data_4251 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4251 _Entry.Title ; Triple Resonance Assignment for Abl SH(32) and One in the Complex with a Consolidated Ligand ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 1998-10-19 _Entry.Accession_date 1998-10-19 _Entry.Last_release_date 1998-10-19 _Entry.Original_release_date 1998-10-19 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _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.ORCID _Entry_author.Entry_ID 1 Rong Xu . . . . 4251 2 Sean Cahill . . . . 4251 3 David Cowburn . . . . 4251 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4251 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 443 4251 '15N chemical shifts' 148 4251 '1H chemical shifts' 945 4251 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 . . 1999-11-26 . original BMRB . 4251 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4251 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 99356753 _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Triple resonance-based assignment for Abl SH(32) and its complex with a consolidated ligand ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 14 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 187 _Citation.Page_last 188 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Rong Xu . . . . 4251 1 2 Sean Cahill . . . . 4251 1 3 David Cowburn . . . . 4251 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID Abl_SH(32) 4251 1 NMR_assignment 4251 1 consolidated_ligand 4251 1 stop_ save_ save_citation_one _Citation.Sf_category citations _Citation.Sf_framecode citation_one _Citation.Entry_ID 4251 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; Wishart, D. S., Bigam, C. G., Yao, J., Abildgaard, F., Dyson, H. J., Oldfield, E., Markley, J. L., and Sykes, B. D. J. Biomol. NMR 6, 135-140 (1995). ; _Citation.Title . _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 D. Wishart . . . . 4251 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_Abl_SH(32) _Assembly.Sf_category assembly _Assembly.Sf_framecode system_Abl_SH(32) _Assembly.Entry_ID 4251 _Assembly.ID 1 _Assembly.Name 'Src homology domain 3 and 2' _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 present' _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 monomer 4251 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 'Abl SH(32)' 1 $Abl_SH(32) . . . native . . . . . 4251 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 2ABL . 'Sh3-Sh2 Domain Fragment Of Human Bcr-Abl Tyrosine Kinase' . . . . 4251 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'Abl SH(32)' abbreviation 4251 1 'Src homology domain 3 and 2' system 4251 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Abl_SH(32) _Entity.Sf_category entity _Entity.Sf_framecode Abl_SH(32) _Entity.Entry_ID 4251 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Src homology domain 3 and 2' _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 ; GSPGGSLFVALYDFVASGDN TLSITKGEKLRVLGYNHNGE WAEAQTKNGQGWVPSNYITP VNSLEKHSWYHGPVSRNAAE YLLSSGINGSFLVRESESSP GQRSISLRYEGRVYHYRINT ASDGKLYVSSESRFNTLAEL VHHHSTVADGLITTLHYPAP KRGIRD ; _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 166 _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 . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date 2008-08-19 _Entity.DB_query_revised_last_date 2008-08-19 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 . . BMRB 4252 . 'Src homology domain 3 and 2' . . . . . 100.00 166 100.00 100.00 1.04e-91 . . . . 4251 1 . . PDB 1AB2 . 'Three-Dimensional Solution Structure Of The Src Homology 2 Domain Of C-Abl' . . . . . 63.86 109 99.06 99.06 1.80e-52 . . . . 4251 1 . . PDB 1OPK . 'Structural Basis For The Auto-Inhibition Of C-Abl Tyrosine Kinase' . . . . . 94.58 495 98.73 99.36 2.14e-86 . . . . 4251 1 . . PDB 1OPL . 'Structural Basis For The Auto-Inhibition Of C-Abl Tyrosine Kinase' . . . . . 94.58 537 98.73 99.36 3.04e-86 . . . . 4251 1 . . PDB 2ABL . 'Sh3-Sh2 Domain Fragment Of Human Bcr-Abl Tyrosine Kinase' . . . . . 93.37 163 98.71 99.35 4.28e-84 . . . . 4251 1 . . PDB 2FO0 . 'Organization Of The Sh3-Sh2 Unit In Active And Inactive Forms Of The C-Abl Tyrosine Kinase' . . . . . 94.58 495 98.73 99.36 2.18e-86 . . . . 4251 1 . . DBJ BAC41088 . 'unnamed protein product [Mus musculus]' . . . . . 93.98 1123 99.36 99.36 1.64e-88 . . . . 4251 1 . . DBJ BAD92693 . 'v-abl Abelson murine leukemia viral oncogene homolog 1 isoform b variant [Homo sapiens]' . . . . . 93.98 1167 99.36 99.36 7.80e-88 . . . . 4251 1 . . DBJ BAG10808 . 'proto-oncogene tyrosine-protein kinase ABL1 [synthetic construct]' . . . . . 93.98 1149 99.36 99.36 4.50e-88 . . . . 4251 1 . . EMBL CAA10376 . 'bcr-abl1 e14a2 chimeric protein [Homo sapiens]' . . . . . 93.98 332 99.36 99.36 8.34e-87 . . . . 4251 1 . . EMBL CAA10377 . 'bcr-abl1 e13a2 chimeric protein [Homo sapiens]' . . . . . 93.98 307 99.36 99.36 7.42e-87 . . . . 4251 1 . . EMBL CAA24781 . 'oncogene v-abl [Abelson murine leukemia virus]' . . . . . 63.86 918 100.00 100.00 6.18e-56 . . . . 4251 1 . . EMBL CAA34438 . 'unnamed protein product [Homo sapiens]' . . . . . 93.98 1130 99.36 99.36 3.56e-88 . . . . 4251 1 . . EMBL CAB56204 . 'unnamed protein product [Abelson murine leukemia virus]' . . . . . 63.86 818 100.00 100.00 5.32e-56 . . . . 4251 1 . . GenBank AAA43042 . 'gag-abl-pol fusion polyprotein' . . . . . 94.58 697 98.09 98.73 4.14e-86 . . . . 4251 1 . . GenBank AAA51561 . 'abl protein' . . . . . 93.98 1130 98.08 98.08 2.23e-86 . . . . 4251 1 . . GenBank AAA88241 . '125 kDa c-abl protein' . . . . . 93.98 1123 99.36 99.36 1.77e-88 . . . . 4251 1 . . GenBank AAB60393 . 'proto-oncogene tyrosine-protein kinase [Homo sapiens]' . . . . . 93.98 1149 99.36 99.36 4.50e-88 . . . . 4251 1 . . GenBank AAB60394 . 'proto-oncogene tyrosine-protein kinase [Homo sapiens]' . . . . . 93.98 1130 99.36 99.36 3.56e-88 . . . . 4251 1 . . REF NP_001106174 . 'v-abl Abelson murine leukemia oncogene 1 isoform a [Mus musculus]' . . . . . 93.98 1142 99.36 99.36 2.53e-88 . . . . 4251 1 . . REF NP_005148 . 'v-abl Abelson murine leukemia viral oncogene homolog 1 isoform a [Homo sapiens]' . . . . . 93.98 1130 99.36 99.36 3.56e-88 . . . . 4251 1 . . REF NP_009297 . 'v-abl Abelson murine leukemia viral oncogene homolog 1 isoform b [Homo sapiens]' . . . . . 93.98 1149 99.36 99.36 4.50e-88 . . . . 4251 1 . . REF NP_033724 . 'v-abl Abelson murine leukemia oncogene 1 isoform b [Mus musculus]' . . . . . 93.98 1123 99.36 99.36 1.36e-88 . . . . 4251 1 . . REF NP_057866 . 'p120 Gag-Abl polyprotein [Abelson murine leukemia virus]' . . . . . 63.86 981 100.00 100.00 2.47e-56 . . . . 4251 1 . . SWISS-PROT P00519 . 'Proto-oncogene tyrosine-protein kinase ABL1 (Abelson murine leukemia viral oncogene homolog 1) (c-ABL) (p150)' . . . . . 93.98 1130 99.36 99.36 3.56e-88 . . . . 4251 1 . . SWISS-PROT P00520 . 'Proto-oncogene tyrosine-protein kinase ABL1 (Abelson murine leukemia viral oncogene homolog 1) (c-ABL) (p150)' . . . . . 93.98 1123 99.36 99.36 1.36e-88 . . . . 4251 1 . . SWISS-PROT P00521 . 'Tyrosine-protein kinase transforming protein Abl (V-abl)' . . . . . 63.86 746 100.00 100.00 1.57e-56 . . . . 4251 1 . . SWISS-PROT P10447 . 'Tyrosine-protein kinase transforming protein Abl (V-abl)' . . . . . 94.58 439 98.09 98.73 1.28e-85 . . . . 4251 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Abl SH(32)' abbreviation 4251 1 'Abl SH(32)' variant 4251 1 'Src homology domain 3 and 2' common 4251 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 59 GLY . 4251 1 2 60 SER . 4251 1 3 61 PRO . 4251 1 4 62 GLY . 4251 1 5 63 GLY . 4251 1 6 64 SER . 4251 1 7 65 LEU . 4251 1 8 66 PHE . 4251 1 9 67 VAL . 4251 1 10 68 ALA . 4251 1 11 69 LEU . 4251 1 12 70 TYR . 4251 1 13 71 ASP . 4251 1 14 72 PHE . 4251 1 15 73 VAL . 4251 1 16 74 ALA . 4251 1 17 75 SER . 4251 1 18 76 GLY . 4251 1 19 77 ASP . 4251 1 20 78 ASN . 4251 1 21 79 THR . 4251 1 22 80 LEU . 4251 1 23 81 SER . 4251 1 24 82 ILE . 4251 1 25 83 THR . 4251 1 26 84 LYS . 4251 1 27 85 GLY . 4251 1 28 86 GLU . 4251 1 29 87 LYS . 4251 1 30 88 LEU . 4251 1 31 89 ARG . 4251 1 32 90 VAL . 4251 1 33 91 LEU . 4251 1 34 92 GLY . 4251 1 35 93 TYR . 4251 1 36 94 ASN . 4251 1 37 95 HIS . 4251 1 38 96 ASN . 4251 1 39 97 GLY . 4251 1 40 98 GLU . 4251 1 41 99 TRP . 4251 1 42 100 ALA . 4251 1 43 101 GLU . 4251 1 44 102 ALA . 4251 1 45 103 GLN . 4251 1 46 104 THR . 4251 1 47 105 LYS . 4251 1 48 106 ASN . 4251 1 49 107 GLY . 4251 1 50 108 GLN . 4251 1 51 109 GLY . 4251 1 52 110 TRP . 4251 1 53 111 VAL . 4251 1 54 112 PRO . 4251 1 55 113 SER . 4251 1 56 114 ASN . 4251 1 57 115 TYR . 4251 1 58 116 ILE . 4251 1 59 117 THR . 4251 1 60 118 PRO . 4251 1 61 119 VAL . 4251 1 62 120 ASN . 4251 1 63 121 SER . 4251 1 64 122 LEU . 4251 1 65 123 GLU . 4251 1 66 124 LYS . 4251 1 67 125 HIS . 4251 1 68 126 SER . 4251 1 69 127 TRP . 4251 1 70 128 TYR . 4251 1 71 129 HIS . 4251 1 72 130 GLY . 4251 1 73 131 PRO . 4251 1 74 132 VAL . 4251 1 75 133 SER . 4251 1 76 134 ARG . 4251 1 77 135 ASN . 4251 1 78 136 ALA . 4251 1 79 137 ALA . 4251 1 80 138 GLU . 4251 1 81 139 TYR . 4251 1 82 140 LEU . 4251 1 83 141 LEU . 4251 1 84 142 SER . 4251 1 85 143 SER . 4251 1 86 144 GLY . 4251 1 87 145 ILE . 4251 1 88 146 ASN . 4251 1 89 147 GLY . 4251 1 90 148 SER . 4251 1 91 149 PHE . 4251 1 92 150 LEU . 4251 1 93 151 VAL . 4251 1 94 152 ARG . 4251 1 95 153 GLU . 4251 1 96 154 SER . 4251 1 97 155 GLU . 4251 1 98 156 SER . 4251 1 99 157 SER . 4251 1 100 158 PRO . 4251 1 101 159 GLY . 4251 1 102 160 GLN . 4251 1 103 161 ARG . 4251 1 104 162 SER . 4251 1 105 163 ILE . 4251 1 106 164 SER . 4251 1 107 165 LEU . 4251 1 108 166 ARG . 4251 1 109 167 TYR . 4251 1 110 168 GLU . 4251 1 111 169 GLY . 4251 1 112 170 ARG . 4251 1 113 171 VAL . 4251 1 114 172 TYR . 4251 1 115 173 HIS . 4251 1 116 174 TYR . 4251 1 117 175 ARG . 4251 1 118 176 ILE . 4251 1 119 177 ASN . 4251 1 120 178 THR . 4251 1 121 179 ALA . 4251 1 122 180 SER . 4251 1 123 181 ASP . 4251 1 124 182 GLY . 4251 1 125 183 LYS . 4251 1 126 184 LEU . 4251 1 127 185 TYR . 4251 1 128 186 VAL . 4251 1 129 187 SER . 4251 1 130 188 SER . 4251 1 131 189 GLU . 4251 1 132 190 SER . 4251 1 133 191 ARG . 4251 1 134 192 PHE . 4251 1 135 193 ASN . 4251 1 136 194 THR . 4251 1 137 195 LEU . 4251 1 138 196 ALA . 4251 1 139 197 GLU . 4251 1 140 198 LEU . 4251 1 141 199 VAL . 4251 1 142 200 HIS . 4251 1 143 201 HIS . 4251 1 144 202 HIS . 4251 1 145 203 SER . 4251 1 146 204 THR . 4251 1 147 205 VAL . 4251 1 148 206 ALA . 4251 1 149 207 ASP . 4251 1 150 208 GLY . 4251 1 151 209 LEU . 4251 1 152 210 ILE . 4251 1 153 211 THR . 4251 1 154 212 THR . 4251 1 155 213 LEU . 4251 1 156 214 HIS . 4251 1 157 215 TYR . 4251 1 158 216 PRO . 4251 1 159 217 ALA . 4251 1 160 218 PRO . 4251 1 161 219 LYS . 4251 1 162 220 ARG . 4251 1 163 221 GLY . 4251 1 164 222 ILE . 4251 1 165 224 ARG . 4251 1 166 225 ASP . 4251 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 4251 1 . SER 2 2 4251 1 . PRO 3 3 4251 1 . GLY 4 4 4251 1 . GLY 5 5 4251 1 . SER 6 6 4251 1 . LEU 7 7 4251 1 . PHE 8 8 4251 1 . VAL 9 9 4251 1 . ALA 10 10 4251 1 . LEU 11 11 4251 1 . TYR 12 12 4251 1 . ASP 13 13 4251 1 . PHE 14 14 4251 1 . VAL 15 15 4251 1 . ALA 16 16 4251 1 . SER 17 17 4251 1 . GLY 18 18 4251 1 . ASP 19 19 4251 1 . ASN 20 20 4251 1 . THR 21 21 4251 1 . LEU 22 22 4251 1 . SER 23 23 4251 1 . ILE 24 24 4251 1 . THR 25 25 4251 1 . LYS 26 26 4251 1 . GLY 27 27 4251 1 . GLU 28 28 4251 1 . LYS 29 29 4251 1 . LEU 30 30 4251 1 . ARG 31 31 4251 1 . VAL 32 32 4251 1 . LEU 33 33 4251 1 . GLY 34 34 4251 1 . TYR 35 35 4251 1 . ASN 36 36 4251 1 . HIS 37 37 4251 1 . ASN 38 38 4251 1 . GLY 39 39 4251 1 . GLU 40 40 4251 1 . TRP 41 41 4251 1 . ALA 42 42 4251 1 . GLU 43 43 4251 1 . ALA 44 44 4251 1 . GLN 45 45 4251 1 . THR 46 46 4251 1 . LYS 47 47 4251 1 . ASN 48 48 4251 1 . GLY 49 49 4251 1 . GLN 50 50 4251 1 . GLY 51 51 4251 1 . TRP 52 52 4251 1 . VAL 53 53 4251 1 . PRO 54 54 4251 1 . SER 55 55 4251 1 . ASN 56 56 4251 1 . TYR 57 57 4251 1 . ILE 58 58 4251 1 . THR 59 59 4251 1 . PRO 60 60 4251 1 . VAL 61 61 4251 1 . ASN 62 62 4251 1 . SER 63 63 4251 1 . LEU 64 64 4251 1 . GLU 65 65 4251 1 . LYS 66 66 4251 1 . HIS 67 67 4251 1 . SER 68 68 4251 1 . TRP 69 69 4251 1 . TYR 70 70 4251 1 . HIS 71 71 4251 1 . GLY 72 72 4251 1 . PRO 73 73 4251 1 . VAL 74 74 4251 1 . SER 75 75 4251 1 . ARG 76 76 4251 1 . ASN 77 77 4251 1 . ALA 78 78 4251 1 . ALA 79 79 4251 1 . GLU 80 80 4251 1 . TYR 81 81 4251 1 . LEU 82 82 4251 1 . LEU 83 83 4251 1 . SER 84 84 4251 1 . SER 85 85 4251 1 . GLY 86 86 4251 1 . ILE 87 87 4251 1 . ASN 88 88 4251 1 . GLY 89 89 4251 1 . SER 90 90 4251 1 . PHE 91 91 4251 1 . LEU 92 92 4251 1 . VAL 93 93 4251 1 . ARG 94 94 4251 1 . GLU 95 95 4251 1 . SER 96 96 4251 1 . GLU 97 97 4251 1 . SER 98 98 4251 1 . SER 99 99 4251 1 . PRO 100 100 4251 1 . GLY 101 101 4251 1 . GLN 102 102 4251 1 . ARG 103 103 4251 1 . SER 104 104 4251 1 . ILE 105 105 4251 1 . SER 106 106 4251 1 . LEU 107 107 4251 1 . ARG 108 108 4251 1 . TYR 109 109 4251 1 . GLU 110 110 4251 1 . GLY 111 111 4251 1 . ARG 112 112 4251 1 . VAL 113 113 4251 1 . TYR 114 114 4251 1 . HIS 115 115 4251 1 . TYR 116 116 4251 1 . ARG 117 117 4251 1 . ILE 118 118 4251 1 . ASN 119 119 4251 1 . THR 120 120 4251 1 . ALA 121 121 4251 1 . SER 122 122 4251 1 . ASP 123 123 4251 1 . GLY 124 124 4251 1 . LYS 125 125 4251 1 . LEU 126 126 4251 1 . TYR 127 127 4251 1 . VAL 128 128 4251 1 . SER 129 129 4251 1 . SER 130 130 4251 1 . GLU 131 131 4251 1 . SER 132 132 4251 1 . ARG 133 133 4251 1 . PHE 134 134 4251 1 . ASN 135 135 4251 1 . THR 136 136 4251 1 . LEU 137 137 4251 1 . ALA 138 138 4251 1 . GLU 139 139 4251 1 . LEU 140 140 4251 1 . VAL 141 141 4251 1 . HIS 142 142 4251 1 . HIS 143 143 4251 1 . HIS 144 144 4251 1 . SER 145 145 4251 1 . THR 146 146 4251 1 . VAL 147 147 4251 1 . ALA 148 148 4251 1 . ASP 149 149 4251 1 . GLY 150 150 4251 1 . LEU 151 151 4251 1 . ILE 152 152 4251 1 . THR 153 153 4251 1 . THR 154 154 4251 1 . LEU 155 155 4251 1 . HIS 156 156 4251 1 . TYR 157 157 4251 1 . PRO 158 158 4251 1 . ALA 159 159 4251 1 . PRO 160 160 4251 1 . LYS 161 161 4251 1 . ARG 162 162 4251 1 . GLY 163 163 4251 1 . ILE 164 164 4251 1 . ARG 165 165 4251 1 . ASP 166 166 4251 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 4251 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Abl_SH(32) . 9606 . . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 4251 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 4251 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Abl_SH(32) . 'recombinant technology' . . . . . . . . . . . . . . . . 4251 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Sample.Sf_category sample _Sample.Sf_framecode sample_one _Sample.Entry_ID 4251 _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 'Src homology domain 3 and 2' . . . 1 $Abl_SH(32) . . 0.8 . . mM . . . . 4251 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_one _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_one _Sample_condition_list.Entry_ID 4251 _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 pH 7.2 0.5 n/a 4251 1 temperature 308 0.1 K 4251 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 4251 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4251 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_one _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_one _Chem_shift_reference.Entry_ID 4251 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . 4251 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 . direct 1.0 . . . . . 4251 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . 4251 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts _Assigned_chem_shift_list.Entry_ID 4251 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_one _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_one _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_one . 4251 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY CA C 13 45.1 . . 1 . . . . . . . . 4251 1 2 . 1 1 2 2 SER N N 15 115.1 . . 1 . . . . . . . . 4251 1 3 . 1 1 2 2 SER H H 1 8.31 . . 1 . . . . . . . . 4251 1 4 . 1 1 2 2 SER CA C 13 58.3 . . 1 . . . . . . . . 4251 1 5 . 1 1 2 2 SER HA H 1 4.71 . . 1 . . . . . . . . 4251 1 6 . 1 1 2 2 SER CB C 13 64.6 . . 1 . . . . . . . . 4251 1 7 . 1 1 2 2 SER HB2 H 1 4.04 . . 2 . . . . . . . . 4251 1 8 . 1 1 2 2 SER HB3 H 1 3.97 . . 2 . . . . . . . . 4251 1 9 . 1 1 3 3 PRO CA C 13 63.6 . . 1 . . . . . . . . 4251 1 10 . 1 1 3 3 PRO HA H 1 4.47 . . 1 . . . . . . . . 4251 1 11 . 1 1 3 3 PRO HB2 H 1 2.28 . . 2 . . . . . . . . 4251 1 12 . 1 1 3 3 PRO HB3 H 1 1.94 . . 2 . . . . . . . . 4251 1 13 . 1 1 3 3 PRO HG2 H 1 2.01 . . 1 . . . . . . . . 4251 1 14 . 1 1 3 3 PRO HG3 H 1 2.01 . . 1 . . . . . . . . 4251 1 15 . 1 1 3 3 PRO HD2 H 1 3.83 . . 2 . . . . . . . . 4251 1 16 . 1 1 3 3 PRO HD3 H 1 3.73 . . 2 . . . . . . . . 4251 1 17 . 1 1 6 6 SER N N 15 120.4 . . 1 . . . . . . . . 4251 1 18 . 1 1 6 6 SER H H 1 8.24 . . 1 . . . . . . . . 4251 1 19 . 1 1 6 6 SER CA C 13 58.2 . . 1 . . . . . . . . 4251 1 20 . 1 1 6 6 SER CB C 13 64.3 . . 1 . . . . . . . . 4251 1 21 . 1 1 7 7 LEU N N 15 124.0 . . 1 . . . . . . . . 4251 1 22 . 1 1 7 7 LEU H H 1 8.39 . . 1 . . . . . . . . 4251 1 23 . 1 1 7 7 LEU CA C 13 55.2 . . 1 . . . . . . . . 4251 1 24 . 1 1 7 7 LEU HA H 1 4.97 . . 1 . . . . . . . . 4251 1 25 . 1 1 7 7 LEU CB C 13 43.6 . . 1 . . . . . . . . 4251 1 26 . 1 1 7 7 LEU HB2 H 1 1.62 . . 1 . . . . . . . . 4251 1 27 . 1 1 7 7 LEU HB3 H 1 1.62 . . 1 . . . . . . . . 4251 1 28 . 1 1 7 7 LEU CG C 13 27.2 . . 1 . . . . . . . . 4251 1 29 . 1 1 7 7 LEU HG H 1 1.65 . . 1 . . . . . . . . 4251 1 30 . 1 1 7 7 LEU HD11 H 1 0.94 . . 2 . . . . . . . . 4251 1 31 . 1 1 7 7 LEU HD12 H 1 0.94 . . 2 . . . . . . . . 4251 1 32 . 1 1 7 7 LEU HD13 H 1 0.94 . . 2 . . . . . . . . 4251 1 33 . 1 1 7 7 LEU HD21 H 1 0.86 . . 2 . . . . . . . . 4251 1 34 . 1 1 7 7 LEU HD22 H 1 0.86 . . 2 . . . . . . . . 4251 1 35 . 1 1 7 7 LEU HD23 H 1 0.86 . . 2 . . . . . . . . 4251 1 36 . 1 1 7 7 LEU CD1 C 13 24.5 . . 1 . . . . . . . . 4251 1 37 . 1 1 7 7 LEU CD2 C 13 24.2 . . 1 . . . . . . . . 4251 1 38 . 1 1 8 8 PHE N N 15 126.8 . . 1 . . . . . . . . 4251 1 39 . 1 1 8 8 PHE H H 1 9.51 . . 1 . . . . . . . . 4251 1 40 . 1 1 8 8 PHE CA C 13 56.0 . . 1 . . . . . . . . 4251 1 41 . 1 1 8 8 PHE HA H 1 5.24 . . 1 . . . . . . . . 4251 1 42 . 1 1 8 8 PHE CB C 13 44.5 . . 1 . . . . . . . . 4251 1 43 . 1 1 8 8 PHE HB2 H 1 2.80 . . 2 . . . . . . . . 4251 1 44 . 1 1 8 8 PHE HB3 H 1 2.63 . . 2 . . . . . . . . 4251 1 45 . 1 1 9 9 VAL N N 15 117.1 . . 1 . . . . . . . . 4251 1 46 . 1 1 9 9 VAL H H 1 9.42 . . 1 . . . . . . . . 4251 1 47 . 1 1 9 9 VAL CA C 13 58.8 . . 1 . . . . . . . . 4251 1 48 . 1 1 9 9 VAL HA H 1 5.22 . . 1 . . . . . . . . 4251 1 49 . 1 1 9 9 VAL CB C 13 35.5 . . 1 . . . . . . . . 4251 1 50 . 1 1 9 9 VAL HB H 1 1.68 . . 1 . . . . . . . . 4251 1 51 . 1 1 9 9 VAL HG11 H 1 0.81 . . 2 . . . . . . . . 4251 1 52 . 1 1 9 9 VAL HG12 H 1 0.81 . . 2 . . . . . . . . 4251 1 53 . 1 1 9 9 VAL HG13 H 1 0.81 . . 2 . . . . . . . . 4251 1 54 . 1 1 9 9 VAL HG21 H 1 0.77 . . 2 . . . . . . . . 4251 1 55 . 1 1 9 9 VAL HG22 H 1 0.77 . . 2 . . . . . . . . 4251 1 56 . 1 1 9 9 VAL HG23 H 1 0.77 . . 2 . . . . . . . . 4251 1 57 . 1 1 9 9 VAL CG1 C 13 21.4 . . 1 . . . . . . . . 4251 1 58 . 1 1 9 9 VAL CG2 C 13 20.1 . . 1 . . . . . . . . 4251 1 59 . 1 1 10 10 ALA N N 15 126.7 . . 1 . . . . . . . . 4251 1 60 . 1 1 10 10 ALA H H 1 8.41 . . 1 . . . . . . . . 4251 1 61 . 1 1 10 10 ALA CA C 13 51.9 . . 1 . . . . . . . . 4251 1 62 . 1 1 10 10 ALA HA H 1 4.70 . . 1 . . . . . . . . 4251 1 63 . 1 1 10 10 ALA HB1 H 1 1.55 . . 1 . . . . . . . . 4251 1 64 . 1 1 10 10 ALA HB2 H 1 1.55 . . 1 . . . . . . . . 4251 1 65 . 1 1 10 10 ALA HB3 H 1 1.55 . . 1 . . . . . . . . 4251 1 66 . 1 1 10 10 ALA CB C 13 19.6 . . 1 . . . . . . . . 4251 1 67 . 1 1 11 11 LEU N N 15 126.8 . . 1 . . . . . . . . 4251 1 68 . 1 1 11 11 LEU H H 1 9.48 . . 1 . . . . . . . . 4251 1 69 . 1 1 11 11 LEU CA C 13 55.8 . . 1 . . . . . . . . 4251 1 70 . 1 1 11 11 LEU HA H 1 3.90 . . 1 . . . . . . . . 4251 1 71 . 1 1 11 11 LEU CB C 13 43.6 . . 1 . . . . . . . . 4251 1 72 . 1 1 11 11 LEU HB2 H 1 0.97 . . 2 . . . . . . . . 4251 1 73 . 1 1 11 11 LEU HB3 H 1 0.51 . . 2 . . . . . . . . 4251 1 74 . 1 1 11 11 LEU CG C 13 26.5 . . 1 . . . . . . . . 4251 1 75 . 1 1 11 11 LEU HG H 1 1.13 . . 1 . . . . . . . . 4251 1 76 . 1 1 11 11 LEU CD1 C 13 25.0 . . 1 . . . . . . . . 4251 1 77 . 1 1 11 11 LEU HD11 H 1 0.63 . . 1 . . . . . . . . 4251 1 78 . 1 1 11 11 LEU HD12 H 1 0.63 . . 1 . . . . . . . . 4251 1 79 . 1 1 11 11 LEU HD13 H 1 0.63 . . 1 . . . . . . . . 4251 1 80 . 1 1 11 11 LEU HD21 H 1 0.63 . . 1 . . . . . . . . 4251 1 81 . 1 1 11 11 LEU HD22 H 1 0.63 . . 1 . . . . . . . . 4251 1 82 . 1 1 11 11 LEU HD23 H 1 0.63 . . 1 . . . . . . . . 4251 1 83 . 1 1 12 12 TYR N N 15 111.9 . . 1 . . . . . . . . 4251 1 84 . 1 1 12 12 TYR H H 1 6.98 . . 1 . . . . . . . . 4251 1 85 . 1 1 12 12 TYR CA C 13 54.0 . . 1 . . . . . . . . 4251 1 86 . 1 1 12 12 TYR HA H 1 4.73 . . 1 . . . . . . . . 4251 1 87 . 1 1 12 12 TYR CB C 13 42.5 . . 1 . . . . . . . . 4251 1 88 . 1 1 12 12 TYR HB2 H 1 3.10 . . 2 . . . . . . . . 4251 1 89 . 1 1 12 12 TYR HB3 H 1 2.15 . . 2 . . . . . . . . 4251 1 90 . 1 1 13 13 ASP N N 15 117.3 . . 1 . . . . . . . . 4251 1 91 . 1 1 13 13 ASP H H 1 8.19 . . 1 . . . . . . . . 4251 1 92 . 1 1 13 13 ASP CA C 13 54.4 . . 1 . . . . . . . . 4251 1 93 . 1 1 13 13 ASP HA H 1 4.84 . . 1 . . . . . . . . 4251 1 94 . 1 1 13 13 ASP CB C 13 41.7 . . 1 . . . . . . . . 4251 1 95 . 1 1 13 13 ASP HB2 H 1 2.74 . . 2 . . . . . . . . 4251 1 96 . 1 1 13 13 ASP HB3 H 1 2.62 . . 2 . . . . . . . . 4251 1 97 . 1 1 14 14 PHE N N 15 121.9 . . 1 . . . . . . . . 4251 1 98 . 1 1 14 14 PHE H H 1 8.94 . . 1 . . . . . . . . 4251 1 99 . 1 1 14 14 PHE CA C 13 57.6 . . 1 . . . . . . . . 4251 1 100 . 1 1 14 14 PHE HA H 1 4.98 . . 1 . . . . . . . . 4251 1 101 . 1 1 14 14 PHE CB C 13 42.0 . . 1 . . . . . . . . 4251 1 102 . 1 1 14 14 PHE HB2 H 1 3.21 . . 2 . . . . . . . . 4251 1 103 . 1 1 14 14 PHE HB3 H 1 3.09 . . 2 . . . . . . . . 4251 1 104 . 1 1 15 15 VAL N N 15 128.7 . . 1 . . . . . . . . 4251 1 105 . 1 1 15 15 VAL H H 1 7.91 . . 1 . . . . . . . . 4251 1 106 . 1 1 15 15 VAL CA C 13 60.8 . . 1 . . . . . . . . 4251 1 107 . 1 1 15 15 VAL HA H 1 4.02 . . 1 . . . . . . . . 4251 1 108 . 1 1 15 15 VAL CB C 13 32.4 . . 1 . . . . . . . . 4251 1 109 . 1 1 15 15 VAL HB H 1 1.73 . . 1 . . . . . . . . 4251 1 110 . 1 1 15 15 VAL HG11 H 1 0.86 . . 2 . . . . . . . . 4251 1 111 . 1 1 15 15 VAL HG12 H 1 0.86 . . 2 . . . . . . . . 4251 1 112 . 1 1 15 15 VAL HG13 H 1 0.86 . . 2 . . . . . . . . 4251 1 113 . 1 1 15 15 VAL HG21 H 1 0.80 . . 2 . . . . . . . . 4251 1 114 . 1 1 15 15 VAL HG22 H 1 0.80 . . 2 . . . . . . . . 4251 1 115 . 1 1 15 15 VAL HG23 H 1 0.80 . . 2 . . . . . . . . 4251 1 116 . 1 1 15 15 VAL CG1 C 13 20.9 . . 1 . . . . . . . . 4251 1 117 . 1 1 15 15 VAL CG2 C 13 20.9 . . 1 . . . . . . . . 4251 1 118 . 1 1 16 16 ALA N N 15 129.4 . . 1 . . . . . . . . 4251 1 119 . 1 1 16 16 ALA H H 1 8.28 . . 1 . . . . . . . . 4251 1 120 . 1 1 16 16 ALA CA C 13 53.0 . . 1 . . . . . . . . 4251 1 121 . 1 1 16 16 ALA HA H 1 3.77 . . 1 . . . . . . . . 4251 1 122 . 1 1 16 16 ALA HB1 H 1 1.30 . . 1 . . . . . . . . 4251 1 123 . 1 1 16 16 ALA HB2 H 1 1.30 . . 1 . . . . . . . . 4251 1 124 . 1 1 16 16 ALA HB3 H 1 1.30 . . 1 . . . . . . . . 4251 1 125 . 1 1 16 16 ALA CB C 13 19.5 . . 1 . . . . . . . . 4251 1 126 . 1 1 17 17 SER N N 15 115.6 . . 1 . . . . . . . . 4251 1 127 . 1 1 17 17 SER H H 1 7.96 . . 1 . . . . . . . . 4251 1 128 . 1 1 17 17 SER CA C 13 57.1 . . 1 . . . . . . . . 4251 1 129 . 1 1 17 17 SER HA H 1 4.52 . . 1 . . . . . . . . 4251 1 130 . 1 1 17 17 SER CB C 13 64.1 . . 1 . . . . . . . . 4251 1 131 . 1 1 17 17 SER HB2 H 1 3.89 . . 2 . . . . . . . . 4251 1 132 . 1 1 17 17 SER HB3 H 1 3.76 . . 2 . . . . . . . . 4251 1 133 . 1 1 18 18 GLY N N 15 110.5 . . 1 . . . . . . . . 4251 1 134 . 1 1 18 18 GLY H H 1 8.04 . . 1 . . . . . . . . 4251 1 135 . 1 1 19 19 ASP CA C 13 55.5 . . 1 . . . . . . . . 4251 1 136 . 1 1 19 19 ASP CB C 13 40.6 . . 1 . . . . . . . . 4251 1 137 . 1 1 20 20 ASN N N 15 115.0 . . 1 . . . . . . . . 4251 1 138 . 1 1 20 20 ASN H H 1 8.63 . . 1 . . . . . . . . 4251 1 139 . 1 1 20 20 ASN CA C 13 53.8 . . 1 . . . . . . . . 4251 1 140 . 1 1 20 20 ASN HA H 1 4.77 . . 1 . . . . . . . . 4251 1 141 . 1 1 20 20 ASN CB C 13 38.2 . . 1 . . . . . . . . 4251 1 142 . 1 1 20 20 ASN HB2 H 1 3.18 . . 2 . . . . . . . . 4251 1 143 . 1 1 20 20 ASN HB3 H 1 2.96 . . 2 . . . . . . . . 4251 1 144 . 1 1 21 21 THR N N 15 109.0 . . 1 . . . . . . . . 4251 1 145 . 1 1 21 21 THR H H 1 7.71 . . 1 . . . . . . . . 4251 1 146 . 1 1 21 21 THR CA C 13 60.9 . . 1 . . . . . . . . 4251 1 147 . 1 1 21 21 THR HA H 1 5.14 . . 1 . . . . . . . . 4251 1 148 . 1 1 21 21 THR CB C 13 71.7 . . 1 . . . . . . . . 4251 1 149 . 1 1 21 21 THR HB H 1 4.58 . . 1 . . . . . . . . 4251 1 150 . 1 1 21 21 THR HG21 H 1 1.24 . . 1 . . . . . . . . 4251 1 151 . 1 1 21 21 THR HG22 H 1 1.24 . . 1 . . . . . . . . 4251 1 152 . 1 1 21 21 THR HG23 H 1 1.24 . . 1 . . . . . . . . 4251 1 153 . 1 1 21 21 THR CG2 C 13 22.7 . . 1 . . . . . . . . 4251 1 154 . 1 1 22 22 LEU N N 15 125.3 . . 1 . . . . . . . . 4251 1 155 . 1 1 22 22 LEU H H 1 8.22 . . 1 . . . . . . . . 4251 1 156 . 1 1 22 22 LEU CA C 13 53.5 . . 1 . . . . . . . . 4251 1 157 . 1 1 22 22 LEU HA H 1 4.60 . . 1 . . . . . . . . 4251 1 158 . 1 1 22 22 LEU CB C 13 46.3 . . 1 . . . . . . . . 4251 1 159 . 1 1 22 22 LEU HB2 H 1 1.55 . . 2 . . . . . . . . 4251 1 160 . 1 1 22 22 LEU HB3 H 1 0.79 . . 2 . . . . . . . . 4251 1 161 . 1 1 22 22 LEU CG C 13 26.0 . . 1 . . . . . . . . 4251 1 162 . 1 1 22 22 LEU HG H 1 1.41 . . 1 . . . . . . . . 4251 1 163 . 1 1 22 22 LEU HD11 H 1 0.66 . . 2 . . . . . . . . 4251 1 164 . 1 1 22 22 LEU HD12 H 1 0.66 . . 2 . . . . . . . . 4251 1 165 . 1 1 22 22 LEU HD13 H 1 0.66 . . 2 . . . . . . . . 4251 1 166 . 1 1 22 22 LEU HD21 H 1 0.58 . . 2 . . . . . . . . 4251 1 167 . 1 1 22 22 LEU HD22 H 1 0.58 . . 2 . . . . . . . . 4251 1 168 . 1 1 22 22 LEU HD23 H 1 0.58 . . 2 . . . . . . . . 4251 1 169 . 1 1 22 22 LEU CD1 C 13 22.9 . . 1 . . . . . . . . 4251 1 170 . 1 1 22 22 LEU CD2 C 13 26.0 . . 1 . . . . . . . . 4251 1 171 . 1 1 23 23 SER N N 15 120.1 . . 1 . . . . . . . . 4251 1 172 . 1 1 23 23 SER H H 1 8.11 . . 1 . . . . . . . . 4251 1 173 . 1 1 23 23 SER CA C 13 58.5 . . 1 . . . . . . . . 4251 1 174 . 1 1 23 23 SER HA H 1 5.05 . . 1 . . . . . . . . 4251 1 175 . 1 1 23 23 SER CB C 13 63.7 . . 1 . . . . . . . . 4251 1 176 . 1 1 23 23 SER HB2 H 1 4.02 . . 2 . . . . . . . . 4251 1 177 . 1 1 23 23 SER HB3 H 1 3.84 . . 2 . . . . . . . . 4251 1 178 . 1 1 24 24 ILE N N 15 117.7 . . 1 . . . . . . . . 4251 1 179 . 1 1 24 24 ILE H H 1 9.01 . . 1 . . . . . . . . 4251 1 180 . 1 1 24 24 ILE CA C 13 59.4 . . 1 . . . . . . . . 4251 1 181 . 1 1 24 24 ILE HA H 1 5.05 . . 1 . . . . . . . . 4251 1 182 . 1 1 24 24 ILE CB C 13 42.7 . . 1 . . . . . . . . 4251 1 183 . 1 1 24 24 ILE HB H 1 1.81 . . 1 . . . . . . . . 4251 1 184 . 1 1 24 24 ILE HG21 H 1 0.86 . . 1 . . . . . . . . 4251 1 185 . 1 1 24 24 ILE HG22 H 1 0.86 . . 1 . . . . . . . . 4251 1 186 . 1 1 24 24 ILE HG23 H 1 0.86 . . 1 . . . . . . . . 4251 1 187 . 1 1 24 24 ILE CG2 C 13 18.6 . . 1 . . . . . . . . 4251 1 188 . 1 1 24 24 ILE CG1 C 13 26.0 . . 1 . . . . . . . . 4251 1 189 . 1 1 24 24 ILE HG12 H 1 1.46 . . 1 . . . . . . . . 4251 1 190 . 1 1 24 24 ILE HG13 H 1 1.46 . . 1 . . . . . . . . 4251 1 191 . 1 1 24 24 ILE HD11 H 1 0.88 . . 1 . . . . . . . . 4251 1 192 . 1 1 24 24 ILE HD12 H 1 0.88 . . 1 . . . . . . . . 4251 1 193 . 1 1 24 24 ILE HD13 H 1 0.88 . . 1 . . . . . . . . 4251 1 194 . 1 1 24 24 ILE CD1 C 13 13.3 . . 1 . . . . . . . . 4251 1 195 . 1 1 25 25 THR N N 15 118.9 . . 1 . . . . . . . . 4251 1 196 . 1 1 25 25 THR H H 1 9.00 . . 1 . . . . . . . . 4251 1 197 . 1 1 25 25 THR CA C 13 59.8 . . 1 . . . . . . . . 4251 1 198 . 1 1 25 25 THR HA H 1 4.91 . . 1 . . . . . . . . 4251 1 199 . 1 1 25 25 THR CB C 13 71.6 . . 1 . . . . . . . . 4251 1 200 . 1 1 25 25 THR HB H 1 3.92 . . 1 . . . . . . . . 4251 1 201 . 1 1 25 25 THR HG21 H 1 1.28 . . 1 . . . . . . . . 4251 1 202 . 1 1 25 25 THR HG22 H 1 1.28 . . 1 . . . . . . . . 4251 1 203 . 1 1 25 25 THR HG23 H 1 1.28 . . 1 . . . . . . . . 4251 1 204 . 1 1 26 26 LYS N N 15 124.5 . . 1 . . . . . . . . 4251 1 205 . 1 1 26 26 LYS H H 1 8.95 . . 1 . . . . . . . . 4251 1 206 . 1 1 26 26 LYS CA C 13 58.8 . . 1 . . . . . . . . 4251 1 207 . 1 1 26 26 LYS HA H 1 3.27 . . 1 . . . . . . . . 4251 1 208 . 1 1 26 26 LYS CB C 13 32.4 . . 1 . . . . . . . . 4251 1 209 . 1 1 26 26 LYS HB2 H 1 1.65 . . 2 . . . . . . . . 4251 1 210 . 1 1 26 26 LYS HB3 H 1 1.52 . . 2 . . . . . . . . 4251 1 211 . 1 1 26 26 LYS CG C 13 24.1 . . 1 . . . . . . . . 4251 1 212 . 1 1 26 26 LYS HG2 H 1 1.19 . . 2 . . . . . . . . 4251 1 213 . 1 1 26 26 LYS HG3 H 1 1.12 . . 2 . . . . . . . . 4251 1 214 . 1 1 26 26 LYS CD C 13 29.7 . . 1 . . . . . . . . 4251 1 215 . 1 1 26 26 LYS HD2 H 1 1.67 . . 1 . . . . . . . . 4251 1 216 . 1 1 26 26 LYS HD3 H 1 1.67 . . 1 . . . . . . . . 4251 1 217 . 1 1 26 26 LYS CE C 13 41.7 . . 1 . . . . . . . . 4251 1 218 . 1 1 26 26 LYS HE2 H 1 3.00 . . 1 . . . . . . . . 4251 1 219 . 1 1 26 26 LYS HE3 H 1 3.00 . . 1 . . . . . . . . 4251 1 220 . 1 1 27 27 GLY N N 15 114.9 . . 1 . . . . . . . . 4251 1 221 . 1 1 27 27 GLY H H 1 8.97 . . 1 . . . . . . . . 4251 1 222 . 1 1 27 27 GLY CA C 13 44.8 . . 1 . . . . . . . . 4251 1 223 . 1 1 27 27 GLY HA2 H 1 4.36 . . 2 . . . . . . . . 4251 1 224 . 1 1 27 27 GLY HA3 H 1 3.46 . . 2 . . . . . . . . 4251 1 225 . 1 1 28 28 GLU N N 15 124.0 . . 1 . . . . . . . . 4251 1 226 . 1 1 28 28 GLU H H 1 8.54 . . 1 . . . . . . . . 4251 1 227 . 1 1 28 28 GLU CA C 13 57.2 . . 1 . . . . . . . . 4251 1 228 . 1 1 28 28 GLU HA H 1 4.26 . . 1 . . . . . . . . 4251 1 229 . 1 1 28 28 GLU CB C 13 31.5 . . 1 . . . . . . . . 4251 1 230 . 1 1 28 28 GLU HB2 H 1 2.34 . . 2 . . . . . . . . 4251 1 231 . 1 1 28 28 GLU HB3 H 1 2.08 . . 2 . . . . . . . . 4251 1 232 . 1 1 28 28 GLU CG C 13 36.3 . . 1 . . . . . . . . 4251 1 233 . 1 1 28 28 GLU HG2 H 1 2.48 . . 2 . . . . . . . . 4251 1 234 . 1 1 28 28 GLU HG3 H 1 2.33 . . 2 . . . . . . . . 4251 1 235 . 1 1 29 29 LYS N N 15 122.5 . . 1 . . . . . . . . 4251 1 236 . 1 1 29 29 LYS H H 1 8.35 . . 1 . . . . . . . . 4251 1 237 . 1 1 29 29 LYS CA C 13 55.4 . . 1 . . . . . . . . 4251 1 238 . 1 1 29 29 LYS HA H 1 5.20 . . 1 . . . . . . . . 4251 1 239 . 1 1 29 29 LYS CB C 13 33.3 . . 1 . . . . . . . . 4251 1 240 . 1 1 29 29 LYS HB2 H 1 1.89 . . 2 . . . . . . . . 4251 1 241 . 1 1 29 29 LYS HB3 H 1 1.81 . . 2 . . . . . . . . 4251 1 242 . 1 1 29 29 LYS CG C 13 25.7 . . 1 . . . . . . . . 4251 1 243 . 1 1 29 29 LYS HG2 H 1 1.65 . . 2 . . . . . . . . 4251 1 244 . 1 1 29 29 LYS HG3 H 1 1.45 . . 2 . . . . . . . . 4251 1 245 . 1 1 29 29 LYS CD C 13 28.7 . . 1 . . . . . . . . 4251 1 246 . 1 1 29 29 LYS HD2 H 1 1.70 . . 1 . . . . . . . . 4251 1 247 . 1 1 29 29 LYS HD3 H 1 1.70 . . 1 . . . . . . . . 4251 1 248 . 1 1 29 29 LYS CE C 13 42.2 . . 1 . . . . . . . . 4251 1 249 . 1 1 29 29 LYS HE2 H 1 2.98 . . 1 . . . . . . . . 4251 1 250 . 1 1 29 29 LYS HE3 H 1 2.98 . . 1 . . . . . . . . 4251 1 251 . 1 1 30 30 LEU N N 15 119.8 . . 1 . . . . . . . . 4251 1 252 . 1 1 30 30 LEU H H 1 9.17 . . 1 . . . . . . . . 4251 1 253 . 1 1 30 30 LEU CA C 13 53.9 . . 1 . . . . . . . . 4251 1 254 . 1 1 30 30 LEU HA H 1 4.86 . . 1 . . . . . . . . 4251 1 255 . 1 1 30 30 LEU CB C 13 45.1 . . 1 . . . . . . . . 4251 1 256 . 1 1 30 30 LEU HB2 H 1 1.56 . . 2 . . . . . . . . 4251 1 257 . 1 1 30 30 LEU HB3 H 1 1.29 . . 2 . . . . . . . . 4251 1 258 . 1 1 30 30 LEU CG C 13 26.0 . . 1 . . . . . . . . 4251 1 259 . 1 1 30 30 LEU HG H 1 1.56 . . 1 . . . . . . . . 4251 1 260 . 1 1 30 30 LEU HD11 H 1 0.68 . . 2 . . . . . . . . 4251 1 261 . 1 1 30 30 LEU HD12 H 1 0.68 . . 2 . . . . . . . . 4251 1 262 . 1 1 30 30 LEU HD13 H 1 0.68 . . 2 . . . . . . . . 4251 1 263 . 1 1 30 30 LEU HD21 H 1 0.61 . . 2 . . . . . . . . 4251 1 264 . 1 1 30 30 LEU HD22 H 1 0.61 . . 2 . . . . . . . . 4251 1 265 . 1 1 30 30 LEU HD23 H 1 0.61 . . 2 . . . . . . . . 4251 1 266 . 1 1 30 30 LEU CD2 C 13 27.3 . . 1 . . . . . . . . 4251 1 267 . 1 1 31 31 ARG N N 15 120.1 . . 1 . . . . . . . . 4251 1 268 . 1 1 31 31 ARG H H 1 8.29 . . 1 . . . . . . . . 4251 1 269 . 1 1 31 31 ARG CA C 13 54.2 . . 1 . . . . . . . . 4251 1 270 . 1 1 31 31 ARG HA H 1 5.07 . . 1 . . . . . . . . 4251 1 271 . 1 1 31 31 ARG CB C 13 32.2 . . 1 . . . . . . . . 4251 1 272 . 1 1 31 31 ARG HB2 H 1 1.69 . . 1 . . . . . . . . 4251 1 273 . 1 1 31 31 ARG HB3 H 1 1.69 . . 1 . . . . . . . . 4251 1 274 . 1 1 31 31 ARG CG C 13 27.8 . . 1 . . . . . . . . 4251 1 275 . 1 1 31 31 ARG HG2 H 1 1.63 . . 2 . . . . . . . . 4251 1 276 . 1 1 31 31 ARG HG3 H 1 1.41 . . 2 . . . . . . . . 4251 1 277 . 1 1 31 31 ARG CD C 13 43.1 . . 1 . . . . . . . . 4251 1 278 . 1 1 31 31 ARG HD2 H 1 3.11 . . 1 . . . . . . . . 4251 1 279 . 1 1 31 31 ARG HD3 H 1 3.11 . . 1 . . . . . . . . 4251 1 280 . 1 1 32 32 VAL N N 15 124.6 . . 1 . . . . . . . . 4251 1 281 . 1 1 32 32 VAL H H 1 8.77 . . 1 . . . . . . . . 4251 1 282 . 1 1 32 32 VAL CA C 13 62.2 . . 1 . . . . . . . . 4251 1 283 . 1 1 32 32 VAL HA H 1 4.14 . . 1 . . . . . . . . 4251 1 284 . 1 1 32 32 VAL CB C 13 32.8 . . 1 . . . . . . . . 4251 1 285 . 1 1 32 32 VAL HB H 1 1.45 . . 1 . . . . . . . . 4251 1 286 . 1 1 32 32 VAL HG11 H 1 0.22 . . 2 . . . . . . . . 4251 1 287 . 1 1 32 32 VAL HG12 H 1 0.22 . . 2 . . . . . . . . 4251 1 288 . 1 1 32 32 VAL HG13 H 1 0.22 . . 2 . . . . . . . . 4251 1 289 . 1 1 32 32 VAL HG21 H 1 -0.21 . . 2 . . . . . . . . 4251 1 290 . 1 1 32 32 VAL HG22 H 1 -0.21 . . 2 . . . . . . . . 4251 1 291 . 1 1 32 32 VAL HG23 H 1 -0.21 . . 2 . . . . . . . . 4251 1 292 . 1 1 32 32 VAL CG1 C 13 20.7 . . 1 . . . . . . . . 4251 1 293 . 1 1 32 32 VAL CG2 C 13 22.4 . . 1 . . . . . . . . 4251 1 294 . 1 1 33 33 LEU N N 15 128.5 . . 1 . . . . . . . . 4251 1 295 . 1 1 33 33 LEU H H 1 9.21 . . 1 . . . . . . . . 4251 1 296 . 1 1 33 33 LEU CA C 13 55.1 . . 1 . . . . . . . . 4251 1 297 . 1 1 33 33 LEU HA H 1 4.20 . . 1 . . . . . . . . 4251 1 298 . 1 1 33 33 LEU CB C 13 42.0 . . 1 . . . . . . . . 4251 1 299 . 1 1 33 33 LEU HB2 H 1 1.20 . . 2 . . . . . . . . 4251 1 300 . 1 1 33 33 LEU HB3 H 1 1.42 . . 2 . . . . . . . . 4251 1 301 . 1 1 33 33 LEU CG C 13 27.5 . . 1 . . . . . . . . 4251 1 302 . 1 1 33 33 LEU HG H 1 1.33 . . 1 . . . . . . . . 4251 1 303 . 1 1 33 33 LEU HD11 H 1 0.56 . . 2 . . . . . . . . 4251 1 304 . 1 1 33 33 LEU HD12 H 1 0.56 . . 2 . . . . . . . . 4251 1 305 . 1 1 33 33 LEU HD13 H 1 0.56 . . 2 . . . . . . . . 4251 1 306 . 1 1 33 33 LEU HD21 H 1 0.52 . . 2 . . . . . . . . 4251 1 307 . 1 1 33 33 LEU HD22 H 1 0.52 . . 2 . . . . . . . . 4251 1 308 . 1 1 33 33 LEU HD23 H 1 0.52 . . 2 . . . . . . . . 4251 1 309 . 1 1 33 33 LEU CD1 C 13 22.4 . . 1 . . . . . . . . 4251 1 310 . 1 1 33 33 LEU CD2 C 13 24.7 . . 1 . . . . . . . . 4251 1 311 . 1 1 34 34 GLY N N 15 105.8 . . 1 . . . . . . . . 4251 1 312 . 1 1 34 34 GLY H H 1 7.03 . . 1 . . . . . . . . 4251 1 313 . 1 1 34 34 GLY CA C 13 44.8 . . 1 . . . . . . . . 4251 1 314 . 1 1 34 34 GLY HA2 H 1 4.25 . . 2 . . . . . . . . 4251 1 315 . 1 1 34 34 GLY HA3 H 1 3.79 . . 2 . . . . . . . . 4251 1 316 . 1 1 35 35 TYR N N 15 116.0 . . 1 . . . . . . . . 4251 1 317 . 1 1 35 35 TYR H H 1 8.65 . . 1 . . . . . . . . 4251 1 318 . 1 1 35 35 TYR CA C 13 57.2 . . 1 . . . . . . . . 4251 1 319 . 1 1 35 35 TYR HA H 1 5.70 . . 1 . . . . . . . . 4251 1 320 . 1 1 35 35 TYR CB C 13 43.5 . . 1 . . . . . . . . 4251 1 321 . 1 1 35 35 TYR HB2 H 1 3.29 . . 2 . . . . . . . . 4251 1 322 . 1 1 35 35 TYR HB3 H 1 2.94 . . 2 . . . . . . . . 4251 1 323 . 1 1 36 36 ASN N N 15 120.5 . . 1 . . . . . . . . 4251 1 324 . 1 1 36 36 ASN H H 1 9.04 . . 1 . . . . . . . . 4251 1 325 . 1 1 36 36 ASN CA C 13 52.3 . . 1 . . . . . . . . 4251 1 326 . 1 1 36 36 ASN HA H 1 4.91 . . 1 . . . . . . . . 4251 1 327 . 1 1 36 36 ASN CB C 13 37.8 . . 1 . . . . . . . . 4251 1 328 . 1 1 36 36 ASN HB2 H 1 3.20 . . 2 . . . . . . . . 4251 1 329 . 1 1 36 36 ASN HB3 H 1 2.42 . . 2 . . . . . . . . 4251 1 330 . 1 1 37 37 HIS N N 15 120.4 . . 1 . . . . . . . . 4251 1 331 . 1 1 37 37 HIS H H 1 8.98 . . 1 . . . . . . . . 4251 1 332 . 1 1 37 37 HIS CA C 13 59.8 . . 1 . . . . . . . . 4251 1 333 . 1 1 37 37 HIS HA H 1 4.29 . . 1 . . . . . . . . 4251 1 334 . 1 1 37 37 HIS CB C 13 30.1 . . 1 . . . . . . . . 4251 1 335 . 1 1 37 37 HIS HB2 H 1 3.12 . . 1 . . . . . . . . 4251 1 336 . 1 1 37 37 HIS HB3 H 1 3.12 . . 1 . . . . . . . . 4251 1 337 . 1 1 38 38 ASN N N 15 113.5 . . 1 . . . . . . . . 4251 1 338 . 1 1 38 38 ASN H H 1 6.54 . . 1 . . . . . . . . 4251 1 339 . 1 1 38 38 ASN CA C 13 51.0 . . 1 . . . . . . . . 4251 1 340 . 1 1 38 38 ASN HA H 1 4.76 . . 1 . . . . . . . . 4251 1 341 . 1 1 38 38 ASN CB C 13 37.9 . . 1 . . . . . . . . 4251 1 342 . 1 1 38 38 ASN HB2 H 1 3.18 . . 2 . . . . . . . . 4251 1 343 . 1 1 38 38 ASN HB3 H 1 2.45 . . 2 . . . . . . . . 4251 1 344 . 1 1 39 39 GLY N N 15 107.4 . . 1 . . . . . . . . 4251 1 345 . 1 1 39 39 GLY H H 1 7.60 . . 1 . . . . . . . . 4251 1 346 . 1 1 39 39 GLY CA C 13 45.9 . . 1 . . . . . . . . 4251 1 347 . 1 1 39 39 GLY HA2 H 1 4.11 . . 2 . . . . . . . . 4251 1 348 . 1 1 39 39 GLY HA3 H 1 3.58 . . 2 . . . . . . . . 4251 1 349 . 1 1 40 40 GLU N N 15 122.1 . . 1 . . . . . . . . 4251 1 350 . 1 1 40 40 GLU H H 1 8.34 . . 1 . . . . . . . . 4251 1 351 . 1 1 40 40 GLU CA C 13 58.5 . . 1 . . . . . . . . 4251 1 352 . 1 1 40 40 GLU HA H 1 4.00 . . 1 . . . . . . . . 4251 1 353 . 1 1 40 40 GLU CB C 13 30.5 . . 1 . . . . . . . . 4251 1 354 . 1 1 40 40 GLU HB2 H 1 2.09 . . 2 . . . . . . . . 4251 1 355 . 1 1 40 40 GLU HB3 H 1 1.96 . . 2 . . . . . . . . 4251 1 356 . 1 1 40 40 GLU CG C 13 36.9 . . 1 . . . . . . . . 4251 1 357 . 1 1 40 40 GLU HG2 H 1 2.14 . . 2 . . . . . . . . 4251 1 358 . 1 1 40 40 GLU HG3 H 1 2.02 . . 2 . . . . . . . . 4251 1 359 . 1 1 41 41 TRP N N 15 119.6 . . 1 . . . . . . . . 4251 1 360 . 1 1 41 41 TRP H H 1 8.31 . . 1 . . . . . . . . 4251 1 361 . 1 1 41 41 TRP CA C 13 56.1 . . 1 . . . . . . . . 4251 1 362 . 1 1 41 41 TRP HA H 1 4.99 . . 1 . . . . . . . . 4251 1 363 . 1 1 41 41 TRP CB C 13 32.6 . . 1 . . . . . . . . 4251 1 364 . 1 1 41 41 TRP HB2 H 1 3.36 . . 2 . . . . . . . . 4251 1 365 . 1 1 41 41 TRP HB3 H 1 2.43 . . 2 . . . . . . . . 4251 1 366 . 1 1 42 42 ALA N N 15 124.9 . . 1 . . . . . . . . 4251 1 367 . 1 1 42 42 ALA H H 1 9.78 . . 1 . . . . . . . . 4251 1 368 . 1 1 42 42 ALA CA C 13 49.5 . . 1 . . . . . . . . 4251 1 369 . 1 1 42 42 ALA HA H 1 4.92 . . 1 . . . . . . . . 4251 1 370 . 1 1 42 42 ALA HB1 H 1 0.84 . . 1 . . . . . . . . 4251 1 371 . 1 1 42 42 ALA HB2 H 1 0.84 . . 1 . . . . . . . . 4251 1 372 . 1 1 42 42 ALA HB3 H 1 0.84 . . 1 . . . . . . . . 4251 1 373 . 1 1 42 42 ALA CB C 13 21.8 . . 1 . . . . . . . . 4251 1 374 . 1 1 43 43 GLU N N 15 126.6 . . 1 . . . . . . . . 4251 1 375 . 1 1 43 43 GLU H H 1 8.38 . . 1 . . . . . . . . 4251 1 376 . 1 1 43 43 GLU CA C 13 55.0 . . 1 . . . . . . . . 4251 1 377 . 1 1 43 43 GLU HA H 1 3.40 . . 1 . . . . . . . . 4251 1 378 . 1 1 43 43 GLU CB C 13 27.4 . . 1 . . . . . . . . 4251 1 379 . 1 1 43 43 GLU HB2 H 1 1.06 . . 2 . . . . . . . . 4251 1 380 . 1 1 43 43 GLU HB3 H 1 -0.32 . . 2 . . . . . . . . 4251 1 381 . 1 1 43 43 GLU CG C 13 36.1 . . 1 . . . . . . . . 4251 1 382 . 1 1 43 43 GLU HG2 H 1 1.29 . . 2 . . . . . . . . 4251 1 383 . 1 1 43 43 GLU HG3 H 1 0.67 . . 2 . . . . . . . . 4251 1 384 . 1 1 44 44 ALA N N 15 130.7 . . 1 . . . . . . . . 4251 1 385 . 1 1 44 44 ALA H H 1 8.97 . . 1 . . . . . . . . 4251 1 386 . 1 1 44 44 ALA CA C 13 49.9 . . 1 . . . . . . . . 4251 1 387 . 1 1 44 44 ALA HA H 1 5.25 . . 1 . . . . . . . . 4251 1 388 . 1 1 44 44 ALA HB1 H 1 1.07 . . 1 . . . . . . . . 4251 1 389 . 1 1 44 44 ALA HB2 H 1 1.07 . . 1 . . . . . . . . 4251 1 390 . 1 1 44 44 ALA HB3 H 1 1.07 . . 1 . . . . . . . . 4251 1 391 . 1 1 44 44 ALA CB C 13 24.3 . . 1 . . . . . . . . 4251 1 392 . 1 1 45 45 GLN N N 15 117.5 . . 1 . . . . . . . . 4251 1 393 . 1 1 45 45 GLN H H 1 8.82 . . 1 . . . . . . . . 4251 1 394 . 1 1 45 45 GLN CA C 13 54.7 . . 1 . . . . . . . . 4251 1 395 . 1 1 45 45 GLN HA H 1 5.14 . . 1 . . . . . . . . 4251 1 396 . 1 1 45 45 GLN CB C 13 32.4 . . 1 . . . . . . . . 4251 1 397 . 1 1 45 45 GLN HB2 H 1 1.77 . . 2 . . . . . . . . 4251 1 398 . 1 1 45 45 GLN HB3 H 1 1.96 . . 2 . . . . . . . . 4251 1 399 . 1 1 45 45 GLN CG C 13 34.5 . . 1 . . . . . . . . 4251 1 400 . 1 1 45 45 GLN HG2 H 1 2.28 . . 2 . . . . . . . . 4251 1 401 . 1 1 45 45 GLN HG3 H 1 2.19 . . 2 . . . . . . . . 4251 1 402 . 1 1 46 46 THR N N 15 117.6 . . 1 . . . . . . . . 4251 1 403 . 1 1 46 46 THR H H 1 9.09 . . 1 . . . . . . . . 4251 1 404 . 1 1 46 46 THR CA C 13 59.1 . . 1 . . . . . . . . 4251 1 405 . 1 1 46 46 THR HA H 1 4.93 . . 1 . . . . . . . . 4251 1 406 . 1 1 46 46 THR CB C 13 72.2 . . 1 . . . . . . . . 4251 1 407 . 1 1 46 46 THR HB H 1 4.91 . . 1 . . . . . . . . 4251 1 408 . 1 1 46 46 THR HG21 H 1 1.22 . . 1 . . . . . . . . 4251 1 409 . 1 1 46 46 THR HG22 H 1 1.22 . . 1 . . . . . . . . 4251 1 410 . 1 1 46 46 THR HG23 H 1 1.22 . . 1 . . . . . . . . 4251 1 411 . 1 1 46 46 THR CG2 C 13 21.9 . . 1 . . . . . . . . 4251 1 412 . 1 1 47 47 LYS CA C 13 58.4 . . 1 . . . . . . . . 4251 1 413 . 1 1 47 47 LYS HA H 1 4.21 . . 1 . . . . . . . . 4251 1 414 . 1 1 47 47 LYS CB C 13 31.9 . . 1 . . . . . . . . 4251 1 415 . 1 1 47 47 LYS HB2 H 1 1.94 . . 2 . . . . . . . . 4251 1 416 . 1 1 47 47 LYS HB3 H 1 1.86 . . 2 . . . . . . . . 4251 1 417 . 1 1 47 47 LYS CG C 13 24.2 . . 1 . . . . . . . . 4251 1 418 . 1 1 47 47 LYS HG2 H 1 1.52 . . 2 . . . . . . . . 4251 1 419 . 1 1 47 47 LYS HG3 H 1 1.44 . . 2 . . . . . . . . 4251 1 420 . 1 1 47 47 LYS CD C 13 29.2 . . 1 . . . . . . . . 4251 1 421 . 1 1 47 47 LYS HD2 H 1 1.72 . . 1 . . . . . . . . 4251 1 422 . 1 1 47 47 LYS HD3 H 1 1.72 . . 1 . . . . . . . . 4251 1 423 . 1 1 47 47 LYS CE C 13 42.0 . . 1 . . . . . . . . 4251 1 424 . 1 1 47 47 LYS HE2 H 1 3.04 . . 1 . . . . . . . . 4251 1 425 . 1 1 47 47 LYS HE3 H 1 3.04 . . 1 . . . . . . . . 4251 1 426 . 1 1 48 48 ASN N N 15 113.9 . . 1 . . . . . . . . 4251 1 427 . 1 1 48 48 ASN H H 1 8.25 . . 1 . . . . . . . . 4251 1 428 . 1 1 48 48 ASN CA C 13 53.2 . . 1 . . . . . . . . 4251 1 429 . 1 1 48 48 ASN HA H 1 4.86 . . 1 . . . . . . . . 4251 1 430 . 1 1 48 48 ASN CB C 13 40.1 . . 1 . . . . . . . . 4251 1 431 . 1 1 48 48 ASN HB2 H 1 2.89 . . 2 . . . . . . . . 4251 1 432 . 1 1 48 48 ASN HB3 H 1 2.59 . . 2 . . . . . . . . 4251 1 433 . 1 1 49 49 GLY N N 15 108.3 . . 1 . . . . . . . . 4251 1 434 . 1 1 49 49 GLY H H 1 7.51 . . 1 . . . . . . . . 4251 1 435 . 1 1 49 49 GLY CA C 13 45.2 . . 1 . . . . . . . . 4251 1 436 . 1 1 49 49 GLY HA2 H 1 4.31 . . 2 . . . . . . . . 4251 1 437 . 1 1 49 49 GLY HA3 H 1 3.86 . . 2 . . . . . . . . 4251 1 438 . 1 1 50 50 GLN N N 15 119.6 . . 1 . . . . . . . . 4251 1 439 . 1 1 50 50 GLN H H 1 8.20 . . 1 . . . . . . . . 4251 1 440 . 1 1 50 50 GLN CA C 13 53.6 . . 1 . . . . . . . . 4251 1 441 . 1 1 50 50 GLN HA H 1 5.56 . . 1 . . . . . . . . 4251 1 442 . 1 1 50 50 GLN CB C 13 31.8 . . 1 . . . . . . . . 4251 1 443 . 1 1 50 50 GLN HB2 H 1 1.80 . . 2 . . . . . . . . 4251 1 444 . 1 1 50 50 GLN HB3 H 1 2.03 . . 2 . . . . . . . . 4251 1 445 . 1 1 50 50 GLN CG C 13 33.3 . . 1 . . . . . . . . 4251 1 446 . 1 1 50 50 GLN HG2 H 1 2.11 . . 1 . . . . . . . . 4251 1 447 . 1 1 50 50 GLN HG3 H 1 2.11 . . 1 . . . . . . . . 4251 1 448 . 1 1 51 51 GLY N N 15 112.2 . . 1 . . . . . . . . 4251 1 449 . 1 1 51 51 GLY H H 1 8.75 . . 1 . . . . . . . . 4251 1 450 . 1 1 51 51 GLY CA C 13 45.2 . . 1 . . . . . . . . 4251 1 451 . 1 1 51 51 GLY HA2 H 1 4.07 . . 2 . . . . . . . . 4251 1 452 . 1 1 51 51 GLY HA3 H 1 3.95 . . 2 . . . . . . . . 4251 1 453 . 1 1 52 52 TRP N N 15 121.1 . . 1 . . . . . . . . 4251 1 454 . 1 1 52 52 TRP H H 1 8.74 . . 1 . . . . . . . . 4251 1 455 . 1 1 52 52 TRP CA C 13 57.1 . . 1 . . . . . . . . 4251 1 456 . 1 1 52 52 TRP HA H 1 5.46 . . 1 . . . . . . . . 4251 1 457 . 1 1 52 52 TRP CB C 13 30.6 . . 1 . . . . . . . . 4251 1 458 . 1 1 52 52 TRP HB2 H 1 3.22 . . 2 . . . . . . . . 4251 1 459 . 1 1 52 52 TRP HB3 H 1 2.83 . . 2 . . . . . . . . 4251 1 460 . 1 1 53 53 VAL N N 15 115.7 . . 1 . . . . . . . . 4251 1 461 . 1 1 53 53 VAL H H 1 9.76 . . 1 . . . . . . . . 4251 1 462 . 1 1 53 53 VAL CA C 13 57.4 . . 1 . . . . . . . . 4251 1 463 . 1 1 53 53 VAL HA H 1 4.87 . . 1 . . . . . . . . 4251 1 464 . 1 1 53 53 VAL CB C 13 33.8 . . 1 . . . . . . . . 4251 1 465 . 1 1 53 53 VAL HB H 1 1.74 . . 1 . . . . . . . . 4251 1 466 . 1 1 53 53 VAL HG11 H 1 1.02 . . 2 . . . . . . . . 4251 1 467 . 1 1 53 53 VAL HG12 H 1 1.02 . . 2 . . . . . . . . 4251 1 468 . 1 1 53 53 VAL HG13 H 1 1.02 . . 2 . . . . . . . . 4251 1 469 . 1 1 53 53 VAL HG21 H 1 0.61 . . 2 . . . . . . . . 4251 1 470 . 1 1 53 53 VAL HG22 H 1 0.61 . . 2 . . . . . . . . 4251 1 471 . 1 1 53 53 VAL HG23 H 1 0.61 . . 2 . . . . . . . . 4251 1 472 . 1 1 53 53 VAL CG1 C 13 22.2 . . 1 . . . . . . . . 4251 1 473 . 1 1 53 53 VAL CG2 C 13 19.3 . . 1 . . . . . . . . 4251 1 474 . 1 1 54 54 PRO CA C 13 62.1 . . 1 . . . . . . . . 4251 1 475 . 1 1 54 54 PRO CB C 13 30.8 . . 1 . . . . . . . . 4251 1 476 . 1 1 55 55 SER N N 15 121.4 . . 1 . . . . . . . . 4251 1 477 . 1 1 55 55 SER H H 1 8.46 . . 1 . . . . . . . . 4251 1 478 . 1 1 55 55 SER CA C 13 60.8 . . 1 . . . . . . . . 4251 1 479 . 1 1 55 55 SER HA H 1 4.01 . . 1 . . . . . . . . 4251 1 480 . 1 1 55 55 SER CB C 13 62.8 . . 1 . . . . . . . . 4251 1 481 . 1 1 55 55 SER HB2 H 1 3.94 . . 2 . . . . . . . . 4251 1 482 . 1 1 55 55 SER HB3 H 1 3.84 . . 2 . . . . . . . . 4251 1 483 . 1 1 56 56 ASN N N 15 114.2 . . 1 . . . . . . . . 4251 1 484 . 1 1 56 56 ASN H H 1 8.39 . . 1 . . . . . . . . 4251 1 485 . 1 1 56 56 ASN CA C 13 53.2 . . 1 . . . . . . . . 4251 1 486 . 1 1 56 56 ASN HA H 1 4.84 . . 1 . . . . . . . . 4251 1 487 . 1 1 56 56 ASN CB C 13 36.4 . . 1 . . . . . . . . 4251 1 488 . 1 1 56 56 ASN HB2 H 1 3.03 . . 2 . . . . . . . . 4251 1 489 . 1 1 56 56 ASN HB3 H 1 2.77 . . 2 . . . . . . . . 4251 1 490 . 1 1 57 57 TYR N N 15 119.1 . . 1 . . . . . . . . 4251 1 491 . 1 1 57 57 TYR H H 1 7.96 . . 1 . . . . . . . . 4251 1 492 . 1 1 57 57 TYR CA C 13 57.5 . . 1 . . . . . . . . 4251 1 493 . 1 1 57 57 TYR HA H 1 4.80 . . 1 . . . . . . . . 4251 1 494 . 1 1 57 57 TYR CB C 13 37.8 . . 1 . . . . . . . . 4251 1 495 . 1 1 57 57 TYR HB2 H 1 3.39 . . 2 . . . . . . . . 4251 1 496 . 1 1 57 57 TYR HB3 H 1 3.21 . . 2 . . . . . . . . 4251 1 497 . 1 1 58 58 ILE N N 15 111.7 . . 1 . . . . . . . . 4251 1 498 . 1 1 58 58 ILE H H 1 7.41 . . 1 . . . . . . . . 4251 1 499 . 1 1 58 58 ILE CA C 13 59.1 . . 1 . . . . . . . . 4251 1 500 . 1 1 58 58 ILE HA H 1 5.45 . . 1 . . . . . . . . 4251 1 501 . 1 1 58 58 ILE CB C 13 42.2 . . 1 . . . . . . . . 4251 1 502 . 1 1 58 58 ILE HB H 1 1.73 . . 1 . . . . . . . . 4251 1 503 . 1 1 58 58 ILE HG21 H 1 0.66 . . 1 . . . . . . . . 4251 1 504 . 1 1 58 58 ILE HG22 H 1 0.66 . . 1 . . . . . . . . 4251 1 505 . 1 1 58 58 ILE HG23 H 1 0.66 . . 1 . . . . . . . . 4251 1 506 . 1 1 58 58 ILE CG2 C 13 18.1 . . 1 . . . . . . . . 4251 1 507 . 1 1 58 58 ILE HG12 H 1 1.43 . . 2 . . . . . . . . 4251 1 508 . 1 1 58 58 ILE HG13 H 1 1.28 . . 2 . . . . . . . . 4251 1 509 . 1 1 58 58 ILE HD11 H 1 0.12 . . 1 . . . . . . . . 4251 1 510 . 1 1 58 58 ILE HD12 H 1 0.12 . . 1 . . . . . . . . 4251 1 511 . 1 1 58 58 ILE HD13 H 1 0.12 . . 1 . . . . . . . . 4251 1 512 . 1 1 58 58 ILE CD1 C 13 13.8 . . 1 . . . . . . . . 4251 1 513 . 1 1 59 59 THR N N 15 116.3 . . 1 . . . . . . . . 4251 1 514 . 1 1 59 59 THR H H 1 8.73 . . 1 . . . . . . . . 4251 1 515 . 1 1 59 59 THR CA C 13 58.8 . . 1 . . . . . . . . 4251 1 516 . 1 1 59 59 THR HA H 1 5.23 . . 1 . . . . . . . . 4251 1 517 . 1 1 59 59 THR CB C 13 72.7 . . 1 . . . . . . . . 4251 1 518 . 1 1 59 59 THR HB H 1 3.92 . . 1 . . . . . . . . 4251 1 519 . 1 1 59 59 THR HG21 H 1 1.05 . . 1 . . . . . . . . 4251 1 520 . 1 1 59 59 THR HG22 H 1 1.05 . . 1 . . . . . . . . 4251 1 521 . 1 1 59 59 THR HG23 H 1 1.05 . . 1 . . . . . . . . 4251 1 522 . 1 1 59 59 THR CG2 C 13 20.1 . . 1 . . . . . . . . 4251 1 523 . 1 1 60 60 PRO CA C 13 63.3 . . 1 . . . . . . . . 4251 1 524 . 1 1 60 60 PRO HA H 1 4.79 . . 1 . . . . . . . . 4251 1 525 . 1 1 60 60 PRO CB C 13 31.9 . . 1 . . . . . . . . 4251 1 526 . 1 1 60 60 PRO HB2 H 1 2.28 . . 2 . . . . . . . . 4251 1 527 . 1 1 60 60 PRO HB3 H 1 1.94 . . 2 . . . . . . . . 4251 1 528 . 1 1 60 60 PRO HD2 H 1 3.58 . . 2 . . . . . . . . 4251 1 529 . 1 1 60 60 PRO HD3 H 1 3.52 . . 2 . . . . . . . . 4251 1 530 . 1 1 61 61 VAL N N 15 119.6 . . 1 . . . . . . . . 4251 1 531 . 1 1 61 61 VAL H H 1 7.89 . . 1 . . . . . . . . 4251 1 532 . 1 1 61 61 VAL CA C 13 62.4 . . 1 . . . . . . . . 4251 1 533 . 1 1 61 61 VAL HA H 1 3.98 . . 1 . . . . . . . . 4251 1 534 . 1 1 61 61 VAL CB C 13 32.7 . . 1 . . . . . . . . 4251 1 535 . 1 1 61 61 VAL HB H 1 1.92 . . 1 . . . . . . . . 4251 1 536 . 1 1 61 61 VAL HG11 H 1 0.85 . . 1 . . . . . . . . 4251 1 537 . 1 1 61 61 VAL HG12 H 1 0.85 . . 1 . . . . . . . . 4251 1 538 . 1 1 61 61 VAL HG13 H 1 0.85 . . 1 . . . . . . . . 4251 1 539 . 1 1 61 61 VAL HG21 H 1 0.85 . . 1 . . . . . . . . 4251 1 540 . 1 1 61 61 VAL HG22 H 1 0.85 . . 1 . . . . . . . . 4251 1 541 . 1 1 61 61 VAL HG23 H 1 0.85 . . 1 . . . . . . . . 4251 1 542 . 1 1 61 61 VAL CG1 C 13 21.4 . . 1 . . . . . . . . 4251 1 543 . 1 1 61 61 VAL CG2 C 13 21.4 . . 1 . . . . . . . . 4251 1 544 . 1 1 62 62 ASN N N 15 127.3 . . 1 . . . . . . . . 4251 1 545 . 1 1 62 62 ASN H H 1 7.90 . . 1 . . . . . . . . 4251 1 546 . 1 1 62 62 ASN CA C 13 54.7 . . 1 . . . . . . . . 4251 1 547 . 1 1 62 62 ASN HA H 1 4.45 . . 1 . . . . . . . . 4251 1 548 . 1 1 62 62 ASN CB C 13 40.7 . . 1 . . . . . . . . 4251 1 549 . 1 1 62 62 ASN HB2 H 1 2.66 . . 2 . . . . . . . . 4251 1 550 . 1 1 62 62 ASN HB3 H 1 2.55 . . 2 . . . . . . . . 4251 1 551 . 1 1 63 63 SER N N 15 116.7 . . 1 . . . . . . . . 4251 1 552 . 1 1 63 63 SER H H 1 7.22 . . 1 . . . . . . . . 4251 1 553 . 1 1 63 63 SER CA C 13 55.7 . . 1 . . . . . . . . 4251 1 554 . 1 1 63 63 SER HA H 1 4.64 . . 1 . . . . . . . . 4251 1 555 . 1 1 63 63 SER HB2 H 1 3.77 . . 1 . . . . . . . . 4251 1 556 . 1 1 63 63 SER HB3 H 1 3.77 . . 1 . . . . . . . . 4251 1 557 . 1 1 64 64 LEU CA C 13 59.0 . . 1 . . . . . . . . 4251 1 558 . 1 1 64 64 LEU HA H 1 4.20 . . 1 . . . . . . . . 4251 1 559 . 1 1 64 64 LEU CB C 13 41.4 . . 1 . . . . . . . . 4251 1 560 . 1 1 64 64 LEU HB2 H 1 1.52 . . 2 . . . . . . . . 4251 1 561 . 1 1 64 64 LEU HD21 H 1 0.73 . . 2 . . . . . . . . 4251 1 562 . 1 1 64 64 LEU HD22 H 1 0.73 . . 2 . . . . . . . . 4251 1 563 . 1 1 64 64 LEU HD23 H 1 0.73 . . 2 . . . . . . . . 4251 1 564 . 1 1 65 65 GLU N N 15 115.3 . . 1 . . . . . . . . 4251 1 565 . 1 1 65 65 GLU H H 1 8.29 . . 1 . . . . . . . . 4251 1 566 . 1 1 65 65 GLU CA C 13 58.3 . . 1 . . . . . . . . 4251 1 567 . 1 1 65 65 GLU HA H 1 4.68 . . 1 . . . . . . . . 4251 1 568 . 1 1 65 65 GLU CB C 13 29.0 . . 1 . . . . . . . . 4251 1 569 . 1 1 65 65 GLU HB2 H 1 2.03 . . 2 . . . . . . . . 4251 1 570 . 1 1 65 65 GLU HB3 H 1 1.88 . . 2 . . . . . . . . 4251 1 571 . 1 1 65 65 GLU CG C 13 37.0 . . 1 . . . . . . . . 4251 1 572 . 1 1 65 65 GLU HG2 H 1 2.25 . . 1 . . . . . . . . 4251 1 573 . 1 1 65 65 GLU HG3 H 1 2.25 . . 1 . . . . . . . . 4251 1 574 . 1 1 66 66 LYS N N 15 116.4 . . 1 . . . . . . . . 4251 1 575 . 1 1 66 66 LYS H H 1 7.35 . . 1 . . . . . . . . 4251 1 576 . 1 1 66 66 LYS CA C 13 56.5 . . 1 . . . . . . . . 4251 1 577 . 1 1 66 66 LYS HA H 1 3.96 . . 1 . . . . . . . . 4251 1 578 . 1 1 66 66 LYS CB C 13 31.8 . . 1 . . . . . . . . 4251 1 579 . 1 1 66 66 LYS HB2 H 1 1.52 . . 1 . . . . . . . . 4251 1 580 . 1 1 66 66 LYS HB3 H 1 1.52 . . 1 . . . . . . . . 4251 1 581 . 1 1 66 66 LYS CG C 13 24.0 . . 1 . . . . . . . . 4251 1 582 . 1 1 66 66 LYS HG2 H 1 1.11 . . 2 . . . . . . . . 4251 1 583 . 1 1 66 66 LYS HG3 H 1 0.90 . . 2 . . . . . . . . 4251 1 584 . 1 1 66 66 LYS CD C 13 28.8 . . 1 . . . . . . . . 4251 1 585 . 1 1 66 66 LYS HD2 H 1 1.46 . . 1 . . . . . . . . 4251 1 586 . 1 1 66 66 LYS HD3 H 1 1.46 . . 1 . . . . . . . . 4251 1 587 . 1 1 66 66 LYS CE C 13 42.0 . . 1 . . . . . . . . 4251 1 588 . 1 1 66 66 LYS HE2 H 1 2.80 . . 1 . . . . . . . . 4251 1 589 . 1 1 66 66 LYS HE3 H 1 2.80 . . 1 . . . . . . . . 4251 1 590 . 1 1 67 67 HIS N N 15 119.2 . . 1 . . . . . . . . 4251 1 591 . 1 1 67 67 HIS H H 1 7.49 . . 1 . . . . . . . . 4251 1 592 . 1 1 67 67 HIS CA C 13 55.5 . . 1 . . . . . . . . 4251 1 593 . 1 1 67 67 HIS HA H 1 4.60 . . 1 . . . . . . . . 4251 1 594 . 1 1 67 67 HIS CB C 13 31.0 . . 1 . . . . . . . . 4251 1 595 . 1 1 67 67 HIS HB2 H 1 3.09 . . 2 . . . . . . . . 4251 1 596 . 1 1 67 67 HIS HB3 H 1 3.01 . . 2 . . . . . . . . 4251 1 597 . 1 1 68 68 SER CA C 13 60.7 . . 1 . . . . . . . . 4251 1 598 . 1 1 68 68 SER HA H 1 3.51 . . 1 . . . . . . . . 4251 1 599 . 1 1 68 68 SER CB C 13 62.4 . . 1 . . . . . . . . 4251 1 600 . 1 1 68 68 SER HB2 H 1 3.79 . . 2 . . . . . . . . 4251 1 601 . 1 1 68 68 SER HB3 H 1 3.87 . . 2 . . . . . . . . 4251 1 602 . 1 1 69 69 TRP N N 15 111.0 . . 1 . . . . . . . . 4251 1 603 . 1 1 69 69 TRP H H 1 6.42 . . 1 . . . . . . . . 4251 1 604 . 1 1 69 69 TRP CA C 13 53.7 . . 1 . . . . . . . . 4251 1 605 . 1 1 69 69 TRP HA H 1 4.51 . . 1 . . . . . . . . 4251 1 606 . 1 1 69 69 TRP CB C 13 31.4 . . 1 . . . . . . . . 4251 1 607 . 1 1 69 69 TRP HB2 H 1 3.55 . . 1 . . . . . . . . 4251 1 608 . 1 1 69 69 TRP HB3 H 1 3.55 . . 1 . . . . . . . . 4251 1 609 . 1 1 70 70 TYR N N 15 123.4 . . 1 . . . . . . . . 4251 1 610 . 1 1 70 70 TYR H H 1 7.58 . . 1 . . . . . . . . 4251 1 611 . 1 1 70 70 TYR CA C 13 58.6 . . 1 . . . . . . . . 4251 1 612 . 1 1 70 70 TYR HA H 1 5.12 . . 1 . . . . . . . . 4251 1 613 . 1 1 70 70 TYR CB C 13 37.5 . . 1 . . . . . . . . 4251 1 614 . 1 1 70 70 TYR HB2 H 1 3.09 . . 2 . . . . . . . . 4251 1 615 . 1 1 70 70 TYR HB3 H 1 2.43 . . 2 . . . . . . . . 4251 1 616 . 1 1 71 71 HIS N N 15 127.1 . . 1 . . . . . . . . 4251 1 617 . 1 1 71 71 HIS H H 1 8.91 . . 1 . . . . . . . . 4251 1 618 . 1 1 71 71 HIS CA C 13 56.7 . . 1 . . . . . . . . 4251 1 619 . 1 1 71 71 HIS HA H 1 4.48 . . 1 . . . . . . . . 4251 1 620 . 1 1 71 71 HIS CB C 13 33.7 . . 1 . . . . . . . . 4251 1 621 . 1 1 71 71 HIS HB2 H 1 3.26 . . 2 . . . . . . . . 4251 1 622 . 1 1 71 71 HIS HB3 H 1 2.66 . . 2 . . . . . . . . 4251 1 623 . 1 1 72 72 GLY N N 15 105.1 . . 1 . . . . . . . . 4251 1 624 . 1 1 72 72 GLY H H 1 5.72 . . 1 . . . . . . . . 4251 1 625 . 1 1 72 72 GLY CA C 13 45.3 . . 1 . . . . . . . . 4251 1 626 . 1 1 72 72 GLY HA2 H 1 4.28 . . 2 . . . . . . . . 4251 1 627 . 1 1 72 72 GLY HA3 H 1 3.43 . . 2 . . . . . . . . 4251 1 628 . 1 1 73 73 PRO CA C 13 62.9 . . 1 . . . . . . . . 4251 1 629 . 1 1 73 73 PRO HA H 1 4.87 . . 1 . . . . . . . . 4251 1 630 . 1 1 73 73 PRO CB C 13 29.8 . . 1 . . . . . . . . 4251 1 631 . 1 1 73 73 PRO HB2 H 1 2.15 . . 2 . . . . . . . . 4251 1 632 . 1 1 73 73 PRO HB3 H 1 1.94 . . 2 . . . . . . . . 4251 1 633 . 1 1 73 73 PRO HG2 H 1 2.04 . . 1 . . . . . . . . 4251 1 634 . 1 1 73 73 PRO HG3 H 1 2.04 . . 1 . . . . . . . . 4251 1 635 . 1 1 73 73 PRO HD2 H 1 3.81 . . 2 . . . . . . . . 4251 1 636 . 1 1 73 73 PRO HD3 H 1 3.64 . . 2 . . . . . . . . 4251 1 637 . 1 1 74 74 VAL N N 15 126.2 . . 1 . . . . . . . . 4251 1 638 . 1 1 74 74 VAL H H 1 8.03 . . 1 . . . . . . . . 4251 1 639 . 1 1 74 74 VAL CA C 13 61.3 . . 1 . . . . . . . . 4251 1 640 . 1 1 74 74 VAL HA H 1 4.32 . . 1 . . . . . . . . 4251 1 641 . 1 1 74 74 VAL CB C 13 35.4 . . 1 . . . . . . . . 4251 1 642 . 1 1 74 74 VAL HB H 1 1.83 . . 1 . . . . . . . . 4251 1 643 . 1 1 74 74 VAL HG11 H 1 1.03 . . 2 . . . . . . . . 4251 1 644 . 1 1 74 74 VAL HG12 H 1 1.03 . . 2 . . . . . . . . 4251 1 645 . 1 1 74 74 VAL HG13 H 1 1.03 . . 2 . . . . . . . . 4251 1 646 . 1 1 74 74 VAL HG21 H 1 0.87 . . 2 . . . . . . . . 4251 1 647 . 1 1 74 74 VAL HG22 H 1 0.87 . . 2 . . . . . . . . 4251 1 648 . 1 1 74 74 VAL HG23 H 1 0.87 . . 2 . . . . . . . . 4251 1 649 . 1 1 74 74 VAL CG1 C 13 22.1 . . 1 . . . . . . . . 4251 1 650 . 1 1 74 74 VAL CG2 C 13 22.1 . . 1 . . . . . . . . 4251 1 651 . 1 1 75 75 SER N N 15 122.5 . . 1 . . . . . . . . 4251 1 652 . 1 1 75 75 SER H H 1 8.64 . . 1 . . . . . . . . 4251 1 653 . 1 1 75 75 SER CA C 13 57.9 . . 1 . . . . . . . . 4251 1 654 . 1 1 75 75 SER HA H 1 4.43 . . 1 . . . . . . . . 4251 1 655 . 1 1 75 75 SER CB C 13 65.1 . . 1 . . . . . . . . 4251 1 656 . 1 1 75 75 SER HB2 H 1 3.82 . . 2 . . . . . . . . 4251 1 657 . 1 1 75 75 SER HB3 H 1 4.36 . . 2 . . . . . . . . 4251 1 658 . 1 1 76 76 ARG N N 15 122.5 . . 1 . . . . . . . . 4251 1 659 . 1 1 76 76 ARG H H 1 8.92 . . 1 . . . . . . . . 4251 1 660 . 1 1 76 76 ARG CA C 13 60.5 . . 1 . . . . . . . . 4251 1 661 . 1 1 76 76 ARG HA H 1 3.45 . . 1 . . . . . . . . 4251 1 662 . 1 1 76 76 ARG CB C 13 30.1 . . 1 . . . . . . . . 4251 1 663 . 1 1 76 76 ARG HB2 H 1 1.74 . . 2 . . . . . . . . 4251 1 664 . 1 1 76 76 ARG HB3 H 1 1.57 . . 2 . . . . . . . . 4251 1 665 . 1 1 76 76 ARG CG C 13 27.3 . . 1 . . . . . . . . 4251 1 666 . 1 1 76 76 ARG HG2 H 1 1.01 . . 2 . . . . . . . . 4251 1 667 . 1 1 76 76 ARG HG3 H 1 0.52 . . 2 . . . . . . . . 4251 1 668 . 1 1 76 76 ARG CD C 13 43.3 . . 1 . . . . . . . . 4251 1 669 . 1 1 76 76 ARG HD2 H 1 2.85 . . 1 . . . . . . . . 4251 1 670 . 1 1 76 76 ARG HD3 H 1 2.85 . . 1 . . . . . . . . 4251 1 671 . 1 1 77 77 ASN N N 15 115.3 . . 1 . . . . . . . . 4251 1 672 . 1 1 77 77 ASN H H 1 8.50 . . 1 . . . . . . . . 4251 1 673 . 1 1 77 77 ASN CA C 13 56.2 . . 1 . . . . . . . . 4251 1 674 . 1 1 77 77 ASN HA H 1 4.31 . . 1 . . . . . . . . 4251 1 675 . 1 1 77 77 ASN CB C 13 38.2 . . 1 . . . . . . . . 4251 1 676 . 1 1 77 77 ASN HB2 H 1 2.67 . . 1 . . . . . . . . 4251 1 677 . 1 1 77 77 ASN HB3 H 1 2.67 . . 1 . . . . . . . . 4251 1 678 . 1 1 78 78 ALA N N 15 124.5 . . 1 . . . . . . . . 4251 1 679 . 1 1 78 78 ALA H H 1 8.15 . . 1 . . . . . . . . 4251 1 680 . 1 1 78 78 ALA CA C 13 54.9 . . 1 . . . . . . . . 4251 1 681 . 1 1 78 78 ALA HA H 1 4.19 . . 1 . . . . . . . . 4251 1 682 . 1 1 78 78 ALA HB1 H 1 1.49 . . 1 . . . . . . . . 4251 1 683 . 1 1 78 78 ALA HB2 H 1 1.49 . . 1 . . . . . . . . 4251 1 684 . 1 1 78 78 ALA HB3 H 1 1.49 . . 1 . . . . . . . . 4251 1 685 . 1 1 78 78 ALA CB C 13 18.3 . . 1 . . . . . . . . 4251 1 686 . 1 1 79 79 ALA N N 15 121.4 . . 1 . . . . . . . . 4251 1 687 . 1 1 79 79 ALA H H 1 8.62 . . 1 . . . . . . . . 4251 1 688 . 1 1 79 79 ALA CA C 13 54.9 . . 1 . . . . . . . . 4251 1 689 . 1 1 79 79 ALA HA H 1 3.90 . . 1 . . . . . . . . 4251 1 690 . 1 1 79 79 ALA HB1 H 1 1.47 . . 1 . . . . . . . . 4251 1 691 . 1 1 79 79 ALA HB2 H 1 1.47 . . 1 . . . . . . . . 4251 1 692 . 1 1 79 79 ALA HB3 H 1 1.47 . . 1 . . . . . . . . 4251 1 693 . 1 1 79 79 ALA CB C 13 18.3 . . 1 . . . . . . . . 4251 1 694 . 1 1 80 80 GLU N N 15 115.4 . . 1 . . . . . . . . 4251 1 695 . 1 1 80 80 GLU H H 1 7.96 . . 1 . . . . . . . . 4251 1 696 . 1 1 80 80 GLU CA C 13 60.3 . . 1 . . . . . . . . 4251 1 697 . 1 1 80 80 GLU HA H 1 3.79 . . 1 . . . . . . . . 4251 1 698 . 1 1 80 80 GLU CB C 13 27.9 . . 1 . . . . . . . . 4251 1 699 . 1 1 80 80 GLU HB2 H 1 2.25 . . 2 . . . . . . . . 4251 1 700 . 1 1 80 80 GLU HB3 H 1 2.11 . . 2 . . . . . . . . 4251 1 701 . 1 1 80 80 GLU CG C 13 37.4 . . 1 . . . . . . . . 4251 1 702 . 1 1 80 80 GLU HG2 H 1 2.88 . . 2 . . . . . . . . 4251 1 703 . 1 1 80 80 GLU HG3 H 1 2.08 . . 2 . . . . . . . . 4251 1 704 . 1 1 81 81 TYR N N 15 120.2 . . 1 . . . . . . . . 4251 1 705 . 1 1 81 81 TYR H H 1 7.82 . . 1 . . . . . . . . 4251 1 706 . 1 1 81 81 TYR CA C 13 61.2 . . 1 . . . . . . . . 4251 1 707 . 1 1 81 81 TYR HA H 1 4.30 . . 1 . . . . . . . . 4251 1 708 . 1 1 81 81 TYR CB C 13 37.5 . . 1 . . . . . . . . 4251 1 709 . 1 1 81 81 TYR HB2 H 1 3.23 . . 2 . . . . . . . . 4251 1 710 . 1 1 81 81 TYR HB3 H 1 3.15 . . 2 . . . . . . . . 4251 1 711 . 1 1 82 82 LEU N N 15 123.0 . . 1 . . . . . . . . 4251 1 712 . 1 1 82 82 LEU H H 1 8.56 . . 1 . . . . . . . . 4251 1 713 . 1 1 82 82 LEU CA C 13 57.8 . . 1 . . . . . . . . 4251 1 714 . 1 1 82 82 LEU HA H 1 3.89 . . 1 . . . . . . . . 4251 1 715 . 1 1 82 82 LEU CB C 13 42.1 . . 1 . . . . . . . . 4251 1 716 . 1 1 82 82 LEU HB2 H 1 1.87 . . 2 . . . . . . . . 4251 1 717 . 1 1 82 82 LEU HB3 H 1 1.32 . . 2 . . . . . . . . 4251 1 718 . 1 1 82 82 LEU CG C 13 27.3 . . 1 . . . . . . . . 4251 1 719 . 1 1 82 82 LEU HG H 1 1.86 . . 1 . . . . . . . . 4251 1 720 . 1 1 82 82 LEU HD21 H 1 0.99 . . 2 . . . . . . . . 4251 1 721 . 1 1 82 82 LEU HD22 H 1 0.99 . . 2 . . . . . . . . 4251 1 722 . 1 1 82 82 LEU HD23 H 1 0.99 . . 2 . . . . . . . . 4251 1 723 . 1 1 82 82 LEU CD2 C 13 23.6 . . 1 . . . . . . . . 4251 1 724 . 1 1 83 83 LEU N N 15 116.2 . . 1 . . . . . . . . 4251 1 725 . 1 1 83 83 LEU H H 1 7.55 . . 1 . . . . . . . . 4251 1 726 . 1 1 83 83 LEU CA C 13 54.3 . . 1 . . . . . . . . 4251 1 727 . 1 1 83 83 LEU HA H 1 4.35 . . 1 . . . . . . . . 4251 1 728 . 1 1 83 83 LEU CB C 13 42.0 . . 1 . . . . . . . . 4251 1 729 . 1 1 83 83 LEU HB2 H 1 1.66 . . 1 . . . . . . . . 4251 1 730 . 1 1 83 83 LEU HB3 H 1 1.66 . . 1 . . . . . . . . 4251 1 731 . 1 1 83 83 LEU CG C 13 27.0 . . 1 . . . . . . . . 4251 1 732 . 1 1 83 83 LEU HG H 1 1.69 . . 1 . . . . . . . . 4251 1 733 . 1 1 83 83 LEU HD11 H 1 0.66 . . 2 . . . . . . . . 4251 1 734 . 1 1 83 83 LEU HD12 H 1 0.66 . . 2 . . . . . . . . 4251 1 735 . 1 1 83 83 LEU HD13 H 1 0.66 . . 2 . . . . . . . . 4251 1 736 . 1 1 83 83 LEU HD21 H 1 0.59 . . 2 . . . . . . . . 4251 1 737 . 1 1 83 83 LEU HD22 H 1 0.59 . . 2 . . . . . . . . 4251 1 738 . 1 1 83 83 LEU HD23 H 1 0.59 . . 2 . . . . . . . . 4251 1 739 . 1 1 83 83 LEU CD1 C 13 23.5 . . 1 . . . . . . . . 4251 1 740 . 1 1 83 83 LEU CD2 C 13 27.0 . . 1 . . . . . . . . 4251 1 741 . 1 1 84 84 SER N N 15 116.5 . . 1 . . . . . . . . 4251 1 742 . 1 1 84 84 SER H H 1 7.54 . . 1 . . . . . . . . 4251 1 743 . 1 1 84 84 SER CA C 13 61.1 . . 1 . . . . . . . . 4251 1 744 . 1 1 84 84 SER HA H 1 4.19 . . 1 . . . . . . . . 4251 1 745 . 1 1 84 84 SER CB C 13 63.1 . . 1 . . . . . . . . 4251 1 746 . 1 1 84 84 SER HB2 H 1 3.99 . . 1 . . . . . . . . 4251 1 747 . 1 1 84 84 SER HB3 H 1 3.99 . . 1 . . . . . . . . 4251 1 748 . 1 1 85 85 SER CA C 13 57.1 . . 1 . . . . . . . . 4251 1 749 . 1 1 85 85 SER HA H 1 4.82 . . 1 . . . . . . . . 4251 1 750 . 1 1 85 85 SER CB C 13 64.1 . . 1 . . . . . . . . 4251 1 751 . 1 1 85 85 SER HB2 H 1 3.88 . . 2 . . . . . . . . 4251 1 752 . 1 1 85 85 SER HB3 H 1 3.82 . . 2 . . . . . . . . 4251 1 753 . 1 1 86 86 GLY N N 15 108.8 . . 1 . . . . . . . . 4251 1 754 . 1 1 86 86 GLY H H 1 7.87 . . 1 . . . . . . . . 4251 1 755 . 1 1 86 86 GLY CA C 13 44.2 . . 1 . . . . . . . . 4251 1 756 . 1 1 86 86 GLY HA2 H 1 4.33 . . 2 . . . . . . . . 4251 1 757 . 1 1 87 87 ILE N N 15 113.9 . . 1 . . . . . . . . 4251 1 758 . 1 1 87 87 ILE H H 1 8.18 . . 1 . . . . . . . . 4251 1 759 . 1 1 87 87 ILE CA C 13 60.2 . . 1 . . . . . . . . 4251 1 760 . 1 1 87 87 ILE HA H 1 4.46 . . 1 . . . . . . . . 4251 1 761 . 1 1 87 87 ILE CB C 13 40.9 . . 1 . . . . . . . . 4251 1 762 . 1 1 87 87 ILE HB H 1 1.97 . . 1 . . . . . . . . 4251 1 763 . 1 1 87 87 ILE HG21 H 1 0.85 . . 1 . . . . . . . . 4251 1 764 . 1 1 87 87 ILE HG22 H 1 0.85 . . 1 . . . . . . . . 4251 1 765 . 1 1 87 87 ILE HG23 H 1 0.85 . . 1 . . . . . . . . 4251 1 766 . 1 1 87 87 ILE CG2 C 13 17.7 . . 1 . . . . . . . . 4251 1 767 . 1 1 87 87 ILE CG1 C 13 25.0 . . 1 . . . . . . . . 4251 1 768 . 1 1 87 87 ILE HG12 H 1 1.30 . . 2 . . . . . . . . 4251 1 769 . 1 1 87 87 ILE HG13 H 1 0.90 . . 2 . . . . . . . . 4251 1 770 . 1 1 87 87 ILE HD11 H 1 0.59 . . 1 . . . . . . . . 4251 1 771 . 1 1 87 87 ILE HD12 H 1 0.59 . . 1 . . . . . . . . 4251 1 772 . 1 1 87 87 ILE HD13 H 1 0.59 . . 1 . . . . . . . . 4251 1 773 . 1 1 87 87 ILE CD1 C 13 13.7 . . 1 . . . . . . . . 4251 1 774 . 1 1 88 88 ASN N N 15 121.1 . . 1 . . . . . . . . 4251 1 775 . 1 1 88 88 ASN H H 1 8.69 . . 1 . . . . . . . . 4251 1 776 . 1 1 88 88 ASN CA C 13 54.3 . . 1 . . . . . . . . 4251 1 777 . 1 1 88 88 ASN HA H 1 4.66 . . 1 . . . . . . . . 4251 1 778 . 1 1 88 88 ASN CB C 13 37.8 . . 1 . . . . . . . . 4251 1 779 . 1 1 88 88 ASN HB2 H 1 2.36 . . 2 . . . . . . . . 4251 1 780 . 1 1 88 88 ASN HB3 H 1 2.27 . . 2 . . . . . . . . 4251 1 781 . 1 1 89 89 GLY N N 15 109.1 . . 1 . . . . . . . . 4251 1 782 . 1 1 89 89 GLY H H 1 9.33 . . 1 . . . . . . . . 4251 1 783 . 1 1 89 89 GLY CA C 13 45.9 . . 1 . . . . . . . . 4251 1 784 . 1 1 89 89 GLY HA2 H 1 3.88 . . 2 . . . . . . . . 4251 1 785 . 1 1 90 90 SER N N 15 122.1 . . 1 . . . . . . . . 4251 1 786 . 1 1 90 90 SER H H 1 8.71 . . 1 . . . . . . . . 4251 1 787 . 1 1 90 90 SER CA C 13 60.3 . . 1 . . . . . . . . 4251 1 788 . 1 1 90 90 SER HA H 1 6.07 . . 1 . . . . . . . . 4251 1 789 . 1 1 90 90 SER CB C 13 63.8 . . 1 . . . . . . . . 4251 1 790 . 1 1 90 90 SER HB2 H 1 3.98 . . 1 . . . . . . . . 4251 1 791 . 1 1 90 90 SER HB3 H 1 3.98 . . 1 . . . . . . . . 4251 1 792 . 1 1 91 91 PHE N N 15 120.5 . . 1 . . . . . . . . 4251 1 793 . 1 1 91 91 PHE H H 1 8.78 . . 1 . . . . . . . . 4251 1 794 . 1 1 91 91 PHE CA C 13 55.8 . . 1 . . . . . . . . 4251 1 795 . 1 1 91 91 PHE HA H 1 5.98 . . 1 . . . . . . . . 4251 1 796 . 1 1 91 91 PHE CB C 13 44.7 . . 1 . . . . . . . . 4251 1 797 . 1 1 91 91 PHE HB2 H 1 3.03 . . 2 . . . . . . . . 4251 1 798 . 1 1 91 91 PHE HB3 H 1 2.98 . . 2 . . . . . . . . 4251 1 799 . 1 1 92 92 LEU N N 15 114.5 . . 1 . . . . . . . . 4251 1 800 . 1 1 92 92 LEU H H 1 9.07 . . 1 . . . . . . . . 4251 1 801 . 1 1 92 92 LEU CA C 13 54.5 . . 1 . . . . . . . . 4251 1 802 . 1 1 92 92 LEU HA H 1 4.53 . . 1 . . . . . . . . 4251 1 803 . 1 1 92 92 LEU CB C 13 43.6 . . 1 . . . . . . . . 4251 1 804 . 1 1 92 92 LEU HB2 H 1 1.33 . . 2 . . . . . . . . 4251 1 805 . 1 1 92 92 LEU HB3 H 1 1.01 . . 2 . . . . . . . . 4251 1 806 . 1 1 92 92 LEU CG C 13 25.0 . . 1 . . . . . . . . 4251 1 807 . 1 1 92 92 LEU HG H 1 1.55 . . 1 . . . . . . . . 4251 1 808 . 1 1 92 92 LEU HD11 H 1 0.42 . . 2 . . . . . . . . 4251 1 809 . 1 1 92 92 LEU HD12 H 1 0.42 . . 2 . . . . . . . . 4251 1 810 . 1 1 92 92 LEU HD13 H 1 0.42 . . 2 . . . . . . . . 4251 1 811 . 1 1 92 92 LEU HD21 H 1 0.55 . . 2 . . . . . . . . 4251 1 812 . 1 1 92 92 LEU HD22 H 1 0.55 . . 2 . . . . . . . . 4251 1 813 . 1 1 92 92 LEU HD23 H 1 0.55 . . 2 . . . . . . . . 4251 1 814 . 1 1 92 92 LEU CD1 C 13 27.9 . . 1 . . . . . . . . 4251 1 815 . 1 1 92 92 LEU CD2 C 13 25.9 . . 1 . . . . . . . . 4251 1 816 . 1 1 93 93 VAL N N 15 120.9 . . 1 . . . . . . . . 4251 1 817 . 1 1 93 93 VAL H H 1 9.22 . . 1 . . . . . . . . 4251 1 818 . 1 1 93 93 VAL CA C 13 61.2 . . 1 . . . . . . . . 4251 1 819 . 1 1 93 93 VAL HA H 1 5.21 . . 1 . . . . . . . . 4251 1 820 . 1 1 93 93 VAL CB C 13 33.5 . . 1 . . . . . . . . 4251 1 821 . 1 1 93 93 VAL HB H 1 2.56 . . 1 . . . . . . . . 4251 1 822 . 1 1 93 93 VAL HG11 H 1 1.24 . . 2 . . . . . . . . 4251 1 823 . 1 1 93 93 VAL HG12 H 1 1.24 . . 2 . . . . . . . . 4251 1 824 . 1 1 93 93 VAL HG13 H 1 1.24 . . 2 . . . . . . . . 4251 1 825 . 1 1 93 93 VAL HG21 H 1 1.12 . . 2 . . . . . . . . 4251 1 826 . 1 1 93 93 VAL HG22 H 1 1.12 . . 2 . . . . . . . . 4251 1 827 . 1 1 93 93 VAL HG23 H 1 1.12 . . 2 . . . . . . . . 4251 1 828 . 1 1 93 93 VAL CG1 C 13 21.9 . . 1 . . . . . . . . 4251 1 829 . 1 1 93 93 VAL CG2 C 13 22.4 . . 1 . . . . . . . . 4251 1 830 . 1 1 94 94 ARG N N 15 122.9 . . 1 . . . . . . . . 4251 1 831 . 1 1 94 94 ARG H H 1 9.22 . . 1 . . . . . . . . 4251 1 832 . 1 1 94 94 ARG CA C 13 52.2 . . 1 . . . . . . . . 4251 1 833 . 1 1 94 94 ARG HA H 1 5.28 . . 1 . . . . . . . . 4251 1 834 . 1 1 94 94 ARG CB C 13 34.5 . . 1 . . . . . . . . 4251 1 835 . 1 1 94 94 ARG HB2 H 1 2.16 . . 2 . . . . . . . . 4251 1 836 . 1 1 94 94 ARG HG2 H 1 1.26 . . 1 . . . . . . . . 4251 1 837 . 1 1 94 94 ARG HG3 H 1 1.26 . . 1 . . . . . . . . 4251 1 838 . 1 1 94 94 ARG CD C 13 43.3 . . 1 . . . . . . . . 4251 1 839 . 1 1 94 94 ARG HD2 H 1 3.34 . . 1 . . . . . . . . 4251 1 840 . 1 1 94 94 ARG HD3 H 1 3.34 . . 1 . . . . . . . . 4251 1 841 . 1 1 95 95 GLU N N 15 120.6 . . 1 . . . . . . . . 4251 1 842 . 1 1 95 95 GLU H H 1 8.01 . . 1 . . . . . . . . 4251 1 843 . 1 1 95 95 GLU CA C 13 54.5 . . 1 . . . . . . . . 4251 1 844 . 1 1 95 95 GLU HA H 1 4.75 . . 1 . . . . . . . . 4251 1 845 . 1 1 95 95 GLU CB C 13 31.0 . . 1 . . . . . . . . 4251 1 846 . 1 1 95 95 GLU HB2 H 1 2.37 . . 2 . . . . . . . . 4251 1 847 . 1 1 95 95 GLU HB3 H 1 2.01 . . 2 . . . . . . . . 4251 1 848 . 1 1 96 96 SER N N 15 117.2 . . 1 . . . . . . . . 4251 1 849 . 1 1 96 96 SER H H 1 8.30 . . 1 . . . . . . . . 4251 1 850 . 1 1 96 96 SER CA C 13 57.9 . . 1 . . . . . . . . 4251 1 851 . 1 1 96 96 SER HA H 1 4.30 . . 1 . . . . . . . . 4251 1 852 . 1 1 96 96 SER CB C 13 63.5 . . 1 . . . . . . . . 4251 1 853 . 1 1 96 96 SER HB2 H 1 3.87 . . 2 . . . . . . . . 4251 1 854 . 1 1 96 96 SER HB3 H 1 3.95 . . 2 . . . . . . . . 4251 1 855 . 1 1 97 97 GLU N N 15 127.1 . . 1 . . . . . . . . 4251 1 856 . 1 1 97 97 GLU H H 1 9.19 . . 1 . . . . . . . . 4251 1 857 . 1 1 97 97 GLU CA C 13 57.9 . . 1 . . . . . . . . 4251 1 858 . 1 1 97 97 GLU HA H 1 4.14 . . 1 . . . . . . . . 4251 1 859 . 1 1 97 97 GLU CB C 13 30.5 . . 1 . . . . . . . . 4251 1 860 . 1 1 97 97 GLU HB2 H 1 2.01 . . 1 . . . . . . . . 4251 1 861 . 1 1 97 97 GLU HB3 H 1 2.01 . . 1 . . . . . . . . 4251 1 862 . 1 1 97 97 GLU CG C 13 36.8 . . 1 . . . . . . . . 4251 1 863 . 1 1 97 97 GLU HG2 H 1 2.26 . . 2 . . . . . . . . 4251 1 864 . 1 1 97 97 GLU HG3 H 1 2.15 . . 2 . . . . . . . . 4251 1 865 . 1 1 98 98 SER N N 15 121.1 . . 1 . . . . . . . . 4251 1 866 . 1 1 98 98 SER H H 1 9.03 . . 1 . . . . . . . . 4251 1 867 . 1 1 98 98 SER CA C 13 59.3 . . 1 . . . . . . . . 4251 1 868 . 1 1 98 98 SER HA H 1 4.22 . . 1 . . . . . . . . 4251 1 869 . 1 1 98 98 SER CB C 13 63.9 . . 1 . . . . . . . . 4251 1 870 . 1 1 98 98 SER HB2 H 1 3.88 . . 2 . . . . . . . . 4251 1 871 . 1 1 98 98 SER HB3 H 1 3.81 . . 2 . . . . . . . . 4251 1 872 . 1 1 99 99 SER N N 15 118.0 . . 1 . . . . . . . . 4251 1 873 . 1 1 99 99 SER H H 1 7.66 . . 1 . . . . . . . . 4251 1 874 . 1 1 99 99 SER CA C 13 54.7 . . 1 . . . . . . . . 4251 1 875 . 1 1 99 99 SER HA H 1 4.84 . . 1 . . . . . . . . 4251 1 876 . 1 1 99 99 SER CB C 13 63.6 . . 1 . . . . . . . . 4251 1 877 . 1 1 99 99 SER HB2 H 1 3.77 . . 2 . . . . . . . . 4251 1 878 . 1 1 99 99 SER HB3 H 1 3.57 . . 2 . . . . . . . . 4251 1 879 . 1 1 100 100 PRO CA C 13 63.8 . . 1 . . . . . . . . 4251 1 880 . 1 1 100 100 PRO HA H 1 4.32 . . 1 . . . . . . . . 4251 1 881 . 1 1 100 100 PRO CB C 13 31.7 . . 1 . . . . . . . . 4251 1 882 . 1 1 100 100 PRO HB2 H 1 2.26 . . 2 . . . . . . . . 4251 1 883 . 1 1 100 100 PRO HB3 H 1 1.84 . . 2 . . . . . . . . 4251 1 884 . 1 1 100 100 PRO CG C 13 27.5 . . 1 . . . . . . . . 4251 1 885 . 1 1 100 100 PRO HG2 H 1 2.03 . . 2 . . . . . . . . 4251 1 886 . 1 1 100 100 PRO HG3 H 1 1.94 . . 2 . . . . . . . . 4251 1 887 . 1 1 100 100 PRO HD2 H 1 3.62 . . 2 . . . . . . . . 4251 1 888 . 1 1 100 100 PRO HD3 H 1 3.53 . . 2 . . . . . . . . 4251 1 889 . 1 1 101 101 GLY N N 15 111.8 . . 1 . . . . . . . . 4251 1 890 . 1 1 101 101 GLY H H 1 9.23 . . 1 . . . . . . . . 4251 1 891 . 1 1 101 101 GLY CA C 13 45.2 . . 1 . . . . . . . . 4251 1 892 . 1 1 101 101 GLY HA2 H 1 4.04 . . 2 . . . . . . . . 4251 1 893 . 1 1 102 102 GLN N N 15 120.5 . . 1 . . . . . . . . 4251 1 894 . 1 1 102 102 GLN H H 1 8.11 . . 1 . . . . . . . . 4251 1 895 . 1 1 102 102 GLN CA C 13 54.7 . . 1 . . . . . . . . 4251 1 896 . 1 1 102 102 GLN HA H 1 4.70 . . 1 . . . . . . . . 4251 1 897 . 1 1 102 102 GLN CB C 13 29.1 . . 1 . . . . . . . . 4251 1 898 . 1 1 102 102 GLN HB2 H 1 2.25 . . 2 . . . . . . . . 4251 1 899 . 1 1 102 102 GLN HB3 H 1 2.08 . . 2 . . . . . . . . 4251 1 900 . 1 1 102 102 GLN CG C 13 34.1 . . 1 . . . . . . . . 4251 1 901 . 1 1 102 102 GLN HG2 H 1 2.35 . . 2 . . . . . . . . 4251 1 902 . 1 1 102 102 GLN HG3 H 1 2.27 . . 2 . . . . . . . . 4251 1 903 . 1 1 103 103 ARG N N 15 124.7 . . 1 . . . . . . . . 4251 1 904 . 1 1 103 103 ARG H H 1 9.15 . . 1 . . . . . . . . 4251 1 905 . 1 1 103 103 ARG CA C 13 55.3 . . 1 . . . . . . . . 4251 1 906 . 1 1 103 103 ARG HA H 1 5.40 . . 1 . . . . . . . . 4251 1 907 . 1 1 103 103 ARG CB C 13 34.3 . . 1 . . . . . . . . 4251 1 908 . 1 1 103 103 ARG HB2 H 1 1.76 . . 1 . . . . . . . . 4251 1 909 . 1 1 103 103 ARG HB3 H 1 1.76 . . 1 . . . . . . . . 4251 1 910 . 1 1 103 103 ARG CD C 13 43.8 . . 1 . . . . . . . . 4251 1 911 . 1 1 103 103 ARG HD2 H 1 3.26 . . 2 . . . . . . . . 4251 1 912 . 1 1 103 103 ARG HD3 H 1 3.09 . . 2 . . . . . . . . 4251 1 913 . 1 1 104 104 SER N N 15 114.9 . . 1 . . . . . . . . 4251 1 914 . 1 1 104 104 SER H H 1 9.09 . . 1 . . . . . . . . 4251 1 915 . 1 1 104 104 SER CA C 13 57.6 . . 1 . . . . . . . . 4251 1 916 . 1 1 104 104 SER HA H 1 5.49 . . 1 . . . . . . . . 4251 1 917 . 1 1 104 104 SER CB C 13 67.1 . . 1 . . . . . . . . 4251 1 918 . 1 1 104 104 SER HB2 H 1 3.31 . . 2 . . . . . . . . 4251 1 919 . 1 1 104 104 SER HB3 H 1 3.71 . . 2 . . . . . . . . 4251 1 920 . 1 1 105 105 ILE N N 15 122.6 . . 1 . . . . . . . . 4251 1 921 . 1 1 105 105 ILE H H 1 9.49 . . 1 . . . . . . . . 4251 1 922 . 1 1 105 105 ILE CA C 13 60.4 . . 1 . . . . . . . . 4251 1 923 . 1 1 105 105 ILE HA H 1 4.94 . . 1 . . . . . . . . 4251 1 924 . 1 1 105 105 ILE CB C 13 41.7 . . 1 . . . . . . . . 4251 1 925 . 1 1 105 105 ILE HB H 1 1.70 . . 1 . . . . . . . . 4251 1 926 . 1 1 105 105 ILE HG21 H 1 0.93 . . 1 . . . . . . . . 4251 1 927 . 1 1 105 105 ILE HG22 H 1 0.93 . . 1 . . . . . . . . 4251 1 928 . 1 1 105 105 ILE HG23 H 1 0.93 . . 1 . . . . . . . . 4251 1 929 . 1 1 105 105 ILE CG2 C 13 17.9 . . 1 . . . . . . . . 4251 1 930 . 1 1 105 105 ILE CG1 C 13 28.5 . . 1 . . . . . . . . 4251 1 931 . 1 1 105 105 ILE HG12 H 1 1.75 . . 2 . . . . . . . . 4251 1 932 . 1 1 105 105 ILE HG13 H 1 0.91 . . 2 . . . . . . . . 4251 1 933 . 1 1 105 105 ILE HD11 H 1 0.50 . . 1 . . . . . . . . 4251 1 934 . 1 1 105 105 ILE HD12 H 1 0.50 . . 1 . . . . . . . . 4251 1 935 . 1 1 105 105 ILE HD13 H 1 0.50 . . 1 . . . . . . . . 4251 1 936 . 1 1 105 105 ILE CD1 C 13 13.8 . . 1 . . . . . . . . 4251 1 937 . 1 1 106 106 SER N N 15 124.1 . . 1 . . . . . . . . 4251 1 938 . 1 1 106 106 SER H H 1 9.09 . . 1 . . . . . . . . 4251 1 939 . 1 1 106 106 SER CA C 13 58.5 . . 1 . . . . . . . . 4251 1 940 . 1 1 106 106 SER HA H 1 5.64 . . 1 . . . . . . . . 4251 1 941 . 1 1 106 106 SER CB C 13 65.4 . . 1 . . . . . . . . 4251 1 942 . 1 1 106 106 SER HB2 H 1 3.29 . . 1 . . . . . . . . 4251 1 943 . 1 1 106 106 SER HB3 H 1 3.29 . . 1 . . . . . . . . 4251 1 944 . 1 1 107 107 LEU N N 15 126.5 . . 1 . . . . . . . . 4251 1 945 . 1 1 107 107 LEU H H 1 9.35 . . 1 . . . . . . . . 4251 1 946 . 1 1 107 107 LEU CA C 13 53.7 . . 1 . . . . . . . . 4251 1 947 . 1 1 107 107 LEU HA H 1 5.40 . . 1 . . . . . . . . 4251 1 948 . 1 1 107 107 LEU CB C 13 48.2 . . 1 . . . . . . . . 4251 1 949 . 1 1 107 107 LEU HB2 H 1 1.87 . . 2 . . . . . . . . 4251 1 950 . 1 1 107 107 LEU HB3 H 1 1.37 . . 2 . . . . . . . . 4251 1 951 . 1 1 107 107 LEU HD11 H 1 0.87 . . 2 . . . . . . . . 4251 1 952 . 1 1 107 107 LEU HD12 H 1 0.87 . . 2 . . . . . . . . 4251 1 953 . 1 1 107 107 LEU HD13 H 1 0.87 . . 2 . . . . . . . . 4251 1 954 . 1 1 107 107 LEU HD21 H 1 0.76 . . 2 . . . . . . . . 4251 1 955 . 1 1 107 107 LEU HD22 H 1 0.76 . . 2 . . . . . . . . 4251 1 956 . 1 1 107 107 LEU HD23 H 1 0.76 . . 2 . . . . . . . . 4251 1 957 . 1 1 107 107 LEU CD1 C 13 24.5 . . 1 . . . . . . . . 4251 1 958 . 1 1 107 107 LEU CD2 C 13 28.2 . . 1 . . . . . . . . 4251 1 959 . 1 1 108 108 ARG N N 15 127.0 . . 1 . . . . . . . . 4251 1 960 . 1 1 108 108 ARG H H 1 9.21 . . 1 . . . . . . . . 4251 1 961 . 1 1 108 108 ARG CA C 13 54.6 . . 1 . . . . . . . . 4251 1 962 . 1 1 108 108 ARG HA H 1 5.29 . . 1 . . . . . . . . 4251 1 963 . 1 1 108 108 ARG CB C 13 33.1 . . 1 . . . . . . . . 4251 1 964 . 1 1 108 108 ARG HB2 H 1 2.19 . . 1 . . . . . . . . 4251 1 965 . 1 1 108 108 ARG HB3 H 1 2.19 . . 1 . . . . . . . . 4251 1 966 . 1 1 108 108 ARG HG2 H 1 1.46 . . 1 . . . . . . . . 4251 1 967 . 1 1 108 108 ARG HG3 H 1 1.46 . . 1 . . . . . . . . 4251 1 968 . 1 1 108 108 ARG CD C 13 43.0 . . 1 . . . . . . . . 4251 1 969 . 1 1 108 108 ARG HD2 H 1 3.11 . . 2 . . . . . . . . 4251 1 970 . 1 1 108 108 ARG HD3 H 1 2.70 . . 2 . . . . . . . . 4251 1 971 . 1 1 109 109 TYR N N 15 125.6 . . 1 . . . . . . . . 4251 1 972 . 1 1 109 109 TYR H H 1 9.48 . . 1 . . . . . . . . 4251 1 973 . 1 1 109 109 TYR CA C 13 59.3 . . 1 . . . . . . . . 4251 1 974 . 1 1 109 109 TYR HA H 1 4.66 . . 1 . . . . . . . . 4251 1 975 . 1 1 109 109 TYR CB C 13 41.3 . . 1 . . . . . . . . 4251 1 976 . 1 1 109 109 TYR HB2 H 1 2.85 . . 2 . . . . . . . . 4251 1 977 . 1 1 109 109 TYR HB3 H 1 2.74 . . 2 . . . . . . . . 4251 1 978 . 1 1 110 110 GLU N N 15 128.5 . . 1 . . . . . . . . 4251 1 979 . 1 1 110 110 GLU H H 1 9.33 . . 1 . . . . . . . . 4251 1 980 . 1 1 110 110 GLU CA C 13 56.1 . . 1 . . . . . . . . 4251 1 981 . 1 1 110 110 GLU HA H 1 3.63 . . 1 . . . . . . . . 4251 1 982 . 1 1 110 110 GLU CB C 13 27.6 . . 1 . . . . . . . . 4251 1 983 . 1 1 110 110 GLU HB2 H 1 2.01 . . 2 . . . . . . . . 4251 1 984 . 1 1 110 110 GLU HB3 H 1 1.48 . . 2 . . . . . . . . 4251 1 985 . 1 1 110 110 GLU CG C 13 35.5 . . 1 . . . . . . . . 4251 1 986 . 1 1 110 110 GLU HG2 H 1 1.67 . . 2 . . . . . . . . 4251 1 987 . 1 1 110 110 GLU HG3 H 1 0.99 . . 2 . . . . . . . . 4251 1 988 . 1 1 111 111 GLY N N 15 102.7 . . 1 . . . . . . . . 4251 1 989 . 1 1 111 111 GLY H H 1 8.40 . . 1 . . . . . . . . 4251 1 990 . 1 1 111 111 GLY CA C 13 45.5 . . 1 . . . . . . . . 4251 1 991 . 1 1 111 111 GLY HA2 H 1 3.48 . . 2 . . . . . . . . 4251 1 992 . 1 1 111 111 GLY HA3 H 1 4.10 . . 2 . . . . . . . . 4251 1 993 . 1 1 112 112 ARG N N 15 120.3 . . 1 . . . . . . . . 4251 1 994 . 1 1 112 112 ARG H H 1 7.81 . . 1 . . . . . . . . 4251 1 995 . 1 1 112 112 ARG CA C 13 54.0 . . 1 . . . . . . . . 4251 1 996 . 1 1 112 112 ARG HA H 1 4.62 . . 1 . . . . . . . . 4251 1 997 . 1 1 112 112 ARG CB C 13 33.6 . . 1 . . . . . . . . 4251 1 998 . 1 1 112 112 ARG HB2 H 1 1.76 . . 2 . . . . . . . . 4251 1 999 . 1 1 112 112 ARG HB3 H 1 1.60 . . 2 . . . . . . . . 4251 1 1000 . 1 1 112 112 ARG CG C 13 27.4 . . 1 . . . . . . . . 4251 1 1001 . 1 1 112 112 ARG HG2 H 1 1.56 . . 2 . . . . . . . . 4251 1 1002 . 1 1 112 112 ARG HG3 H 1 1.37 . . 2 . . . . . . . . 4251 1 1003 . 1 1 113 113 VAL N N 15 120.6 . . 1 . . . . . . . . 4251 1 1004 . 1 1 113 113 VAL H H 1 8.23 . . 1 . . . . . . . . 4251 1 1005 . 1 1 113 113 VAL CA C 13 61.1 . . 1 . . . . . . . . 4251 1 1006 . 1 1 113 113 VAL HA H 1 4.71 . . 1 . . . . . . . . 4251 1 1007 . 1 1 113 113 VAL CB C 13 32.5 . . 1 . . . . . . . . 4251 1 1008 . 1 1 113 113 VAL HB H 1 1.67 . . 1 . . . . . . . . 4251 1 1009 . 1 1 113 113 VAL HG11 H 1 0.79 . . 2 . . . . . . . . 4251 1 1010 . 1 1 113 113 VAL HG12 H 1 0.79 . . 2 . . . . . . . . 4251 1 1011 . 1 1 113 113 VAL HG13 H 1 0.79 . . 2 . . . . . . . . 4251 1 1012 . 1 1 113 113 VAL CG1 C 13 23.1 . . 1 . . . . . . . . 4251 1 1013 . 1 1 114 114 TYR N N 15 128.8 . . 1 . . . . . . . . 4251 1 1014 . 1 1 114 114 TYR H H 1 9.40 . . 1 . . . . . . . . 4251 1 1015 . 1 1 114 114 TYR CA C 13 56.7 . . 1 . . . . . . . . 4251 1 1016 . 1 1 114 114 TYR HA H 1 4.22 . . 1 . . . . . . . . 4251 1 1017 . 1 1 114 114 TYR CB C 13 33.0 . . 1 . . . . . . . . 4251 1 1018 . 1 1 114 114 TYR HB2 H 1 2.72 . . 1 . . . . . . . . 4251 1 1019 . 1 1 114 114 TYR HB3 H 1 2.72 . . 1 . . . . . . . . 4251 1 1020 . 1 1 115 115 HIS N N 15 120.1 . . 1 . . . . . . . . 4251 1 1021 . 1 1 115 115 HIS H H 1 8.31 . . 1 . . . . . . . . 4251 1 1022 . 1 1 115 115 HIS CA C 13 54.2 . . 1 . . . . . . . . 4251 1 1023 . 1 1 115 115 HIS HA H 1 5.63 . . 1 . . . . . . . . 4251 1 1024 . 1 1 115 115 HIS CB C 13 33.3 . . 1 . . . . . . . . 4251 1 1025 . 1 1 115 115 HIS HB2 H 1 2.75 . . 1 . . . . . . . . 4251 1 1026 . 1 1 115 115 HIS HB3 H 1 2.75 . . 1 . . . . . . . . 4251 1 1027 . 1 1 116 116 TYR N N 15 121.7 . . 1 . . . . . . . . 4251 1 1028 . 1 1 116 116 TYR H H 1 9.69 . . 1 . . . . . . . . 4251 1 1029 . 1 1 116 116 TYR CA C 13 56.5 . . 1 . . . . . . . . 4251 1 1030 . 1 1 116 116 TYR HA H 1 4.78 . . 1 . . . . . . . . 4251 1 1031 . 1 1 116 116 TYR CB C 13 41.3 . . 1 . . . . . . . . 4251 1 1032 . 1 1 116 116 TYR HB2 H 1 2.82 . . 2 . . . . . . . . 4251 1 1033 . 1 1 116 116 TYR HB3 H 1 2.56 . . 2 . . . . . . . . 4251 1 1034 . 1 1 117 117 ARG N N 15 125.2 . . 1 . . . . . . . . 4251 1 1035 . 1 1 117 117 ARG H H 1 8.75 . . 1 . . . . . . . . 4251 1 1036 . 1 1 117 117 ARG CA C 13 56.3 . . 1 . . . . . . . . 4251 1 1037 . 1 1 117 117 ARG HA H 1 4.46 . . 1 . . . . . . . . 4251 1 1038 . 1 1 117 117 ARG CB C 13 30.5 . . 1 . . . . . . . . 4251 1 1039 . 1 1 117 117 ARG HB2 H 1 1.80 . . 2 . . . . . . . . 4251 1 1040 . 1 1 117 117 ARG HB3 H 1 1.72 . . 2 . . . . . . . . 4251 1 1041 . 1 1 117 117 ARG HG2 H 1 1.58 . . 1 . . . . . . . . 4251 1 1042 . 1 1 117 117 ARG HG3 H 1 1.58 . . 1 . . . . . . . . 4251 1 1043 . 1 1 117 117 ARG CD C 13 42.8 . . 1 . . . . . . . . 4251 1 1044 . 1 1 117 117 ARG HD2 H 1 3.22 . . 1 . . . . . . . . 4251 1 1045 . 1 1 117 117 ARG HD3 H 1 3.22 . . 1 . . . . . . . . 4251 1 1046 . 1 1 118 118 ILE N N 15 123.3 . . 1 . . . . . . . . 4251 1 1047 . 1 1 118 118 ILE H H 1 8.41 . . 1 . . . . . . . . 4251 1 1048 . 1 1 118 118 ILE CA C 13 61.3 . . 1 . . . . . . . . 4251 1 1049 . 1 1 118 118 ILE HA H 1 3.93 . . 1 . . . . . . . . 4251 1 1050 . 1 1 118 118 ILE CB C 13 37.3 . . 1 . . . . . . . . 4251 1 1051 . 1 1 118 118 ILE HB H 1 1.69 . . 1 . . . . . . . . 4251 1 1052 . 1 1 118 118 ILE HG21 H 1 0.79 . . 1 . . . . . . . . 4251 1 1053 . 1 1 118 118 ILE HG22 H 1 0.79 . . 1 . . . . . . . . 4251 1 1054 . 1 1 118 118 ILE HG23 H 1 0.79 . . 1 . . . . . . . . 4251 1 1055 . 1 1 118 118 ILE CG2 C 13 18.7 . . 1 . . . . . . . . 4251 1 1056 . 1 1 118 118 ILE HG12 H 1 1.59 . . 2 . . . . . . . . 4251 1 1057 . 1 1 118 118 ILE HG13 H 1 0.66 . . 2 . . . . . . . . 4251 1 1058 . 1 1 118 118 ILE HD11 H 1 0.71 . . 1 . . . . . . . . 4251 1 1059 . 1 1 118 118 ILE HD12 H 1 0.71 . . 1 . . . . . . . . 4251 1 1060 . 1 1 118 118 ILE HD13 H 1 0.71 . . 1 . . . . . . . . 4251 1 1061 . 1 1 118 118 ILE CD1 C 13 14.3 . . 1 . . . . . . . . 4251 1 1062 . 1 1 119 119 ASN N N 15 128.3 . . 1 . . . . . . . . 4251 1 1063 . 1 1 119 119 ASN H H 1 8.72 . . 1 . . . . . . . . 4251 1 1064 . 1 1 119 119 ASN CA C 13 52.6 . . 1 . . . . . . . . 4251 1 1065 . 1 1 119 119 ASN HA H 1 4.63 . . 1 . . . . . . . . 4251 1 1066 . 1 1 119 119 ASN CB C 13 40.3 . . 1 . . . . . . . . 4251 1 1067 . 1 1 119 119 ASN HB2 H 1 2.00 . . 2 . . . . . . . . 4251 1 1068 . 1 1 119 119 ASN HB3 H 1 1.02 . . 2 . . . . . . . . 4251 1 1069 . 1 1 120 120 THR N N 15 113.8 . . 1 . . . . . . . . 4251 1 1070 . 1 1 120 120 THR H H 1 8.31 . . 1 . . . . . . . . 4251 1 1071 . 1 1 120 120 THR CA C 13 60.9 . . 1 . . . . . . . . 4251 1 1072 . 1 1 120 120 THR HA H 1 5.04 . . 1 . . . . . . . . 4251 1 1073 . 1 1 120 120 THR CB C 13 69.9 . . 1 . . . . . . . . 4251 1 1074 . 1 1 120 120 THR HB H 1 3.94 . . 1 . . . . . . . . 4251 1 1075 . 1 1 120 120 THR HG21 H 1 1.27 . . 1 . . . . . . . . 4251 1 1076 . 1 1 120 120 THR HG22 H 1 1.27 . . 1 . . . . . . . . 4251 1 1077 . 1 1 120 120 THR HG23 H 1 1.27 . . 1 . . . . . . . . 4251 1 1078 . 1 1 120 120 THR CG2 C 13 21.1 . . 1 . . . . . . . . 4251 1 1079 . 1 1 121 121 ALA N N 15 129.5 . . 1 . . . . . . . . 4251 1 1080 . 1 1 121 121 ALA H H 1 9.67 . . 1 . . . . . . . . 4251 1 1081 . 1 1 121 121 ALA CA C 13 51.0 . . 1 . . . . . . . . 4251 1 1082 . 1 1 121 121 ALA HA H 1 4.78 . . 1 . . . . . . . . 4251 1 1083 . 1 1 121 121 ALA HB1 H 1 1.70 . . 1 . . . . . . . . 4251 1 1084 . 1 1 121 121 ALA HB2 H 1 1.70 . . 1 . . . . . . . . 4251 1 1085 . 1 1 121 121 ALA HB3 H 1 1.70 . . 1 . . . . . . . . 4251 1 1086 . 1 1 121 121 ALA CB C 13 21.4 . . 1 . . . . . . . . 4251 1 1087 . 1 1 122 122 SER CA C 13 61.2 . . 1 . . . . . . . . 4251 1 1088 . 1 1 122 122 SER HA H 1 3.86 . . 1 . . . . . . . . 4251 1 1089 . 1 1 122 122 SER CB C 13 62.7 . . 1 . . . . . . . . 4251 1 1090 . 1 1 122 122 SER HB2 H 1 3.75 . . 1 . . . . . . . . 4251 1 1091 . 1 1 122 122 SER HB3 H 1 3.75 . . 1 . . . . . . . . 4251 1 1092 . 1 1 123 123 ASP N N 15 118.0 . . 1 . . . . . . . . 4251 1 1093 . 1 1 123 123 ASP H H 1 7.84 . . 1 . . . . . . . . 4251 1 1094 . 1 1 123 123 ASP CA C 13 52.6 . . 1 . . . . . . . . 4251 1 1095 . 1 1 123 123 ASP HA H 1 4.61 . . 1 . . . . . . . . 4251 1 1096 . 1 1 123 123 ASP CB C 13 39.9 . . 1 . . . . . . . . 4251 1 1097 . 1 1 123 123 ASP HB2 H 1 3.06 . . 2 . . . . . . . . 4251 1 1098 . 1 1 123 123 ASP HB3 H 1 2.53 . . 2 . . . . . . . . 4251 1 1099 . 1 1 124 124 GLY N N 15 108.0 . . 1 . . . . . . . . 4251 1 1100 . 1 1 124 124 GLY H H 1 8.16 . . 1 . . . . . . . . 4251 1 1101 . 1 1 124 124 GLY CA C 13 44.9 . . 1 . . . . . . . . 4251 1 1102 . 1 1 124 124 GLY HA2 H 1 4.31 . . 2 . . . . . . . . 4251 1 1103 . 1 1 124 124 GLY HA3 H 1 3.54 . . 2 . . . . . . . . 4251 1 1104 . 1 1 125 125 LYS N N 15 119.1 . . 1 . . . . . . . . 4251 1 1105 . 1 1 125 125 LYS H H 1 7.52 . . 1 . . . . . . . . 4251 1 1106 . 1 1 125 125 LYS CA C 13 57.6 . . 1 . . . . . . . . 4251 1 1107 . 1 1 125 125 LYS HA H 1 4.37 . . 1 . . . . . . . . 4251 1 1108 . 1 1 125 125 LYS CB C 13 33.9 . . 1 . . . . . . . . 4251 1 1109 . 1 1 125 125 LYS HB2 H 1 1.77 . . 2 . . . . . . . . 4251 1 1110 . 1 1 125 125 LYS HB3 H 1 1.59 . . 2 . . . . . . . . 4251 1 1111 . 1 1 125 125 LYS CG C 13 26.5 . . 1 . . . . . . . . 4251 1 1112 . 1 1 125 125 LYS HG2 H 1 1.42 . . 2 . . . . . . . . 4251 1 1113 . 1 1 125 125 LYS HG3 H 1 1.12 . . 2 . . . . . . . . 4251 1 1114 . 1 1 125 125 LYS CD C 13 29.4 . . 1 . . . . . . . . 4251 1 1115 . 1 1 125 125 LYS HD2 H 1 1.43 . . 2 . . . . . . . . 4251 1 1116 . 1 1 125 125 LYS HD3 H 1 1.23 . . 2 . . . . . . . . 4251 1 1117 . 1 1 125 125 LYS CE C 13 42.2 . . 1 . . . . . . . . 4251 1 1118 . 1 1 125 125 LYS HE2 H 1 2.85 . . 1 . . . . . . . . 4251 1 1119 . 1 1 125 125 LYS HE3 H 1 2.85 . . 1 . . . . . . . . 4251 1 1120 . 1 1 126 126 LEU N N 15 119.7 . . 1 . . . . . . . . 4251 1 1121 . 1 1 126 126 LEU H H 1 9.21 . . 1 . . . . . . . . 4251 1 1122 . 1 1 126 126 LEU CA C 13 53.5 . . 1 . . . . . . . . 4251 1 1123 . 1 1 126 126 LEU HA H 1 5.53 . . 1 . . . . . . . . 4251 1 1124 . 1 1 126 126 LEU CB C 13 45.8 . . 1 . . . . . . . . 4251 1 1125 . 1 1 126 126 LEU HB2 H 1 1.57 . . 2 . . . . . . . . 4251 1 1126 . 1 1 126 126 LEU HB3 H 1 1.34 . . 2 . . . . . . . . 4251 1 1127 . 1 1 126 126 LEU CG C 13 27.3 . . 1 . . . . . . . . 4251 1 1128 . 1 1 126 126 LEU HG H 1 1.81 . . 1 . . . . . . . . 4251 1 1129 . 1 1 126 126 LEU HD11 H 1 0.86 . . 2 . . . . . . . . 4251 1 1130 . 1 1 126 126 LEU HD12 H 1 0.86 . . 2 . . . . . . . . 4251 1 1131 . 1 1 126 126 LEU HD13 H 1 0.86 . . 2 . . . . . . . . 4251 1 1132 . 1 1 126 126 LEU HD21 H 1 0.82 . . 2 . . . . . . . . 4251 1 1133 . 1 1 126 126 LEU HD22 H 1 0.82 . . 2 . . . . . . . . 4251 1 1134 . 1 1 126 126 LEU HD23 H 1 0.82 . . 2 . . . . . . . . 4251 1 1135 . 1 1 126 126 LEU CD1 C 13 24.3 . . 1 . . . . . . . . 4251 1 1136 . 1 1 126 126 LEU CD2 C 13 25.8 . . 1 . . . . . . . . 4251 1 1137 . 1 1 127 127 TYR N N 15 114.5 . . 1 . . . . . . . . 4251 1 1138 . 1 1 127 127 TYR H H 1 8.72 . . 1 . . . . . . . . 4251 1 1139 . 1 1 127 127 TYR CA C 13 57.7 . . 1 . . . . . . . . 4251 1 1140 . 1 1 127 127 TYR HA H 1 5.13 . . 1 . . . . . . . . 4251 1 1141 . 1 1 127 127 TYR CB C 13 41.0 . . 1 . . . . . . . . 4251 1 1142 . 1 1 127 127 TYR HB3 H 1 3.07 . . 2 . . . . . . . . 4251 1 1143 . 1 1 128 128 VAL N N 15 121.4 . . 1 . . . . . . . . 4251 1 1144 . 1 1 128 128 VAL H H 1 10.20 . . 1 . . . . . . . . 4251 1 1145 . 1 1 128 128 VAL CA C 13 64.1 . . 1 . . . . . . . . 4251 1 1146 . 1 1 128 128 VAL HA H 1 4.29 . . 1 . . . . . . . . 4251 1 1147 . 1 1 128 128 VAL CB C 13 32.9 . . 1 . . . . . . . . 4251 1 1148 . 1 1 128 128 VAL HB H 1 1.92 . . 1 . . . . . . . . 4251 1 1149 . 1 1 128 128 VAL HG11 H 1 0.76 . . 2 . . . . . . . . 4251 1 1150 . 1 1 128 128 VAL HG12 H 1 0.76 . . 2 . . . . . . . . 4251 1 1151 . 1 1 128 128 VAL HG13 H 1 0.76 . . 2 . . . . . . . . 4251 1 1152 . 1 1 128 128 VAL HG21 H 1 0.61 . . 2 . . . . . . . . 4251 1 1153 . 1 1 128 128 VAL HG22 H 1 0.61 . . 2 . . . . . . . . 4251 1 1154 . 1 1 128 128 VAL HG23 H 1 0.61 . . 2 . . . . . . . . 4251 1 1155 . 1 1 128 128 VAL CG1 C 13 20.9 . . 1 . . . . . . . . 4251 1 1156 . 1 1 128 128 VAL CG2 C 13 21.4 . . 1 . . . . . . . . 4251 1 1157 . 1 1 129 129 SER N N 15 117.5 . . 1 . . . . . . . . 4251 1 1158 . 1 1 129 129 SER H H 1 9.22 . . 1 . . . . . . . . 4251 1 1159 . 1 1 129 129 SER CA C 13 56.8 . . 1 . . . . . . . . 4251 1 1160 . 1 1 129 129 SER HA H 1 4.89 . . 1 . . . . . . . . 4251 1 1161 . 1 1 129 129 SER CB C 13 64.1 . . 1 . . . . . . . . 4251 1 1162 . 1 1 129 129 SER HB2 H 1 4.04 . . 1 . . . . . . . . 4251 1 1163 . 1 1 129 129 SER HB3 H 1 4.04 . . 1 . . . . . . . . 4251 1 1164 . 1 1 130 130 SER CA C 13 60.6 . . 1 . . . . . . . . 4251 1 1165 . 1 1 130 130 SER CB C 13 63.4 . . 1 . . . . . . . . 4251 1 1166 . 1 1 131 131 GLU N N 15 116.7 . . 1 . . . . . . . . 4251 1 1167 . 1 1 131 131 GLU H H 1 8.44 . . 1 . . . . . . . . 4251 1 1168 . 1 1 131 131 GLU CA C 13 57.1 . . 1 . . . . . . . . 4251 1 1169 . 1 1 131 131 GLU HA H 1 4.11 . . 1 . . . . . . . . 4251 1 1170 . 1 1 131 131 GLU CB C 13 29.5 . . 1 . . . . . . . . 4251 1 1171 . 1 1 131 131 GLU HB2 H 1 2.09 . . 2 . . . . . . . . 4251 1 1172 . 1 1 131 131 GLU HB3 H 1 1.86 . . 2 . . . . . . . . 4251 1 1173 . 1 1 131 131 GLU CG C 13 36.4 . . 1 . . . . . . . . 4251 1 1174 . 1 1 131 131 GLU HG2 H 1 2.20 . . 1 . . . . . . . . 4251 1 1175 . 1 1 131 131 GLU HG3 H 1 2.20 . . 1 . . . . . . . . 4251 1 1176 . 1 1 132 132 SER N N 15 118.5 . . 1 . . . . . . . . 4251 1 1177 . 1 1 132 132 SER H H 1 7.81 . . 1 . . . . . . . . 4251 1 1178 . 1 1 132 132 SER CA C 13 56.6 . . 1 . . . . . . . . 4251 1 1179 . 1 1 132 132 SER HA H 1 4.29 . . 1 . . . . . . . . 4251 1 1180 . 1 1 132 132 SER CB C 13 63.5 . . 1 . . . . . . . . 4251 1 1181 . 1 1 132 132 SER HB2 H 1 3.77 . . 2 . . . . . . . . 4251 1 1182 . 1 1 132 132 SER HB3 H 1 3.36 . . 2 . . . . . . . . 4251 1 1183 . 1 1 133 133 ARG N N 15 120.0 . . 1 . . . . . . . . 4251 1 1184 . 1 1 133 133 ARG H H 1 7.60 . . 1 . . . . . . . . 4251 1 1185 . 1 1 133 133 ARG CA C 13 53.1 . . 1 . . . . . . . . 4251 1 1186 . 1 1 133 133 ARG HA H 1 5.06 . . 1 . . . . . . . . 4251 1 1187 . 1 1 133 133 ARG CB C 13 32.9 . . 1 . . . . . . . . 4251 1 1188 . 1 1 133 133 ARG HB2 H 1 1.43 . . 2 . . . . . . . . 4251 1 1189 . 1 1 133 133 ARG HB3 H 1 1.32 . . 2 . . . . . . . . 4251 1 1190 . 1 1 133 133 ARG CG C 13 26.5 . . 1 . . . . . . . . 4251 1 1191 . 1 1 133 133 ARG HG2 H 1 1.29 . . 2 . . . . . . . . 4251 1 1192 . 1 1 133 133 ARG HG3 H 1 0.99 . . 2 . . . . . . . . 4251 1 1193 . 1 1 133 133 ARG CD C 13 43.8 . . 1 . . . . . . . . 4251 1 1194 . 1 1 133 133 ARG HD2 H 1 2.81 . . 2 . . . . . . . . 4251 1 1195 . 1 1 133 133 ARG HD3 H 1 2.63 . . 2 . . . . . . . . 4251 1 1196 . 1 1 134 134 PHE N N 15 118.0 . . 1 . . . . . . . . 4251 1 1197 . 1 1 134 134 PHE H H 1 9.16 . . 1 . . . . . . . . 4251 1 1198 . 1 1 134 134 PHE CA C 13 57.6 . . 1 . . . . . . . . 4251 1 1199 . 1 1 134 134 PHE HA H 1 4.84 . . 1 . . . . . . . . 4251 1 1200 . 1 1 134 134 PHE CB C 13 44.7 . . 1 . . . . . . . . 4251 1 1201 . 1 1 134 134 PHE HB2 H 1 3.41 . . 2 . . . . . . . . 4251 1 1202 . 1 1 134 134 PHE HB3 H 1 2.53 . . 2 . . . . . . . . 4251 1 1203 . 1 1 135 135 ASN N N 15 118.6 . . 1 . . . . . . . . 4251 1 1204 . 1 1 135 135 ASN H H 1 9.59 . . 1 . . . . . . . . 4251 1 1205 . 1 1 135 135 ASN CA C 13 55.8 . . 1 . . . . . . . . 4251 1 1206 . 1 1 135 135 ASN HA H 1 4.69 . . 1 . . . . . . . . 4251 1 1207 . 1 1 135 135 ASN CB C 13 39.4 . . 1 . . . . . . . . 4251 1 1208 . 1 1 135 135 ASN HB2 H 1 3.20 . . 2 . . . . . . . . 4251 1 1209 . 1 1 135 135 ASN HB3 H 1 2.88 . . 2 . . . . . . . . 4251 1 1210 . 1 1 136 136 THR N N 15 104.7 . . 1 . . . . . . . . 4251 1 1211 . 1 1 136 136 THR H H 1 7.43 . . 1 . . . . . . . . 4251 1 1212 . 1 1 136 136 THR CA C 13 58.8 . . 1 . . . . . . . . 4251 1 1213 . 1 1 136 136 THR HA H 1 4.92 . . 1 . . . . . . . . 4251 1 1214 . 1 1 136 136 THR CB C 13 73.4 . . 1 . . . . . . . . 4251 1 1215 . 1 1 136 136 THR HB H 1 4.71 . . 1 . . . . . . . . 4251 1 1216 . 1 1 136 136 THR HG21 H 1 1.25 . . 1 . . . . . . . . 4251 1 1217 . 1 1 136 136 THR HG22 H 1 1.25 . . 1 . . . . . . . . 4251 1 1218 . 1 1 136 136 THR HG23 H 1 1.25 . . 1 . . . . . . . . 4251 1 1219 . 1 1 136 136 THR CG2 C 13 21.7 . . 1 . . . . . . . . 4251 1 1220 . 1 1 137 137 LEU N N 15 123.5 . . 1 . . . . . . . . 4251 1 1221 . 1 1 137 137 LEU H H 1 9.15 . . 1 . . . . . . . . 4251 1 1222 . 1 1 137 137 LEU CA C 13 57.2 . . 1 . . . . . . . . 4251 1 1223 . 1 1 137 137 LEU HA H 1 4.00 . . 1 . . . . . . . . 4251 1 1224 . 1 1 137 137 LEU CB C 13 41.9 . . 1 . . . . . . . . 4251 1 1225 . 1 1 137 137 LEU HB2 H 1 1.77 . . 1 . . . . . . . . 4251 1 1226 . 1 1 137 137 LEU HB3 H 1 1.77 . . 1 . . . . . . . . 4251 1 1227 . 1 1 137 137 LEU CG C 13 27.0 . . 1 . . . . . . . . 4251 1 1228 . 1 1 137 137 LEU HG H 1 1.83 . . 1 . . . . . . . . 4251 1 1229 . 1 1 137 137 LEU HD11 H 1 1.07 . . 2 . . . . . . . . 4251 1 1230 . 1 1 137 137 LEU HD12 H 1 1.07 . . 2 . . . . . . . . 4251 1 1231 . 1 1 137 137 LEU HD13 H 1 1.07 . . 2 . . . . . . . . 4251 1 1232 . 1 1 137 137 LEU HD21 H 1 1.02 . . 2 . . . . . . . . 4251 1 1233 . 1 1 137 137 LEU HD22 H 1 1.02 . . 2 . . . . . . . . 4251 1 1234 . 1 1 137 137 LEU HD23 H 1 1.02 . . 2 . . . . . . . . 4251 1 1235 . 1 1 137 137 LEU CD1 C 13 26.3 . . 1 . . . . . . . . 4251 1 1236 . 1 1 137 137 LEU CD2 C 13 25.0 . . 1 . . . . . . . . 4251 1 1237 . 1 1 138 138 ALA N N 15 119.9 . . 1 . . . . . . . . 4251 1 1238 . 1 1 138 138 ALA H H 1 8.93 . . 1 . . . . . . . . 4251 1 1239 . 1 1 138 138 ALA CA C 13 55.5 . . 1 . . . . . . . . 4251 1 1240 . 1 1 138 138 ALA HA H 1 3.95 . . 1 . . . . . . . . 4251 1 1241 . 1 1 138 138 ALA HB1 H 1 1.49 . . 1 . . . . . . . . 4251 1 1242 . 1 1 138 138 ALA HB2 H 1 1.49 . . 1 . . . . . . . . 4251 1 1243 . 1 1 138 138 ALA HB3 H 1 1.49 . . 1 . . . . . . . . 4251 1 1244 . 1 1 138 138 ALA CB C 13 17.7 . . 1 . . . . . . . . 4251 1 1245 . 1 1 139 139 GLU N N 15 117.4 . . 1 . . . . . . . . 4251 1 1246 . 1 1 139 139 GLU H H 1 7.63 . . 1 . . . . . . . . 4251 1 1247 . 1 1 139 139 GLU CA C 13 59.0 . . 1 . . . . . . . . 4251 1 1248 . 1 1 139 139 GLU HA H 1 3.87 . . 1 . . . . . . . . 4251 1 1249 . 1 1 139 139 GLU CB C 13 31.2 . . 1 . . . . . . . . 4251 1 1250 . 1 1 139 139 GLU HB2 H 1 2.25 . . 1 . . . . . . . . 4251 1 1251 . 1 1 139 139 GLU HB3 H 1 2.25 . . 1 . . . . . . . . 4251 1 1252 . 1 1 139 139 GLU CG C 13 37.9 . . 1 . . . . . . . . 4251 1 1253 . 1 1 139 139 GLU HG2 H 1 2.32 . . 1 . . . . . . . . 4251 1 1254 . 1 1 139 139 GLU HG3 H 1 2.32 . . 1 . . . . . . . . 4251 1 1255 . 1 1 140 140 LEU N N 15 123.4 . . 1 . . . . . . . . 4251 1 1256 . 1 1 140 140 LEU H H 1 7.26 . . 1 . . . . . . . . 4251 1 1257 . 1 1 140 140 LEU CA C 13 58.6 . . 1 . . . . . . . . 4251 1 1258 . 1 1 140 140 LEU HA H 1 2.92 . . 1 . . . . . . . . 4251 1 1259 . 1 1 140 140 LEU CB C 13 42.2 . . 1 . . . . . . . . 4251 1 1260 . 1 1 140 140 LEU HB2 H 1 2.04 . . 2 . . . . . . . . 4251 1 1261 . 1 1 140 140 LEU HB3 H 1 1.49 . . 2 . . . . . . . . 4251 1 1262 . 1 1 140 140 LEU CG C 13 27.3 . . 1 . . . . . . . . 4251 1 1263 . 1 1 140 140 LEU HG H 1 1.77 . . 1 . . . . . . . . 4251 1 1264 . 1 1 140 140 LEU HD11 H 1 1.15 . . 2 . . . . . . . . 4251 1 1265 . 1 1 140 140 LEU HD12 H 1 1.15 . . 2 . . . . . . . . 4251 1 1266 . 1 1 140 140 LEU HD13 H 1 1.15 . . 2 . . . . . . . . 4251 1 1267 . 1 1 140 140 LEU HD21 H 1 0.67 . . 2 . . . . . . . . 4251 1 1268 . 1 1 140 140 LEU HD22 H 1 0.67 . . 2 . . . . . . . . 4251 1 1269 . 1 1 140 140 LEU HD23 H 1 0.67 . . 2 . . . . . . . . 4251 1 1270 . 1 1 140 140 LEU CD1 C 13 28.2 . . 1 . . . . . . . . 4251 1 1271 . 1 1 140 140 LEU CD2 C 13 25.2 . . 1 . . . . . . . . 4251 1 1272 . 1 1 141 141 VAL N N 15 119.6 . . 1 . . . . . . . . 4251 1 1273 . 1 1 141 141 VAL H H 1 8.20 . . 1 . . . . . . . . 4251 1 1274 . 1 1 141 141 VAL CA C 13 66.3 . . 1 . . . . . . . . 4251 1 1275 . 1 1 141 141 VAL HA H 1 2.87 . . 1 . . . . . . . . 4251 1 1276 . 1 1 141 141 VAL CB C 13 31.2 . . 1 . . . . . . . . 4251 1 1277 . 1 1 141 141 VAL HB H 1 1.17 . . 1 . . . . . . . . 4251 1 1278 . 1 1 141 141 VAL HG11 H 1 -0.14 . . 2 . . . . . . . . 4251 1 1279 . 1 1 141 141 VAL HG12 H 1 -0.14 . . 2 . . . . . . . . 4251 1 1280 . 1 1 141 141 VAL HG13 H 1 -0.14 . . 2 . . . . . . . . 4251 1 1281 . 1 1 141 141 VAL HG21 H 1 -0.26 . . 2 . . . . . . . . 4251 1 1282 . 1 1 141 141 VAL HG22 H 1 -0.26 . . 2 . . . . . . . . 4251 1 1283 . 1 1 141 141 VAL HG23 H 1 -0.26 . . 2 . . . . . . . . 4251 1 1284 . 1 1 141 141 VAL CG1 C 13 19.9 . . 1 . . . . . . . . 4251 1 1285 . 1 1 141 141 VAL CG2 C 13 21.7 . . 1 . . . . . . . . 4251 1 1286 . 1 1 142 142 HIS N N 15 118.4 . . 1 . . . . . . . . 4251 1 1287 . 1 1 142 142 HIS H H 1 7.96 . . 1 . . . . . . . . 4251 1 1288 . 1 1 142 142 HIS CA C 13 59.8 . . 1 . . . . . . . . 4251 1 1289 . 1 1 142 142 HIS HA H 1 4.08 . . 1 . . . . . . . . 4251 1 1290 . 1 1 142 142 HIS CB C 13 30.0 . . 1 . . . . . . . . 4251 1 1291 . 1 1 142 142 HIS HB3 H 1 3.03 . . 2 . . . . . . . . 4251 1 1292 . 1 1 143 143 HIS N N 15 120.4 . . 1 . . . . . . . . 4251 1 1293 . 1 1 143 143 HIS H H 1 7.95 . . 1 . . . . . . . . 4251 1 1294 . 1 1 143 143 HIS CA C 13 60.3 . . 1 . . . . . . . . 4251 1 1295 . 1 1 143 143 HIS HA H 1 3.99 . . 1 . . . . . . . . 4251 1 1296 . 1 1 143 143 HIS CB C 13 31.3 . . 1 . . . . . . . . 4251 1 1297 . 1 1 143 143 HIS HB2 H 1 2.69 . . 2 . . . . . . . . 4251 1 1298 . 1 1 143 143 HIS HB3 H 1 2.59 . . 2 . . . . . . . . 4251 1 1299 . 1 1 144 144 HIS N N 15 115.6 . . 1 . . . . . . . . 4251 1 1300 . 1 1 144 144 HIS H H 1 7.76 . . 1 . . . . . . . . 4251 1 1301 . 1 1 144 144 HIS CA C 13 57.3 . . 1 . . . . . . . . 4251 1 1302 . 1 1 144 144 HIS HA H 1 4.97 . . 1 . . . . . . . . 4251 1 1303 . 1 1 144 144 HIS CB C 13 27.5 . . 1 . . . . . . . . 4251 1 1304 . 1 1 144 144 HIS HB2 H 1 3.06 . . 2 . . . . . . . . 4251 1 1305 . 1 1 144 144 HIS HB3 H 1 2.54 . . 2 . . . . . . . . 4251 1 1306 . 1 1 145 145 SER N N 15 115.5 . . 1 . . . . . . . . 4251 1 1307 . 1 1 145 145 SER H H 1 7.58 . . 1 . . . . . . . . 4251 1 1308 . 1 1 145 145 SER CA C 13 59.8 . . 1 . . . . . . . . 4251 1 1309 . 1 1 145 145 SER HA H 1 4.68 . . 1 . . . . . . . . 4251 1 1310 . 1 1 145 145 SER CB C 13 63.3 . . 1 . . . . . . . . 4251 1 1311 . 1 1 145 145 SER HB2 H 1 3.88 . . 2 . . . . . . . . 4251 1 1312 . 1 1 145 145 SER HB3 H 1 3.75 . . 2 . . . . . . . . 4251 1 1313 . 1 1 146 146 THR N N 15 113.9 . . 1 . . . . . . . . 4251 1 1314 . 1 1 146 146 THR H H 1 7.40 . . 1 . . . . . . . . 4251 1 1315 . 1 1 146 146 THR CA C 13 63.1 . . 1 . . . . . . . . 4251 1 1316 . 1 1 146 146 THR HA H 1 4.22 . . 1 . . . . . . . . 4251 1 1317 . 1 1 146 146 THR CB C 13 70.1 . . 1 . . . . . . . . 4251 1 1318 . 1 1 146 146 THR HB H 1 4.07 . . 1 . . . . . . . . 4251 1 1319 . 1 1 146 146 THR HG21 H 1 1.02 . . 1 . . . . . . . . 4251 1 1320 . 1 1 146 146 THR HG22 H 1 1.02 . . 1 . . . . . . . . 4251 1 1321 . 1 1 146 146 THR HG23 H 1 1.02 . . 1 . . . . . . . . 4251 1 1322 . 1 1 146 146 THR CG2 C 13 21.2 . . 1 . . . . . . . . 4251 1 1323 . 1 1 147 147 VAL N N 15 120.8 . . 1 . . . . . . . . 4251 1 1324 . 1 1 147 147 VAL H H 1 7.61 . . 1 . . . . . . . . 4251 1 1325 . 1 1 147 147 VAL CA C 13 59.8 . . 1 . . . . . . . . 4251 1 1326 . 1 1 147 147 VAL HA H 1 4.01 . . 1 . . . . . . . . 4251 1 1327 . 1 1 147 147 VAL CB C 13 33.8 . . 1 . . . . . . . . 4251 1 1328 . 1 1 147 147 VAL HB H 1 1.43 . . 1 . . . . . . . . 4251 1 1329 . 1 1 147 147 VAL HG11 H 1 0.60 . . 2 . . . . . . . . 4251 1 1330 . 1 1 147 147 VAL HG12 H 1 0.60 . . 2 . . . . . . . . 4251 1 1331 . 1 1 147 147 VAL HG13 H 1 0.60 . . 2 . . . . . . . . 4251 1 1332 . 1 1 147 147 VAL HG21 H 1 0.50 . . 2 . . . . . . . . 4251 1 1333 . 1 1 147 147 VAL HG22 H 1 0.50 . . 2 . . . . . . . . 4251 1 1334 . 1 1 147 147 VAL HG23 H 1 0.50 . . 2 . . . . . . . . 4251 1 1335 . 1 1 147 147 VAL CG1 C 13 21.3 . . 1 . . . . . . . . 4251 1 1336 . 1 1 147 147 VAL CG2 C 13 19.6 . . 1 . . . . . . . . 4251 1 1337 . 1 1 148 148 ALA N N 15 127.8 . . 1 . . . . . . . . 4251 1 1338 . 1 1 148 148 ALA H H 1 8.28 . . 1 . . . . . . . . 4251 1 1339 . 1 1 148 148 ALA CA C 13 56.2 . . 1 . . . . . . . . 4251 1 1340 . 1 1 148 148 ALA HA H 1 3.54 . . 1 . . . . . . . . 4251 1 1341 . 1 1 148 148 ALA HB1 H 1 1.06 . . 1 . . . . . . . . 4251 1 1342 . 1 1 148 148 ALA HB2 H 1 1.06 . . 1 . . . . . . . . 4251 1 1343 . 1 1 148 148 ALA HB3 H 1 1.06 . . 1 . . . . . . . . 4251 1 1344 . 1 1 148 148 ALA CB C 13 16.9 . . 1 . . . . . . . . 4251 1 1345 . 1 1 149 149 ASP N N 15 116.4 . . 1 . . . . . . . . 4251 1 1346 . 1 1 149 149 ASP H H 1 8.37 . . 1 . . . . . . . . 4251 1 1347 . 1 1 149 149 ASP CA C 13 54.2 . . 1 . . . . . . . . 4251 1 1348 . 1 1 149 149 ASP HA H 1 4.18 . . 1 . . . . . . . . 4251 1 1349 . 1 1 149 149 ASP CB C 13 41.2 . . 1 . . . . . . . . 4251 1 1350 . 1 1 149 149 ASP HB2 H 1 2.99 . . 2 . . . . . . . . 4251 1 1351 . 1 1 149 149 ASP HB3 H 1 2.11 . . 2 . . . . . . . . 4251 1 1352 . 1 1 150 150 GLY N N 15 105.4 . . 1 . . . . . . . . 4251 1 1353 . 1 1 150 150 GLY H H 1 8.21 . . 1 . . . . . . . . 4251 1 1354 . 1 1 150 150 GLY CA C 13 44.5 . . 1 . . . . . . . . 4251 1 1355 . 1 1 150 150 GLY HA2 H 1 4.41 . . 2 . . . . . . . . 4251 1 1356 . 1 1 150 150 GLY HA3 H 1 3.45 . . 2 . . . . . . . . 4251 1 1357 . 1 1 151 151 LEU N N 15 119.7 . . 1 . . . . . . . . 4251 1 1358 . 1 1 151 151 LEU H H 1 7.26 . . 1 . . . . . . . . 4251 1 1359 . 1 1 151 151 LEU CA C 13 53.8 . . 1 . . . . . . . . 4251 1 1360 . 1 1 151 151 LEU HA H 1 3.82 . . 1 . . . . . . . . 4251 1 1361 . 1 1 151 151 LEU CB C 13 42.5 . . 1 . . . . . . . . 4251 1 1362 . 1 1 151 151 LEU HB2 H 1 1.67 . . 2 . . . . . . . . 4251 1 1363 . 1 1 151 151 LEU HB3 H 1 0.85 . . 2 . . . . . . . . 4251 1 1364 . 1 1 151 151 LEU CG C 13 26.2 . . 1 . . . . . . . . 4251 1 1365 . 1 1 151 151 LEU HG H 1 1.03 . . 1 . . . . . . . . 4251 1 1366 . 1 1 151 151 LEU HD11 H 1 0.29 . . 2 . . . . . . . . 4251 1 1367 . 1 1 151 151 LEU HD12 H 1 0.29 . . 2 . . . . . . . . 4251 1 1368 . 1 1 151 151 LEU HD13 H 1 0.29 . . 2 . . . . . . . . 4251 1 1369 . 1 1 151 151 LEU HD21 H 1 -0.46 . . 2 . . . . . . . . 4251 1 1370 . 1 1 151 151 LEU HD22 H 1 -0.46 . . 2 . . . . . . . . 4251 1 1371 . 1 1 151 151 LEU HD23 H 1 -0.46 . . 2 . . . . . . . . 4251 1 1372 . 1 1 151 151 LEU CD1 C 13 26.2 . . 1 . . . . . . . . 4251 1 1373 . 1 1 151 151 LEU CD2 C 13 21.1 . . 1 . . . . . . . . 4251 1 1374 . 1 1 152 152 ILE N N 15 118.2 . . 1 . . . . . . . . 4251 1 1375 . 1 1 152 152 ILE H H 1 7.10 . . 1 . . . . . . . . 4251 1 1376 . 1 1 152 152 ILE CA C 13 61.8 . . 1 . . . . . . . . 4251 1 1377 . 1 1 152 152 ILE HA H 1 3.63 . . 1 . . . . . . . . 4251 1 1378 . 1 1 152 152 ILE CB C 13 38.5 . . 1 . . . . . . . . 4251 1 1379 . 1 1 152 152 ILE HB H 1 1.15 . . 1 . . . . . . . . 4251 1 1380 . 1 1 152 152 ILE HG21 H 1 0.00 . . 1 . . . . . . . . 4251 1 1381 . 1 1 152 152 ILE HG22 H 1 0.00 . . 1 . . . . . . . . 4251 1 1382 . 1 1 152 152 ILE HG23 H 1 0.00 . . 1 . . . . . . . . 4251 1 1383 . 1 1 152 152 ILE CG2 C 13 16.9 . . 1 . . . . . . . . 4251 1 1384 . 1 1 152 152 ILE CG1 C 13 29.0 . . 1 . . . . . . . . 4251 1 1385 . 1 1 152 152 ILE HG12 H 1 0.85 . . 2 . . . . . . . . 4251 1 1386 . 1 1 152 152 ILE HG13 H 1 0.41 . . 2 . . . . . . . . 4251 1 1387 . 1 1 152 152 ILE HD11 H 1 0.52 . . 1 . . . . . . . . 4251 1 1388 . 1 1 152 152 ILE HD12 H 1 0.52 . . 1 . . . . . . . . 4251 1 1389 . 1 1 152 152 ILE HD13 H 1 0.52 . . 1 . . . . . . . . 4251 1 1390 . 1 1 152 152 ILE CD1 C 13 14.5 . . 1 . . . . . . . . 4251 1 1391 . 1 1 153 153 THR N N 15 111.1 . . 1 . . . . . . . . 4251 1 1392 . 1 1 153 153 THR H H 1 6.78 . . 1 . . . . . . . . 4251 1 1393 . 1 1 153 153 THR CA C 13 58.9 . . 1 . . . . . . . . 4251 1 1394 . 1 1 153 153 THR HA H 1 3.97 . . 1 . . . . . . . . 4251 1 1395 . 1 1 153 153 THR CB C 13 68.5 . . 1 . . . . . . . . 4251 1 1396 . 1 1 153 153 THR HB H 1 3.35 . . 1 . . . . . . . . 4251 1 1397 . 1 1 153 153 THR HG21 H 1 1.04 . . 1 . . . . . . . . 4251 1 1398 . 1 1 153 153 THR HG22 H 1 1.04 . . 1 . . . . . . . . 4251 1 1399 . 1 1 153 153 THR HG23 H 1 1.04 . . 1 . . . . . . . . 4251 1 1400 . 1 1 153 153 THR CG2 C 13 18.2 . . 1 . . . . . . . . 4251 1 1401 . 1 1 154 154 THR N N 15 106.7 . . 1 . . . . . . . . 4251 1 1402 . 1 1 154 154 THR H H 1 7.28 . . 1 . . . . . . . . 4251 1 1403 . 1 1 154 154 THR CA C 13 60.2 . . 1 . . . . . . . . 4251 1 1404 . 1 1 154 154 THR HA H 1 3.98 . . 1 . . . . . . . . 4251 1 1405 . 1 1 154 154 THR CB C 13 69.6 . . 1 . . . . . . . . 4251 1 1406 . 1 1 154 154 THR HB H 1 3.74 . . 1 . . . . . . . . 4251 1 1407 . 1 1 154 154 THR HG21 H 1 0.67 . . 1 . . . . . . . . 4251 1 1408 . 1 1 154 154 THR HG22 H 1 0.67 . . 1 . . . . . . . . 4251 1 1409 . 1 1 154 154 THR HG23 H 1 0.67 . . 1 . . . . . . . . 4251 1 1410 . 1 1 154 154 THR CG2 C 13 22.5 . . 1 . . . . . . . . 4251 1 1411 . 1 1 155 155 LEU N N 15 117.9 . . 1 . . . . . . . . 4251 1 1412 . 1 1 155 155 LEU H H 1 7.59 . . 1 . . . . . . . . 4251 1 1413 . 1 1 155 155 LEU CA C 13 53.5 . . 1 . . . . . . . . 4251 1 1414 . 1 1 155 155 LEU HA H 1 3.49 . . 1 . . . . . . . . 4251 1 1415 . 1 1 155 155 LEU CB C 13 37.3 . . 1 . . . . . . . . 4251 1 1416 . 1 1 155 155 LEU HB2 H 1 0.85 . . 1 . . . . . . . . 4251 1 1417 . 1 1 155 155 LEU HB3 H 1 0.85 . . 1 . . . . . . . . 4251 1 1418 . 1 1 155 155 LEU CG C 13 25.0 . . 1 . . . . . . . . 4251 1 1419 . 1 1 155 155 LEU HG H 1 0.95 . . 1 . . . . . . . . 4251 1 1420 . 1 1 155 155 LEU HD11 H 1 0.12 . . 2 . . . . . . . . 4251 1 1421 . 1 1 155 155 LEU HD12 H 1 0.12 . . 2 . . . . . . . . 4251 1 1422 . 1 1 155 155 LEU HD13 H 1 0.12 . . 2 . . . . . . . . 4251 1 1423 . 1 1 155 155 LEU HD21 H 1 0.09 . . 2 . . . . . . . . 4251 1 1424 . 1 1 155 155 LEU HD22 H 1 0.09 . . 2 . . . . . . . . 4251 1 1425 . 1 1 155 155 LEU HD23 H 1 0.09 . . 2 . . . . . . . . 4251 1 1426 . 1 1 155 155 LEU CD1 C 13 22.6 . . 1 . . . . . . . . 4251 1 1427 . 1 1 155 155 LEU CD2 C 13 25.5 . . 1 . . . . . . . . 4251 1 1428 . 1 1 156 156 HIS N N 15 123.1 . . 1 . . . . . . . . 4251 1 1429 . 1 1 156 156 HIS H H 1 8.38 . . 1 . . . . . . . . 4251 1 1430 . 1 1 156 156 HIS CA C 13 56.9 . . 1 . . . . . . . . 4251 1 1431 . 1 1 156 156 HIS HA H 1 4.75 . . 1 . . . . . . . . 4251 1 1432 . 1 1 156 156 HIS CB C 13 33.6 . . 1 . . . . . . . . 4251 1 1433 . 1 1 156 156 HIS HB2 H 1 2.79 . . 2 . . . . . . . . 4251 1 1434 . 1 1 156 156 HIS HB3 H 1 2.65 . . 2 . . . . . . . . 4251 1 1435 . 1 1 157 157 TYR N N 15 119.3 . . 1 . . . . . . . . 4251 1 1436 . 1 1 157 157 TYR H H 1 8.02 . . 1 . . . . . . . . 4251 1 1437 . 1 1 157 157 TYR CA C 13 54.4 . . 1 . . . . . . . . 4251 1 1438 . 1 1 157 157 TYR HA H 1 5.24 . . 1 . . . . . . . . 4251 1 1439 . 1 1 157 157 TYR CB C 13 40.6 . . 1 . . . . . . . . 4251 1 1440 . 1 1 157 157 TYR HB2 H 1 3.06 . . 2 . . . . . . . . 4251 1 1441 . 1 1 157 157 TYR HB3 H 1 2.78 . . 2 . . . . . . . . 4251 1 1442 . 1 1 158 158 PRO CA C 13 61.7 . . 1 . . . . . . . . 4251 1 1443 . 1 1 158 158 PRO HA H 1 3.86 . . 1 . . . . . . . . 4251 1 1444 . 1 1 158 158 PRO CB C 13 31.5 . . 1 . . . . . . . . 4251 1 1445 . 1 1 158 158 PRO HB2 H 1 1.78 . . 1 . . . . . . . . 4251 1 1446 . 1 1 158 158 PRO HB3 H 1 1.78 . . 1 . . . . . . . . 4251 1 1447 . 1 1 158 158 PRO CG C 13 28.0 . . 1 . . . . . . . . 4251 1 1448 . 1 1 158 158 PRO HG2 H 1 2.26 . . 2 . . . . . . . . 4251 1 1449 . 1 1 158 158 PRO HG3 H 1 1.99 . . 2 . . . . . . . . 4251 1 1450 . 1 1 158 158 PRO HD2 H 1 3.69 . . 1 . . . . . . . . 4251 1 1451 . 1 1 158 158 PRO HD3 H 1 3.69 . . 1 . . . . . . . . 4251 1 1452 . 1 1 159 159 ALA N N 15 129.8 . . 1 . . . . . . . . 4251 1 1453 . 1 1 159 159 ALA H H 1 8.73 . . 1 . . . . . . . . 4251 1 1454 . 1 1 159 159 ALA CA C 13 50.1 . . 1 . . . . . . . . 4251 1 1455 . 1 1 159 159 ALA HA H 1 4.54 . . 1 . . . . . . . . 4251 1 1456 . 1 1 159 159 ALA HB1 H 1 1.13 . . 1 . . . . . . . . 4251 1 1457 . 1 1 159 159 ALA HB2 H 1 1.13 . . 1 . . . . . . . . 4251 1 1458 . 1 1 159 159 ALA HB3 H 1 1.13 . . 1 . . . . . . . . 4251 1 1459 . 1 1 159 159 ALA CB C 13 17.9 . . 1 . . . . . . . . 4251 1 1460 . 1 1 160 160 PRO CA C 13 62.9 . . 1 . . . . . . . . 4251 1 1461 . 1 1 160 160 PRO HA H 1 4.39 . . 1 . . . . . . . . 4251 1 1462 . 1 1 160 160 PRO CB C 13 32.0 . . 1 . . . . . . . . 4251 1 1463 . 1 1 160 160 PRO HB2 H 1 2.26 . . 2 . . . . . . . . 4251 1 1464 . 1 1 160 160 PRO HB3 H 1 1.84 . . 2 . . . . . . . . 4251 1 1465 . 1 1 160 160 PRO CG C 13 27.5 . . 1 . . . . . . . . 4251 1 1466 . 1 1 160 160 PRO HG2 H 1 2.10 . . 2 . . . . . . . . 4251 1 1467 . 1 1 160 160 PRO HG3 H 1 2.00 . . 2 . . . . . . . . 4251 1 1468 . 1 1 160 160 PRO HD2 H 1 3.93 . . 2 . . . . . . . . 4251 1 1469 . 1 1 160 160 PRO HD3 H 1 3.68 . . 2 . . . . . . . . 4251 1 1470 . 1 1 161 161 LYS N N 15 121.9 . . 1 . . . . . . . . 4251 1 1471 . 1 1 161 161 LYS H H 1 8.17 . . 1 . . . . . . . . 4251 1 1472 . 1 1 161 161 LYS CA C 13 56.5 . . 1 . . . . . . . . 4251 1 1473 . 1 1 161 161 LYS HA H 1 4.02 . . 1 . . . . . . . . 4251 1 1474 . 1 1 161 161 LYS CB C 13 33.1 . . 1 . . . . . . . . 4251 1 1475 . 1 1 161 161 LYS HB2 H 1 1.44 . . 2 . . . . . . . . 4251 1 1476 . 1 1 161 161 LYS HB3 H 1 1.53 . . 2 . . . . . . . . 4251 1 1477 . 1 1 161 161 LYS CG C 13 25.3 . . 1 . . . . . . . . 4251 1 1478 . 1 1 161 161 LYS HG2 H 1 1.12 . . 2 . . . . . . . . 4251 1 1479 . 1 1 161 161 LYS HG3 H 1 0.41 . . 2 . . . . . . . . 4251 1 1480 . 1 1 161 161 LYS CD C 13 29.2 . . 1 . . . . . . . . 4251 1 1481 . 1 1 161 161 LYS HD2 H 1 1.41 . . 1 . . . . . . . . 4251 1 1482 . 1 1 161 161 LYS HD3 H 1 1.41 . . 1 . . . . . . . . 4251 1 1483 . 1 1 161 161 LYS CE C 13 42.8 . . 1 . . . . . . . . 4251 1 1484 . 1 1 161 161 LYS HE2 H 1 2.77 . . 2 . . . . . . . . 4251 1 1485 . 1 1 161 161 LYS HE3 H 1 2.61 . . 2 . . . . . . . . 4251 1 1486 . 1 1 162 162 ARG N N 15 121.1 . . 1 . . . . . . . . 4251 1 1487 . 1 1 162 162 ARG H H 1 8.34 . . 1 . . . . . . . . 4251 1 1488 . 1 1 162 162 ARG CA C 13 55.7 . . 1 . . . . . . . . 4251 1 1489 . 1 1 162 162 ARG HA H 1 4.33 . . 1 . . . . . . . . 4251 1 1490 . 1 1 162 162 ARG CB C 13 31.3 . . 1 . . . . . . . . 4251 1 1491 . 1 1 162 162 ARG HB2 H 1 1.81 . . 2 . . . . . . . . 4251 1 1492 . 1 1 162 162 ARG HB3 H 1 1.65 . . 2 . . . . . . . . 4251 1 1493 . 1 1 162 162 ARG CG C 13 26.8 . . 1 . . . . . . . . 4251 1 1494 . 1 1 162 162 ARG HG2 H 1 1.53 . . 1 . . . . . . . . 4251 1 1495 . 1 1 162 162 ARG HG3 H 1 1.53 . . 1 . . . . . . . . 4251 1 1496 . 1 1 162 162 ARG CD C 13 43.1 . . 1 . . . . . . . . 4251 1 1497 . 1 1 162 162 ARG HD2 H 1 3.11 . . 1 . . . . . . . . 4251 1 1498 . 1 1 162 162 ARG HD3 H 1 3.11 . . 1 . . . . . . . . 4251 1 1499 . 1 1 163 163 GLY N N 15 109.6 . . 1 . . . . . . . . 4251 1 1500 . 1 1 163 163 GLY H H 1 8.39 . . 1 . . . . . . . . 4251 1 1501 . 1 1 163 163 GLY CA C 13 45.2 . . 1 . . . . . . . . 4251 1 1502 . 1 1 163 163 GLY HA2 H 1 4.67 . . 2 . . . . . . . . 4251 1 1503 . 1 1 164 164 ILE N N 15 119.5 . . 1 . . . . . . . . 4251 1 1504 . 1 1 164 164 ILE H H 1 7.90 . . 1 . . . . . . . . 4251 1 1505 . 1 1 164 164 ILE CA C 13 60.9 . . 1 . . . . . . . . 4251 1 1506 . 1 1 164 164 ILE HA H 1 4.12 . . 1 . . . . . . . . 4251 1 1507 . 1 1 164 164 ILE CB C 13 38.5 . . 1 . . . . . . . . 4251 1 1508 . 1 1 164 164 ILE HB H 1 1.76 . . 1 . . . . . . . . 4251 1 1509 . 1 1 164 164 ILE HG21 H 1 0.75 . . 1 . . . . . . . . 4251 1 1510 . 1 1 164 164 ILE HG22 H 1 0.75 . . 1 . . . . . . . . 4251 1 1511 . 1 1 164 164 ILE HG23 H 1 0.75 . . 1 . . . . . . . . 4251 1 1512 . 1 1 164 164 ILE CG2 C 13 17.4 . . 1 . . . . . . . . 4251 1 1513 . 1 1 164 164 ILE CG1 C 13 27.0 . . 1 . . . . . . . . 4251 1 1514 . 1 1 164 164 ILE HG12 H 1 1.28 . . 2 . . . . . . . . 4251 1 1515 . 1 1 164 164 ILE HG13 H 1 1.04 . . 2 . . . . . . . . 4251 1 1516 . 1 1 164 164 ILE HD11 H 1 0.76 . . 1 . . . . . . . . 4251 1 1517 . 1 1 164 164 ILE HD12 H 1 0.76 . . 1 . . . . . . . . 4251 1 1518 . 1 1 164 164 ILE HD13 H 1 0.76 . . 1 . . . . . . . . 4251 1 1519 . 1 1 164 164 ILE CD1 C 13 13.0 . . 1 . . . . . . . . 4251 1 1520 . 1 1 165 165 ARG CA C 13 55.5 . . 1 . . . . . . . . 4251 1 1521 . 1 1 165 165 ARG HA H 1 4.80 . . 1 . . . . . . . . 4251 1 1522 . 1 1 165 165 ARG CB C 13 31.2 . . 1 . . . . . . . . 4251 1 1523 . 1 1 165 165 ARG HB2 H 1 2.35 . . 2 . . . . . . . . 4251 1 1524 . 1 1 165 165 ARG HB3 H 1 2.19 . . 2 . . . . . . . . 4251 1 1525 . 1 1 165 165 ARG CG C 13 24.6 . . 1 . . . . . . . . 4251 1 1526 . 1 1 165 165 ARG HG2 H 1 1.92 . . 2 . . . . . . . . 4251 1 1527 . 1 1 165 165 ARG HG3 H 1 1.84 . . 2 . . . . . . . . 4251 1 1528 . 1 1 165 165 ARG HD2 H 1 3.58 . . 2 . . . . . . . . 4251 1 1529 . 1 1 165 165 ARG HD3 H 1 3.52 . . 2 . . . . . . . . 4251 1 1530 . 1 1 166 166 ASP N N 15 127.2 . . 1 . . . . . . . . 4251 1 1531 . 1 1 166 166 ASP H H 1 7.96 . . 1 . . . . . . . . 4251 1 1532 . 1 1 166 166 ASP CA C 13 55.7 . . 1 . . . . . . . . 4251 1 1533 . 1 1 166 166 ASP HA H 1 4.36 . . 1 . . . . . . . . 4251 1 1534 . 1 1 166 166 ASP CB C 13 42.2 . . 1 . . . . . . . . 4251 1 1535 . 1 1 166 166 ASP HB2 H 1 2.65 . . 2 . . . . . . . . 4251 1 1536 . 1 1 166 166 ASP HB3 H 1 2.51 . . 2 . . . . . . . . 4251 1 stop_ save_