 . 1 1 62 62 ALA H H 1 7.09 . . 1 . . . . . . . . 4407 1 580 . 1 1 62 62 ALA CA C 13 51.77 . . 1 . . . . . . . . 4407 1 581 . 1 1 62 62 ALA CB C 13 19.27 . . 1 . . . . . . . . 4407 1 582 . 1 1 62 62 ALA N N 15 119.53 . . 1 . . . . . . . . 4407 1 583 . 1 1 63 63 GLU HA H 1 4.12 . . 1 . . . . . . . . 4407 1 584 . 1 1 63 63 GLU HB2 H 1 2.10 . . 2 . . . . . . . . 4407 1 585 . 1 1 63 63 GLU HB3 H 1 2.01 . . 2 . . . . . . . . 4407 1 586 . 1 1 63 63 GLU HG2 H 1 2.21 . . 1 . . . . . . . . 4407 1 587 . 1 1 63 63 GLU HG3 H 1 2.21 . . 1 . . . . . . . . 4407 1 588 . 1 1 63 63 GLU H H 1 7.75 . . 1 . . . . . . . . 4407 1 589 . 1 1 63 63 GLU CA C 13 56.86 . . 1 . . . . . . . . 4407 1 590 . 1 1 63 63 GLU CB C 13 30.04 . . 1 . . . . . . . . 4407 1 591 . 1 1 63 63 GLU CG C 13 36.67 . . 1 . . . . . . . . 4407 1 592 . 1 1 63 63 GLU N N 15 122.01 . . 1 . . . . . . . . 4407 1 593 . 1 1 64 64 ALA HA H 1 4.35 . . 1 . . . . . . . . 4407 1 594 . 1 1 64 64 ALA HB1 H 1 1.40 . . 1 . . . . . . . . 4407 1 595 . 1 1 64 64 ALA HB2 H 1 1.40 . . 1 . . . . . . . . 4407 1 596 . 1 1 64 64 ALA HB3 H 1 1.40 . . 1 . . . . . . . . 4407 1 597 . 1 1 64 64 ALA H H 1 8.37 . . 1 . . . . . . . . 4407 1 598 . 1 1 64 64 ALA CA C 13 53.08 . . 1 . . . . . . . . 4407 1 599 . 1 1 64 64 ALA CB C 13 20.33 . . 1 . . . . . . . . 4407 1 600 . 1 1 64 64 ALA N N 15 126.12 . . 1 . . . . . . . . 4407 1 601 . 1 1 65 65 ASN HA H 1 4.89 . . 1 . . . . . . . . 4407 1 602 . 1 1 65 65 ASN HB2 H 1 3.01 . . 2 . . . . . . . . 4407 1 603 . 1 1 65 65 ASN HB3 H 1 2.75 . . 2 . . . . . . . . 4407 1 604 . 1 1 65 65 ASN HD21 H 1 7.80 . . 2 . . . . . . . . 4407 1 605 . 1 1 65 65 ASN HD22 H 1 7.17 . . 2 . . . . . . . . 4407 1 606 . 1 1 65 65 ASN H H 1 8.91 . . 1 . . . . . . . . 4407 1 607 . 1 1 65 65 ASN CA C 13 52.79 . . 1 . . . . . . . . 4407 1 608 . 1 1 65 65 ASN CB C 13 39.25 . . 1 . . . . . . . . 4407 1 609 . 1 1 65 65 ASN ND2 N 15 113.18 . . 1 . . . . . . . . 4407 1 610 . 1 1 65 65 ASN N N 15 117.82 . . 1 . . . . . . . . 4407 1 611 . 1 1 66 66 GLN HA H 1 3.94 . . 1 . . . . . . . . 4407 1 612 . 1 1 66 66 GLN HB2 H 1 2.16 . . 2 . . . . . . . . 4407 1 613 . 1 1 66 66 GLN HB3 H 1 1.97 . . 2 . . . . . . . . 4407 1 614 . 1 1 66 66 GLN HG2 H 1 2.34 . . 1 . . . . . . . . 4407 1 615 . 1 1 66 66 GLN HG3 H 1 2.34 . . 1 . . . . . . . . 4407 1 616 . 1 1 66 66 GLN HE21 H 1 7.78 . . 2 . . . . . . . . 4407 1 617 . 1 1 66 66 GLN HE22 H 1 6.75 . . 2 . . . . . . . . 4407 1 618 . 1 1 66 66 GLN CA C 13 58.58 . . 1 . . . . . . . . 4407 1 619 . 1 1 66 66 GLN CB C 13 28.55 . . 1 . . . . . . . . 4407 1 620 . 1 1 66 66 GLN CG C 13 33.44 . . 1 . . . . . . . . 4407 1 621 . 1 1 66 66 GLN NE2 N 15 113.97 . . 1 . . . . . . . . 4407 1 622 . 1 1 67 67 HIS HA H 1 4.54 . . 1 . . . . . . . . 4407 1 623 . 1 1 67 67 HIS HB2 H 1 3.23 . . 1 . . . . . . . . 4407 1 624 . 1 1 67 67 HIS HB3 H 1 3.23 . . 1 . . . . . . . . 4407 1 625 . 1 1 67 67 HIS CA C 13 58.34 . . 1 . . . . . . . . 4407 1 626 . 1 1 67 67 HIS CB C 13 29.42 . . 1 . . . . . . . . 4407 1 627 . 1 1 68 68 VAL HA H 1 4.17 . . 1 . . . . . . . . 4407 1 628 . 1 1 68 68 VAL HB H 1 2.24 . . 1 . . . . . . . . 4407 1 629 . 1 1 68 68 VAL HG11 H 1 0.85 . . 1 . . . . . . . . 4407 1 630 . 1 1 68 68 VAL HG12 H 1 0.85 . . 1 . . . . . . . . 4407 1 631 . 1 1 68 68 VAL HG13 H 1 0.85 . . 1 . . . . . . . . 4407 1 632 . 1 1 68 68 VAL HG21 H 1 0.85 . . 1 . . . . . . . . 4407 1 633 . 1 1 68 68 VAL HG22 H 1 0.85 . . 1 . . . . . . . . 4407 1 634 . 1 1 68 68 VAL HG23 H 1 0.85 . . 1 . . . . . . . . 4407 1 635 . 1 1 68 68 VAL H H 1 7.33 . . 1 . . . . . . . . 4407 1 636 . 1 1 68 68 VAL CA C 13 63.50 . . 1 . . . . . . . . 4407 1 637 . 1 1 68 68 VAL CB C 13 31.59 . . 1 . . . . . . . . 4407 1 638 . 1 1 68 68 VAL CG1 C 13 21.33 . . 1 . . . . . . . . 4407 1 639 . 1 1 68 68 VAL CG2 C 13 21.33 . . 1 . . . . . . . . 4407 1 640 . 1 1 68 68 VAL N N 15 118.64 . . 1 . . . . . . . . 4407 1 641 . 1 1 69 69 VAL HA H 1 3.38 . . 1 . . . . . . . . 4407 1 642 . 1 1 69 69 VAL HB H 1 2.13 . . 1 . . . . . . . . 4407 1 643 . 1 1 69 69 VAL HG11 H 1 0.93 . . 2 . . . . . . . . 4407 1 644 . 1 1 69 69 VAL HG12 H 1 0.93 . . 2 . . . . . . . . 4407 1 645 . 1 1 69 69 VAL HG13 H 1 0.93 . . 2 . . . . . . . . 4407 1 646 . 1 1 69 69 VAL HG21 H 1 0.72 . . 2 . . . . . . . . 4407 1 647 . 1 1 69 69 VAL HG22 H 1 0.72 . . 2 . . . . . . . . 4407 1 648 . 1 1 69 69 VAL HG23 H 1 0.72 . . 2 . . . . . . . . 4407 1 649 . 1 1 69 69 VAL H H 1 7.78 . . 1 . . . . . . . . 4407 1 650 . 1 1 69 69 VAL CA C 13 66.50 . . 1 . . . . . . . . 4407 1 651 . 1 1 69 69 VAL CB C 13 31.53 . . 1 . . . . . . . . 4407 1 652 . 1 1 69 69 VAL CG1 C 13 23.09 . . 2 . . . . . . . . 4407 1 653 . 1 1 69 69 VAL CG2 C 13 20.86 . . 2 . . . . . . . . 4407 1 654 . 1 1 69 69 VAL N N 15 121.22 . . 1 . . . . . . . . 4407 1 655 . 1 1 70 70 ASP HA H 1 4.04 . . 1 . . . . . . . . 4407 1 656 . 1 1 70 70 ASP HB2 H 1 2.69 . . 1 . . . . . . . . 4407 1 657 . 1 1 70 70 ASP HB3 H 1 2.69 . . 1 . . . . . . . . 4407 1 658 . 1 1 70 70 ASP H H 1 8.20 . . 1 . . . . . . . . 4407 1 659 . 1 1 70 70 ASP CA C 13 58.40 . . 1 . . . . . . . . 4407 1 660 . 1 1 70 70 ASP CB C 13 40.81 . . 1 . . . . . . . . 4407 1 661 . 1 1 70 70 ASP N N 15 117.79 . . 1 . . . . . . . . 4407 1 662 . 1 1 71 71 GLU HA H 1 4.07 . . 1 . . . . . . . . 4407 1 663 . 1 1 71 71 GLU HB2 H 1 2.10 . . 1 . . . . . . . . 4407 1 664 . 1 1 71 71 GLU HB3 H 1 2.10 . . 1 . . . . . . . . 4407 1 665 . 1 1 71 71 GLU HG2 H 1 2.28 . . 1 . . . . . . . . 4407 1 666 . 1 1 71 71 GLU HG3 H 1 2.28 . . 1 . . . . . . . . 4407 1 667 . 1 1 71 71 GLU H H 1 7.48 . . 1 . . . . . . . . 4407 1 668 . 1 1 71 71 GLU CA C 13 59.30 . . 1 . . . . . . . . 4407 1 669 . 1 1 71 71 GLU CB C 13 30.36 . . 1 . . . . . . . . 4407 1 670 . 1 1 71 71 GLU CG C 13 36.24 . . 1 . . . . . . . . 4407 1 671 . 1 1 71 71 GLU N N 15 117.73 . . 1 . . . . . . . . 4407 1 672 . 1 1 72 72 LYS HA H 1 4.06 . . 1 . . . . . . . . 4407 1 673 . 1 1 72 72 LYS HB2 H 1 1.89 . . 2 . . . . . . . . 4407 1 674 . 1 1 72 72 LYS HB3 H 1 1.79 . . 2 . . . . . . . . 4407 1 675 . 1 1 72 72 LYS HG2 H 1 1.65 . . 2 . . . . . . . . 4407 1 676 . 1 1 72 72 LYS HG3 H 1 1.45 . . 2 . . . . . . . . 4407 1 677 . 1 1 72 72 LYS HD2 H 1 1.60 . . 1 . . . . . . . . 4407 1 678 . 1 1 72 72 LYS HD3 H 1 1.60 . . 1 . . . . . . . . 4407 1 679 . 1 1 72 72 LYS HE2 H 1 2.86 . . 1 . . . . . . . . 4407 1 680 . 1 1 72 72 LYS HE3 H 1 2.86 . . 1 . . . . . . . . 4407 1 681 . 1 1 72 72 LYS H H 1 8.88 . . 1 . . . . . . . . 4407 1 682 . 1 1 72 72 LYS CA C 13 59.98 . . 1 . . . . . . . . 4407 1 683 . 1 1 72 72 LYS CB C 13 33.08 . . 1 . . . . . . . . 4407 1 684 . 1 1 72 72 LYS CG C 13 26.78 . . 1 . . . . . . . . 4407 1 685 . 1 1 72 72 LYS CD C 13 29.34 . . 1 . . . . . . . . 4407 1 686 . 1 1 72 72 LYS CE C 13 41.80 . . 1 . . . . . . . . 4407 1 687 . 1 1 72 72 LYS N N 15 118.93 . . 1 . . . . . . . . 4407 1 688 . 1 1 73 73 ALA HA H 1 4.29 . . 1 . . . . . . . . 4407 1 689 . 1 1 73 73 ALA HB1 H 1 1.62 . . 1 . . . . . . . . 4407 1 690 . 1 1 73 73 ALA HB2 H 1 1.62 . . 1 . . . . . . . . 4407 1 691 . 1 1 73 73 ALA HB3 H 1 1.62 . . 1 . . . . . . . . 4407 1 692 . 1 1 73 73 ALA H H 1 9.30 . . 1 . . . . . . . . 4407 1 693 . 1 1 73 73 ALA CA C 13 55.69 . . 1 . . . . . . . . 4407 1 694 . 1 1 73 73 ALA CB C 13 18.56 . . 1 . . . . . . . . 4407 1 695 . 1 1 73 73 ALA N N 15 121.39 . . 1 . . . . . . . . 4407 1 696 . 1 1 74 74 ARG HA H 1 4.07 . . 1 . . . . . . . . 4407 1 697 . 1 1 74 74 ARG HB2 H 1 2.00 . . 1 . . . . . . . . 4407 1 698 . 1 1 74 74 ARG HB3 H 1 2.00 . . 1 . . . . . . . . 4407 1 699 . 1 1 74 74 ARG HG2 H 1 1.87 . . 2 . . . . . . . . 4407 1 700 . 1 1 74 74 ARG HG3 H 1 1.65 . . 2 . . . . . . . . 4407 1 701 . 1 1 74 74 ARG HD2 H 1 3.22 . . 1 . . . . . . . . 4407 1 702 . 1 1 74 74 ARG HD3 H 1 3.22 . . 1 . . . . . . . . 4407 1 703 . 1 1 74 74 ARG H H 1 7.70 . . 1 . . . . . . . . 4407 1 704 . 1 1 74 74 ARG CA C 13 60.18 . . 1 . . . . . . . . 4407 1 705 . 1 1 74 74 ARG CB C 13 29.53 . . 1 . . . . . . . . 4407 1 706 . 1 1 74 74 ARG CG C 13 28.33 . . 1 . . . . . . . . 4407 1 707 . 1 1 74 74 ARG CD C 13 43.09 . . 1 . . . . . . . . 4407 1 708 . 1 1 74 74 ARG N N 15 116.70 . . 1 . . . . . . . . 4407 1 709 . 1 1 75 75 LEU HA H 1 4.15 . . 1 . . . . . . . . 4407 1 710 . 1 1 75 75 LEU HB2 H 1 1.83 . . 2 . . . . . . . . 4407 1 711 . 1 1 75 75 LEU HB3 H 1 1.69 . . 2 . . . . . . . . 4407 1 712 . 1 1 75 75 LEU HG H 1 1.79 . . 1 . . . . . . . . 4407 1 713 . 1 1 75 75 LEU HD11 H 1 0.90 . . 2 . . . . . . . . 4407 1 714 . 1 1 75 75 LEU HD12 H 1 0.90 . . 2 . . . . . . . . 4407 1 715 . 1 1 75 75 LEU HD13 H 1 0.90 . . 2 . . . . . . . . 4407 1 716 . 1 1 75 75 LEU HD21 H 1 0.89 . . 2 . . . . . . . . 4407 1 717 . 1 1 75 75 LEU HD22 H 1 0.89 . . 2 . . . . . . . . 4407 1 718 . 1 1 75 75 LEU HD23 H 1 0.89 . . 2 . . . . . . . . 4407 1 719 . 1 1 75 75 LEU H H 1 7.76 . . 1 . . . . . . . . 4407 1 720 . 1 1 75 75 LEU CA C 13 58.30 . . 1 . . . . . . . . 4407 1 721 . 1 1 75 75 LEU CB C 13 41.75 . . 1 . . . . . . . . 4407 1 722 . 1 1 75 75 LEU CG C 13 26.78 . . 1 . . . . . . . . 4407 1 723 . 1 1 75 75 LEU CD1 C 13 25.11 . . 2 . . . . . . . . 4407 1 724 . 1 1 75 75 LEU CD2 C 13 23.62 . . 2 . . . . . . . . 4407 1 725 . 1 1 75 75 LEU N N 15 119.75 . . 1 . . . . . . . . 4407 1 726 . 1 1 76 76 ILE HA H 1 3.80 . . 1 . . . . . . . . 4407 1 727 . 1 1 76 76 ILE HB H 1 1.67 . . 1 . . . . . . . . 4407 1 728 . 1 1 76 76 ILE HG12 H 1 2.00 . . 2 . . . . . . . . 4407 1 729 . 1 1 76 76 ILE HG13 H 1 0.72 . . 2 . . . . . . . . 4407 1 730 . 1 1 76 76 ILE HG21 H 1 0.21 . . 1 . . . . . . . . 4407 1 731 . 1 1 76 76 ILE HG22 H 1 0.21 . . 1 . . . . . . . . 4407 1 732 . 1 1 76 76 ILE HG23 H 1 0.21 . . 1 . . . . . . . . 4407 1 733 . 1 1 76 76 ILE HD11 H 1 0.53 . . 1 . . . . . . . . 4407 1 734 . 1 1 76 76 ILE HD12 H 1 0.53 . . 1 . . . . . . . . 4407 1 735 . 1 1 76 76 ILE HD13 H 1 0.53 . . 1 . . . . . . . . 4407 1 736 . 1 1 76 76 ILE H H 1 8.15 . . 1 . . . . . . . . 4407 1 737 . 1 1 76 76 ILE CA C 13 65.87 . . 1 . . . . . . . . 4407 1 738 . 1 1 76 76 ILE CB C 13 38.45 . . 1 . . . . . . . . 4407 1 739 . 1 1 76 76 ILE CG1 C 13 30.04 . . 1 . . . . . . . . 4407 1 740 . 1 1 76 76 ILE CG2 C 13 17.70 . . 1 . . . . . . . . 4407 1 741 . 1 1 76 76 ILE CD1 C 13 15.01 . . 1 . . . . . . . . 4407 1 742 . 1 1 76 76 ILE N N 15 119.45 . . 1 . . . . . . . . 4407 1 743 . 1 1 77 77 TYR HA H 1 4.06 . . 1 . . . . . . . . 4407 1 744 . 1 1 77 77 TYR HB2 H 1 3.50 . . 1 . . . . . . . . 4407 1 745 . 1 1 77 77 TYR HB3 H 1 3.50 . . 1 . . . . . . . . 4407 1 746 . 1 1 77 77 TYR HD1 H 1 7.14 . . 1 . . . . . . . . 4407 1 747 . 1 1 77 77 TYR HD2 H 1 7.14 . . 1 . . . . . . . . 4407 1 748 . 1 1 77 77 TYR HE1 H 1 6.91 . . 1 . . . . . . . . 4407 1 749 . 1 1 77 77 TYR HE2 H 1 6.91 . . 1 . . . . . . . . 4407 1 750 . 1 1 77 77 TYR H H 1 8.52 . . 1 . . . . . . . . 4407 1 751 . 1 1 77 77 TYR CA C 13 62.47 . . 1 . . . . . . . . 4407 1 752 . 1 1 77 77 TYR CB C 13 39.18 . . 1 . . . . . . . . 4407 1 753 . 1 1 77 77 TYR CD1 C 13 133.17 . . 1 . . . . . . . . 4407 1 754 . 1 1 77 77 TYR CD2 C 13 133.17 . . 1 . . . . . . . . 4407 1 755 . 1 1 77 77 TYR CE1 C 13 118.12 . . 1 . . . . . . . . 4407 1 756 . 1 1 77 77 TYR CE2 C 13 118.12 . . 1 . . . . . . . . 4407 1 757 . 1 1 77 77 TYR N N 15 119.51 . . 1 . . . . . . . . 4407 1 758 . 1 1 78 78 GLU HA H 1 3.90 . . 1 . . . . . . . . 4407 1 759 . 1 1 78 78 GLU HB2 H 1 2.09 . . 1 . . . . . . . . 4407 1 760 . 1 1 78 78 GLU HB3 H 1 2.09 . . 1 . . . . . . . . 4407 1 761 . 1 1 78 78 GLU HG2 H 1 2.62 . . 2 . . . . . . . . 4407 1 762 . 1 1 78 78 GLU HG3 H 1 2.55 . . 2 . . . . . . . . 4407 1 763 . 1 1 78 78 GLU H H 1 8.65 . . 1 . . . . . . . . 4407 1 764 . 1 1 78 78 GLU CA C 13 59.22 . . 1 . . . . . . . . 4407 1 765 . 1 1 78 78 GLU CB C 13 29.98 . . 1 . . . . . . . . 4407 1 766 . 1 1 78 78 GLU CG C 13 36.59 . . 1 . . . . . . . . 4407 1 767 . 1 1 78 78 GLU N N 15 118.09 . . 1 . . . . . . . . 4407 1 768 . 1 1 79 79 ASP HA H 1 4.45 . . 1 . . . . . . . . 4407 1 769 . 1 1 79 79 ASP HB2 H 1 2.41 . . 2 . . . . . . . . 4407 1 770 . 1 1 79 79 ASP HB3 H 1 1.33 . . 2 . . . . . . . . 4407 1 771 . 1 1 79 79 ASP H H 1 8.27 . . 1 . . . . . . . . 4407 1 772 . 1 1 79 79 ASP CA C 13 56.54 . . 1 . . . . . . . . 4407 1 773 . 1 1 79 79 ASP CB C 13 41.37 . . 1 . . . . . . . . 4407 1 774 . 1 1 79 79 ASP N N 15 116.36 . . 1 . . . . . . . . 4407 1 775 . 1 1 80 80 TYR HA H 1 4.75 . . 1 . . . . . . . . 4407 1 776 . 1 1 80 80 TYR HB2 H 1 2.80 . . 1 . . . . . . . . 4407 1 777 . 1 1 80 80 TYR HB3 H 1 2.80 . . 1 . . . . . . . . 4407 1 778 . 1 1 80 80 TYR HD1 H 1 7.42 . . 1 . . . . . . . . 4407 1 779 . 1 1 80 80 TYR HD2 H 1 7.42 . . 1 . . . . . . . . 4407 1 780 . 1 1 80 80 TYR HE1 H 1 6.84 . . 1 . . . . . . . . 4407 1 781 . 1 1 80 80 TYR HE2 H 1 6.84 . . 1 . . . . . . . . 4407 1 782 . 1 1 80 80 TYR H H 1 7.93 . . 1 . . . . . . . . 4407 1 783 . 1 1 80 80 TYR CA C 13 58.82 . . 1 . . . . . . . . 4407 1 784 . 1 1 80 80 TYR CB C 13 42.40 . . 1 . . . . . . . . 4407 1 785 . 1 1 80 80 TYR CD1 C 13 134.49 . . 1 . . . . . . . . 4407 1 786 . 1 1 80 80 TYR CD2 C 13 134.49 . . 1 . . . . . . . . 4407 1 787 . 1 1 80 80 TYR CE1 C 13 117.80 . . 1 . . . . . . . . 4407 1 788 . 1 1 80 80 TYR CE2 C 13 117.80 . . 1 . . . . . . . . 4407 1 789 . 1 1 80 80 TYR N N 15 112.08 . . 1 . . . . . . . . 4407 1 790 . 1 1 81 81 VAL HA H 1 3.92 . . 1 . . . . . . . . 4407 1 791 . 1 1 81 81 VAL HB H 1 1.95 . . 1 . . . . . . . . 4407 1 792 . 1 1 81 81 VAL HG11 H 1 0.95 . . 1 . . . . . . . . 4407 1 793 . 1 1 81 81 VAL HG12 H 1 0.95 . . 1 . . . . . . . . 4407 1 794 . 1 1 81 81 VAL HG13 H 1 0.95 . . 1 . . . . . . . . 4407 1 795 . 1 1 81 81 VAL HG21 H 1 0.95 . . 1 . . . . . . . . 4407 1 796 . 1 1 81 81 VAL HG22 H 1 0.95 . . 1 . . . . . . . . 4407 1 797 . 1 1 81 81 VAL HG23 H 1 0.95 . . 1 . . . . . . . . 4407 1 798 . 1 1 81 81 VAL H H 1 7.46 . . 1 . . . . . . . . 4407 1 799 . 1 1 81 81 VAL CA C 13 63.48 . . 1 . . . . . . . . 4407 1 800 . 1 1 81 81 VAL CB C 13 32.70 . . 1 . . . . . . . . 4407 1 801 . 1 1 81 81 VAL CG1 C 13 22.57 . . 1 . . . . . . . . 4407 1 802 . 1 1 81 81 VAL CG2 C 13 22.57 . . 1 . . . . . . . . 4407 1 803 . 1 1 81 81 VAL N N 15 116.02 . . 1 . . . . . . . . 4407 1 804 . 1 1 82 82 SER HA H 1 3.93 . . 1 . . . . . . . . 4407 1 805 . 1 1 82 82 SER HB2 H 1 3.68 . . 2 . . . . . . . . 4407 1 806 . 1 1 82 82 SER HB3 H 1 3.52 . . 2 . . . . . . . . 4407 1 807 . 1 1 82 82 SER H H 1 7.68 . . 1 . . . . . . . . 4407 1 808 . 1 1 82 82 SER CA C 13 57.85 . . 1 . . . . . . . . 4407 1 809 . 1 1 82 82 SER CB C 13 63.31 . . 1 . . . . . . . . 4407 1 810 . 1 1 82 82 SER N N 15 113.42 . . 1 . . . . . . . . 4407 1 811 . 1 1 83 83 ILE HA H 1 4.05 . . 1 . . . . . . . . 4407 1 812 . 1 1 83 83 ILE HB H 1 1.89 . . 1 . . . . . . . . 4407 1 813 . 1 1 83 83 ILE HG12 H 1 1.43 . . 2 . . . . . . . . 4407 1 814 . 1 1 83 83 ILE HG13 H 1 1.30 . . 2 . . . . . . . . 4407 1 815 . 1 1 83 83 ILE HG21 H 1 0.93 . . 1 . . . . . . . . 4407 1 816 . 1 1 83 83 ILE HG22 H 1 0.93 . . 1 . . . . . . . . 4407 1 817 . 1 1 83 83 ILE HG23 H 1 0.93 . . 1 . . . . . . . . 4407 1 818 . 1 1 83 83 ILE HD11 H 1 0.85 . . 1 . . . . . . . . 4407 1 819 . 1 1 83 83 ILE HD12 H 1 0.85 . . 1 . . . . . . . . 4407 1 820 . 1 1 83 83 ILE HD13 H 1 0.85 . . 1 . . . . . . . . 4407 1 821 . 1 1 83 83 ILE CA C 13 62.99 . . 1 . . . . . . . . 4407 1 822 . 1 1 83 83 ILE CB C 13 38.01 . . 1 . . . . . . . . 4407 1 823 . 1 1 83 83 ILE CG1 C 13 27.66 . . 1 . . . . . . . . 4407 1 824 . 1 1 83 83 ILE CG2 C 13 17.08 . . 1 . . . . . . . . 4407 1 825 . 1 1 83 83 ILE CD1 C 13 13.48 . . 1 . . . . . . . . 4407 1 826 . 1 1 84 84 LEU HA H 1 4.23 . . 1 . . . . . . . . 4407 1 827 . 1 1 84 84 LEU HB2 H 1 1.68 . . 1 . . . . . . . . 4407 1 828 . 1 1 84 84 LEU HB3 H 1 1.68 . . 1 . . . . . . . . 4407 1 829 . 1 1 84 84 LEU HG H 1 1.55 . . 1 . . . . . . . . 4407 1 830 . 1 1 84 84 LEU HD11 H 1 0.91 . . 2 . . . . . . . . 4407 1 831 . 1 1 84 84 LEU HD12 H 1 0.91 . . 2 . . . . . . . . 4407 1 832 . 1 1 84 84 LEU HD13 H 1 0.91 . . 2 . . . . . . . . 4407 1 833 . 1 1 84 84 LEU HD21 H 1 0.79 . . 2 . . . . . . . . 4407 1 834 . 1 1 84 84 LEU HD22 H 1 0.79 . . 2 . . . . . . . . 4407 1 835 . 1 1 84 84 LEU HD23 H 1 0.79 . . 2 . . . . . . . . 4407 1 836 . 1 1 84 84 LEU H H 1 8.23 . . 1 . . . . . . . . 4407 1 837 . 1 1 84 84 LEU CA C 13 55.28 . . 1 . . . . . . . . 4407 1 838 . 1 1 84 84 LEU CB C 13 40.82 . . 1 . . . . . . . . 4407 1 839 . 1 1 84 84 LEU CG C 13 27.09 . . 1 . . . . . . . . 4407 1 840 . 1 1 84 84 LEU CD1 C 13 25.50 . . 2 . . . . . . . . 4407 1 841 . 1 1 84 84 LEU CD2 C 13 22.68 . . 2 . . . . . . . . 4407 1 842 . 1 1 84 84 LEU N N 15 123.46 . . 1 . . . . . . . . 4407 1 843 . 1 1 85 85 SER HA H 1 4.48 . . 1 . . . . . . . . 4407 1 844 . 1 1 85 85 SER HB2 H 1 3.85 . . 2 . . . . . . . . 4407 1 845 . 1 1 85 85 SER HB3 H 1 3.72 . . 2 . . . . . . . . 4407 1 846 . 1 1 85 85 SER H H 1 7.60 . . 1 . . . . . . . . 4407 1 847 . 1 1 85 85 SER CA C 13 56.34 . . 1 . . . . . . . . 4407 1 848 . 1 1 85 85 SER CB C 13 63.11 . . 1 . . . . . . . . 4407 1 849 . 1 1 85 85 SER N N 15 115.69 . . 1 . . . . . . . . 4407 1 850 . 1 1 86 86 PRO HA H 1 4.42 . . 1 . . . . . . . . 4407 1 851 . 1 1 86 86 PRO HB2 H 1 2.29 . . 2 . . . . . . . . 4407 1 852 . 1 1 86 86 PRO HB3 H 1 1.95 . . 2 . . . . . . . . 4407 1 853 . 1 1 86 86 PRO HG2 H 1 2.09 . . 2 . . . . . . . . 4407 1 854 . 1 1 86 86 PRO HG3 H 1 1.96 . . 2 . . . . . . . . 4407 1 855 . 1 1 86 86 PRO HD3 H 1 4.08 . . 2 . . . . . . . . 4407 1 856 . 1 1 86 86 PRO HD2 H 1 3.78 . . 2 . . . . . . . . 4407 1 857 . 1 1 86 86 PRO CA C 13 64.17 . . 1 . . . . . . . . 4407 1 858 . 1 1 86 86 PRO CB C 13 32.12 . . 1 . . . . . . . . 4407 1 859 . 1 1 86 86 PRO CG C 13 27.57 . . 1 . . . . . . . . 4407 1 860 . 1 1 86 86 PRO CD C 13 50.57 . . 1 . . . . . . . . 4407 1 861 . 1 1 87 87 LYS HA H 1 4.36 . . 1 . . . . . . . . 4407 1 862 . 1 1 87 87 LYS HB2 H 1 1.69 . . 2 . . . . . . . . 4407 1 863 . 1 1 87 87 LYS HB3 H 1 1.49 . . 2 . . . . . . . . 4407 1 864 . 1 1 87 87 LYS HG2 H 1 1.24 . . 2 . . . . . . . . 4407 1 865 . 1 1 87 87 LYS HG3 H 1 1.11 . . 2 . . . . . . . . 4407 1 866 . 1 1 87 87 LYS HD2 H 1 1.50 . . 2 . . . . . . . . 4407 1 867 . 1 1 87 87 LYS HD3 H 1 1.24 . . 2 . . . . . . . . 4407 1 868 . 1 1 87 87 LYS HE2 H 1 2.85 . . 2 . . . . . . . . 4407 1 869 . 1 1 87 87 LYS HE3 H 1 2.74 . . 2 . . . . . . . . 4407 1 870 . 1 1 87 87 LYS H H 1 7.78 . . 1 . . . . . . . . 4407 1 871 . 1 1 87 87 LYS CA C 13 55.25 . . 1 . . . . . . . . 4407 1 872 . 1 1 87 87 LYS CB C 13 33.17 . . 1 . . . . . . . . 4407 1 873 . 1 1 87 87 LYS CG C 13 25.22 . . 1 . . . . . . . . 4407 1 874 . 1 1 87 87 LYS CD C 13 29.82 . . 1 . . . . . . . . 4407 1 875 . 1 1 87 87 LYS CE C 13 42.12 . . 1 . . . . . . . . 4407 1 876 . 1 1 87 87 LYS N N 15 118.88 . . 1 . . . . . . . . 4407 1 877 . 1 1 88 88 GLU HA H 1 4.13 . . 1 . . . . . . . . 4407 1 878 . 1 1 88 88 GLU HB2 H 1 1.96 . . 2 . . . . . . . . 4407 1 879 . 1 1 88 88 GLU HB3 H 1 1.83 . . 2 . . . . . . . . 4407 1 880 . 1 1 88 88 GLU HG2 H 1 2.08 . . 1 . . . . . . . . 4407 1 881 . 1 1 88 88 GLU HG3 H 1 2.08 . . 1 . . . . . . . . 4407 1 882 . 1 1 88 88 GLU CA C 13 56.73 . . 1 . . . . . . . . 4407 1 883 . 1 1 88 88 GLU CB C 13 30.64 . . 1 . . . . . . . . 4407 1 884 . 1 1 88 88 GLU CG C 13 35.68 . . 1 . . . . . . . . 4407 1 885 . 1 1 89 89 VAL HA H 1 4.50 . . 1 . . . . . . . . 4407 1 886 . 1 1 89 89 VAL HB H 1 1.96 . . 1 . . . . . . . . 4407 1 887 . 1 1 89 89 VAL HG11 H 1 0.82 . . 2 . . . . . . . . 4407 1 888 . 1 1 89 89 VAL HG12 H 1 0.82 . . 2 . . . . . . . . 4407 1 889 . 1 1 89 89 VAL HG13 H 1 0.82 . . 2 . . . . . . . . 4407 1 890 . 1 1 89 89 VAL HG21 H 1 0.47 . . 2 . . . . . . . . 4407 1 891 . 1 1 89 89 VAL HG22 H 1 0.47 . . 2 . . . . . . . . 4407 1 892 . 1 1 89 89 VAL HG23 H 1 0.47 . . 2 . . . . . . . . 4407 1 893 . 1 1 89 89 VAL H H 1 8.20 . . 1 . . . . . . . . 4407 1 894 . 1 1 89 89 VAL CA C 13 59.98 . . 1 . . . . . . . . 4407 1 895 . 1 1 89 89 VAL CB C 13 33.82 . . 1 . . . . . . . . 4407 1 896 . 1 1 89 89 VAL CG1 C 13 21.84 . . 2 . . . . . . . . 4407 1 897 . 1 1 89 89 VAL CG2 C 13 18.75 . . 2 . . . . . . . . 4407 1 898 . 1 1 89 89 VAL N N 15 120.02 . . 1 . . . . . . . . 4407 1 899 . 1 1 90 90 SER HA H 1 4.36 . . 1 . . . . . . . . 4407 1 900 . 1 1 90 90 SER HB2 H 1 3.91 . . 2 . . . . . . . . 4407 1 901 . 1 1 90 90 SER HB3 H 1 3.71 . . 2 . . . . . . . . 4407 1 902 . 1 1 90 90 SER H H 1 8.82 . . 1 . . . . . . . . 4407 1 903 . 1 1 90 90 SER CA C 13 57.93 . . 1 . . . . . . . . 4407 1 904 . 1 1 90 90 SER CB C 13 62.63 . . 1 . . . . . . . . 4407 1 905 . 1 1 90 90 SER N N 15 119.77 . . 1 . . . . . . . . 4407 1 906 . 1 1 91 91 LEU HA H 1 4.77 . . 1 . . . . . . . . 4407 1 907 . 1 1 91 91 LEU HB2 H 1 1.48 . . 1 . . . . . . . . 4407 1 908 . 1 1 91 91 LEU HB3 H 1 1.48 . . 1 . . . . . . . . 4407 1 909 . 1 1 91 91 LEU HG H 1 1.30 . . 1 . . . . . . . . 4407 1 910 . 1 1 91 91 LEU HD11 H 1 0.86 . . 2 . . . . . . . . 4407 1 911 . 1 1 91 91 LEU HD12 H 1 0.86 . . 2 . . . . . . . . 4407 1 912 . 1 1 91 91 LEU HD13 H 1 0.86 . . 2 . . . . . . . . 4407 1 913 . 1 1 91 91 LEU HD21 H 1 0.64 . . 2 . . . . . . . . 4407 1 914 . 1 1 91 91 LEU HD22 H 1 0.64 . . 2 . . . . . . . . 4407 1 915 . 1 1 91 91 LEU HD23 H 1 0.64 . . 2 . . . . . . . . 4407 1 916 . 1 1 91 91 LEU H H 1 7.61 . . 1 . . . . . . . . 4407 1 917 . 1 1 91 91 LEU CA C 13 52.95 . . 1 . . . . . . . . 4407 1 918 . 1 1 91 91 LEU CB C 13 45.29 . . 1 . . . . . . . . 4407 1 919 . 1 1 91 91 LEU CG C 13 27.83 . . 1 . . . . . . . . 4407 1 920 . 1 1 91 91 LEU CD1 C 13 23.99 . . 2 . . . . . . . . 4407 1 921 . 1 1 91 91 LEU CD2 C 13 26.20 . . 2 . . . . . . . . 4407 1 922 . 1 1 91 91 LEU N N 15 123.42 . . 1 . . . . . . . . 4407 1 923 . 1 1 92 92 ASP HA H 1 4.64 . . 1 . . . . . . . . 4407 1 924 . 1 1 92 92 ASP HB2 H 1 3.02 . . 2 . . . . . . . . 4407 1 925 . 1 1 92 92 ASP HB3 H 1 2.71 . . 2 . . . . . . . . 4407 1 926 . 1 1 92 92 ASP H H 1 8.74 . . 1 . . . . . . . . 4407 1 927 . 1 1 92 92 ASP CA C 13 53.70 . . 1 . . . . . . . . 4407 1 928 . 1 1 92 92 ASP CB C 13 42.30 . . 1 . . . . . . . . 4407 1 929 . 1 1 92 92 ASP N N 15 122.80 . . 1 . . . . . . . . 4407 1 930 . 1 1 93 93 SER HA H 1 4.11 . . 1 . . . . . . . . 4407 1 931 . 1 1 93 93 SER CA C 13 62.21 . . 1 . . . . . . . . 4407 1 932 . 1 1 94 94 ARG HA H 1 4.14 . . 1 . . . . . . . . 4407 1 933 . 1 1 94 94 ARG HB2 H 1 1.97 . . 1 . . . . . . . . 4407 1 934 . 1 1 94 94 ARG HB3 H 1 1.97 . . 1 . . . . . . . . 4407 1 935 . 1 1 94 94 ARG HD2 H 1 3.00 . . 2 . . . . . . . . 4407 1 936 . 1 1 94 94 ARG HD3 H 1 2.70 . . 2 . . . . . . . . 4407 1 937 . 1 1 94 94 ARG H H 1 8.41 . . 1 . . . . . . . . 4407 1 938 . 1 1 94 94 ARG CA C 13 59.29 . . 1 . . . . . . . . 4407 1 939 . 1 1 94 94 ARG CB C 13 29.71 . . 1 . . . . . . . . 4407 1 940 . 1 1 94 94 ARG CD C 13 42.06 . . 1 . . . . . . . . 4407 1 941 . 1 1 94 94 ARG N N 15 122.12 . . 1 . . . . . . . . 4407 1 942 . 1 1 95 95 VAL HA H 1 3.93 . . 1 . . . . . . . . 4407 1 943 . 1 1 95 95 VAL HB H 1 2.31 . . 1 . . . . . . . . 4407 1 944 . 1 1 95 95 VAL HG11 H 1 1.04 . . 2 . . . . . . . . 4407 1 945 . 1 1 95 95 VAL HG12 H 1 1.04 . . 2 . . . . . . . . 4407 1 946 . 1 1 95 95 VAL HG13 H 1 1.04 . . 2 . . . . . . . . 4407 1 947 . 1 1 95 95 VAL HG21 H 1 1.13 . . 2 . . . . . . . . 4407 1 948 . 1 1 95 95 VAL HG22 H 1 1.13 . . 2 . . . . . . . . 4407 1 949 . 1 1 95 95 VAL HG23 H 1 1.13 . . 2 . . . . . . . . 4407 1 950 . 1 1 95 95 VAL H H 1 8.11 . . 1 . . . . . . . . 4407 1 951 . 1 1 95 95 VAL CA C 13 65.43 . . 1 . . . . . . . . 4407 1 952 . 1 1 95 95 VAL CB C 13 31.70 . . 1 . . . . . . . . 4407 1 953 . 1 1 95 95 VAL CG1 C 13 22.05 . . 2 . . . . . . . . 4407 1 954 . 1 1 95 95 VAL CG2 C 13 23.25 . . 2 . . . . . . . . 4407 1 955 . 1 1 95 95 VAL N N 15 121.58 . . 1 . . . . . . . . 4407 1 956 . 1 1 96 96 ARG HA H 1 3.83 . . 1 . . . . . . . . 4407 1 957 . 1 1 96 96 ARG HB2 H 1 1.96 . . 2 . . . . . . . . 4407 1 958 . 1 1 96 96 ARG HB3 H 1 1.84 . . 2 . . . . . . . . 4407 1 959 . 1 1 96 96 ARG HG2 H 1 1.70 . . 2 . . . . . . . . 4407 1 960 . 1 1 96 96 ARG HG3 H 1 1.53 . . 2 . . . . . . . . 4407 1 961 . 1 1 96 96 ARG HD2 H 1 3.40 . . 2 . . . . . . . . 4407 1 962 . 1 1 96 96 ARG HD3 H 1 3.19 . . 2 . . . . . . . . 4407 1 963 . 1 1 96 96 ARG H H 1 8.23 . . 1 . . . . . . . . 4407 1 964 . 1 1 96 96 ARG CA C 13 60.99 . . 1 . . . . . . . . 4407 1 965 . 1 1 96 96 ARG CB C 13 30.30 . . 1 . . . . . . . . 4407 1 966 . 1 1 96 96 ARG CG C 13 28.82 . . 1 . . . . . . . . 4407 1 967 . 1 1 96 96 ARG CD C 13 43.32 . . 1 . . . . . . . . 4407 1 968 . 1 1 96 96 ARG N N 15 120.77 . . 1 . . . . . . . . 4407 1 969 . 1 1 97 97 GLU HA H 1 4.17 . . 1 . . . . . . . . 4407 1 970 . 1 1 97 97 GLU HB2 H 1 2.18 . . 2 . . . . . . . . 4407 1 971 . 1 1 97 97 GLU HB3 H 1 2.10 . . 2 . . . . . . . . 4407 1 972 . 1 1 97 97 GLU HG2 H 1 2.32 . . 2 . . . . . . . . 4407 1 973 . 1 1 97 97 GLU HG3 H 1 2.44 . . 2 . . . . . . . . 4407 1 974 . 1 1 97 97 GLU H H 1 8.33 . . 1 . . . . . . . . 4407 1 975 . 1 1 97 97 GLU CA C 13 59.31 . . 1 . . . . . . . . 4407 1 976 . 1 1 97 97 GLU CB C 13 29.53 . . 1 . . . . . . . . 4407 1 977 . 1 1 97 97 GLU CG C 13 36.15 . . 1 . . . . . . . . 4407 1 978 . 1 1 97 97 GLU N N 15 118.94 . . 1 . . . . . . . . 4407 1 979 . 1 1 98 98 GLY HA2 H 1 3.95 . . 1 . . . . . . . . 4407 1 980 . 1 1 98 98 GLY HA3 H 1 3.95 . . 1 . . . . . . . . 4407 1 981 . 1 1 98 98 GLY H H 1 7.95 . . 1 . . . . . . . . 4407 1 982 . 1 1 98 98 GLY CA C 13 47.34 . . 1 . . . . . . . . 4407 1 983 . 1 1 98 98 GLY N N 15 106.13 . . 1 . . . . . . . . 4407 1 984 . 1 1 99 99 ILE HA H 1 3.57 . . 1 . . . . . . . . 4407 1 985 . 1 1 99 99 ILE HB H 1 2.08 . . 1 . . . . . . . . 4407 1 986 . 1 1 99 99 ILE HG12 H 1 1.95 . . 2 . . . . . . . . 4407 1 987 . 1 1 99 99 ILE HG13 H 1 1.05 . . 2 . . . . . . . . 4407 1 988 . 1 1 99 99 ILE HG21 H 1 1.00 . . 1 . . . . . . . . 4407 1 989 . 1 1 99 99 ILE HG22 H 1 1.00 . . 1 . . . . . . . . 4407 1 990 . 1 1 99 99 ILE HG23 H 1 1.00 . . 1 . . . . . . . . 4407 1 991 . 1 1 99 99 ILE HD11 H 1 1.09 . . 1 . . . . . . . . 4407 1 992 . 1 1 99 99 ILE HD12 H 1 1.09 . . 1 . . . . . . . . 4407 1 993 . 1 1 99 99 ILE HD13 H 1 1.09 . . 1 . . . . . . . . 4407 1 994 . 1 1 99 99 ILE H H 1 7.93 . . 1 . . . . . . . . 4407 1 995 . 1 1 99 99 ILE CA C 13 65.15 . . 1 . . . . . . . . 4407 1 996 . 1 1 99 99 ILE CB C 13 38.12 . . 1 . . . . . . . . 4407 1 997 . 1 1 99 99 ILE CG1 C 13 29.33 . . 1 . . . . . . . . 4407 1 998 . 1 1 99 99 ILE CG2 C 13 19.52 . . 1 . . . . . . . . 4407 1 999 . 1 1 99 99 ILE CD1 C 13 15.44 . . 1 . . . . . . . . 4407 1 1000 . 1 1 99 99 ILE N N 15 121.55 . . 1 . . . . . . . . 4407 1 1001 . 1 1 100 100 ASN HA H 1 4.23 . . 1 . . . . . . . . 4407 1 1002 . 1 1 100 100 ASN HB2 H 1 3.06 . . 2 . . . . . . . . 4407 1 1003 . 1 1 100 100 ASN HB3 H 1 2.92 . . 2 . . . . . . . . 4407 1 1004 . 1 1 100 100 ASN HD21 H 1 7.58 . . 2 . . . . . . . . 4407 1 1005 . 1 1 100 100 ASN HD22 H 1 7.01 . . 2 . . . . . . . . 4407 1 1006 . 1 1 100 100 ASN H H 1 8.26 . . 1 . . . . . . . . 4407 1 1007 . 1 1 100 100 ASN CA C 13 56.74 . . 1 . . . . . . . . 4407 1 1008 . 1 1 100 100 ASN CB C 13 38.41 . . 1 . . . . . . . . 4407 1 1009 . 1 1 100 100 ASN ND2 N 15 111.95 . . 1 . . . . . . . . 4407 1 1010 . 1 1 100 100 ASN N N 15 117.91 . . 1 . . . . . . . . 4407 1 1011 . 1 1 101 101 LYS HA H 1 4.13 . . 1 . . . . . . . . 4407 1 1012 . 1 1 101 101 LYS HB2 H 1 1.95 . . 1 . . . . . . . . 4407 1 1013 . 1 1 101 101 LYS HB3 H 1 1.95 . . 1 . . . . . . . . 4407 1 1014 . 1 1 101 101 LYS HG2 H 1 1.59 . . 2 . . . . . . . . 4407 1 1015 . 1 1 101 101 LYS HG3 H 1 1.50 . . 2 . . . . . . . . 4407 1 1016 . 1 1 101 101 LYS HD2 H 1 1.69 . . 1 . . . . . . . . 4407 1 1017 . 1 1 101 101 LYS HD3 H 1 1.69 . . 1 . . . . . . . . 4407 1 1018 . 1 1 101 101 LYS HE2 H 1 3.07 . . 1 . . . . . . . . 4407 1 1019 . 1 1 101 101 LYS HE3 H 1 3.07 . . 1 . . . . . . . . 4407 1 1020 . 1 1 101 101 LYS H H 1 7.60 . . 1 . . . . . . . . 4407 1 1021 . 1 1 101 101 LYS CA C 13 58.77 . . 1 . . . . . . . . 4407 1 1022 . 1 1 101 101 LYS CB C 13 32.61 . . 1 . . . . . . . . 4407 1 1023 . 1 1 101 101 LYS CG C 13 25.05 . . 1 . . . . . . . . 4407 1 1024 . 1 1 101 101 LYS CD C 13 28.77 . . 1 . . . . . . . . 4407 1 1025 . 1 1 101 101 LYS CE C 13 38.25 . . 1 . . . . . . . . 4407 1 1026 . 1 1 101 101 LYS N N 15 117.09 . . 1 . . . . . . . . 4407 1 1027 . 1 1 102 102 LYS HA H 1 4.19 . . 1 . . . . . . . . 4407 1 1028 . 1 1 102 102 LYS HB2 H 1 1.97 . . 2 . . . . . . . . 4407 1 1029 . 1 1 102 102 LYS HB3 H 1 1.71 . . 2 . . . . . . . . 4407 1 1030 . 1 1 102 102 LYS HG2 H 1 1.62 . . 2 . . . . . . . . 4407 1 1031 . 1 1 102 102 LYS HG3 H 1 1.47 . . 2 . . . . . . . . 4407 1 1032 . 1 1 102 102 LYS HD2 H 1 1.69 . . 1 . . . . . . . . 4407 1 1033 . 1 1 102 102 LYS HD3 H 1 1.69 . . 1 . . . . . . . . 4407 1 1034 . 1 1 102 102 LYS HE2 H 1 3.00 . . 1 . . . . . . . . 4407 1 1035 . 1 1 102 102 LYS HE3 H 1 3.00 . . 1 . . . . . . . . 4407 1 1036 . 1 1 102 102 LYS H H 1 7.87 . . 1 . . . . . . . . 4407 1 1037 . 1 1 102 102 LYS CA C 13 58.01 . . 1 . . . . . . . . 4407 1 1038 . 1 1 102 102 LYS CB C 13 33.83 . . 1 . . . . . . . . 4407 1 1039 . 1 1 102 102 LYS CG C 13 26.10 . . 1 . . . . . . . . 4407 1 1040 . 1 1 102 102 LYS CD C 13 29.72 . . 1 . . . . . . . . 4407 1 1041 . 1 1 102 102 LYS CE C 13 42.31 . . 1 . . . . . . . . 4407 1 1042 . 1 1 102 102 LYS N N 15 119.66 . . 1 . . . . . . . . 4407 1 1043 . 1 1 103 103 MET HA H 1 4.31 . . 1 . . . . . . . . 4407 1 1044 . 1 1 103 103 MET HB2 H 1 1.89 . . 1 . . . . . . . . 4407 1 1045 . 1 1 103 103 MET HB3 H 1 1.89 . . 1 . . . . . . . . 4407 1 1046 . 1 1 103 103 MET HG2 H 1 2.41 . . 2 . . . . . . . . 4407 1 1047 . 1 1 103 103 MET HG3 H 1 1.89 . . 2 . . . . . . . . 4407 1 1048 . 1 1 103 103 MET HE1 H 1 1.76 . . 1 . . . . . . . . 4407 1 1049 . 1 1 103 103 MET HE2 H 1 1.76 . . 1 . . . . . . . . 4407 1 1050 . 1 1 103 103 MET HE3 H 1 1.76 . . 1 . . . . . . . . 4407 1 1051 . 1 1 103 103 MET H H 1 7.66 . . 1 . . . . . . . . 4407 1 1052 . 1 1 103 103 MET CA C 13 54.49 . . 1 . . . . . . . . 4407 1 1053 . 1 1 103 103 MET CB C 13 29.79 . . 1 . . . . . . . . 4407 1 1054 . 1 1 103 103 MET CG C 13 31.98 . . 1 . . . . . . . . 4407 1 1055 . 1 1 103 103 MET CE C 13 14.61 . . 1 . . . . . . . . 4407 1 1056 . 1 1 103 103 MET N N 15 116.02 . . 1 . . . . . . . . 4407 1 1057 . 1 1 104 104 GLN HA H 1 4.12 . . 1 . . . . . . . . 4407 1 1058 . 1 1 104 104 GLN HB2 H 1 2.11 . . 1 . . . . . . . . 4407 1 1059 . 1 1 104 104 GLN HB3 H 1 2.11 . . 1 . . . . . . . . 4407 1 1060 . 1 1 104 104 GLN HG2 H 1 2.48 . . 2 . . . . . . . . 4407 1 1061 . 1 1 104 104 GLN HG3 H 1 2.40 . . 2 . . . . . . . . 4407 1 1062 . 1 1 104 104 GLN HE21 H 1 7.56 . . 2 . . . . . . . . 4407 1 1063 . 1 1 104 104 GLN HE22 H 1 6.83 . . 2 . . . . . . . . 4407 1 1064 . 1 1 104 104 GLN H H 1 7.50 . . 1 . . . . . . . . 4407 1 1065 . 1 1 104 104 GLN CA C 13 58.11 . . 1 . . . . . . . . 4407 1 1066 . 1 1 104 104 GLN CB C 13 28.80 . . 1 . . . . . . . . 4407 1 1067 . 1 1 104 104 GLN CG C 13 34.27 . . 1 . . . . . . . . 4407 1 1068 . 1 1 104 104 GLN NE2 N 15 111.69 . . 1 . . . . . . . . 4407 1 1069 . 1 1 104 104 GLN N N 15 117.49 . . 1 . . . . . . . . 4407 1 1070 . 1 1 105 105 GLU HA H 1 4.58 . . 1 . . . . . . . . 4407 1 1071 . 1 1 105 105 GLU HB2 H 1 1.95 . . 2 . . . . . . . . 4407 1 1072 . 1 1 105 105 GLU HB3 H 1 1.85 . . 2 . . . . . . . . 4407 1 1073 . 1 1 105 105 GLU HG2 H 1 2.12 . . 1 . . . . . . . . 4407 1 1074 . 1 1 105 105 GLU HG3 H 1 2.12 . . 1 . . . . . . . . 4407 1 1075 . 1 1 105 105 GLU H H 1 7.58 . . 1 . . . . . . . . 4407 1 1076 . 1 1 105 105 GLU CA C 13 53.64 . . 1 . . . . . . . . 4407 1 1077 . 1 1 105 105 GLU CB C 13 30.47 . . 1 . . . . . . . . 4407 1 1078 . 1 1 105 105 GLU CG C 13 36.18 . . 1 . . . . . . . . 4407 1 1079 . 1 1 105 105 GLU N N 15 117.36 . . 1 . . . . . . . . 4407 1 1080 . 1 1 106 106 PRO HA H 1 4.26 . . 1 . . . . . . . . 4407 1 1081 . 1 1 106 106 PRO HB2 H 1 2.14 . . 2 . . . . . . . . 4407 1 1082 . 1 1 106 106 PRO HB3 H 1 1.74 . . 2 . . . . . . . . 4407 1 1083 . 1 1 106 106 PRO HG2 H 1 1.99 . . 1 . . . . . . . . 4407 1 1084 . 1 1 106 106 PRO HG3 H 1 1.99 . . 1 . . . . . . . . 4407 1 1085 . 1 1 106 106 PRO HD3 H 1 3.53 . . 2 . . . . . . . . 4407 1 1086 . 1 1 106 106 PRO HD2 H 1 3.47 . . 2 . . . . . . . . 4407 1 1087 . 1 1 106 106 PRO CA C 13 63.72 . . 1 . . . . . . . . 4407 1 1088 . 1 1 106 106 PRO CB C 13 32.83 . . 1 . . . . . . . . 4407 1 1089 . 1 1 106 106 PRO CG C 13 27.22 . . 1 . . . . . . . . 4407 1 1090 . 1 1 106 106 PRO CD C 13 49.82 . . 1 . . . . . . . . 4407 1 1091 . 1 1 107 107 SER HA H 1 4.76 . . 1 . . . . . . . . 4407 1 1092 . 1 1 107 107 SER HB2 H 1 4.16 . . 2 . . . . . . . . 4407 1 1093 . 1 1 107 107 SER HB3 H 1 3.90 . . 2 . . . . . . . . 4407 1 1094 . 1 1 107 107 SER H H 1 8.69 . . 1 . . . . . . . . 4407 1 1095 . 1 1 107 107 SER CA C 13 56.92 . . 1 . . . . . . . . 4407 1 1096 . 1 1 107 107 SER CB C 13 67.66 . . 1 . . . . . . . . 4407 1 1097 . 1 1 107 107 SER N N 15 115.46 . . 1 . . . . . . . . 4407 1 1098 . 1 1 108 108 ALA HA H 1 3.93 . . 1 . . . . . . . . 4407 1 1099 . 1 1 108 108 ALA HB1 H 1 1.31 . . 1 . . . . . . . . 4407 1 1100 . 1 1 108 108 ALA HB2 H 1 1.31 . . 1 . . . . . . . . 4407 1 1101 . 1 1 108 108 ALA HB3 H 1 1.31 . . 1 . . . . . . . . 4407 1 1102 . 1 1 108 108 ALA H H 1 8.91 . . 1 . . . . . . . . 4407 1 1103 . 1 1 108 108 ALA CA C 13 54.09 . . 1 . . . . . . . . 4407 1 1104 . 1 1 108 108 ALA CB C 13 18.86 . . 1 . . . . . . . . 4407 1 1105 . 1 1 108 108 ALA N N 15 121.03 . . 1 . . . . . . . . 4407 1 1106 . 1 1 109 109 HIS HA H 1 4.82 . . 1 . . . . . . . . 4407 1 1107 . 1 1 109 109 HIS HB2 H 1 2.69 . . 1 . . . . . . . . 4407 1 1108 . 1 1 109 109 HIS HB3 H 1 2.69 . . 1 . . . . . . . . 4407 1 1109 . 1 1 109 109 HIS H H 1 7.75 . . 1 . . . . . . . . 4407 1 1110 . 1 1 109 109 HIS CA C 13 55.40 . . 1 . . . . . . . . 4407 1 1111 . 1 1 109 109 HIS CB C 13 29.86 . . 1 . . . . . . . . 4407 1 1112 . 1 1 109 109 HIS N N 15 110.07 . . 1 . . . . . . . . 4407 1 1113 . 1 1 110 110 THR HA H 1 3.53 . . 1 . . . . . . . . 4407 1 1114 . 1 1 110 110 THR HB H 1 3.39 . . 1 . . . . . . . . 4407 1 1115 . 1 1 110 110 THR HG21 H 1 0.40 . . 1 . . . . . . . . 4407 1 1116 . 1 1 110 110 THR HG22 H 1 0.40 . . 1 . . . . . . . . 4407 1 1117 . 1 1 110 110 THR HG23 H 1 0.40 . . 1 . . . . . . . . 4407 1 1118 . 1 1 110 110 THR H H 1 7.66 . . 1 . . . . . . . . 4407 1 1119 . 1 1 110 110 THR CA C 13 67.84 . . 1 . . . . . . . . 4407 1 1120 . 1 1 110 110 THR CB C 13 70.49 . . 1 . . . . . . . . 4407 1 1121 . 1 1 110 110 THR CG2 C 13 22.00 . . 1 . . . . . . . . 4407 1 1122 . 1 1 110 110 THR N N 15 120.14 . . 1 . . . . . . . . 4407 1 1123 . 1 1 111 111 PHE HA H 1 4.58 . . 1 . . . . . . . . 4407 1 1124 . 1 1 111 111 PHE HB2 H 1 3.61 . . 2 . . . . . . . . 4407 1 1125 . 1 1 111 111 PHE HB3 H 1 2.94 . . 2 . . . . . . . . 4407 1 1126 . 1 1 111 111 PHE HD1 H 1 7.22 . . 1 . . . . . . . . 4407 1 1127 . 1 1 111 111 PHE HD2 H 1 7.22 . . 1 . . . . . . . . 4407 1 1128 . 1 1 111 111 PHE H H 1 8.46 . . 1 . . . . . . . . 4407 1 1129 . 1 1 111 111 PHE CA C 13 57.94 . . 1 . . . . . . . . 4407 1 1130 . 1 1 111 111 PHE CB C 13 40.36 . . 1 . . . . . . . . 4407 1 1131 . 1 1 111 111 PHE CD1 C 13 131.68 . . 1 . . . . . . . . 4407 1 1132 . 1 1 111 111 PHE CD2 C 13 131.68 . . 1 . . . . . . . . 4407 1 1133 . 1 1 111 111 PHE N N 15 114.01 . . 1 . . . . . . . . 4407 1 1134 . 1 1 112 112 ASP HA H 1 4.29 . . 1 . . . . . . . . 4407 1 1135 . 1 1 112 112 ASP HB2 H 1 2.82 . . 1 . . . . . . . . 4407 1 1136 . 1 1 112 112 ASP HB3 H 1 2.82 . . 1 . . . . . . . . 4407 1 1137 . 1 1 112 112 ASP H H 1 7.53 . . 1 . . . . . . . . 4407 1 1138 . 1 1 112 112 ASP CA C 13 58.85 . . 1 . . . . . . . . 4407 1 1139 . 1 1 112 112 ASP CB C 13 40.01 . . 1 . . . . . . . . 4407 1 1140 . 1 1 112 112 ASP N N 15 121.23 . . 1 . . . . . . . . 4407 1 1141 . 1 1 113 113 ASP HA H 1 4.59 . . 1 . . . . . . . . 4407 1 1142 . 1 1 113 113 ASP HB2 H 1 2.72 . . 1 . . . . . . . . 4407 1 1143 . 1 1 113 113 ASP HB3 H 1 2.72 . . 1 . . . . . . . . 4407 1 1144 . 1 1 113 113 ASP CA C 13 57.40 . . 1 . . . . . . . . 4407 1 1145 . 1 1 113 113 ASP CB C 13 40.10 . . 1 . . . . . . . . 4407 1 1146 . 1 1 114 114 ALA HA H 1 4.19 . . 1 . . . . . . . . 4407 1 1147 . 1 1 114 114 ALA HB1 H 1 1.76 . . 1 . . . . . . . . 4407 1 1148 . 1 1 114 114 ALA HB2 H 1 1.76 . . 1 . . . . . . . . 4407 1 1149 . 1 1 114 114 ALA HB3 H 1 1.76 . . 1 . . . . . . . . 4407 1 1150 . 1 1 114 114 ALA H H 1 8.06 . . 1 . . . . . . . . 4407 1 1151 . 1 1 114 114 ALA CA C 13 55.07 . . 1 . . . . . . . . 4407 1 1152 . 1 1 114 114 ALA CB C 13 20.28 . . 1 . . . . . . . . 4407 1 1153 . 1 1 114 114 ALA N N 15 123.60 . . 1 . . . . . . . . 4407 1 1154 . 1 1 115 115 GLN HA H 1 3.93 . . 1 . . . . . . . . 4407 1 1155 . 1 1 115 115 GLN HB2 H 1 2.27 . . 2 . . . . . . . . 4407 1 1156 . 1 1 115 115 GLN HB3 H 1 2.04 . . 2 . . . . . . . . 4407 1 1157 . 1 1 115 115 GLN HG2 H 1 2.28 . . 1 . . . . . . . . 4407 1 1158 . 1 1 115 115 GLN HG3 H 1 2.28 . . 1 . . . . . . . . 4407 1 1159 . 1 1 115 115 GLN H H 1 9.56 . . 1 . . . . . . . . 4407 1 1160 . 1 1 115 115 GLN CA C 13 60.51 . . 1 . . . . . . . . 4407 1 1161 . 1 1 115 115 GLN CB C 13 28.15 . . 1 . . . . . . . . 4407 1 1162 . 1 1 115 115 GLN CG C 13 28.13 . . 1 . . . . . . . . 4407 1 1163 . 1 1 115 115 GLN N N 15 118.87 . . 1 . . . . . . . . 4407 1 1164 . 1 1 116 116 LEU HA H 1 4.46 . . 1 . . . . . . . . 4407 1 1165 . 1 1 116 116 LEU HB2 H 1 1.97 . . 2 . . . . . . . . 4407 1 1166 . 1 1 116 116 LEU HB3 H 1 1.83 . . 2 . . . . . . . . 4407 1 1167 . 1 1 116 116 LEU HG H 1 1.75 . . 1 . . . . . . . . 4407 1 1168 . 1 1 116 116 LEU HD11 H 1 0.97 . . 2 . . . . . . . . 4407 1 1169 . 1 1 116 116 LEU HD12 H 1 0.97 . . 2 . . . . . . . . 4407 1 1170 . 1 1 116 116 LEU HD13 H 1 0.97 . . 2 . . . . . . . . 4407 1 1171 . 1 1 116 116 LEU HD21 H 1 0.96 . . 2 . . . . . . . . 4407 1 1172 . 1 1 116 116 LEU HD22 H 1 0.96 . . 2 . . . . . . . . 4407 1 1173 . 1 1 116 116 LEU HD23 H 1 0.96 . . 2 . . . . . . . . 4407 1 1174 . 1 1 116 116 LEU H H 1 8.06 . . 1 . . . . . . . . 4407 1 1175 . 1 1 116 116 LEU CA C 13 58.00 . . 1 . . . . . . . . 4407 1 1176 . 1 1 116 116 LEU CB C 13 41.67 . . 1 . . . . . . . . 4407 1 1177 . 1 1 116 116 LEU CG C 13 27.28 . . 1 . . . . . . . . 4407 1 1178 . 1 1 116 116 LEU CD1 C 13 23.47 . . 2 . . . . . . . . 4407 1 1179 . 1 1 116 116 LEU CD2 C 13 25.25 . . 2 . . . . . . . . 4407 1 1180 . 1 1 116 116 LEU N N 15 119.44 . . 1 . . . . . . . . 4407 1 1181 . 1 1 117 117 GLN HA H 1 4.22 . . 1 . . . . . . . . 4407 1 1182 . 1 1 117 117 GLN HB2 H 1 2.37 . . 1 . . . . . . . . 4407 1 1183 . 1 1 117 117 GLN HB3 H 1 2.37 . . 1 . . . . . . . . 4407 1 1184 . 1 1 117 117 GLN HG2 H 1 2.43 . . 2 . . . . . . . . 4407 1 1185 . 1 1 117 117 GLN HG3 H 1 2.64 . . 2 . . . . . . . . 4407 1 1186 . 1 1 117 117 GLN HE21 H 1 7.36 . . 2 . . . . . . . . 4407 1 1187 . 1 1 117 117 GLN HE22 H 1 6.83 . . 2 . . . . . . . . 4407 1 1188 . 1 1 117 117 GLN H H 1 8.12 . . 1 . . . . . . . . 4407 1 1189 . 1 1 117 117 GLN CA C 13 60.18 . . 1 . . . . . . . . 4407 1 1190 . 1 1 117 117 GLN CB C 13 28.57 . . 1 . . . . . . . . 4407 1 1191 . 1 1 117 117 GLN CG C 13 34.56 . . 1 . . . . . . . . 4407 1 1192 . 1 1 117 117 GLN NE2 N 15 109.93 . . 1 . . . . . . . . 4407 1 1193 . 1 1 117 117 GLN N N 15 121.35 . . 1 . . . . . . . . 4407 1 1194 . 1 1 118 118 ILE HA H 1 4.21 . . 1 . . . . . . . . 4407 1 1195 . 1 1 118 118 ILE HB H 1 2.48 . . 1 . . . . . . . . 4407 1 1196 . 1 1 118 118 ILE HG12 H 1 1.97 . . 2 . . . . . . . . 4407 1 1197 . 1 1 118 118 ILE HG13 H 1 1.50 . . 2 . . . . . . . . 4407 1 1198 . 1 1 118 118 ILE HG21 H 1 1.43 . . 1 . . . . . . . . 4407 1 1199 . 1 1 118 118 ILE HG22 H 1 1.43 . . 1 . . . . . . . . 4407 1 1200 . 1 1 118 118 ILE HG23 H 1 1.43 . . 1 . . . . . . . . 4407 1 1201 . 1 1 118 118 ILE HD11 H 1 0.80 . . 1 . . . . . . . . 4407 1 1202 . 1 1 118 118 ILE HD12 H 1 0.80 . . 1 . . . . . . . . 4407 1 1203 . 1 1 118 118 ILE HD13 H 1 0.80 . . 1 . . . . . . . . 4407 1 1204 . 1 1 118 118 ILE H H 1 8.41 . . 1 . . . . . . . . 4407 1 1205 . 1 1 118 118 ILE CA C 13 61.87 . . 1 . . . . . . . . 4407 1 1206 . 1 1 118 118 ILE CB C 13 36.57 . . 1 . . . . . . . . 4407 1 1207 . 1 1 118 118 ILE CG1 C 13 29.06 . . 1 . . . . . . . . 4407 1 1208 . 1 1 118 118 ILE CG2 C 13 19.79 . . 1 . . . . . . . . 4407 1 1209 . 1 1 118 118 ILE CD1 C 13 9.71 . . 1 . . . . . . . . 4407 1 1210 . 1 1 118 118 ILE N N 15 120.68 . . 1 . . . . . . . . 4407 1 1211 . 1 1 119 119 TYR HA H 1 3.92 . . 1 . . . . . . . . 4407 1 1212 . 1 1 119 119 TYR HB2 H 1 3.41 . . 1 . . . . . . . . 4407 1 1213 . 1 1 119 119 TYR HB3 H 1 3.41 . . 1 . . . . . . . . 4407 1 1214 . 1 1 119 119 TYR HD1 H 1 6.72 . . 1 . . . . . . . . 4407 1 1215 . 1 1 119 119 TYR HD2 H 1 6.72 . . 1 . . . . . . . . 4407 1 1216 . 1 1 119 119 TYR HE1 H 1 6.37 . . 1 . . . . . . . . 4407 1 1217 . 1 1 119 119 TYR HE2 H 1 6.37 . . 1 . . . . . . . . 4407 1 1218 . 1 1 119 119 TYR H H 1 9.20 . . 1 . . . . . . . . 4407 1 1219 . 1 1 119 119 TYR CA C 13 63.46 . . 1 . . . . . . . . 4407 1 1220 . 1 1 119 119 TYR CB C 13 39.43 . . 1 . . . . . . . . 4407 1 1221 . 1 1 119 119 TYR CD1 C 13 133.27 . . 1 . . . . . . . . 4407 1 1222 . 1 1 119 119 TYR CD2 C 13 133.27 . . 1 . . . . . . . . 4407 1 1223 . 1 1 119 119 TYR CE1 C 13 118.12 . . 1 . . . . . . . . 4407 1 1224 . 1 1 119 119 TYR CE2 C 13 118.12 . . 1 . . . . . . . . 4407 1 1225 . 1 1 119 119 TYR N N 15 124.17 . . 1 . . . . . . . . 4407 1 1226 . 1 1 120 120 THR HA H 1 4.04 . . 1 . . . . . . . . 4407 1 1227 . 1 1 120 120 THR HB H 1 4.50 . . 1 . . . . . . . . 4407 1 1228 . 1 1 120 120 THR HG21 H 1 1.39 . . 1 . . . . . . . . 4407 1 1229 . 1 1 120 120 THR HG22 H 1 1.39 . . 1 . . . . . . . . 4407 1 1230 . 1 1 120 120 THR HG23 H 1 1.39 . . 1 . . . . . . . . 4407 1 1231 . 1 1 120 120 THR H H 1 8.60 . . 1 . . . . . . . . 4407 1 1232 . 1 1 120 120 THR CA C 13 66.96 . . 1 . . . . . . . . 4407 1 1233 . 1 1 120 120 THR CB C 13 69.22 . . 1 . . . . . . . . 4407 1 1234 . 1 1 120 120 THR CG2 C 13 21.42 . . 1 . . . . . . . . 4407 1 1235 . 1 1 120 120 THR N N 15 113.42 . . 1 . . . . . . . . 4407 1 1236 . 1 1 121 121 LEU HA H 1 4.14 . . 1 . . . . . . . . 4407 1 1237 . 1 1 121 121 LEU HB2 H 1 2.06 . . 2 . . . . . . . . 4407 1 1238 . 1 1 121 121 LEU HB3 H 1 1.88 . . 2 . . . . . . . . 4407 1 1239 . 1 1 121 121 LEU HG H 1 1.82 . . 1 . . . . . . . . 4407 1 1240 . 1 1 121 121 LEU HD11 H 1 1.00 . . 1 . . . . . . . . 4407 1 1241 . 1 1 121 121 LEU HD12 H 1 1.00 . . 1 . . . . . . . . 4407 1 1242 . 1 1 121 121 LEU HD13 H 1 1.00 . . 1 . . . . . . . . 4407 1 1243 . 1 1 121 121 LEU HD21 H 1 1.00 . . 1 . . . . . . . . 4407 1 1244 . 1 1 121 121 LEU HD22 H 1 1.00 . . 1 . . . . . . . . 4407 1 1245 . 1 1 121 121 LEU HD23 H 1 1.00 . . 1 . . . . . . . . 4407 1 1246 . 1 1 121 121 LEU H H 1 8.00 . . 1 . . . . . . . . 4407 1 1247 . 1 1 121 121 LEU CA C 13 58.89 . . 1 . . . . . . . . 4407 1 1248 . 1 1 121 121 LEU CB C 13 42.42 . . 1 . . . . . . . . 4407 1 1249 . 1 1 121 121 LEU CG C 13 27.14 . . 1 . . . . . . . . 4407 1 1250 . 1 1 121 121 LEU CD1 C 13 25.00 . . 1 . . . . . . . . 4407 1 1251 . 1 1 121 121 LEU CD2 C 13 25.00 . . 1 . . . . . . . . 4407 1 1252 . 1 1 121 121 LEU N N 15 123.98 . . 1 . . . . . . . . 4407 1 1253 . 1 1 122 122 MET HA H 1 4.20 . . 1 . . . . . . . . 4407 1 1254 . 1 1 122 122 MET HB2 H 1 2.55 . . 2 . . . . . . . . 4407 1 1255 . 1 1 122 122 MET HB3 H 1 1.95 . . 2 . . . . . . . . 4407 1 1256 . 1 1 122 122 MET HG2 H 1 3.12 . . 2 . . . . . . . . 4407 1 1257 . 1 1 122 122 MET HG3 H 1 2.53 . . 2 . . . . . . . . 4407 1 1258 . 1 1 122 122 MET HE1 H 1 1.88 . . 1 . . . . . . . . 4407 1 1259 . 1 1 122 122 MET HE2 H 1 1.88 . . 1 . . . . . . . . 4407 1 1260 . 1 1 122 122 MET HE3 H 1 1.88 . . 1 . . . . . . . . 4407 1 1261 . 1 1 122 122 MET H H 1 8.47 . . 1 . . . . . . . . 4407 1 1262 . 1 1 122 122 MET CA C 13 60.60 . . 1 . . . . . . . . 4407 1 1263 . 1 1 122 122 MET CB C 13 35.18 . . 1 . . . . . . . . 4407 1 1264 . 1 1 122 122 MET CG C 13 32.01 . . 1 . . . . . . . . 4407 1 1265 . 1 1 122 122 MET CE C 13 16.54 . . 1 . . . . . . . . 4407 1 1266 . 1 1 122 122 MET N N 15 117.81 . . 1 . . . . . . . . 4407 1 1267 . 1 1 123 123 HIS HA H 1 2.67 . . 1 . . . . . . . . 4407 1 1268 . 1 1 123 123 HIS HB2 H 1 3.06 . . 2 . . . . . . . . 4407 1 1269 . 1 1 123 123 HIS HB3 H 1 2.36 . . 2 . . . . . . . . 4407 1 1270 . 1 1 123 123 HIS H H 1 8.11 . . 1 . . . . . . . . 4407 1 1271 . 1 1 123 123 HIS CA C 13 56.96 . . 1 . . . . . . . . 4407 1 1272 . 1 1 123 123 HIS CB C 13 31.70 . . 1 . . . . . . . . 4407 1 1273 . 1 1 123 123 HIS N N 15 118.86 . . 1 . . . . . . . . 4407 1 1274 . 1 1 124 124 ARG HA H 1 3.89 . . 1 . . . . . . . . 4407 1 1275 . 1 1 124 124 ARG HB2 H 1 1.85 . . 1 . . . . . . . . 4407 1 1276 . 1 1 124 124 ARG HB3 H 1 1.85 . . 1 . . . . . . . . 4407 1 1277 . 1 1 124 124 ARG HG2 H 1 1.69 . . 2 . . . . . . . . 4407 1 1278 . 1 1 124 124 ARG HG3 H 1 1.63 . . 2 . . . . . . . . 4407 1 1279 . 1 1 124 124 ARG HD2 H 1 3.12 . . 1 . . . . . . . . 4407 1 1280 . 1 1 124 124 ARG HD3 H 1 3.12 . . 1 . . . . . . . . 4407 1 1281 . 1 1 124 124 ARG H H 1 8.16 . . 1 . . . . . . . . 4407 1 1282 . 1 1 124 124 ARG CA C 13 58.30 . . 1 . . . . . . . . 4407 1 1283 . 1 1 124 124 ARG CB C 13 31.40 . . 1 . . . . . . . . 4407 1 1284 . 1 1 124 124 ARG CG C 13 26.88 . . 1 . . . . . . . . 4407 1 1285 . 1 1 124 124 ARG CD C 13 43.53 . . 1 . . . . . . . . 4407 1 1286 . 1 1 124 124 ARG N N 15 115.08 . . 1 . . . . . . . . 4407 1 1287 . 1 1 125 125 ASP HA H 1 4.92 . . 1 . . . . . . . . 4407 1 1288 . 1 1 125 125 ASP HB2 H 1 2.80 . . 1 . . . . . . . . 4407 1 1289 . 1 1 125 125 ASP HB3 H 1 2.80 . . 1 . . . . . . . . 4407 1 1290 . 1 1 125 125 ASP H H 1 8.35 . . 1 . . . . . . . . 4407 1 1291 . 1 1 125 125 ASP CA C 13 56.01 . . 1 . . . . . . . . 4407 1 1292 . 1 1 125 125 ASP CB C 13 42.50 . . 1 . . . . . . . . 4407 1 1293 . 1 1 125 125 ASP N N 15 115.15 . . 1 . . . . . . . . 4407 1 1294 . 1 1 126 126 SER HA H 1 4.65 . . 1 . . . . . . . . 4407 1 1295 . 1 1 126 126 SER HB2 H 1 4.19 . . 1 . . . . . . . . 4407 1 1296 . 1 1 126 126 SER HB3 H 1 4.19 . . 1 . . . . . . . . 4407 1 1297 . 1 1 126 126 SER H H 1 7.46 . . 1 . . . . . . . . 4407 1 1298 . 1 1 126 126 SER CA C 13 62.26 . . 1 . . . . . . . . 4407 1 1299 . 1 1 126 126 SER CB C 13 64.29 . . 1 . . . . . . . . 4407 1 1300 . 1 1 126 126 SER N N 15 113.46 . . 1 . . . . . . . . 4407 1 1301 . 1 1 127 127 TYR HA H 1 4.53 . . 1 . . . . . . . . 4407 1 1302 . 1 1 127 127 TYR HB2 H 1 3.45 . . 2 . . . . . . . . 4407 1 1303 . 1 1 127 127 TYR HB3 H 1 2.63 . . 2 . . . . . . . . 4407 1 1304 . 1 1 127 127 TYR HD1 H 1 7.42 . . 1 . . . . . . . . 4407 1 1305 . 1 1 127 127 TYR HD2 H 1 7.42 . . 1 . . . . . . . . 4407 1 1306 . 1 1 127 127 TYR HE1 H 1 6.84 . . 1 . . . . . . . . 4407 1 1307 . 1 1 127 127 TYR HE2 H 1 6.84 . . 1 . . . . . . . . 4407 1 1308 . 1 1 127 127 TYR H H 1 8.70 . . 1 . . . . . . . . 4407 1 1309 . 1 1 127 127 TYR CA C 13 61.95 . . 1 . . . . . . . . 4407 1 1310 . 1 1 127 127 TYR CB C 13 35.81 . . 1 . . . . . . . . 4407 1 1311 . 1 1 127 127 TYR CD1 C 13 134.22 . . 1 . . . . . . . . 4407 1 1312 . 1 1 127 127 TYR CD2 C 13 134.22 . . 1 . . . . . . . . 4407 1 1313 . 1 1 127 127 TYR CE1 C 13 117.80 . . 1 . . . . . . . . 4407 1 1314 . 1 1 127 127 TYR CE2 C 13 117.80 . . 1 . . . . . . . . 4407 1 1315 . 1 1 127 127 TYR N N 15 122.03 . . 1 . . . . . . . . 4407 1 1316 . 1 1 128 128 PRO HA H 1 3.83 . . 1 . . . . . . . . 4407 1 1317 . 1 1 128 128 PRO HB2 H 1 2.21 . . 2 . . . . . . . . 4407 1 1318 . 1 1 128 128 PRO HB3 H 1 1.75 . . 2 . . . . . . . . 4407 1 1319 . 1 1 128 128 PRO HG2 H 1 2.02 . . 2 . . . . . . . . 4407 1 1320 . 1 1 128 128 PRO HG3 H 1 1.95 . . 2 . . . . . . . . 4407 1 1321 . 1 1 128 128 PRO HD2 H 1 3.33 . . 1 . . . . . . . . 4407 1 1322 . 1 1 128 128 PRO HD3 H 1 3.33 . . 1 . . . . . . . . 4407 1 1323 . 1 1 128 128 PRO CA C 13 66.17 . . 1 . . . . . . . . 4407 1 1324 . 1 1 128 128 PRO CB C 13 30.82 . . 1 . . . . . . . . 4407 1 1325 . 1 1 128 128 PRO CG C 13 28.94 . . 1 . . . . . . . . 4407 1 1326 . 1 1 128 128 PRO CD C 13 49.69 . . 1 . . . . . . . . 4407 1 1327 . 1 1 129 129 ARG HA H 1 4.05 . . 1 . . . . . . . . 4407 1 1328 . 1 1 129 129 ARG HB2 H 1 2.19 . . 1 . . . . . . . . 4407 1 1329 . 1 1 129 129 ARG HB3 H 1 2.19 . . 1 . . . . . . . . 4407 1 1330 . 1 1 129 129 ARG HG2 H 1 1.95 . . 2 . . . . . . . . 4407 1 1331 . 1 1 129 129 ARG HG3 H 1 1.64 . . 2 . . . . . . . . 4407 1 1332 . 1 1 129 129 ARG HD2 H 1 3.45 . . 1 . . . . . . . . 4407 1 1333 . 1 1 129 129 ARG HD3 H 1 3.45 . . 1 . . . . . . . . 4407 1 1334 . 1 1 129 129 ARG H H 1 6.51 . . 1 . . . . . . . . 4407 1 1335 . 1 1 129 129 ARG CA C 13 59.38 . . 1 . . . . . . . . 4407 1 1336 . 1 1 129 129 ARG CB C 13 30.92 . . 1 . . . . . . . . 4407 1 1337 . 1 1 129 129 ARG CG C 13 29.10 . . 1 . . . . . . . . 4407 1 1338 . 1 1 129 129 ARG CD C 13 43.31 . . 1 . . . . . . . . 4407 1 1339 . 1 1 129 129 ARG N N 15 114.41 . . 1 . . . . . . . . 4407 1 1340 . 1 1 130 130 PHE HA H 1 2.72 . . 1 . . . . . . . . 4407 1 1341 . 1 1 130 130 PHE HB2 H 1 3.39 . . 2 . . . . . . . . 4407 1 1342 . 1 1 130 130 PHE HB3 H 1 2.87 . . 2 . . . . . . . . 4407 1 1343 . 1 1 130 130 PHE HD1 H 1 6.84 . . 1 . . . . . . . . 4407 1 1344 . 1 1 130 130 PHE HD2 H 1 6.84 . . 1 . . . . . . . . 4407 1 1345 . 1 1 130 130 PHE HE1 H 1 7.14 . . 1 . . . . . . . . 4407 1 1346 . 1 1 130 130 PHE HE2 H 1 7.14 . . 1 . . . . . . . . 4407 1 1347 . 1 1 130 130 PHE HZ H 1 7.29 . . 1 . . . . . . . . 4407 1 1348 . 1 1 130 130 PHE H H 1 8.41 . . 1 . . . . . . . . 4407 1 1349 . 1 1 130 130 PHE CA C 13 59.48 . . 1 . . . . . . . . 4407 1 1350 . 1 1 130 130 PHE CB C 13 38.73 . . 1 . . . . . . . . 4407 1 1351 . 1 1 130 130 PHE CE1 C 13 130.96 . . 1 . . . . . . . . 4407 1 1352 . 1 1 130 130 PHE CE2 C 13 130.96 . . 1 . . . . . . . . 4407 1 1353 . 1 1 130 130 PHE CZ C 13 128.64 . . 1 . . . . . . . . 4407 1 1354 . 1 1 130 130 PHE N N 15 122.67 . . 1 . . . . . . . . 4407 1 1355 . 1 1 131 131 LEU HA H 1 3.17 . . 1 . . . . . . . . 4407 1 1356 . 1 1 131 131 LEU HB2 H 1 1.50 . . 2 . . . . . . . . 4407 1 1357 . 1 1 131 131 LEU HB3 H 1 1.06 . . 2 . . . . . . . . 4407 1 1358 . 1 1 131 131 LEU HG H 1 1.06 . . 1 . . . . . . . . 4407 1 1359 . 1 1 131 131 LEU HD11 H 1 0.39 . . 2 . . . . . . . . 4407 1 1360 . 1 1 131 131 LEU HD12 H 1 0.39 . . 2 . . . . . . . . 4407 1 1361 . 1 1 131 131 LEU HD13 H 1 0.39 . . 2 . . . . . . . . 4407 1 1362 . 1 1 131 131 LEU HD21 H 1 -0.01 . . 2 . . . . . . . . 4407 1 1363 . 1 1 131 131 LEU HD22 H 1 -0.01 . . 2 . . . . . . . . 4407 1 1364 . 1 1 131 131 LEU HD23 H 1 -0.01 . . 2 . . . . . . . . 4407 1 1365 . 1 1 131 131 LEU H H 1 7.37 . . 1 . . . . . . . . 4407 1 1366 . 1 1 131 131 LEU CA C 13 56.54 . . 1 . . . . . . . . 4407 1 1367 . 1 1 131 131 LEU CB C 13 41.24 . . 1 . . . . . . . . 4407 1 1368 . 1 1 131 131 LEU CG C 13 25.60 . . 1 . . . . . . . . 4407 1 1369 . 1 1 131 131 LEU CD1 C 13 24.77 . . 2 . . . . . . . . 4407 1 1370 . 1 1 131 131 LEU CD2 C 13 20.21 . . 2 . . . . . . . . 4407 1 1371 . 1 1 131 131 LEU N N 15 117.20 . . 1 . . . . . . . . 4407 1 1372 . 1 1 132 132 SER HA H 1 4.52 . . 1 . . . . . . . . 4407 1 1373 . 1 1 132 132 SER HB2 H 1 3.89 . . 1 . . . . . . . . 4407 1 1374 . 1 1 132 132 SER HB3 H 1 3.89 . . 1 . . . . . . . . 4407 1 1375 . 1 1 132 132 SER H H 1 6.95 . . 1 . . . . . . . . 4407 1 1376 . 1 1 132 132 SER CA C 13 57.83 . . 1 . . . . . . . . 4407 1 1377 . 1 1 132 132 SER CB C 13 64.36 . . 1 . . . . . . . . 4407 1 1378 . 1 1 132 132 SER N N 15 110.19 . . 1 . . . . . . . . 4407 1 1379 . 1 1 133 133 SER HA H 1 4.84 . . 1 . . . . . . . . 4407 1 1380 . 1 1 133 133 SER HB2 H 1 4.44 . . 2 . . . . . . . . 4407 1 1381 . 1 1 133 133 SER HB3 H 1 4.24 . . 2 . . . . . . . . 4407 1 1382 . 1 1 133 133 SER H H 1 7.65 . . 1 . . . . . . . . 4407 1 1383 . 1 1 133 133 SER CA C 13 57.61 . . 1 . . . . . . . . 4407 1 1384 . 1 1 133 133 SER CB C 13 64.73 . . 1 . . . . . . . . 4407 1 1385 . 1 1 133 133 SER N N 15 119.60 . . 1 . . . . . . . . 4407 1 1386 . 1 1 134 134 PRO HA H 1 4.32 . . 1 . . . . . . . . 4407 1 1387 . 1 1 134 134 PRO HB2 H 1 2.47 . . 2 . . . . . . . . 4407 1 1388 . 1 1 134 134 PRO HB3 H 1 2.03 . . 2 . . . . . . . . 4407 1 1389 . 1 1 134 134 PRO HG2 H 1 2.29 . . 2 . . . . . . . . 4407 1 1390 . 1 1 134 134 PRO HG3 H 1 2.09 . . 2 . . . . . . . . 4407 1 1391 . 1 1 134 134 PRO HD2 H 1 4.12 . . 1 . . . . . . . . 4407 1 1392 . 1 1 134 134 PRO HD3 H 1 4.12 . . 1 . . . . . . . . 4407 1 1393 . 1 1 134 134 PRO CA C 13 65.01 . . 1 . . . . . . . . 4407 1 1394 . 1 1 134 134 PRO CB C 13 32.18 . . 1 . . . . . . . . 4407 1 1395 . 1 1 134 134 PRO CG C 13 28.10 . . 1 . . . . . . . . 4407 1 1396 . 1 1 134 134 PRO CD C 13 50.92 . . 1 . . . . . . . . 4407 1 1397 . 1 1 135 135 THR HA H 1 3.89 . . 1 . . . . . . . . 4407 1 1398 . 1 1 135 135 THR HB H 1 4.27 . . 1 . . . . . . . . 4407 1 1399 . 1 1 135 135 THR HG21 H 1 1.51 . . 1 . . . . . . . . 4407 1 1400 . 1 1 135 135 THR HG22 H 1 1.51 . . 1 . . . . . . . . 4407 1 1401 . 1 1 135 135 THR HG23 H 1 1.51 . . 1 . . . . . . . . 4407 1 1402 . 1 1 135 135 THR H H 1 7.53 . . 1 . . . . . . . . 4407 1 1403 . 1 1 135 135 THR CA C 13 67.01 . . 1 . . . . . . . . 4407 1 1404 . 1 1 135 135 THR CB C 13 69.55 . . 1 . . . . . . . . 4407 1 1405 . 1 1 135 135 THR CG2 C 13 22.39 . . 1 . . . . . . . . 4407 1 1406 . 1 1 135 135 THR N N 15 112.02 . . 1 . . . . . . . . 4407 1 1407 . 1 1 136 136 TYR HA H 1 4.11 . . 1 . . . . . . . . 4407 1 1408 . 1 1 136 136 TYR HB2 H 1 2.40 . . 2 . . . . . . . . 4407 1 1409 . 1 1 136 136 TYR HB3 H 1 1.58 . . 2 . . . . . . . . 4407 1 1410 . 1 1 136 136 TYR HD1 H 1 6.91 . . 1 . . . . . . . . 4407 1 1411 . 1 1 136 136 TYR HD2 H 1 6.91 . . 1 . . . . . . . . 4407 1 1412 . 1 1 136 136 TYR HE1 H 1 6.88 . . 1 . . . . . . . . 4407 1 1413 . 1 1 136 136 TYR HE2 H 1 6.88 . . 1 . . . . . . . . 4407 1 1414 . 1 1 136 136 TYR H H 1 7.15 . . 1 . . . . . . . . 4407 1 1415 . 1 1 136 136 TYR CA C 13 60.54 . . 1 . . . . . . . . 4407 1 1416 . 1 1 136 136 TYR CB C 13 39.30 . . 1 . . . . . . . . 4407 1 1417 . 1 1 136 136 TYR CD1 C 13 132.74 . . 1 . . . . . . . . 4407 1 1418 . 1 1 136 136 TYR CD2 C 13 132.74 . . 1 . . . . . . . . 4407 1 1419 . 1 1 136 136 TYR CE1 C 13 117.41 . . 1 . . . . . . . . 4407 1 1420 . 1 1 136 136 TYR CE2 C 13 117.41 . . 1 . . . . . . . . 4407 1 1421 . 1 1 136 136 TYR N N 15 118.19 . . 1 . . . . . . . . 4407 1 1422 . 1 1 137 137 ARG HA H 1 3.49 . . 1 . . . . . . . . 4407 1 1423 . 1 1 137 137 ARG HB2 H 1 1.80 . . 2 . . . . . . . . 4407 1 1424 . 1 1 137 137 ARG HB3 H 1 1.69 . . 2 . . . . . . . . 4407 1 1425 . 1 1 137 137 ARG HG2 H 1 1.77 . . 2 . . . . . . . . 4407 1 1426 . 1 1 137 137 ARG HG3 H 1 1.58 . . 2 . . . . . . . . 4407 1 1427 . 1 1 137 137 ARG HD2 H 1 3.04 . . 1 . . . . . . . . 4407 1 1428 . 1 1 137 137 ARG HD3 H 1 3.04 . . 1 . . . . . . . . 4407 1 1429 . 1 1 137 137 ARG H H 1 8.14 . . 1 . . . . . . . . 4407 1 1430 . 1 1 137 137 ARG CA C 13 59.17 . . 1 . . . . . . . . 4407 1 1431 . 1 1 137 137 ARG CB C 13 29.75 . . 1 . . . . . . . . 4407 1 1432 . 1 1 137 137 ARG CG C 13 28.23 . . 1 . . . . . . . . 4407 1 1433 . 1 1 137 137 ARG CD C 13 43.29 . . 1 . . . . . . . . 4407 1 1434 . 1 1 137 137 ARG N N 15 114.58 . . 1 . . . . . . . . 4407 1 1435 . 1 1 138 138 ALA HA H 1 4.12 . . 1 . . . . . . . . 4407 1 1436 . 1 1 138 138 ALA HB1 H 1 1.44 . . 1 . . . . . . . . 4407 1 1437 . 1 1 138 138 ALA HB2 H 1 1.44 . . 1 . . . . . . . . 4407 1 1438 . 1 1 138 138 ALA HB3 H 1 1.44 . . 1 . . . . . . . . 4407 1 1439 . 1 1 138 138 ALA H H 1 7.87 . . 1 . . . . . . . . 4407 1 1440 . 1 1 138 138 ALA CA C 13 53.90 . . 1 . . . . . . . . 4407 1 1441 . 1 1 138 138 ALA CB C 13 18.73 . . 1 . . . . . . . . 4407 1 1442 . 1 1 138 138 ALA N N 15 118.30 . . 1 . . . . . . . . 4407 1 1443 . 1 1 139 139 LEU HA H 1 4.15 . . 1 . . . . . . . . 4407 1 1444 . 1 1 139 139 LEU HB2 H 1 1.73 . . 2 . . . . . . . . 4407 1 1445 . 1 1 139 139 LEU HB3 H 1 1.48 . . 2 . . . . . . . . 4407 1 1446 . 1 1 139 139 LEU HG H 1 1.89 . . 1 . . . . . . . . 4407 1 1447 . 1 1 139 139 LEU HD11 H 1 1.23 . . 2 . . . . . . . . 4407 1 1448 . 1 1 139 139 LEU HD12 H 1 1.23 . . 2 . . . . . . . . 4407 1 1449 . 1 1 139 139 LEU HD13 H 1 1.23 . . 2 . . . . . . . . 4407 1 1450 . 1 1 139 139 LEU HD21 H 1 0.95 . . 2 . . . . . . . . 4407 1 1451 . 1 1 139 139 LEU HD22 H 1 0.95 . . 2 . . . . . . . . 4407 1 1452 . 1 1 139 139 LEU HD23 H 1 0.95 . . 2 . . . . . . . . 4407 1 1453 . 1 1 139 139 LEU H H 1 7.47 . . 1 . . . . . . . . 4407 1 1454 . 1 1 139 139 LEU CA C 13 54.84 . . 1 . . . . . . . . 4407 1 1455 . 1 1 139 139 LEU CB C 13 43.02 . . 1 . . . . . . . . 4407 1 1456 . 1 1 139 139 LEU CG C 13 26.88 . . 1 . . . . . . . . 4407 1 1457 . 1 1 139 139 LEU CD1 C 13 27.16 . . 2 . . . . . . . . 4407 1 1458 . 1 1 139 139 LEU CD2 C 13 22.58 . . 2 . . . . . . . . 4407 1 1459 . 1 1 139 139 LEU N N 15 115.58 . . 1 . . . . . . . . 4407 1 1460 . 1 1 140 140 LEU HA H 1 4.19 . . 1 . . . . . . . . 4407 1 1461 . 1 1 140 140 LEU HB2 H 1 1.48 . . 2 . . . . . . . . 4407 1 1462 . 1 1 140 140 LEU HB3 H 1 1.06 . . 2 . . . . . . . . 4407 1 1463 . 1 1 140 140 LEU HG H 1 1.18 . . 1 . . . . . . . . 4407 1 1464 . 1 1 140 140 LEU HD11 H 1 0.66 . . 2 . . . . . . . . 4407 1 1465 . 1 1 140 140 LEU HD12 H 1 0.66 . . 2 . . . . . . . . 4407 1 1466 . 1 1 140 140 LEU HD13 H 1 0.66 . . 2 . . . . . . . . 4407 1 1467 . 1 1 140 140 LEU HD21 H 1 0.52 . . 2 . . . . . . . . 4407 1 1468 . 1 1 140 140 LEU HD22 H 1 0.52 . . 2 . . . . . . . . 4407 1 1469 . 1 1 140 140 LEU HD23 H 1 0.52 . . 2 . . . . . . . . 4407 1 1470 . 1 1 140 140 LEU H H 1 7.00 . . 1 . . . . . . . . 4407 1 1471 . 1 1 140 140 LEU CA C 13 52.49 . . 1 . . . . . . . . 4407 1 1472 . 1 1 140 140 LEU CB C 13 41.37 . . 1 . . . . . . . . 4407 1 1473 . 1 1 140 140 LEU CG C 13 26.22 . . 1 . . . . . . . . 4407 1 1474 . 1 1 140 140 LEU CD1 C 13 25.40 . . 2 . . . . . . . . 4407 1 1475 . 1 1 140 140 LEU CD2 C 13 22.83 . . 2 . . . . . . . . 4407 1 1476 . 1 1 140 140 LEU N N 15 118.63 . . 1 . . . . . . . . 4407 1 stop_ save_