data_4367 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4367 _Entry.Title ; Backbone assignments of a Borrelia OspA mutant containing an extended single-layer beta-sheet ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 1999-07-14 _Entry.Accession_date 1999-07-14 _Entry.Last_release_date 1999-07-14 _Entry.Original_release_date 1999-07-14 _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 ; This protein is a variant of OspA (wild-type accession number 4076) which contains a 23-residue insertion between residue 118 and 119. The insertion duplicates a beta-hairpin within the unique single-layer beta sheet of OspA. ; _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 Xiaolin Huang . . . . 4367 2 Karl Link . . . . 4367 3 Akiko Koide . . . . 4367 4 Shohei Koide . . . . 4367 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4367 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 813 4367 '15N chemical shifts' 277 4367 '1H chemical shifts' 277 4367 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 . . 2000-03-23 . original BMRB . 4367 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 4076 'wild-type assignments' 4367 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4367 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 20129263 _Citation.DOI . _Citation.PubMed_ID 10667801 _Citation.Full_citation . _Citation.Title ; Design of single-layer beta-sheets without a hydrophobic core ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Nature _Citation.Journal_name_full . _Citation.Journal_volume 403 _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 456 _Citation.Page_last 460 _Citation.Year 2000 _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 Shohei Koide . . . . 4367 1 2 Xiaolin Huang . . . . 4367 1 3 Karl Link . . . . 4367 1 4 Akiko Koide . . . . 4367 1 5 Zimei Bu . . . . 4367 1 6 Donald Engelman . M. . . 4367 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'beta-sheet protein' 4367 1 design 4367 1 'outer surface protein' 4367 1 stop_ save_ save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 4367 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; Pham, T. N. & Koide, S. (1998) NMR studies of Borrelia burgdorferi OspA, a 28 kDa protein containing a single-layer b-sheet. J. Biomol. NMR 11, 407-414. ; _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 T. Pham . . . . 4367 2 stop_ save_ save_citation_2 _Citation.Sf_category citations _Citation.Sf_framecode citation_2 _Citation.Entry_ID 4367 _Citation.ID 3 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 9461076 _Citation.Full_citation ; Pham, T.-N., Koide, A. & Koide, S. (1998) A stable single-layer b-sheet without a hydrophobic core. Nat. Struct. Biol. 5, 115-119. ; _Citation.Title ; A stable single-layer beta-sheet without a hydrophobic core. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Struct. Biol.' _Citation.Journal_name_full 'Nature structural biology' _Citation.Journal_volume 5 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1072-8368 _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 115 _Citation.Page_last 119 _Citation.Year 1998 _Citation.Details ; Outer surface protein A from the Lyme disease spirochete Borrelia burgdorferi contains a single-layer beta-sheet connecting the N- and C-terminal globular domains. The central beta-sheet consists largely of polar amino acids and is solvent-exposed on both faces, which so far appears to be unique among known protein structures. We show that the single-layer beta-sheet segment is surprisingly stable (deltaG for hydrogen exchange is approximately 8 kcal mol(-1) at 45 degrees C). Possible factors contributing to the stability of the single-layer beta-sheet are discussed based on an analysis of the crystal structure. ; 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 'T N' Pham T. N. . . 4367 3 2 A Koide A. . . . 4367 3 3 S Koide S. . . . 4367 3 stop_ save_ save_citation_3 _Citation.Sf_category citations _Citation.Sf_framecode citation_3 _Citation.Entry_ID 4367 _Citation.ID 4 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 10200164 _Citation.Full_citation ; Koide, S., Bu, Z., Risal,D., Pham, T.-N., Nakagawa, T., Tamura, A. & Engelman, D. M. (1999) Multi-step denaturation of Borrelia burgdorferi OspA, a protein containing a single-layer b-sheet. Biochemistry 38, 4757-4767 ; _Citation.Title ; Multistep denaturation of Borrelia burgdorferi OspA, a protein containing a single-layer beta-sheet. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume 38 _Citation.Journal_issue 15 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0006-2960 _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 4757 _Citation.Page_last 4767 _Citation.Year 1999 _Citation.Details ; Outer surface protein A (OspA) from the Lyme disease spirochete, Borrelia burgdorferi, is a dumbbell-shaped protein in which two globular domains are connected by a three-stranded beta-sheet segment that is solvent-exposed on both faces. Previous studies showed that the whole protein, including the single-layer beta-sheet, is highly rigid. To elucidate the folding mechanism and the role of the central beta-sheet in the formation of the rigid molecule, we investigated the equilibrium thermal denaturation reaction of OspA. We applied differential scanning calorimetry, heteronuclear NMR spectroscopy, and solution small-angle X-ray scattering (SAXS) to characterize the reaction in detail. All three techniques revealed that OspA denatures in two separable cooperative transitions. NMR measurements on OspA specifically 15N-labeled at Lys residues identified the locations of the two folding units and revealed that the C-terminal segment is less stable than the remaining N-terminal segment. The boundary between the two folding units is located within the central beta-sheet. The interconversion among the three folding states (fully folded, C-terminus unfolded, and fully denatured) is slow relative to chemical shift differences (<24 Hz), indicating that there are significant kinetic barriers in the denaturation reactions. SAXS measurements determined the radius of gyration of the native protein to be 25.0 +/- 0.3 A, which increases to 34.4 +/- 1.0 A in the first transition, and then to 56.1 +/- 1.6 A in the second transition. Thus, the intermediate state, in which the C-terminal folding unit is already denatured, is still compact. These results provide a basis for elucidating the folding mechanism of OspA. ; 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 S Koide S. . . . 4367 4 2 Z Bu Z. . . . 4367 4 3 D Risal D. . . . 4367 4 4 'T N' Pham T. N. . . 4367 4 5 T Nakagawa T. . . . 4367 4 6 A Tamura A. . . . 4367 4 7 'D M' Engelman D. M. . . 4367 4 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_abbreviation _Assembly.Sf_category assembly _Assembly.Sf_framecode system_abbreviation _Assembly.Entry_ID 4367 _Assembly.ID 1 _Assembly.Name OspA+1bh _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 30260 _Assembly.Enzyme_commission_number . _Assembly.Details ; Borrelia burgdorferi outer surface protein A mutant containing an extended single-layer beta-sheet. The monomeric state of the protein has been confirmed with solution by small angle X-ray scattering. ; _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4367 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 OspA+1bh 1 $OspA+1bh . . . native . . . . . 4367 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_OspA+1bh _Entity.Sf_category entity _Entity.Sf_framecode OspA+1bh _Entity.Entry_ID 4367 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'OspA mutant' _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 ; AKQNVSSLDEKNSVSVDLPG EMKVLVSKEKNKDGKYDLIA TVDKLELKGTSDKNNGSGVL EGVKADKSKVKLTISDDLGQ TTLEVFKEDGKTLVSKKVTS KDKSSTEEKFNEKGELSEKK ITRADKSSTEEKFNEKGEVS EKIITRADGTRLEYTGIKSD GSGKAKEVLKGYVLEGTLTA EKTTLVVKEGTVTLSKNISK SGEVSVELNDTDSSAATKKT AAWNSGTSTLTITVNSKKTK DLVFTKENTITVQQYDSNGT KLEGSAVEITKLDEIKNALK ; _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 280 _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 30260 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'OspA mutant' abbreviation 4367 1 'OspA mutant' common 4367 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 17 ALA . 4367 1 2 18 LYS . 4367 1 3 19 GLN . 4367 1 4 20 ASN . 4367 1 5 21 VAL . 4367 1 6 22 SER . 4367 1 7 23 SER . 4367 1 8 24 LEU . 4367 1 9 25 ASP . 4367 1 10 26 GLU . 4367 1 11 27 LYS . 4367 1 12 28 ASN . 4367 1 13 29 SER . 4367 1 14 30 VAL . 4367 1 15 31 SER . 4367 1 16 32 VAL . 4367 1 17 33 ASP . 4367 1 18 34 LEU . 4367 1 19 35 PRO . 4367 1 20 36 GLY . 4367 1 21 37 GLU . 4367 1 22 38 MET . 4367 1 23 39 LYS . 4367 1 24 40 VAL . 4367 1 25 41 LEU . 4367 1 26 42 VAL . 4367 1 27 43 SER . 4367 1 28 44 LYS . 4367 1 29 45 GLU . 4367 1 30 46 LYS . 4367 1 31 47 ASN . 4367 1 32 48 LYS . 4367 1 33 49 ASP . 4367 1 34 50 GLY . 4367 1 35 51 LYS . 4367 1 36 52 TYR . 4367 1 37 53 ASP . 4367 1 38 54 LEU . 4367 1 39 55 ILE . 4367 1 40 56 ALA . 4367 1 41 57 THR . 4367 1 42 58 VAL . 4367 1 43 59 ASP . 4367 1 44 60 LYS . 4367 1 45 61 LEU . 4367 1 46 62 GLU . 4367 1 47 63 LEU . 4367 1 48 64 LYS . 4367 1 49 65 GLY . 4367 1 50 66 THR . 4367 1 51 67 SER . 4367 1 52 68 ASP . 4367 1 53 69 LYS . 4367 1 54 70 ASN . 4367 1 55 71 ASN . 4367 1 56 72 GLY . 4367 1 57 73 SER . 4367 1 58 74 GLY . 4367 1 59 75 VAL . 4367 1 60 76 LEU . 4367 1 61 77 GLU . 4367 1 62 78 GLY . 4367 1 63 79 VAL . 4367 1 64 80 LYS . 4367 1 65 81 ALA . 4367 1 66 82 ASP . 4367 1 67 83 LYS . 4367 1 68 84 SER . 4367 1 69 85 LYS . 4367 1 70 86 VAL . 4367 1 71 87 LYS . 4367 1 72 88 LEU . 4367 1 73 89 THR . 4367 1 74 90 ILE . 4367 1 75 91 SER . 4367 1 76 92 ASP . 4367 1 77 93 ASP . 4367 1 78 94 LEU . 4367 1 79 95 GLY . 4367 1 80 96 GLN . 4367 1 81 97 THR . 4367 1 82 98 THR . 4367 1 83 99 LEU . 4367 1 84 100 GLU . 4367 1 85 101 VAL . 4367 1 86 102 PHE . 4367 1 87 103 LYS . 4367 1 88 104 GLU . 4367 1 89 105 ASP . 4367 1 90 106 GLY . 4367 1 91 107 LYS . 4367 1 92 108 THR . 4367 1 93 109 LEU . 4367 1 94 110 VAL . 4367 1 95 111 SER . 4367 1 96 112 LYS . 4367 1 97 113 LYS . 4367 1 98 114 VAL . 4367 1 99 115 THR . 4367 1 100 116 SER . 4367 1 101 117 LYS . 4367 1 102 118 ASP . 4367 1 103 119 LYS . 4367 1 104 120 SER . 4367 1 105 121 SER . 4367 1 106 122 THR . 4367 1 107 123 GLU . 4367 1 108 124 GLU . 4367 1 109 125 LYS . 4367 1 110 126 PHE . 4367 1 111 127 ASN . 4367 1 112 128 GLU . 4367 1 113 129 LYS . 4367 1 114 130 GLY . 4367 1 115 131 GLU . 4367 1 116 132 LEU . 4367 1 117 133 SER . 4367 1 118 134 GLU . 4367 1 119 135 LYS . 4367 1 120 136 LYS . 4367 1 121 137 ILE . 4367 1 122 138 THR . 4367 1 123 139 ARG . 4367 1 124 140 ALA . 4367 1 125 141 ASP . 4367 1 126 119 LYS . 4367 1 127 120 SER . 4367 1 128 121 SER . 4367 1 129 122 THR . 4367 1 130 123 GLU . 4367 1 131 124 GLU . 4367 1 132 125 LYS . 4367 1 133 126 PHE . 4367 1 134 127 ASN . 4367 1 135 128 GLU . 4367 1 136 129 LYS . 4367 1 137 130 GLY . 4367 1 138 131 GLU . 4367 1 139 132 VAL . 4367 1 140 133 SER . 4367 1 141 134 GLU . 4367 1 142 135 LYS . 4367 1 143 136 ILE . 4367 1 144 137 ILE . 4367 1 145 138 THR . 4367 1 146 139 ARG . 4367 1 147 140 ALA . 4367 1 148 141 ASP . 4367 1 149 142 GLY . 4367 1 150 143 THR . 4367 1 151 144 ARG . 4367 1 152 145 LEU . 4367 1 153 146 GLU . 4367 1 154 147 TYR . 4367 1 155 148 THR . 4367 1 156 149 GLY . 4367 1 157 150 ILE . 4367 1 158 151 LYS . 4367 1 159 152 SER . 4367 1 160 153 ASP . 4367 1 161 154 GLY . 4367 1 162 155 SER . 4367 1 163 156 GLY . 4367 1 164 157 LYS . 4367 1 165 158 ALA . 4367 1 166 159 LYS . 4367 1 167 160 GLU . 4367 1 168 161 VAL . 4367 1 169 162 LEU . 4367 1 170 163 LYS . 4367 1 171 164 GLY . 4367 1 172 165 TYR . 4367 1 173 166 VAL . 4367 1 174 167 LEU . 4367 1 175 168 GLU . 4367 1 176 169 GLY . 4367 1 177 170 THR . 4367 1 178 171 LEU . 4367 1 179 172 THR . 4367 1 180 173 ALA . 4367 1 181 174 GLU . 4367 1 182 175 LYS . 4367 1 183 176 THR . 4367 1 184 177 THR . 4367 1 185 178 LEU . 4367 1 186 179 VAL . 4367 1 187 180 VAL . 4367 1 188 181 LYS . 4367 1 189 182 GLU . 4367 1 190 183 GLY . 4367 1 191 184 THR . 4367 1 192 185 VAL . 4367 1 193 186 THR . 4367 1 194 187 LEU . 4367 1 195 188 SER . 4367 1 196 189 LYS . 4367 1 197 190 ASN . 4367 1 198 191 ILE . 4367 1 199 192 SER . 4367 1 200 193 LYS . 4367 1 201 194 SER . 4367 1 202 195 GLY . 4367 1 203 196 GLU . 4367 1 204 197 VAL . 4367 1 205 198 SER . 4367 1 206 199 VAL . 4367 1 207 200 GLU . 4367 1 208 201 LEU . 4367 1 209 202 ASN . 4367 1 210 203 ASP . 4367 1 211 204 THR . 4367 1 212 205 ASP . 4367 1 213 206 SER . 4367 1 214 207 SER . 4367 1 215 208 ALA . 4367 1 216 209 ALA . 4367 1 217 210 THR . 4367 1 218 211 LYS . 4367 1 219 212 LYS . 4367 1 220 213 THR . 4367 1 221 214 ALA . 4367 1 222 215 ALA . 4367 1 223 216 TRP . 4367 1 224 217 ASN . 4367 1 225 218 SER . 4367 1 226 219 GLY . 4367 1 227 220 THR . 4367 1 228 221 SER . 4367 1 229 222 THR . 4367 1 230 223 LEU . 4367 1 231 224 THR . 4367 1 232 225 ILE . 4367 1 233 226 THR . 4367 1 234 227 VAL . 4367 1 235 228 ASN . 4367 1 236 229 SER . 4367 1 237 230 LYS . 4367 1 238 231 LYS . 4367 1 239 232 THR . 4367 1 240 233 LYS . 4367 1 241 234 ASP . 4367 1 242 235 LEU . 4367 1 243 236 VAL . 4367 1 244 237 PHE . 4367 1 245 238 THR . 4367 1 246 239 LYS . 4367 1 247 240 GLU . 4367 1 248 241 ASN . 4367 1 249 242 THR . 4367 1 250 243 ILE . 4367 1 251 244 THR . 4367 1 252 245 VAL . 4367 1 253 246 GLN . 4367 1 254 247 GLN . 4367 1 255 248 TYR . 4367 1 256 249 ASP . 4367 1 257 250 SER . 4367 1 258 251 ASN . 4367 1 259 252 GLY . 4367 1 260 253 THR . 4367 1 261 254 LYS . 4367 1 262 255 LEU . 4367 1 263 256 GLU . 4367 1 264 257 GLY . 4367 1 265 258 SER . 4367 1 266 259 ALA . 4367 1 267 260 VAL . 4367 1 268 261 GLU . 4367 1 269 262 ILE . 4367 1 270 263 THR . 4367 1 271 264 LYS . 4367 1 272 265 LEU . 4367 1 273 266 ASP . 4367 1 274 267 GLU . 4367 1 275 268 ILE . 4367 1 276 269 LYS . 4367 1 277 270 ASN . 4367 1 278 271 ALA . 4367 1 279 272 LEU . 4367 1 280 273 LYS . 4367 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 . ALA 1 1 4367 1 . LYS 2 2 4367 1 . GLN 3 3 4367 1 . ASN 4 4 4367 1 . VAL 5 5 4367 1 . SER 6 6 4367 1 . SER 7 7 4367 1 . LEU 8 8 4367 1 . ASP 9 9 4367 1 . GLU 10 10 4367 1 . LYS 11 11 4367 1 . ASN 12 12 4367 1 . SER 13 13 4367 1 . VAL 14 14 4367 1 . SER 15 15 4367 1 . VAL 16 16 4367 1 . ASP 17 17 4367 1 . LEU 18 18 4367 1 . PRO 19 19 4367 1 . GLY 20 20 4367 1 . GLU 21 21 4367 1 . MET 22 22 4367 1 . LYS 23 23 4367 1 . VAL 24 24 4367 1 . LEU 25 25 4367 1 . VAL 26 26 4367 1 . SER 27 27 4367 1 . LYS 28 28 4367 1 . GLU 29 29 4367 1 . LYS 30 30 4367 1 . ASN 31 31 4367 1 . LYS 32 32 4367 1 . ASP 33 33 4367 1 . GLY 34 34 4367 1 . LYS 35 35 4367 1 . TYR 36 36 4367 1 . ASP 37 37 4367 1 . LEU 38 38 4367 1 . ILE 39 39 4367 1 . ALA 40 40 4367 1 . THR 41 41 4367 1 . VAL 42 42 4367 1 . ASP 43 43 4367 1 . LYS 44 44 4367 1 . LEU 45 45 4367 1 . GLU 46 46 4367 1 . LEU 47 47 4367 1 . LYS 48 48 4367 1 . GLY 49 49 4367 1 . THR 50 50 4367 1 . SER 51 51 4367 1 . ASP 52 52 4367 1 . LYS 53 53 4367 1 . ASN 54 54 4367 1 . ASN 55 55 4367 1 . GLY 56 56 4367 1 . SER 57 57 4367 1 . GLY 58 58 4367 1 . VAL 59 59 4367 1 . LEU 60 60 4367 1 . GLU 61 61 4367 1 . GLY 62 62 4367 1 . VAL 63 63 4367 1 . LYS 64 64 4367 1 . ALA 65 65 4367 1 . ASP 66 66 4367 1 . LYS 67 67 4367 1 . SER 68 68 4367 1 . LYS 69 69 4367 1 . VAL 70 70 4367 1 . LYS 71 71 4367 1 . LEU 72 72 4367 1 . THR 73 73 4367 1 . ILE 74 74 4367 1 . SER 75 75 4367 1 . ASP 76 76 4367 1 . ASP 77 77 4367 1 . LEU 78 78 4367 1 . GLY 79 79 4367 1 . GLN 80 80 4367 1 . THR 81 81 4367 1 . THR 82 82 4367 1 . LEU 83 83 4367 1 . GLU 84 84 4367 1 . VAL 85 85 4367 1 . PHE 86 86 4367 1 . LYS 87 87 4367 1 . GLU 88 88 4367 1 . ASP 89 89 4367 1 . GLY 90 90 4367 1 . LYS 91 91 4367 1 . THR 92 92 4367 1 . LEU 93 93 4367 1 . VAL 94 94 4367 1 . SER 95 95 4367 1 . LYS 96 96 4367 1 . LYS 97 97 4367 1 . VAL 98 98 4367 1 . THR 99 99 4367 1 . SER 100 100 4367 1 . LYS 101 101 4367 1 . ASP 102 102 4367 1 . LYS 103 103 4367 1 . SER 104 104 4367 1 . SER 105 105 4367 1 . THR 106 106 4367 1 . GLU 107 107 4367 1 . GLU 108 108 4367 1 . LYS 109 109 4367 1 . PHE 110 110 4367 1 . ASN 111 111 4367 1 . GLU 112 112 4367 1 . LYS 113 113 4367 1 . GLY 114 114 4367 1 . GLU 115 115 4367 1 . LEU 116 116 4367 1 . SER 117 117 4367 1 . GLU 118 118 4367 1 . LYS 119 119 4367 1 . LYS 120 120 4367 1 . ILE 121 121 4367 1 . THR 122 122 4367 1 . ARG 123 123 4367 1 . ALA 124 124 4367 1 . ASP 125 125 4367 1 . LYS 126 126 4367 1 . SER 127 127 4367 1 . SER 128 128 4367 1 . THR 129 129 4367 1 . GLU 130 130 4367 1 . GLU 131 131 4367 1 . LYS 132 132 4367 1 . PHE 133 133 4367 1 . ASN 134 134 4367 1 . GLU 135 135 4367 1 . LYS 136 136 4367 1 . GLY 137 137 4367 1 . GLU 138 138 4367 1 . VAL 139 139 4367 1 . SER 140 140 4367 1 . GLU 141 141 4367 1 . LYS 142 142 4367 1 . ILE 143 143 4367 1 . ILE 144 144 4367 1 . THR 145 145 4367 1 . ARG 146 146 4367 1 . ALA 147 147 4367 1 . ASP 148 148 4367 1 . GLY 149 149 4367 1 . THR 150 150 4367 1 . ARG 151 151 4367 1 . LEU 152 152 4367 1 . GLU 153 153 4367 1 . TYR 154 154 4367 1 . THR 155 155 4367 1 . GLY 156 156 4367 1 . ILE 157 157 4367 1 . LYS 158 158 4367 1 . SER 159 159 4367 1 . ASP 160 160 4367 1 . GLY 161 161 4367 1 . SER 162 162 4367 1 . GLY 163 163 4367 1 . LYS 164 164 4367 1 . ALA 165 165 4367 1 . LYS 166 166 4367 1 . GLU 167 167 4367 1 . VAL 168 168 4367 1 . LEU 169 169 4367 1 . LYS 170 170 4367 1 . GLY 171 171 4367 1 . TYR 172 172 4367 1 . VAL 173 173 4367 1 . LEU 174 174 4367 1 . GLU 175 175 4367 1 . GLY 176 176 4367 1 . THR 177 177 4367 1 . LEU 178 178 4367 1 . THR 179 179 4367 1 . ALA 180 180 4367 1 . GLU 181 181 4367 1 . LYS 182 182 4367 1 . THR 183 183 4367 1 . THR 184 184 4367 1 . LEU 185 185 4367 1 . VAL 186 186 4367 1 . VAL 187 187 4367 1 . LYS 188 188 4367 1 . GLU 189 189 4367 1 . GLY 190 190 4367 1 . THR 191 191 4367 1 . VAL 192 192 4367 1 . THR 193 193 4367 1 . LEU 194 194 4367 1 . SER 195 195 4367 1 . LYS 196 196 4367 1 . ASN 197 197 4367 1 . ILE 198 198 4367 1 . SER 199 199 4367 1 . LYS 200 200 4367 1 . SER 201 201 4367 1 . GLY 202 202 4367 1 . GLU 203 203 4367 1 . VAL 204 204 4367 1 . SER 205 205 4367 1 . VAL 206 206 4367 1 . GLU 207 207 4367 1 . LEU 208 208 4367 1 . ASN 209 209 4367 1 . ASP 210 210 4367 1 . THR 211 211 4367 1 . ASP 212 212 4367 1 . SER 213 213 4367 1 . SER 214 214 4367 1 . ALA 215 215 4367 1 . ALA 216 216 4367 1 . THR 217 217 4367 1 . LYS 218 218 4367 1 . LYS 219 219 4367 1 . THR 220 220 4367 1 . ALA 221 221 4367 1 . ALA 222 222 4367 1 . TRP 223 223 4367 1 . ASN 224 224 4367 1 . SER 225 225 4367 1 . GLY 226 226 4367 1 . THR 227 227 4367 1 . SER 228 228 4367 1 . THR 229 229 4367 1 . LEU 230 230 4367 1 . THR 231 231 4367 1 . ILE 232 232 4367 1 . THR 233 233 4367 1 . VAL 234 234 4367 1 . ASN 235 235 4367 1 . SER 236 236 4367 1 . LYS 237 237 4367 1 . LYS 238 238 4367 1 . THR 239 239 4367 1 . LYS 240 240 4367 1 . ASP 241 241 4367 1 . LEU 242 242 4367 1 . VAL 243 243 4367 1 . PHE 244 244 4367 1 . THR 245 245 4367 1 . LYS 246 246 4367 1 . GLU 247 247 4367 1 . ASN 248 248 4367 1 . THR 249 249 4367 1 . ILE 250 250 4367 1 . THR 251 251 4367 1 . VAL 252 252 4367 1 . GLN 253 253 4367 1 . GLN 254 254 4367 1 . TYR 255 255 4367 1 . ASP 256 256 4367 1 . SER 257 257 4367 1 . ASN 258 258 4367 1 . GLY 259 259 4367 1 . THR 260 260 4367 1 . LYS 261 261 4367 1 . LEU 262 262 4367 1 . GLU 263 263 4367 1 . GLY 264 264 4367 1 . SER 265 265 4367 1 . ALA 266 266 4367 1 . VAL 267 267 4367 1 . GLU 268 268 4367 1 . ILE 269 269 4367 1 . THR 270 270 4367 1 . LYS 271 271 4367 1 . LEU 272 272 4367 1 . ASP 273 273 4367 1 . GLU 274 274 4367 1 . ILE 275 275 4367 1 . LYS 276 276 4367 1 . ASN 277 277 4367 1 . ALA 278 278 4367 1 . LEU 279 279 4367 1 . LYS 280 280 4367 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 4367 _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 $OspA+1bh . 139 . . 'Borrelia burgdorferi' 'Lyme disease spirochete' . . . . Borrelia burgdorferi B31 . . . . . . . . . . . . 4367 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 4367 _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 $OspA+1bh . 'recombinant technology' . 'E. coli' . . . . BL21(DE3) . . plasmid . . pET24a . Novagen 'natural gene containing a synthetic segment' 4367 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Sample.Sf_category sample _Sample.Sf_framecode sample_one _Sample.Entry_ID 4367 _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 'OspA mutant' '[U-13C; U-15N]' . . 1 $OspA+1bh . . 1.5 . . mM . . . . 4367 1 2 'sodium phosphate' . . . . . . . 10 . . mM . . . . 4367 1 3 'sodium chloride' . . . . . . . 50 . . mM . . . . 4367 1 4 EDTA . . . . . . . 0.05 . . mM . . . . 4367 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_set_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_set_1 _Sample_condition_list.Entry_ID 4367 _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 6.0 0.1 na 4367 1 temperature 318 0.5 K 4367 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 4367 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4367 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_set_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_set_1 _Chem_shift_reference.Entry_ID 4367 _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 TSP 'methyl protons' . . . . ppm 0 external indirect 0.25144954 . . . . . 4367 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct . 'external to the sample' . . . . 4367 1 N 15 NH3 nitrogen . . . . ppm 0 external indirect 0.101329 . . . . . 4367 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_label _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_label _Assigned_chem_shift_list.Entry_ID 4367 _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_set_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_set_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_one . 4367 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 LYS CA C 13 56.6 0.5 . 1 . . . . . . . . 4367 1 2 . 1 1 2 2 LYS CB C 13 33.2 0.5 . 1 . . . . . . . . 4367 1 3 . 1 1 2 2 LYS C C 13 176.11 0.09 . 1 . . . . . . . . 4367 1 4 . 1 1 3 3 GLN N N 15 122.9 0.1 . 1 . . . . . . . . 4367 1 5 . 1 1 3 3 GLN H H 1 8.40 0.010 . 1 . . . . . . . . 4367 1 6 . 1 1 3 3 GLN CA C 13 55.8 0.5 . 1 . . . . . . . . 4367 1 7 . 1 1 3 3 GLN CB C 13 29.9 0.5 . 1 . . . . . . . . 4367 1 8 . 1 1 3 3 GLN C C 13 175.44 0.09 . 1 . . . . . . . . 4367 1 9 . 1 1 4 4 ASN N N 15 121.6 0.1 . 1 . . . . . . . . 4367 1 10 . 1 1 4 4 ASN H H 1 8.48 0.010 . 1 . . . . . . . . 4367 1 11 . 1 1 4 4 ASN CA C 13 53.4 0.5 . 1 . . . . . . . . 4367 1 12 . 1 1 4 4 ASN CB C 13 39.0 0.5 . 1 . . . . . . . . 4367 1 13 . 1 1 4 4 ASN C C 13 174.93 0.09 . 1 . . . . . . . . 4367 1 14 . 1 1 5 5 VAL N N 15 120.9 0.1 . 1 . . . . . . . . 4367 1 15 . 1 1 5 5 VAL H H 1 8.04 0.010 . 1 . . . . . . . . 4367 1 16 . 1 1 5 5 VAL CA C 13 62.3 0.5 . 1 . . . . . . . . 4367 1 17 . 1 1 5 5 VAL CB C 13 33.0 0.5 . 1 . . . . . . . . 4367 1 18 . 1 1 5 5 VAL C C 13 175.91 0.09 . 1 . . . . . . . . 4367 1 19 . 1 1 6 6 SER N N 15 120.4 0.1 . 1 . . . . . . . . 4367 1 20 . 1 1 6 6 SER H H 1 8.34 0.010 . 1 . . . . . . . . 4367 1 21 . 1 1 6 6 SER CA C 13 58.2 0.5 . 1 . . . . . . . . 4367 1 22 . 1 1 6 6 SER CB C 13 64.1 0.5 . 1 . . . . . . . . 4367 1 23 . 1 1 6 6 SER C C 13 174.42 0.09 . 1 . . . . . . . . 4367 1 24 . 1 1 7 7 SER N N 15 119.1 0.1 . 1 . . . . . . . . 4367 1 25 . 1 1 7 7 SER H H 1 8.27 0.010 . 1 . . . . . . . . 4367 1 26 . 1 1 7 7 SER CA C 13 58.6 0.5 . 1 . . . . . . . . 4367 1 27 . 1 1 7 7 SER CB C 13 63.8 0.5 . 1 . . . . . . . . 4367 1 28 . 1 1 7 7 SER C C 13 174.21 0.09 . 1 . . . . . . . . 4367 1 29 . 1 1 8 8 LEU N N 15 124.1 0.1 . 1 . . . . . . . . 4367 1 30 . 1 1 8 8 LEU H H 1 7.91 0.010 . 1 . . . . . . . . 4367 1 31 . 1 1 8 8 LEU CA C 13 54.9 0.5 . 1 . . . . . . . . 4367 1 32 . 1 1 8 8 LEU CB C 13 42.5 0.5 . 1 . . . . . . . . 4367 1 33 . 1 1 8 8 LEU C C 13 176.20 0.09 . 1 . . . . . . . . 4367 1 34 . 1 1 9 9 ASP N N 15 123.2 0.1 . 1 . . . . . . . . 4367 1 35 . 1 1 9 9 ASP H H 1 8.71 0.010 . 1 . . . . . . . . 4367 1 36 . 1 1 9 9 ASP CA C 13 53.5 0.5 . 1 . . . . . . . . 4367 1 37 . 1 1 9 9 ASP CB C 13 41.8 0.5 . 1 . . . . . . . . 4367 1 38 . 1 1 9 9 ASP C C 13 176.81 0.09 . 1 . . . . . . . . 4367 1 39 . 1 1 10 10 GLU N N 15 120.9 0.1 . 1 . . . . . . . . 4367 1 40 . 1 1 10 10 GLU H H 1 8.63 0.010 . 1 . . . . . . . . 4367 1 41 . 1 1 10 10 GLU CA C 13 58.1 0.5 . 1 . . . . . . . . 4367 1 42 . 1 1 10 10 GLU CB C 13 29.5 0.5 . 1 . . . . . . . . 4367 1 43 . 1 1 10 10 GLU C C 13 177.14 0.09 . 1 . . . . . . . . 4367 1 44 . 1 1 11 11 LYS N N 15 119.8 0.1 . 1 . . . . . . . . 4367 1 45 . 1 1 11 11 LYS H H 1 8.34 0.010 . 1 . . . . . . . . 4367 1 46 . 1 1 11 11 LYS CA C 13 57.3 0.5 . 1 . . . . . . . . 4367 1 47 . 1 1 11 11 LYS CB C 13 32.5 0.5 . 1 . . . . . . . . 4367 1 48 . 1 1 11 11 LYS C C 13 177.62 0.09 . 1 . . . . . . . . 4367 1 49 . 1 1 12 12 ASN N N 15 118.5 0.1 . 1 . . . . . . . . 4367 1 50 . 1 1 12 12 ASN H H 1 8.06 0.010 . 1 . . . . . . . . 4367 1 51 . 1 1 12 12 ASN CA C 13 52.6 0.5 . 1 . . . . . . . . 4367 1 52 . 1 1 12 12 ASN CB C 13 39.3 0.5 . 1 . . . . . . . . 4367 1 53 . 1 1 12 12 ASN C C 13 175.02 0.09 . 1 . . . . . . . . 4367 1 54 . 1 1 13 13 SER N N 15 115.3 0.1 . 1 . . . . . . . . 4367 1 55 . 1 1 13 13 SER H H 1 7.76 0.010 . 1 . . . . . . . . 4367 1 56 . 1 1 13 13 SER CA C 13 58.0 0.5 . 1 . . . . . . . . 4367 1 57 . 1 1 13 13 SER CB C 13 67.3 0.5 . 1 . . . . . . . . 4367 1 58 . 1 1 13 13 SER C C 13 172.16 0.09 . 1 . . . . . . . . 4367 1 59 . 1 1 14 14 VAL N N 15 120.9 0.1 . 1 . . . . . . . . 4367 1 60 . 1 1 14 14 VAL H H 1 9.04 0.010 . 1 . . . . . . . . 4367 1 61 . 1 1 14 14 VAL CA C 13 61.0 0.5 . 1 . . . . . . . . 4367 1 62 . 1 1 14 14 VAL CB C 13 34.5 0.5 . 1 . . . . . . . . 4367 1 63 . 1 1 14 14 VAL C C 13 174.51 0.09 . 1 . . . . . . . . 4367 1 64 . 1 1 15 15 SER N N 15 120.0 0.1 . 1 . . . . . . . . 4367 1 65 . 1 1 15 15 SER H H 1 8.23 0.010 . 1 . . . . . . . . 4367 1 66 . 1 1 15 15 SER CA C 13 57.2 0.5 . 1 . . . . . . . . 4367 1 67 . 1 1 15 15 SER CB C 13 64.3 0.5 . 1 . . . . . . . . 4367 1 68 . 1 1 15 15 SER C C 13 174.44 0.09 . 1 . . . . . . . . 4367 1 69 . 1 1 16 16 VAL N N 15 130.3 0.1 . 1 . . . . . . . . 4367 1 70 . 1 1 16 16 VAL H H 1 9.30 0.010 . 1 . . . . . . . . 4367 1 71 . 1 1 16 16 VAL CA C 13 62.3 0.5 . 1 . . . . . . . . 4367 1 72 . 1 1 16 16 VAL CB C 13 34.4 0.5 . 1 . . . . . . . . 4367 1 73 . 1 1 16 16 VAL C C 13 174.95 0.09 . 1 . . . . . . . . 4367 1 74 . 1 1 17 17 ASP N N 15 127.4 0.1 . 1 . . . . . . . . 4367 1 75 . 1 1 17 17 ASP H H 1 8.20 0.010 . 1 . . . . . . . . 4367 1 76 . 1 1 17 17 ASP CA C 13 55.2 0.5 . 1 . . . . . . . . 4367 1 77 . 1 1 17 17 ASP CB C 13 42.1 0.5 . 1 . . . . . . . . 4367 1 78 . 1 1 17 17 ASP C C 13 175.40 0.09 . 1 . . . . . . . . 4367 1 79 . 1 1 18 18 LEU N N 15 123.1 0.1 . 1 . . . . . . . . 4367 1 80 . 1 1 18 18 LEU H H 1 8.32 0.010 . 1 . . . . . . . . 4367 1 81 . 1 1 18 18 LEU CA C 13 51.8 0.5 . 1 . . . . . . . . 4367 1 82 . 1 1 18 18 LEU CB C 13 44.2 0.5 . 1 . . . . . . . . 4367 1 83 . 1 1 19 19 PRO CA C 13 63.5 0.5 . 1 . . . . . . . . 4367 1 84 . 1 1 19 19 PRO CB C 13 32.0 0.5 . 1 . . . . . . . . 4367 1 85 . 1 1 19 19 PRO C C 13 176.13 0.09 . 1 . . . . . . . . 4367 1 86 . 1 1 20 20 GLY N N 15 111.4 0.1 . 1 . . . . . . . . 4367 1 87 . 1 1 20 20 GLY H H 1 8.70 0.010 . 1 . . . . . . . . 4367 1 88 . 1 1 20 20 GLY CA C 13 45.5 0.5 . 1 . . . . . . . . 4367 1 89 . 1 1 20 20 GLY C C 13 174.34 0.09 . 1 . . . . . . . . 4367 1 90 . 1 1 21 21 GLU N N 15 115.7 0.1 . 1 . . . . . . . . 4367 1 91 . 1 1 21 21 GLU H H 1 8.30 0.010 . 1 . . . . . . . . 4367 1 92 . 1 1 21 21 GLU CA C 13 57.2 0.5 . 1 . . . . . . . . 4367 1 93 . 1 1 21 21 GLU CB C 13 26.7 0.5 . 1 . . . . . . . . 4367 1 94 . 1 1 21 21 GLU C C 13 175.29 0.09 . 1 . . . . . . . . 4367 1 95 . 1 1 22 22 MET N N 15 117.5 0.1 . 1 . . . . . . . . 4367 1 96 . 1 1 22 22 MET H H 1 6.79 0.010 . 1 . . . . . . . . 4367 1 97 . 1 1 22 22 MET CA C 13 54.3 0.5 . 1 . . . . . . . . 4367 1 98 . 1 1 22 22 MET CB C 13 36.5 0.5 . 1 . . . . . . . . 4367 1 99 . 1 1 22 22 MET C C 13 174.18 0.09 . 1 . . . . . . . . 4367 1 100 . 1 1 23 23 LYS N N 15 122.1 0.1 . 1 . . . . . . . . 4367 1 101 . 1 1 23 23 LYS H H 1 8.11 0.010 . 1 . . . . . . . . 4367 1 102 . 1 1 23 23 LYS CA C 13 55.0 0.5 . 1 . . . . . . . . 4367 1 103 . 1 1 23 23 LYS CB C 13 36.1 0.5 . 1 . . . . . . . . 4367 1 104 . 1 1 23 23 LYS C C 13 174.84 0.09 . 1 . . . . . . . . 4367 1 105 . 1 1 24 24 VAL N N 15 123.0 0.1 . 1 . . . . . . . . 4367 1 106 . 1 1 24 24 VAL H H 1 8.72 0.010 . 1 . . . . . . . . 4367 1 107 . 1 1 24 24 VAL CA C 13 59.0 0.5 . 1 . . . . . . . . 4367 1 108 . 1 1 24 24 VAL CB C 13 35.7 0.5 . 1 . . . . . . . . 4367 1 109 . 1 1 24 24 VAL C C 13 171.97 0.09 . 1 . . . . . . . . 4367 1 110 . 1 1 25 25 LEU N N 15 128.5 0.1 . 1 . . . . . . . . 4367 1 111 . 1 1 25 25 LEU H H 1 9.12 0.010 . 1 . . . . . . . . 4367 1 112 . 1 1 25 25 LEU CA C 13 53.7 0.5 . 1 . . . . . . . . 4367 1 113 . 1 1 25 25 LEU CB C 13 42.8 0.5 . 1 . . . . . . . . 4367 1 114 . 1 1 25 25 LEU C C 13 175.81 0.09 . 1 . . . . . . . . 4367 1 115 . 1 1 26 26 VAL N N 15 123.2 0.1 . 1 . . . . . . . . 4367 1 116 . 1 1 26 26 VAL H H 1 8.87 0.010 . 1 . . . . . . . . 4367 1 117 . 1 1 26 26 VAL CA C 13 59.3 0.5 . 1 . . . . . . . . 4367 1 118 . 1 1 26 26 VAL CB C 13 34.3 0.5 . 1 . . . . . . . . 4367 1 119 . 1 1 26 26 VAL C C 13 176.35 0.09 . 1 . . . . . . . . 4367 1 120 . 1 1 27 27 SER N N 15 124.3 0.1 . 1 . . . . . . . . 4367 1 121 . 1 1 27 27 SER H H 1 9.06 0.010 . 1 . . . . . . . . 4367 1 122 . 1 1 27 27 SER CA C 13 59.6 0.5 . 1 . . . . . . . . 4367 1 123 . 1 1 27 27 SER CB C 13 64.2 0.5 . 1 . . . . . . . . 4367 1 124 . 1 1 27 27 SER C C 13 173.90 0.09 . 1 . . . . . . . . 4367 1 125 . 1 1 28 28 LYS N N 15 121.4 0.1 . 1 . . . . . . . . 4367 1 126 . 1 1 28 28 LYS H H 1 8.16 0.010 . 1 . . . . . . . . 4367 1 127 . 1 1 28 28 LYS CA C 13 59.0 0.5 . 1 . . . . . . . . 4367 1 128 . 1 1 28 28 LYS CB C 13 33.7 0.5 . 1 . . . . . . . . 4367 1 129 . 1 1 28 28 LYS C C 13 177.33 0.09 . 1 . . . . . . . . 4367 1 130 . 1 1 29 29 GLU N N 15 116.3 0.1 . 1 . . . . . . . . 4367 1 131 . 1 1 29 29 GLU H H 1 8.10 0.010 . 1 . . . . . . . . 4367 1 132 . 1 1 29 29 GLU CA C 13 53.8 0.5 . 1 . . . . . . . . 4367 1 133 . 1 1 29 29 GLU CB C 13 32.6 0.5 . 1 . . . . . . . . 4367 1 134 . 1 1 29 29 GLU C C 13 176.59 0.09 . 1 . . . . . . . . 4367 1 135 . 1 1 30 30 LYS N N 15 124.0 0.1 . 1 . . . . . . . . 4367 1 136 . 1 1 30 30 LYS H H 1 8.47 0.010 . 1 . . . . . . . . 4367 1 137 . 1 1 30 30 LYS CA C 13 56.4 0.5 . 1 . . . . . . . . 4367 1 138 . 1 1 30 30 LYS CB C 13 34.2 0.5 . 1 . . . . . . . . 4367 1 139 . 1 1 30 30 LYS C C 13 176.66 0.09 . 1 . . . . . . . . 4367 1 140 . 1 1 31 31 ASN N N 15 121.0 0.1 . 1 . . . . . . . . 4367 1 141 . 1 1 31 31 ASN H H 1 9.17 0.010 . 1 . . . . . . . . 4367 1 142 . 1 1 31 31 ASN CA C 13 51.1 0.5 . 1 . . . . . . . . 4367 1 143 . 1 1 31 31 ASN CB C 13 38.9 0.5 . 1 . . . . . . . . 4367 1 144 . 1 1 31 31 ASN C C 13 178.03 0.09 . 1 . . . . . . . . 4367 1 145 . 1 1 32 32 LYS N N 15 118.8 0.1 . 1 . . . . . . . . 4367 1 146 . 1 1 32 32 LYS H H 1 8.32 0.010 . 1 . . . . . . . . 4367 1 147 . 1 1 32 32 LYS CA C 13 58.8 0.5 . 1 . . . . . . . . 4367 1 148 . 1 1 32 32 LYS CB C 13 31.9 0.5 . 1 . . . . . . . . 4367 1 149 . 1 1 32 32 LYS C C 13 176.88 0.09 . 1 . . . . . . . . 4367 1 150 . 1 1 33 33 ASP N N 15 119.4 0.1 . 1 . . . . . . . . 4367 1 151 . 1 1 33 33 ASP H H 1 7.94 0.010 . 1 . . . . . . . . 4367 1 152 . 1 1 33 33 ASP CA C 13 54.2 0.5 . 1 . . . . . . . . 4367 1 153 . 1 1 33 33 ASP CB C 13 41.7 0.5 . 1 . . . . . . . . 4367 1 154 . 1 1 33 33 ASP C C 13 176.28 0.09 . 1 . . . . . . . . 4367 1 155 . 1 1 34 34 GLY N N 15 108.7 0.1 . 1 . . . . . . . . 4367 1 156 . 1 1 34 34 GLY H H 1 8.23 0.010 . 1 . . . . . . . . 4367 1 157 . 1 1 34 34 GLY CA C 13 45.8 0.5 . 1 . . . . . . . . 4367 1 158 . 1 1 34 34 GLY C C 13 173.22 0.09 . 1 . . . . . . . . 4367 1 159 . 1 1 35 35 LYS N N 15 119.5 0.1 . 1 . . . . . . . . 4367 1 160 . 1 1 35 35 LYS H H 1 7.33 0.010 . 1 . . . . . . . . 4367 1 161 . 1 1 35 35 LYS CA C 13 53.8 0.5 . 1 . . . . . . . . 4367 1 162 . 1 1 35 35 LYS CB C 13 35.9 0.5 . 1 . . . . . . . . 4367 1 163 . 1 1 35 35 LYS C C 13 173.82 0.09 . 1 . . . . . . . . 4367 1 164 . 1 1 36 36 TYR N N 15 119.7 0.1 . 1 . . . . . . . . 4367 1 165 . 1 1 36 36 TYR H H 1 9.13 0.010 . 1 . . . . . . . . 4367 1 166 . 1 1 36 36 TYR CA C 13 59.1 0.5 . 1 . . . . . . . . 4367 1 167 . 1 1 36 36 TYR CB C 13 38.6 0.5 . 1 . . . . . . . . 4367 1 168 . 1 1 36 36 TYR C C 13 175.71 0.09 . 1 . . . . . . . . 4367 1 169 . 1 1 37 37 ASP N N 15 123.2 0.1 . 1 . . . . . . . . 4367 1 170 . 1 1 37 37 ASP H H 1 8.48 0.010 . 1 . . . . . . . . 4367 1 171 . 1 1 37 37 ASP CA C 13 55.2 0.5 . 1 . . . . . . . . 4367 1 172 . 1 1 37 37 ASP CB C 13 43.9 0.5 . 1 . . . . . . . . 4367 1 173 . 1 1 37 37 ASP C C 13 174.54 0.09 . 1 . . . . . . . . 4367 1 174 . 1 1 38 38 LEU N N 15 121.3 0.1 . 1 . . . . . . . . 4367 1 175 . 1 1 38 38 LEU H H 1 8.40 0.010 . 1 . . . . . . . . 4367 1 176 . 1 1 38 38 LEU CA C 13 53.8 0.5 . 1 . . . . . . . . 4367 1 177 . 1 1 38 38 LEU CB C 13 46.4 0.5 . 1 . . . . . . . . 4367 1 178 . 1 1 38 38 LEU C C 13 177.26 0.09 . 1 . . . . . . . . 4367 1 179 . 1 1 39 39 ILE N N 15 121.9 0.1 . 1 . . . . . . . . 4367 1 180 . 1 1 39 39 ILE H H 1 8.69 0.010 . 1 . . . . . . . . 4367 1 181 . 1 1 39 39 ILE CA C 13 60.2 0.5 . 1 . . . . . . . . 4367 1 182 . 1 1 39 39 ILE CB C 13 42.6 0.5 . 1 . . . . . . . . 4367 1 183 . 1 1 39 39 ILE C C 13 173.66 0.09 . 1 . . . . . . . . 4367 1 184 . 1 1 40 40 ALA N N 15 127.2 0.1 . 1 . . . . . . . . 4367 1 185 . 1 1 40 40 ALA H H 1 8.56 0.010 . 1 . . . . . . . . 4367 1 186 . 1 1 40 40 ALA CA C 13 51.2 0.5 . 1 . . . . . . . . 4367 1 187 . 1 1 40 40 ALA CB C 13 23.6 0.5 . 1 . . . . . . . . 4367 1 188 . 1 1 40 40 ALA C C 13 175.52 0.09 . 1 . . . . . . . . 4367 1 189 . 1 1 41 41 THR N N 15 118.0 0.1 . 1 . . . . . . . . 4367 1 190 . 1 1 41 41 THR H H 1 8.80 0.010 . 1 . . . . . . . . 4367 1 191 . 1 1 41 41 THR CA C 13 61.3 0.5 . 1 . . . . . . . . 4367 1 192 . 1 1 41 41 THR CB C 13 69.9 0.5 . 1 . . . . . . . . 4367 1 193 . 1 1 41 41 THR C C 13 174.44 0.09 . 1 . . . . . . . . 4367 1 194 . 1 1 42 42 VAL N N 15 127.7 0.1 . 1 . . . . . . . . 4367 1 195 . 1 1 42 42 VAL H H 1 8.65 0.010 . 1 . . . . . . . . 4367 1 196 . 1 1 42 42 VAL CA C 13 61.0 0.5 . 1 . . . . . . . . 4367 1 197 . 1 1 42 42 VAL CB C 13 34.4 0.5 . 1 . . . . . . . . 4367 1 198 . 1 1 42 42 VAL C C 13 175.24 0.09 . 1 . . . . . . . . 4367 1 199 . 1 1 43 43 ASP N N 15 129.8 0.1 . 1 . . . . . . . . 4367 1 200 . 1 1 43 43 ASP H H 1 9.16 0.010 . 1 . . . . . . . . 4367 1 201 . 1 1 43 43 ASP CA C 13 55.9 0.5 . 1 . . . . . . . . 4367 1 202 . 1 1 43 43 ASP CB C 13 39.4 0.5 . 1 . . . . . . . . 4367 1 203 . 1 1 43 43 ASP C C 13 175.05 0.09 . 1 . . . . . . . . 4367 1 204 . 1 1 44 44 LYS N N 15 111.4 0.1 . 1 . . . . . . . . 4367 1 205 . 1 1 44 44 LYS H H 1 8.27 0.010 . 1 . . . . . . . . 4367 1 206 . 1 1 44 44 LYS CA C 13 57.8 0.5 . 1 . . . . . . . . 4367 1 207 . 1 1 44 44 LYS CB C 13 30.6 0.5 . 1 . . . . . . . . 4367 1 208 . 1 1 44 44 LYS C C 13 174.91 0.09 . 1 . . . . . . . . 4367 1 209 . 1 1 45 45 LEU N N 15 125.1 0.1 . 1 . . . . . . . . 4367 1 210 . 1 1 45 45 LEU H H 1 8.08 0.010 . 1 . . . . . . . . 4367 1 211 . 1 1 45 45 LEU CA C 13 54.0 0.5 . 1 . . . . . . . . 4367 1 212 . 1 1 45 45 LEU CB C 13 44.2 0.5 . 1 . . . . . . . . 4367 1 213 . 1 1 45 45 LEU C C 13 174.86 0.09 . 1 . . . . . . . . 4367 1 214 . 1 1 46 46 GLU N N 15 126.6 0.1 . 1 . . . . . . . . 4367 1 215 . 1 1 46 46 GLU H H 1 8.36 0.010 . 1 . . . . . . . . 4367 1 216 . 1 1 46 46 GLU CA C 13 56.3 0.5 . 1 . . . . . . . . 4367 1 217 . 1 1 46 46 GLU CB C 13 30.9 0.5 . 1 . . . . . . . . 4367 1 218 . 1 1 46 46 GLU C C 13 175.06 0.09 . 1 . . . . . . . . 4367 1 219 . 1 1 47 47 LEU N N 15 128.6 0.1 . 1 . . . . . . . . 4367 1 220 . 1 1 47 47 LEU H H 1 9.35 0.010 . 1 . . . . . . . . 4367 1 221 . 1 1 47 47 LEU CA C 13 53.5 0.5 . 1 . . . . . . . . 4367 1 222 . 1 1 47 47 LEU CB C 13 44.4 0.5 . 1 . . . . . . . . 4367 1 223 . 1 1 47 47 LEU C C 13 175.36 0.09 . 1 . . . . . . . . 4367 1 224 . 1 1 48 48 LYS N N 15 119.3 0.1 . 1 . . . . . . . . 4367 1 225 . 1 1 48 48 LYS H H 1 8.39 0.010 . 1 . . . . . . . . 4367 1 226 . 1 1 48 48 LYS CA C 13 55.1 0.5 . 1 . . . . . . . . 4367 1 227 . 1 1 48 48 LYS CB C 13 37.4 0.5 . 1 . . . . . . . . 4367 1 228 . 1 1 48 48 LYS C C 13 176.90 0.09 . 1 . . . . . . . . 4367 1 229 . 1 1 49 49 GLY N N 15 112.3 0.1 . 1 . . . . . . . . 4367 1 230 . 1 1 49 49 GLY H H 1 8.93 0.010 . 1 . . . . . . . . 4367 1 231 . 1 1 49 49 GLY CA C 13 45.6 0.5 . 1 . . . . . . . . 4367 1 232 . 1 1 49 49 GLY C C 13 172.13 0.09 . 1 . . . . . . . . 4367 1 233 . 1 1 50 50 THR N N 15 111.9 0.1 . 1 . . . . . . . . 4367 1 234 . 1 1 50 50 THR H H 1 8.49 0.010 . 1 . . . . . . . . 4367 1 235 . 1 1 50 50 THR CA C 13 59.6 0.5 . 1 . . . . . . . . 4367 1 236 . 1 1 50 50 THR CB C 13 73.6 0.5 . 1 . . . . . . . . 4367 1 237 . 1 1 50 50 THR C C 13 174.00 0.09 . 1 . . . . . . . . 4367 1 238 . 1 1 51 51 SER N N 15 113.6 0.1 . 1 . . . . . . . . 4367 1 239 . 1 1 51 51 SER H H 1 8.95 0.010 . 1 . . . . . . . . 4367 1 240 . 1 1 51 51 SER CA C 13 56.5 0.5 . 1 . . . . . . . . 4367 1 241 . 1 1 51 51 SER CB C 13 65.4 0.5 . 1 . . . . . . . . 4367 1 242 . 1 1 51 51 SER C C 13 173.60 0.09 . 1 . . . . . . . . 4367 1 243 . 1 1 52 52 ASP N N 15 125.2 0.1 . 1 . . . . . . . . 4367 1 244 . 1 1 52 52 ASP H H 1 8.86 0.010 . 1 . . . . . . . . 4367 1 245 . 1 1 52 52 ASP CA C 13 55.8 0.5 . 1 . . . . . . . . 4367 1 246 . 1 1 52 52 ASP CB C 13 41.1 0.5 . 1 . . . . . . . . 4367 1 247 . 1 1 52 52 ASP C C 13 176.09 0.09 . 1 . . . . . . . . 4367 1 248 . 1 1 53 53 LYS N N 15 120.4 0.1 . 1 . . . . . . . . 4367 1 249 . 1 1 53 53 LYS H H 1 8.67 0.010 . 1 . . . . . . . . 4367 1 250 . 1 1 53 53 LYS CA C 13 55.0 0.5 . 1 . . . . . . . . 4367 1 251 . 1 1 53 53 LYS CB C 13 35.5 0.5 . 1 . . . . . . . . 4367 1 252 . 1 1 53 53 LYS C C 13 176.02 0.09 . 1 . . . . . . . . 4367 1 253 . 1 1 54 54 ASN N N 15 117.2 0.1 . 1 . . . . . . . . 4367 1 254 . 1 1 54 54 ASN H H 1 7.77 0.010 . 1 . . . . . . . . 4367 1 255 . 1 1 54 54 ASN CA C 13 50.8 0.5 . 1 . . . . . . . . 4367 1 256 . 1 1 54 54 ASN CB C 13 36.3 0.5 . 1 . . . . . . . . 4367 1 257 . 1 1 54 54 ASN C C 13 174.46 0.09 . 1 . . . . . . . . 4367 1 258 . 1 1 55 55 ASN N N 15 116.1 0.1 . 1 . . . . . . . . 4367 1 259 . 1 1 55 55 ASN H H 1 7.57 0.010 . 1 . . . . . . . . 4367 1 260 . 1 1 55 55 ASN CA C 13 52.8 0.5 . 1 . . . . . . . . 4367 1 261 . 1 1 55 55 ASN CB C 13 38.2 0.5 . 1 . . . . . . . . 4367 1 262 . 1 1 55 55 ASN C C 13 173.82 0.09 . 1 . . . . . . . . 4367 1 263 . 1 1 56 56 GLY N N 15 110.4 0.1 . 1 . . . . . . . . 4367 1 264 . 1 1 56 56 GLY H H 1 9.06 0.010 . 1 . . . . . . . . 4367 1 265 . 1 1 56 56 GLY CA C 13 44.5 0.5 . 1 . . . . . . . . 4367 1 266 . 1 1 56 56 GLY C C 13 170.04 0.09 . 1 . . . . . . . . 4367 1 267 . 1 1 57 57 SER N N 15 110.4 0.1 . 1 . . . . . . . . 4367 1 268 . 1 1 57 57 SER H H 1 7.04 0.010 . 1 . . . . . . . . 4367 1 269 . 1 1 57 57 SER CA C 13 57.4 0.5 . 1 . . . . . . . . 4367 1 270 . 1 1 57 57 SER CB C 13 66.2 0.5 . 1 . . . . . . . . 4367 1 271 . 1 1 57 57 SER C C 13 174.15 0.09 . 1 . . . . . . . . 4367 1 272 . 1 1 58 58 GLY N N 15 107.1 0.1 . 1 . . . . . . . . 4367 1 273 . 1 1 58 58 GLY H H 1 7.71 0.010 . 1 . . . . . . . . 4367 1 274 . 1 1 58 58 GLY CA C 13 44.2 0.5 . 1 . . . . . . . . 4367 1 275 . 1 1 58 58 GLY C C 13 170.80 0.09 . 1 . . . . . . . . 4367 1 276 . 1 1 59 59 VAL N N 15 120.0 0.1 . 1 . . . . . . . . 4367 1 277 . 1 1 59 59 VAL H H 1 8.10 0.010 . 1 . . . . . . . . 4367 1 278 . 1 1 59 59 VAL CA C 13 61.1 0.5 . 1 . . . . . . . . 4367 1 279 . 1 1 59 59 VAL CB C 13 34.7 0.5 . 1 . . . . . . . . 4367 1 280 . 1 1 59 59 VAL C C 13 175.21 0.09 . 1 . . . . . . . . 4367 1 281 . 1 1 60 60 LEU N N 15 127.7 0.1 . 1 . . . . . . . . 4367 1 282 . 1 1 60 60 LEU H H 1 9.53 0.010 . 1 . . . . . . . . 4367 1 283 . 1 1 60 60 LEU CA C 13 54.9 0.5 . 1 . . . . . . . . 4367 1 284 . 1 1 60 60 LEU CB C 13 46.4 0.5 . 1 . . . . . . . . 4367 1 285 . 1 1 60 60 LEU C C 13 175.20 0.09 . 1 . . . . . . . . 4367 1 286 . 1 1 61 61 GLU N N 15 118.8 0.1 . 1 . . . . . . . . 4367 1 287 . 1 1 61 61 GLU H H 1 8.67 0.010 . 1 . . . . . . . . 4367 1 288 . 1 1 61 61 GLU CA C 13 54.9 0.5 . 1 . . . . . . . . 4367 1 289 . 1 1 61 61 GLU CB C 13 36.0 0.5 . 1 . . . . . . . . 4367 1 290 . 1 1 61 61 GLU C C 13 176.45 0.09 . 1 . . . . . . . . 4367 1 291 . 1 1 62 62 GLY N N 15 110.7 0.1 . 1 . . . . . . . . 4367 1 292 . 1 1 62 62 GLY H H 1 8.86 0.010 . 1 . . . . . . . . 4367 1 293 . 1 1 62 62 GLY CA C 13 45.3 0.5 . 1 . . . . . . . . 4367 1 294 . 1 1 62 62 GLY C C 13 171.04 0.09 . 1 . . . . . . . . 4367 1 295 . 1 1 63 63 VAL N N 15 121.2 0.1 . 1 . . . . . . . . 4367 1 296 . 1 1 63 63 VAL H H 1 8.56 0.010 . 1 . . . . . . . . 4367 1 297 . 1 1 63 63 VAL CA C 13 61.0 0.5 . 1 . . . . . . . . 4367 1 298 . 1 1 63 63 VAL CB C 13 35.1 0.5 . 1 . . . . . . . . 4367 1 299 . 1 1 63 63 VAL C C 13 175.45 0.09 . 1 . . . . . . . . 4367 1 300 . 1 1 64 64 LYS N N 15 125.2 0.1 . 1 . . . . . . . . 4367 1 301 . 1 1 64 64 LYS H H 1 8.71 0.010 . 1 . . . . . . . . 4367 1 302 . 1 1 64 64 LYS CA C 13 56.3 0.5 . 1 . . . . . . . . 4367 1 303 . 1 1 64 64 LYS CB C 13 34.7 0.5 . 1 . . . . . . . . 4367 1 304 . 1 1 64 64 LYS C C 13 178.76 0.09 . 1 . . . . . . . . 4367 1 305 . 1 1 65 65 ALA N N 15 125.6 0.1 . 1 . . . . . . . . 4367 1 306 . 1 1 65 65 ALA H H 1 8.75 0.010 . 1 . . . . . . . . 4367 1 307 . 1 1 65 65 ALA CA C 13 55.0 0.5 . 1 . . . . . . . . 4367 1 308 . 1 1 65 65 ALA CB C 13 18.3 0.5 . 1 . . . . . . . . 4367 1 309 . 1 1 65 65 ALA C C 13 178.00 0.09 . 1 . . . . . . . . 4367 1 310 . 1 1 66 66 ASP N N 15 115.8 0.1 . 1 . . . . . . . . 4367 1 311 . 1 1 66 66 ASP H H 1 7.48 0.010 . 1 . . . . . . . . 4367 1 312 . 1 1 66 66 ASP CA C 13 53.4 0.5 . 1 . . . . . . . . 4367 1 313 . 1 1 66 66 ASP CB C 13 39.6 0.5 . 1 . . . . . . . . 4367 1 314 . 1 1 66 66 ASP C C 13 176.41 0.09 . 1 . . . . . . . . 4367 1 315 . 1 1 67 67 LYS N N 15 111.9 0.1 . 1 . . . . . . . . 4367 1 316 . 1 1 67 67 LYS H H 1 8.00 0.010 . 1 . . . . . . . . 4367 1 317 . 1 1 67 67 LYS CA C 13 59.0 0.5 . 1 . . . . . . . . 4367 1 318 . 1 1 67 67 LYS CB C 13 29.6 0.5 . 1 . . . . . . . . 4367 1 319 . 1 1 67 67 LYS C C 13 175.63 0.09 . 1 . . . . . . . . 4367 1 320 . 1 1 68 68 SER N N 15 116.5 0.1 . 1 . . . . . . . . 4367 1 321 . 1 1 68 68 SER H H 1 8.14 0.010 . 1 . . . . . . . . 4367 1 322 . 1 1 68 68 SER CA C 13 60.8 0.5 . 1 . . . . . . . . 4367 1 323 . 1 1 68 68 SER CB C 13 63.1 0.5 . 1 . . . . . . . . 4367 1 324 . 1 1 68 68 SER C C 13 172.78 0.09 . 1 . . . . . . . . 4367 1 325 . 1 1 69 69 LYS N N 15 124.0 0.1 . 1 . . . . . . . . 4367 1 326 . 1 1 69 69 LYS H H 1 7.85 0.010 . 1 . . . . . . . . 4367 1 327 . 1 1 69 69 LYS CA C 13 55.5 0.5 . 1 . . . . . . . . 4367 1 328 . 1 1 69 69 LYS CB C 13 35.1 0.5 . 1 . . . . . . . . 4367 1 329 . 1 1 69 69 LYS C C 13 174.69 0.09 . 1 . . . . . . . . 4367 1 330 . 1 1 70 70 VAL N N 15 124.2 0.1 . 1 . . . . . . . . 4367 1 331 . 1 1 70 70 VAL H H 1 8.69 0.010 . 1 . . . . . . . . 4367 1 332 . 1 1 70 70 VAL CA C 13 61.0 0.5 . 1 . . . . . . . . 4367 1 333 . 1 1 70 70 VAL CB C 13 34.4 0.5 . 1 . . . . . . . . 4367 1 334 . 1 1 70 70 VAL C C 13 174.51 0.09 . 1 . . . . . . . . 4367 1 335 . 1 1 71 71 LYS N N 15 129.2 0.1 . 1 . . . . . . . . 4367 1 336 . 1 1 71 71 LYS H H 1 9.50 0.010 . 1 . . . . . . . . 4367 1 337 . 1 1 71 71 LYS CA C 13 55.3 0.5 . 1 . . . . . . . . 4367 1 338 . 1 1 71 71 LYS CB C 13 37.8 0.5 . 1 . . . . . . . . 4367 1 339 . 1 1 71 71 LYS C C 13 174.07 0.09 . 1 . . . . . . . . 4367 1 340 . 1 1 72 72 LEU N N 15 132.5 0.1 . 1 . . . . . . . . 4367 1 341 . 1 1 72 72 LEU H H 1 9.58 0.010 . 1 . . . . . . . . 4367 1 342 . 1 1 72 72 LEU CA C 13 52.8 0.5 . 1 . . . . . . . . 4367 1 343 . 1 1 72 72 LEU CB C 13 46.0 0.5 . 1 . . . . . . . . 4367 1 344 . 1 1 72 72 LEU C C 13 174.02 0.09 . 1 . . . . . . . . 4367 1 345 . 1 1 73 73 THR N N 15 124.2 0.1 . 1 . . . . . . . . 4367 1 346 . 1 1 73 73 THR H H 1 9.41 0.010 . 1 . . . . . . . . 4367 1 347 . 1 1 73 73 THR CA C 13 62.7 0.5 . 1 . . . . . . . . 4367 1 348 . 1 1 73 73 THR CB C 13 70.1 0.5 . 1 . . . . . . . . 4367 1 349 . 1 1 73 73 THR C C 13 174.24 0.09 . 1 . . . . . . . . 4367 1 350 . 1 1 74 74 ILE N N 15 132.4 0.1 . 1 . . . . . . . . 4367 1 351 . 1 1 74 74 ILE H H 1 9.48 0.010 . 1 . . . . . . . . 4367 1 352 . 1 1 74 74 ILE CA C 13 61.0 0.5 . 1 . . . . . . . . 4367 1 353 . 1 1 74 74 ILE CB C 13 40.5 0.5 . 1 . . . . . . . . 4367 1 354 . 1 1 74 74 ILE C C 13 176.54 0.09 . 1 . . . . . . . . 4367 1 355 . 1 1 75 75 SER N N 15 124.8 0.1 . 1 . . . . . . . . 4367 1 356 . 1 1 75 75 SER H H 1 8.41 0.010 . 1 . . . . . . . . 4367 1 357 . 1 1 75 75 SER CA C 13 59.5 0.5 . 1 . . . . . . . . 4367 1 358 . 1 1 75 75 SER CB C 13 64.3 0.5 . 1 . . . . . . . . 4367 1 359 . 1 1 75 75 SER C C 13 174.83 0.09 . 1 . . . . . . . . 4367 1 360 . 1 1 76 76 ASP N N 15 121.0 0.1 . 1 . . . . . . . . 4367 1 361 . 1 1 76 76 ASP H H 1 8.52 0.010 . 1 . . . . . . . . 4367 1 362 . 1 1 76 76 ASP CA C 13 57.6 0.5 . 1 . . . . . . . . 4367 1 363 . 1 1 76 76 ASP CB C 13 41.2 0.5 . 1 . . . . . . . . 4367 1 364 . 1 1 76 76 ASP C C 13 176.22 0.09 . 1 . . . . . . . . 4367 1 365 . 1 1 77 77 ASP N N 15 115.4 0.1 . 1 . . . . . . . . 4367 1 366 . 1 1 77 77 ASP H H 1 7.80 0.010 . 1 . . . . . . . . 4367 1 367 . 1 1 77 77 ASP CA C 13 52.3 0.5 . 1 . . . . . . . . 4367 1 368 . 1 1 77 77 ASP CB C 13 40.3 0.5 . 1 . . . . . . . . 4367 1 369 . 1 1 77 77 ASP C C 13 176.88 0.09 . 1 . . . . . . . . 4367 1 370 . 1 1 78 78 LEU N N 15 117.2 0.1 . 1 . . . . . . . . 4367 1 371 . 1 1 78 78 LEU H H 1 8.35 0.010 . 1 . . . . . . . . 4367 1 372 . 1 1 78 78 LEU CA C 13 56.5 0.5 . 1 . . . . . . . . 4367 1 373 . 1 1 78 78 LEU CB C 13 39.0 0.5 . 1 . . . . . . . . 4367 1 374 . 1 1 78 78 LEU C C 13 176.16 0.09 . 1 . . . . . . . . 4367 1 375 . 1 1 79 79 GLY N N 15 105.6 0.1 . 1 . . . . . . . . 4367 1 376 . 1 1 79 79 GLY H H 1 8.14 0.010 . 1 . . . . . . . . 4367 1 377 . 1 1 79 79 GLY CA C 13 46.2 0.5 . 1 . . . . . . . . 4367 1 378 . 1 1 79 79 GLY C C 13 173.64 0.09 . 1 . . . . . . . . 4367 1 379 . 1 1 80 80 GLN N N 15 118.8 0.1 . 1 . . . . . . . . 4367 1 380 . 1 1 80 80 GLN H H 1 7.84 0.010 . 1 . . . . . . . . 4367 1 381 . 1 1 80 80 GLN CA C 13 54.9 0.5 . 1 . . . . . . . . 4367 1 382 . 1 1 80 80 GLN CB C 13 33.7 0.5 . 1 . . . . . . . . 4367 1 383 . 1 1 80 80 GLN C C 13 174.68 0.09 . 1 . . . . . . . . 4367 1 384 . 1 1 81 81 THR N N 15 114.2 0.1 . 1 . . . . . . . . 4367 1 385 . 1 1 81 81 THR H H 1 8.84 0.010 . 1 . . . . . . . . 4367 1 386 . 1 1 81 81 THR CA C 13 59.1 0.5 . 1 . . . . . . . . 4367 1 387 . 1 1 81 81 THR CB C 13 71.4 0.5 . 1 . . . . . . . . 4367 1 388 . 1 1 81 81 THR C C 13 173.48 0.09 . 1 . . . . . . . . 4367 1 389 . 1 1 82 82 THR N N 15 119.8 0.1 . 1 . . . . . . . . 4367 1 390 . 1 1 82 82 THR H H 1 9.01 0.010 . 1 . . . . . . . . 4367 1 391 . 1 1 82 82 THR CA C 13 62.3 0.5 . 1 . . . . . . . . 4367 1 392 . 1 1 82 82 THR CB C 13 71.3 0.5 . 1 . . . . . . . . 4367 1 393 . 1 1 82 82 THR C C 13 172.41 0.09 . 1 . . . . . . . . 4367 1 394 . 1 1 83 83 LEU N N 15 132.7 0.1 . 1 . . . . . . . . 4367 1 395 . 1 1 83 83 LEU H H 1 9.56 0.010 . 1 . . . . . . . . 4367 1 396 . 1 1 83 83 LEU CA C 13 53.6 0.5 . 1 . . . . . . . . 4367 1 397 . 1 1 83 83 LEU CB C 13 44.7 0.5 . 1 . . . . . . . . 4367 1 398 . 1 1 83 83 LEU C C 13 175.82 0.09 . 1 . . . . . . . . 4367 1 399 . 1 1 84 84 GLU N N 15 130.6 0.1 . 1 . . . . . . . . 4367 1 400 . 1 1 84 84 GLU H H 1 9.64 0.010 . 1 . . . . . . . . 4367 1 401 . 1 1 84 84 GLU CA C 13 55.2 0.5 . 1 . . . . . . . . 4367 1 402 . 1 1 84 84 GLU CB C 13 35.2 0.5 . 1 . . . . . . . . 4367 1 403 . 1 1 84 84 GLU C C 13 173.49 0.09 . 1 . . . . . . . . 4367 1 404 . 1 1 85 85 VAL N N 15 122.7 0.1 . 1 . . . . . . . . 4367 1 405 . 1 1 85 85 VAL H H 1 8.28 0.010 . 1 . . . . . . . . 4367 1 406 . 1 1 85 85 VAL CA C 13 61.2 0.5 . 1 . . . . . . . . 4367 1 407 . 1 1 85 85 VAL CB C 13 33.3 0.5 . 1 . . . . . . . . 4367 1 408 . 1 1 85 85 VAL C C 13 174.41 0.09 . 1 . . . . . . . . 4367 1 409 . 1 1 86 86 PHE N N 15 126.7 0.1 . 1 . . . . . . . . 4367 1 410 . 1 1 86 86 PHE H H 1 9.67 0.010 . 1 . . . . . . . . 4367 1 411 . 1 1 86 86 PHE CA C 13 56.3 0.5 . 1 . . . . . . . . 4367 1 412 . 1 1 86 86 PHE CB C 13 43.8 0.5 . 1 . . . . . . . . 4367 1 413 . 1 1 86 86 PHE C C 13 176.82 0.09 . 1 . . . . . . . . 4367 1 414 . 1 1 87 87 LYS N N 15 117.6 0.1 . 1 . . . . . . . . 4367 1 415 . 1 1 87 87 LYS H H 1 8.39 0.010 . 1 . . . . . . . . 4367 1 416 . 1 1 87 87 LYS CA C 13 56.6 0.5 . 1 . . . . . . . . 4367 1 417 . 1 1 87 87 LYS CB C 13 33.8 0.5 . 1 . . . . . . . . 4367 1 418 . 1 1 87 87 LYS C C 13 176.66 0.09 . 1 . . . . . . . . 4367 1 419 . 1 1 88 88 GLU N N 15 119.9 0.1 . 1 . . . . . . . . 4367 1 420 . 1 1 88 88 GLU H H 1 8.78 0.010 . 1 . . . . . . . . 4367 1 421 . 1 1 88 88 GLU CA C 13 58.7 0.5 . 1 . . . . . . . . 4367 1 422 . 1 1 88 88 GLU CB C 13 29.6 0.5 . 1 . . . . . . . . 4367 1 423 . 1 1 88 88 GLU C C 13 176.12 0.09 . 1 . . . . . . . . 4367 1 424 . 1 1 89 89 ASP N N 15 117.4 0.1 . 1 . . . . . . . . 4367 1 425 . 1 1 89 89 ASP H H 1 7.32 0.010 . 1 . . . . . . . . 4367 1 426 . 1 1 89 89 ASP CA C 13 54.5 0.5 . 1 . . . . . . . . 4367 1 427 . 1 1 89 89 ASP CB C 13 39.9 0.5 . 1 . . . . . . . . 4367 1 428 . 1 1 89 89 ASP C C 13 177.60 0.09 . 1 . . . . . . . . 4367 1 429 . 1 1 90 90 GLY N N 15 110.5 0.1 . 1 . . . . . . . . 4367 1 430 . 1 1 90 90 GLY H H 1 8.71 0.010 . 1 . . . . . . . . 4367 1 431 . 1 1 90 90 GLY CA C 13 46.0 0.5 . 1 . . . . . . . . 4367 1 432 . 1 1 90 90 GLY C C 13 172.20 0.09 . 1 . . . . . . . . 4367 1 433 . 1 1 91 91 LYS N N 15 118.8 0.1 . 1 . . . . . . . . 4367 1 434 . 1 1 91 91 LYS H H 1 8.49 0.010 . 1 . . . . . . . . 4367 1 435 . 1 1 91 91 LYS CA C 13 56.9 0.5 . 1 . . . . . . . . 4367 1 436 . 1 1 91 91 LYS CB C 13 36.0 0.5 . 1 . . . . . . . . 4367 1 437 . 1 1 91 91 LYS C C 13 175.71 0.09 . 1 . . . . . . . . 4367 1 438 . 1 1 92 92 THR N N 15 123.1 0.1 . 1 . . . . . . . . 4367 1 439 . 1 1 92 92 THR H H 1 9.65 0.010 . 1 . . . . . . . . 4367 1 440 . 1 1 92 92 THR CA C 13 63.3 0.5 . 1 . . . . . . . . 4367 1 441 . 1 1 92 92 THR CB C 13 67.7 0.5 . 1 . . . . . . . . 4367 1 442 . 1 1 92 92 THR C C 13 173.73 0.09 . 1 . . . . . . . . 4367 1 443 . 1 1 93 93 LEU N N 15 132.5 0.1 . 1 . . . . . . . . 4367 1 444 . 1 1 93 93 LEU H H 1 8.38 0.010 . 1 . . . . . . . . 4367 1 445 . 1 1 93 93 LEU CA C 13 56.4 0.5 . 1 . . . . . . . . 4367 1 446 . 1 1 93 93 LEU CB C 13 43.2 0.5 . 1 . . . . . . . . 4367 1 447 . 1 1 93 93 LEU C C 13 176.03 0.09 . 1 . . . . . . . . 4367 1 448 . 1 1 94 94 VAL N N 15 121.6 0.1 . 1 . . . . . . . . 4367 1 449 . 1 1 94 94 VAL H H 1 9.13 0.010 . 1 . . . . . . . . 4367 1 450 . 1 1 94 94 VAL CA C 13 64.2 0.5 . 1 . . . . . . . . 4367 1 451 . 1 1 94 94 VAL C C 13 176.92 0.09 . 1 . . . . . . . . 4367 1 452 . 1 1 95 95 SER N N 15 113.4 0.1 . 1 . . . . . . . . 4367 1 453 . 1 1 95 95 SER H H 1 7.83 0.010 . 1 . . . . . . . . 4367 1 454 . 1 1 95 95 SER CA C 13 57.6 0.5 . 1 . . . . . . . . 4367 1 455 . 1 1 95 95 SER CB C 13 65.6 0.5 . 1 . . . . . . . . 4367 1 456 . 1 1 95 95 SER C C 13 171.67 0.09 . 1 . . . . . . . . 4367 1 457 . 1 1 96 96 LYS N N 15 123.0 0.1 . 1 . . . . . . . . 4367 1 458 . 1 1 96 96 LYS H H 1 8.96 0.010 . 1 . . . . . . . . 4367 1 459 . 1 1 96 96 LYS CA C 13 55.7 0.5 . 1 . . . . . . . . 4367 1 460 . 1 1 96 96 LYS CB C 13 37.5 0.5 . 1 . . . . . . . . 4367 1 461 . 1 1 96 96 LYS C C 13 174.24 0.09 . 1 . . . . . . . . 4367 1 462 . 1 1 97 97 LYS N N 15 130.1 0.1 . 1 . . . . . . . . 4367 1 463 . 1 1 97 97 LYS H H 1 9.24 0.010 . 1 . . . . . . . . 4367 1 464 . 1 1 97 97 LYS CA C 13 55.2 0.5 . 1 . . . . . . . . 4367 1 465 . 1 1 97 97 LYS CB C 13 36.1 0.5 . 1 . . . . . . . . 4367 1 466 . 1 1 97 97 LYS C C 13 175.28 0.09 . 1 . . . . . . . . 4367 1 467 . 1 1 98 98 VAL N N 15 132.7 0.1 . 1 . . . . . . . . 4367 1 468 . 1 1 98 98 VAL H H 1 9.32 0.010 . 1 . . . . . . . . 4367 1 469 . 1 1 98 98 VAL CA C 13 61.0 0.5 . 1 . . . . . . . . 4367 1 470 . 1 1 98 98 VAL CB C 13 34.3 0.5 . 1 . . . . . . . . 4367 1 471 . 1 1 98 98 VAL C C 13 175.99 0.09 . 1 . . . . . . . . 4367 1 472 . 1 1 99 99 THR N N 15 125.3 0.1 . 1 . . . . . . . . 4367 1 473 . 1 1 99 99 THR H H 1 9.05 0.010 . 1 . . . . . . . . 4367 1 474 . 1 1 99 99 THR CA C 13 62.2 0.5 . 1 . . . . . . . . 4367 1 475 . 1 1 99 99 THR CB C 13 70.1 0.5 . 1 . . . . . . . . 4367 1 476 . 1 1 99 99 THR C C 13 173.13 0.09 . 1 . . . . . . . . 4367 1 477 . 1 1 100 100 SER N N 15 120.4 0.1 . 1 . . . . . . . . 4367 1 478 . 1 1 100 100 SER H H 1 8.41 0.010 . 1 . . . . . . . . 4367 1 479 . 1 1 100 100 SER CA C 13 56.9 0.5 . 1 . . . . . . . . 4367 1 480 . 1 1 100 100 SER CB C 13 65.0 0.5 . 1 . . . . . . . . 4367 1 481 . 1 1 100 100 SER C C 13 176.68 0.09 . 1 . . . . . . . . 4367 1 482 . 1 1 101 101 LYS N N 15 125.5 0.1 . 1 . . . . . . . . 4367 1 483 . 1 1 101 101 LYS H H 1 8.37 0.010 . 1 . . . . . . . . 4367 1 484 . 1 1 101 101 LYS CA C 13 59.1 0.5 . 1 . . . . . . . . 4367 1 485 . 1 1 101 101 LYS CB C 13 32.8 0.5 . 1 . . . . . . . . 4367 1 486 . 1 1 101 101 LYS C C 13 175.81 0.09 . 1 . . . . . . . . 4367 1 487 . 1 1 102 102 ASP N N 15 120.1 0.1 . 1 . . . . . . . . 4367 1 488 . 1 1 102 102 ASP H H 1 7.98 0.010 . 1 . . . . . . . . 4367 1 489 . 1 1 102 102 ASP CA C 13 54.0 0.5 . 1 . . . . . . . . 4367 1 490 . 1 1 102 102 ASP CB C 13 39.5 0.5 . 1 . . . . . . . . 4367 1 491 . 1 1 102 102 ASP C C 13 175.75 0.09 . 1 . . . . . . . . 4367 1 492 . 1 1 103 103 LYS N N 15 112.0 0.1 . 1 . . . . . . . . 4367 1 493 . 1 1 103 103 LYS H H 1 8.09 0.010 . 1 . . . . . . . . 4367 1 494 . 1 1 103 103 LYS CA C 13 59.1 0.5 . 1 . . . . . . . . 4367 1 495 . 1 1 103 103 LYS CB C 13 29.6 0.5 . 1 . . . . . . . . 4367 1 496 . 1 1 103 103 LYS C C 13 175.88 0.09 . 1 . . . . . . . . 4367 1 497 . 1 1 104 104 SER N N 15 117.4 0.1 . 1 . . . . . . . . 4367 1 498 . 1 1 104 104 SER H H 1 8.20 0.010 . 1 . . . . . . . . 4367 1 499 . 1 1 104 104 SER CA C 13 58.5 0.5 . 1 . . . . . . . . 4367 1 500 . 1 1 104 104 SER CB C 13 64.7 0.5 . 1 . . . . . . . . 4367 1 501 . 1 1 104 104 SER C C 13 173.35 0.09 . 1 . . . . . . . . 4367 1 502 . 1 1 105 105 SER N N 15 115.4 0.1 . 1 . . . . . . . . 4367 1 503 . 1 1 105 105 SER H H 1 8.87 0.010 . 1 . . . . . . . . 4367 1 504 . 1 1 105 105 SER CA C 13 57.3 0.5 . 1 . . . . . . . . 4367 1 505 . 1 1 105 105 SER CB C 13 67.0 0.5 . 1 . . . . . . . . 4367 1 506 . 1 1 105 105 SER C C 13 174.06 0.09 . 1 . . . . . . . . 4367 1 507 . 1 1 106 106 THR N N 15 119.8 0.1 . 1 . . . . . . . . 4367 1 508 . 1 1 106 106 THR H H 1 9.08 0.010 . 1 . . . . . . . . 4367 1 509 . 1 1 106 106 THR CA C 13 61.9 0.5 . 1 . . . . . . . . 4367 1 510 . 1 1 106 106 THR CB C 13 71.5 0.5 . 1 . . . . . . . . 4367 1 511 . 1 1 106 106 THR C C 13 172.71 0.09 . 1 . . . . . . . . 4367 1 512 . 1 1 107 107 GLU N N 15 129.0 0.1 . 1 . . . . . . . . 4367 1 513 . 1 1 107 107 GLU H H 1 9.25 0.010 . 1 . . . . . . . . 4367 1 514 . 1 1 107 107 GLU CA C 13 54.8 0.5 . 1 . . . . . . . . 4367 1 515 . 1 1 107 107 GLU CB C 13 33.6 0.5 . 1 . . . . . . . . 4367 1 516 . 1 1 107 107 GLU C C 13 174.44 0.09 . 1 . . . . . . . . 4367 1 517 . 1 1 108 108 GLU N N 15 125.8 0.1 . 1 . . . . . . . . 4367 1 518 . 1 1 108 108 GLU H H 1 9.20 0.010 . 1 . . . . . . . . 4367 1 519 . 1 1 108 108 GLU CA C 13 55.0 0.5 . 1 . . . . . . . . 4367 1 520 . 1 1 108 108 GLU CB C 13 34.6 0.5 . 1 . . . . . . . . 4367 1 521 . 1 1 108 108 GLU C C 13 174.57 0.09 . 1 . . . . . . . . 4367 1 522 . 1 1 109 109 LYS N N 15 122.5 0.1 . 1 . . . . . . . . 4367 1 523 . 1 1 109 109 LYS H H 1 8.45 0.010 . 1 . . . . . . . . 4367 1 524 . 1 1 109 109 LYS CA C 13 55.1 0.5 . 1 . . . . . . . . 4367 1 525 . 1 1 109 109 LYS CB C 13 35.6 0.5 . 1 . . . . . . . . 4367 1 526 . 1 1 109 109 LYS C C 13 174.51 0.09 . 1 . . . . . . . . 4367 1 527 . 1 1 110 110 PHE N N 15 122.7 0.1 . 1 . . . . . . . . 4367 1 528 . 1 1 110 110 PHE H H 1 7.93 0.010 . 1 . . . . . . . . 4367 1 529 . 1 1 110 110 PHE CA C 13 56.8 0.5 . 1 . . . . . . . . 4367 1 530 . 1 1 110 110 PHE CB C 13 42.5 0.5 . 1 . . . . . . . . 4367 1 531 . 1 1 110 110 PHE C C 13 176.68 0.09 . 1 . . . . . . . . 4367 1 532 . 1 1 111 111 ASN N N 15 120.8 0.1 . 1 . . . . . . . . 4367 1 533 . 1 1 111 111 ASN H H 1 8.84 0.010 . 1 . . . . . . . . 4367 1 534 . 1 1 111 111 ASN CA C 13 50.6 0.5 . 1 . . . . . . . . 4367 1 535 . 1 1 111 111 ASN CB C 13 39.0 0.5 . 1 . . . . . . . . 4367 1 536 . 1 1 111 111 ASN C C 13 177.54 0.09 . 1 . . . . . . . . 4367 1 537 . 1 1 112 112 GLU N N 15 119.3 0.1 . 1 . . . . . . . . 4367 1 538 . 1 1 112 112 GLU H H 1 9.26 0.010 . 1 . . . . . . . . 4367 1 539 . 1 1 112 112 GLU CA C 13 59.0 0.5 . 1 . . . . . . . . 4367 1 540 . 1 1 112 112 GLU CB C 13 28.8 0.5 . 1 . . . . . . . . 4367 1 541 . 1 1 112 112 GLU C C 13 177.00 0.09 . 1 . . . . . . . . 4367 1 542 . 1 1 113 113 LYS N N 15 119.6 0.1 . 1 . . . . . . . . 4367 1 543 . 1 1 113 113 LYS H H 1 7.71 0.010 . 1 . . . . . . . . 4367 1 544 . 1 1 113 113 LYS CA C 13 55.5 0.5 . 1 . . . . . . . . 4367 1 545 . 1 1 113 113 LYS CB C 13 32.7 0.5 . 1 . . . . . . . . 4367 1 546 . 1 1 113 113 LYS C C 13 176.79 0.09 . 1 . . . . . . . . 4367 1 547 . 1 1 114 114 GLY N N 15 109.1 0.1 . 1 . . . . . . . . 4367 1 548 . 1 1 114 114 GLY H H 1 8.22 0.010 . 1 . . . . . . . . 4367 1 549 . 1 1 114 114 GLY CA C 13 45.9 0.5 . 1 . . . . . . . . 4367 1 550 . 1 1 114 114 GLY C C 13 174.12 0.09 . 1 . . . . . . . . 4367 1 551 . 1 1 115 115 GLU N N 15 120.4 0.1 . 1 . . . . . . . . 4367 1 552 . 1 1 115 115 GLU H H 1 7.75 0.010 . 1 . . . . . . . . 4367 1 553 . 1 1 115 115 GLU CA C 13 54.3 0.5 . 1 . . . . . . . . 4367 1 554 . 1 1 115 115 GLU CB C 13 30.5 0.5 . 1 . . . . . . . . 4367 1 555 . 1 1 115 115 GLU C C 13 176.31 0.09 . 1 . . . . . . . . 4367 1 556 . 1 1 116 116 LEU N N 15 125.6 0.1 . 1 . . . . . . . . 4367 1 557 . 1 1 116 116 LEU H H 1 8.52 0.010 . 1 . . . . . . . . 4367 1 558 . 1 1 116 116 LEU CA C 13 56.7 0.5 . 1 . . . . . . . . 4367 1 559 . 1 1 116 116 LEU CB C 13 42.1 0.5 . 1 . . . . . . . . 4367 1 560 . 1 1 116 116 LEU C C 13 176.03 0.09 . 1 . . . . . . . . 4367 1 561 . 1 1 117 117 SER N N 15 121.6 0.1 . 1 . . . . . . . . 4367 1 562 . 1 1 117 117 SER H H 1 9.13 0.010 . 1 . . . . . . . . 4367 1 563 . 1 1 117 117 SER CA C 13 59.1 0.5 . 1 . . . . . . . . 4367 1 564 . 1 1 117 117 SER CB C 13 65.2 0.5 . 1 . . . . . . . . 4367 1 565 . 1 1 117 117 SER C C 13 175.38 0.09 . 1 . . . . . . . . 4367 1 566 . 1 1 118 118 GLU N N 15 121.1 0.1 . 1 . . . . . . . . 4367 1 567 . 1 1 118 118 GLU H H 1 7.71 0.010 . 1 . . . . . . . . 4367 1 568 . 1 1 118 118 GLU CA C 13 55.7 0.5 . 1 . . . . . . . . 4367 1 569 . 1 1 118 118 GLU CB C 13 34.3 0.5 . 1 . . . . . . . . 4367 1 570 . 1 1 118 118 GLU C C 13 173.63 0.09 . 1 . . . . . . . . 4367 1 571 . 1 1 119 119 LYS N N 15 123.7 0.1 . 1 . . . . . . . . 4367 1 572 . 1 1 119 119 LYS H H 1 9.11 0.010 . 1 . . . . . . . . 4367 1 573 . 1 1 119 119 LYS CA C 13 55.4 0.5 . 1 . . . . . . . . 4367 1 574 . 1 1 119 119 LYS CB C 13 37.8 0.5 . 1 . . . . . . . . 4367 1 575 . 1 1 119 119 LYS C C 13 173.99 0.09 . 1 . . . . . . . . 4367 1 576 . 1 1 120 120 LYS N N 15 129.8 0.1 . 1 . . . . . . . . 4367 1 577 . 1 1 120 120 LYS H H 1 9.49 0.010 . 1 . . . . . . . . 4367 1 578 . 1 1 120 120 LYS CA C 13 55.2 0.5 . 1 . . . . . . . . 4367 1 579 . 1 1 120 120 LYS CB C 13 36.5 0.5 . 1 . . . . . . . . 4367 1 580 . 1 1 120 120 LYS C C 13 175.12 0.09 . 1 . . . . . . . . 4367 1 581 . 1 1 121 121 ILE N N 15 130.9 0.1 . 1 . . . . . . . . 4367 1 582 . 1 1 121 121 ILE H H 1 9.17 0.010 . 1 . . . . . . . . 4367 1 583 . 1 1 121 121 ILE CA C 13 60.5 0.5 . 1 . . . . . . . . 4367 1 584 . 1 1 121 121 ILE CB C 13 40.9 0.5 . 1 . . . . . . . . 4367 1 585 . 1 1 121 121 ILE C C 13 175.46 0.09 . 1 . . . . . . . . 4367 1 586 . 1 1 122 122 THR N N 15 125.2 0.1 . 1 . . . . . . . . 4367 1 587 . 1 1 122 122 THR H H 1 9.24 0.010 . 1 . . . . . . . . 4367 1 588 . 1 1 122 122 THR CA C 13 61.9 0.5 . 1 . . . . . . . . 4367 1 589 . 1 1 122 122 THR CB C 13 70.1 0.5 . 1 . . . . . . . . 4367 1 590 . 1 1 122 122 THR C C 13 174.26 0.09 . 1 . . . . . . . . 4367 1 591 . 1 1 123 123 ARG N N 15 125.3 0.1 . 1 . . . . . . . . 4367 1 592 . 1 1 123 123 ARG H H 1 8.66 0.010 . 1 . . . . . . . . 4367 1 593 . 1 1 123 123 ARG CA C 13 55.3 0.5 . 1 . . . . . . . . 4367 1 594 . 1 1 123 123 ARG CB C 13 32.3 0.5 . 1 . . . . . . . . 4367 1 595 . 1 1 123 123 ARG C C 13 178.09 0.09 . 1 . . . . . . . . 4367 1 596 . 1 1 124 124 ALA N N 15 124.8 0.1 . 1 . . . . . . . . 4367 1 597 . 1 1 124 124 ALA H H 1 8.79 0.010 . 1 . . . . . . . . 4367 1 598 . 1 1 124 124 ALA CA C 13 54.8 0.5 . 1 . . . . . . . . 4367 1 599 . 1 1 124 124 ALA CB C 13 18.8 0.5 . 1 . . . . . . . . 4367 1 600 . 1 1 124 124 ALA C C 13 177.48 0.09 . 1 . . . . . . . . 4367 1 601 . 1 1 125 125 ASP N N 15 116.0 0.1 . 1 . . . . . . . . 4367 1 602 . 1 1 125 125 ASP H H 1 7.56 0.010 . 1 . . . . . . . . 4367 1 603 . 1 1 125 125 ASP CA C 13 53.4 0.5 . 1 . . . . . . . . 4367 1 604 . 1 1 125 125 ASP CB C 13 39.6 0.5 . 1 . . . . . . . . 4367 1 605 . 1 1 125 125 ASP C C 13 175.71 0.09 . 1 . . . . . . . . 4367 1 606 . 1 1 126 126 LYS N N 15 110.7 0.1 . 1 . . . . . . . . 4367 1 607 . 1 1 126 126 LYS H H 1 7.92 0.010 . 1 . . . . . . . . 4367 1 608 . 1 1 126 126 LYS CA C 13 59.1 0.5 . 1 . . . . . . . . 4367 1 609 . 1 1 126 126 LYS CB C 13 29.6 0.5 . 1 . . . . . . . . 4367 1 610 . 1 1 126 126 LYS C C 13 176.52 0.09 . 1 . . . . . . . . 4367 1 611 . 1 1 127 127 SER N N 15 118.1 0.1 . 1 . . . . . . . . 4367 1 612 . 1 1 127 127 SER H H 1 8.31 0.010 . 1 . . . . . . . . 4367 1 613 . 1 1 127 127 SER CA C 13 59.1 0.5 . 1 . . . . . . . . 4367 1 614 . 1 1 127 127 SER CB C 13 64.5 0.5 . 1 . . . . . . . . 4367 1 615 . 1 1 127 127 SER C C 13 172.96 0.09 . 1 . . . . . . . . 4367 1 616 . 1 1 128 128 SER N N 15 113.7 0.1 . 1 . . . . . . . . 4367 1 617 . 1 1 128 128 SER H H 1 9.06 0.010 . 1 . . . . . . . . 4367 1 618 . 1 1 128 128 SER CA C 13 57.5 0.5 . 1 . . . . . . . . 4367 1 619 . 1 1 128 128 SER CB C 13 68.0 0.5 . 1 . . . . . . . . 4367 1 620 . 1 1 128 128 SER C C 13 174.35 0.09 . 1 . . . . . . . . 4367 1 621 . 1 1 129 129 THR N N 15 117.5 0.1 . 1 . . . . . . . . 4367 1 622 . 1 1 129 129 THR H H 1 8.98 0.010 . 1 . . . . . . . . 4367 1 623 . 1 1 129 129 THR CA C 13 61.8 0.5 . 1 . . . . . . . . 4367 1 624 . 1 1 129 129 THR CB C 13 71.3 0.5 . 1 . . . . . . . . 4367 1 625 . 1 1 129 129 THR C C 13 173.25 0.09 . 1 . . . . . . . . 4367 1 626 . 1 1 130 130 GLU N N 15 128.5 0.1 . 1 . . . . . . . . 4367 1 627 . 1 1 130 130 GLU H H 1 9.46 0.010 . 1 . . . . . . . . 4367 1 628 . 1 1 130 130 GLU CA C 13 55.2 0.5 . 1 . . . . . . . . 4367 1 629 . 1 1 130 130 GLU CB C 13 33.6 0.5 . 1 . . . . . . . . 4367 1 630 . 1 1 130 130 GLU C C 13 174.69 0.09 . 1 . . . . . . . . 4367 1 631 . 1 1 131 131 GLU N N 15 126.9 0.1 . 1 . . . . . . . . 4367 1 632 . 1 1 131 131 GLU H H 1 9.29 0.010 . 1 . . . . . . . . 4367 1 633 . 1 1 131 131 GLU CA C 13 54.8 0.5 . 1 . . . . . . . . 4367 1 634 . 1 1 131 131 GLU CB C 13 35.0 0.5 . 1 . . . . . . . . 4367 1 635 . 1 1 131 131 GLU C C 13 174.35 0.09 . 1 . . . . . . . . 4367 1 636 . 1 1 132 132 LYS N N 15 121.7 0.1 . 1 . . . . . . . . 4367 1 637 . 1 1 132 132 LYS H H 1 8.20 0.010 . 1 . . . . . . . . 4367 1 638 . 1 1 132 132 LYS CA C 13 54.9 0.5 . 1 . . . . . . . . 4367 1 639 . 1 1 132 132 LYS CB C 13 35.1 0.5 . 1 . . . . . . . . 4367 1 640 . 1 1 132 132 LYS C C 13 174.97 0.09 . 1 . . . . . . . . 4367 1 641 . 1 1 133 133 PHE N N 15 121.8 0.1 . 1 . . . . . . . . 4367 1 642 . 1 1 133 133 PHE H H 1 8.07 0.010 . 1 . . . . . . . . 4367 1 643 . 1 1 133 133 PHE CA C 13 56.9 0.5 . 1 . . . . . . . . 4367 1 644 . 1 1 133 133 PHE CB C 13 42.1 0.5 . 1 . . . . . . . . 4367 1 645 . 1 1 133 133 PHE C C 13 175.82 0.09 . 1 . . . . . . . . 4367 1 646 . 1 1 134 134 ASN N N 15 120.2 0.1 . 1 . . . . . . . . 4367 1 647 . 1 1 134 134 ASN H H 1 8.98 0.010 . 1 . . . . . . . . 4367 1 648 . 1 1 134 134 ASN CA C 13 51.0 0.5 . 1 . . . . . . . . 4367 1 649 . 1 1 134 134 ASN CB C 13 38.9 0.5 . 1 . . . . . . . . 4367 1 650 . 1 1 134 134 ASN C C 13 177.72 0.09 . 1 . . . . . . . . 4367 1 651 . 1 1 135 135 GLU N N 15 119.3 0.1 . 1 . . . . . . . . 4367 1 652 . 1 1 135 135 GLU H H 1 9.06 0.010 . 1 . . . . . . . . 4367 1 653 . 1 1 135 135 GLU CA C 13 59.2 0.5 . 1 . . . . . . . . 4367 1 654 . 1 1 135 135 GLU CB C 13 29.1 0.5 . 1 . . . . . . . . 4367 1 655 . 1 1 135 135 GLU C C 13 176.97 0.09 . 1 . . . . . . . . 4367 1 656 . 1 1 136 136 LYS N N 15 118.3 0.1 . 1 . . . . . . . . 4367 1 657 . 1 1 136 136 LYS H H 1 7.65 0.010 . 1 . . . . . . . . 4367 1 658 . 1 1 136 136 LYS CA C 13 55.7 0.5 . 1 . . . . . . . . 4367 1 659 . 1 1 136 136 LYS CB C 13 32.8 0.5 . 1 . . . . . . . . 4367 1 660 . 1 1 136 136 LYS C C 13 176.91 0.09 . 1 . . . . . . . . 4367 1 661 . 1 1 137 137 GLY N N 15 108.9 0.1 . 1 . . . . . . . . 4367 1 662 . 1 1 137 137 GLY H H 1 8.37 0.010 . 1 . . . . . . . . 4367 1 663 . 1 1 137 137 GLY CA C 13 45.7 0.5 . 1 . . . . . . . . 4367 1 664 . 1 1 137 137 GLY C C 13 174.12 0.09 . 1 . . . . . . . . 4367 1 665 . 1 1 138 138 GLU N N 15 120.4 0.1 . 1 . . . . . . . . 4367 1 666 . 1 1 138 138 GLU H H 1 7.75 0.010 . 1 . . . . . . . . 4367 1 667 . 1 1 138 138 GLU CA C 13 54.1 0.5 . 1 . . . . . . . . 4367 1 668 . 1 1 138 138 GLU CB C 13 30.7 0.5 . 1 . . . . . . . . 4367 1 669 . 1 1 138 138 GLU C C 13 176.14 0.09 . 1 . . . . . . . . 4367 1 670 . 1 1 139 139 VAL N N 15 124.0 0.1 . 1 . . . . . . . . 4367 1 671 . 1 1 139 139 VAL H H 1 8.36 0.010 . 1 . . . . . . . . 4367 1 672 . 1 1 139 139 VAL CA C 13 63.4 0.5 . 1 . . . . . . . . 4367 1 673 . 1 1 139 139 VAL CB C 13 31.9 0.5 . 1 . . . . . . . . 4367 1 674 . 1 1 139 139 VAL C C 13 175.43 0.09 . 1 . . . . . . . . 4367 1 675 . 1 1 140 140 SER N N 15 123.4 0.1 . 1 . . . . . . . . 4367 1 676 . 1 1 140 140 SER H H 1 8.97 0.010 . 1 . . . . . . . . 4367 1 677 . 1 1 140 140 SER CA C 13 58.5 0.5 . 1 . . . . . . . . 4367 1 678 . 1 1 140 140 SER CB C 13 65.6 0.5 . 1 . . . . . . . . 4367 1 679 . 1 1 140 140 SER C C 13 174.35 0.09 . 1 . . . . . . . . 4367 1 680 . 1 1 141 141 GLU N N 15 121.5 0.1 . 1 . . . . . . . . 4367 1 681 . 1 1 141 141 GLU H H 1 7.38 0.010 . 1 . . . . . . . . 4367 1 682 . 1 1 141 141 GLU CA C 13 55.4 0.5 . 1 . . . . . . . . 4367 1 683 . 1 1 141 141 GLU CB C 13 34.1 0.5 . 1 . . . . . . . . 4367 1 684 . 1 1 141 141 GLU C C 13 173.74 0.09 . 1 . . . . . . . . 4367 1 685 . 1 1 142 142 LYS N N 15 124.6 0.1 . 1 . . . . . . . . 4367 1 686 . 1 1 142 142 LYS H H 1 9.00 0.010 . 1 . . . . . . . . 4367 1 687 . 1 1 142 142 LYS CA C 13 55.3 0.5 . 1 . . . . . . . . 4367 1 688 . 1 1 142 142 LYS CB C 13 37.1 0.5 . 1 . . . . . . . . 4367 1 689 . 1 1 142 142 LYS C C 13 173.42 0.09 . 1 . . . . . . . . 4367 1 690 . 1 1 143 143 ILE N N 15 126.7 0.1 . 1 . . . . . . . . 4367 1 691 . 1 1 143 143 ILE H H 1 9.33 0.010 . 1 . . . . . . . . 4367 1 692 . 1 1 143 143 ILE CA C 13 60.2 0.5 . 1 . . . . . . . . 4367 1 693 . 1 1 143 143 ILE CB C 13 40.9 0.5 . 1 . . . . . . . . 4367 1 694 . 1 1 143 143 ILE C C 13 176.29 0.09 . 1 . . . . . . . . 4367 1 695 . 1 1 144 144 ILE N N 15 134.0 0.1 . 1 . . . . . . . . 4367 1 696 . 1 1 144 144 ILE H H 1 9.67 0.010 . 1 . . . . . . . . 4367 1 697 . 1 1 144 144 ILE CA C 13 60.9 0.5 . 1 . . . . . . . . 4367 1 698 . 1 1 144 144 ILE CB C 13 40.4 0.5 . 1 . . . . . . . . 4367 1 699 . 1 1 144 144 ILE C C 13 175.07 0.09 . 1 . . . . . . . . 4367 1 700 . 1 1 145 145 THR N N 15 125.6 0.1 . 1 . . . . . . . . 4367 1 701 . 1 1 145 145 THR H H 1 9.26 0.010 . 1 . . . . . . . . 4367 1 702 . 1 1 145 145 THR CA C 13 62.4 0.5 . 1 . . . . . . . . 4367 1 703 . 1 1 145 145 THR CB C 13 68.9 0.5 . 1 . . . . . . . . 4367 1 704 . 1 1 145 145 THR C C 13 175.00 0.09 . 1 . . . . . . . . 4367 1 705 . 1 1 146 146 ARG N N 15 126.7 0.1 . 1 . . . . . . . . 4367 1 706 . 1 1 146 146 ARG H H 1 8.98 0.010 . 1 . . . . . . . . 4367 1 707 . 1 1 146 146 ARG CA C 13 56.3 0.5 . 1 . . . . . . . . 4367 1 708 . 1 1 146 146 ARG CB C 13 30.9 0.5 . 1 . . . . . . . . 4367 1 709 . 1 1 146 146 ARG C C 13 178.06 0.09 . 1 . . . . . . . . 4367 1 710 . 1 1 147 147 ALA N N 15 125.0 0.1 . 1 . . . . . . . . 4367 1 711 . 1 1 147 147 ALA H H 1 8.95 0.010 . 1 . . . . . . . . 4367 1 712 . 1 1 147 147 ALA CA C 13 54.9 0.5 . 1 . . . . . . . . 4367 1 713 . 1 1 147 147 ALA CB C 13 18.4 0.5 . 1 . . . . . . . . 4367 1 714 . 1 1 147 147 ALA C C 13 177.52 0.09 . 1 . . . . . . . . 4367 1 715 . 1 1 148 148 ASP N N 15 113.8 0.1 . 1 . . . . . . . . 4367 1 716 . 1 1 148 148 ASP H H 1 7.26 0.010 . 1 . . . . . . . . 4367 1 717 . 1 1 148 148 ASP CA C 13 53.1 0.5 . 1 . . . . . . . . 4367 1 718 . 1 1 148 148 ASP CB C 13 40.5 0.5 . 1 . . . . . . . . 4367 1 719 . 1 1 148 148 ASP C C 13 177.29 0.09 . 1 . . . . . . . . 4367 1 720 . 1 1 149 149 GLY N N 15 109.3 0.1 . 1 . . . . . . . . 4367 1 721 . 1 1 149 149 GLY H H 1 7.98 0.010 . 1 . . . . . . . . 4367 1 722 . 1 1 149 149 GLY CA C 13 45.3 0.5 . 1 . . . . . . . . 4367 1 723 . 1 1 149 149 GLY C C 13 175.62 0.09 . 1 . . . . . . . . 4367 1 724 . 1 1 150 150 THR N N 15 115.1 0.1 . 1 . . . . . . . . 4367 1 725 . 1 1 150 150 THR H H 1 8.34 0.010 . 1 . . . . . . . . 4367 1 726 . 1 1 150 150 THR CA C 13 62.7 0.5 . 1 . . . . . . . . 4367 1 727 . 1 1 150 150 THR CB C 13 70.5 0.5 . 1 . . . . . . . . 4367 1 728 . 1 1 150 150 THR C C 13 173.46 0.09 . 1 . . . . . . . . 4367 1 729 . 1 1 151 151 ARG N N 15 116.1 0.1 . 1 . . . . . . . . 4367 1 730 . 1 1 151 151 ARG H H 1 8.21 0.010 . 1 . . . . . . . . 4367 1 731 . 1 1 151 151 ARG CA C 13 54.5 0.5 . 1 . . . . . . . . 4367 1 732 . 1 1 151 151 ARG CB C 13 36.1 0.5 . 1 . . . . . . . . 4367 1 733 . 1 1 151 151 ARG C C 13 174.79 0.09 . 1 . . . . . . . . 4367 1 734 . 1 1 152 152 LEU N N 15 123.7 0.1 . 1 . . . . . . . . 4367 1 735 . 1 1 152 152 LEU H H 1 9.12 0.010 . 1 . . . . . . . . 4367 1 736 . 1 1 152 152 LEU CA C 13 53.6 0.5 . 1 . . . . . . . . 4367 1 737 . 1 1 152 152 LEU CB C 13 45.4 0.5 . 1 . . . . . . . . 4367 1 738 . 1 1 152 152 LEU C C 13 174.71 0.09 . 1 . . . . . . . . 4367 1 739 . 1 1 153 153 GLU N N 15 121.8 0.1 . 1 . . . . . . . . 4367 1 740 . 1 1 153 153 GLU H H 1 9.08 0.010 . 1 . . . . . . . . 4367 1 741 . 1 1 153 153 GLU CA C 13 54.5 0.5 . 1 . . . . . . . . 4367 1 742 . 1 1 153 153 GLU CB C 13 32.3 0.5 . 1 . . . . . . . . 4367 1 743 . 1 1 153 153 GLU C C 13 175.22 0.09 . 1 . . . . . . . . 4367 1 744 . 1 1 154 154 TYR N N 15 126.2 0.1 . 1 . . . . . . . . 4367 1 745 . 1 1 154 154 TYR H H 1 9.38 0.010 . 1 . . . . . . . . 4367 1 746 . 1 1 154 154 TYR CA C 13 55.0 0.5 . 1 . . . . . . . . 4367 1 747 . 1 1 154 154 TYR CB C 13 40.2 0.5 . 1 . . . . . . . . 4367 1 748 . 1 1 154 154 TYR C C 13 175.66 0.09 . 1 . . . . . . . . 4367 1 749 . 1 1 155 155 THR N N 15 114.1 0.1 . 1 . . . . . . . . 4367 1 750 . 1 1 155 155 THR H H 1 8.74 0.010 . 1 . . . . . . . . 4367 1 751 . 1 1 155 155 THR CA C 13 59.5 0.5 . 1 . . . . . . . . 4367 1 752 . 1 1 155 155 THR CB C 13 72.3 0.5 . 1 . . . . . . . . 4367 1 753 . 1 1 155 155 THR C C 13 173.70 0.09 . 1 . . . . . . . . 4367 1 754 . 1 1 156 156 GLY N N 15 112.0 0.1 . 1 . . . . . . . . 4367 1 755 . 1 1 156 156 GLY H H 1 8.83 0.010 . 1 . . . . . . . . 4367 1 756 . 1 1 156 156 GLY CA C 13 47.3 0.5 . 1 . . . . . . . . 4367 1 757 . 1 1 156 156 GLY C C 13 175.22 0.09 . 1 . . . . . . . . 4367 1 758 . 1 1 157 157 ILE N N 15 118.8 0.1 . 1 . . . . . . . . 4367 1 759 . 1 1 157 157 ILE H H 1 7.75 0.010 . 1 . . . . . . . . 4367 1 760 . 1 1 157 157 ILE CA C 13 62.4 0.5 . 1 . . . . . . . . 4367 1 761 . 1 1 157 157 ILE CB C 13 37.5 0.5 . 1 . . . . . . . . 4367 1 762 . 1 1 157 157 ILE C C 13 177.63 0.09 . 1 . . . . . . . . 4367 1 763 . 1 1 158 158 LYS N N 15 129.5 0.1 . 1 . . . . . . . . 4367 1 764 . 1 1 158 158 LYS H H 1 8.88 0.010 . 1 . . . . . . . . 4367 1 765 . 1 1 158 158 LYS CA C 13 54.8 0.5 . 1 . . . . . . . . 4367 1 766 . 1 1 158 158 LYS CB C 13 35.1 0.5 . 1 . . . . . . . . 4367 1 767 . 1 1 158 158 LYS C C 13 179.60 0.09 . 1 . . . . . . . . 4367 1 768 . 1 1 159 159 SER N N 15 118.1 0.1 . 1 . . . . . . . . 4367 1 769 . 1 1 159 159 SER H H 1 8.62 0.010 . 1 . . . . . . . . 4367 1 770 . 1 1 159 159 SER CA C 13 61.4 0.5 . 1 . . . . . . . . 4367 1 771 . 1 1 159 159 SER CB C 13 62.9 0.5 . 1 . . . . . . . . 4367 1 772 . 1 1 159 159 SER C C 13 174.50 0.09 . 1 . . . . . . . . 4367 1 773 . 1 1 160 160 ASP N N 15 118.8 0.1 . 1 . . . . . . . . 4367 1 774 . 1 1 160 160 ASP H H 1 7.59 0.010 . 1 . . . . . . . . 4367 1 775 . 1 1 160 160 ASP CA C 13 53.3 0.5 . 1 . . . . . . . . 4367 1 776 . 1 1 160 160 ASP CB C 13 39.8 0.5 . 1 . . . . . . . . 4367 1 777 . 1 1 160 160 ASP C C 13 177.36 0.09 . 1 . . . . . . . . 4367 1 778 . 1 1 161 161 GLY N N 15 110.6 0.1 . 1 . . . . . . . . 4367 1 779 . 1 1 161 161 GLY H H 1 8.32 0.010 . 1 . . . . . . . . 4367 1 780 . 1 1 161 161 GLY CA C 13 45.0 0.5 . 1 . . . . . . . . 4367 1 781 . 1 1 161 161 GLY C C 13 172.64 0.09 . 1 . . . . . . . . 4367 1 782 . 1 1 162 162 SER N N 15 115.5 0.1 . 1 . . . . . . . . 4367 1 783 . 1 1 162 162 SER H H 1 7.86 0.010 . 1 . . . . . . . . 4367 1 784 . 1 1 162 162 SER CA C 13 57.2 0.5 . 1 . . . . . . . . 4367 1 785 . 1 1 162 162 SER CB C 13 65.3 0.5 . 1 . . . . . . . . 4367 1 786 . 1 1 162 162 SER C C 13 173.35 0.09 . 1 . . . . . . . . 4367 1 787 . 1 1 163 163 GLY N N 15 104.7 0.1 . 1 . . . . . . . . 4367 1 788 . 1 1 163 163 GLY H H 1 8.25 0.010 . 1 . . . . . . . . 4367 1 789 . 1 1 163 163 GLY CA C 13 46.2 0.5 . 1 . . . . . . . . 4367 1 790 . 1 1 163 163 GLY C C 13 172.72 0.09 . 1 . . . . . . . . 4367 1 791 . 1 1 164 164 LYS N N 15 124.7 0.1 . 1 . . . . . . . . 4367 1 792 . 1 1 164 164 LYS H H 1 8.95 0.010 . 1 . . . . . . . . 4367 1 793 . 1 1 164 164 LYS CA C 13 56.1 0.5 . 1 . . . . . . . . 4367 1 794 . 1 1 164 164 LYS CB C 13 33.6 0.5 . 1 . . . . . . . . 4367 1 795 . 1 1 164 164 LYS C C 13 174.87 0.09 . 1 . . . . . . . . 4367 1 796 . 1 1 165 165 ALA N N 15 123.5 0.1 . 1 . . . . . . . . 4367 1 797 . 1 1 165 165 ALA H H 1 7.92 0.010 . 1 . . . . . . . . 4367 1 798 . 1 1 165 165 ALA CA C 13 50.1 0.5 . 1 . . . . . . . . 4367 1 799 . 1 1 165 165 ALA CB C 13 25.5 0.5 . 1 . . . . . . . . 4367 1 800 . 1 1 165 165 ALA C C 13 175.81 0.09 . 1 . . . . . . . . 4367 1 801 . 1 1 166 166 LYS N N 15 122.2 0.1 . 1 . . . . . . . . 4367 1 802 . 1 1 166 166 LYS H H 1 8.54 0.010 . 1 . . . . . . . . 4367 1 803 . 1 1 166 166 LYS CA C 13 55.4 0.5 . 1 . . . . . . . . 4367 1 804 . 1 1 166 166 LYS CB C 13 36.7 0.5 . 1 . . . . . . . . 4367 1 805 . 1 1 166 166 LYS C C 13 173.62 0.09 . 1 . . . . . . . . 4367 1 806 . 1 1 167 167 GLU N N 15 128.1 0.1 . 1 . . . . . . . . 4367 1 807 . 1 1 167 167 GLU H H 1 9.54 0.010 . 1 . . . . . . . . 4367 1 808 . 1 1 167 167 GLU CA C 13 54.5 0.5 . 1 . . . . . . . . 4367 1 809 . 1 1 167 167 GLU CB C 13 32.7 0.5 . 1 . . . . . . . . 4367 1 810 . 1 1 167 167 GLU C C 13 174.35 0.09 . 1 . . . . . . . . 4367 1 811 . 1 1 168 168 VAL N N 15 130.6 0.1 . 1 . . . . . . . . 4367 1 812 . 1 1 168 168 VAL H H 1 9.49 0.010 . 1 . . . . . . . . 4367 1 813 . 1 1 168 168 VAL CA C 13 62.8 0.5 . 1 . . . . . . . . 4367 1 814 . 1 1 168 168 VAL CB C 13 31.9 0.5 . 1 . . . . . . . . 4367 1 815 . 1 1 168 168 VAL C C 13 174.90 0.09 . 1 . . . . . . . . 4367 1 816 . 1 1 169 169 LEU N N 15 129.3 0.1 . 1 . . . . . . . . 4367 1 817 . 1 1 169 169 LEU H H 1 7.76 0.010 . 1 . . . . . . . . 4367 1 818 . 1 1 169 169 LEU CA C 13 52.5 0.5 . 1 . . . . . . . . 4367 1 819 . 1 1 169 169 LEU CB C 13 40.7 0.5 . 1 . . . . . . . . 4367 1 820 . 1 1 169 169 LEU C C 13 175.95 0.09 . 1 . . . . . . . . 4367 1 821 . 1 1 170 170 LYS N N 15 120.8 0.1 . 1 . . . . . . . . 4367 1 822 . 1 1 170 170 LYS H H 1 7.87 0.010 . 1 . . . . . . . . 4367 1 823 . 1 1 170 170 LYS CA C 13 57.4 0.5 . 1 . . . . . . . . 4367 1 824 . 1 1 170 170 LYS CB C 13 30.4 0.5 . 1 . . . . . . . . 4367 1 825 . 1 1 170 170 LYS C C 13 176.32 0.09 . 1 . . . . . . . . 4367 1 826 . 1 1 171 171 GLY N N 15 114.1 0.1 . 1 . . . . . . . . 4367 1 827 . 1 1 171 171 GLY H H 1 7.96 0.010 . 1 . . . . . . . . 4367 1 828 . 1 1 171 171 GLY CA C 13 45.4 0.5 . 1 . . . . . . . . 4367 1 829 . 1 1 171 171 GLY C C 13 173.47 0.09 . 1 . . . . . . . . 4367 1 830 . 1 1 172 172 TYR N N 15 114.9 0.1 . 1 . . . . . . . . 4367 1 831 . 1 1 172 172 TYR H H 1 6.77 0.010 . 1 . . . . . . . . 4367 1 832 . 1 1 172 172 TYR CA C 13 55.8 0.5 . 1 . . . . . . . . 4367 1 833 . 1 1 172 172 TYR CB C 13 39.3 0.5 . 1 . . . . . . . . 4367 1 834 . 1 1 172 172 TYR C C 13 171.39 0.09 . 1 . . . . . . . . 4367 1 835 . 1 1 173 173 VAL N N 15 117.1 0.1 . 1 . . . . . . . . 4367 1 836 . 1 1 173 173 VAL H H 1 7.99 0.010 . 1 . . . . . . . . 4367 1 837 . 1 1 173 173 VAL CA C 13 59.6 0.5 . 1 . . . . . . . . 4367 1 838 . 1 1 173 173 VAL CB C 13 35.3 0.5 . 1 . . . . . . . . 4367 1 839 . 1 1 173 173 VAL C C 13 175.10 0.09 . 1 . . . . . . . . 4367 1 840 . 1 1 174 174 LEU N N 15 124.1 0.1 . 1 . . . . . . . . 4367 1 841 . 1 1 174 174 LEU H H 1 8.92 0.010 . 1 . . . . . . . . 4367 1 842 . 1 1 174 174 LEU CA C 13 52.6 0.5 . 1 . . . . . . . . 4367 1 843 . 1 1 174 174 LEU CB C 13 45.4 0.5 . 1 . . . . . . . . 4367 1 844 . 1 1 174 174 LEU C C 13 176.02 0.09 . 1 . . . . . . . . 4367 1 845 . 1 1 175 175 GLU N N 15 122.4 0.1 . 1 . . . . . . . . 4367 1 846 . 1 1 175 175 GLU H H 1 9.48 0.010 . 1 . . . . . . . . 4367 1 847 . 1 1 175 175 GLU CA C 13 55.5 0.5 . 1 . . . . . . . . 4367 1 848 . 1 1 175 175 GLU CB C 13 34.0 0.5 . 1 . . . . . . . . 4367 1 849 . 1 1 175 175 GLU C C 13 176.32 0.09 . 1 . . . . . . . . 4367 1 850 . 1 1 176 176 GLY N N 15 108.9 0.1 . 1 . . . . . . . . 4367 1 851 . 1 1 176 176 GLY H H 1 8.65 0.010 . 1 . . . . . . . . 4367 1 852 . 1 1 176 176 GLY CA C 13 46.5 0.5 . 1 . . . . . . . . 4367 1 853 . 1 1 176 176 GLY C C 13 174.19 0.09 . 1 . . . . . . . . 4367 1 854 . 1 1 177 177 THR N N 15 118.8 0.1 . 1 . . . . . . . . 4367 1 855 . 1 1 177 177 THR H H 1 9.14 0.010 . 1 . . . . . . . . 4367 1 856 . 1 1 177 177 THR CA C 13 60.9 0.5 . 1 . . . . . . . . 4367 1 857 . 1 1 177 177 THR CB C 13 73.2 0.5 . 1 . . . . . . . . 4367 1 858 . 1 1 177 177 THR C C 13 171.51 0.09 . 1 . . . . . . . . 4367 1 859 . 1 1 178 178 LEU N N 15 125.8 0.1 . 1 . . . . . . . . 4367 1 860 . 1 1 178 178 LEU H H 1 8.39 0.010 . 1 . . . . . . . . 4367 1 861 . 1 1 178 178 LEU CA C 13 54.0 0.5 . 1 . . . . . . . . 4367 1 862 . 1 1 178 178 LEU CB C 13 45.1 0.5 . 1 . . . . . . . . 4367 1 863 . 1 1 178 178 LEU C C 13 175.63 0.09 . 1 . . . . . . . . 4367 1 864 . 1 1 179 179 THR N N 15 118.2 0.1 . 1 . . . . . . . . 4367 1 865 . 1 1 179 179 THR H H 1 8.46 0.010 . 1 . . . . . . . . 4367 1 866 . 1 1 179 179 THR CA C 13 60.1 0.5 . 1 . . . . . . . . 4367 1 867 . 1 1 179 179 THR CB C 13 72.8 0.5 . 1 . . . . . . . . 4367 1 868 . 1 1 179 179 THR C C 13 173.68 0.09 . 1 . . . . . . . . 4367 1 869 . 1 1 180 180 ALA N N 15 122.2 0.1 . 1 . . . . . . . . 4367 1 870 . 1 1 180 180 ALA H H 1 8.78 0.010 . 1 . . . . . . . . 4367 1 871 . 1 1 180 180 ALA CA C 13 54.3 0.5 . 1 . . . . . . . . 4367 1 872 . 1 1 180 180 ALA CB C 13 18.2 0.5 . 1 . . . . . . . . 4367 1 873 . 1 1 180 180 ALA C C 13 178.26 0.09 . 1 . . . . . . . . 4367 1 874 . 1 1 181 181 GLU N N 15 113.2 0.1 . 1 . . . . . . . . 4367 1 875 . 1 1 181 181 GLU H H 1 7.92 0.010 . 1 . . . . . . . . 4367 1 876 . 1 1 181 181 GLU CA C 13 57.6 0.5 . 1 . . . . . . . . 4367 1 877 . 1 1 181 181 GLU CB C 13 31.4 0.5 . 1 . . . . . . . . 4367 1 878 . 1 1 181 181 GLU C C 13 176.06 0.09 . 1 . . . . . . . . 4367 1 879 . 1 1 182 182 LYS N N 15 116.7 0.1 . 1 . . . . . . . . 4367 1 880 . 1 1 182 182 LYS H H 1 7.59 0.010 . 1 . . . . . . . . 4367 1 881 . 1 1 182 182 LYS CA C 13 55.8 0.5 . 1 . . . . . . . . 4367 1 882 . 1 1 182 182 LYS CB C 13 34.7 0.5 . 1 . . . . . . . . 4367 1 883 . 1 1 182 182 LYS C C 13 174.38 0.09 . 1 . . . . . . . . 4367 1 884 . 1 1 183 183 THR N N 15 121.0 0.1 . 1 . . . . . . . . 4367 1 885 . 1 1 183 183 THR H H 1 8.65 0.010 . 1 . . . . . . . . 4367 1 886 . 1 1 183 183 THR CA C 13 62.4 0.5 . 1 . . . . . . . . 4367 1 887 . 1 1 183 183 THR CB C 13 70.5 0.5 . 1 . . . . . . . . 4367 1 888 . 1 1 183 183 THR C C 13 173.36 0.09 . 1 . . . . . . . . 4367 1 889 . 1 1 184 184 THR N N 15 125.1 0.1 . 1 . . . . . . . . 4367 1 890 . 1 1 184 184 THR H H 1 9.11 0.010 . 1 . . . . . . . . 4367 1 891 . 1 1 184 184 THR CA C 13 62.3 0.5 . 1 . . . . . . . . 4367 1 892 . 1 1 184 184 THR CB C 13 71.5 0.5 . 1 . . . . . . . . 4367 1 893 . 1 1 184 184 THR C C 13 172.63 0.09 . 1 . . . . . . . . 4367 1 894 . 1 1 185 185 LEU N N 15 131.8 0.1 . 1 . . . . . . . . 4367 1 895 . 1 1 185 185 LEU H H 1 9.30 0.010 . 1 . . . . . . . . 4367 1 896 . 1 1 185 185 LEU CA C 13 53.6 0.5 . 1 . . . . . . . . 4367 1 897 . 1 1 185 185 LEU CB C 13 42.3 0.5 . 1 . . . . . . . . 4367 1 898 . 1 1 185 185 LEU C C 13 175.62 0.09 . 1 . . . . . . . . 4367 1 899 . 1 1 186 186 VAL N N 15 120.9 0.1 . 1 . . . . . . . . 4367 1 900 . 1 1 186 186 VAL H H 1 8.41 0.010 . 1 . . . . . . . . 4367 1 901 . 1 1 186 186 VAL CA C 13 61.0 0.5 . 1 . . . . . . . . 4367 1 902 . 1 1 186 186 VAL CB C 13 36.1 0.5 . 1 . . . . . . . . 4367 1 903 . 1 1 186 186 VAL C C 13 175.61 0.09 . 1 . . . . . . . . 4367 1 904 . 1 1 187 187 VAL N N 15 126.9 0.1 . 1 . . . . . . . . 4367 1 905 . 1 1 187 187 VAL H H 1 9.10 0.010 . 1 . . . . . . . . 4367 1 906 . 1 1 187 187 VAL CA C 13 61.8 0.5 . 1 . . . . . . . . 4367 1 907 . 1 1 187 187 VAL CB C 13 34.9 0.5 . 1 . . . . . . . . 4367 1 908 . 1 1 187 187 VAL C C 13 173.32 0.09 . 1 . . . . . . . . 4367 1 909 . 1 1 188 188 LYS N N 15 127.9 0.1 . 1 . . . . . . . . 4367 1 910 . 1 1 188 188 LYS H H 1 8.41 0.010 . 1 . . . . . . . . 4367 1 911 . 1 1 188 188 LYS CA C 13 54.5 0.5 . 1 . . . . . . . . 4367 1 912 . 1 1 188 188 LYS CB C 13 35.9 0.5 . 1 . . . . . . . . 4367 1 913 . 1 1 188 188 LYS C C 13 175.47 0.09 . 1 . . . . . . . . 4367 1 914 . 1 1 189 189 GLU N N 15 125.3 0.1 . 1 . . . . . . . . 4367 1 915 . 1 1 189 189 GLU H H 1 8.57 0.010 . 1 . . . . . . . . 4367 1 916 . 1 1 189 189 GLU CA C 13 55.4 0.5 . 1 . . . . . . . . 4367 1 917 . 1 1 189 189 GLU CB C 13 32.1 0.5 . 1 . . . . . . . . 4367 1 918 . 1 1 189 189 GLU C C 13 175.88 0.09 . 1 . . . . . . . . 4367 1 919 . 1 1 190 190 GLY N N 15 121.2 0.1 . 1 . . . . . . . . 4367 1 920 . 1 1 190 190 GLY H H 1 9.00 0.010 . 1 . . . . . . . . 4367 1 921 . 1 1 190 190 GLY CA C 13 47.0 0.5 . 1 . . . . . . . . 4367 1 922 . 1 1 190 190 GLY C C 13 175.90 0.09 . 1 . . . . . . . . 4367 1 923 . 1 1 191 191 THR N N 15 119.8 0.1 . 1 . . . . . . . . 4367 1 924 . 1 1 191 191 THR H H 1 8.70 0.010 . 1 . . . . . . . . 4367 1 925 . 1 1 191 191 THR CA C 13 62.8 0.5 . 1 . . . . . . . . 4367 1 926 . 1 1 191 191 THR CB C 13 67.8 0.5 . 1 . . . . . . . . 4367 1 927 . 1 1 191 191 THR C C 13 174.48 0.09 . 1 . . . . . . . . 4367 1 928 . 1 1 192 192 VAL N N 15 126.1 0.1 . 1 . . . . . . . . 4367 1 929 . 1 1 192 192 VAL H H 1 8.33 0.010 . 1 . . . . . . . . 4367 1 930 . 1 1 192 192 VAL CA C 13 62.7 0.5 . 1 . . . . . . . . 4367 1 931 . 1 1 192 192 VAL CB C 13 33.1 0.5 . 1 . . . . . . . . 4367 1 932 . 1 1 192 192 VAL C C 13 175.44 0.09 . 1 . . . . . . . . 4367 1 933 . 1 1 193 193 THR N N 15 123.5 0.1 . 1 . . . . . . . . 4367 1 934 . 1 1 193 193 THR H H 1 9.04 0.010 . 1 . . . . . . . . 4367 1 935 . 1 1 193 193 THR CA C 13 62.5 0.5 . 1 . . . . . . . . 4367 1 936 . 1 1 193 193 THR CB C 13 70.8 0.5 . 1 . . . . . . . . 4367 1 937 . 1 1 193 193 THR C C 13 173.24 0.09 . 1 . . . . . . . . 4367 1 938 . 1 1 194 194 LEU N N 15 134.0 0.1 . 1 . . . . . . . . 4367 1 939 . 1 1 194 194 LEU H H 1 9.53 0.010 . 1 . . . . . . . . 4367 1 940 . 1 1 194 194 LEU CA C 13 54.0 0.5 . 1 . . . . . . . . 4367 1 941 . 1 1 194 194 LEU CB C 13 45.0 0.5 . 1 . . . . . . . . 4367 1 942 . 1 1 194 194 LEU C C 13 174.15 0.09 . 1 . . . . . . . . 4367 1 943 . 1 1 195 195 SER N N 15 122.8 0.1 . 1 . . . . . . . . 4367 1 944 . 1 1 195 195 SER H H 1 8.97 0.010 . 1 . . . . . . . . 4367 1 945 . 1 1 195 195 SER CA C 13 56.6 0.5 . 1 . . . . . . . . 4367 1 946 . 1 1 195 195 SER CB C 13 64.3 0.5 . 1 . . . . . . . . 4367 1 947 . 1 1 195 195 SER C C 13 171.69 0.09 . 1 . . . . . . . . 4367 1 948 . 1 1 196 196 LYS N N 15 128.0 0.1 . 1 . . . . . . . . 4367 1 949 . 1 1 196 196 LYS H H 1 9.50 0.010 . 1 . . . . . . . . 4367 1 950 . 1 1 196 196 LYS CA C 13 54.8 0.5 . 1 . . . . . . . . 4367 1 951 . 1 1 196 196 LYS CB C 13 34.6 0.5 . 1 . . . . . . . . 4367 1 952 . 1 1 196 196 LYS C C 13 173.47 0.09 . 1 . . . . . . . . 4367 1 953 . 1 1 197 197 ASN N N 15 126.9 0.1 . 1 . . . . . . . . 4367 1 954 . 1 1 197 197 ASN H H 1 9.00 0.010 . 1 . . . . . . . . 4367 1 955 . 1 1 197 197 ASN CA C 13 51.7 0.5 . 1 . . . . . . . . 4367 1 956 . 1 1 197 197 ASN CB C 13 41.2 0.5 . 1 . . . . . . . . 4367 1 957 . 1 1 197 197 ASN C C 13 174.41 0.09 . 1 . . . . . . . . 4367 1 958 . 1 1 198 198 ILE N N 15 122.4 0.1 . 1 . . . . . . . . 4367 1 959 . 1 1 198 198 ILE H H 1 9.18 0.010 . 1 . . . . . . . . 4367 1 960 . 1 1 198 198 ILE CA C 13 60.4 0.5 . 1 . . . . . . . . 4367 1 961 . 1 1 198 198 ILE CB C 13 40.8 0.5 . 1 . . . . . . . . 4367 1 962 . 1 1 198 198 ILE C C 13 177.42 0.09 . 1 . . . . . . . . 4367 1 963 . 1 1 199 199 SER N N 15 126.1 0.1 . 1 . . . . . . . . 4367 1 964 . 1 1 199 199 SER H H 1 9.19 0.010 . 1 . . . . . . . . 4367 1 965 . 1 1 199 199 SER CA C 13 58.1 0.5 . 1 . . . . . . . . 4367 1 966 . 1 1 199 199 SER CB C 13 65.0 0.5 . 1 . . . . . . . . 4367 1 967 . 1 1 199 199 SER C C 13 176.13 0.09 . 1 . . . . . . . . 4367 1 968 . 1 1 200 200 LYS N N 15 123.3 0.1 . 1 . . . . . . . . 4367 1 969 . 1 1 200 200 LYS H H 1 8.48 0.010 . 1 . . . . . . . . 4367 1 970 . 1 1 200 200 LYS CA C 13 59.2 0.5 . 1 . . . . . . . . 4367 1 971 . 1 1 200 200 LYS CB C 13 31.9 0.5 . 1 . . . . . . . . 4367 1 972 . 1 1 200 200 LYS C C 13 177.19 0.09 . 1 . . . . . . . . 4367 1 973 . 1 1 201 201 SER N N 15 113.1 0.1 . 1 . . . . . . . . 4367 1 974 . 1 1 201 201 SER H H 1 7.93 0.010 . 1 . . . . . . . . 4367 1 975 . 1 1 201 201 SER CA C 13 57.9 0.5 . 1 . . . . . . . . 4367 1 976 . 1 1 201 201 SER CB C 13 63.6 0.5 . 1 . . . . . . . . 4367 1 977 . 1 1 201 201 SER C C 13 174.99 0.09 . 1 . . . . . . . . 4367 1 978 . 1 1 202 202 GLY N N 15 111.9 0.1 . 1 . . . . . . . . 4367 1 979 . 1 1 202 202 GLY H H 1 8.03 0.010 . 1 . . . . . . . . 4367 1 980 . 1 1 202 202 GLY CA C 13 45.2 0.5 . 1 . . . . . . . . 4367 1 981 . 1 1 202 202 GLY C C 13 173.93 0.09 . 1 . . . . . . . . 4367 1 982 . 1 1 203 203 GLU N N 15 122.0 0.1 . 1 . . . . . . . . 4367 1 983 . 1 1 203 203 GLU H H 1 7.75 0.010 . 1 . . . . . . . . 4367 1 984 . 1 1 203 203 GLU CA C 13 56.9 0.5 . 1 . . . . . . . . 4367 1 985 . 1 1 203 203 GLU CB C 13 30.6 0.5 . 1 . . . . . . . . 4367 1 986 . 1 1 203 203 GLU C C 13 176.52 0.09 . 1 . . . . . . . . 4367 1 987 . 1 1 204 204 VAL N N 15 129.8 0.1 . 1 . . . . . . . . 4367 1 988 . 1 1 204 204 VAL H H 1 8.77 0.010 . 1 . . . . . . . . 4367 1 989 . 1 1 204 204 VAL CA C 13 61.3 0.5 . 1 . . . . . . . . 4367 1 990 . 1 1 204 204 VAL CB C 13 33.8 0.5 . 1 . . . . . . . . 4367 1 991 . 1 1 204 204 VAL C C 13 175.77 0.09 . 1 . . . . . . . . 4367 1 992 . 1 1 205 205 SER N N 15 121.8 0.1 . 1 . . . . . . . . 4367 1 993 . 1 1 205 205 SER H H 1 8.72 0.010 . 1 . . . . . . . . 4367 1 994 . 1 1 205 205 SER CA C 13 57.3 0.5 . 1 . . . . . . . . 4367 1 995 . 1 1 205 205 SER CB C 13 65.1 0.5 . 1 . . . . . . . . 4367 1 996 . 1 1 205 205 SER C C 13 171.16 0.09 . 1 . . . . . . . . 4367 1 997 . 1 1 206 206 VAL N N 15 120.6 0.1 . 1 . . . . . . . . 4367 1 998 . 1 1 206 206 VAL H H 1 3.98 0.010 . 1 . . . . . . . . 4367 1 999 . 1 1 206 206 VAL CA C 13 59.5 0.5 . 1 . . . . . . . . 4367 1 1000 . 1 1 206 206 VAL CB C 13 33.7 0.5 . 1 . . . . . . . . 4367 1 1001 . 1 1 206 206 VAL C C 13 173.07 0.09 . 1 . . . . . . . . 4367 1 1002 . 1 1 207 207 GLU N N 15 124.5 0.1 . 1 . . . . . . . . 4367 1 1003 . 1 1 207 207 GLU H H 1 8.51 0.010 . 1 . . . . . . . . 4367 1 1004 . 1 1 207 207 GLU CA C 13 53.9 0.5 . 1 . . . . . . . . 4367 1 1005 . 1 1 207 207 GLU CB C 13 34.2 0.5 . 1 . . . . . . . . 4367 1 1006 . 1 1 207 207 GLU C C 13 173.29 0.09 . 1 . . . . . . . . 4367 1 1007 . 1 1 208 208 LEU N N 15 124.5 0.1 . 1 . . . . . . . . 4367 1 1008 . 1 1 208 208 LEU H H 1 8.61 0.010 . 1 . . . . . . . . 4367 1 1009 . 1 1 208 208 LEU CA C 13 54.0 0.5 . 1 . . . . . . . . 4367 1 1010 . 1 1 208 208 LEU CB C 13 46.9 0.5 . 1 . . . . . . . . 4367 1 1011 . 1 1 208 208 LEU C C 13 174.77 0.09 . 1 . . . . . . . . 4367 1 1012 . 1 1 209 209 ASN N N 15 125.1 0.1 . 1 . . . . . . . . 4367 1 1013 . 1 1 209 209 ASN H H 1 8.88 0.010 . 1 . . . . . . . . 4367 1 1014 . 1 1 209 209 ASN CA C 13 52.9 0.5 . 1 . . . . . . . . 4367 1 1015 . 1 1 209 209 ASN CB C 13 43.1 0.5 . 1 . . . . . . . . 4367 1 1016 . 1 1 209 209 ASN C C 13 172.19 0.09 . 1 . . . . . . . . 4367 1 1017 . 1 1 210 210 ASP N N 15 126.8 0.1 . 1 . . . . . . . . 4367 1 1018 . 1 1 210 210 ASP H H 1 8.54 0.010 . 1 . . . . . . . . 4367 1 1019 . 1 1 210 210 ASP CA C 13 52.4 0.5 . 1 . . . . . . . . 4367 1 1020 . 1 1 210 210 ASP CB C 13 45.0 0.5 . 1 . . . . . . . . 4367 1 1021 . 1 1 210 210 ASP C C 13 177.37 0.09 . 1 . . . . . . . . 4367 1 1022 . 1 1 211 211 THR N N 15 117.5 0.1 . 1 . . . . . . . . 4367 1 1023 . 1 1 211 211 THR H H 1 8.49 0.010 . 1 . . . . . . . . 4367 1 1024 . 1 1 211 211 THR CA C 13 62.6 0.5 . 1 . . . . . . . . 4367 1 1025 . 1 1 211 211 THR CB C 13 68.5 0.5 . 1 . . . . . . . . 4367 1 1026 . 1 1 211 211 THR C C 13 175.53 0.09 . 1 . . . . . . . . 4367 1 1027 . 1 1 212 212 ASP N N 15 126.8 0.1 . 1 . . . . . . . . 4367 1 1028 . 1 1 212 212 ASP H H 1 8.37 0.010 . 1 . . . . . . . . 4367 1 1029 . 1 1 212 212 ASP CA C 13 55.4 0.5 . 1 . . . . . . . . 4367 1 1030 . 1 1 212 212 ASP CB C 13 41.3 0.5 . 1 . . . . . . . . 4367 1 1031 . 1 1 212 212 ASP C C 13 176.32 0.09 . 1 . . . . . . . . 4367 1 1032 . 1 1 213 213 SER N N 15 121.1 0.1 . 1 . . . . . . . . 4367 1 1033 . 1 1 213 213 SER H H 1 8.18 0.010 . 1 . . . . . . . . 4367 1 1034 . 1 1 213 213 SER CA C 13 58.7 0.5 . 1 . . . . . . . . 4367 1 1035 . 1 1 213 213 SER CB C 13 64.4 0.5 . 1 . . . . . . . . 4367 1 1036 . 1 1 213 213 SER C C 13 175.69 0.09 . 1 . . . . . . . . 4367 1 1037 . 1 1 214 214 SER N N 15 120.7 0.1 . 1 . . . . . . . . 4367 1 1038 . 1 1 214 214 SER H H 1 8.49 0.010 . 1 . . . . . . . . 4367 1 1039 . 1 1 214 214 SER CA C 13 57.3 0.5 . 1 . . . . . . . . 4367 1 1040 . 1 1 214 214 SER CB C 13 63.4 0.5 . 1 . . . . . . . . 4367 1 1041 . 1 1 214 214 SER C C 13 175.05 0.09 . 1 . . . . . . . . 4367 1 1042 . 1 1 215 215 ALA N N 15 131.8 0.1 . 1 . . . . . . . . 4367 1 1043 . 1 1 215 215 ALA H H 1 8.71 0.010 . 1 . . . . . . . . 4367 1 1044 . 1 1 215 215 ALA CA C 13 54.6 0.5 . 1 . . . . . . . . 4367 1 1045 . 1 1 215 215 ALA CB C 13 18.5 0.5 . 1 . . . . . . . . 4367 1 1046 . 1 1 215 215 ALA C C 13 178.99 0.09 . 1 . . . . . . . . 4367 1 1047 . 1 1 216 216 ALA N N 15 118.1 0.1 . 1 . . . . . . . . 4367 1 1048 . 1 1 216 216 ALA H H 1 7.97 0.010 . 1 . . . . . . . . 4367 1 1049 . 1 1 216 216 ALA CA C 13 54.0 0.5 . 1 . . . . . . . . 4367 1 1050 . 1 1 216 216 ALA CB C 13 19.4 0.5 . 1 . . . . . . . . 4367 1 1051 . 1 1 216 216 ALA C C 13 177.86 0.09 . 1 . . . . . . . . 4367 1 1052 . 1 1 217 217 THR N N 15 103.4 0.1 . 1 . . . . . . . . 4367 1 1053 . 1 1 217 217 THR H H 1 6.99 0.010 . 1 . . . . . . . . 4367 1 1054 . 1 1 217 217 THR CA C 13 61.0 0.5 . 1 . . . . . . . . 4367 1 1055 . 1 1 217 217 THR CB C 13 69.8 0.5 . 1 . . . . . . . . 4367 1 1056 . 1 1 217 217 THR C C 13 174.48 0.09 . 1 . . . . . . . . 4367 1 1057 . 1 1 218 218 LYS N N 15 124.3 0.1 . 1 . . . . . . . . 4367 1 1058 . 1 1 218 218 LYS H H 1 7.58 0.010 . 1 . . . . . . . . 4367 1 1059 . 1 1 218 218 LYS CA C 13 57.3 0.5 . 1 . . . . . . . . 4367 1 1060 . 1 1 218 218 LYS CB C 13 33.3 0.5 . 1 . . . . . . . . 4367 1 1061 . 1 1 218 218 LYS C C 13 176.26 0.09 . 1 . . . . . . . . 4367 1 1062 . 1 1 219 219 LYS N N 15 130.3 0.1 . 1 . . . . . . . . 4367 1 1063 . 1 1 219 219 LYS H H 1 10.29 0.010 . 1 . . . . . . . . 4367 1 1064 . 1 1 219 219 LYS CA C 13 56.9 0.5 . 1 . . . . . . . . 4367 1 1065 . 1 1 219 219 LYS CB C 13 33.9 0.5 . 1 . . . . . . . . 4367 1 1066 . 1 1 219 219 LYS C C 13 176.24 0.09 . 1 . . . . . . . . 4367 1 1067 . 1 1 220 220 THR N N 15 113.1 0.1 . 1 . . . . . . . . 4367 1 1068 . 1 1 220 220 THR H H 1 8.57 0.010 . 1 . . . . . . . . 4367 1 1069 . 1 1 220 220 THR CA C 13 60.1 0.5 . 1 . . . . . . . . 4367 1 1070 . 1 1 220 220 THR CB C 13 71.8 0.5 . 1 . . . . . . . . 4367 1 1071 . 1 1 220 220 THR C C 13 172.81 0.09 . 1 . . . . . . . . 4367 1 1072 . 1 1 221 221 ALA N N 15 122.5 0.1 . 1 . . . . . . . . 4367 1 1073 . 1 1 221 221 ALA H H 1 8.83 0.010 . 1 . . . . . . . . 4367 1 1074 . 1 1 221 221 ALA CA C 13 51.1 0.5 . 1 . . . . . . . . 4367 1 1075 . 1 1 221 221 ALA CB C 13 25.7 0.5 . 1 . . . . . . . . 4367 1 1076 . 1 1 221 221 ALA C C 13 175.44 0.09 . 1 . . . . . . . . 4367 1 1077 . 1 1 222 222 ALA N N 15 123.7 0.1 . 1 . . . . . . . . 4367 1 1078 . 1 1 222 222 ALA H H 1 8.25 0.010 . 1 . . . . . . . . 4367 1 1079 . 1 1 222 222 ALA CA C 13 50.7 0.5 . 1 . . . . . . . . 4367 1 1080 . 1 1 222 222 ALA CB C 13 22.4 0.5 . 1 . . . . . . . . 4367 1 1081 . 1 1 222 222 ALA C C 13 175.52 0.09 . 1 . . . . . . . . 4367 1 1082 . 1 1 223 223 TRP N N 15 125.6 0.1 . 1 . . . . . . . . 4367 1 1083 . 1 1 223 223 TRP H H 1 8.90 0.010 . 1 . . . . . . . . 4367 1 1084 . 1 1 223 223 TRP CA C 13 55.2 0.5 . 1 . . . . . . . . 4367 1 1085 . 1 1 223 223 TRP CB C 13 32.3 0.5 . 1 . . . . . . . . 4367 1 1086 . 1 1 223 223 TRP C C 13 174.52 0.09 . 1 . . . . . . . . 4367 1 1087 . 1 1 224 224 ASN N N 15 128.5 0.1 . 1 . . . . . . . . 4367 1 1088 . 1 1 224 224 ASN H H 1 8.13 0.010 . 1 . . . . . . . . 4367 1 1089 . 1 1 224 224 ASN CA C 13 50.9 0.5 . 1 . . . . . . . . 4367 1 1090 . 1 1 224 224 ASN CB C 13 39.4 0.5 . 1 . . . . . . . . 4367 1 1091 . 1 1 224 224 ASN C C 13 174.76 0.09 . 1 . . . . . . . . 4367 1 1092 . 1 1 225 225 SER N N 15 121.2 0.1 . 1 . . . . . . . . 4367 1 1093 . 1 1 225 225 SER H H 1 8.60 0.010 . 1 . . . . . . . . 4367 1 1094 . 1 1 225 225 SER CA C 13 60.9 0.5 . 1 . . . . . . . . 4367 1 1095 . 1 1 225 225 SER CB C 13 63.2 0.5 . 1 . . . . . . . . 4367 1 1096 . 1 1 225 225 SER C C 13 176.68 0.09 . 1 . . . . . . . . 4367 1 1097 . 1 1 226 226 GLY N N 15 110.9 0.1 . 1 . . . . . . . . 4367 1 1098 . 1 1 226 226 GLY H H 1 8.36 0.010 . 1 . . . . . . . . 4367 1 1099 . 1 1 226 226 GLY CA C 13 46.5 0.5 . 1 . . . . . . . . 4367 1 1100 . 1 1 226 226 GLY C C 13 175.44 0.09 . 1 . . . . . . . . 4367 1 1101 . 1 1 227 227 THR N N 15 108.4 0.1 . 1 . . . . . . . . 4367 1 1102 . 1 1 227 227 THR H H 1 7.00 0.010 . 1 . . . . . . . . 4367 1 1103 . 1 1 227 227 THR CA C 13 60.1 0.5 . 1 . . . . . . . . 4367 1 1104 . 1 1 227 227 THR CB C 13 69.4 0.5 . 1 . . . . . . . . 4367 1 1105 . 1 1 227 227 THR C C 13 175.61 0.09 . 1 . . . . . . . . 4367 1 1106 . 1 1 228 228 SER N N 15 122.0 0.1 . 1 . . . . . . . . 4367 1 1107 . 1 1 228 228 SER H H 1 7.57 0.010 . 1 . . . . . . . . 4367 1 1108 . 1 1 228 228 SER CA C 13 59.2 0.5 . 1 . . . . . . . . 4367 1 1109 . 1 1 228 228 SER CB C 13 62.7 0.5 . 1 . . . . . . . . 4367 1 1110 . 1 1 228 228 SER C C 13 172.20 0.09 . 1 . . . . . . . . 4367 1 1111 . 1 1 229 229 THR N N 15 111.4 0.1 . 1 . . . . . . . . 4367 1 1112 . 1 1 229 229 THR H H 1 6.64 0.010 . 1 . . . . . . . . 4367 1 1113 . 1 1 229 229 THR CA C 13 61.6 0.5 . 1 . . . . . . . . 4367 1 1114 . 1 1 229 229 THR CB C 13 71.6 0.5 . 1 . . . . . . . . 4367 1 1115 . 1 1 229 229 THR C C 13 172.69 0.09 . 1 . . . . . . . . 4367 1 1116 . 1 1 230 230 LEU N N 15 134.2 0.1 . 1 . . . . . . . . 4367 1 1117 . 1 1 230 230 LEU H H 1 10.21 0.010 . 1 . . . . . . . . 4367 1 1118 . 1 1 230 230 LEU CA C 13 53.1 0.5 . 1 . . . . . . . . 4367 1 1119 . 1 1 230 230 LEU CB C 13 45.9 0.5 . 1 . . . . . . . . 4367 1 1120 . 1 1 230 230 LEU C C 13 175.30 0.09 . 1 . . . . . . . . 4367 1 1121 . 1 1 231 231 THR N N 15 127.3 0.1 . 1 . . . . . . . . 4367 1 1122 . 1 1 231 231 THR H H 1 9.15 0.010 . 1 . . . . . . . . 4367 1 1123 . 1 1 231 231 THR CA C 13 62.3 0.5 . 1 . . . . . . . . 4367 1 1124 . 1 1 231 231 THR CB C 13 71.3 0.5 . 1 . . . . . . . . 4367 1 1125 . 1 1 231 231 THR C C 13 175.39 0.09 . 1 . . . . . . . . 4367 1 1126 . 1 1 232 232 ILE N N 15 132.8 0.1 . 1 . . . . . . . . 4367 1 1127 . 1 1 232 232 ILE H H 1 9.56 0.010 . 1 . . . . . . . . 4367 1 1128 . 1 1 232 232 ILE CA C 13 61.9 0.5 . 1 . . . . . . . . 4367 1 1129 . 1 1 232 232 ILE CB C 13 39.3 0.5 . 1 . . . . . . . . 4367 1 1130 . 1 1 232 232 ILE C C 13 174.19 0.09 . 1 . . . . . . . . 4367 1 1131 . 1 1 233 233 THR N N 15 125.4 0.1 . 1 . . . . . . . . 4367 1 1132 . 1 1 233 233 THR H H 1 9.15 0.010 . 1 . . . . . . . . 4367 1 1133 . 1 1 233 233 THR CA C 13 61.3 0.5 . 1 . . . . . . . . 4367 1 1134 . 1 1 233 233 THR CB C 13 71.7 0.5 . 1 . . . . . . . . 4367 1 1135 . 1 1 233 233 THR C C 13 173.07 0.09 . 1 . . . . . . . . 4367 1 1136 . 1 1 234 234 VAL N N 15 124.8 0.1 . 1 . . . . . . . . 4367 1 1137 . 1 1 234 234 VAL H H 1 8.61 0.010 . 1 . . . . . . . . 4367 1 1138 . 1 1 234 234 VAL CA C 13 61.9 0.5 . 1 . . . . . . . . 4367 1 1139 . 1 1 234 234 VAL CB C 13 35.7 0.5 . 1 . . . . . . . . 4367 1 1140 . 1 1 234 234 VAL C C 13 177.11 0.09 . 1 . . . . . . . . 4367 1 1141 . 1 1 235 235 ASN N N 15 132.2 0.1 . 1 . . . . . . . . 4367 1 1142 . 1 1 235 235 ASN H H 1 10.13 0.010 . 1 . . . . . . . . 4367 1 1143 . 1 1 235 235 ASN CA C 13 53.6 0.5 . 1 . . . . . . . . 4367 1 1144 . 1 1 235 235 ASN CB C 13 37.0 0.5 . 1 . . . . . . . . 4367 1 1145 . 1 1 235 235 ASN C C 13 175.07 0.09 . 1 . . . . . . . . 4367 1 1146 . 1 1 236 236 SER N N 15 107.1 0.1 . 1 . . . . . . . . 4367 1 1147 . 1 1 236 236 SER H H 1 8.65 0.010 . 1 . . . . . . . . 4367 1 1148 . 1 1 236 236 SER CA C 13 60.4 0.5 . 1 . . . . . . . . 4367 1 1149 . 1 1 236 236 SER CB C 13 62.4 0.5 . 1 . . . . . . . . 4367 1 1150 . 1 1 236 236 SER C C 13 172.77 0.09 . 1 . . . . . . . . 4367 1 1151 . 1 1 237 237 LYS N N 15 123.4 0.1 . 1 . . . . . . . . 4367 1 1152 . 1 1 237 237 LYS H H 1 7.83 0.010 . 1 . . . . . . . . 4367 1 1153 . 1 1 237 237 LYS CA C 13 54.6 0.5 . 1 . . . . . . . . 4367 1 1154 . 1 1 237 237 LYS CB C 13 35.0 0.5 . 1 . . . . . . . . 4367 1 1155 . 1 1 237 237 LYS C C 13 174.90 0.09 . 1 . . . . . . . . 4367 1 1156 . 1 1 238 238 LYS N N 15 126.8 0.1 . 1 . . . . . . . . 4367 1 1157 . 1 1 238 238 LYS H H 1 8.21 0.010 . 1 . . . . . . . . 4367 1 1158 . 1 1 238 238 LYS CA C 13 57.7 0.5 . 1 . . . . . . . . 4367 1 1159 . 1 1 238 238 LYS CB C 13 30.8 0.5 . 1 . . . . . . . . 4367 1 1160 . 1 1 238 238 LYS C C 13 176.69 0.09 . 1 . . . . . . . . 4367 1 1161 . 1 1 239 239 THR N N 15 113.1 0.1 . 1 . . . . . . . . 4367 1 1162 . 1 1 239 239 THR H H 1 9.18 0.010 . 1 . . . . . . . . 4367 1 1163 . 1 1 239 239 THR CA C 13 62.8 0.5 . 1 . . . . . . . . 4367 1 1164 . 1 1 239 239 THR CB C 13 69.5 0.5 . 1 . . . . . . . . 4367 1 1165 . 1 1 239 239 THR C C 13 176.86 0.09 . 1 . . . . . . . . 4367 1 1166 . 1 1 240 240 LYS N N 15 121.3 0.1 . 1 . . . . . . . . 4367 1 1167 . 1 1 240 240 LYS H H 1 7.57 0.010 . 1 . . . . . . . . 4367 1 1168 . 1 1 240 240 LYS CA C 13 56.0 0.5 . 1 . . . . . . . . 4367 1 1169 . 1 1 240 240 LYS CB C 13 36.6 0.5 . 1 . . . . . . . . 4367 1 1170 . 1 1 240 240 LYS C C 13 173.46 0.09 . 1 . . . . . . . . 4367 1 1171 . 1 1 241 241 ASP N N 15 121.9 0.1 . 1 . . . . . . . . 4367 1 1172 . 1 1 241 241 ASP H H 1 8.95 0.010 . 1 . . . . . . . . 4367 1 1173 . 1 1 241 241 ASP CA C 13 53.1 0.5 . 1 . . . . . . . . 4367 1 1174 . 1 1 241 241 ASP CB C 13 43.4 0.5 . 1 . . . . . . . . 4367 1 1175 . 1 1 241 241 ASP C C 13 176.39 0.09 . 1 . . . . . . . . 4367 1 1176 . 1 1 242 242 LEU N N 15 126.3 0.1 . 1 . . . . . . . . 4367 1 1177 . 1 1 242 242 LEU H H 1 9.62 0.010 . 1 . . . . . . . . 4367 1 1178 . 1 1 242 242 LEU CA C 13 53.9 0.5 . 1 . . . . . . . . 4367 1 1179 . 1 1 242 242 LEU CB C 13 44.6 0.5 . 1 . . . . . . . . 4367 1 1180 . 1 1 242 242 LEU C C 13 175.15 0.09 . 1 . . . . . . . . 4367 1 1181 . 1 1 243 243 VAL N N 15 126.3 0.1 . 1 . . . . . . . . 4367 1 1182 . 1 1 243 243 VAL H H 1 8.70 0.010 . 1 . . . . . . . . 4367 1 1183 . 1 1 243 243 VAL CA C 13 61.7 0.5 . 1 . . . . . . . . 4367 1 1184 . 1 1 243 243 VAL CB C 13 32.3 0.5 . 1 . . . . . . . . 4367 1 1185 . 1 1 243 243 VAL C C 13 174.74 0.09 . 1 . . . . . . . . 4367 1 1186 . 1 1 244 244 PHE N N 15 129.2 0.1 . 1 . . . . . . . . 4367 1 1187 . 1 1 244 244 PHE H H 1 8.72 0.010 . 1 . . . . . . . . 4367 1 1188 . 1 1 244 244 PHE CA C 13 56.7 0.5 . 1 . . . . . . . . 4367 1 1189 . 1 1 244 244 PHE CB C 13 38.0 0.5 . 1 . . . . . . . . 4367 1 1190 . 1 1 244 244 PHE C C 13 176.68 0.09 . 1 . . . . . . . . 4367 1 1191 . 1 1 245 245 THR N N 15 114.6 0.1 . 1 . . . . . . . . 4367 1 1192 . 1 1 245 245 THR H H 1 8.53 0.010 . 1 . . . . . . . . 4367 1 1193 . 1 1 245 245 THR CA C 13 61.9 0.5 . 1 . . . . . . . . 4367 1 1194 . 1 1 245 245 THR CB C 13 71.4 0.5 . 1 . . . . . . . . 4367 1 1195 . 1 1 245 245 THR C C 13 177.59 0.09 . 1 . . . . . . . . 4367 1 1196 . 1 1 246 246 LYS N N 15 121.7 0.1 . 1 . . . . . . . . 4367 1 1197 . 1 1 246 246 LYS H H 1 8.91 0.010 . 1 . . . . . . . . 4367 1 1198 . 1 1 246 246 LYS CA C 13 57.6 0.5 . 1 . . . . . . . . 4367 1 1199 . 1 1 246 246 LYS CB C 13 31.8 0.5 . 1 . . . . . . . . 4367 1 1200 . 1 1 246 246 LYS C C 13 176.90 0.09 . 1 . . . . . . . . 4367 1 1201 . 1 1 247 247 GLU N N 15 118.5 0.1 . 1 . . . . . . . . 4367 1 1202 . 1 1 247 247 GLU H H 1 7.60 0.010 . 1 . . . . . . . . 4367 1 1203 . 1 1 247 247 GLU CA C 13 56.3 0.5 . 1 . . . . . . . . 4367 1 1204 . 1 1 247 247 GLU CB C 13 28.5 0.5 . 1 . . . . . . . . 4367 1 1205 . 1 1 247 247 GLU C C 13 174.16 0.09 . 1 . . . . . . . . 4367 1 1206 . 1 1 248 248 ASN N N 15 112.3 0.1 . 1 . . . . . . . . 4367 1 1207 . 1 1 248 248 ASN H H 1 7.78 0.010 . 1 . . . . . . . . 4367 1 1208 . 1 1 248 248 ASN CA C 13 55.4 0.5 . 1 . . . . . . . . 4367 1 1209 . 1 1 248 248 ASN CB C 13 36.6 0.5 . 1 . . . . . . . . 4367 1 1210 . 1 1 248 248 ASN C C 13 174.17 0.09 . 1 . . . . . . . . 4367 1 1211 . 1 1 249 249 THR N N 15 108.3 0.1 . 1 . . . . . . . . 4367 1 1212 . 1 1 249 249 THR H H 1 7.33 0.010 . 1 . . . . . . . . 4367 1 1213 . 1 1 249 249 THR CA C 13 58.7 0.5 . 1 . . . . . . . . 4367 1 1214 . 1 1 249 249 THR CB C 13 72.2 0.5 . 1 . . . . . . . . 4367 1 1215 . 1 1 249 249 THR C C 13 173.22 0.09 . 1 . . . . . . . . 4367 1 1216 . 1 1 250 250 ILE N N 15 122.5 0.1 . 1 . . . . . . . . 4367 1 1217 . 1 1 250 250 ILE H H 1 8.41 0.010 . 1 . . . . . . . . 4367 1 1218 . 1 1 250 250 ILE CA C 13 59.7 0.5 . 1 . . . . . . . . 4367 1 1219 . 1 1 250 250 ILE CB C 13 41.3 0.5 . 1 . . . . . . . . 4367 1 1220 . 1 1 250 250 ILE C C 13 175.88 0.09 . 1 . . . . . . . . 4367 1 1221 . 1 1 251 251 THR N N 15 117.4 0.1 . 1 . . . . . . . . 4367 1 1222 . 1 1 251 251 THR H H 1 8.97 0.010 . 1 . . . . . . . . 4367 1 1223 . 1 1 251 251 THR CA C 13 59.0 0.5 . 1 . . . . . . . . 4367 1 1224 . 1 1 251 251 THR CB C 13 71.4 0.5 . 1 . . . . . . . . 4367 1 1225 . 1 1 251 251 THR C C 13 173.20 0.09 . 1 . . . . . . . . 4367 1 1226 . 1 1 252 252 VAL N N 15 120.9 0.1 . 1 . . . . . . . . 4367 1 1227 . 1 1 252 252 VAL H H 1 9.03 0.010 . 1 . . . . . . . . 4367 1 1228 . 1 1 252 252 VAL CA C 13 59.5 0.5 . 1 . . . . . . . . 4367 1 1229 . 1 1 252 252 VAL CB C 13 35.6 0.5 . 1 . . . . . . . . 4367 1 1230 . 1 1 252 252 VAL C C 13 173.83 0.09 . 1 . . . . . . . . 4367 1 1231 . 1 1 253 253 GLN N N 15 129.1 0.1 . 1 . . . . . . . . 4367 1 1232 . 1 1 253 253 GLN H H 1 8.47 0.010 . 1 . . . . . . . . 4367 1 1233 . 1 1 253 253 GLN CA C 13 55.7 0.5 . 1 . . . . . . . . 4367 1 1234 . 1 1 253 253 GLN CB C 13 31.6 0.5 . 1 . . . . . . . . 4367 1 1235 . 1 1 253 253 GLN C C 13 173.47 0.09 . 1 . . . . . . . . 4367 1 1236 . 1 1 254 254 GLN N N 15 125.9 0.1 . 1 . . . . . . . . 4367 1 1237 . 1 1 254 254 GLN H H 1 8.78 0.010 . 1 . . . . . . . . 4367 1 1238 . 1 1 254 254 GLN CA C 13 55.4 0.5 . 1 . . . . . . . . 4367 1 1239 . 1 1 254 254 GLN CB C 13 31.0 0.5 . 1 . . . . . . . . 4367 1 1240 . 1 1 254 254 GLN C C 13 175.23 0.09 . 1 . . . . . . . . 4367 1 1241 . 1 1 255 255 TYR N N 15 120.1 0.1 . 1 . . . . . . . . 4367 1 1242 . 1 1 255 255 TYR H H 1 7.58 0.010 . 1 . . . . . . . . 4367 1 1243 . 1 1 255 255 TYR CA C 13 58.2 0.5 . 1 . . . . . . . . 4367 1 1244 . 1 1 255 255 TYR CB C 13 41.5 0.5 . 1 . . . . . . . . 4367 1 1245 . 1 1 255 255 TYR C C 13 176.80 0.09 . 1 . . . . . . . . 4367 1 1246 . 1 1 256 256 ASP N N 15 119.3 0.1 . 1 . . . . . . . . 4367 1 1247 . 1 1 256 256 ASP H H 1 8.87 0.010 . 1 . . . . . . . . 4367 1 1248 . 1 1 256 256 ASP CA C 13 53.5 0.5 . 1 . . . . . . . . 4367 1 1249 . 1 1 256 256 ASP CB C 13 41.3 0.5 . 1 . . . . . . . . 4367 1 1250 . 1 1 256 256 ASP C C 13 177.41 0.09 . 1 . . . . . . . . 4367 1 1251 . 1 1 257 257 SER N N 15 116.7 0.1 . 1 . . . . . . . . 4367 1 1252 . 1 1 257 257 SER H H 1 8.73 0.010 . 1 . . . . . . . . 4367 1 1253 . 1 1 257 257 SER CA C 13 61.4 0.5 . 1 . . . . . . . . 4367 1 1254 . 1 1 257 257 SER CB C 13 63.0 0.5 . 1 . . . . . . . . 4367 1 1255 . 1 1 257 257 SER C C 13 175.08 0.09 . 1 . . . . . . . . 4367 1 1256 . 1 1 258 258 ASN N N 15 117.5 0.1 . 1 . . . . . . . . 4367 1 1257 . 1 1 258 258 ASN H H 1 7.91 0.010 . 1 . . . . . . . . 4367 1 1258 . 1 1 258 258 ASN CA C 13 53.4 0.5 . 1 . . . . . . . . 4367 1 1259 . 1 1 258 258 ASN CB C 13 39.5 0.5 . 1 . . . . . . . . 4367 1 1260 . 1 1 258 258 ASN C C 13 175.88 0.09 . 1 . . . . . . . . 4367 1 1261 . 1 1 259 259 GLY N N 15 111.3 0.1 . 1 . . . . . . . . 4367 1 1262 . 1 1 259 259 GLY H H 1 8.39 0.010 . 1 . . . . . . . . 4367 1 1263 . 1 1 259 259 GLY CA C 13 46.8 0.5 . 1 . . . . . . . . 4367 1 1264 . 1 1 259 259 GLY C C 13 174.80 0.09 . 1 . . . . . . . . 4367 1 1265 . 1 1 260 260 THR N N 15 114.6 0.1 . 1 . . . . . . . . 4367 1 1266 . 1 1 260 260 THR H H 1 9.34 0.010 . 1 . . . . . . . . 4367 1 1267 . 1 1 260 260 THR CA C 13 63.3 0.5 . 1 . . . . . . . . 4367 1 1268 . 1 1 260 260 THR CB C 13 70.3 0.5 . 1 . . . . . . . . 4367 1 1269 . 1 1 260 260 THR C C 13 174.62 0.09 . 1 . . . . . . . . 4367 1 1270 . 1 1 261 261 LYS N N 15 123.5 0.1 . 1 . . . . . . . . 4367 1 1271 . 1 1 261 261 LYS H H 1 8.39 0.010 . 1 . . . . . . . . 4367 1 1272 . 1 1 261 261 LYS CA C 13 54.9 0.5 . 1 . . . . . . . . 4367 1 1273 . 1 1 261 261 LYS CB C 13 35.2 0.5 . 1 . . . . . . . . 4367 1 1274 . 1 1 261 261 LYS C C 13 174.41 0.09 . 1 . . . . . . . . 4367 1 1275 . 1 1 262 262 LEU N N 15 124.2 0.1 . 1 . . . . . . . . 4367 1 1276 . 1 1 262 262 LEU H H 1 8.05 0.010 . 1 . . . . . . . . 4367 1 1277 . 1 1 262 262 LEU CA C 13 55.3 0.5 . 1 . . . . . . . . 4367 1 1278 . 1 1 262 262 LEU CB C 13 42.7 0.5 . 1 . . . . . . . . 4367 1 1279 . 1 1 262 262 LEU C C 13 177.03 0.09 . 1 . . . . . . . . 4367 1 1280 . 1 1 263 263 GLU N N 15 123.0 0.1 . 1 . . . . . . . . 4367 1 1281 . 1 1 263 263 GLU H H 1 8.62 0.010 . 1 . . . . . . . . 4367 1 1282 . 1 1 263 263 GLU CA C 13 54.7 0.5 . 1 . . . . . . . . 4367 1 1283 . 1 1 263 263 GLU CB C 13 33.1 0.5 . 1 . . . . . . . . 4367 1 1284 . 1 1 263 263 GLU C C 13 177.69 0.09 . 1 . . . . . . . . 4367 1 1285 . 1 1 264 264 GLY N N 15 113.0 0.1 . 1 . . . . . . . . 4367 1 1286 . 1 1 264 264 GLY H H 1 8.69 0.010 . 1 . . . . . . . . 4367 1 1287 . 1 1 264 264 GLY CA C 13 46.5 0.5 . 1 . . . . . . . . 4367 1 1288 . 1 1 264 264 GLY C C 13 173.58 0.09 . 1 . . . . . . . . 4367 1 1289 . 1 1 265 265 SER N N 15 118.5 0.1 . 1 . . . . . . . . 4367 1 1290 . 1 1 265 265 SER H H 1 8.12 0.010 . 1 . . . . . . . . 4367 1 1291 . 1 1 265 265 SER CA C 13 57.1 0.5 . 1 . . . . . . . . 4367 1 1292 . 1 1 265 265 SER CB C 13 65.6 0.5 . 1 . . . . . . . . 4367 1 1293 . 1 1 265 265 SER C C 13 173.12 0.09 . 1 . . . . . . . . 4367 1 1294 . 1 1 266 266 ALA N N 15 126.9 0.1 . 1 . . . . . . . . 4367 1 1295 . 1 1 266 266 ALA H H 1 8.44 0.010 . 1 . . . . . . . . 4367 1 1296 . 1 1 266 266 ALA CA C 13 52.2 0.5 . 1 . . . . . . . . 4367 1 1297 . 1 1 266 266 ALA CB C 13 18.7 0.5 . 1 . . . . . . . . 4367 1 1298 . 1 1 266 266 ALA C C 13 177.41 0.09 . 1 . . . . . . . . 4367 1 1299 . 1 1 267 267 VAL N N 15 123.6 0.1 . 1 . . . . . . . . 4367 1 1300 . 1 1 267 267 VAL H H 1 8.64 0.010 . 1 . . . . . . . . 4367 1 1301 . 1 1 267 267 VAL CA C 13 61.0 0.5 . 1 . . . . . . . . 4367 1 1302 . 1 1 267 267 VAL CB C 13 34.7 0.5 . 1 . . . . . . . . 4367 1 1303 . 1 1 267 267 VAL C C 13 175.08 0.09 . 1 . . . . . . . . 4367 1 1304 . 1 1 268 268 GLU N N 15 127.9 0.1 . 1 . . . . . . . . 4367 1 1305 . 1 1 268 268 GLU H H 1 8.55 0.010 . 1 . . . . . . . . 4367 1 1306 . 1 1 268 268 GLU CA C 13 56.7 0.5 . 1 . . . . . . . . 4367 1 1307 . 1 1 268 268 GLU CB C 13 31.0 0.5 . 1 . . . . . . . . 4367 1 1308 . 1 1 268 268 GLU C C 13 176.26 0.09 . 1 . . . . . . . . 4367 1 1309 . 1 1 269 269 ILE N N 15 129.2 0.1 . 1 . . . . . . . . 4367 1 1310 . 1 1 269 269 ILE H H 1 8.87 0.010 . 1 . . . . . . . . 4367 1 1311 . 1 1 269 269 ILE CA C 13 61.0 0.5 . 1 . . . . . . . . 4367 1 1312 . 1 1 269 269 ILE CB C 13 37.6 0.5 . 1 . . . . . . . . 4367 1 1313 . 1 1 269 269 ILE C C 13 177.10 0.09 . 1 . . . . . . . . 4367 1 1314 . 1 1 270 270 THR N N 15 118.3 0.1 . 1 . . . . . . . . 4367 1 1315 . 1 1 270 270 THR H H 1 9.38 0.010 . 1 . . . . . . . . 4367 1 1316 . 1 1 270 270 THR CA C 13 61.8 0.5 . 1 . . . . . . . . 4367 1 1317 . 1 1 270 270 THR CB C 13 71.4 0.5 . 1 . . . . . . . . 4367 1 1318 . 1 1 270 270 THR C C 13 173.23 0.09 . 1 . . . . . . . . 4367 1 1319 . 1 1 271 271 LYS N N 15 118.1 0.1 . 1 . . . . . . . . 4367 1 1320 . 1 1 271 271 LYS H H 1 7.28 0.010 . 1 . . . . . . . . 4367 1 1321 . 1 1 271 271 LYS CA C 13 54.6 0.5 . 1 . . . . . . . . 4367 1 1322 . 1 1 271 271 LYS CB C 13 36.0 0.5 . 1 . . . . . . . . 4367 1 1323 . 1 1 271 271 LYS C C 13 176.41 0.09 . 1 . . . . . . . . 4367 1 1324 . 1 1 272 272 LEU N N 15 126.0 0.1 . 1 . . . . . . . . 4367 1 1325 . 1 1 272 272 LEU H H 1 8.94 0.010 . 1 . . . . . . . . 4367 1 1326 . 1 1 272 272 LEU CA C 13 58.1 0.5 . 1 . . . . . . . . 4367 1 1327 . 1 1 272 272 LEU CB C 13 41.9 0.5 . 1 . . . . . . . . 4367 1 1328 . 1 1 272 272 LEU C C 13 179.42 0.09 . 1 . . . . . . . . 4367 1 1329 . 1 1 273 273 ASP N N 15 116.4 0.1 . 1 . . . . . . . . 4367 1 1330 . 1 1 273 273 ASP H H 1 8.81 0.010 . 1 . . . . . . . . 4367 1 1331 . 1 1 273 273 ASP CA C 13 57.2 0.5 . 1 . . . . . . . . 4367 1 1332 . 1 1 273 273 ASP CB C 13 40.4 0.5 . 1 . . . . . . . . 4367 1 1333 . 1 1 273 273 ASP C C 13 178.06 0.09 . 1 . . . . . . . . 4367 1 1334 . 1 1 274 274 GLU N N 15 117.0 0.1 . 1 . . . . . . . . 4367 1 1335 . 1 1 274 274 GLU H H 1 7.23 0.010 . 1 . . . . . . . . 4367 1 1336 . 1 1 274 274 GLU CA C 13 58.6 0.5 . 1 . . . . . . . . 4367 1 1337 . 1 1 274 274 GLU CB C 13 30.8 0.5 . 1 . . . . . . . . 4367 1 1338 . 1 1 274 274 GLU C C 13 179.60 0.09 . 1 . . . . . . . . 4367 1 1339 . 1 1 275 275 ILE N N 15 121.2 0.1 . 1 . . . . . . . . 4367 1 1340 . 1 1 275 275 ILE H H 1 7.33 0.010 . 1 . . . . . . . . 4367 1 1341 . 1 1 275 275 ILE CA C 13 64.7 0.5 . 1 . . . . . . . . 4367 1 1342 . 1 1 275 275 ILE CB C 13 37.6 0.5 . 1 . . . . . . . . 4367 1 1343 . 1 1 275 275 ILE C C 13 176.94 0.09 . 1 . . . . . . . . 4367 1 1344 . 1 1 276 276 LYS N N 15 118.9 0.1 . 1 . . . . . . . . 4367 1 1345 . 1 1 276 276 LYS H H 1 7.42 0.010 . 1 . . . . . . . . 4367 1 1346 . 1 1 276 276 LYS CA C 13 61.1 0.5 . 1 . . . . . . . . 4367 1 1347 . 1 1 276 276 LYS CB C 13 31.5 0.5 . 1 . . . . . . . . 4367 1 1348 . 1 1 276 276 LYS C C 13 178.92 0.09 . 1 . . . . . . . . 4367 1 1349 . 1 1 277 277 ASN N N 15 115.6 0.1 . 1 . . . . . . . . 4367 1 1350 . 1 1 277 277 ASN H H 1 8.03 0.010 . 1 . . . . . . . . 4367 1 1351 . 1 1 277 277 ASN CA C 13 55.8 0.5 . 1 . . . . . . . . 4367 1 1352 . 1 1 277 277 ASN CB C 13 38.3 0.5 . 1 . . . . . . . . 4367 1 1353 . 1 1 277 277 ASN C C 13 177.64 0.09 . 1 . . . . . . . . 4367 1 1354 . 1 1 278 278 ALA N N 15 122.2 0.1 . 1 . . . . . . . . 4367 1 1355 . 1 1 278 278 ALA H H 1 7.39 0.010 . 1 . . . . . . . . 4367 1 1356 . 1 1 278 278 ALA CA C 13 53.9 0.5 . 1 . . . . . . . . 4367 1 1357 . 1 1 278 278 ALA CB C 13 17.6 0.5 . 1 . . . . . . . . 4367 1 1358 . 1 1 278 278 ALA C C 13 177.17 0.09 . 1 . . . . . . . . 4367 1 1359 . 1 1 279 279 LEU N N 15 117.3 0.1 . 1 . . . . . . . . 4367 1 1360 . 1 1 279 279 LEU H H 1 7.31 0.010 . 1 . . . . . . . . 4367 1 1361 . 1 1 279 279 LEU CA C 13 54.1 0.5 . 1 . . . . . . . . 4367 1 1362 . 1 1 279 279 LEU CB C 13 41.6 0.5 . 1 . . . . . . . . 4367 1 1363 . 1 1 279 279 LEU C C 13 175.62 0.09 . 1 . . . . . . . . 4367 1 1364 . 1 1 280 280 LYS N N 15 124.6 0.1 . 1 . . . . . . . . 4367 1 1365 . 1 1 280 280 LYS H H 1 6.88 0.010 . 1 . . . . . . . . 4367 1 1366 . 1 1 280 280 LYS CA C 13 59.1 0.5 . 1 . . . . . . . . 4367 1 1367 . 1 1 280 280 LYS CB C 13 33.8 0.5 . 1 . . . . . . . . 4367 1 stop_ save_