data_4076 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4076 _Entry.Title ; 1H, 15N, 13C Chemical Shift Assignments of Outer Surface Protein A from Borrelia burgdorferi ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 1997-11-26 _Entry.Accession_date 1997-11-28 _Entry.Last_release_date 1998-12-17 _Entry.Original_release_date 1998-12-17 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Thuy-Nga Pham . . . 4076 2 Shohei Koide . . . 4076 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4076 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 1041 4076 '15N chemical shifts' 254 4076 '1H chemical shifts' 930 4076 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 . . 1998-12-17 1997-11-26 original author . 4076 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4076 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 98356289 _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; Pham, T-N., and Koide, S., "NMR Studies of Borrelia burgdorferi OspA, a 28 KDa Protein Containing a Single-Layer Beta-sheet," J. Biomol. NMR 11, 407-414 (1998) ; _Citation.Title ; NMR Studies of Borrelia burgdorferi OspA, a 28 kDa Protein Containing a Single-Layer Beta-sheet ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 11 _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 407 _Citation.Page_last 414 _Citation.Year 1998 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Thuy-Nga Pham . . . 4076 1 2 Shohei Koide . . . 4076 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID antigen 4076 1 beta-sheet 4076 1 'large proteins' 4076 1 'Lyme disease' 4076 1 'Outer Surface Protein A' 4076 1 'triple resonance' 4076 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_OspA _Assembly.Sf_category assembly _Assembly.Sf_framecode system_OspA _Assembly.Entry_ID 4076 _Assembly.ID 1 _Assembly.Name 'Outer Surface Protein A' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4076 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 1 $OspA . . . native . . . . . 4076 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1FJ1 . 'E Chain E, Lyme Disease Antigen Ospa In Complex With Neutralizing Antibody Fab La-2' . . . . 4076 1 . PDB 1OSP . 'O Chain O, Crystal Structure Of Outer Surface Protein A Of Borrelia Burgdorferi Complexed With A Murine Monoclonal Antibody Fab' . . . . 4076 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID OspA abbreviation 4076 1 'Outer Surface Protein A' system 4076 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_OspA _Entity.Sf_category entity _Entity.Sf_framecode OspA _Entity.Entry_ID 4076 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Outer Surface Protein A' _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 KDKSSTEEKFNEKGEVSEKI ITRADGTRLEYTGIKSDGSG KAKEVLKGYVLEGTLTAEKT TLVVKEGTVTLSKNISKSGE VSVELNDTDSSAATKKTAAW NSGTSTLTITVNSKKTKDLV FTKENTITVQQYDSNGTKLE GSAVEITKLDEIKNALK ; _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 257 _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 27555 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 4077 . "Outer Surface Protein A" . . . . . 100.00 257 100.00 100.00 5.14e-171 . . . . 4076 1 2 no PDB 1FJ1 . "Lyme Disease Antigen Ospa In Complex With Neutralizing Antibody Fab La-2" . . . . . 100.00 257 99.61 99.61 1.75e-170 . . . . 4076 1 3 no PDB 1OSP . "Crystal Structure Of Outer Surface Protein A Of Borrelia Burgdorferi Complexed With A Murine Monoclonal Antibody Fab" . . . . . 100.00 257 99.61 99.61 1.75e-170 . . . . 4076 1 4 no EMBL CAA32579 . "ospA [Borrelia burgdorferi]" . . . . . 100.00 273 99.61 99.61 7.31e-170 . . . . 4076 1 5 no EMBL CAA34487 . "unnamed protein product [Borrelia burgdorferi ZS7]" . . . . . 100.00 273 98.44 98.44 5.40e-167 . . . . 4076 1 6 no EMBL CAA49314 . "0spA [Borrelia burgdorferi]" . . . . . 100.00 273 99.61 99.61 7.31e-170 . . . . 4076 1 7 no EMBL CAA56467 . "ospA [Borrelia burgdorferi]" . . . . . 100.00 273 99.61 99.61 7.31e-170 . . . . 4076 1 8 no EMBL CAA59729 . "outer surface protein A [Borrelia burgdorferi 297]" . . . . . 100.00 273 99.22 99.22 1.49e-168 . . . . 4076 1 9 no GB AAA20947 . "OspA, partial [Borrelia burgdorferi]" . . . . . 97.28 250 100.00 100.00 1.16e-165 . . . . 4076 1 10 no GB AAA20949 . "OspA, partial [Borrelia burgdorferi]" . . . . . 97.28 250 99.20 99.20 8.80e-164 . . . . 4076 1 11 no GB AAA20951 . "OspA, partial [Borrelia burgdorferi]" . . . . . 97.28 250 100.00 100.00 1.16e-165 . . . . 4076 1 12 no GB AAA20953 . "OspA, partial [Borrelia burgdorferi]" . . . . . 97.28 250 98.80 99.20 3.94e-163 . . . . 4076 1 13 no GB AAA20955 . "OspA, partial [Borrelia burgdorferi]" . . . . . 97.28 250 100.00 100.00 1.16e-165 . . . . 4076 1 14 no REF NP_045688 . "outer surface protein A [Borrelia burgdorferi B31]" . . . . . 100.00 273 99.61 99.61 7.31e-170 . . . . 4076 1 15 no REF WP_010258120 . "outer surface protein A (ospA) [Borrelia burgdorferi]" . . . . . 100.00 273 99.22 99.22 1.49e-168 . . . . 4076 1 16 no REF WP_010890378 . "outer surface protein A [Borrelia burgdorferi]" . . . . . 100.00 273 99.61 99.61 7.31e-170 . . . . 4076 1 17 no REF WP_012615002 . "outer surface protein A [Borrelia burgdorferi]" . . . . . 100.00 273 98.44 98.44 5.40e-167 . . . . 4076 1 18 no REF WP_012665570 . "outer surface protein A [Borrelia burgdorferi]" . . . . . 100.00 273 98.83 98.83 8.79e-168 . . . . 4076 1 19 no SP B7IZU3 . "RecName: Full=Outer surface protein A; Flags: Precursor" . . . . . 100.00 273 98.44 98.44 5.40e-167 . . . . 4076 1 20 no SP C6C2D6 . "RecName: Full=Outer surface protein A; Flags: Precursor" . . . . . 100.00 273 98.83 98.83 8.79e-168 . . . . 4076 1 21 no SP P0CL66 . "RecName: Full=Outer surface protein A; Flags: Precursor" . . . . . 100.00 273 99.61 99.61 7.31e-170 . . . . 4076 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID OspA abbreviation 4076 1 'Outer Surface Protein A' common 4076 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 . 4076 1 2 18 LYS . 4076 1 3 19 GLN . 4076 1 4 20 ASN . 4076 1 5 21 VAL . 4076 1 6 22 SER . 4076 1 7 23 SER . 4076 1 8 24 LEU . 4076 1 9 25 ASP . 4076 1 10 26 GLU . 4076 1 11 27 LYS . 4076 1 12 28 ASN . 4076 1 13 29 SER . 4076 1 14 30 VAL . 4076 1 15 31 SER . 4076 1 16 32 VAL . 4076 1 17 33 ASP . 4076 1 18 34 LEU . 4076 1 19 35 PRO . 4076 1 20 36 GLY . 4076 1 21 37 GLU . 4076 1 22 38 MET . 4076 1 23 39 LYS . 4076 1 24 40 VAL . 4076 1 25 41 LEU . 4076 1 26 42 VAL . 4076 1 27 43 SER . 4076 1 28 44 LYS . 4076 1 29 45 GLU . 4076 1 30 46 LYS . 4076 1 31 47 ASN . 4076 1 32 48 LYS . 4076 1 33 49 ASP . 4076 1 34 50 GLY . 4076 1 35 51 LYS . 4076 1 36 52 TYR . 4076 1 37 53 ASP . 4076 1 38 54 LEU . 4076 1 39 55 ILE . 4076 1 40 56 ALA . 4076 1 41 57 THR . 4076 1 42 58 VAL . 4076 1 43 59 ASP . 4076 1 44 60 LYS . 4076 1 45 61 LEU . 4076 1 46 62 GLU . 4076 1 47 63 LEU . 4076 1 48 64 LYS . 4076 1 49 65 GLY . 4076 1 50 66 THR . 4076 1 51 67 SER . 4076 1 52 68 ASP . 4076 1 53 69 LYS . 4076 1 54 70 ASN . 4076 1 55 71 ASN . 4076 1 56 72 GLY . 4076 1 57 73 SER . 4076 1 58 74 GLY . 4076 1 59 75 VAL . 4076 1 60 76 LEU . 4076 1 61 77 GLU . 4076 1 62 78 GLY . 4076 1 63 79 VAL . 4076 1 64 80 LYS . 4076 1 65 81 ALA . 4076 1 66 82 ASP . 4076 1 67 83 LYS . 4076 1 68 84 SER . 4076 1 69 85 LYS . 4076 1 70 86 VAL . 4076 1 71 87 LYS . 4076 1 72 88 LEU . 4076 1 73 89 THR . 4076 1 74 90 ILE . 4076 1 75 91 SER . 4076 1 76 92 ASP . 4076 1 77 93 ASP . 4076 1 78 94 LEU . 4076 1 79 95 GLY . 4076 1 80 96 GLN . 4076 1 81 97 THR . 4076 1 82 98 THR . 4076 1 83 99 LEU . 4076 1 84 100 GLU . 4076 1 85 101 VAL . 4076 1 86 102 PHE . 4076 1 87 103 LYS . 4076 1 88 104 GLU . 4076 1 89 105 ASP . 4076 1 90 106 GLY . 4076 1 91 107 LYS . 4076 1 92 108 THR . 4076 1 93 109 LEU . 4076 1 94 110 VAL . 4076 1 95 111 SER . 4076 1 96 112 LYS . 4076 1 97 113 LYS . 4076 1 98 114 VAL . 4076 1 99 115 THR . 4076 1 100 116 SER . 4076 1 101 117 LYS . 4076 1 102 118 ASP . 4076 1 103 119 LYS . 4076 1 104 120 SER . 4076 1 105 121 SER . 4076 1 106 122 THR . 4076 1 107 123 GLU . 4076 1 108 124 GLU . 4076 1 109 125 LYS . 4076 1 110 126 PHE . 4076 1 111 127 ASN . 4076 1 112 128 GLU . 4076 1 113 129 LYS . 4076 1 114 130 GLY . 4076 1 115 131 GLU . 4076 1 116 132 VAL . 4076 1 117 133 SER . 4076 1 118 134 GLU . 4076 1 119 135 LYS . 4076 1 120 136 ILE . 4076 1 121 137 ILE . 4076 1 122 138 THR . 4076 1 123 139 ARG . 4076 1 124 140 ALA . 4076 1 125 141 ASP . 4076 1 126 142 GLY . 4076 1 127 143 THR . 4076 1 128 144 ARG . 4076 1 129 145 LEU . 4076 1 130 146 GLU . 4076 1 131 147 TYR . 4076 1 132 148 THR . 4076 1 133 149 GLY . 4076 1 134 150 ILE . 4076 1 135 151 LYS . 4076 1 136 152 SER . 4076 1 137 153 ASP . 4076 1 138 154 GLY . 4076 1 139 155 SER . 4076 1 140 156 GLY . 4076 1 141 157 LYS . 4076 1 142 158 ALA . 4076 1 143 159 LYS . 4076 1 144 160 GLU . 4076 1 145 161 VAL . 4076 1 146 162 LEU . 4076 1 147 163 LYS . 4076 1 148 164 GLY . 4076 1 149 165 TYR . 4076 1 150 166 VAL . 4076 1 151 167 LEU . 4076 1 152 168 GLU . 4076 1 153 169 GLY . 4076 1 154 170 THR . 4076 1 155 171 LEU . 4076 1 156 172 THR . 4076 1 157 173 ALA . 4076 1 158 174 GLU . 4076 1 159 175 LYS . 4076 1 160 176 THR . 4076 1 161 177 THR . 4076 1 162 178 LEU . 4076 1 163 179 VAL . 4076 1 164 180 VAL . 4076 1 165 181 LYS . 4076 1 166 182 GLU . 4076 1 167 183 GLY . 4076 1 168 184 THR . 4076 1 169 185 VAL . 4076 1 170 186 THR . 4076 1 171 187 LEU . 4076 1 172 188 SER . 4076 1 173 189 LYS . 4076 1 174 190 ASN . 4076 1 175 191 ILE . 4076 1 176 192 SER . 4076 1 177 193 LYS . 4076 1 178 194 SER . 4076 1 179 195 GLY . 4076 1 180 196 GLU . 4076 1 181 197 VAL . 4076 1 182 198 SER . 4076 1 183 199 VAL . 4076 1 184 200 GLU . 4076 1 185 201 LEU . 4076 1 186 202 ASN . 4076 1 187 203 ASP . 4076 1 188 204 THR . 4076 1 189 205 ASP . 4076 1 190 206 SER . 4076 1 191 207 SER . 4076 1 192 208 ALA . 4076 1 193 209 ALA . 4076 1 194 210 THR . 4076 1 195 211 LYS . 4076 1 196 212 LYS . 4076 1 197 213 THR . 4076 1 198 214 ALA . 4076 1 199 215 ALA . 4076 1 200 216 TRP . 4076 1 201 217 ASN . 4076 1 202 218 SER . 4076 1 203 219 GLY . 4076 1 204 220 THR . 4076 1 205 221 SER . 4076 1 206 222 THR . 4076 1 207 223 LEU . 4076 1 208 224 THR . 4076 1 209 225 ILE . 4076 1 210 226 THR . 4076 1 211 227 VAL . 4076 1 212 228 ASN . 4076 1 213 229 SER . 4076 1 214 230 LYS . 4076 1 215 231 LYS . 4076 1 216 232 THR . 4076 1 217 233 LYS . 4076 1 218 234 ASP . 4076 1 219 235 LEU . 4076 1 220 236 VAL . 4076 1 221 237 PHE . 4076 1 222 238 THR . 4076 1 223 239 LYS . 4076 1 224 240 GLU . 4076 1 225 241 ASN . 4076 1 226 242 THR . 4076 1 227 243 ILE . 4076 1 228 244 THR . 4076 1 229 245 VAL . 4076 1 230 246 GLN . 4076 1 231 247 GLN . 4076 1 232 248 TYR . 4076 1 233 249 ASP . 4076 1 234 250 SER . 4076 1 235 251 ASN . 4076 1 236 252 GLY . 4076 1 237 253 THR . 4076 1 238 254 LYS . 4076 1 239 255 LEU . 4076 1 240 256 GLU . 4076 1 241 257 GLY . 4076 1 242 258 SER . 4076 1 243 259 ALA . 4076 1 244 260 VAL . 4076 1 245 261 GLU . 4076 1 246 262 ILE . 4076 1 247 263 THR . 4076 1 248 264 LYS . 4076 1 249 265 LEU . 4076 1 250 266 ASP . 4076 1 251 267 GLU . 4076 1 252 268 ILE . 4076 1 253 269 LYS . 4076 1 254 270 ASN . 4076 1 255 271 ALA . 4076 1 256 272 LEU . 4076 1 257 273 LYS . 4076 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 4076 1 . LYS 2 2 4076 1 . GLN 3 3 4076 1 . ASN 4 4 4076 1 . VAL 5 5 4076 1 . SER 6 6 4076 1 . SER 7 7 4076 1 . LEU 8 8 4076 1 . ASP 9 9 4076 1 . GLU 10 10 4076 1 . LYS 11 11 4076 1 . ASN 12 12 4076 1 . SER 13 13 4076 1 . VAL 14 14 4076 1 . SER 15 15 4076 1 . VAL 16 16 4076 1 . ASP 17 17 4076 1 . LEU 18 18 4076 1 . PRO 19 19 4076 1 . GLY 20 20 4076 1 . GLU 21 21 4076 1 . MET 22 22 4076 1 . LYS 23 23 4076 1 . VAL 24 24 4076 1 . LEU 25 25 4076 1 . VAL 26 26 4076 1 . SER 27 27 4076 1 . LYS 28 28 4076 1 . GLU 29 29 4076 1 . LYS 30 30 4076 1 . ASN 31 31 4076 1 . LYS 32 32 4076 1 . ASP 33 33 4076 1 . GLY 34 34 4076 1 . LYS 35 35 4076 1 . TYR 36 36 4076 1 . ASP 37 37 4076 1 . LEU 38 38 4076 1 . ILE 39 39 4076 1 . ALA 40 40 4076 1 . THR 41 41 4076 1 . VAL 42 42 4076 1 . ASP 43 43 4076 1 . LYS 44 44 4076 1 . LEU 45 45 4076 1 . GLU 46 46 4076 1 . LEU 47 47 4076 1 . LYS 48 48 4076 1 . GLY 49 49 4076 1 . THR 50 50 4076 1 . SER 51 51 4076 1 . ASP 52 52 4076 1 . LYS 53 53 4076 1 . ASN 54 54 4076 1 . ASN 55 55 4076 1 . GLY 56 56 4076 1 . SER 57 57 4076 1 . GLY 58 58 4076 1 . VAL 59 59 4076 1 . LEU 60 60 4076 1 . GLU 61 61 4076 1 . GLY 62 62 4076 1 . VAL 63 63 4076 1 . LYS 64 64 4076 1 . ALA 65 65 4076 1 . ASP 66 66 4076 1 . LYS 67 67 4076 1 . SER 68 68 4076 1 . LYS 69 69 4076 1 . VAL 70 70 4076 1 . LYS 71 71 4076 1 . LEU 72 72 4076 1 . THR 73 73 4076 1 . ILE 74 74 4076 1 . SER 75 75 4076 1 . ASP 76 76 4076 1 . ASP 77 77 4076 1 . LEU 78 78 4076 1 . GLY 79 79 4076 1 . GLN 80 80 4076 1 . THR 81 81 4076 1 . THR 82 82 4076 1 . LEU 83 83 4076 1 . GLU 84 84 4076 1 . VAL 85 85 4076 1 . PHE 86 86 4076 1 . LYS 87 87 4076 1 . GLU 88 88 4076 1 . ASP 89 89 4076 1 . GLY 90 90 4076 1 . LYS 91 91 4076 1 . THR 92 92 4076 1 . LEU 93 93 4076 1 . VAL 94 94 4076 1 . SER 95 95 4076 1 . LYS 96 96 4076 1 . LYS 97 97 4076 1 . VAL 98 98 4076 1 . THR 99 99 4076 1 . SER 100 100 4076 1 . LYS 101 101 4076 1 . ASP 102 102 4076 1 . LYS 103 103 4076 1 . SER 104 104 4076 1 . SER 105 105 4076 1 . THR 106 106 4076 1 . GLU 107 107 4076 1 . GLU 108 108 4076 1 . LYS 109 109 4076 1 . PHE 110 110 4076 1 . ASN 111 111 4076 1 . GLU 112 112 4076 1 . LYS 113 113 4076 1 . GLY 114 114 4076 1 . GLU 115 115 4076 1 . VAL 116 116 4076 1 . SER 117 117 4076 1 . GLU 118 118 4076 1 . LYS 119 119 4076 1 . ILE 120 120 4076 1 . ILE 121 121 4076 1 . THR 122 122 4076 1 . ARG 123 123 4076 1 . ALA 124 124 4076 1 . ASP 125 125 4076 1 . GLY 126 126 4076 1 . THR 127 127 4076 1 . ARG 128 128 4076 1 . LEU 129 129 4076 1 . GLU 130 130 4076 1 . TYR 131 131 4076 1 . THR 132 132 4076 1 . GLY 133 133 4076 1 . ILE 134 134 4076 1 . LYS 135 135 4076 1 . SER 136 136 4076 1 . ASP 137 137 4076 1 . GLY 138 138 4076 1 . SER 139 139 4076 1 . GLY 140 140 4076 1 . LYS 141 141 4076 1 . ALA 142 142 4076 1 . LYS 143 143 4076 1 . GLU 144 144 4076 1 . VAL 145 145 4076 1 . LEU 146 146 4076 1 . LYS 147 147 4076 1 . GLY 148 148 4076 1 . TYR 149 149 4076 1 . VAL 150 150 4076 1 . LEU 151 151 4076 1 . GLU 152 152 4076 1 . GLY 153 153 4076 1 . THR 154 154 4076 1 . LEU 155 155 4076 1 . THR 156 156 4076 1 . ALA 157 157 4076 1 . GLU 158 158 4076 1 . LYS 159 159 4076 1 . THR 160 160 4076 1 . THR 161 161 4076 1 . LEU 162 162 4076 1 . VAL 163 163 4076 1 . VAL 164 164 4076 1 . LYS 165 165 4076 1 . GLU 166 166 4076 1 . GLY 167 167 4076 1 . THR 168 168 4076 1 . VAL 169 169 4076 1 . THR 170 170 4076 1 . LEU 171 171 4076 1 . SER 172 172 4076 1 . LYS 173 173 4076 1 . ASN 174 174 4076 1 . ILE 175 175 4076 1 . SER 176 176 4076 1 . LYS 177 177 4076 1 . SER 178 178 4076 1 . GLY 179 179 4076 1 . GLU 180 180 4076 1 . VAL 181 181 4076 1 . SER 182 182 4076 1 . VAL 183 183 4076 1 . GLU 184 184 4076 1 . LEU 185 185 4076 1 . ASN 186 186 4076 1 . ASP 187 187 4076 1 . THR 188 188 4076 1 . ASP 189 189 4076 1 . SER 190 190 4076 1 . SER 191 191 4076 1 . ALA 192 192 4076 1 . ALA 193 193 4076 1 . THR 194 194 4076 1 . LYS 195 195 4076 1 . LYS 196 196 4076 1 . THR 197 197 4076 1 . ALA 198 198 4076 1 . ALA 199 199 4076 1 . TRP 200 200 4076 1 . ASN 201 201 4076 1 . SER 202 202 4076 1 . GLY 203 203 4076 1 . THR 204 204 4076 1 . SER 205 205 4076 1 . THR 206 206 4076 1 . LEU 207 207 4076 1 . THR 208 208 4076 1 . ILE 209 209 4076 1 . THR 210 210 4076 1 . VAL 211 211 4076 1 . ASN 212 212 4076 1 . SER 213 213 4076 1 . LYS 214 214 4076 1 . LYS 215 215 4076 1 . THR 216 216 4076 1 . LYS 217 217 4076 1 . ASP 218 218 4076 1 . LEU 219 219 4076 1 . VAL 220 220 4076 1 . PHE 221 221 4076 1 . THR 222 222 4076 1 . LYS 223 223 4076 1 . GLU 224 224 4076 1 . ASN 225 225 4076 1 . THR 226 226 4076 1 . ILE 227 227 4076 1 . THR 228 228 4076 1 . VAL 229 229 4076 1 . GLN 230 230 4076 1 . GLN 231 231 4076 1 . TYR 232 232 4076 1 . ASP 233 233 4076 1 . SER 234 234 4076 1 . ASN 235 235 4076 1 . GLY 236 236 4076 1 . THR 237 237 4076 1 . LYS 238 238 4076 1 . LEU 239 239 4076 1 . GLU 240 240 4076 1 . GLY 241 241 4076 1 . SER 242 242 4076 1 . ALA 243 243 4076 1 . VAL 244 244 4076 1 . GLU 245 245 4076 1 . ILE 246 246 4076 1 . THR 247 247 4076 1 . LYS 248 248 4076 1 . LEU 249 249 4076 1 . ASP 250 250 4076 1 . GLU 251 251 4076 1 . ILE 252 252 4076 1 . LYS 253 253 4076 1 . ASN 254 254 4076 1 . ALA 255 255 4076 1 . LEU 256 256 4076 1 . LYS 257 257 4076 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 4076 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $OspA . 139 . . 'Borrelia burgdorferi' spirochete . . Eubacteria . Borrelia burgdorferi B31 . . . . . . . . . . . . . . . . . . . . 4076 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 4076 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $OspA . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli BL21(DE3) . . . . . . . . . . . . plasmid . . pET9-OspA . . . 'natural source' . . 4076 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Sample.Sf_category sample _Sample.Sf_framecode sample_one _Sample.Entry_ID 4076 _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 'Outer Surface Protein A' '[U-99% 13C; U-98% 15N]' . . 1 $OspA . . 1.5 . . mM . . . . 4076 1 2 'sodium phosphate' . . . . . . . 10 . . mM . . . . 4076 1 3 'sodium chloride' . . . . . . . 50 . . mM . . . . 4076 1 4 EDTA . . . . . . . 0.05 . . mM . . . . 4076 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions _Sample_condition_list.Entry_ID 4076 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 60 3 mM 4076 1 pH 6.0 0.05 n/a 4076 1 pressure 1.0 . atm 4076 1 temperature 318 0.5 K 4076 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_list _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_list _NMR_spectrometer.Entry_ID 4076 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'spectrometer information not available' _NMR_spectrometer.Manufacturer unknown _NMR_spectrometer.Model unknown _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 0 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 4076 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 unknown unknown . 0 'spectrometer information not available' . . 4076 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 4076 _Experiment_list.ID 1 _Experiment_list.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference _Chem_shift_reference.Entry_ID 4076 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 TSP methyl . . . . ppm 0.00 external indirect 0.25144954 . . . . . . . . . 4076 1 H 1 DSS methyl . . . . ppm 0.00 external direct . . . . . . . . . . 4076 1 N 15 DSS . . . . . ppm 0 external indirect 0.10132900 . . . . . . . . . 4076 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_chemical_shift_assignment_OspA _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_assignment_OspA _Assigned_chem_shift_list.Entry_ID 4076 _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 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_one . 4076 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 . . . . . . . . 4076 1 2 . 1 1 2 2 LYS HA H 1 4.33 0.06 . 1 . . . . . . . . 4076 1 3 . 1 1 2 2 LYS CB C 13 33.2 0.5 . 1 . . . . . . . . 4076 1 4 . 1 1 2 2 LYS HB2 H 1 1.79 0.06 . 2 . . . . . . . . 4076 1 5 . 1 1 2 2 LYS HB3 H 1 1.79 0.06 . 2 . . . . . . . . 4076 1 6 . 1 1 2 2 LYS CG C 13 24.6 0.5 . 1 . . . . . . . . 4076 1 7 . 1 1 2 2 LYS CD C 13 29.0 0.5 . 1 . . . . . . . . 4076 1 8 . 1 1 2 2 LYS CE C 13 42.0 0.5 . 1 . . . . . . . . 4076 1 9 . 1 1 2 2 LYS C C 13 176.13 0.09 . 1 . . . . . . . . 4076 1 10 . 1 1 3 3 GLN N N 15 122.9 0.1 . 1 . . . . . . . . 4076 1 11 . 1 1 3 3 GLN H H 1 8.40 0.007 . 1 . . . . . . . . 4076 1 12 . 1 1 3 3 GLN CA C 13 55.8 0.5 . 1 . . . . . . . . 4076 1 13 . 1 1 3 3 GLN HA H 1 4.35 0.06 . 1 . . . . . . . . 4076 1 14 . 1 1 3 3 GLN CB C 13 29.8 0.5 . 1 . . . . . . . . 4076 1 15 . 1 1 3 3 GLN HB2 H 1 2.04 0.06 . 2 . . . . . . . . 4076 1 16 . 1 1 3 3 GLN HB3 H 1 2.04 0.06 . 2 . . . . . . . . 4076 1 17 . 1 1 3 3 GLN CG C 13 33.8 0.5 . 1 . . . . . . . . 4076 1 18 . 1 1 3 3 GLN C C 13 175.46 0.09 . 1 . . . . . . . . 4076 1 19 . 1 1 4 4 ASN N N 15 121.6 0.1 . 1 . . . . . . . . 4076 1 20 . 1 1 4 4 ASN H H 1 8.47 0.007 . 1 . . . . . . . . 4076 1 21 . 1 1 4 4 ASN CA C 13 53.4 0.5 . 1 . . . . . . . . 4076 1 22 . 1 1 4 4 ASN HA H 1 4.72 0.06 . 1 . . . . . . . . 4076 1 23 . 1 1 4 4 ASN CB C 13 39.0 0.5 . 1 . . . . . . . . 4076 1 24 . 1 1 4 4 ASN HB2 H 1 2.79 0.06 . 2 . . . . . . . . 4076 1 25 . 1 1 4 4 ASN HB3 H 1 2.79 0.06 . 2 . . . . . . . . 4076 1 26 . 1 1 4 4 ASN C C 13 174.95 0.09 . 1 . . . . . . . . 4076 1 27 . 1 1 5 5 VAL N N 15 121.0 0.1 . 1 . . . . . . . . 4076 1 28 . 1 1 5 5 VAL H H 1 8.03 0.007 . 1 . . . . . . . . 4076 1 29 . 1 1 5 5 VAL CA C 13 62.1 0.5 . 1 . . . . . . . . 4076 1 30 . 1 1 5 5 VAL HA H 1 4.20 0.06 . 1 . . . . . . . . 4076 1 31 . 1 1 5 5 VAL CB C 13 33.1 0.5 . 1 . . . . . . . . 4076 1 32 . 1 1 5 5 VAL HB H 1 2.12 0.06 . 1 . . . . . . . . 4076 1 33 . 1 1 5 5 VAL CG1 C 13 21.2 0.5 . 2 . . . . . . . . 4076 1 34 . 1 1 5 5 VAL CG2 C 13 20.2 0.5 . 2 . . . . . . . . 4076 1 35 . 1 1 5 5 VAL C C 13 175.94 0.09 . 1 . . . . . . . . 4076 1 36 . 1 1 6 6 SER N N 15 120.5 0.1 . 1 . . . . . . . . 4076 1 37 . 1 1 6 6 SER H H 1 8.33 0.007 . 1 . . . . . . . . 4076 1 38 . 1 1 6 6 SER CA C 13 58.3 0.5 . 1 . . . . . . . . 4076 1 39 . 1 1 6 6 SER HA H 1 4.50 0.06 . 1 . . . . . . . . 4076 1 40 . 1 1 6 6 SER CB C 13 64.0 0.5 . 1 . . . . . . . . 4076 1 41 . 1 1 6 6 SER HB2 H 1 3.85 0.06 . 2 . . . . . . . . 4076 1 42 . 1 1 6 6 SER HB3 H 1 3.85 0.06 . 2 . . . . . . . . 4076 1 43 . 1 1 6 6 SER C C 13 174.45 0.09 . 1 . . . . . . . . 4076 1 44 . 1 1 7 7 SER N N 15 119.1 0.1 . 1 . . . . . . . . 4076 1 45 . 1 1 7 7 SER H H 1 8.26 0.007 . 1 . . . . . . . . 4076 1 46 . 1 1 7 7 SER CA C 13 58.5 0.5 . 1 . . . . . . . . 4076 1 47 . 1 1 7 7 SER HA H 1 4.43 0.06 . 1 . . . . . . . . 4076 1 48 . 1 1 7 7 SER CB C 13 63.8 0.5 . 1 . . . . . . . . 4076 1 49 . 1 1 7 7 SER HB2 H 1 3.84 0.06 . 2 . . . . . . . . 4076 1 50 . 1 1 7 7 SER HB3 H 1 3.84 0.06 . 2 . . . . . . . . 4076 1 51 . 1 1 7 7 SER C C 13 174.23 0.09 . 1 . . . . . . . . 4076 1 52 . 1 1 8 8 LEU N N 15 124.1 0.1 . 1 . . . . . . . . 4076 1 53 . 1 1 8 8 LEU H H 1 7.90 0.007 . 1 . . . . . . . . 4076 1 54 . 1 1 8 8 LEU CA C 13 54.9 0.5 . 1 . . . . . . . . 4076 1 55 . 1 1 8 8 LEU HA H 1 4.64 0.06 . 1 . . . . . . . . 4076 1 56 . 1 1 8 8 LEU CB C 13 42.5 0.5 . 1 . . . . . . . . 4076 1 57 . 1 1 8 8 LEU HB2 H 1 1.54 0.06 . 2 . . . . . . . . 4076 1 58 . 1 1 8 8 LEU HB3 H 1 1.54 0.06 . 2 . . . . . . . . 4076 1 59 . 1 1 8 8 LEU CG C 13 27.0 0.5 . 1 . . . . . . . . 4076 1 60 . 1 1 8 8 LEU CD1 C 13 23.5 0.5 . 2 . . . . . . . . 4076 1 61 . 1 1 8 8 LEU CD2 C 13 25.5 0.5 . 2 . . . . . . . . 4076 1 62 . 1 1 8 8 LEU C C 13 176.23 0.09 . 1 . . . . . . . . 4076 1 63 . 1 1 9 9 ASP N N 15 123.2 0.1 . 1 . . . . . . . . 4076 1 64 . 1 1 9 9 ASP H H 1 8.70 0.007 . 1 . . . . . . . . 4076 1 65 . 1 1 9 9 ASP CA C 13 53.6 0.5 . 1 . . . . . . . . 4076 1 66 . 1 1 9 9 ASP HA H 1 4.54 0.06 . 1 . . . . . . . . 4076 1 67 . 1 1 9 9 ASP CB C 13 41.8 0.5 . 1 . . . . . . . . 4076 1 68 . 1 1 9 9 ASP HB2 H 1 2.68 0.06 . 2 . . . . . . . . 4076 1 69 . 1 1 9 9 ASP HB3 H 1 2.80 0.06 . 2 . . . . . . . . 4076 1 70 . 1 1 9 9 ASP C C 13 176.81 0.09 . 1 . . . . . . . . 4076 1 71 . 1 1 10 10 GLU N N 15 121.0 0.1 . 1 . . . . . . . . 4076 1 72 . 1 1 10 10 GLU H H 1 8.62 0.007 . 1 . . . . . . . . 4076 1 73 . 1 1 10 10 GLU CA C 13 58.1 0.5 . 1 . . . . . . . . 4076 1 74 . 1 1 10 10 GLU HA H 1 4.21 0.06 . 1 . . . . . . . . 4076 1 75 . 1 1 10 10 GLU CB C 13 29.4 0.5 . 1 . . . . . . . . 4076 1 76 . 1 1 10 10 GLU HB2 H 1 2.05 0.06 . 2 . . . . . . . . 4076 1 77 . 1 1 10 10 GLU HB3 H 1 2.05 0.06 . 2 . . . . . . . . 4076 1 78 . 1 1 10 10 GLU CG C 13 36.3 0.5 . 1 . . . . . . . . 4076 1 79 . 1 1 10 10 GLU HG2 H 1 2.27 0.06 . 2 . . . . . . . . 4076 1 80 . 1 1 10 10 GLU HG3 H 1 2.27 0.06 . 2 . . . . . . . . 4076 1 81 . 1 1 10 10 GLU C C 13 177.14 0.09 . 1 . . . . . . . . 4076 1 82 . 1 1 11 11 LYS N N 15 119.7 0.1 . 1 . . . . . . . . 4076 1 83 . 1 1 11 11 LYS H H 1 8.34 0.007 . 1 . . . . . . . . 4076 1 84 . 1 1 11 11 LYS CA C 13 57.4 0.5 . 1 . . . . . . . . 4076 1 85 . 1 1 11 11 LYS HA H 1 4.33 0.06 . 1 . . . . . . . . 4076 1 86 . 1 1 11 11 LYS CB C 13 32.6 0.5 . 1 . . . . . . . . 4076 1 87 . 1 1 11 11 LYS HB2 H 1 1.88 0.06 . 2 . . . . . . . . 4076 1 88 . 1 1 11 11 LYS HB3 H 1 1.88 0.06 . 2 . . . . . . . . 4076 1 89 . 1 1 11 11 LYS CG C 13 25.0 0.5 . 1 . . . . . . . . 4076 1 90 . 1 1 11 11 LYS CD C 13 28.9 0.5 . 1 . . . . . . . . 4076 1 91 . 1 1 11 11 LYS C C 13 177.63 0.09 . 1 . . . . . . . . 4076 1 92 . 1 1 12 12 ASN N N 15 118.4 0.1 . 1 . . . . . . . . 4076 1 93 . 1 1 12 12 ASN H H 1 8.06 0.007 . 1 . . . . . . . . 4076 1 94 . 1 1 12 12 ASN CA C 13 52.7 0.5 . 1 . . . . . . . . 4076 1 95 . 1 1 12 12 ASN HA H 1 4.94 0.06 . 1 . . . . . . . . 4076 1 96 . 1 1 12 12 ASN CB C 13 39.3 0.5 . 1 . . . . . . . . 4076 1 97 . 1 1 12 12 ASN HB2 H 1 2.88 0.06 . 2 . . . . . . . . 4076 1 98 . 1 1 12 12 ASN HB3 H 1 3.05 0.06 . 2 . . . . . . . . 4076 1 99 . 1 1 12 12 ASN C C 13 175.04 0.09 . 1 . . . . . . . . 4076 1 100 . 1 1 13 13 SER N N 15 115.2 0.1 . 1 . . . . . . . . 4076 1 101 . 1 1 13 13 SER H H 1 7.75 0.007 . 1 . . . . . . . . 4076 1 102 . 1 1 13 13 SER CA C 13 58.0 0.5 . 1 . . . . . . . . 4076 1 103 . 1 1 13 13 SER HA H 1 5.21 0.06 . 1 . . . . . . . . 4076 1 104 . 1 1 13 13 SER CB C 13 67.3 0.5 . 1 . . . . . . . . 4076 1 105 . 1 1 13 13 SER HB2 H 1 3.57 0.06 . 2 . . . . . . . . 4076 1 106 . 1 1 13 13 SER HB3 H 1 3.73 0.06 . 2 . . . . . . . . 4076 1 107 . 1 1 13 13 SER C C 13 172.17 0.09 . 1 . . . . . . . . 4076 1 108 . 1 1 14 14 VAL N N 15 120.8 0.1 . 1 . . . . . . . . 4076 1 109 . 1 1 14 14 VAL H H 1 9.03 0.007 . 1 . . . . . . . . 4076 1 110 . 1 1 14 14 VAL CA C 13 61.1 0.5 . 1 . . . . . . . . 4076 1 111 . 1 1 14 14 VAL HA H 1 4.33 0.06 . 1 . . . . . . . . 4076 1 112 . 1 1 14 14 VAL CB C 13 34.5 0.5 . 1 . . . . . . . . 4076 1 113 . 1 1 14 14 VAL HB H 1 1.98 0.06 . 1 . . . . . . . . 4076 1 114 . 1 1 14 14 VAL CG1 C 13 20.7 0.5 . 2 . . . . . . . . 4076 1 115 . 1 1 14 14 VAL CG2 C 13 20.7 0.5 . 2 . . . . . . . . 4076 1 116 . 1 1 14 14 VAL C C 13 174.52 0.09 . 1 . . . . . . . . 4076 1 117 . 1 1 15 15 SER N N 15 120.0 0.1 . 1 . . . . . . . . 4076 1 118 . 1 1 15 15 SER H H 1 8.22 0.007 . 1 . . . . . . . . 4076 1 119 . 1 1 15 15 SER CA C 13 57.3 0.5 . 1 . . . . . . . . 4076 1 120 . 1 1 15 15 SER HA H 1 5.14 0.06 . 1 . . . . . . . . 4076 1 121 . 1 1 15 15 SER CB C 13 64.3 0.5 . 1 . . . . . . . . 4076 1 122 . 1 1 15 15 SER HB2 H 1 3.63 0.06 . 2 . . . . . . . . 4076 1 123 . 1 1 15 15 SER HB3 H 1 3.63 0.06 . 2 . . . . . . . . 4076 1 124 . 1 1 15 15 SER C C 13 174.45 0.09 . 1 . . . . . . . . 4076 1 125 . 1 1 16 16 VAL N N 15 130.3 0.1 . 1 . . . . . . . . 4076 1 126 . 1 1 16 16 VAL H H 1 9.29 0.007 . 1 . . . . . . . . 4076 1 127 . 1 1 16 16 VAL CA C 13 62.1 0.5 . 1 . . . . . . . . 4076 1 128 . 1 1 16 16 VAL HA H 1 4.15 0.06 . 1 . . . . . . . . 4076 1 129 . 1 1 16 16 VAL CB C 13 34.4 0.5 . 1 . . . . . . . . 4076 1 130 . 1 1 16 16 VAL HB H 1 2.00 0.06 . 1 . . . . . . . . 4076 1 131 . 1 1 16 16 VAL CG1 C 13 20.5 0.5 . 2 . . . . . . . . 4076 1 132 . 1 1 16 16 VAL CG2 C 13 20.5 0.5 . 2 . . . . . . . . 4076 1 133 . 1 1 16 16 VAL C C 13 174.97 0.09 . 1 . . . . . . . . 4076 1 134 . 1 1 17 17 ASP N N 15 127.4 0.1 . 1 . . . . . . . . 4076 1 135 . 1 1 17 17 ASP H H 1 8.20 0.007 . 1 . . . . . . . . 4076 1 136 . 1 1 17 17 ASP CA C 13 55.3 0.5 . 1 . . . . . . . . 4076 1 137 . 1 1 17 17 ASP HA H 1 4.76 0.06 . 1 . . . . . . . . 4076 1 138 . 1 1 17 17 ASP CB C 13 41.8 0.5 . 1 . . . . . . . . 4076 1 139 . 1 1 17 17 ASP HB2 H 1 2.51 0.06 . 2 . . . . . . . . 4076 1 140 . 1 1 17 17 ASP HB3 H 1 2.66 0.06 . 2 . . . . . . . . 4076 1 141 . 1 1 17 17 ASP C C 13 175.37 0.09 . 1 . . . . . . . . 4076 1 142 . 1 1 18 18 LEU N N 15 123.2 0.1 . 1 . . . . . . . . 4076 1 143 . 1 1 18 18 LEU H H 1 8.31 0.007 . 1 . . . . . . . . 4076 1 144 . 1 1 18 18 LEU CA C 13 51.8 0.5 . 1 . . . . . . . . 4076 1 145 . 1 1 18 18 LEU CB C 13 44.1 0.5 . 1 . . . . . . . . 4076 1 146 . 1 1 18 18 LEU CG C 13 33.8 0.5 . 1 . . . . . . . . 4076 1 147 . 1 1 18 18 LEU CD1 C 13 24.9 0.5 . 2 . . . . . . . . 4076 1 148 . 1 1 18 18 LEU CD2 C 13 24.9 0.5 . 2 . . . . . . . . 4076 1 149 . 1 1 19 19 PRO CA C 13 63.5 0.5 . 1 . . . . . . . . 4076 1 150 . 1 1 19 19 PRO HA H 1 4.36 0.06 . 1 . . . . . . . . 4076 1 151 . 1 1 19 19 PRO CB C 13 31.9 0.5 . 1 . . . . . . . . 4076 1 152 . 1 1 19 19 PRO HB2 H 1 1.55 0.06 . 2 . . . . . . . . 4076 1 153 . 1 1 19 19 PRO HB3 H 1 1.88 0.06 . 2 . . . . . . . . 4076 1 154 . 1 1 19 19 PRO CG C 13 27.9 0.5 . 1 . . . . . . . . 4076 1 155 . 1 1 19 19 PRO CD C 13 50.5 0.5 . 1 . . . . . . . . 4076 1 156 . 1 1 19 19 PRO C C 13 176.13 0.09 . 1 . . . . . . . . 4076 1 157 . 1 1 20 20 GLY N N 15 111.3 0.1 . 1 . . . . . . . . 4076 1 158 . 1 1 20 20 GLY H H 1 8.72 0.007 . 1 . . . . . . . . 4076 1 159 . 1 1 20 20 GLY CA C 13 45.7 0.5 . 1 . . . . . . . . 4076 1 160 . 1 1 20 20 GLY HA2 H 1 3.70 0.06 . 2 . . . . . . . . 4076 1 161 . 1 1 20 20 GLY HA3 H 1 3.94 0.06 . 2 . . . . . . . . 4076 1 162 . 1 1 20 20 GLY C C 13 174.37 0.09 . 1 . . . . . . . . 4076 1 163 . 1 1 21 21 GLU N N 15 115.7 0.1 . 1 . . . . . . . . 4076 1 164 . 1 1 21 21 GLU H H 1 8.32 0.007 . 1 . . . . . . . . 4076 1 165 . 1 1 21 21 GLU CA C 13 57.1 0.5 . 1 . . . . . . . . 4076 1 166 . 1 1 21 21 GLU HA H 1 4.04 0.06 . 1 . . . . . . . . 4076 1 167 . 1 1 21 21 GLU CB C 13 26.7 0.5 . 1 . . . . . . . . 4076 1 168 . 1 1 21 21 GLU HB2 H 1 2.19 0.06 . 2 . . . . . . . . 4076 1 169 . 1 1 21 21 GLU HB3 H 1 2.19 0.06 . 2 . . . . . . . . 4076 1 170 . 1 1 21 21 GLU CG C 13 36.7 0.5 . 1 . . . . . . . . 4076 1 171 . 1 1 21 21 GLU C C 13 175.33 0.09 . 1 . . . . . . . . 4076 1 172 . 1 1 22 22 MET N N 15 117.6 0.1 . 1 . . . . . . . . 4076 1 173 . 1 1 22 22 MET H H 1 6.79 0.007 . 1 . . . . . . . . 4076 1 174 . 1 1 22 22 MET CA C 13 54.4 0.5 . 1 . . . . . . . . 4076 1 175 . 1 1 22 22 MET HA H 1 4.76 0.06 . 1 . . . . . . . . 4076 1 176 . 1 1 22 22 MET CB C 13 36.4 0.5 . 1 . . . . . . . . 4076 1 177 . 1 1 22 22 MET HB2 H 1 1.82 0.06 . 2 . . . . . . . . 4076 1 178 . 1 1 22 22 MET HB3 H 1 1.82 0.06 . 2 . . . . . . . . 4076 1 179 . 1 1 22 22 MET CG C 13 32.3 0.5 . 1 . . . . . . . . 4076 1 180 . 1 1 22 22 MET C C 13 174.22 0.09 . 1 . . . . . . . . 4076 1 181 . 1 1 23 23 LYS N N 15 122.1 0.1 . 1 . . . . . . . . 4076 1 182 . 1 1 23 23 LYS H H 1 8.10 0.007 . 1 . . . . . . . . 4076 1 183 . 1 1 23 23 LYS CA C 13 59.0 0.5 . 1 . . . . . . . . 4076 1 184 . 1 1 23 23 LYS HA H 1 5.23 0.06 . 1 . . . . . . . . 4076 1 185 . 1 1 23 23 LYS CB C 13 36.2 0.5 . 1 . . . . . . . . 4076 1 186 . 1 1 23 23 LYS HB2 H 1 3.57 0.06 . 2 . . . . . . . . 4076 1 187 . 1 1 23 23 LYS HB3 H 1 1.62 0.06 . 2 . . . . . . . . 4076 1 188 . 1 1 23 23 LYS CG C 13 24.7 0.5 . 1 . . . . . . . . 4076 1 189 . 1 1 23 23 LYS CD C 13 29.3 0.5 . 1 . . . . . . . . 4076 1 190 . 1 1 23 23 LYS CE C 13 42.1 0.5 . 1 . . . . . . . . 4076 1 191 . 1 1 23 23 LYS C C 13 174.87 0.09 . 1 . . . . . . . . 4076 1 192 . 1 1 24 24 VAL N N 15 122.9 0.1 . 1 . . . . . . . . 4076 1 193 . 1 1 24 24 VAL H H 1 8.73 0.007 . 1 . . . . . . . . 4076 1 194 . 1 1 24 24 VAL CA C 13 59.0 0.5 . 1 . . . . . . . . 4076 1 195 . 1 1 24 24 VAL HA H 1 4.87 0.06 . 1 . . . . . . . . 4076 1 196 . 1 1 24 24 VAL CB C 13 35.8 0.5 . 1 . . . . . . . . 4076 1 197 . 1 1 24 24 VAL HB H 1 1.75 0.06 . 1 . . . . . . . . 4076 1 198 . 1 1 24 24 VAL CG1 C 13 22.6 0.5 . 2 . . . . . . . . 4076 1 199 . 1 1 24 24 VAL CG2 C 13 20.3 0.5 . 2 . . . . . . . . 4076 1 200 . 1 1 24 24 VAL C C 13 171.98 0.09 . 1 . . . . . . . . 4076 1 201 . 1 1 25 25 LEU N N 15 128.5 0.1 . 1 . . . . . . . . 4076 1 202 . 1 1 25 25 LEU H H 1 9.12 0.007 . 1 . . . . . . . . 4076 1 203 . 1 1 25 25 LEU CA C 13 53.6 0.5 . 1 . . . . . . . . 4076 1 204 . 1 1 25 25 LEU HA H 1 5.17 0.06 . 1 . . . . . . . . 4076 1 205 . 1 1 25 25 LEU CB C 13 42.8 0.5 . 1 . . . . . . . . 4076 1 206 . 1 1 25 25 LEU HB2 H 1 1.29 0.06 . 2 . . . . . . . . 4076 1 207 . 1 1 25 25 LEU HB3 H 1 1.77 0.06 . 2 . . . . . . . . 4076 1 208 . 1 1 25 25 LEU CG C 13 27.9 0.5 . 1 . . . . . . . . 4076 1 209 . 1 1 25 25 LEU CD1 C 13 24.3 0.5 . 2 . . . . . . . . 4076 1 210 . 1 1 25 25 LEU CD2 C 13 24.3 0.5 . 2 . . . . . . . . 4076 1 211 . 1 1 25 25 LEU C C 13 175.84 0.09 . 1 . . . . . . . . 4076 1 212 . 1 1 26 26 VAL N N 15 123.2 0.1 . 1 . . . . . . . . 4076 1 213 . 1 1 26 26 VAL H H 1 8.87 0.007 . 1 . . . . . . . . 4076 1 214 . 1 1 26 26 VAL CA C 13 59.4 0.5 . 1 . . . . . . . . 4076 1 215 . 1 1 26 26 VAL HA H 1 4.92 0.06 . 1 . . . . . . . . 4076 1 216 . 1 1 26 26 VAL CB C 13 34.3 0.5 . 1 . . . . . . . . 4076 1 217 . 1 1 26 26 VAL HB H 1 1.78 0.06 . 1 . . . . . . . . 4076 1 218 . 1 1 26 26 VAL CG1 C 13 19.5 0.5 . 2 . . . . . . . . 4076 1 219 . 1 1 26 26 VAL CG2 C 13 20.9 0.5 . 2 . . . . . . . . 4076 1 220 . 1 1 26 26 VAL C C 13 176.40 0.09 . 1 . . . . . . . . 4076 1 221 . 1 1 27 27 SER N N 15 124.4 0.1 . 1 . . . . . . . . 4076 1 222 . 1 1 27 27 SER H H 1 9.06 0.007 . 1 . . . . . . . . 4076 1 223 . 1 1 27 27 SER CA C 13 59.8 0.5 . 1 . . . . . . . . 4076 1 224 . 1 1 27 27 SER CB C 13 64.1 0.5 . 1 . . . . . . . . 4076 1 225 . 1 1 27 27 SER C C 13 173.91 0.09 . 1 . . . . . . . . 4076 1 226 . 1 1 28 28 LYS N N 15 121.3 0.1 . 1 . . . . . . . . 4076 1 227 . 1 1 28 28 LYS H H 1 8.16 0.007 . 1 . . . . . . . . 4076 1 228 . 1 1 28 28 LYS CA C 13 58.9 0.5 . 1 . . . . . . . . 4076 1 229 . 1 1 28 28 LYS HA H 1 4.17 0.06 . 1 . . . . . . . . 4076 1 230 . 1 1 28 28 LYS CB C 13 33.6 0.5 . 1 . . . . . . . . 4076 1 231 . 1 1 28 28 LYS HB2 H 1 1.67 0.06 . 2 . . . . . . . . 4076 1 232 . 1 1 28 28 LYS HB3 H 1 1.93 0.06 . 2 . . . . . . . . 4076 1 233 . 1 1 28 28 LYS CG C 13 26.9 0.5 . 1 . . . . . . . . 4076 1 234 . 1 1 28 28 LYS CD C 13 29.6 0.5 . 1 . . . . . . . . 4076 1 235 . 1 1 28 28 LYS CE C 13 42.8 0.5 . 1 . . . . . . . . 4076 1 236 . 1 1 28 28 LYS C C 13 177.35 0.09 . 1 . . . . . . . . 4076 1 237 . 1 1 29 29 GLU N N 15 116.3 0.1 . 1 . . . . . . . . 4076 1 238 . 1 1 29 29 GLU H H 1 8.09 0.007 . 1 . . . . . . . . 4076 1 239 . 1 1 29 29 GLU CA C 13 53.7 0.5 . 1 . . . . . . . . 4076 1 240 . 1 1 29 29 GLU HA H 1 4.75 0.06 . 1 . . . . . . . . 4076 1 241 . 1 1 29 29 GLU CB C 13 32.6 0.5 . 1 . . . . . . . . 4076 1 242 . 1 1 29 29 GLU HB2 H 1 1.83 0.06 . 2 . . . . . . . . 4076 1 243 . 1 1 29 29 GLU HB3 H 1 2.13 0.06 . 2 . . . . . . . . 4076 1 244 . 1 1 29 29 GLU CG C 13 35.9 0.5 . 1 . . . . . . . . 4076 1 245 . 1 1 29 29 GLU HG2 H 1 2.54 0.06 . 2 . . . . . . . . 4076 1 246 . 1 1 29 29 GLU HG3 H 1 2.54 0.06 . 2 . . . . . . . . 4076 1 247 . 1 1 29 29 GLU C C 13 176.61 0.09 . 1 . . . . . . . . 4076 1 248 . 1 1 30 30 LYS N N 15 124.0 0.1 . 1 . . . . . . . . 4076 1 249 . 1 1 30 30 LYS H H 1 8.47 0.007 . 1 . . . . . . . . 4076 1 250 . 1 1 30 30 LYS CA C 13 56.4 0.5 . 1 . . . . . . . . 4076 1 251 . 1 1 30 30 LYS HA H 1 3.53 0.06 . 1 . . . . . . . . 4076 1 252 . 1 1 30 30 LYS CB C 13 34.2 0.5 . 1 . . . . . . . . 4076 1 253 . 1 1 30 30 LYS HB2 H 1 1.24 0.06 . 2 . . . . . . . . 4076 1 254 . 1 1 30 30 LYS HB3 H 1 1.42 0.06 . 2 . . . . . . . . 4076 1 255 . 1 1 30 30 LYS CG C 13 25.6 0.5 . 1 . . . . . . . . 4076 1 256 . 1 1 30 30 LYS CD C 13 29.7 0.5 . 1 . . . . . . . . 4076 1 257 . 1 1 30 30 LYS CE C 13 42.0 0.5 . 1 . . . . . . . . 4076 1 258 . 1 1 30 30 LYS C C 13 176.67 0.09 . 1 . . . . . . . . 4076 1 259 . 1 1 31 31 ASN N N 15 121.0 0.1 . 1 . . . . . . . . 4076 1 260 . 1 1 31 31 ASN H H 1 9.16 0.007 . 1 . . . . . . . . 4076 1 261 . 1 1 31 31 ASN CA C 13 51.1 0.5 . 1 . . . . . . . . 4076 1 262 . 1 1 31 31 ASN HA H 1 4.59 0.06 . 1 . . . . . . . . 4076 1 263 . 1 1 31 31 ASN CB C 13 38.9 0.5 . 1 . . . . . . . . 4076 1 264 . 1 1 31 31 ASN HB2 H 1 3.19 0.06 . 2 . . . . . . . . 4076 1 265 . 1 1 31 31 ASN HB3 H 1 3.19 0.06 . 2 . . . . . . . . 4076 1 266 . 1 1 31 31 ASN C C 13 178.03 0.09 . 1 . . . . . . . . 4076 1 267 . 1 1 32 32 LYS N N 15 118.9 0.1 . 1 . . . . . . . . 4076 1 268 . 1 1 32 32 LYS H H 1 8.31 0.007 . 1 . . . . . . . . 4076 1 269 . 1 1 32 32 LYS CA C 13 58.8 0.5 . 1 . . . . . . . . 4076 1 270 . 1 1 32 32 LYS HA H 1 4.08 0.06 . 1 . . . . . . . . 4076 1 271 . 1 1 32 32 LYS CB C 13 31.7 0.5 . 1 . . . . . . . . 4076 1 272 . 1 1 32 32 LYS HB2 H 1 1.85 0.06 . 2 . . . . . . . . 4076 1 273 . 1 1 32 32 LYS HB3 H 1 1.85 0.06 . 2 . . . . . . . . 4076 1 274 . 1 1 32 32 LYS CG C 13 24.0 0.5 . 1 . . . . . . . . 4076 1 275 . 1 1 32 32 LYS CD C 13 28.9 0.5 . 1 . . . . . . . . 4076 1 276 . 1 1 32 32 LYS CE C 13 42.3 0.5 . 1 . . . . . . . . 4076 1 277 . 1 1 32 32 LYS C C 13 176.90 0.09 . 1 . . . . . . . . 4076 1 278 . 1 1 33 33 ASP N N 15 119.4 0.1 . 1 . . . . . . . . 4076 1 279 . 1 1 33 33 ASP H H 1 7.94 0.007 . 1 . . . . . . . . 4076 1 280 . 1 1 33 33 ASP CA C 13 54.5 0.5 . 1 . . . . . . . . 4076 1 281 . 1 1 33 33 ASP HA H 1 4.78 0.06 . 1 . . . . . . . . 4076 1 282 . 1 1 33 33 ASP CB C 13 41.8 0.5 . 1 . . . . . . . . 4076 1 283 . 1 1 33 33 ASP HB2 H 1 2.54 0.06 . 2 . . . . . . . . 4076 1 284 . 1 1 33 33 ASP HB3 H 1 2.84 0.06 . 2 . . . . . . . . 4076 1 285 . 1 1 33 33 ASP C C 13 176.29 0.09 . 1 . . . . . . . . 4076 1 286 . 1 1 34 34 GLY N N 15 108.8 0.1 . 1 . . . . . . . . 4076 1 287 . 1 1 34 34 GLY H H 1 8.22 0.007 . 1 . . . . . . . . 4076 1 288 . 1 1 34 34 GLY CA C 13 45.8 0.5 . 1 . . . . . . . . 4076 1 289 . 1 1 34 34 GLY HA2 H 1 3.54 0.06 . 2 . . . . . . . . 4076 1 290 . 1 1 34 34 GLY HA3 H 1 4.16 0.06 . 2 . . . . . . . . 4076 1 291 . 1 1 34 34 GLY C C 13 173.25 0.09 . 1 . . . . . . . . 4076 1 292 . 1 1 35 35 LYS N N 15 119.4 0.1 . 1 . . . . . . . . 4076 1 293 . 1 1 35 35 LYS H H 1 7.33 0.007 . 1 . . . . . . . . 4076 1 294 . 1 1 35 35 LYS CA C 13 53.8 0.5 . 1 . . . . . . . . 4076 1 295 . 1 1 35 35 LYS HA H 1 4.54 0.06 . 1 . . . . . . . . 4076 1 296 . 1 1 35 35 LYS CB C 13 36.0 0.5 . 1 . . . . . . . . 4076 1 297 . 1 1 35 35 LYS HB2 H 1 1.55 0.06 . 2 . . . . . . . . 4076 1 298 . 1 1 35 35 LYS HB3 H 1 1.85 0.06 . 2 . . . . . . . . 4076 1 299 . 1 1 35 35 LYS CG C 13 25.2 0.5 . 1 . . . . . . . . 4076 1 300 . 1 1 35 35 LYS CD C 13 28.9 0.5 . 1 . . . . . . . . 4076 1 301 . 1 1 35 35 LYS CE C 13 42.4 0.5 . 1 . . . . . . . . 4076 1 302 . 1 1 35 35 LYS C C 13 173.84 0.09 . 1 . . . . . . . . 4076 1 303 . 1 1 36 36 TYR N N 15 119.7 0.1 . 1 . . . . . . . . 4076 1 304 . 1 1 36 36 TYR H H 1 9.13 0.007 . 1 . . . . . . . . 4076 1 305 . 1 1 36 36 TYR CA C 13 59.3 0.5 . 1 . . . . . . . . 4076 1 306 . 1 1 36 36 TYR HA H 1 4.28 0.06 . 1 . . . . . . . . 4076 1 307 . 1 1 36 36 TYR CB C 13 38.6 0.5 . 1 . . . . . . . . 4076 1 308 . 1 1 36 36 TYR HB2 H 1 2.76 0.06 . 2 . . . . . . . . 4076 1 309 . 1 1 36 36 TYR HB3 H 1 2.88 0.06 . 2 . . . . . . . . 4076 1 310 . 1 1 36 36 TYR C C 13 175.73 0.09 . 1 . . . . . . . . 4076 1 311 . 1 1 37 37 ASP N N 15 123.2 0.1 . 1 . . . . . . . . 4076 1 312 . 1 1 37 37 ASP H H 1 8.48 0.007 . 1 . . . . . . . . 4076 1 313 . 1 1 37 37 ASP CA C 13 55.1 0.5 . 1 . . . . . . . . 4076 1 314 . 1 1 37 37 ASP HA H 1 5.05 0.06 . 1 . . . . . . . . 4076 1 315 . 1 1 37 37 ASP CB C 13 43.9 0.5 . 1 . . . . . . . . 4076 1 316 . 1 1 37 37 ASP HB2 H 1 2.51 0.06 . 2 . . . . . . . . 4076 1 317 . 1 1 37 37 ASP HB3 H 1 2.80 0.06 . 2 . . . . . . . . 4076 1 318 . 1 1 37 37 ASP C C 13 174.57 0.09 . 1 . . . . . . . . 4076 1 319 . 1 1 38 38 LEU N N 15 121.3 0.1 . 1 . . . . . . . . 4076 1 320 . 1 1 38 38 LEU H H 1 8.40 0.007 . 1 . . . . . . . . 4076 1 321 . 1 1 38 38 LEU CA C 13 53.7 0.5 . 1 . . . . . . . . 4076 1 322 . 1 1 38 38 LEU HA H 1 5.63 0.06 . 1 . . . . . . . . 4076 1 323 . 1 1 38 38 LEU CB C 13 46.3 0.5 . 1 . . . . . . . . 4076 1 324 . 1 1 38 38 LEU HB2 H 1 2.51 0.06 . 2 . . . . . . . . 4076 1 325 . 1 1 38 38 LEU HB3 H 1 1.20 0.06 . 2 . . . . . . . . 4076 1 326 . 1 1 38 38 LEU CG C 13 28.2 0.5 . 1 . . . . . . . . 4076 1 327 . 1 1 38 38 LEU CD1 C 13 25.5 0.5 . 2 . . . . . . . . 4076 1 328 . 1 1 38 38 LEU CD2 C 13 25.5 0.5 . 2 . . . . . . . . 4076 1 329 . 1 1 38 38 LEU C C 13 177.29 0.09 . 1 . . . . . . . . 4076 1 330 . 1 1 39 39 ILE N N 15 121.9 0.1 . 1 . . . . . . . . 4076 1 331 . 1 1 39 39 ILE H H 1 8.68 0.007 . 1 . . . . . . . . 4076 1 332 . 1 1 39 39 ILE CA C 13 60.1 0.5 . 1 . . . . . . . . 4076 1 333 . 1 1 39 39 ILE HA H 1 5.14 0.06 . 1 . . . . . . . . 4076 1 334 . 1 1 39 39 ILE CB C 13 42.6 0.5 . 1 . . . . . . . . 4076 1 335 . 1 1 39 39 ILE HB H 1 1.75 0.06 . 1 . . . . . . . . 4076 1 336 . 1 1 39 39 ILE CG1 C 13 27.9 0.5 . 2 . . . . . . . . 4076 1 337 . 1 1 39 39 ILE CD1 C 13 17.6 0.5 . 1 . . . . . . . . 4076 1 338 . 1 1 39 39 ILE C C 13 173.70 0.09 . 1 . . . . . . . . 4076 1 339 . 1 1 40 40 ALA N N 15 127.3 0.1 . 1 . . . . . . . . 4076 1 340 . 1 1 40 40 ALA H H 1 8.57 0.007 . 1 . . . . . . . . 4076 1 341 . 1 1 40 40 ALA CA C 13 51.2 0.5 . 1 . . . . . . . . 4076 1 342 . 1 1 40 40 ALA HA H 1 4.89 0.06 . 1 . . . . . . . . 4076 1 343 . 1 1 40 40 ALA CB C 13 23.6 0.5 . 1 . . . . . . . . 4076 1 344 . 1 1 40 40 ALA HB1 H 1 1.24 0.06 . 1 . . . . . . . . 4076 1 345 . 1 1 40 40 ALA HB2 H 1 1.24 0.06 . 1 . . . . . . . . 4076 1 346 . 1 1 40 40 ALA HB3 H 1 1.24 0.06 . 1 . . . . . . . . 4076 1 347 . 1 1 40 40 ALA C C 13 175.53 0.09 . 1 . . . . . . . . 4076 1 348 . 1 1 41 41 THR N N 15 117.9 0.1 . 1 . . . . . . . . 4076 1 349 . 1 1 41 41 THR H H 1 8.78 0.007 . 1 . . . . . . . . 4076 1 350 . 1 1 41 41 THR CA C 13 61.5 0.5 . 1 . . . . . . . . 4076 1 351 . 1 1 41 41 THR HA H 1 5.22 0.06 . 1 . . . . . . . . 4076 1 352 . 1 1 41 41 THR CB C 13 69.8 0.5 . 1 . . . . . . . . 4076 1 353 . 1 1 41 41 THR HB H 1 3.89 0.06 . 1 . . . . . . . . 4076 1 354 . 1 1 41 41 THR CG2 C 13 20.8 0.5 . 1 . . . . . . . . 4076 1 355 . 1 1 41 41 THR C C 13 174.44 0.09 . 1 . . . . . . . . 4076 1 356 . 1 1 42 42 VAL N N 15 127.7 0.1 . 1 . . . . . . . . 4076 1 357 . 1 1 42 42 VAL H H 1 8.64 0.007 . 1 . . . . . . . . 4076 1 358 . 1 1 42 42 VAL CA C 13 61.2 0.5 . 1 . . . . . . . . 4076 1 359 . 1 1 42 42 VAL HA H 1 4.22 0.06 . 1 . . . . . . . . 4076 1 360 . 1 1 42 42 VAL CB C 13 34.5 0.5 . 1 . . . . . . . . 4076 1 361 . 1 1 42 42 VAL HB H 1 1.83 0.06 . 1 . . . . . . . . 4076 1 362 . 1 1 42 42 VAL CG1 C 13 20.8 0.5 . 2 . . . . . . . . 4076 1 363 . 1 1 42 42 VAL CG2 C 13 20.8 0.5 . 2 . . . . . . . . 4076 1 364 . 1 1 42 42 VAL C C 13 175.28 0.09 . 1 . . . . . . . . 4076 1 365 . 1 1 43 43 ASP N N 15 129.8 0.1 . 1 . . . . . . . . 4076 1 366 . 1 1 43 43 ASP H H 1 9.15 0.007 . 1 . . . . . . . . 4076 1 367 . 1 1 43 43 ASP CA C 13 56.0 0.5 . 1 . . . . . . . . 4076 1 368 . 1 1 43 43 ASP HA H 1 4.17 0.06 . 1 . . . . . . . . 4076 1 369 . 1 1 43 43 ASP CB C 13 39.5 0.5 . 1 . . . . . . . . 4076 1 370 . 1 1 43 43 ASP HB2 H 1 2.54 0.06 . 2 . . . . . . . . 4076 1 371 . 1 1 43 43 ASP HB3 H 1 2.96 0.06 . 2 . . . . . . . . 4076 1 372 . 1 1 43 43 ASP C C 13 175.06 0.09 . 1 . . . . . . . . 4076 1 373 . 1 1 44 44 LYS N N 15 111.7 0.1 . 1 . . . . . . . . 4076 1 374 . 1 1 44 44 LYS H H 1 8.26 0.007 . 1 . . . . . . . . 4076 1 375 . 1 1 44 44 LYS CA C 13 57.9 0.5 . 1 . . . . . . . . 4076 1 376 . 1 1 44 44 LYS HA H 1 3.73 0.06 . 1 . . . . . . . . 4076 1 377 . 1 1 44 44 LYS CB C 13 30.7 0.5 . 1 . . . . . . . . 4076 1 378 . 1 1 44 44 LYS HB2 H 1 2.05 0.06 . 2 . . . . . . . . 4076 1 379 . 1 1 44 44 LYS HB3 H 1 2.05 0.06 . 2 . . . . . . . . 4076 1 380 . 1 1 44 44 LYS CG C 13 25.4 0.5 . 1 . . . . . . . . 4076 1 381 . 1 1 44 44 LYS CD C 13 28.9 0.5 . 1 . . . . . . . . 4076 1 382 . 1 1 44 44 LYS CE C 13 42.4 0.5 . 1 . . . . . . . . 4076 1 383 . 1 1 44 44 LYS C C 13 174.96 0.09 . 1 . . . . . . . . 4076 1 384 . 1 1 45 45 LEU N N 15 125.0 0.1 . 1 . . . . . . . . 4076 1 385 . 1 1 45 45 LEU H H 1 8.09 0.007 . 1 . . . . . . . . 4076 1 386 . 1 1 45 45 LEU CA C 13 54.1 0.5 . 1 . . . . . . . . 4076 1 387 . 1 1 45 45 LEU HA H 1 4.53 0.06 . 1 . . . . . . . . 4076 1 388 . 1 1 45 45 LEU CB C 13 44.2 0.5 . 1 . . . . . . . . 4076 1 389 . 1 1 45 45 LEU HB2 H 1 1.49 0.06 . 2 . . . . . . . . 4076 1 390 . 1 1 45 45 LEU HB3 H 1 1.88 0.06 . 2 . . . . . . . . 4076 1 391 . 1 1 45 45 LEU CG C 13 26.2 0.5 . 1 . . . . . . . . 4076 1 392 . 1 1 45 45 LEU CD1 C 13 24.3 0.5 . 2 . . . . . . . . 4076 1 393 . 1 1 45 45 LEU CD2 C 13 24.3 0.5 . 2 . . . . . . . . 4076 1 394 . 1 1 45 45 LEU C C 13 174.87 0.09 . 1 . . . . . . . . 4076 1 395 . 1 1 46 46 GLU N N 15 126.6 0.1 . 1 . . . . . . . . 4076 1 396 . 1 1 46 46 GLU H H 1 8.35 0.007 . 1 . . . . . . . . 4076 1 397 . 1 1 46 46 GLU CA C 13 56.2 0.5 . 1 . . . . . . . . 4076 1 398 . 1 1 46 46 GLU HA H 1 4.66 0.06 . 1 . . . . . . . . 4076 1 399 . 1 1 46 46 GLU CB C 13 30.9 0.5 . 1 . . . . . . . . 4076 1 400 . 1 1 46 46 GLU HB2 H 1 1.97 0.06 . 2 . . . . . . . . 4076 1 401 . 1 1 46 46 GLU HB3 H 1 1.97 0.06 . 2 . . . . . . . . 4076 1 402 . 1 1 46 46 GLU CG C 13 37.4 0.5 . 1 . . . . . . . . 4076 1 403 . 1 1 46 46 GLU HG2 H 1 2.15 0.06 . 2 . . . . . . . . 4076 1 404 . 1 1 46 46 GLU HG3 H 1 2.15 0.06 . 2 . . . . . . . . 4076 1 405 . 1 1 46 46 GLU C C 13 175.08 0.09 . 1 . . . . . . . . 4076 1 406 . 1 1 47 47 LEU N N 15 128.5 0.1 . 1 . . . . . . . . 4076 1 407 . 1 1 47 47 LEU H H 1 9.34 0.007 . 1 . . . . . . . . 4076 1 408 . 1 1 47 47 LEU CA C 13 53.6 0.5 . 1 . . . . . . . . 4076 1 409 . 1 1 47 47 LEU HA H 1 4.65 0.06 . 1 . . . . . . . . 4076 1 410 . 1 1 47 47 LEU CB C 13 44.4 0.5 . 1 . . . . . . . . 4076 1 411 . 1 1 47 47 LEU HB2 H 1 1.16 0.06 . 2 . . . . . . . . 4076 1 412 . 1 1 47 47 LEU HB3 H 1 1.62 0.06 . 2 . . . . . . . . 4076 1 413 . 1 1 47 47 LEU CG C 13 27.3 0.5 . 1 . . . . . . . . 4076 1 414 . 1 1 47 47 LEU CD1 C 13 23.7 0.5 . 2 . . . . . . . . 4076 1 415 . 1 1 47 47 LEU CD2 C 13 23.7 0.5 . 2 . . . . . . . . 4076 1 416 . 1 1 47 47 LEU C C 13 175.38 0.09 . 1 . . . . . . . . 4076 1 417 . 1 1 48 48 LYS N N 15 119.2 0.1 . 1 . . . . . . . . 4076 1 418 . 1 1 48 48 LYS H H 1 8.40 0.007 . 1 . . . . . . . . 4076 1 419 . 1 1 48 48 LYS CA C 13 55.1 0.5 . 1 . . . . . . . . 4076 1 420 . 1 1 48 48 LYS HA H 1 5.57 0.06 . 1 . . . . . . . . 4076 1 421 . 1 1 48 48 LYS CB C 13 37.3 0.5 . 1 . . . . . . . . 4076 1 422 . 1 1 48 48 LYS HB2 H 1 1.93 0.06 . 2 . . . . . . . . 4076 1 423 . 1 1 48 48 LYS HB3 H 1 2.01 0.06 . 2 . . . . . . . . 4076 1 424 . 1 1 48 48 LYS CG C 13 25.2 0.5 . 1 . . . . . . . . 4076 1 425 . 1 1 48 48 LYS CD C 13 29.4 0.5 . 1 . . . . . . . . 4076 1 426 . 1 1 48 48 LYS CE C 13 42.4 0.5 . 1 . . . . . . . . 4076 1 427 . 1 1 48 48 LYS C C 13 176.91 0.09 . 1 . . . . . . . . 4076 1 428 . 1 1 49 49 GLY N N 15 112.3 0.1 . 1 . . . . . . . . 4076 1 429 . 1 1 49 49 GLY H H 1 8.92 0.007 . 1 . . . . . . . . 4076 1 430 . 1 1 49 49 GLY CA C 13 45.6 0.5 . 1 . . . . . . . . 4076 1 431 . 1 1 49 49 GLY HA2 H 1 4.76 0.06 . 2 . . . . . . . . 4076 1 432 . 1 1 49 49 GLY HA3 H 1 4.76 0.06 . 2 . . . . . . . . 4076 1 433 . 1 1 49 49 GLY C C 13 172.16 0.09 . 1 . . . . . . . . 4076 1 434 . 1 1 50 50 THR N N 15 112.0 0.1 . 1 . . . . . . . . 4076 1 435 . 1 1 50 50 THR H H 1 8.49 0.007 . 1 . . . . . . . . 4076 1 436 . 1 1 50 50 THR CA C 13 59.8 0.5 . 1 . . . . . . . . 4076 1 437 . 1 1 50 50 THR HA H 1 5.77 0.06 . 1 . . . . . . . . 4076 1 438 . 1 1 50 50 THR CB C 13 73.1 0.5 . 1 . . . . . . . . 4076 1 439 . 1 1 50 50 THR HB H 1 4.05 0.06 . 1 . . . . . . . . 4076 1 440 . 1 1 50 50 THR C C 13 174.02 0.09 . 1 . . . . . . . . 4076 1 441 . 1 1 51 51 SER N N 15 113.6 0.1 . 1 . . . . . . . . 4076 1 442 . 1 1 51 51 SER H H 1 8.94 0.007 . 1 . . . . . . . . 4076 1 443 . 1 1 51 51 SER CA C 13 56.6 0.5 . 1 . . . . . . . . 4076 1 444 . 1 1 51 51 SER HA H 1 4.98 0.06 . 1 . . . . . . . . 4076 1 445 . 1 1 51 51 SER CB C 13 65.4 0.5 . 1 . . . . . . . . 4076 1 446 . 1 1 51 51 SER HB2 H 1 4.23 0.06 . 2 . . . . . . . . 4076 1 447 . 1 1 51 51 SER HB3 H 1 4.23 0.06 . 2 . . . . . . . . 4076 1 448 . 1 1 51 51 SER C C 13 173.62 0.09 . 1 . . . . . . . . 4076 1 449 . 1 1 52 52 ASP N N 15 125.3 0.1 . 1 . . . . . . . . 4076 1 450 . 1 1 52 52 ASP H H 1 8.86 0.007 . 1 . . . . . . . . 4076 1 451 . 1 1 52 52 ASP CA C 13 55.7 0.5 . 1 . . . . . . . . 4076 1 452 . 1 1 52 52 ASP HA H 1 4.89 0.06 . 1 . . . . . . . . 4076 1 453 . 1 1 52 52 ASP CB C 13 41.1 0.5 . 1 . . . . . . . . 4076 1 454 . 1 1 52 52 ASP HB2 H 1 2.80 0.06 . 2 . . . . . . . . 4076 1 455 . 1 1 52 52 ASP HB3 H 1 2.80 0.06 . 2 . . . . . . . . 4076 1 456 . 1 1 52 52 ASP C C 13 176.11 0.09 . 1 . . . . . . . . 4076 1 457 . 1 1 53 53 LYS N N 15 120.3 0.1 . 1 . . . . . . . . 4076 1 458 . 1 1 53 53 LYS H H 1 8.66 0.007 . 1 . . . . . . . . 4076 1 459 . 1 1 53 53 LYS CA C 13 55.1 0.5 . 1 . . . . . . . . 4076 1 460 . 1 1 53 53 LYS HA H 1 4.65 0.06 . 1 . . . . . . . . 4076 1 461 . 1 1 53 53 LYS CB C 13 35.4 0.5 . 1 . . . . . . . . 4076 1 462 . 1 1 53 53 LYS HB2 H 1 1.69 0.06 . 2 . . . . . . . . 4076 1 463 . 1 1 53 53 LYS HB3 H 1 1.86 0.06 . 2 . . . . . . . . 4076 1 464 . 1 1 53 53 LYS CG C 13 24.8 0.5 . 1 . . . . . . . . 4076 1 465 . 1 1 53 53 LYS CD C 13 28.8 0.5 . 1 . . . . . . . . 4076 1 466 . 1 1 53 53 LYS CE C 13 42.1 0.5 . 1 . . . . . . . . 4076 1 467 . 1 1 53 53 LYS C C 13 176.04 0.09 . 1 . . . . . . . . 4076 1 468 . 1 1 54 54 ASN N N 15 117.3 0.1 . 1 . . . . . . . . 4076 1 469 . 1 1 54 54 ASN H H 1 7.77 0.007 . 1 . . . . . . . . 4076 1 470 . 1 1 54 54 ASN CA C 13 50.9 0.5 . 1 . . . . . . . . 4076 1 471 . 1 1 54 54 ASN HA H 1 4.12 0.06 . 1 . . . . . . . . 4076 1 472 . 1 1 54 54 ASN CB C 13 36.4 0.5 . 1 . . . . . . . . 4076 1 473 . 1 1 54 54 ASN HB2 H 1 2.50 0.06 . 2 . . . . . . . . 4076 1 474 . 1 1 54 54 ASN HB3 H 1 2.50 0.06 . 2 . . . . . . . . 4076 1 475 . 1 1 54 54 ASN C C 13 174.47 0.09 . 1 . . . . . . . . 4076 1 476 . 1 1 55 55 ASN N N 15 116.0 0.1 . 1 . . . . . . . . 4076 1 477 . 1 1 55 55 ASN H H 1 7.57 0.007 . 1 . . . . . . . . 4076 1 478 . 1 1 55 55 ASN CA C 13 52.9 0.5 . 1 . . . . . . . . 4076 1 479 . 1 1 55 55 ASN HA H 1 4.48 0.06 . 1 . . . . . . . . 4076 1 480 . 1 1 55 55 ASN CB C 13 38.1 0.5 . 1 . . . . . . . . 4076 1 481 . 1 1 55 55 ASN HB2 H 1 2.83 0.06 . 2 . . . . . . . . 4076 1 482 . 1 1 55 55 ASN HB3 H 1 3.13 0.06 . 2 . . . . . . . . 4076 1 483 . 1 1 55 55 ASN C C 13 173.84 0.09 . 1 . . . . . . . . 4076 1 484 . 1 1 56 56 GLY N N 15 110.4 0.1 . 1 . . . . . . . . 4076 1 485 . 1 1 56 56 GLY H H 1 9.06 0.007 . 1 . . . . . . . . 4076 1 486 . 1 1 56 56 GLY CA C 13 44.5 0.5 . 1 . . . . . . . . 4076 1 487 . 1 1 56 56 GLY HA2 H 1 2.98 0.06 . 2 . . . . . . . . 4076 1 488 . 1 1 56 56 GLY HA3 H 1 4.22 0.06 . 2 . . . . . . . . 4076 1 489 . 1 1 56 56 GLY C C 13 170.07 0.09 . 1 . . . . . . . . 4076 1 490 . 1 1 57 57 SER N N 15 110.4 0.1 . 1 . . . . . . . . 4076 1 491 . 1 1 57 57 SER H H 1 7.04 0.007 . 1 . . . . . . . . 4076 1 492 . 1 1 57 57 SER CA C 13 57.4 0.5 . 1 . . . . . . . . 4076 1 493 . 1 1 57 57 SER HA H 1 3.97 0.06 . 1 . . . . . . . . 4076 1 494 . 1 1 57 57 SER CB C 13 66.0 0.5 . 1 . . . . . . . . 4076 1 495 . 1 1 57 57 SER HB2 H 1 3.78 0.06 . 2 . . . . . . . . 4076 1 496 . 1 1 57 57 SER HB3 H 1 3.78 0.06 . 2 . . . . . . . . 4076 1 497 . 1 1 57 57 SER C C 13 174.17 0.09 . 1 . . . . . . . . 4076 1 498 . 1 1 58 58 GLY N N 15 107.0 0.1 . 1 . . . . . . . . 4076 1 499 . 1 1 58 58 GLY H H 1 7.68 0.007 . 1 . . . . . . . . 4076 1 500 . 1 1 58 58 GLY CA C 13 44.2 0.5 . 1 . . . . . . . . 4076 1 501 . 1 1 58 58 GLY HA2 H 1 3.94 0.06 . 2 . . . . . . . . 4076 1 502 . 1 1 58 58 GLY HA3 H 1 4.49 0.06 . 2 . . . . . . . . 4076 1 503 . 1 1 58 58 GLY C C 13 170.82 0.09 . 1 . . . . . . . . 4076 1 504 . 1 1 59 59 VAL N N 15 120.0 0.1 . 1 . . . . . . . . 4076 1 505 . 1 1 59 59 VAL H H 1 8.10 0.007 . 1 . . . . . . . . 4076 1 506 . 1 1 59 59 VAL CA C 13 61.3 0.5 . 1 . . . . . . . . 4076 1 507 . 1 1 59 59 VAL HA H 1 5.15 0.06 . 1 . . . . . . . . 4076 1 508 . 1 1 59 59 VAL CB C 13 34.6 0.5 . 1 . . . . . . . . 4076 1 509 . 1 1 59 59 VAL HB H 1 1.98 0.06 . 1 . . . . . . . . 4076 1 510 . 1 1 59 59 VAL CG1 C 13 21.4 0.5 . 2 . . . . . . . . 4076 1 511 . 1 1 59 59 VAL CG2 C 13 21.4 0.5 . 2 . . . . . . . . 4076 1 512 . 1 1 59 59 VAL C C 13 175.23 0.09 . 1 . . . . . . . . 4076 1 513 . 1 1 60 60 LEU N N 15 127.7 0.1 . 1 . . . . . . . . 4076 1 514 . 1 1 60 60 LEU H H 1 9.52 0.007 . 1 . . . . . . . . 4076 1 515 . 1 1 60 60 LEU CA C 13 54.9 0.5 . 1 . . . . . . . . 4076 1 516 . 1 1 60 60 LEU HA H 1 4.88 0.06 . 1 . . . . . . . . 4076 1 517 . 1 1 60 60 LEU CB C 13 46.5 0.5 . 1 . . . . . . . . 4076 1 518 . 1 1 60 60 LEU HB2 H 1 1.49 0.06 . 2 . . . . . . . . 4076 1 519 . 1 1 60 60 LEU HB3 H 1 1.49 0.06 . 2 . . . . . . . . 4076 1 520 . 1 1 60 60 LEU CG C 13 29.4 0.5 . 1 . . . . . . . . 4076 1 521 . 1 1 60 60 LEU CD1 C 13 26.3 0.5 . 2 . . . . . . . . 4076 1 522 . 1 1 60 60 LEU CD2 C 13 26.3 0.5 . 2 . . . . . . . . 4076 1 523 . 1 1 60 60 LEU C C 13 175.22 0.09 . 1 . . . . . . . . 4076 1 524 . 1 1 61 61 GLU N N 15 118.9 0.1 . 1 . . . . . . . . 4076 1 525 . 1 1 61 61 GLU H H 1 8.67 0.007 . 1 . . . . . . . . 4076 1 526 . 1 1 61 61 GLU CA C 13 55.0 0.5 . 1 . . . . . . . . 4076 1 527 . 1 1 61 61 GLU HA H 1 5.75 0.06 . 1 . . . . . . . . 4076 1 528 . 1 1 61 61 GLU CB C 13 35.9 0.5 . 1 . . . . . . . . 4076 1 529 . 1 1 61 61 GLU HB2 H 1 2.08 0.06 . 2 . . . . . . . . 4076 1 530 . 1 1 61 61 GLU HB3 H 1 2.26 0.06 . 2 . . . . . . . . 4076 1 531 . 1 1 61 61 GLU CG C 13 37.4 0.5 . 1 . . . . . . . . 4076 1 532 . 1 1 61 61 GLU C C 13 176.46 0.09 . 1 . . . . . . . . 4076 1 533 . 1 1 62 62 GLY N N 15 110.7 0.1 . 1 . . . . . . . . 4076 1 534 . 1 1 62 62 GLY H H 1 8.85 0.007 . 1 . . . . . . . . 4076 1 535 . 1 1 62 62 GLY CA C 13 45.3 0.5 . 1 . . . . . . . . 4076 1 536 . 1 1 62 62 GLY HA2 H 1 3.89 0.06 . 2 . . . . . . . . 4076 1 537 . 1 1 62 62 GLY HA3 H 1 4.64 0.06 . 2 . . . . . . . . 4076 1 538 . 1 1 62 62 GLY C C 13 171.05 0.09 . 1 . . . . . . . . 4076 1 539 . 1 1 63 63 VAL N N 15 121.3 0.1 . 1 . . . . . . . . 4076 1 540 . 1 1 63 63 VAL H H 1 8.56 0.007 . 1 . . . . . . . . 4076 1 541 . 1 1 63 63 VAL CA C 13 61.1 0.5 . 1 . . . . . . . . 4076 1 542 . 1 1 63 63 VAL HA H 1 5.00 0.06 . 1 . . . . . . . . 4076 1 543 . 1 1 63 63 VAL CB C 13 35.0 0.5 . 1 . . . . . . . . 4076 1 544 . 1 1 63 63 VAL HB H 1 1.97 0.06 . 1 . . . . . . . . 4076 1 545 . 1 1 63 63 VAL CG1 C 13 20.8 0.5 . 2 . . . . . . . . 4076 1 546 . 1 1 63 63 VAL CG2 C 13 20.8 0.5 . 2 . . . . . . . . 4076 1 547 . 1 1 63 63 VAL C C 13 175.47 0.09 . 1 . . . . . . . . 4076 1 548 . 1 1 64 64 LYS N N 15 125.3 0.1 . 1 . . . . . . . . 4076 1 549 . 1 1 64 64 LYS H H 1 8.72 0.007 . 1 . . . . . . . . 4076 1 550 . 1 1 64 64 LYS CA C 13 56.4 0.5 . 1 . . . . . . . . 4076 1 551 . 1 1 64 64 LYS HA H 1 4.41 0.06 . 1 . . . . . . . . 4076 1 552 . 1 1 64 64 LYS CB C 13 34.7 0.5 . 1 . . . . . . . . 4076 1 553 . 1 1 64 64 LYS CG C 13 26.4 0.5 . 1 . . . . . . . . 4076 1 554 . 1 1 64 64 LYS CD C 13 29.3 0.5 . 1 . . . . . . . . 4076 1 555 . 1 1 64 64 LYS CE C 13 41.5 0.5 . 1 . . . . . . . . 4076 1 556 . 1 1 64 64 LYS C C 13 178.77 0.09 . 1 . . . . . . . . 4076 1 557 . 1 1 65 65 ALA N N 15 125.6 0.1 . 1 . . . . . . . . 4076 1 558 . 1 1 65 65 ALA H H 1 8.75 0.007 . 1 . . . . . . . . 4076 1 559 . 1 1 65 65 ALA CA C 13 55.1 0.5 . 1 . . . . . . . . 4076 1 560 . 1 1 65 65 ALA HA H 1 4.16 0.06 . 1 . . . . . . . . 4076 1 561 . 1 1 65 65 ALA CB C 13 18.1 0.5 . 1 . . . . . . . . 4076 1 562 . 1 1 65 65 ALA HB1 H 1 1.49 0.06 . 2 . . . . . . . . 4076 1 563 . 1 1 65 65 ALA HB2 H 1 1.49 0.06 . 2 . . . . . . . . 4076 1 564 . 1 1 65 65 ALA HB3 H 1 1.49 0.06 . 2 . . . . . . . . 4076 1 565 . 1 1 65 65 ALA C C 13 178.03 0.09 . 1 . . . . . . . . 4076 1 566 . 1 1 66 66 ASP N N 15 115.7 0.1 . 1 . . . . . . . . 4076 1 567 . 1 1 66 66 ASP H H 1 7.47 0.007 . 1 . . . . . . . . 4076 1 568 . 1 1 66 66 ASP CA C 13 53.3 0.5 . 1 . . . . . . . . 4076 1 569 . 1 1 66 66 ASP HA H 1 4.50 0.06 . 1 . . . . . . . . 4076 1 570 . 1 1 66 66 ASP CB C 13 39.6 0.5 . 1 . . . . . . . . 4076 1 571 . 1 1 66 66 ASP HB2 H 1 2.55 0.06 . 2 . . . . . . . . 4076 1 572 . 1 1 66 66 ASP HB3 H 1 3.12 0.06 . 2 . . . . . . . . 4076 1 573 . 1 1 66 66 ASP C C 13 176.44 0.09 . 1 . . . . . . . . 4076 1 574 . 1 1 67 67 LYS N N 15 112.0 0.1 . 1 . . . . . . . . 4076 1 575 . 1 1 67 67 LYS H H 1 7.99 0.007 . 1 . . . . . . . . 4076 1 576 . 1 1 67 67 LYS CA C 13 59.2 0.5 . 1 . . . . . . . . 4076 1 577 . 1 1 67 67 LYS HA H 1 3.67 0.06 . 1 . . . . . . . . 4076 1 578 . 1 1 67 67 LYS CB C 13 29.6 0.5 . 1 . . . . . . . . 4076 1 579 . 1 1 67 67 LYS HB2 H 1 2.02 0.06 . 2 . . . . . . . . 4076 1 580 . 1 1 67 67 LYS HB3 H 1 2.44 0.06 . 2 . . . . . . . . 4076 1 581 . 1 1 67 67 LYS CD C 13 25.5 0.5 . 1 . . . . . . . . 4076 1 582 . 1 1 67 67 LYS CE C 13 42.4 0.5 . 1 . . . . . . . . 4076 1 583 . 1 1 67 67 LYS C C 13 175.66 0.09 . 1 . . . . . . . . 4076 1 584 . 1 1 68 68 SER N N 15 116.5 0.1 . 1 . . . . . . . . 4076 1 585 . 1 1 68 68 SER H H 1 8.14 0.007 . 1 . . . . . . . . 4076 1 586 . 1 1 68 68 SER CA C 13 60.8 0.5 . 1 . . . . . . . . 4076 1 587 . 1 1 68 68 SER HA H 1 4.22 0.06 . 1 . . . . . . . . 4076 1 588 . 1 1 68 68 SER CB C 13 63.1 0.5 . 1 . . . . . . . . 4076 1 589 . 1 1 68 68 SER HB2 H 1 4.03 0.06 . 2 . . . . . . . . 4076 1 590 . 1 1 68 68 SER HB3 H 1 4.03 0.06 . 2 . . . . . . . . 4076 1 591 . 1 1 68 68 SER C C 13 172.79 0.09 . 1 . . . . . . . . 4076 1 592 . 1 1 69 69 LYS N N 15 124.0 0.1 . 1 . . . . . . . . 4076 1 593 . 1 1 69 69 LYS H H 1 7.81 0.007 . 1 . . . . . . . . 4076 1 594 . 1 1 69 69 LYS CA C 13 55.6 0.5 . 1 . . . . . . . . 4076 1 595 . 1 1 69 69 LYS HA H 1 4.95 0.06 . 1 . . . . . . . . 4076 1 596 . 1 1 69 69 LYS CB C 13 35.1 0.5 . 1 . . . . . . . . 4076 1 597 . 1 1 69 69 LYS HB2 H 1 1.76 0.06 . 2 . . . . . . . . 4076 1 598 . 1 1 69 69 LYS HB3 H 1 1.99 0.06 . 2 . . . . . . . . 4076 1 599 . 1 1 69 69 LYS CG C 13 25.6 0.5 . 1 . . . . . . . . 4076 1 600 . 1 1 69 69 LYS CD C 13 28.9 0.5 . 1 . . . . . . . . 4076 1 601 . 1 1 69 69 LYS CE C 13 42.4 0.5 . 1 . . . . . . . . 4076 1 602 . 1 1 69 69 LYS C C 13 174.70 0.09 . 1 . . . . . . . . 4076 1 603 . 1 1 70 70 VAL N N 15 124.2 0.1 . 1 . . . . . . . . 4076 1 604 . 1 1 70 70 VAL H H 1 8.69 0.007 . 1 . . . . . . . . 4076 1 605 . 1 1 70 70 VAL CA C 13 61.2 0.5 . 1 . . . . . . . . 4076 1 606 . 1 1 70 70 VAL HA H 1 5.10 0.06 . 1 . . . . . . . . 4076 1 607 . 1 1 70 70 VAL CB C 13 34.5 0.5 . 1 . . . . . . . . 4076 1 608 . 1 1 70 70 VAL HB H 1 1.64 0.06 . 1 . . . . . . . . 4076 1 609 . 1 1 70 70 VAL CG1 C 13 21.8 0.5 . 2 . . . . . . . . 4076 1 610 . 1 1 70 70 VAL CG2 C 13 21.8 0.5 . 2 . . . . . . . . 4076 1 611 . 1 1 70 70 VAL C C 13 174.48 0.09 . 1 . . . . . . . . 4076 1 612 . 1 1 71 71 LYS N N 15 129.1 0.1 . 1 . . . . . . . . 4076 1 613 . 1 1 71 71 LYS H H 1 9.48 0.007 . 1 . . . . . . . . 4076 1 614 . 1 1 71 71 LYS CA C 13 55.3 0.5 . 1 . . . . . . . . 4076 1 615 . 1 1 71 71 LYS HA H 1 5.33 0.06 . 1 . . . . . . . . 4076 1 616 . 1 1 71 71 LYS CB C 13 37.8 0.5 . 1 . . . . . . . . 4076 1 617 . 1 1 71 71 LYS HB2 H 1 1.83 0.06 . 2 . . . . . . . . 4076 1 618 . 1 1 71 71 LYS HB3 H 1 2.05 0.06 . 2 . . . . . . . . 4076 1 619 . 1 1 71 71 LYS CG C 13 25.6 0.5 . 1 . . . . . . . . 4076 1 620 . 1 1 71 71 LYS CD C 13 29.8 0.5 . 1 . . . . . . . . 4076 1 621 . 1 1 71 71 LYS CE C 13 42.2 0.5 . 1 . . . . . . . . 4076 1 622 . 1 1 71 71 LYS C C 13 174.06 0.09 . 1 . . . . . . . . 4076 1 623 . 1 1 72 72 LEU N N 15 132.5 0.1 . 1 . . . . . . . . 4076 1 624 . 1 1 72 72 LEU H H 1 9.57 0.007 . 1 . . . . . . . . 4076 1 625 . 1 1 72 72 LEU CA C 13 53.0 0.5 . 1 . . . . . . . . 4076 1 626 . 1 1 72 72 LEU HA H 1 5.51 0.06 . 1 . . . . . . . . 4076 1 627 . 1 1 72 72 LEU CB C 13 46.1 0.5 . 1 . . . . . . . . 4076 1 628 . 1 1 72 72 LEU HB2 H 1 1.08 0.06 . 2 . . . . . . . . 4076 1 629 . 1 1 72 72 LEU HB3 H 1 1.80 0.06 . 2 . . . . . . . . 4076 1 630 . 1 1 72 72 LEU CG C 13 26.5 0.5 . 1 . . . . . . . . 4076 1 631 . 1 1 72 72 LEU C C 13 174.04 0.09 . 1 . . . . . . . . 4076 1 632 . 1 1 73 73 THR N N 15 124.2 0.1 . 1 . . . . . . . . 4076 1 633 . 1 1 73 73 THR H H 1 9.40 0.007 . 1 . . . . . . . . 4076 1 634 . 1 1 73 73 THR CA C 13 62.6 0.5 . 1 . . . . . . . . 4076 1 635 . 1 1 73 73 THR HA H 1 4.96 0.06 . 1 . . . . . . . . 4076 1 636 . 1 1 73 73 THR CB C 13 69.9 0.5 . 1 . . . . . . . . 4076 1 637 . 1 1 73 73 THR CG2 C 13 20.4 0.5 . 1 . . . . . . . . 4076 1 638 . 1 1 73 73 THR C C 13 174.24 0.09 . 1 . . . . . . . . 4076 1 639 . 1 1 74 74 ILE N N 15 132.2 0.1 . 1 . . . . . . . . 4076 1 640 . 1 1 74 74 ILE H H 1 9.47 0.007 . 1 . . . . . . . . 4076 1 641 . 1 1 74 74 ILE CA C 13 61.2 0.5 . 1 . . . . . . . . 4076 1 642 . 1 1 74 74 ILE HA H 1 4.56 0.06 . 1 . . . . . . . . 4076 1 643 . 1 1 74 74 ILE CB C 13 40.4 0.5 . 1 . . . . . . . . 4076 1 644 . 1 1 74 74 ILE HB H 1 1.92 0.06 . 1 . . . . . . . . 4076 1 645 . 1 1 74 74 ILE CG1 C 13 28.5 0.5 . 2 . . . . . . . . 4076 1 646 . 1 1 74 74 ILE CD1 C 13 16.1 0.5 . 1 . . . . . . . . 4076 1 647 . 1 1 74 74 ILE CG2 C 13 19.8 0.5 . 2 . . . . . . . . 4076 1 648 . 1 1 74 74 ILE C C 13 176.53 0.09 . 1 . . . . . . . . 4076 1 649 . 1 1 75 75 SER N N 15 124.8 0.1 . 1 . . . . . . . . 4076 1 650 . 1 1 75 75 SER H H 1 8.40 0.007 . 1 . . . . . . . . 4076 1 651 . 1 1 75 75 SER CA C 13 59.7 0.5 . 1 . . . . . . . . 4076 1 652 . 1 1 75 75 SER HA H 1 4.42 0.06 . 1 . . . . . . . . 4076 1 653 . 1 1 75 75 SER CB C 13 64.3 0.5 . 1 . . . . . . . . 4076 1 654 . 1 1 75 75 SER HB2 H 1 3.89 0.06 . 2 . . . . . . . . 4076 1 655 . 1 1 75 75 SER HB3 H 1 4.06 0.06 . 2 . . . . . . . . 4076 1 656 . 1 1 75 75 SER C C 13 174.83 0.09 . 1 . . . . . . . . 4076 1 657 . 1 1 76 76 ASP N N 15 121.0 0.1 . 1 . . . . . . . . 4076 1 658 . 1 1 76 76 ASP H H 1 8.51 0.007 . 1 . . . . . . . . 4076 1 659 . 1 1 76 76 ASP CA C 13 57.7 0.5 . 1 . . . . . . . . 4076 1 660 . 1 1 76 76 ASP HA H 1 4.38 0.06 . 1 . . . . . . . . 4076 1 661 . 1 1 76 76 ASP CB C 13 41.2 0.5 . 1 . . . . . . . . 4076 1 662 . 1 1 76 76 ASP HB2 H 1 2.63 0.06 . 2 . . . . . . . . 4076 1 663 . 1 1 76 76 ASP HB3 H 1 2.63 0.06 . 2 . . . . . . . . 4076 1 664 . 1 1 76 76 ASP C C 13 176.25 0.09 . 1 . . . . . . . . 4076 1 665 . 1 1 77 77 ASP N N 15 115.4 0.1 . 1 . . . . . . . . 4076 1 666 . 1 1 77 77 ASP H H 1 7.79 0.007 . 1 . . . . . . . . 4076 1 667 . 1 1 77 77 ASP CA C 13 52.3 0.5 . 1 . . . . . . . . 4076 1 668 . 1 1 77 77 ASP HA H 1 4.49 0.06 . 1 . . . . . . . . 4076 1 669 . 1 1 77 77 ASP CB C 13 40.3 0.5 . 1 . . . . . . . . 4076 1 670 . 1 1 77 77 ASP HB2 H 1 2.52 0.06 . 2 . . . . . . . . 4076 1 671 . 1 1 77 77 ASP HB3 H 1 2.99 0.06 . 2 . . . . . . . . 4076 1 672 . 1 1 77 77 ASP C C 13 176.90 0.09 . 1 . . . . . . . . 4076 1 673 . 1 1 78 78 LEU N N 15 117.3 0.1 . 1 . . . . . . . . 4076 1 674 . 1 1 78 78 LEU H H 1 8.33 0.007 . 1 . . . . . . . . 4076 1 675 . 1 1 78 78 LEU CA C 13 56.5 0.5 . 1 . . . . . . . . 4076 1 676 . 1 1 78 78 LEU HA H 1 3.54 0.06 . 1 . . . . . . . . 4076 1 677 . 1 1 78 78 LEU CB C 13 39.1 0.5 . 1 . . . . . . . . 4076 1 678 . 1 1 78 78 LEU HB2 H 1 1.51 0.06 . 2 . . . . . . . . 4076 1 679 . 1 1 78 78 LEU HB3 H 1 2.08 0.06 . 2 . . . . . . . . 4076 1 680 . 1 1 78 78 LEU CG C 13 27.5 0.5 . 1 . . . . . . . . 4076 1 681 . 1 1 78 78 LEU CD1 C 13 22.9 0.5 . 2 . . . . . . . . 4076 1 682 . 1 1 78 78 LEU CD2 C 13 25.4 0.5 . 2 . . . . . . . . 4076 1 683 . 1 1 78 78 LEU C C 13 176.17 0.09 . 1 . . . . . . . . 4076 1 684 . 1 1 79 79 GLY N N 15 105.6 0.1 . 1 . . . . . . . . 4076 1 685 . 1 1 79 79 GLY H H 1 8.13 0.007 . 1 . . . . . . . . 4076 1 686 . 1 1 79 79 GLY CA C 13 46.2 0.5 . 1 . . . . . . . . 4076 1 687 . 1 1 79 79 GLY HA2 H 1 3.63 0.06 . 2 . . . . . . . . 4076 1 688 . 1 1 79 79 GLY HA3 H 1 3.90 0.06 . 2 . . . . . . . . 4076 1 689 . 1 1 79 79 GLY C C 13 173.68 0.09 . 1 . . . . . . . . 4076 1 690 . 1 1 80 80 GLN N N 15 118.7 0.1 . 1 . . . . . . . . 4076 1 691 . 1 1 80 80 GLN H H 1 7.83 0.007 . 1 . . . . . . . . 4076 1 692 . 1 1 80 80 GLN CA C 13 54.9 0.5 . 1 . . . . . . . . 4076 1 693 . 1 1 80 80 GLN HA H 1 5.37 0.06 . 1 . . . . . . . . 4076 1 694 . 1 1 80 80 GLN CB C 13 33.9 0.5 . 1 . . . . . . . . 4076 1 695 . 1 1 80 80 GLN HB2 H 1 1.95 0.06 . 2 . . . . . . . . 4076 1 696 . 1 1 80 80 GLN HB3 H 1 1.95 0.06 . 2 . . . . . . . . 4076 1 697 . 1 1 80 80 GLN C C 13 174.74 0.09 . 1 . . . . . . . . 4076 1 698 . 1 1 81 81 THR N N 15 114.1 0.1 . 1 . . . . . . . . 4076 1 699 . 1 1 81 81 THR H H 1 8.86 0.007 . 1 . . . . . . . . 4076 1 700 . 1 1 81 81 THR CA C 13 59.0 0.5 . 1 . . . . . . . . 4076 1 701 . 1 1 81 81 THR HA H 1 5.17 0.06 . 1 . . . . . . . . 4076 1 702 . 1 1 81 81 THR CB C 13 71.2 0.5 . 1 . . . . . . . . 4076 1 703 . 1 1 81 81 THR HB H 1 4.00 0.06 . 1 . . . . . . . . 4076 1 704 . 1 1 81 81 THR CG2 C 13 20.3 0.5 . 1 . . . . . . . . 4076 1 705 . 1 1 81 81 THR C C 13 173.56 0.09 . 1 . . . . . . . . 4076 1 706 . 1 1 82 82 THR N N 15 119.7 0.1 . 1 . . . . . . . . 4076 1 707 . 1 1 82 82 THR H H 1 9.04 0.007 . 1 . . . . . . . . 4076 1 708 . 1 1 82 82 THR CA C 13 62.1 0.5 . 1 . . . . . . . . 4076 1 709 . 1 1 82 82 THR HA H 1 5.09 0.06 . 1 . . . . . . . . 4076 1 710 . 1 1 82 82 THR CB C 13 71.1 0.5 . 1 . . . . . . . . 4076 1 711 . 1 1 82 82 THR HB H 1 4.09 0.06 . 1 . . . . . . . . 4076 1 712 . 1 1 82 82 THR CG2 C 13 20.9 0.5 . 1 . . . . . . . . 4076 1 713 . 1 1 82 82 THR C C 13 172.46 0.09 . 1 . . . . . . . . 4076 1 714 . 1 1 83 83 LEU N N 15 132.7 0.1 . 1 . . . . . . . . 4076 1 715 . 1 1 83 83 LEU H H 1 9.53 0.007 . 1 . . . . . . . . 4076 1 716 . 1 1 83 83 LEU CA C 13 53.6 0.5 . 1 . . . . . . . . 4076 1 717 . 1 1 83 83 LEU HA H 1 5.34 0.06 . 1 . . . . . . . . 4076 1 718 . 1 1 83 83 LEU CB C 13 44.8 0.5 . 1 . . . . . . . . 4076 1 719 . 1 1 83 83 LEU HB2 H 1 1.31 0.06 . 2 . . . . . . . . 4076 1 720 . 1 1 83 83 LEU HB3 H 1 1.95 0.06 . 2 . . . . . . . . 4076 1 721 . 1 1 83 83 LEU CG C 13 25.9 0.5 . 1 . . . . . . . . 4076 1 722 . 1 1 83 83 LEU CD1 C 13 24.6 0.5 . 2 . . . . . . . . 4076 1 723 . 1 1 83 83 LEU CD2 C 13 24.6 0.5 . 2 . . . . . . . . 4076 1 724 . 1 1 83 83 LEU C C 13 175.85 0.09 . 1 . . . . . . . . 4076 1 725 . 1 1 84 84 GLU N N 15 130.6 0.1 . 1 . . . . . . . . 4076 1 726 . 1 1 84 84 GLU H H 1 9.63 0.007 . 1 . . . . . . . . 4076 1 727 . 1 1 84 84 GLU CA C 13 55.1 0.5 . 1 . . . . . . . . 4076 1 728 . 1 1 84 84 GLU HA H 1 4.26 0.06 . 1 . . . . . . . . 4076 1 729 . 1 1 84 84 GLU CB C 13 35.2 0.5 . 1 . . . . . . . . 4076 1 730 . 1 1 84 84 GLU HB2 H 1 1.80 0.06 . 2 . . . . . . . . 4076 1 731 . 1 1 84 84 GLU HB3 H 1 1.80 0.06 . 2 . . . . . . . . 4076 1 732 . 1 1 84 84 GLU CG C 13 38.8 0.5 . 1 . . . . . . . . 4076 1 733 . 1 1 84 84 GLU C C 13 173.50 0.09 . 1 . . . . . . . . 4076 1 734 . 1 1 85 85 VAL N N 15 122.6 0.1 . 1 . . . . . . . . 4076 1 735 . 1 1 85 85 VAL H H 1 8.24 0.007 . 1 . . . . . . . . 4076 1 736 . 1 1 85 85 VAL CA C 13 61.3 0.5 . 1 . . . . . . . . 4076 1 737 . 1 1 85 85 VAL HA H 1 4.82 0.06 . 1 . . . . . . . . 4076 1 738 . 1 1 85 85 VAL CB C 13 33.4 0.5 . 1 . . . . . . . . 4076 1 739 . 1 1 85 85 VAL HB H 1 2.00 0.06 . 1 . . . . . . . . 4076 1 740 . 1 1 85 85 VAL CG1 C 13 21.0 0.5 . 2 . . . . . . . . 4076 1 741 . 1 1 85 85 VAL CG2 C 13 21.0 0.5 . 2 . . . . . . . . 4076 1 742 . 1 1 85 85 VAL C C 13 174.43 0.09 . 1 . . . . . . . . 4076 1 743 . 1 1 86 86 PHE N N 15 126.9 0.1 . 1 . . . . . . . . 4076 1 744 . 1 1 86 86 PHE H H 1 9.67 0.007 . 1 . . . . . . . . 4076 1 745 . 1 1 86 86 PHE CA C 13 56.4 0.5 . 1 . . . . . . . . 4076 1 746 . 1 1 86 86 PHE HA H 1 5.34 0.06 . 1 . . . . . . . . 4076 1 747 . 1 1 86 86 PHE CB C 13 43.8 0.5 . 1 . . . . . . . . 4076 1 748 . 1 1 86 86 PHE HB2 H 1 2.90 0.06 . 2 . . . . . . . . 4076 1 749 . 1 1 86 86 PHE HB3 H 1 3.12 0.06 . 2 . . . . . . . . 4076 1 750 . 1 1 86 86 PHE C C 13 176.81 0.09 . 1 . . . . . . . . 4076 1 751 . 1 1 87 87 LYS N N 15 117.6 0.1 . 1 . . . . . . . . 4076 1 752 . 1 1 87 87 LYS H H 1 8.37 0.007 . 1 . . . . . . . . 4076 1 753 . 1 1 87 87 LYS CA C 13 56.5 0.5 . 1 . . . . . . . . 4076 1 754 . 1 1 87 87 LYS HA H 1 4.47 0.06 . 1 . . . . . . . . 4076 1 755 . 1 1 87 87 LYS CB C 13 33.8 0.5 . 1 . . . . . . . . 4076 1 756 . 1 1 87 87 LYS HB2 H 1 2.03 0.06 . 2 . . . . . . . . 4076 1 757 . 1 1 87 87 LYS HB3 H 1 2.19 0.06 . 2 . . . . . . . . 4076 1 758 . 1 1 87 87 LYS CG C 13 26.1 0.5 . 1 . . . . . . . . 4076 1 759 . 1 1 87 87 LYS CD C 13 29.1 0.5 . 1 . . . . . . . . 4076 1 760 . 1 1 87 87 LYS C C 13 176.65 0.09 . 1 . . . . . . . . 4076 1 761 . 1 1 88 88 GLU N N 15 120.0 0.1 . 1 . . . . . . . . 4076 1 762 . 1 1 88 88 GLU H H 1 8.80 0.007 . 1 . . . . . . . . 4076 1 763 . 1 1 88 88 GLU CA C 13 58.7 0.5 . 1 . . . . . . . . 4076 1 764 . 1 1 88 88 GLU HA H 1 4.18 0.06 . 1 . . . . . . . . 4076 1 765 . 1 1 88 88 GLU CB C 13 29.6 0.5 . 1 . . . . . . . . 4076 1 766 . 1 1 88 88 GLU HB2 H 1 2.06 0.06 . 2 . . . . . . . . 4076 1 767 . 1 1 88 88 GLU HB3 H 1 2.06 0.06 . 2 . . . . . . . . 4076 1 768 . 1 1 88 88 GLU CG C 13 35.6 0.5 . 1 . . . . . . . . 4076 1 769 . 1 1 88 88 GLU C C 13 176.13 0.09 . 1 . . . . . . . . 4076 1 770 . 1 1 89 89 ASP N N 15 117.4 0.1 . 1 . . . . . . . . 4076 1 771 . 1 1 89 89 ASP H H 1 7.32 0.007 . 1 . . . . . . . . 4076 1 772 . 1 1 89 89 ASP CA C 13 54.6 0.5 . 1 . . . . . . . . 4076 1 773 . 1 1 89 89 ASP HA H 1 4.28 0.06 . 1 . . . . . . . . 4076 1 774 . 1 1 89 89 ASP CB C 13 40.0 0.5 . 1 . . . . . . . . 4076 1 775 . 1 1 89 89 ASP HB2 H 1 2.81 0.06 . 2 . . . . . . . . 4076 1 776 . 1 1 89 89 ASP HB3 H 1 2.91 0.06 . 2 . . . . . . . . 4076 1 777 . 1 1 89 89 ASP C C 13 177.61 0.09 . 1 . . . . . . . . 4076 1 778 . 1 1 90 90 GLY N N 15 110.4 0.1 . 1 . . . . . . . . 4076 1 779 . 1 1 90 90 GLY H H 1 8.70 0.007 . 1 . . . . . . . . 4076 1 780 . 1 1 90 90 GLY CA C 13 46.1 0.5 . 1 . . . . . . . . 4076 1 781 . 1 1 90 90 GLY HA2 H 1 3.22 0.06 . 2 . . . . . . . . 4076 1 782 . 1 1 90 90 GLY HA3 H 1 3.91 0.06 . 2 . . . . . . . . 4076 1 783 . 1 1 90 90 GLY C C 13 172.22 0.09 . 1 . . . . . . . . 4076 1 784 . 1 1 91 91 LYS N N 15 118.7 0.1 . 1 . . . . . . . . 4076 1 785 . 1 1 91 91 LYS H H 1 8.48 0.007 . 1 . . . . . . . . 4076 1 786 . 1 1 91 91 LYS CA C 13 56.9 0.5 . 1 . . . . . . . . 4076 1 787 . 1 1 91 91 LYS HA H 1 4.28 0.06 . 1 . . . . . . . . 4076 1 788 . 1 1 91 91 LYS CB C 13 35.9 0.5 . 1 . . . . . . . . 4076 1 789 . 1 1 91 91 LYS HB2 H 1 1.49 0.06 . 2 . . . . . . . . 4076 1 790 . 1 1 91 91 LYS HB3 H 1 1.65 0.06 . 2 . . . . . . . . 4076 1 791 . 1 1 91 91 LYS CG C 13 24.0 0.5 . 1 . . . . . . . . 4076 1 792 . 1 1 91 91 LYS CD C 13 28.8 0.5 . 1 . . . . . . . . 4076 1 793 . 1 1 91 91 LYS CE C 13 42.1 0.5 . 1 . . . . . . . . 4076 1 794 . 1 1 91 91 LYS C C 13 175.81 0.09 . 1 . . . . . . . . 4076 1 795 . 1 1 92 92 THR N N 15 123.1 0.1 . 1 . . . . . . . . 4076 1 796 . 1 1 92 92 THR H H 1 9.65 0.007 . 1 . . . . . . . . 4076 1 797 . 1 1 92 92 THR CA C 13 63.5 0.5 . 1 . . . . . . . . 4076 1 798 . 1 1 92 92 THR HA H 1 4.20 0.06 . 1 . . . . . . . . 4076 1 799 . 1 1 92 92 THR CB C 13 67.7 0.5 . 1 . . . . . . . . 4076 1 800 . 1 1 92 92 THR CG2 C 13 21.1 0.5 . 1 . . . . . . . . 4076 1 801 . 1 1 92 92 THR C C 13 173.77 0.09 . 1 . . . . . . . . 4076 1 802 . 1 1 93 93 LEU N N 15 132.5 0.1 . 1 . . . . . . . . 4076 1 803 . 1 1 93 93 LEU H H 1 8.32 0.007 . 1 . . . . . . . . 4076 1 804 . 1 1 93 93 LEU CA C 13 56.2 0.5 . 1 . . . . . . . . 4076 1 805 . 1 1 93 93 LEU HA H 1 3.83 0.06 . 1 . . . . . . . . 4076 1 806 . 1 1 93 93 LEU CB C 13 43.0 0.5 . 1 . . . . . . . . 4076 1 807 . 1 1 93 93 LEU HB2 H 1 4.66 0.06 . 2 . . . . . . . . 4076 1 808 . 1 1 93 93 LEU HB3 H 1 4.83 0.06 . 2 . . . . . . . . 4076 1 809 . 1 1 93 93 LEU CG C 13 25.1 0.5 . 1 . . . . . . . . 4076 1 810 . 1 1 93 93 LEU C C 13 176.23 0.09 . 1 . . . . . . . . 4076 1 811 . 1 1 94 94 VAL N N 15 122.1 0.1 . 1 . . . . . . . . 4076 1 812 . 1 1 94 94 VAL H H 1 9.20 0.007 . 1 . . . . . . . . 4076 1 813 . 1 1 94 94 VAL CA C 13 64.0 0.5 . 1 . . . . . . . . 4076 1 814 . 1 1 94 94 VAL HA H 1 4.23 0.06 . 1 . . . . . . . . 4076 1 815 . 1 1 94 94 VAL CB C 13 33.7 0.5 . 1 . . . . . . . . 4076 1 816 . 1 1 94 94 VAL HB H 1 1.80 0.06 . 1 . . . . . . . . 4076 1 817 . 1 1 94 94 VAL CG1 C 13 21.1 0.5 . 2 . . . . . . . . 4076 1 818 . 1 1 94 94 VAL CG2 C 13 21.1 0.5 . 2 . . . . . . . . 4076 1 819 . 1 1 94 94 VAL C C 13 176.97 0.09 . 1 . . . . . . . . 4076 1 820 . 1 1 95 95 SER N N 15 113.9 0.1 . 1 . . . . . . . . 4076 1 821 . 1 1 95 95 SER H H 1 7.82 0.007 . 1 . . . . . . . . 4076 1 822 . 1 1 95 95 SER CA C 13 57.5 0.5 . 1 . . . . . . . . 4076 1 823 . 1 1 95 95 SER HA H 1 5.42 0.06 . 1 . . . . . . . . 4076 1 824 . 1 1 95 95 SER CB C 13 67.5 0.5 . 1 . . . . . . . . 4076 1 825 . 1 1 95 95 SER HB2 H 1 3.82 0.06 . 2 . . . . . . . . 4076 1 826 . 1 1 95 95 SER HB3 H 1 3.99 0.06 . 2 . . . . . . . . 4076 1 827 . 1 1 95 95 SER C C 13 174.21 0.09 . 1 . . . . . . . . 4076 1 828 . 1 1 96 96 LYS N N 15 117.6 0.1 . 1 . . . . . . . . 4076 1 829 . 1 1 96 96 LYS H H 1 8.93 0.007 . 1 . . . . . . . . 4076 1 830 . 1 1 96 96 LYS CA C 13 55.8 0.5 . 1 . . . . . . . . 4076 1 831 . 1 1 96 96 LYS HA H 1 5.25 0.06 . 1 . . . . . . . . 4076 1 832 . 1 1 96 96 LYS CB C 13 37.5 0.5 . 1 . . . . . . . . 4076 1 833 . 1 1 96 96 LYS HB2 H 1 1.98 0.06 . 2 . . . . . . . . 4076 1 834 . 1 1 96 96 LYS HB3 H 1 1.81 0.06 . 2 . . . . . . . . 4076 1 835 . 1 1 96 96 LYS CD C 13 29.8 0.5 . 1 . . . . . . . . 4076 1 836 . 1 1 96 96 LYS CE C 13 42.1 0.5 . 1 . . . . . . . . 4076 1 837 . 1 1 96 96 LYS C C 13 174.22 0.09 . 1 . . . . . . . . 4076 1 838 . 1 1 97 97 LYS N N 15 130.6 0.1 . 1 . . . . . . . . 4076 1 839 . 1 1 97 97 LYS H H 1 9.30 0.007 . 1 . . . . . . . . 4076 1 840 . 1 1 97 97 LYS CA C 13 55.2 0.5 . 1 . . . . . . . . 4076 1 841 . 1 1 97 97 LYS HA H 1 5.60 0.06 . 1 . . . . . . . . 4076 1 842 . 1 1 97 97 LYS CB C 13 36.4 0.5 . 1 . . . . . . . . 4076 1 843 . 1 1 97 97 LYS HB2 H 1 1.74 0.06 . 2 . . . . . . . . 4076 1 844 . 1 1 97 97 LYS HB3 H 1 1.93 0.06 . 2 . . . . . . . . 4076 1 845 . 1 1 97 97 LYS CG C 13 25.6 0.5 . 1 . . . . . . . . 4076 1 846 . 1 1 97 97 LYS CD C 13 29.8 0.5 . 1 . . . . . . . . 4076 1 847 . 1 1 97 97 LYS CE C 13 42.0 0.5 . 1 . . . . . . . . 4076 1 848 . 1 1 97 97 LYS C C 13 175.23 0.09 . 1 . . . . . . . . 4076 1 849 . 1 1 98 98 VAL N N 15 133.2 0.1 . 1 . . . . . . . . 4076 1 850 . 1 1 98 98 VAL H H 1 9.22 0.007 . 1 . . . . . . . . 4076 1 851 . 1 1 98 98 VAL CA C 13 61.2 0.5 . 1 . . . . . . . . 4076 1 852 . 1 1 98 98 VAL HA H 1 5.22 0.06 . 1 . . . . . . . . 4076 1 853 . 1 1 98 98 VAL CB C 13 34.1 0.5 . 1 . . . . . . . . 4076 1 854 . 1 1 98 98 VAL HB H 1 2.03 0.06 . 1 . . . . . . . . 4076 1 855 . 1 1 98 98 VAL CG1 C 13 20.9 0.5 . 2 . . . . . . . . 4076 1 856 . 1 1 98 98 VAL CG2 C 13 20.9 0.5 . 2 . . . . . . . . 4076 1 857 . 1 1 98 98 VAL C C 13 175.86 0.09 . 1 . . . . . . . . 4076 1 858 . 1 1 99 99 THR N N 15 125.5 0.1 . 1 . . . . . . . . 4076 1 859 . 1 1 99 99 THR H H 1 9.07 0.007 . 1 . . . . . . . . 4076 1 860 . 1 1 99 99 THR CA C 13 62.1 0.5 . 1 . . . . . . . . 4076 1 861 . 1 1 99 99 THR HA H 1 4.85 0.06 . 1 . . . . . . . . 4076 1 862 . 1 1 99 99 THR CB C 13 70.0 0.5 . 1 . . . . . . . . 4076 1 863 . 1 1 99 99 THR HB H 1 3.71 0.06 . 1 . . . . . . . . 4076 1 864 . 1 1 99 99 THR CG2 C 13 21.0 0.5 . 1 . . . . . . . . 4076 1 865 . 1 1 99 99 THR C C 13 173.19 0.09 . 1 . . . . . . . . 4076 1 866 . 1 1 100 100 SER N N 15 120.8 0.1 . 1 . . . . . . . . 4076 1 867 . 1 1 100 100 SER H H 1 8.54 0.007 . 1 . . . . . . . . 4076 1 868 . 1 1 100 100 SER CA C 13 57.2 0.5 . 1 . . . . . . . . 4076 1 869 . 1 1 100 100 SER HA H 1 5.37 0.06 . 1 . . . . . . . . 4076 1 870 . 1 1 100 100 SER CB C 13 64.8 0.5 . 1 . . . . . . . . 4076 1 871 . 1 1 100 100 SER HB2 H 1 3.96 0.06 . 2 . . . . . . . . 4076 1 872 . 1 1 100 100 SER HB3 H 1 4.06 0.06 . 2 . . . . . . . . 4076 1 873 . 1 1 100 100 SER C C 13 176.59 0.09 . 1 . . . . . . . . 4076 1 874 . 1 1 101 101 LYS N N 15 125.3 0.1 . 1 . . . . . . . . 4076 1 875 . 1 1 101 101 LYS H H 1 8.25 0.007 . 1 . . . . . . . . 4076 1 876 . 1 1 101 101 LYS CA C 13 58.9 0.5 . 1 . . . . . . . . 4076 1 877 . 1 1 101 101 LYS HA H 1 4.05 0.06 . 1 . . . . . . . . 4076 1 878 . 1 1 101 101 LYS CB C 13 32.8 0.5 . 1 . . . . . . . . 4076 1 879 . 1 1 101 101 LYS HB2 H 1 2.03 0.06 . 2 . . . . . . . . 4076 1 880 . 1 1 101 101 LYS HB3 H 1 2.03 0.06 . 2 . . . . . . . . 4076 1 881 . 1 1 101 101 LYS CG C 13 24.2 0.5 . 1 . . . . . . . . 4076 1 882 . 1 1 101 101 LYS CD C 13 29.5 0.5 . 1 . . . . . . . . 4076 1 883 . 1 1 101 101 LYS CE C 13 24.2 0.5 . 1 . . . . . . . . 4076 1 884 . 1 1 101 101 LYS C C 13 175.76 0.09 . 1 . . . . . . . . 4076 1 885 . 1 1 102 102 ASP N N 15 120.0 0.1 . 1 . . . . . . . . 4076 1 886 . 1 1 102 102 ASP H H 1 7.90 0.007 . 1 . . . . . . . . 4076 1 887 . 1 1 102 102 ASP CA C 13 54.0 0.5 . 1 . . . . . . . . 4076 1 888 . 1 1 102 102 ASP HA H 1 4.44 0.06 . 1 . . . . . . . . 4076 1 889 . 1 1 102 102 ASP CB C 13 39.6 0.5 . 1 . . . . . . . . 4076 1 890 . 1 1 102 102 ASP HB2 H 1 2.57 0.06 . 2 . . . . . . . . 4076 1 891 . 1 1 102 102 ASP HB3 H 1 3.07 0.06 . 2 . . . . . . . . 4076 1 892 . 1 1 102 102 ASP C C 13 175.34 0.09 . 1 . . . . . . . . 4076 1 893 . 1 1 103 103 LYS N N 15 110.7 0.1 . 1 . . . . . . . . 4076 1 894 . 1 1 103 103 LYS H H 1 7.94 0.007 . 1 . . . . . . . . 4076 1 895 . 1 1 103 103 LYS CA C 13 59.5 0.5 . 1 . . . . . . . . 4076 1 896 . 1 1 103 103 LYS HA H 1 3.77 0.06 . 1 . . . . . . . . 4076 1 897 . 1 1 103 103 LYS CB C 13 29.8 0.5 . 1 . . . . . . . . 4076 1 898 . 1 1 103 103 LYS HB2 H 1 2.05 0.06 . 2 . . . . . . . . 4076 1 899 . 1 1 103 103 LYS HB3 H 1 2.53 0.06 . 2 . . . . . . . . 4076 1 900 . 1 1 103 103 LYS CD C 13 26.0 0.5 . 1 . . . . . . . . 4076 1 901 . 1 1 103 103 LYS CE C 13 42.4 0.5 . 1 . . . . . . . . 4076 1 902 . 1 1 103 103 LYS C C 13 176.28 0.09 . 1 . . . . . . . . 4076 1 903 . 1 1 104 104 SER N N 15 118.2 0.1 . 1 . . . . . . . . 4076 1 904 . 1 1 104 104 SER H H 1 8.34 0.007 . 1 . . . . . . . . 4076 1 905 . 1 1 104 104 SER CA C 13 58.7 0.5 . 1 . . . . . . . . 4076 1 906 . 1 1 104 104 SER HA H 1 4.39 0.06 . 1 . . . . . . . . 4076 1 907 . 1 1 104 104 SER CB C 13 67.5 0.5 . 1 . . . . . . . . 4076 1 908 . 1 1 104 104 SER HB2 H 1 3.79 0.06 . 2 . . . . . . . . 4076 1 909 . 1 1 104 104 SER HB3 H 1 4.22 0.06 . 2 . . . . . . . . 4076 1 910 . 1 1 104 104 SER C C 13 173.23 0.09 . 1 . . . . . . . . 4076 1 911 . 1 1 105 105 SER N N 15 114.1 0.1 . 1 . . . . . . . . 4076 1 912 . 1 1 105 105 SER H H 1 8.97 0.007 . 1 . . . . . . . . 4076 1 913 . 1 1 105 105 SER CA C 13 57.5 0.5 . 1 . . . . . . . . 4076 1 914 . 1 1 105 105 SER HA H 1 5.61 0.06 . 1 . . . . . . . . 4076 1 915 . 1 1 105 105 SER CB C 13 67.5 0.5 . 1 . . . . . . . . 4076 1 916 . 1 1 105 105 SER HB2 H 1 3.85 0.06 . 2 . . . . . . . . 4076 1 917 . 1 1 105 105 SER HB3 H 1 3.85 0.06 . 2 . . . . . . . . 4076 1 918 . 1 1 105 105 SER C C 13 174.21 0.09 . 1 . . . . . . . . 4076 1 919 . 1 1 106 106 THR N N 15 117.6 0.1 . 1 . . . . . . . . 4076 1 920 . 1 1 106 106 THR H H 1 8.93 0.007 . 1 . . . . . . . . 4076 1 921 . 1 1 106 106 THR CA C 13 61.8 0.5 . 1 . . . . . . . . 4076 1 922 . 1 1 106 106 THR HA H 1 5.19 0.06 . 1 . . . . . . . . 4076 1 923 . 1 1 106 106 THR CB C 13 71.4 0.5 . 1 . . . . . . . . 4076 1 924 . 1 1 106 106 THR HB H 1 3.98 0.06 . 1 . . . . . . . . 4076 1 925 . 1 1 106 106 THR C C 13 172.97 0.09 . 1 . . . . . . . . 4076 1 926 . 1 1 107 107 GLU N N 15 129.3 0.1 . 1 . . . . . . . . 4076 1 927 . 1 1 107 107 GLU H H 1 9.26 0.007 . 1 . . . . . . . . 4076 1 928 . 1 1 107 107 GLU CA C 13 54.8 0.5 . 1 . . . . . . . . 4076 1 929 . 1 1 107 107 GLU HA H 1 5.38 0.06 . 1 . . . . . . . . 4076 1 930 . 1 1 107 107 GLU CB C 13 33.5 0.5 . 1 . . . . . . . . 4076 1 931 . 1 1 107 107 GLU HB2 H 1 1.78 0.06 . 2 . . . . . . . . 4076 1 932 . 1 1 107 107 GLU HB3 H 1 2.10 0.06 . 2 . . . . . . . . 4076 1 933 . 1 1 107 107 GLU CG C 13 36.7 0.5 . 1 . . . . . . . . 4076 1 934 . 1 1 107 107 GLU C C 13 174.47 0.09 . 1 . . . . . . . . 4076 1 935 . 1 1 108 108 GLU N N 15 126.9 0.1 . 1 . . . . . . . . 4076 1 936 . 1 1 108 108 GLU H H 1 9.23 0.007 . 1 . . . . . . . . 4076 1 937 . 1 1 108 108 GLU CA C 13 54.8 0.5 . 1 . . . . . . . . 4076 1 938 . 1 1 108 108 GLU HA H 1 4.96 0.06 . 1 . . . . . . . . 4076 1 939 . 1 1 108 108 GLU CB C 13 35.1 0.5 . 1 . . . . . . . . 4076 1 940 . 1 1 108 108 GLU HB2 H 1 1.55 0.06 . 2 . . . . . . . . 4076 1 941 . 1 1 108 108 GLU HB3 H 1 1.97 0.06 . 2 . . . . . . . . 4076 1 942 . 1 1 108 108 GLU CG C 13 37.7 0.5 . 1 . . . . . . . . 4076 1 943 . 1 1 108 108 GLU C C 13 174.57 0.09 . 1 . . . . . . . . 4076 1 944 . 1 1 109 109 LYS N N 15 121.8 0.1 . 1 . . . . . . . . 4076 1 945 . 1 1 109 109 LYS H H 1 8.28 0.007 . 1 . . . . . . . . 4076 1 946 . 1 1 109 109 LYS CA C 13 54.9 0.5 . 1 . . . . . . . . 4076 1 947 . 1 1 109 109 LYS HA H 1 4.85 0.06 . 1 . . . . . . . . 4076 1 948 . 1 1 109 109 LYS CB C 13 35.0 0.5 . 1 . . . . . . . . 4076 1 949 . 1 1 109 109 LYS HB2 H 1 1.60 0.06 . 2 . . . . . . . . 4076 1 950 . 1 1 109 109 LYS HB3 H 1 1.95 0.06 . 2 . . . . . . . . 4076 1 951 . 1 1 109 109 LYS CG C 13 25.1 0.5 . 1 . . . . . . . . 4076 1 952 . 1 1 109 109 LYS CD C 13 28.9 0.5 . 1 . . . . . . . . 4076 1 953 . 1 1 109 109 LYS CE C 13 42.3 0.5 . 1 . . . . . . . . 4076 1 954 . 1 1 109 109 LYS C C 13 175.03 0.09 . 1 . . . . . . . . 4076 1 955 . 1 1 110 110 PHE N N 15 121.6 0.1 . 1 . . . . . . . . 4076 1 956 . 1 1 110 110 PHE H H 1 7.80 0.007 . 1 . . . . . . . . 4076 1 957 . 1 1 110 110 PHE CA C 13 57.1 0.5 . 1 . . . . . . . . 4076 1 958 . 1 1 110 110 PHE HA H 1 5.14 0.06 . 1 . . . . . . . . 4076 1 959 . 1 1 110 110 PHE CB C 13 42.5 0.5 . 1 . . . . . . . . 4076 1 960 . 1 1 110 110 PHE HB2 H 1 2.81 0.06 . 2 . . . . . . . . 4076 1 961 . 1 1 110 110 PHE HB3 H 1 2.81 0.06 . 2 . . . . . . . . 4076 1 962 . 1 1 110 110 PHE C C 13 176.53 0.09 . 1 . . . . . . . . 4076 1 963 . 1 1 111 111 ASN N N 15 120.5 0.1 . 1 . . . . . . . . 4076 1 964 . 1 1 111 111 ASN H H 1 8.89 0.007 . 1 . . . . . . . . 4076 1 965 . 1 1 111 111 ASN CA C 13 50.8 0.5 . 1 . . . . . . . . 4076 1 966 . 1 1 111 111 ASN HA H 1 4.97 0.06 . 1 . . . . . . . . 4076 1 967 . 1 1 111 111 ASN CB C 13 38.9 0.5 . 1 . . . . . . . . 4076 1 968 . 1 1 111 111 ASN HB2 H 1 2.98 0.06 . 2 . . . . . . . . 4076 1 969 . 1 1 111 111 ASN HB3 H 1 3.62 0.06 . 2 . . . . . . . . 4076 1 970 . 1 1 111 111 ASN C C 13 177.76 0.09 . 1 . . . . . . . . 4076 1 971 . 1 1 112 112 GLU N N 15 119.4 0.1 . 1 . . . . . . . . 4076 1 972 . 1 1 112 112 GLU H H 1 9.21 0.007 . 1 . . . . . . . . 4076 1 973 . 1 1 112 112 GLU CA C 13 59.3 0.5 . 1 . . . . . . . . 4076 1 974 . 1 1 112 112 GLU HA H 1 4.18 0.06 . 1 . . . . . . . . 4076 1 975 . 1 1 112 112 GLU CB C 13 28.9 0.5 . 1 . . . . . . . . 4076 1 976 . 1 1 112 112 GLU HB2 H 1 2.14 0.06 . 2 . . . . . . . . 4076 1 977 . 1 1 112 112 GLU HB3 H 1 2.14 0.06 . 2 . . . . . . . . 4076 1 978 . 1 1 112 112 GLU CG C 13 36.3 0.5 . 1 . . . . . . . . 4076 1 979 . 1 1 112 112 GLU C C 13 176.93 0.09 . 1 . . . . . . . . 4076 1 980 . 1 1 113 113 LYS N N 15 118.7 0.1 . 1 . . . . . . . . 4076 1 981 . 1 1 113 113 LYS H H 1 7.63 0.007 . 1 . . . . . . . . 4076 1 982 . 1 1 113 113 LYS CA C 13 55.7 0.5 . 1 . . . . . . . . 4076 1 983 . 1 1 113 113 LYS HA H 1 4.45 0.06 . 1 . . . . . . . . 4076 1 984 . 1 1 113 113 LYS CB C 13 32.7 0.5 . 1 . . . . . . . . 4076 1 985 . 1 1 113 113 LYS HB2 H 1 1.75 0.06 . 2 . . . . . . . . 4076 1 986 . 1 1 113 113 LYS HB3 H 1 2.04 0.06 . 2 . . . . . . . . 4076 1 987 . 1 1 113 113 LYS CG C 13 25.1 0.5 . 1 . . . . . . . . 4076 1 988 . 1 1 113 113 LYS CD C 13 28.9 0.5 . 1 . . . . . . . . 4076 1 989 . 1 1 113 113 LYS C C 13 176.90 0.09 . 1 . . . . . . . . 4076 1 990 . 1 1 114 114 GLY N N 15 108.8 0.1 . 1 . . . . . . . . 4076 1 991 . 1 1 114 114 GLY H H 1 8.26 0.007 . 1 . . . . . . . . 4076 1 992 . 1 1 114 114 GLY CA C 13 45.8 0.5 . 1 . . . . . . . . 4076 1 993 . 1 1 114 114 GLY HA2 H 1 3.88 0.06 . 2 . . . . . . . . 4076 1 994 . 1 1 114 114 GLY HA3 H 1 4.23 0.06 . 2 . . . . . . . . 4076 1 995 . 1 1 114 114 GLY C C 13 174.14 0.09 . 1 . . . . . . . . 4076 1 996 . 1 1 115 115 GLU N N 15 120.7 0.1 . 1 . . . . . . . . 4076 1 997 . 1 1 115 115 GLU H H 1 7.78 0.007 . 1 . . . . . . . . 4076 1 998 . 1 1 115 115 GLU CA C 13 54.2 0.5 . 1 . . . . . . . . 4076 1 999 . 1 1 115 115 GLU HA H 1 4.56 0.06 . 1 . . . . . . . . 4076 1 1000 . 1 1 115 115 GLU CB C 13 30.7 0.5 . 1 . . . . . . . . 4076 1 1001 . 1 1 115 115 GLU HB2 H 1 1.95 0.06 . 2 . . . . . . . . 4076 1 1002 . 1 1 115 115 GLU HB3 H 1 1.95 0.06 . 2 . . . . . . . . 4076 1 1003 . 1 1 115 115 GLU CG C 13 36.1 0.5 . 1 . . . . . . . . 4076 1 1004 . 1 1 115 115 GLU HG2 H 1 2.18 0.06 . 2 . . . . . . . . 4076 1 1005 . 1 1 115 115 GLU HG3 H 1 2.18 0.06 . 2 . . . . . . . . 4076 1 1006 . 1 1 115 115 GLU C C 13 176.29 0.09 . 1 . . . . . . . . 4076 1 1007 . 1 1 116 116 VAL N N 15 124.7 0.1 . 1 . . . . . . . . 4076 1 1008 . 1 1 116 116 VAL H H 1 8.44 0.007 . 1 . . . . . . . . 4076 1 1009 . 1 1 116 116 VAL CA C 13 63.6 0.5 . 1 . . . . . . . . 4076 1 1010 . 1 1 116 116 VAL HA H 1 3.51 0.06 . 1 . . . . . . . . 4076 1 1011 . 1 1 116 116 VAL CB C 13 31.7 0.5 . 1 . . . . . . . . 4076 1 1012 . 1 1 116 116 VAL HB H 1 1.78 0.06 . 1 . . . . . . . . 4076 1 1013 . 1 1 116 116 VAL C C 13 174.99 0.09 . 1 . . . . . . . . 4076 1 1014 . 1 1 117 117 SER N N 15 122.7 0.1 . 1 . . . . . . . . 4076 1 1015 . 1 1 117 117 SER H H 1 8.94 0.007 . 1 . . . . . . . . 4076 1 1016 . 1 1 117 117 SER CA C 13 58.4 0.5 . 1 . . . . . . . . 4076 1 1017 . 1 1 117 117 SER HA H 1 4.71 0.06 . 1 . . . . . . . . 4076 1 1018 . 1 1 117 117 SER CB C 13 65.5 0.5 . 1 . . . . . . . . 4076 1 1019 . 1 1 117 117 SER HB2 H 1 3.58 0.06 . 2 . . . . . . . . 4076 1 1020 . 1 1 117 117 SER HB3 H 1 3.90 0.06 . 2 . . . . . . . . 4076 1 1021 . 1 1 117 117 SER C C 13 174.28 0.09 . 1 . . . . . . . . 4076 1 1022 . 1 1 118 118 GLU N N 15 121.3 0.1 . 1 . . . . . . . . 4076 1 1023 . 1 1 118 118 GLU H H 1 7.41 0.007 . 1 . . . . . . . . 4076 1 1024 . 1 1 118 118 GLU CA C 13 55.4 0.5 . 1 . . . . . . . . 4076 1 1025 . 1 1 118 118 GLU HA H 1 4.92 0.06 . 1 . . . . . . . . 4076 1 1026 . 1 1 118 118 GLU CB C 13 34.2 0.5 . 1 . . . . . . . . 4076 1 1027 . 1 1 118 118 GLU HB2 H 1 1.97 0.06 . 2 . . . . . . . . 4076 1 1028 . 1 1 118 118 GLU HB3 H 1 1.97 0.06 . 2 . . . . . . . . 4076 1 1029 . 1 1 118 118 GLU CG C 13 36.9 0.5 . 1 . . . . . . . . 4076 1 1030 . 1 1 118 118 GLU HG2 H 1 2.15 0.06 . 2 . . . . . . . . 4076 1 1031 . 1 1 118 118 GLU HG3 H 1 2.15 0.06 . 2 . . . . . . . . 4076 1 1032 . 1 1 118 118 GLU C C 13 173.83 0.09 . 1 . . . . . . . . 4076 1 1033 . 1 1 119 119 LYS N N 15 124.5 0.1 . 1 . . . . . . . . 4076 1 1034 . 1 1 119 119 LYS H H 1 9.03 0.007 . 1 . . . . . . . . 4076 1 1035 . 1 1 119 119 LYS CA C 13 55.5 0.5 . 1 . . . . . . . . 4076 1 1036 . 1 1 119 119 LYS HA H 1 5.37 0.06 . 1 . . . . . . . . 4076 1 1037 . 1 1 119 119 LYS CB C 13 36.9 0.5 . 1 . . . . . . . . 4076 1 1038 . 1 1 119 119 LYS HB2 H 1 1.59 0.06 . 2 . . . . . . . . 4076 1 1039 . 1 1 119 119 LYS HB3 H 1 1.76 0.06 . 2 . . . . . . . . 4076 1 1040 . 1 1 119 119 LYS CD C 13 29.8 0.5 . 1 . . . . . . . . 4076 1 1041 . 1 1 119 119 LYS CE C 13 42.0 0.5 . 1 . . . . . . . . 4076 1 1042 . 1 1 119 119 LYS C C 13 173.34 0.09 . 1 . . . . . . . . 4076 1 1043 . 1 1 120 120 ILE N N 15 127.1 0.1 . 1 . . . . . . . . 4076 1 1044 . 1 1 120 120 ILE H H 1 9.39 0.007 . 1 . . . . . . . . 4076 1 1045 . 1 1 120 120 ILE CA C 13 60.2 0.5 . 1 . . . . . . . . 4076 1 1046 . 1 1 120 120 ILE HA H 1 4.94 0.06 . 1 . . . . . . . . 4076 1 1047 . 1 1 120 120 ILE CB C 13 40.6 0.5 . 1 . . . . . . . . 4076 1 1048 . 1 1 120 120 ILE HB H 1 1.90 0.06 . 1 . . . . . . . . 4076 1 1049 . 1 1 120 120 ILE CG1 C 13 27.9 0.5 . 2 . . . . . . . . 4076 1 1050 . 1 1 120 120 ILE CD1 C 13 13.4 0.5 . 1 . . . . . . . . 4076 1 1051 . 1 1 120 120 ILE CG2 C 13 18.2 0.5 . 2 . . . . . . . . 4076 1 1052 . 1 1 120 120 ILE C C 13 176.27 0.09 . 1 . . . . . . . . 4076 1 1053 . 1 1 121 121 ILE N N 15 134.1 0.1 . 1 . . . . . . . . 4076 1 1054 . 1 1 121 121 ILE H H 1 9.66 0.007 . 1 . . . . . . . . 4076 1 1055 . 1 1 121 121 ILE CA C 13 60.9 0.5 . 1 . . . . . . . . 4076 1 1056 . 1 1 121 121 ILE HA H 1 4.78 0.06 . 1 . . . . . . . . 4076 1 1057 . 1 1 121 121 ILE CB C 13 40.3 0.5 . 1 . . . . . . . . 4076 1 1058 . 1 1 121 121 ILE HB H 1 1.99 0.06 . 1 . . . . . . . . 4076 1 1059 . 1 1 121 121 ILE CG1 C 13 27.7 0.5 . 2 . . . . . . . . 4076 1 1060 . 1 1 121 121 ILE CD1 C 13 14.7 0.5 . 1 . . . . . . . . 4076 1 1061 . 1 1 121 121 ILE CG2 C 13 17.1 0.5 . 2 . . . . . . . . 4076 1 1062 . 1 1 121 121 ILE C C 13 175.14 0.09 . 1 . . . . . . . . 4076 1 1063 . 1 1 122 122 THR N N 15 125.6 0.1 . 1 . . . . . . . . 4076 1 1064 . 1 1 122 122 THR H H 1 9.35 0.007 . 1 . . . . . . . . 4076 1 1065 . 1 1 122 122 THR CA C 13 62.4 0.5 . 1 . . . . . . . . 4076 1 1066 . 1 1 122 122 THR HA H 1 4.73 0.06 . 1 . . . . . . . . 4076 1 1067 . 1 1 122 122 THR CB C 13 69.1 0.5 . 1 . . . . . . . . 4076 1 1068 . 1 1 122 122 THR HB H 1 4.24 0.06 . 1 . . . . . . . . 4076 1 1069 . 1 1 122 122 THR CG2 C 13 20.5 0.5 . 1 . . . . . . . . 4076 1 1070 . 1 1 122 122 THR C C 13 174.88 0.09 . 1 . . . . . . . . 4076 1 1071 . 1 1 123 123 ARG N N 15 126.6 0.1 . 1 . . . . . . . . 4076 1 1072 . 1 1 123 123 ARG H H 1 8.93 0.007 . 1 . . . . . . . . 4076 1 1073 . 1 1 123 123 ARG CA C 13 56.1 0.5 . 1 . . . . . . . . 4076 1 1074 . 1 1 123 123 ARG HA H 1 4.42 0.06 . 1 . . . . . . . . 4076 1 1075 . 1 1 123 123 ARG CB C 13 30.8 0.5 . 1 . . . . . . . . 4076 1 1076 . 1 1 123 123 ARG C C 13 178.05 0.09 . 1 . . . . . . . . 4076 1 1077 . 1 1 124 124 ALA N N 15 124.8 0.1 . 1 . . . . . . . . 4076 1 1078 . 1 1 124 124 ALA H H 1 8.88 0.007 . 1 . . . . . . . . 4076 1 1079 . 1 1 124 124 ALA CA C 13 54.9 0.5 . 1 . . . . . . . . 4076 1 1080 . 1 1 124 124 ALA HA H 1 3.90 0.06 . 1 . . . . . . . . 4076 1 1081 . 1 1 124 124 ALA CB C 13 18.6 0.5 . 1 . . . . . . . . 4076 1 1082 . 1 1 124 124 ALA HB1 H 1 1.43 0.06 . 2 . . . . . . . . 4076 1 1083 . 1 1 124 124 ALA HB2 H 1 1.43 0.06 . 2 . . . . . . . . 4076 1 1084 . 1 1 124 124 ALA HB3 H 1 1.43 0.06 . 2 . . . . . . . . 4076 1 1085 . 1 1 124 124 ALA C C 13 177.58 0.09 . 1 . . . . . . . . 4076 1 1086 . 1 1 125 125 ASP N N 15 113.6 0.1 . 1 . . . . . . . . 4076 1 1087 . 1 1 125 125 ASP H H 1 7.24 0.007 . 1 . . . . . . . . 4076 1 1088 . 1 1 125 125 ASP CA C 13 53.2 0.5 . 1 . . . . . . . . 4076 1 1089 . 1 1 125 125 ASP HA H 1 4.47 0.06 . 1 . . . . . . . . 4076 1 1090 . 1 1 125 125 ASP CB C 13 40.5 0.5 . 1 . . . . . . . . 4076 1 1091 . 1 1 125 125 ASP HB2 H 1 2.55 0.06 . 2 . . . . . . . . 4076 1 1092 . 1 1 125 125 ASP HB3 H 1 3.09 0.06 . 2 . . . . . . . . 4076 1 1093 . 1 1 125 125 ASP C C 13 177.37 0.09 . 1 . . . . . . . . 4076 1 1094 . 1 1 126 126 GLY N N 15 109.5 0.1 . 1 . . . . . . . . 4076 1 1095 . 1 1 126 126 GLY H H 1 8.03 0.007 . 1 . . . . . . . . 4076 1 1096 . 1 1 126 126 GLY CA C 13 45.3 0.5 . 1 . . . . . . . . 4076 1 1097 . 1 1 126 126 GLY HA2 H 1 3.54 0.06 . 2 . . . . . . . . 4076 1 1098 . 1 1 126 126 GLY HA3 H 1 4.35 0.06 . 2 . . . . . . . . 4076 1 1099 . 1 1 126 126 GLY C C 13 175.67 0.09 . 1 . . . . . . . . 4076 1 1100 . 1 1 127 127 THR N N 15 115.2 0.1 . 1 . . . . . . . . 4076 1 1101 . 1 1 127 127 THR H H 1 8.33 0.007 . 1 . . . . . . . . 4076 1 1102 . 1 1 127 127 THR CA C 13 62.9 0.5 . 1 . . . . . . . . 4076 1 1103 . 1 1 127 127 THR HA H 1 4.42 0.06 . 1 . . . . . . . . 4076 1 1104 . 1 1 127 127 THR CB C 13 70.6 0.5 . 1 . . . . . . . . 4076 1 1105 . 1 1 127 127 THR CG2 C 13 22.3 0.5 . 1 . . . . . . . . 4076 1 1106 . 1 1 127 127 THR C C 13 173.40 0.09 . 1 . . . . . . . . 4076 1 1107 . 1 1 128 128 ARG N N 15 116.0 0.1 . 1 . . . . . . . . 4076 1 1108 . 1 1 128 128 ARG H H 1 8.20 0.007 . 1 . . . . . . . . 4076 1 1109 . 1 1 128 128 ARG CA C 13 54.6 0.5 . 1 . . . . . . . . 4076 1 1110 . 1 1 128 128 ARG HA H 1 5.76 0.06 . 1 . . . . . . . . 4076 1 1111 . 1 1 128 128 ARG CB C 13 36.2 0.5 . 1 . . . . . . . . 4076 1 1112 . 1 1 128 128 ARG HB2 H 1 1.54 0.06 . 2 . . . . . . . . 4076 1 1113 . 1 1 128 128 ARG HB3 H 1 1.70 0.06 . 2 . . . . . . . . 4076 1 1114 . 1 1 128 128 ARG CG C 13 27.3 0.5 . 1 . . . . . . . . 4076 1 1115 . 1 1 128 128 ARG CD C 13 44.2 0.5 . 1 . . . . . . . . 4076 1 1116 . 1 1 128 128 ARG C C 13 174.83 0.09 . 1 . . . . . . . . 4076 1 1117 . 1 1 129 129 LEU N N 15 123.7 0.1 . 1 . . . . . . . . 4076 1 1118 . 1 1 129 129 LEU H H 1 9.11 0.007 . 1 . . . . . . . . 4076 1 1119 . 1 1 129 129 LEU CA C 13 53.8 0.5 . 1 . . . . . . . . 4076 1 1120 . 1 1 129 129 LEU HA H 1 4.93 0.06 . 1 . . . . . . . . 4076 1 1121 . 1 1 129 129 LEU CB C 13 45.3 0.5 . 1 . . . . . . . . 4076 1 1122 . 1 1 129 129 LEU HB2 H 1 1.13 0.06 . 2 . . . . . . . . 4076 1 1123 . 1 1 129 129 LEU HB3 H 1 1.43 0.06 . 2 . . . . . . . . 4076 1 1124 . 1 1 129 129 LEU CG C 13 24.5 0.5 . 1 . . . . . . . . 4076 1 1125 . 1 1 129 129 LEU C C 13 174.73 0.09 . 1 . . . . . . . . 4076 1 1126 . 1 1 130 130 GLU N N 15 121.8 0.1 . 1 . . . . . . . . 4076 1 1127 . 1 1 130 130 GLU H H 1 9.07 0.007 . 1 . . . . . . . . 4076 1 1128 . 1 1 130 130 GLU CA C 13 54.6 0.5 . 1 . . . . . . . . 4076 1 1129 . 1 1 130 130 GLU HA H 1 4.80 0.06 . 1 . . . . . . . . 4076 1 1130 . 1 1 130 130 GLU CB C 13 32.1 0.5 . 1 . . . . . . . . 4076 1 1131 . 1 1 130 130 GLU HB2 H 1 1.76 0.06 . 2 . . . . . . . . 4076 1 1132 . 1 1 130 130 GLU HB3 H 1 1.76 0.06 . 2 . . . . . . . . 4076 1 1133 . 1 1 130 130 GLU CG C 13 36.3 0.5 . 1 . . . . . . . . 4076 1 1134 . 1 1 130 130 GLU C C 13 175.25 0.09 . 1 . . . . . . . . 4076 1 1135 . 1 1 131 131 TYR N N 15 126.3 0.1 . 1 . . . . . . . . 4076 1 1136 . 1 1 131 131 TYR H H 1 9.39 0.007 . 1 . . . . . . . . 4076 1 1137 . 1 1 131 131 TYR CA C 13 54.9 0.5 . 1 . . . . . . . . 4076 1 1138 . 1 1 131 131 TYR HA H 1 6.00 0.06 . 1 . . . . . . . . 4076 1 1139 . 1 1 131 131 TYR CB C 13 40.1 0.5 . 1 . . . . . . . . 4076 1 1140 . 1 1 131 131 TYR C C 13 175.74 0.09 . 1 . . . . . . . . 4076 1 1141 . 1 1 132 132 THR N N 15 114.1 0.1 . 1 . . . . . . . . 4076 1 1142 . 1 1 132 132 THR H H 1 8.76 0.007 . 1 . . . . . . . . 4076 1 1143 . 1 1 132 132 THR CA C 13 59.6 0.5 . 1 . . . . . . . . 4076 1 1144 . 1 1 132 132 THR HA H 1 5.01 0.06 . 1 . . . . . . . . 4076 1 1145 . 1 1 132 132 THR CB C 13 72.3 0.5 . 1 . . . . . . . . 4076 1 1146 . 1 1 132 132 THR HB H 1 4.25 0.06 . 1 . . . . . . . . 4076 1 1147 . 1 1 132 132 THR C C 13 173.68 0.09 . 1 . . . . . . . . 4076 1 1148 . 1 1 133 133 GLY N N 15 112.0 0.1 . 1 . . . . . . . . 4076 1 1149 . 1 1 133 133 GLY H H 1 8.80 0.007 . 1 . . . . . . . . 4076 1 1150 . 1 1 133 133 GLY CA C 13 47.3 0.5 . 1 . . . . . . . . 4076 1 1151 . 1 1 133 133 GLY HA2 H 1 3.78 0.06 . 2 . . . . . . . . 4076 1 1152 . 1 1 133 133 GLY HA3 H 1 3.92 0.06 . 2 . . . . . . . . 4076 1 1153 . 1 1 133 133 GLY C C 13 175.25 0.09 . 1 . . . . . . . . 4076 1 1154 . 1 1 134 134 ILE N N 15 118.9 0.1 . 1 . . . . . . . . 4076 1 1155 . 1 1 134 134 ILE H H 1 7.77 0.007 . 1 . . . . . . . . 4076 1 1156 . 1 1 134 134 ILE CA C 13 62.6 0.5 . 1 . . . . . . . . 4076 1 1157 . 1 1 134 134 ILE HA H 1 4.40 0.06 . 1 . . . . . . . . 4076 1 1158 . 1 1 134 134 ILE CB C 13 37.6 0.5 . 1 . . . . . . . . 4076 1 1159 . 1 1 134 134 ILE HB H 1 1.94 0.06 . 1 . . . . . . . . 4076 1 1160 . 1 1 134 134 ILE CD1 C 13 17.3 0.5 . 1 . . . . . . . . 4076 1 1161 . 1 1 134 134 ILE C C 13 177.57 0.09 . 1 . . . . . . . . 4076 1 1162 . 1 1 135 135 LYS N N 15 129.3 0.1 . 1 . . . . . . . . 4076 1 1163 . 1 1 135 135 LYS H H 1 8.86 0.007 . 1 . . . . . . . . 4076 1 1164 . 1 1 135 135 LYS CA C 13 55.0 0.5 . 1 . . . . . . . . 4076 1 1165 . 1 1 135 135 LYS CB C 13 35.1 0.5 . 1 . . . . . . . . 4076 1 1166 . 1 1 135 135 LYS CG C 13 25.0 0.5 . 1 . . . . . . . . 4076 1 1167 . 1 1 135 135 LYS CD C 13 28.8 0.5 . 1 . . . . . . . . 4076 1 1168 . 1 1 135 135 LYS C C 13 179.61 0.09 . 1 . . . . . . . . 4076 1 1169 . 1 1 136 136 SER N N 15 118.1 0.1 . 1 . . . . . . . . 4076 1 1170 . 1 1 136 136 SER H H 1 8.62 0.007 . 1 . . . . . . . . 4076 1 1171 . 1 1 136 136 SER CA C 13 61.6 0.5 . 1 . . . . . . . . 4076 1 1172 . 1 1 136 136 SER HA H 1 4.13 0.06 . 1 . . . . . . . . 4076 1 1173 . 1 1 136 136 SER CB C 13 63.0 0.5 . 1 . . . . . . . . 4076 1 1174 . 1 1 136 136 SER HB2 H 1 3.96 0.06 . 2 . . . . . . . . 4076 1 1175 . 1 1 136 136 SER HB3 H 1 3.96 0.06 . 2 . . . . . . . . 4076 1 1176 . 1 1 136 136 SER C C 13 174.52 0.09 . 1 . . . . . . . . 4076 1 1177 . 1 1 137 137 ASP N N 15 118.9 0.1 . 1 . . . . . . . . 4076 1 1178 . 1 1 137 137 ASP H H 1 7.59 0.007 . 1 . . . . . . . . 4076 1 1179 . 1 1 137 137 ASP CA C 13 53.3 0.5 . 1 . . . . . . . . 4076 1 1180 . 1 1 137 137 ASP HA H 1 4.28 0.06 . 1 . . . . . . . . 4076 1 1181 . 1 1 137 137 ASP CB C 13 39.7 0.5 . 1 . . . . . . . . 4076 1 1182 . 1 1 137 137 ASP HB2 H 1 2.04 0.06 . 2 . . . . . . . . 4076 1 1183 . 1 1 137 137 ASP HB3 H 1 2.04 0.06 . 2 . . . . . . . . 4076 1 1184 . 1 1 137 137 ASP C C 13 177.38 0.09 . 1 . . . . . . . . 4076 1 1185 . 1 1 138 138 GLY N N 15 110.6 0.1 . 1 . . . . . . . . 4076 1 1186 . 1 1 138 138 GLY H H 1 8.31 0.007 . 1 . . . . . . . . 4076 1 1187 . 1 1 138 138 GLY CA C 13 45.1 0.5 . 1 . . . . . . . . 4076 1 1188 . 1 1 138 138 GLY HA2 H 1 3.47 0.06 . 2 . . . . . . . . 4076 1 1189 . 1 1 138 138 GLY HA3 H 1 4.03 0.06 . 2 . . . . . . . . 4076 1 1190 . 1 1 138 138 GLY C C 13 172.64 0.09 . 1 . . . . . . . . 4076 1 1191 . 1 1 139 139 SER N N 15 115.5 0.1 . 1 . . . . . . . . 4076 1 1192 . 1 1 139 139 SER H H 1 7.85 0.007 . 1 . . . . . . . . 4076 1 1193 . 1 1 139 139 SER CA C 13 57.0 0.5 . 1 . . . . . . . . 4076 1 1194 . 1 1 139 139 SER HA H 1 4.88 0.06 . 1 . . . . . . . . 4076 1 1195 . 1 1 139 139 SER CB C 13 65.4 0.5 . 1 . . . . . . . . 4076 1 1196 . 1 1 139 139 SER HB2 H 1 4.12 0.06 . 2 . . . . . . . . 4076 1 1197 . 1 1 139 139 SER HB3 H 1 4.12 0.06 . 2 . . . . . . . . 4076 1 1198 . 1 1 139 139 SER C C 13 173.36 0.09 . 1 . . . . . . . . 4076 1 1199 . 1 1 140 140 GLY N N 15 104.6 0.1 . 1 . . . . . . . . 4076 1 1200 . 1 1 140 140 GLY H H 1 8.23 0.007 . 1 . . . . . . . . 4076 1 1201 . 1 1 140 140 GLY CA C 13 46.2 0.5 . 1 . . . . . . . . 4076 1 1202 . 1 1 140 140 GLY HA2 H 1 3.77 0.06 . 2 . . . . . . . . 4076 1 1203 . 1 1 140 140 GLY HA3 H 1 4.39 0.06 . 2 . . . . . . . . 4076 1 1204 . 1 1 140 140 GLY C C 13 172.74 0.09 . 1 . . . . . . . . 4076 1 1205 . 1 1 141 141 LYS N N 15 124.7 0.1 . 1 . . . . . . . . 4076 1 1206 . 1 1 141 141 LYS H H 1 8.96 0.007 . 1 . . . . . . . . 4076 1 1207 . 1 1 141 141 LYS CA C 13 56.1 0.5 . 1 . . . . . . . . 4076 1 1208 . 1 1 141 141 LYS HA H 1 4.75 0.06 . 1 . . . . . . . . 4076 1 1209 . 1 1 141 141 LYS CB C 13 33.6 0.5 . 1 . . . . . . . . 4076 1 1210 . 1 1 141 141 LYS HB2 H 1 1.93 0.06 . 2 . . . . . . . . 4076 1 1211 . 1 1 141 141 LYS HB3 H 1 1.93 0.06 . 2 . . . . . . . . 4076 1 1212 . 1 1 141 141 LYS CG C 13 25.1 0.5 . 1 . . . . . . . . 4076 1 1213 . 1 1 141 141 LYS CD C 13 28.8 0.5 . 1 . . . . . . . . 4076 1 1214 . 1 1 141 141 LYS CE C 13 42.1 0.5 . 1 . . . . . . . . 4076 1 1215 . 1 1 141 141 LYS C C 13 174.89 0.09 . 1 . . . . . . . . 4076 1 1216 . 1 1 142 142 ALA N N 15 123.4 0.1 . 1 . . . . . . . . 4076 1 1217 . 1 1 142 142 ALA H H 1 7.92 0.007 . 1 . . . . . . . . 4076 1 1218 . 1 1 142 142 ALA CA C 13 50.0 0.5 . 1 . . . . . . . . 4076 1 1219 . 1 1 142 142 ALA HA H 1 5.59 0.06 . 1 . . . . . . . . 4076 1 1220 . 1 1 142 142 ALA CB C 13 25.6 0.5 . 1 . . . . . . . . 4076 1 1221 . 1 1 142 142 ALA HB1 H 1 1.09 0.06 . 1 . . . . . . . . 4076 1 1222 . 1 1 142 142 ALA HB2 H 1 1.09 0.06 . 1 . . . . . . . . 4076 1 1223 . 1 1 142 142 ALA HB3 H 1 1.09 0.06 . 1 . . . . . . . . 4076 1 1224 . 1 1 142 142 ALA C C 13 175.82 0.09 . 1 . . . . . . . . 4076 1 1225 . 1 1 143 143 LYS N N 15 122.3 0.1 . 1 . . . . . . . . 4076 1 1226 . 1 1 143 143 LYS H H 1 8.54 0.007 . 1 . . . . . . . . 4076 1 1227 . 1 1 143 143 LYS CA C 13 55.4 0.5 . 1 . . . . . . . . 4076 1 1228 . 1 1 143 143 LYS HA H 1 5.07 0.06 . 1 . . . . . . . . 4076 1 1229 . 1 1 143 143 LYS CB C 13 36.7 0.5 . 1 . . . . . . . . 4076 1 1230 . 1 1 143 143 LYS HB2 H 1 1.66 0.06 . 2 . . . . . . . . 4076 1 1231 . 1 1 143 143 LYS HB3 H 1 1.66 0.06 . 2 . . . . . . . . 4076 1 1232 . 1 1 143 143 LYS CG C 13 25.0 0.5 . 1 . . . . . . . . 4076 1 1233 . 1 1 143 143 LYS CD C 13 29.4 0.5 . 1 . . . . . . . . 4076 1 1234 . 1 1 143 143 LYS CE C 13 42.0 0.5 . 1 . . . . . . . . 4076 1 1235 . 1 1 143 143 LYS C C 13 173.59 0.09 . 1 . . . . . . . . 4076 1 1236 . 1 1 144 144 GLU N N 15 128.2 0.1 . 1 . . . . . . . . 4076 1 1237 . 1 1 144 144 GLU H H 1 9.53 0.007 . 1 . . . . . . . . 4076 1 1238 . 1 1 144 144 GLU CA C 13 54.6 0.5 . 1 . . . . . . . . 4076 1 1239 . 1 1 144 144 GLU HA H 1 5.17 0.06 . 1 . . . . . . . . 4076 1 1240 . 1 1 144 144 GLU CB C 13 32.7 0.5 . 1 . . . . . . . . 4076 1 1241 . 1 1 144 144 GLU HB2 H 1 1.47 0.06 . 2 . . . . . . . . 4076 1 1242 . 1 1 144 144 GLU HB3 H 1 2.15 0.06 . 2 . . . . . . . . 4076 1 1243 . 1 1 144 144 GLU CG C 13 37.3 0.5 . 1 . . . . . . . . 4076 1 1244 . 1 1 144 144 GLU C C 13 174.37 0.09 . 1 . . . . . . . . 4076 1 1245 . 1 1 145 145 VAL N N 15 130.6 0.1 . 1 . . . . . . . . 4076 1 1246 . 1 1 145 145 VAL H H 1 9.48 0.007 . 1 . . . . . . . . 4076 1 1247 . 1 1 145 145 VAL CA C 13 63.1 0.5 . 1 . . . . . . . . 4076 1 1248 . 1 1 145 145 VAL HA H 1 3.98 0.06 . 1 . . . . . . . . 4076 1 1249 . 1 1 145 145 VAL CB C 13 31.7 0.5 . 1 . . . . . . . . 4076 1 1250 . 1 1 145 145 VAL HB H 1 1.98 0.06 . 1 . . . . . . . . 4076 1 1251 . 1 1 145 145 VAL CG1 C 13 19.5 0.5 . 2 . . . . . . . . 4076 1 1252 . 1 1 145 145 VAL CG2 C 13 20.7 0.5 . 2 . . . . . . . . 4076 1 1253 . 1 1 145 145 VAL C C 13 174.91 0.09 . 1 . . . . . . . . 4076 1 1254 . 1 1 146 146 LEU N N 15 129.3 0.1 . 1 . . . . . . . . 4076 1 1255 . 1 1 146 146 LEU H H 1 7.75 0.007 . 1 . . . . . . . . 4076 1 1256 . 1 1 146 146 LEU CA C 13 52.7 0.5 . 1 . . . . . . . . 4076 1 1257 . 1 1 146 146 LEU HA H 1 4.54 0.06 . 1 . . . . . . . . 4076 1 1258 . 1 1 146 146 LEU CB C 13 40.7 0.5 . 1 . . . . . . . . 4076 1 1259 . 1 1 146 146 LEU HB2 H 1 4.68 0.06 . 2 . . . . . . . . 4076 1 1260 . 1 1 146 146 LEU HB3 H 1 1.25 0.06 . 2 . . . . . . . . 4076 1 1261 . 1 1 146 146 LEU CG C 13 27.6 0.5 . 1 . . . . . . . . 4076 1 1262 . 1 1 146 146 LEU CD1 C 13 22.8 0.5 . 2 . . . . . . . . 4076 1 1263 . 1 1 146 146 LEU CD2 C 13 24.2 0.5 . 2 . . . . . . . . 4076 1 1264 . 1 1 146 146 LEU C C 13 175.97 0.09 . 1 . . . . . . . . 4076 1 1265 . 1 1 147 147 LYS N N 15 120.8 0.1 . 1 . . . . . . . . 4076 1 1266 . 1 1 147 147 LYS H H 1 7.86 0.007 . 1 . . . . . . . . 4076 1 1267 . 1 1 147 147 LYS CA C 13 57.5 0.5 . 1 . . . . . . . . 4076 1 1268 . 1 1 147 147 LYS HA H 1 4.19 0.06 . 1 . . . . . . . . 4076 1 1269 . 1 1 147 147 LYS CB C 13 30.4 0.5 . 1 . . . . . . . . 4076 1 1270 . 1 1 147 147 LYS HB2 H 1 1.74 0.06 . 2 . . . . . . . . 4076 1 1271 . 1 1 147 147 LYS HB3 H 1 1.74 0.06 . 2 . . . . . . . . 4076 1 1272 . 1 1 147 147 LYS CG C 13 24.7 0.5 . 1 . . . . . . . . 4076 1 1273 . 1 1 147 147 LYS CD C 13 29.0 0.5 . 1 . . . . . . . . 4076 1 1274 . 1 1 147 147 LYS CE C 13 42.4 0.5 . 1 . . . . . . . . 4076 1 1275 . 1 1 147 147 LYS C C 13 176.34 0.09 . 1 . . . . . . . . 4076 1 1276 . 1 1 148 148 GLY N N 15 114.1 0.1 . 1 . . . . . . . . 4076 1 1277 . 1 1 148 148 GLY H H 1 7.96 0.007 . 1 . . . . . . . . 4076 1 1278 . 1 1 148 148 GLY CA C 13 45.3 0.5 . 1 . . . . . . . . 4076 1 1279 . 1 1 148 148 GLY HA2 H 1 3.73 0.06 . 2 . . . . . . . . 4076 1 1280 . 1 1 148 148 GLY HA3 H 1 4.78 0.06 . 2 . . . . . . . . 4076 1 1281 . 1 1 148 148 GLY C C 13 173.48 0.09 . 1 . . . . . . . . 4076 1 1282 . 1 1 149 149 TYR N N 15 114.9 0.1 . 1 . . . . . . . . 4076 1 1283 . 1 1 149 149 TYR H H 1 6.76 0.007 . 1 . . . . . . . . 4076 1 1284 . 1 1 149 149 TYR CA C 13 55.9 0.5 . 1 . . . . . . . . 4076 1 1285 . 1 1 149 149 TYR HA H 1 4.86 0.06 . 1 . . . . . . . . 4076 1 1286 . 1 1 149 149 TYR CB C 13 39.3 0.5 . 1 . . . . . . . . 4076 1 1287 . 1 1 149 149 TYR HB2 H 1 3.32 0.06 . 2 . . . . . . . . 4076 1 1288 . 1 1 149 149 TYR HB3 H 1 3.32 0.06 . 2 . . . . . . . . 4076 1 1289 . 1 1 149 149 TYR C C 13 171.42 0.09 . 1 . . . . . . . . 4076 1 1290 . 1 1 150 150 VAL N N 15 117.1 0.1 . 1 . . . . . . . . 4076 1 1291 . 1 1 150 150 VAL H H 1 7.98 0.007 . 1 . . . . . . . . 4076 1 1292 . 1 1 150 150 VAL CA C 13 59.7 0.5 . 1 . . . . . . . . 4076 1 1293 . 1 1 150 150 VAL HA H 1 5.03 0.06 . 1 . . . . . . . . 4076 1 1294 . 1 1 150 150 VAL CB C 13 35.3 0.5 . 1 . . . . . . . . 4076 1 1295 . 1 1 150 150 VAL HB H 1 1.98 0.06 . 1 . . . . . . . . 4076 1 1296 . 1 1 150 150 VAL CG1 C 13 21.1 0.5 . 2 . . . . . . . . 4076 1 1297 . 1 1 150 150 VAL CG2 C 13 21.1 0.5 . 2 . . . . . . . . 4076 1 1298 . 1 1 150 150 VAL C C 13 175.12 0.09 . 1 . . . . . . . . 4076 1 1299 . 1 1 151 151 LEU N N 15 124.2 0.1 . 1 . . . . . . . . 4076 1 1300 . 1 1 151 151 LEU H H 1 8.91 0.007 . 1 . . . . . . . . 4076 1 1301 . 1 1 151 151 LEU CA C 13 52.7 0.5 . 1 . . . . . . . . 4076 1 1302 . 1 1 151 151 LEU HA H 1 5.05 0.06 . 1 . . . . . . . . 4076 1 1303 . 1 1 151 151 LEU CB C 13 45.4 0.5 . 1 . . . . . . . . 4076 1 1304 . 1 1 151 151 LEU HB2 H 1 1.33 0.06 . 2 . . . . . . . . 4076 1 1305 . 1 1 151 151 LEU HB3 H 1 1.33 0.06 . 2 . . . . . . . . 4076 1 1306 . 1 1 151 151 LEU CG C 13 25.5 0.5 . 1 . . . . . . . . 4076 1 1307 . 1 1 151 151 LEU CD1 C 13 23.1 0.5 . 2 . . . . . . . . 4076 1 1308 . 1 1 151 151 LEU CD2 C 13 23.1 0.5 . 2 . . . . . . . . 4076 1 1309 . 1 1 151 151 LEU C C 13 176.04 0.09 . 1 . . . . . . . . 4076 1 1310 . 1 1 152 152 GLU N N 15 122.4 0.1 . 1 . . . . . . . . 4076 1 1311 . 1 1 152 152 GLU H H 1 9.48 0.007 . 1 . . . . . . . . 4076 1 1312 . 1 1 152 152 GLU CA C 13 55.5 0.5 . 1 . . . . . . . . 4076 1 1313 . 1 1 152 152 GLU HA H 1 5.11 0.06 . 1 . . . . . . . . 4076 1 1314 . 1 1 152 152 GLU CB C 13 34.2 0.5 . 1 . . . . . . . . 4076 1 1315 . 1 1 152 152 GLU HB2 H 1 2.14 0.06 . 2 . . . . . . . . 4076 1 1316 . 1 1 152 152 GLU HB3 H 1 2.25 0.06 . 2 . . . . . . . . 4076 1 1317 . 1 1 152 152 GLU CG C 13 37.7 0.5 . 1 . . . . . . . . 4076 1 1318 . 1 1 152 152 GLU C C 13 176.34 0.09 . 1 . . . . . . . . 4076 1 1319 . 1 1 153 153 GLY N N 15 109.0 0.1 . 1 . . . . . . . . 4076 1 1320 . 1 1 153 153 GLY H H 1 8.65 0.007 . 1 . . . . . . . . 4076 1 1321 . 1 1 153 153 GLY CA C 13 46.5 0.5 . 1 . . . . . . . . 4076 1 1322 . 1 1 153 153 GLY HA2 H 1 4.29 0.06 . 2 . . . . . . . . 4076 1 1323 . 1 1 153 153 GLY HA3 H 1 5.20 0.06 . 2 . . . . . . . . 4076 1 1324 . 1 1 153 153 GLY C C 13 174.22 0.09 . 1 . . . . . . . . 4076 1 1325 . 1 1 154 154 THR N N 15 118.9 0.1 . 1 . . . . . . . . 4076 1 1326 . 1 1 154 154 THR H H 1 9.15 0.007 . 1 . . . . . . . . 4076 1 1327 . 1 1 154 154 THR CA C 13 61.0 0.5 . 1 . . . . . . . . 4076 1 1328 . 1 1 154 154 THR HA H 1 4.97 0.06 . 1 . . . . . . . . 4076 1 1329 . 1 1 154 154 THR CB C 13 72.8 0.5 . 1 . . . . . . . . 4076 1 1330 . 1 1 154 154 THR HB H 1 4.30 0.06 . 1 . . . . . . . . 4076 1 1331 . 1 1 154 154 THR C C 13 171.53 0.09 . 1 . . . . . . . . 4076 1 1332 . 1 1 155 155 LEU N N 15 125.8 0.1 . 1 . . . . . . . . 4076 1 1333 . 1 1 155 155 LEU H H 1 8.38 0.007 . 1 . . . . . . . . 4076 1 1334 . 1 1 155 155 LEU CA C 13 54.1 0.5 . 1 . . . . . . . . 4076 1 1335 . 1 1 155 155 LEU HA H 1 4.94 0.06 . 1 . . . . . . . . 4076 1 1336 . 1 1 155 155 LEU CB C 13 45.2 0.5 . 1 . . . . . . . . 4076 1 1337 . 1 1 155 155 LEU HB2 H 1 1.26 0.06 . 2 . . . . . . . . 4076 1 1338 . 1 1 155 155 LEU HB3 H 1 1.26 0.06 . 2 . . . . . . . . 4076 1 1339 . 1 1 155 155 LEU CG C 13 25.2 0.5 . 1 . . . . . . . . 4076 1 1340 . 1 1 155 155 LEU CD1 C 13 22.3 0.5 . 2 . . . . . . . . 4076 1 1341 . 1 1 155 155 LEU CD2 C 13 22.3 0.5 . 2 . . . . . . . . 4076 1 1342 . 1 1 155 155 LEU C C 13 175.65 0.09 . 1 . . . . . . . . 4076 1 1343 . 1 1 156 156 THR N N 15 118.1 0.1 . 1 . . . . . . . . 4076 1 1344 . 1 1 156 156 THR H H 1 8.45 0.007 . 1 . . . . . . . . 4076 1 1345 . 1 1 156 156 THR CA C 13 60.2 0.5 . 1 . . . . . . . . 4076 1 1346 . 1 1 156 156 THR HA H 1 4.46 0.06 . 1 . . . . . . . . 4076 1 1347 . 1 1 156 156 THR CB C 13 72.8 0.5 . 1 . . . . . . . . 4076 1 1348 . 1 1 156 156 THR C C 13 173.69 0.09 . 1 . . . . . . . . 4076 1 1349 . 1 1 157 157 ALA N N 15 122.1 0.1 . 1 . . . . . . . . 4076 1 1350 . 1 1 157 157 ALA H H 1 8.76 0.007 . 1 . . . . . . . . 4076 1 1351 . 1 1 157 157 ALA CA C 13 54.3 0.5 . 1 . . . . . . . . 4076 1 1352 . 1 1 157 157 ALA HA H 1 4.01 0.06 . 1 . . . . . . . . 4076 1 1353 . 1 1 157 157 ALA CB C 13 18.1 0.5 . 1 . . . . . . . . 4076 1 1354 . 1 1 157 157 ALA HB1 H 1 1.43 0.06 . 1 . . . . . . . . 4076 1 1355 . 1 1 157 157 ALA HB2 H 1 1.43 0.06 . 1 . . . . . . . . 4076 1 1356 . 1 1 157 157 ALA HB3 H 1 1.43 0.06 . 1 . . . . . . . . 4076 1 1357 . 1 1 157 157 ALA C C 13 178.29 0.09 . 1 . . . . . . . . 4076 1 1358 . 1 1 158 158 GLU N N 15 113.3 0.1 . 1 . . . . . . . . 4076 1 1359 . 1 1 158 158 GLU H H 1 7.91 0.007 . 1 . . . . . . . . 4076 1 1360 . 1 1 158 158 GLU CA C 13 57.7 0.5 . 1 . . . . . . . . 4076 1 1361 . 1 1 158 158 GLU HA H 1 4.21 0.06 . 1 . . . . . . . . 4076 1 1362 . 1 1 158 158 GLU CB C 13 31.4 0.5 . 1 . . . . . . . . 4076 1 1363 . 1 1 158 158 GLU HB2 H 1 1.95 0.06 . 2 . . . . . . . . 4076 1 1364 . 1 1 158 158 GLU HB3 H 1 1.95 0.06 . 2 . . . . . . . . 4076 1 1365 . 1 1 158 158 GLU CG C 13 36.4 0.5 . 1 . . . . . . . . 4076 1 1366 . 1 1 158 158 GLU HG2 H 1 2.17 0.06 . 2 . . . . . . . . 4076 1 1367 . 1 1 158 158 GLU HG3 H 1 2.17 0.06 . 2 . . . . . . . . 4076 1 1368 . 1 1 158 158 GLU C C 13 176.10 0.09 . 1 . . . . . . . . 4076 1 1369 . 1 1 159 159 LYS N N 15 116.5 0.1 . 1 . . . . . . . . 4076 1 1370 . 1 1 159 159 LYS H H 1 7.57 0.007 . 1 . . . . . . . . 4076 1 1371 . 1 1 159 159 LYS CA C 13 56.0 0.5 . 1 . . . . . . . . 4076 1 1372 . 1 1 159 159 LYS HA H 1 4.71 0.06 . 1 . . . . . . . . 4076 1 1373 . 1 1 159 159 LYS CB C 13 34.6 0.5 . 1 . . . . . . . . 4076 1 1374 . 1 1 159 159 LYS HB2 H 1 1.45 0.06 . 2 . . . . . . . . 4076 1 1375 . 1 1 159 159 LYS HB3 H 1 1.93 0.06 . 2 . . . . . . . . 4076 1 1376 . 1 1 159 159 LYS CG C 13 22.7 0.5 . 1 . . . . . . . . 4076 1 1377 . 1 1 159 159 LYS CD C 13 29.8 0.5 . 1 . . . . . . . . 4076 1 1378 . 1 1 159 159 LYS C C 13 174.36 0.09 . 1 . . . . . . . . 4076 1 1379 . 1 1 160 160 THR N N 15 121.0 0.1 . 1 . . . . . . . . 4076 1 1380 . 1 1 160 160 THR H H 1 8.64 0.007 . 1 . . . . . . . . 4076 1 1381 . 1 1 160 160 THR CA C 13 62.3 0.5 . 1 . . . . . . . . 4076 1 1382 . 1 1 160 160 THR HA H 1 4.97 0.06 . 1 . . . . . . . . 4076 1 1383 . 1 1 160 160 THR CB C 13 70.5 0.5 . 1 . . . . . . . . 4076 1 1384 . 1 1 160 160 THR HB H 1 4.12 0.06 . 1 . . . . . . . . 4076 1 1385 . 1 1 160 160 THR CG2 C 13 20.9 0.5 . 1 . . . . . . . . 4076 1 1386 . 1 1 160 160 THR C C 13 173.38 0.09 . 1 . . . . . . . . 4076 1 1387 . 1 1 161 161 THR N N 15 125.0 0.1 . 1 . . . . . . . . 4076 1 1388 . 1 1 161 161 THR H H 1 9.10 0.007 . 1 . . . . . . . . 4076 1 1389 . 1 1 161 161 THR CA C 13 62.2 0.5 . 1 . . . . . . . . 4076 1 1390 . 1 1 161 161 THR HA H 1 5.06 0.06 . 1 . . . . . . . . 4076 1 1391 . 1 1 161 161 THR CB C 13 71.3 0.5 . 1 . . . . . . . . 4076 1 1392 . 1 1 161 161 THR HB H 1 3.72 0.06 . 1 . . . . . . . . 4076 1 1393 . 1 1 161 161 THR CG2 C 13 19.5 0.5 . 1 . . . . . . . . 4076 1 1394 . 1 1 161 161 THR C C 13 172.65 0.09 . 1 . . . . . . . . 4076 1 1395 . 1 1 162 162 LEU N N 15 131.9 0.1 . 1 . . . . . . . . 4076 1 1396 . 1 1 162 162 LEU H H 1 9.30 0.007 . 1 . . . . . . . . 4076 1 1397 . 1 1 162 162 LEU CA C 13 53.6 0.5 . 1 . . . . . . . . 4076 1 1398 . 1 1 162 162 LEU HA H 1 4.69 0.06 . 1 . . . . . . . . 4076 1 1399 . 1 1 162 162 LEU CB C 13 42.3 0.5 . 1 . . . . . . . . 4076 1 1400 . 1 1 162 162 LEU HB2 H 1 1.76 0.06 . 2 . . . . . . . . 4076 1 1401 . 1 1 162 162 LEU HB3 H 1 2.03 0.06 . 2 . . . . . . . . 4076 1 1402 . 1 1 162 162 LEU CG C 13 25.5 0.5 . 1 . . . . . . . . 4076 1 1403 . 1 1 162 162 LEU CD1 C 13 24.2 0.5 . 2 . . . . . . . . 4076 1 1404 . 1 1 162 162 LEU CD2 C 13 27.3 0.5 . 2 . . . . . . . . 4076 1 1405 . 1 1 162 162 LEU C C 13 175.63 0.09 . 1 . . . . . . . . 4076 1 1406 . 1 1 163 163 VAL N N 15 120.8 0.1 . 1 . . . . . . . . 4076 1 1407 . 1 1 163 163 VAL H H 1 8.41 0.007 . 1 . . . . . . . . 4076 1 1408 . 1 1 163 163 VAL CA C 13 61.2 0.5 . 1 . . . . . . . . 4076 1 1409 . 1 1 163 163 VAL HA H 1 5.32 0.06 . 1 . . . . . . . . 4076 1 1410 . 1 1 163 163 VAL CB C 13 36.2 0.5 . 1 . . . . . . . . 4076 1 1411 . 1 1 163 163 VAL HB H 1 1.90 0.06 . 1 . . . . . . . . 4076 1 1412 . 1 1 163 163 VAL CG1 C 13 20.9 0.5 . 2 . . . . . . . . 4076 1 1413 . 1 1 163 163 VAL CG2 C 13 20.9 0.5 . 2 . . . . . . . . 4076 1 1414 . 1 1 163 163 VAL C C 13 175.63 0.09 . 1 . . . . . . . . 4076 1 1415 . 1 1 164 164 VAL N N 15 126.9 0.1 . 1 . . . . . . . . 4076 1 1416 . 1 1 164 164 VAL H H 1 9.09 0.007 . 1 . . . . . . . . 4076 1 1417 . 1 1 164 164 VAL CA C 13 61.7 0.5 . 1 . . . . . . . . 4076 1 1418 . 1 1 164 164 VAL HA H 1 4.33 0.06 . 1 . . . . . . . . 4076 1 1419 . 1 1 164 164 VAL CB C 13 35.0 0.5 . 1 . . . . . . . . 4076 1 1420 . 1 1 164 164 VAL HB H 1 1.91 0.06 . 1 . . . . . . . . 4076 1 1421 . 1 1 164 164 VAL CG1 C 13 21.5 0.5 . 2 . . . . . . . . 4076 1 1422 . 1 1 164 164 VAL CG2 C 13 21.5 0.5 . 2 . . . . . . . . 4076 1 1423 . 1 1 164 164 VAL C C 13 173.35 0.09 . 1 . . . . . . . . 4076 1 1424 . 1 1 165 165 LYS N N 15 127.9 0.1 . 1 . . . . . . . . 4076 1 1425 . 1 1 165 165 LYS H H 1 8.40 0.007 . 1 . . . . . . . . 4076 1 1426 . 1 1 165 165 LYS CA C 13 54.6 0.5 . 1 . . . . . . . . 4076 1 1427 . 1 1 165 165 LYS HA H 1 5.26 0.06 . 1 . . . . . . . . 4076 1 1428 . 1 1 165 165 LYS CB C 13 35.9 0.5 . 1 . . . . . . . . 4076 1 1429 . 1 1 165 165 LYS HB2 H 1 1.54 0.06 . 2 . . . . . . . . 4076 1 1430 . 1 1 165 165 LYS HB3 H 1 1.80 0.06 . 2 . . . . . . . . 4076 1 1431 . 1 1 165 165 LYS CG C 13 25.1 0.5 . 1 . . . . . . . . 4076 1 1432 . 1 1 165 165 LYS CD C 13 29.4 0.5 . 1 . . . . . . . . 4076 1 1433 . 1 1 165 165 LYS CE C 13 42.1 0.5 . 1 . . . . . . . . 4076 1 1434 . 1 1 165 165 LYS C C 13 175.50 0.09 . 1 . . . . . . . . 4076 1 1435 . 1 1 166 166 GLU N N 15 125.3 0.1 . 1 . . . . . . . . 4076 1 1436 . 1 1 166 166 GLU H H 1 8.56 0.007 . 1 . . . . . . . . 4076 1 1437 . 1 1 166 166 GLU CA C 13 55.5 0.5 . 1 . . . . . . . . 4076 1 1438 . 1 1 166 166 GLU HA H 1 4.59 0.06 . 1 . . . . . . . . 4076 1 1439 . 1 1 166 166 GLU CB C 13 32.1 0.5 . 1 . . . . . . . . 4076 1 1440 . 1 1 166 166 GLU CG C 13 35.1 0.5 . 1 . . . . . . . . 4076 1 1441 . 1 1 166 166 GLU C C 13 175.90 0.09 . 1 . . . . . . . . 4076 1 1442 . 1 1 167 167 GLY N N 15 121.3 0.1 . 1 . . . . . . . . 4076 1 1443 . 1 1 167 167 GLY H H 1 8.99 0.007 . 1 . . . . . . . . 4076 1 1444 . 1 1 167 167 GLY CA C 13 47.1 0.5 . 1 . . . . . . . . 4076 1 1445 . 1 1 167 167 GLY HA2 H 1 3.71 0.06 . 2 . . . . . . . . 4076 1 1446 . 1 1 167 167 GLY HA3 H 1 4.16 0.06 . 2 . . . . . . . . 4076 1 1447 . 1 1 167 167 GLY C C 13 175.93 0.09 . 1 . . . . . . . . 4076 1 1448 . 1 1 168 168 THR N N 15 119.7 0.1 . 1 . . . . . . . . 4076 1 1449 . 1 1 168 168 THR H H 1 8.70 0.007 . 1 . . . . . . . . 4076 1 1450 . 1 1 168 168 THR CA C 13 63.0 0.5 . 1 . . . . . . . . 4076 1 1451 . 1 1 168 168 THR HA H 1 4.96 0.06 . 1 . . . . . . . . 4076 1 1452 . 1 1 168 168 THR CB C 13 67.7 0.5 . 1 . . . . . . . . 4076 1 1453 . 1 1 168 168 THR HB H 1 4.22 0.06 . 1 . . . . . . . . 4076 1 1454 . 1 1 168 168 THR CG2 C 13 21.7 0.5 . 1 . . . . . . . . 4076 1 1455 . 1 1 168 168 THR C C 13 174.49 0.09 . 1 . . . . . . . . 4076 1 1456 . 1 1 169 169 VAL N N 15 126.1 0.1 . 1 . . . . . . . . 4076 1 1457 . 1 1 169 169 VAL H H 1 8.33 0.007 . 1 . . . . . . . . 4076 1 1458 . 1 1 169 169 VAL CA C 13 62.6 0.5 . 1 . . . . . . . . 4076 1 1459 . 1 1 169 169 VAL HA H 1 4.70 0.06 . 1 . . . . . . . . 4076 1 1460 . 1 1 169 169 VAL CB C 13 33.1 0.5 . 1 . . . . . . . . 4076 1 1461 . 1 1 169 169 VAL HB H 1 2.35 0.06 . 1 . . . . . . . . 4076 1 1462 . 1 1 169 169 VAL CG1 C 13 23.2 0.5 . 2 . . . . . . . . 4076 1 1463 . 1 1 169 169 VAL CG2 C 13 23.2 0.5 . 2 . . . . . . . . 4076 1 1464 . 1 1 169 169 VAL C C 13 175.45 0.09 . 1 . . . . . . . . 4076 1 1465 . 1 1 170 170 THR N N 15 123.4 0.1 . 1 . . . . . . . . 4076 1 1466 . 1 1 170 170 THR H H 1 9.04 0.007 . 1 . . . . . . . . 4076 1 1467 . 1 1 170 170 THR CA C 13 62.2 0.5 . 1 . . . . . . . . 4076 1 1468 . 1 1 170 170 THR HA H 1 4.80 0.06 . 1 . . . . . . . . 4076 1 1469 . 1 1 170 170 THR CB C 13 70.9 0.5 . 1 . . . . . . . . 4076 1 1470 . 1 1 170 170 THR HB H 1 3.93 0.06 . 1 . . . . . . . . 4076 1 1471 . 1 1 170 170 THR CG2 C 13 21.3 0.5 . 1 . . . . . . . . 4076 1 1472 . 1 1 170 170 THR C C 13 173.26 0.09 . 1 . . . . . . . . 4076 1 1473 . 1 1 171 171 LEU N N 15 134.0 0.1 . 1 . . . . . . . . 4076 1 1474 . 1 1 171 171 LEU H H 1 9.52 0.007 . 1 . . . . . . . . 4076 1 1475 . 1 1 171 171 LEU CA C 13 54.0 0.5 . 1 . . . . . . . . 4076 1 1476 . 1 1 171 171 LEU HA H 1 4.93 0.06 . 1 . . . . . . . . 4076 1 1477 . 1 1 171 171 LEU CB C 13 45.0 0.5 . 1 . . . . . . . . 4076 1 1478 . 1 1 171 171 LEU HB2 H 1 1.32 0.06 . 2 . . . . . . . . 4076 1 1479 . 1 1 171 171 LEU HB3 H 1 1.32 0.06 . 2 . . . . . . . . 4076 1 1480 . 1 1 171 171 LEU CG C 13 26.1 0.5 . 1 . . . . . . . . 4076 1 1481 . 1 1 171 171 LEU CD1 C 13 25.1 0.5 . 2 . . . . . . . . 4076 1 1482 . 1 1 171 171 LEU CD2 C 13 25.1 0.5 . 2 . . . . . . . . 4076 1 1483 . 1 1 171 171 LEU C C 13 174.16 0.09 . 1 . . . . . . . . 4076 1 1484 . 1 1 172 172 SER N N 15 122.9 0.1 . 1 . . . . . . . . 4076 1 1485 . 1 1 172 172 SER H H 1 8.96 0.007 . 1 . . . . . . . . 4076 1 1486 . 1 1 172 172 SER CA C 13 56.7 0.5 . 1 . . . . . . . . 4076 1 1487 . 1 1 172 172 SER HA H 1 5.36 0.06 . 1 . . . . . . . . 4076 1 1488 . 1 1 172 172 SER CB C 13 64.2 0.5 . 1 . . . . . . . . 4076 1 1489 . 1 1 172 172 SER HB2 H 1 3.50 0.06 . 2 . . . . . . . . 4076 1 1490 . 1 1 172 172 SER HB3 H 1 3.50 0.06 . 2 . . . . . . . . 4076 1 1491 . 1 1 172 172 SER C C 13 171.71 0.09 . 1 . . . . . . . . 4076 1 1492 . 1 1 173 173 LYS N N 15 127.9 0.1 . 1 . . . . . . . . 4076 1 1493 . 1 1 173 173 LYS H H 1 9.49 0.007 . 1 . . . . . . . . 4076 1 1494 . 1 1 173 173 LYS CA C 13 54.8 0.5 . 1 . . . . . . . . 4076 1 1495 . 1 1 173 173 LYS HA H 1 4.30 0.06 . 1 . . . . . . . . 4076 1 1496 . 1 1 173 173 LYS CB C 13 34.7 0.5 . 1 . . . . . . . . 4076 1 1497 . 1 1 173 173 LYS CG C 13 25.9 0.5 . 1 . . . . . . . . 4076 1 1498 . 1 1 173 173 LYS CD C 13 31.0 0.5 . 1 . . . . . . . . 4076 1 1499 . 1 1 173 173 LYS CE C 13 41.9 0.5 . 1 . . . . . . . . 4076 1 1500 . 1 1 173 173 LYS C C 13 173.48 0.09 . 1 . . . . . . . . 4076 1 1501 . 1 1 174 174 ASN N N 15 126.9 0.1 . 1 . . . . . . . . 4076 1 1502 . 1 1 174 174 ASN H H 1 8.99 0.007 . 1 . . . . . . . . 4076 1 1503 . 1 1 174 174 ASN CA C 13 51.7 0.5 . 1 . . . . . . . . 4076 1 1504 . 1 1 174 174 ASN HA H 1 5.69 0.06 . 1 . . . . . . . . 4076 1 1505 . 1 1 174 174 ASN CB C 13 41.1 0.5 . 1 . . . . . . . . 4076 1 1506 . 1 1 174 174 ASN HB2 H 1 2.14 0.06 . 2 . . . . . . . . 4076 1 1507 . 1 1 174 174 ASN HB3 H 1 2.69 0.06 . 2 . . . . . . . . 4076 1 1508 . 1 1 174 174 ASN C C 13 174.40 0.09 . 1 . . . . . . . . 4076 1 1509 . 1 1 175 175 ILE N N 15 122.4 0.1 . 1 . . . . . . . . 4076 1 1510 . 1 1 175 175 ILE H H 1 9.17 0.007 . 1 . . . . . . . . 4076 1 1511 . 1 1 175 175 ILE CA C 13 60.3 0.5 . 1 . . . . . . . . 4076 1 1512 . 1 1 175 175 ILE HA H 1 4.68 0.06 . 1 . . . . . . . . 4076 1 1513 . 1 1 175 175 ILE CB C 13 40.9 0.5 . 1 . . . . . . . . 4076 1 1514 . 1 1 175 175 ILE HB H 1 1.55 0.06 . 1 . . . . . . . . 4076 1 1515 . 1 1 175 175 ILE CG1 C 13 27.0 0.5 . 2 . . . . . . . . 4076 1 1516 . 1 1 175 175 ILE CD1 C 13 14.6 0.5 . 1 . . . . . . . . 4076 1 1517 . 1 1 175 175 ILE CG2 C 13 17.2 0.5 . 2 . . . . . . . . 4076 1 1518 . 1 1 175 175 ILE C C 13 177.43 0.09 . 1 . . . . . . . . 4076 1 1519 . 1 1 176 176 SER N N 15 126.1 0.1 . 1 . . . . . . . . 4076 1 1520 . 1 1 176 176 SER H H 1 9.17 0.007 . 1 . . . . . . . . 4076 1 1521 . 1 1 176 176 SER CA C 13 58.1 0.5 . 1 . . . . . . . . 4076 1 1522 . 1 1 176 176 SER HA H 1 4.60 0.06 . 1 . . . . . . . . 4076 1 1523 . 1 1 176 176 SER CB C 13 65.0 0.5 . 1 . . . . . . . . 4076 1 1524 . 1 1 176 176 SER HB2 H 1 4.07 0.06 . 2 . . . . . . . . 4076 1 1525 . 1 1 176 176 SER HB3 H 1 4.07 0.06 . 2 . . . . . . . . 4076 1 1526 . 1 1 176 176 SER C C 13 176.12 0.09 . 1 . . . . . . . . 4076 1 1527 . 1 1 177 177 LYS N N 15 123.4 0.1 . 1 . . . . . . . . 4076 1 1528 . 1 1 177 177 LYS H H 1 8.46 0.007 . 1 . . . . . . . . 4076 1 1529 . 1 1 177 177 LYS CA C 13 59.3 0.5 . 1 . . . . . . . . 4076 1 1530 . 1 1 177 177 LYS HA H 1 4.09 0.06 . 1 . . . . . . . . 4076 1 1531 . 1 1 177 177 LYS CB C 13 31.8 0.5 . 1 . . . . . . . . 4076 1 1532 . 1 1 177 177 LYS HB2 H 1 1.92 0.06 . 2 . . . . . . . . 4076 1 1533 . 1 1 177 177 LYS HB3 H 1 1.92 0.06 . 2 . . . . . . . . 4076 1 1534 . 1 1 177 177 LYS CG C 13 24.5 0.5 . 1 . . . . . . . . 4076 1 1535 . 1 1 177 177 LYS CD C 13 29.2 0.5 . 1 . . . . . . . . 4076 1 1536 . 1 1 177 177 LYS CE C 13 42.0 0.5 . 1 . . . . . . . . 4076 1 1537 . 1 1 177 177 LYS C C 13 177.20 0.09 . 1 . . . . . . . . 4076 1 1538 . 1 1 178 178 SER N N 15 112.8 0.1 . 1 . . . . . . . . 4076 1 1539 . 1 1 178 178 SER H H 1 7.92 0.007 . 1 . . . . . . . . 4076 1 1540 . 1 1 178 178 SER CA C 13 57.9 0.5 . 1 . . . . . . . . 4076 1 1541 . 1 1 178 178 SER HA H 1 4.50 0.06 . 1 . . . . . . . . 4076 1 1542 . 1 1 178 178 SER CB C 13 63.6 0.5 . 1 . . . . . . . . 4076 1 1543 . 1 1 178 178 SER HB2 H 1 3.83 0.06 . 2 . . . . . . . . 4076 1 1544 . 1 1 178 178 SER HB3 H 1 3.83 0.06 . 2 . . . . . . . . 4076 1 1545 . 1 1 178 178 SER C C 13 174.99 0.09 . 1 . . . . . . . . 4076 1 1546 . 1 1 179 179 GLY N N 15 111.9 0.1 . 1 . . . . . . . . 4076 1 1547 . 1 1 179 179 GLY H H 1 8.02 0.007 . 1 . . . . . . . . 4076 1 1548 . 1 1 179 179 GLY CA C 13 45.2 0.5 . 1 . . . . . . . . 4076 1 1549 . 1 1 179 179 GLY HA2 H 1 3.46 0.06 . 2 . . . . . . . . 4076 1 1550 . 1 1 179 179 GLY HA3 H 1 4.31 0.06 . 2 . . . . . . . . 4076 1 1551 . 1 1 179 179 GLY C C 13 173.96 0.09 . 1 . . . . . . . . 4076 1 1552 . 1 1 180 180 GLU N N 15 122.1 0.1 . 1 . . . . . . . . 4076 1 1553 . 1 1 180 180 GLU H H 1 7.73 0.007 . 1 . . . . . . . . 4076 1 1554 . 1 1 180 180 GLU CA C 13 56.9 0.5 . 1 . . . . . . . . 4076 1 1555 . 1 1 180 180 GLU HA H 1 4.29 0.06 . 1 . . . . . . . . 4076 1 1556 . 1 1 180 180 GLU CB C 13 30.6 0.5 . 1 . . . . . . . . 4076 1 1557 . 1 1 180 180 GLU HB2 H 1 1.95 0.06 . 2 . . . . . . . . 4076 1 1558 . 1 1 180 180 GLU HB3 H 1 1.95 0.06 . 2 . . . . . . . . 4076 1 1559 . 1 1 180 180 GLU CG C 13 36.4 0.5 . 1 . . . . . . . . 4076 1 1560 . 1 1 180 180 GLU HG2 H 1 2.19 0.06 . 2 . . . . . . . . 4076 1 1561 . 1 1 180 180 GLU HG3 H 1 2.19 0.06 . 2 . . . . . . . . 4076 1 1562 . 1 1 180 180 GLU C C 13 176.54 0.09 . 1 . . . . . . . . 4076 1 1563 . 1 1 181 181 VAL N N 15 129.8 0.1 . 1 . . . . . . . . 4076 1 1564 . 1 1 181 181 VAL H H 1 8.77 0.007 . 1 . . . . . . . . 4076 1 1565 . 1 1 181 181 VAL CA C 13 61.5 0.5 . 1 . . . . . . . . 4076 1 1566 . 1 1 181 181 VAL HA H 1 5.03 0.06 . 1 . . . . . . . . 4076 1 1567 . 1 1 181 181 VAL CB C 13 33.6 0.5 . 1 . . . . . . . . 4076 1 1568 . 1 1 181 181 VAL HB H 1 2.06 0.06 . 1 . . . . . . . . 4076 1 1569 . 1 1 181 181 VAL CG1 C 13 22.4 0.5 . 2 . . . . . . . . 4076 1 1570 . 1 1 181 181 VAL CG2 C 13 21.0 0.5 . 2 . . . . . . . . 4076 1 1571 . 1 1 181 181 VAL C C 13 175.80 0.09 . 1 . . . . . . . . 4076 1 1572 . 1 1 182 182 SER N N 15 121.8 0.1 . 1 . . . . . . . . 4076 1 1573 . 1 1 182 182 SER H H 1 8.71 0.007 . 1 . . . . . . . . 4076 1 1574 . 1 1 182 182 SER CA C 13 57.2 0.5 . 1 . . . . . . . . 4076 1 1575 . 1 1 182 182 SER CB C 13 65.1 0.5 . 1 . . . . . . . . 4076 1 1576 . 1 1 182 182 SER C C 13 171.16 0.09 . 1 . . . . . . . . 4076 1 1577 . 1 1 183 183 VAL N N 15 120.8 0.1 . 1 . . . . . . . . 4076 1 1578 . 1 1 183 183 VAL H H 1 3.98 0.007 . 1 . . . . . . . . 4076 1 1579 . 1 1 183 183 VAL CA C 13 59.7 0.5 . 1 . . . . . . . . 4076 1 1580 . 1 1 183 183 VAL HA H 1 4.59 0.06 . 1 . . . . . . . . 4076 1 1581 . 1 1 183 183 VAL CB C 13 33.7 0.5 . 1 . . . . . . . . 4076 1 1582 . 1 1 183 183 VAL HB H 1 4.78 0.06 . 1 . . . . . . . . 4076 1 1583 . 1 1 183 183 VAL CG1 C 13 19.6 0.5 . 2 . . . . . . . . 4076 1 1584 . 1 1 183 183 VAL CG2 C 13 17.6 0.5 . 2 . . . . . . . . 4076 1 1585 . 1 1 183 183 VAL C C 13 173.09 0.09 . 1 . . . . . . . . 4076 1 1586 . 1 1 184 184 GLU N N 15 124.5 0.1 . 1 . . . . . . . . 4076 1 1587 . 1 1 184 184 GLU H H 1 8.51 0.007 . 1 . . . . . . . . 4076 1 1588 . 1 1 184 184 GLU CA C 13 53.8 0.5 . 1 . . . . . . . . 4076 1 1589 . 1 1 184 184 GLU HA H 1 4.55 0.06 . 1 . . . . . . . . 4076 1 1590 . 1 1 184 184 GLU CB C 13 34.3 0.5 . 1 . . . . . . . . 4076 1 1591 . 1 1 184 184 GLU HB2 H 1 1.78 0.06 . 2 . . . . . . . . 4076 1 1592 . 1 1 184 184 GLU HB3 H 1 1.78 0.06 . 2 . . . . . . . . 4076 1 1593 . 1 1 184 184 GLU CG C 13 35.9 0.5 . 1 . . . . . . . . 4076 1 1594 . 1 1 184 184 GLU HG2 H 1 1.90 0.06 . 2 . . . . . . . . 4076 1 1595 . 1 1 184 184 GLU HG3 H 1 1.90 0.06 . 2 . . . . . . . . 4076 1 1596 . 1 1 184 184 GLU C C 13 173.31 0.09 . 1 . . . . . . . . 4076 1 1597 . 1 1 185 185 LEU N N 15 124.5 0.1 . 1 . . . . . . . . 4076 1 1598 . 1 1 185 185 LEU H H 1 8.61 0.007 . 1 . . . . . . . . 4076 1 1599 . 1 1 185 185 LEU CA C 13 54.1 0.5 . 1 . . . . . . . . 4076 1 1600 . 1 1 185 185 LEU HA H 1 5.25 0.06 . 1 . . . . . . . . 4076 1 1601 . 1 1 185 185 LEU CB C 13 47.0 0.5 . 1 . . . . . . . . 4076 1 1602 . 1 1 185 185 LEU HB2 H 1 1.34 0.06 . 2 . . . . . . . . 4076 1 1603 . 1 1 185 185 LEU HB3 H 1 1.59 0.06 . 2 . . . . . . . . 4076 1 1604 . 1 1 185 185 LEU CG C 13 27.4 0.5 . 1 . . . . . . . . 4076 1 1605 . 1 1 185 185 LEU CD1 C 13 26.0 0.5 . 2 . . . . . . . . 4076 1 1606 . 1 1 185 185 LEU CD2 C 13 26.0 0.5 . 2 . . . . . . . . 4076 1 1607 . 1 1 185 185 LEU C C 13 174.79 0.09 . 1 . . . . . . . . 4076 1 1608 . 1 1 186 186 ASN N N 15 125.1 0.1 . 1 . . . . . . . . 4076 1 1609 . 1 1 186 186 ASN H H 1 8.87 0.007 . 1 . . . . . . . . 4076 1 1610 . 1 1 186 186 ASN CA C 13 53.0 0.5 . 1 . . . . . . . . 4076 1 1611 . 1 1 186 186 ASN HA H 1 5.11 0.06 . 1 . . . . . . . . 4076 1 1612 . 1 1 186 186 ASN CB C 13 43.1 0.5 . 1 . . . . . . . . 4076 1 1613 . 1 1 186 186 ASN HB2 H 1 2.64 0.06 . 2 . . . . . . . . 4076 1 1614 . 1 1 186 186 ASN HB3 H 1 2.64 0.06 . 2 . . . . . . . . 4076 1 1615 . 1 1 186 186 ASN C C 13 172.21 0.09 . 1 . . . . . . . . 4076 1 1616 . 1 1 187 187 ASP N N 15 126.9 0.1 . 1 . . . . . . . . 4076 1 1617 . 1 1 187 187 ASP H H 1 8.54 0.007 . 1 . . . . . . . . 4076 1 1618 . 1 1 187 187 ASP CA C 13 52.4 0.5 . 1 . . . . . . . . 4076 1 1619 . 1 1 187 187 ASP HA H 1 5.60 0.06 . 1 . . . . . . . . 4076 1 1620 . 1 1 187 187 ASP CB C 13 45.0 0.5 . 1 . . . . . . . . 4076 1 1621 . 1 1 187 187 ASP HB2 H 1 2.53 0.06 . 2 . . . . . . . . 4076 1 1622 . 1 1 187 187 ASP HB3 H 1 3.21 0.06 . 2 . . . . . . . . 4076 1 1623 . 1 1 187 187 ASP C C 13 177.39 0.09 . 1 . . . . . . . . 4076 1 1624 . 1 1 188 188 THR N N 15 117.5 0.1 . 1 . . . . . . . . 4076 1 1625 . 1 1 188 188 THR H H 1 8.48 0.007 . 1 . . . . . . . . 4076 1 1626 . 1 1 188 188 THR CA C 13 62.6 0.5 . 1 . . . . . . . . 4076 1 1627 . 1 1 188 188 THR HA H 1 4.59 0.06 . 1 . . . . . . . . 4076 1 1628 . 1 1 188 188 THR CB C 13 68.6 0.5 . 1 . . . . . . . . 4076 1 1629 . 1 1 188 188 THR HB H 1 4.26 0.06 . 1 . . . . . . . . 4076 1 1630 . 1 1 188 188 THR CG2 C 13 21.3 0.5 . 1 . . . . . . . . 4076 1 1631 . 1 1 188 188 THR C C 13 175.54 0.09 . 1 . . . . . . . . 4076 1 1632 . 1 1 189 189 ASP N N 15 126.9 0.1 . 1 . . . . . . . . 4076 1 1633 . 1 1 189 189 ASP H H 1 8.37 0.007 . 1 . . . . . . . . 4076 1 1634 . 1 1 189 189 ASP CA C 13 55.2 0.5 . 1 . . . . . . . . 4076 1 1635 . 1 1 189 189 ASP HA H 1 4.29 0.06 . 1 . . . . . . . . 4076 1 1636 . 1 1 189 189 ASP CB C 13 41.2 0.5 . 1 . . . . . . . . 4076 1 1637 . 1 1 189 189 ASP HB2 H 1 2.51 0.06 . 2 . . . . . . . . 4076 1 1638 . 1 1 189 189 ASP HB3 H 1 2.98 0.06 . 2 . . . . . . . . 4076 1 1639 . 1 1 189 189 ASP C C 13 176.34 0.09 . 1 . . . . . . . . 4076 1 1640 . 1 1 190 190 SER N N 15 121.1 0.1 . 1 . . . . . . . . 4076 1 1641 . 1 1 190 190 SER H H 1 8.17 0.007 . 1 . . . . . . . . 4076 1 1642 . 1 1 190 190 SER CA C 13 58.6 0.5 . 1 . . . . . . . . 4076 1 1643 . 1 1 190 190 SER HA H 1 4.42 0.06 . 1 . . . . . . . . 4076 1 1644 . 1 1 190 190 SER CB C 13 64.4 0.5 . 1 . . . . . . . . 4076 1 1645 . 1 1 190 190 SER HB2 H 1 3.89 0.06 . 2 . . . . . . . . 4076 1 1646 . 1 1 190 190 SER HB3 H 1 4.06 0.06 . 2 . . . . . . . . 4076 1 1647 . 1 1 190 190 SER C C 13 175.71 0.09 . 1 . . . . . . . . 4076 1 1648 . 1 1 191 191 SER N N 15 120.8 0.1 . 1 . . . . . . . . 4076 1 1649 . 1 1 191 191 SER H H 1 8.49 0.007 . 1 . . . . . . . . 4076 1 1650 . 1 1 191 191 SER CA C 13 57.4 0.5 . 1 . . . . . . . . 4076 1 1651 . 1 1 191 191 SER HA H 1 4.50 0.06 . 1 . . . . . . . . 4076 1 1652 . 1 1 191 191 SER CB C 13 63.5 0.5 . 1 . . . . . . . . 4076 1 1653 . 1 1 191 191 SER HB2 H 1 3.89 0.06 . 2 . . . . . . . . 4076 1 1654 . 1 1 191 191 SER HB3 H 1 4.12 0.06 . 2 . . . . . . . . 4076 1 1655 . 1 1 191 191 SER C C 13 175.07 0.09 . 1 . . . . . . . . 4076 1 1656 . 1 1 192 192 ALA N N 15 131.9 0.1 . 1 . . . . . . . . 4076 1 1657 . 1 1 192 192 ALA H H 1 8.71 0.007 . 1 . . . . . . . . 4076 1 1658 . 1 1 192 192 ALA CA C 13 54.7 0.5 . 1 . . . . . . . . 4076 1 1659 . 1 1 192 192 ALA HA H 1 4.00 0.06 . 1 . . . . . . . . 4076 1 1660 . 1 1 192 192 ALA CB C 13 18.5 0.5 . 1 . . . . . . . . 4076 1 1661 . 1 1 192 192 ALA HB1 H 1 1.44 0.06 . 2 . . . . . . . . 4076 1 1662 . 1 1 192 192 ALA HB2 H 1 1.44 0.06 . 2 . . . . . . . . 4076 1 1663 . 1 1 192 192 ALA HB3 H 1 1.44 0.06 . 2 . . . . . . . . 4076 1 1664 . 1 1 192 192 ALA C C 13 179.01 0.09 . 1 . . . . . . . . 4076 1 1665 . 1 1 193 193 ALA N N 15 118.1 0.1 . 1 . . . . . . . . 4076 1 1666 . 1 1 193 193 ALA H H 1 7.97 0.007 . 1 . . . . . . . . 4076 1 1667 . 1 1 193 193 ALA CA C 13 54.1 0.5 . 1 . . . . . . . . 4076 1 1668 . 1 1 193 193 ALA HA H 1 4.07 0.06 . 1 . . . . . . . . 4076 1 1669 . 1 1 193 193 ALA CB C 13 19.4 0.5 . 1 . . . . . . . . 4076 1 1670 . 1 1 193 193 ALA HB1 H 1 1.37 0.06 . 2 . . . . . . . . 4076 1 1671 . 1 1 193 193 ALA HB2 H 1 1.37 0.06 . 2 . . . . . . . . 4076 1 1672 . 1 1 193 193 ALA HB3 H 1 1.37 0.06 . 2 . . . . . . . . 4076 1 1673 . 1 1 193 193 ALA C C 13 177.87 0.09 . 1 . . . . . . . . 4076 1 1674 . 1 1 194 194 THR N N 15 103.3 0.1 . 1 . . . . . . . . 4076 1 1675 . 1 1 194 194 THR H H 1 6.99 0.007 . 1 . . . . . . . . 4076 1 1676 . 1 1 194 194 THR CA C 13 61.2 0.5 . 1 . . . . . . . . 4076 1 1677 . 1 1 194 194 THR HA H 1 4.30 0.06 . 1 . . . . . . . . 4076 1 1678 . 1 1 194 194 THR CB C 13 69.6 0.5 . 1 . . . . . . . . 4076 1 1679 . 1 1 194 194 THR CG2 C 13 21.6 0.5 . 1 . . . . . . . . 4076 1 1680 . 1 1 194 194 THR C C 13 174.50 0.09 . 1 . . . . . . . . 4076 1 1681 . 1 1 195 195 LYS N N 15 124.4 0.1 . 1 . . . . . . . . 4076 1 1682 . 1 1 195 195 LYS H H 1 7.58 0.007 . 1 . . . . . . . . 4076 1 1683 . 1 1 195 195 LYS CA C 13 57.4 0.5 . 1 . . . . . . . . 4076 1 1684 . 1 1 195 195 LYS HA H 1 4.15 0.06 . 1 . . . . . . . . 4076 1 1685 . 1 1 195 195 LYS CB C 13 33.3 0.5 . 1 . . . . . . . . 4076 1 1686 . 1 1 195 195 LYS HB2 H 1 1.49 0.06 . 2 . . . . . . . . 4076 1 1687 . 1 1 195 195 LYS HB3 H 1 1.75 0.06 . 2 . . . . . . . . 4076 1 1688 . 1 1 195 195 LYS CG C 13 27.0 0.5 . 1 . . . . . . . . 4076 1 1689 . 1 1 195 195 LYS CD C 13 29.8 0.5 . 1 . . . . . . . . 4076 1 1690 . 1 1 195 195 LYS CE C 13 39.3 0.5 . 1 . . . . . . . . 4076 1 1691 . 1 1 195 195 LYS C C 13 176.28 0.09 . 1 . . . . . . . . 4076 1 1692 . 1 1 196 196 LYS N N 15 130.3 0.1 . 1 . . . . . . . . 4076 1 1693 . 1 1 196 196 LYS H H 1 10.28 0.007 . 1 . . . . . . . . 4076 1 1694 . 1 1 196 196 LYS CA C 13 57.0 0.5 . 1 . . . . . . . . 4076 1 1695 . 1 1 196 196 LYS HA H 1 4.83 0.06 . 1 . . . . . . . . 4076 1 1696 . 1 1 196 196 LYS CB C 13 33.9 0.5 . 1 . . . . . . . . 4076 1 1697 . 1 1 196 196 LYS HB2 H 1 1.64 0.06 . 2 . . . . . . . . 4076 1 1698 . 1 1 196 196 LYS HB3 H 1 1.87 0.06 . 2 . . . . . . . . 4076 1 1699 . 1 1 196 196 LYS CG C 13 27.1 0.5 . 1 . . . . . . . . 4076 1 1700 . 1 1 196 196 LYS CD C 13 29.0 0.5 . 1 . . . . . . . . 4076 1 1701 . 1 1 196 196 LYS C C 13 176.27 0.09 . 1 . . . . . . . . 4076 1 1702 . 1 1 197 197 THR N N 15 113.1 0.1 . 1 . . . . . . . . 4076 1 1703 . 1 1 197 197 THR H H 1 8.56 0.007 . 1 . . . . . . . . 4076 1 1704 . 1 1 197 197 THR CA C 13 60.2 0.5 . 1 . . . . . . . . 4076 1 1705 . 1 1 197 197 THR HA H 1 4.57 0.06 . 1 . . . . . . . . 4076 1 1706 . 1 1 197 197 THR CB C 13 71.9 0.5 . 1 . . . . . . . . 4076 1 1707 . 1 1 197 197 THR HB H 1 4.22 0.06 . 1 . . . . . . . . 4076 1 1708 . 1 1 197 197 THR CG2 C 13 14.8 0.5 . 1 . . . . . . . . 4076 1 1709 . 1 1 197 197 THR C C 13 172.84 0.09 . 1 . . . . . . . . 4076 1 1710 . 1 1 198 198 ALA N N 15 122.6 0.1 . 1 . . . . . . . . 4076 1 1711 . 1 1 198 198 ALA H H 1 8.83 0.007 . 1 . . . . . . . . 4076 1 1712 . 1 1 198 198 ALA CA C 13 51.2 0.5 . 1 . . . . . . . . 4076 1 1713 . 1 1 198 198 ALA HA H 1 5.62 0.06 . 1 . . . . . . . . 4076 1 1714 . 1 1 198 198 ALA CB C 13 25.7 0.5 . 1 . . . . . . . . 4076 1 1715 . 1 1 198 198 ALA HB1 H 1 1.38 0.06 . 2 . . . . . . . . 4076 1 1716 . 1 1 198 198 ALA HB2 H 1 1.38 0.06 . 2 . . . . . . . . 4076 1 1717 . 1 1 198 198 ALA HB3 H 1 1.38 0.06 . 2 . . . . . . . . 4076 1 1718 . 1 1 198 198 ALA C C 13 175.46 0.09 . 1 . . . . . . . . 4076 1 1719 . 1 1 199 199 ALA N N 15 123.7 0.1 . 1 . . . . . . . . 4076 1 1720 . 1 1 199 199 ALA H H 1 8.25 0.007 . 1 . . . . . . . . 4076 1 1721 . 1 1 199 199 ALA CA C 13 50.8 0.5 . 1 . . . . . . . . 4076 1 1722 . 1 1 199 199 ALA HA H 1 4.89 0.06 . 1 . . . . . . . . 4076 1 1723 . 1 1 199 199 ALA CB C 13 22.3 0.5 . 1 . . . . . . . . 4076 1 1724 . 1 1 199 199 ALA HB1 H 1 1.43 0.06 . 2 . . . . . . . . 4076 1 1725 . 1 1 199 199 ALA HB2 H 1 1.43 0.06 . 2 . . . . . . . . 4076 1 1726 . 1 1 199 199 ALA HB3 H 1 1.43 0.06 . 2 . . . . . . . . 4076 1 1727 . 1 1 199 199 ALA C C 13 175.53 0.09 . 1 . . . . . . . . 4076 1 1728 . 1 1 200 200 TRP N N 15 125.6 0.1 . 1 . . . . . . . . 4076 1 1729 . 1 1 200 200 TRP H H 1 8.89 0.007 . 1 . . . . . . . . 4076 1 1730 . 1 1 200 200 TRP CA C 13 55.2 0.5 . 1 . . . . . . . . 4076 1 1731 . 1 1 200 200 TRP HA H 1 5.44 0.06 . 1 . . . . . . . . 4076 1 1732 . 1 1 200 200 TRP CB C 13 32.3 0.5 . 1 . . . . . . . . 4076 1 1733 . 1 1 200 200 TRP HB2 H 1 3.23 0.06 . 2 . . . . . . . . 4076 1 1734 . 1 1 200 200 TRP HB3 H 1 3.45 0.06 . 2 . . . . . . . . 4076 1 1735 . 1 1 200 200 TRP C C 13 174.54 0.09 . 1 . . . . . . . . 4076 1 1736 . 1 1 201 201 ASN N N 15 128.5 0.1 . 1 . . . . . . . . 4076 1 1737 . 1 1 201 201 ASN H H 1 8.13 0.007 . 1 . . . . . . . . 4076 1 1738 . 1 1 201 201 ASN CA C 13 51.0 0.5 . 1 . . . . . . . . 4076 1 1739 . 1 1 201 201 ASN HA H 1 4.76 0.06 . 1 . . . . . . . . 4076 1 1740 . 1 1 201 201 ASN CB C 13 39.5 0.5 . 1 . . . . . . . . 4076 1 1741 . 1 1 201 201 ASN HB2 H 1 2.41 0.06 . 2 . . . . . . . . 4076 1 1742 . 1 1 201 201 ASN HB3 H 1 2.41 0.06 . 2 . . . . . . . . 4076 1 1743 . 1 1 201 201 ASN C C 13 174.77 0.09 . 1 . . . . . . . . 4076 1 1744 . 1 1 202 202 SER N N 15 121.3 0.1 . 1 . . . . . . . . 4076 1 1745 . 1 1 202 202 SER H H 1 8.60 0.007 . 1 . . . . . . . . 4076 1 1746 . 1 1 202 202 SER CA C 13 60.8 0.5 . 1 . . . . . . . . 4076 1 1747 . 1 1 202 202 SER HA H 1 4.06 0.06 . 1 . . . . . . . . 4076 1 1748 . 1 1 202 202 SER CB C 13 63.3 0.5 . 1 . . . . . . . . 4076 1 1749 . 1 1 202 202 SER HB2 H 1 3.78 0.06 . 2 . . . . . . . . 4076 1 1750 . 1 1 202 202 SER HB3 H 1 3.78 0.06 . 2 . . . . . . . . 4076 1 1751 . 1 1 202 202 SER C C 13 176.69 0.09 . 1 . . . . . . . . 4076 1 1752 . 1 1 203 203 GLY N N 15 110.9 0.1 . 1 . . . . . . . . 4076 1 1753 . 1 1 203 203 GLY H H 1 8.35 0.007 . 1 . . . . . . . . 4076 1 1754 . 1 1 203 203 GLY CA C 13 46.6 0.5 . 1 . . . . . . . . 4076 1 1755 . 1 1 203 203 GLY HA2 H 1 3.96 0.06 . 2 . . . . . . . . 4076 1 1756 . 1 1 203 203 GLY HA3 H 1 3.96 0.06 . 2 . . . . . . . . 4076 1 1757 . 1 1 203 203 GLY C C 13 175.45 0.09 . 1 . . . . . . . . 4076 1 1758 . 1 1 204 204 THR N N 15 108.3 0.1 . 1 . . . . . . . . 4076 1 1759 . 1 1 204 204 THR H H 1 6.99 0.007 . 1 . . . . . . . . 4076 1 1760 . 1 1 204 204 THR CA C 13 60.2 0.5 . 1 . . . . . . . . 4076 1 1761 . 1 1 204 204 THR HA H 1 4.39 0.06 . 1 . . . . . . . . 4076 1 1762 . 1 1 204 204 THR CB C 13 69.5 0.5 . 1 . . . . . . . . 4076 1 1763 . 1 1 204 204 THR CG2 C 13 20.8 0.5 . 1 . . . . . . . . 4076 1 1764 . 1 1 204 204 THR C C 13 175.63 0.09 . 1 . . . . . . . . 4076 1 1765 . 1 1 205 205 SER N N 15 122.1 0.1 . 1 . . . . . . . . 4076 1 1766 . 1 1 205 205 SER H H 1 7.56 0.007 . 1 . . . . . . . . 4076 1 1767 . 1 1 205 205 SER CA C 13 59.2 0.5 . 1 . . . . . . . . 4076 1 1768 . 1 1 205 205 SER HA H 1 4.55 0.06 . 1 . . . . . . . . 4076 1 1769 . 1 1 205 205 SER CB C 13 62.6 0.5 . 1 . . . . . . . . 4076 1 1770 . 1 1 205 205 SER HB2 H 1 3.40 0.06 . 2 . . . . . . . . 4076 1 1771 . 1 1 205 205 SER HB3 H 1 3.96 0.06 . 2 . . . . . . . . 4076 1 1772 . 1 1 205 205 SER C C 13 172.23 0.09 . 1 . . . . . . . . 4076 1 1773 . 1 1 206 206 THR N N 15 111.4 0.1 . 1 . . . . . . . . 4076 1 1774 . 1 1 206 206 THR H H 1 6.64 0.007 . 1 . . . . . . . . 4076 1 1775 . 1 1 206 206 THR CA C 13 61.7 0.5 . 1 . . . . . . . . 4076 1 1776 . 1 1 206 206 THR HA H 1 5.13 0.06 . 1 . . . . . . . . 4076 1 1777 . 1 1 206 206 THR CB C 13 71.8 0.5 . 1 . . . . . . . . 4076 1 1778 . 1 1 206 206 THR HB H 1 3.62 0.06 . 1 . . . . . . . . 4076 1 1779 . 1 1 206 206 THR CG2 C 13 18.6 0.5 . 1 . . . . . . . . 4076 1 1780 . 1 1 206 206 THR C C 13 172.72 0.09 . 1 . . . . . . . . 4076 1 1781 . 1 1 207 207 LEU N N 15 134.3 0.1 . 1 . . . . . . . . 4076 1 1782 . 1 1 207 207 LEU H H 1 10.21 0.007 . 1 . . . . . . . . 4076 1 1783 . 1 1 207 207 LEU CA C 13 53.2 0.5 . 1 . . . . . . . . 4076 1 1784 . 1 1 207 207 LEU HA H 1 5.53 0.06 . 1 . . . . . . . . 4076 1 1785 . 1 1 207 207 LEU CB C 13 45.8 0.5 . 1 . . . . . . . . 4076 1 1786 . 1 1 207 207 LEU CG C 13 27.0 0.5 . 1 . . . . . . . . 4076 1 1787 . 1 1 207 207 LEU CD1 C 13 24.5 0.5 . 2 . . . . . . . . 4076 1 1788 . 1 1 207 207 LEU CD2 C 13 24.5 0.5 . 2 . . . . . . . . 4076 1 1789 . 1 1 207 207 LEU C C 13 175.31 0.09 . 1 . . . . . . . . 4076 1 1790 . 1 1 208 208 THR N N 15 127.2 0.1 . 1 . . . . . . . . 4076 1 1791 . 1 1 208 208 THR H H 1 9.15 0.007 . 1 . . . . . . . . 4076 1 1792 . 1 1 208 208 THR CA C 13 62.6 0.5 . 1 . . . . . . . . 4076 1 1793 . 1 1 208 208 THR HA H 1 5.60 0.06 . 1 . . . . . . . . 4076 1 1794 . 1 1 208 208 THR CB C 13 71.4 0.5 . 1 . . . . . . . . 4076 1 1795 . 1 1 208 208 THR HB H 1 3.82 0.06 . 1 . . . . . . . . 4076 1 1796 . 1 1 208 208 THR CG2 C 13 20.9 0.5 . 1 . . . . . . . . 4076 1 1797 . 1 1 208 208 THR C C 13 175.40 0.09 . 1 . . . . . . . . 4076 1 1798 . 1 1 209 209 ILE N N 15 132.8 0.1 . 1 . . . . . . . . 4076 1 1799 . 1 1 209 209 ILE H H 1 9.55 0.007 . 1 . . . . . . . . 4076 1 1800 . 1 1 209 209 ILE CA C 13 61.9 0.5 . 1 . . . . . . . . 4076 1 1801 . 1 1 209 209 ILE HA H 1 4.67 0.06 . 1 . . . . . . . . 4076 1 1802 . 1 1 209 209 ILE CB C 13 39.2 0.5 . 1 . . . . . . . . 4076 1 1803 . 1 1 209 209 ILE HB H 1 1.95 0.06 . 1 . . . . . . . . 4076 1 1804 . 1 1 209 209 ILE CG1 C 13 17.2 0.5 . 2 . . . . . . . . 4076 1 1805 . 1 1 209 209 ILE CD1 C 13 13.5 0.5 . 1 . . . . . . . . 4076 1 1806 . 1 1 209 209 ILE CG2 C 13 17.2 0.5 . 2 . . . . . . . . 4076 1 1807 . 1 1 209 209 ILE C C 13 174.21 0.09 . 1 . . . . . . . . 4076 1 1808 . 1 1 210 210 THR N N 15 125.5 0.1 . 1 . . . . . . . . 4076 1 1809 . 1 1 210 210 THR H H 1 9.15 0.007 . 1 . . . . . . . . 4076 1 1810 . 1 1 210 210 THR CA C 13 61.5 0.5 . 1 . . . . . . . . 4076 1 1811 . 1 1 210 210 THR HA H 1 5.00 0.06 . 1 . . . . . . . . 4076 1 1812 . 1 1 210 210 THR CB C 13 71.5 0.5 . 1 . . . . . . . . 4076 1 1813 . 1 1 210 210 THR HB H 1 3.62 0.06 . 1 . . . . . . . . 4076 1 1814 . 1 1 210 210 THR CG2 C 13 20.3 0.5 . 1 . . . . . . . . 4076 1 1815 . 1 1 210 210 THR C C 13 173.09 0.09 . 1 . . . . . . . . 4076 1 1816 . 1 1 211 211 VAL N N 15 124.8 0.1 . 1 . . . . . . . . 4076 1 1817 . 1 1 211 211 VAL H H 1 8.61 0.007 . 1 . . . . . . . . 4076 1 1818 . 1 1 211 211 VAL CA C 13 61.8 0.5 . 1 . . . . . . . . 4076 1 1819 . 1 1 211 211 VAL HA H 1 4.29 0.06 . 1 . . . . . . . . 4076 1 1820 . 1 1 211 211 VAL CB C 13 35.4 0.5 . 1 . . . . . . . . 4076 1 1821 . 1 1 211 211 VAL HB H 1 1.81 0.06 . 1 . . . . . . . . 4076 1 1822 . 1 1 211 211 VAL CG1 C 13 20.9 0.5 . 2 . . . . . . . . 4076 1 1823 . 1 1 211 211 VAL CG2 C 13 20.9 0.5 . 2 . . . . . . . . 4076 1 1824 . 1 1 211 211 VAL C C 13 177.12 0.09 . 1 . . . . . . . . 4076 1 1825 . 1 1 212 212 ASN N N 15 132.2 0.1 . 1 . . . . . . . . 4076 1 1826 . 1 1 212 212 ASN H H 1 10.13 0.007 . 1 . . . . . . . . 4076 1 1827 . 1 1 212 212 ASN CA C 13 53.6 0.5 . 1 . . . . . . . . 4076 1 1828 . 1 1 212 212 ASN HA H 1 4.33 0.06 . 1 . . . . . . . . 4076 1 1829 . 1 1 212 212 ASN CB C 13 36.9 0.5 . 1 . . . . . . . . 4076 1 1830 . 1 1 212 212 ASN HB2 H 1 2.77 0.06 . 2 . . . . . . . . 4076 1 1831 . 1 1 212 212 ASN HB3 H 1 3.24 0.06 . 2 . . . . . . . . 4076 1 1832 . 1 1 212 212 ASN C C 13 175.08 0.09 . 1 . . . . . . . . 4076 1 1833 . 1 1 213 213 SER N N 15 107.0 0.1 . 1 . . . . . . . . 4076 1 1834 . 1 1 213 213 SER H H 1 8.65 0.007 . 1 . . . . . . . . 4076 1 1835 . 1 1 213 213 SER CA C 13 60.7 0.5 . 1 . . . . . . . . 4076 1 1836 . 1 1 213 213 SER HA H 1 4.21 0.06 . 1 . . . . . . . . 4076 1 1837 . 1 1 213 213 SER CB C 13 62.6 0.5 . 1 . . . . . . . . 4076 1 1838 . 1 1 213 213 SER HB2 H 1 3.73 0.06 . 2 . . . . . . . . 4076 1 1839 . 1 1 213 213 SER HB3 H 1 4.00 0.06 . 2 . . . . . . . . 4076 1 1840 . 1 1 213 213 SER C C 13 172.78 0.09 . 1 . . . . . . . . 4076 1 1841 . 1 1 214 214 LYS N N 15 123.5 0.1 . 1 . . . . . . . . 4076 1 1842 . 1 1 214 214 LYS H H 1 7.82 0.007 . 1 . . . . . . . . 4076 1 1843 . 1 1 214 214 LYS CA C 13 54.7 0.5 . 1 . . . . . . . . 4076 1 1844 . 1 1 214 214 LYS HA H 1 4.62 0.06 . 1 . . . . . . . . 4076 1 1845 . 1 1 214 214 LYS CB C 13 34.9 0.5 . 1 . . . . . . . . 4076 1 1846 . 1 1 214 214 LYS HB2 H 1 1.64 0.06 . 2 . . . . . . . . 4076 1 1847 . 1 1 214 214 LYS HB3 H 1 1.64 0.06 . 2 . . . . . . . . 4076 1 1848 . 1 1 214 214 LYS CG C 13 24.5 0.5 . 1 . . . . . . . . 4076 1 1849 . 1 1 214 214 LYS CD C 13 29.2 0.5 . 1 . . . . . . . . 4076 1 1850 . 1 1 214 214 LYS CE C 13 42.4 0.5 . 1 . . . . . . . . 4076 1 1851 . 1 1 214 214 LYS C C 13 174.92 0.09 . 1 . . . . . . . . 4076 1 1852 . 1 1 215 215 LYS N N 15 126.8 0.1 . 1 . . . . . . . . 4076 1 1853 . 1 1 215 215 LYS H H 1 8.20 0.007 . 1 . . . . . . . . 4076 1 1854 . 1 1 215 215 LYS CA C 13 57.8 0.5 . 1 . . . . . . . . 4076 1 1855 . 1 1 215 215 LYS HA H 1 4.17 0.06 . 1 . . . . . . . . 4076 1 1856 . 1 1 215 215 LYS CB C 13 30.7 0.5 . 1 . . . . . . . . 4076 1 1857 . 1 1 215 215 LYS CD C 13 29.3 0.5 . 1 . . . . . . . . 4076 1 1858 . 1 1 215 215 LYS CE C 13 42.0 0.5 . 1 . . . . . . . . 4076 1 1859 . 1 1 215 215 LYS C C 13 176.71 0.09 . 1 . . . . . . . . 4076 1 1860 . 1 1 216 216 THR N N 15 113.1 0.1 . 1 . . . . . . . . 4076 1 1861 . 1 1 216 216 THR H H 1 9.17 0.007 . 1 . . . . . . . . 4076 1 1862 . 1 1 216 216 THR CA C 13 62.8 0.5 . 1 . . . . . . . . 4076 1 1863 . 1 1 216 216 THR HA H 1 4.71 0.06 . 1 . . . . . . . . 4076 1 1864 . 1 1 216 216 THR CB C 13 69.3 0.5 . 1 . . . . . . . . 4076 1 1865 . 1 1 216 216 THR HB H 1 4.17 0.06 . 1 . . . . . . . . 4076 1 1866 . 1 1 216 216 THR CG2 C 13 22.3 0.5 . 1 . . . . . . . . 4076 1 1867 . 1 1 216 216 THR C C 13 176.88 0.09 . 1 . . . . . . . . 4076 1 1868 . 1 1 217 217 LYS N N 15 121.3 0.1 . 1 . . . . . . . . 4076 1 1869 . 1 1 217 217 LYS H H 1 7.57 0.007 . 1 . . . . . . . . 4076 1 1870 . 1 1 217 217 LYS CA C 13 56.0 0.5 . 1 . . . . . . . . 4076 1 1871 . 1 1 217 217 LYS HA H 1 5.46 0.06 . 1 . . . . . . . . 4076 1 1872 . 1 1 217 217 LYS CB C 13 36.7 0.5 . 1 . . . . . . . . 4076 1 1873 . 1 1 217 217 LYS HB2 H 1 1.65 0.06 . 2 . . . . . . . . 4076 1 1874 . 1 1 217 217 LYS HB3 H 1 2.03 0.06 . 2 . . . . . . . . 4076 1 1875 . 1 1 217 217 LYS CG C 13 24.3 0.5 . 1 . . . . . . . . 4076 1 1876 . 1 1 217 217 LYS CD C 13 29.2 0.5 . 1 . . . . . . . . 4076 1 1877 . 1 1 217 217 LYS CE C 13 42.3 0.5 . 1 . . . . . . . . 4076 1 1878 . 1 1 217 217 LYS C C 13 173.47 0.09 . 1 . . . . . . . . 4076 1 1879 . 1 1 218 218 ASP N N 15 121.8 0.1 . 1 . . . . . . . . 4076 1 1880 . 1 1 218 218 ASP H H 1 8.95 0.007 . 1 . . . . . . . . 4076 1 1881 . 1 1 218 218 ASP CA C 13 53.2 0.5 . 1 . . . . . . . . 4076 1 1882 . 1 1 218 218 ASP HA H 1 5.85 0.06 . 1 . . . . . . . . 4076 1 1883 . 1 1 218 218 ASP CB C 13 43.4 0.5 . 1 . . . . . . . . 4076 1 1884 . 1 1 218 218 ASP HB2 H 1 2.21 0.06 . 2 . . . . . . . . 4076 1 1885 . 1 1 218 218 ASP HB3 H 1 2.38 0.06 . 2 . . . . . . . . 4076 1 1886 . 1 1 218 218 ASP C C 13 176.42 0.09 . 1 . . . . . . . . 4076 1 1887 . 1 1 219 219 LEU N N 15 126.3 0.1 . 1 . . . . . . . . 4076 1 1888 . 1 1 219 219 LEU H H 1 9.61 0.007 . 1 . . . . . . . . 4076 1 1889 . 1 1 219 219 LEU CA C 13 54.0 0.5 . 1 . . . . . . . . 4076 1 1890 . 1 1 219 219 LEU HA H 1 5.63 0.06 . 1 . . . . . . . . 4076 1 1891 . 1 1 219 219 LEU CB C 13 44.6 0.5 . 1 . . . . . . . . 4076 1 1892 . 1 1 219 219 LEU HB2 H 1 1.53 0.06 . 2 . . . . . . . . 4076 1 1893 . 1 1 219 219 LEU HB3 H 1 2.03 0.06 . 2 . . . . . . . . 4076 1 1894 . 1 1 219 219 LEU CG C 13 28.9 0.5 . 1 . . . . . . . . 4076 1 1895 . 1 1 219 219 LEU CD1 C 13 25.3 0.5 . 2 . . . . . . . . 4076 1 1896 . 1 1 219 219 LEU CD2 C 13 25.3 0.5 . 2 . . . . . . . . 4076 1 1897 . 1 1 219 219 LEU C C 13 175.16 0.09 . 1 . . . . . . . . 4076 1 1898 . 1 1 220 220 VAL N N 15 126.3 0.1 . 1 . . . . . . . . 4076 1 1899 . 1 1 220 220 VAL H H 1 8.69 0.007 . 1 . . . . . . . . 4076 1 1900 . 1 1 220 220 VAL CA C 13 61.7 0.5 . 1 . . . . . . . . 4076 1 1901 . 1 1 220 220 VAL HA H 1 4.72 0.06 . 1 . . . . . . . . 4076 1 1902 . 1 1 220 220 VAL CB C 13 32.1 0.5 . 1 . . . . . . . . 4076 1 1903 . 1 1 220 220 VAL HB H 1 2.23 0.06 . 1 . . . . . . . . 4076 1 1904 . 1 1 220 220 VAL CG1 C 13 20.9 0.5 . 2 . . . . . . . . 4076 1 1905 . 1 1 220 220 VAL CG2 C 13 20.9 0.5 . 2 . . . . . . . . 4076 1 1906 . 1 1 220 220 VAL C C 13 174.75 0.09 . 1 . . . . . . . . 4076 1 1907 . 1 1 221 221 PHE N N 15 129.2 0.1 . 1 . . . . . . . . 4076 1 1908 . 1 1 221 221 PHE H H 1 8.71 0.007 . 1 . . . . . . . . 4076 1 1909 . 1 1 221 221 PHE CA C 13 56.8 0.5 . 1 . . . . . . . . 4076 1 1910 . 1 1 221 221 PHE HA H 1 4.91 0.06 . 1 . . . . . . . . 4076 1 1911 . 1 1 221 221 PHE CB C 13 38.1 0.5 . 1 . . . . . . . . 4076 1 1912 . 1 1 221 221 PHE HB2 H 1 3.29 0.06 . 2 . . . . . . . . 4076 1 1913 . 1 1 221 221 PHE HB3 H 1 3.18 0.06 . 2 . . . . . . . . 4076 1 1914 . 1 1 221 221 PHE C C 13 176.69 0.09 . 1 . . . . . . . . 4076 1 1915 . 1 1 222 222 THR N N 15 114.7 0.1 . 1 . . . . . . . . 4076 1 1916 . 1 1 222 222 THR H H 1 8.53 0.007 . 1 . . . . . . . . 4076 1 1917 . 1 1 222 222 THR CA C 13 62.0 0.5 . 1 . . . . . . . . 4076 1 1918 . 1 1 222 222 THR HA H 1 4.66 0.06 . 1 . . . . . . . . 4076 1 1919 . 1 1 222 222 THR CB C 13 71.4 0.5 . 1 . . . . . . . . 4076 1 1920 . 1 1 222 222 THR HB H 1 4.36 0.06 . 1 . . . . . . . . 4076 1 1921 . 1 1 222 222 THR CG2 C 13 18.5 0.5 . 1 . . . . . . . . 4076 1 1922 . 1 1 222 222 THR C C 13 177.57 0.09 . 1 . . . . . . . . 4076 1 1923 . 1 1 223 223 LYS N N 15 121.8 0.1 . 1 . . . . . . . . 4076 1 1924 . 1 1 223 223 LYS H H 1 8.90 0.007 . 1 . . . . . . . . 4076 1 1925 . 1 1 223 223 LYS CA C 13 57.7 0.5 . 1 . . . . . . . . 4076 1 1926 . 1 1 223 223 LYS HA H 1 4.29 0.06 . 1 . . . . . . . . 4076 1 1927 . 1 1 223 223 LYS CB C 13 31.7 0.5 . 1 . . . . . . . . 4076 1 1928 . 1 1 223 223 LYS HB2 H 1 1.93 0.06 . 2 . . . . . . . . 4076 1 1929 . 1 1 223 223 LYS HB3 H 1 1.93 0.06 . 2 . . . . . . . . 4076 1 1930 . 1 1 223 223 LYS CG C 13 24.8 0.5 . 1 . . . . . . . . 4076 1 1931 . 1 1 223 223 LYS CD C 13 28.9 0.5 . 1 . . . . . . . . 4076 1 1932 . 1 1 223 223 LYS CE C 13 42.4 0.5 . 1 . . . . . . . . 4076 1 1933 . 1 1 223 223 LYS C C 13 176.91 0.09 . 1 . . . . . . . . 4076 1 1934 . 1 1 224 224 GLU N N 15 118.4 0.1 . 1 . . . . . . . . 4076 1 1935 . 1 1 224 224 GLU H H 1 7.58 0.007 . 1 . . . . . . . . 4076 1 1936 . 1 1 224 224 GLU CA C 13 56.3 0.5 . 1 . . . . . . . . 4076 1 1937 . 1 1 224 224 GLU HA H 1 4.48 0.06 . 1 . . . . . . . . 4076 1 1938 . 1 1 224 224 GLU CB C 13 28.4 0.5 . 1 . . . . . . . . 4076 1 1939 . 1 1 224 224 GLU HB2 H 1 1.91 0.06 . 2 . . . . . . . . 4076 1 1940 . 1 1 224 224 GLU HB3 H 1 2.24 0.06 . 2 . . . . . . . . 4076 1 1941 . 1 1 224 224 GLU CG C 13 36.8 0.5 . 1 . . . . . . . . 4076 1 1942 . 1 1 224 224 GLU C C 13 174.15 0.09 . 1 . . . . . . . . 4076 1 1943 . 1 1 225 225 ASN N N 15 112.3 0.1 . 1 . . . . . . . . 4076 1 1944 . 1 1 225 225 ASN H H 1 7.78 0.007 . 1 . . . . . . . . 4076 1 1945 . 1 1 225 225 ASN CA C 13 55.7 0.5 . 1 . . . . . . . . 4076 1 1946 . 1 1 225 225 ASN HA H 1 4.43 0.06 . 1 . . . . . . . . 4076 1 1947 . 1 1 225 225 ASN CB C 13 36.6 0.5 . 1 . . . . . . . . 4076 1 1948 . 1 1 225 225 ASN HB2 H 1 2.62 0.06 . 2 . . . . . . . . 4076 1 1949 . 1 1 225 225 ASN HB3 H 1 3.11 0.06 . 2 . . . . . . . . 4076 1 1950 . 1 1 225 225 ASN C C 13 174.20 0.09 . 1 . . . . . . . . 4076 1 1951 . 1 1 226 226 THR N N 15 108.3 0.1 . 1 . . . . . . . . 4076 1 1952 . 1 1 226 226 THR H H 1 7.33 0.007 . 1 . . . . . . . . 4076 1 1953 . 1 1 226 226 THR CA C 13 58.9 0.5 . 1 . . . . . . . . 4076 1 1954 . 1 1 226 226 THR HA H 1 4.65 0.06 . 1 . . . . . . . . 4076 1 1955 . 1 1 226 226 THR CB C 13 72.4 0.5 . 1 . . . . . . . . 4076 1 1956 . 1 1 226 226 THR HB H 1 4.32 0.06 . 1 . . . . . . . . 4076 1 1957 . 1 1 226 226 THR C C 13 173.24 0.09 . 1 . . . . . . . . 4076 1 1958 . 1 1 227 227 ILE N N 15 122.4 0.1 . 1 . . . . . . . . 4076 1 1959 . 1 1 227 227 ILE H H 1 8.40 0.007 . 1 . . . . . . . . 4076 1 1960 . 1 1 227 227 ILE CA C 13 59.8 0.5 . 1 . . . . . . . . 4076 1 1961 . 1 1 227 227 ILE HA H 1 5.26 0.06 . 1 . . . . . . . . 4076 1 1962 . 1 1 227 227 ILE CB C 13 41.3 0.5 . 1 . . . . . . . . 4076 1 1963 . 1 1 227 227 ILE HB H 1 1.19 0.06 . 1 . . . . . . . . 4076 1 1964 . 1 1 227 227 ILE CG1 C 13 27.1 0.5 . 2 . . . . . . . . 4076 1 1965 . 1 1 227 227 ILE CD1 C 13 17.1 0.5 . 1 . . . . . . . . 4076 1 1966 . 1 1 227 227 ILE C C 13 175.91 0.09 . 1 . . . . . . . . 4076 1 1967 . 1 1 228 228 THR N N 15 117.3 0.1 . 1 . . . . . . . . 4076 1 1968 . 1 1 228 228 THR H H 1 8.97 0.007 . 1 . . . . . . . . 4076 1 1969 . 1 1 228 228 THR CA C 13 58.9 0.5 . 1 . . . . . . . . 4076 1 1970 . 1 1 228 228 THR HA H 1 5.42 0.06 . 1 . . . . . . . . 4076 1 1971 . 1 1 228 228 THR CB C 13 71.5 0.5 . 1 . . . . . . . . 4076 1 1972 . 1 1 228 228 THR HB H 1 5.21 0.06 . 1 . . . . . . . . 4076 1 1973 . 1 1 228 228 THR CG2 C 13 18.0 0.5 . 1 . . . . . . . . 4076 1 1974 . 1 1 228 228 THR C C 13 173.22 0.09 . 1 . . . . . . . . 4076 1 1975 . 1 1 229 229 VAL N N 15 120.9 0.1 . 1 . . . . . . . . 4076 1 1976 . 1 1 229 229 VAL H H 1 9.03 0.007 . 1 . . . . . . . . 4076 1 1977 . 1 1 229 229 VAL CA C 13 59.5 0.5 . 1 . . . . . . . . 4076 1 1978 . 1 1 229 229 VAL HA H 1 5.31 0.06 . 1 . . . . . . . . 4076 1 1979 . 1 1 229 229 VAL CB C 13 35.6 0.5 . 1 . . . . . . . . 4076 1 1980 . 1 1 229 229 VAL HB H 1 1.81 0.06 . 1 . . . . . . . . 4076 1 1981 . 1 1 229 229 VAL CG1 C 13 19.5 0.5 . 2 . . . . . . . . 4076 1 1982 . 1 1 229 229 VAL CG2 C 13 19.5 0.5 . 2 . . . . . . . . 4076 1 1983 . 1 1 229 229 VAL C C 13 173.84 0.09 . 1 . . . . . . . . 4076 1 1984 . 1 1 230 230 GLN N N 15 129.0 0.1 . 1 . . . . . . . . 4076 1 1985 . 1 1 230 230 GLN H H 1 8.47 0.007 . 1 . . . . . . . . 4076 1 1986 . 1 1 230 230 GLN CA C 13 55.6 0.5 . 1 . . . . . . . . 4076 1 1987 . 1 1 230 230 GLN HA H 1 4.61 0.06 . 1 . . . . . . . . 4076 1 1988 . 1 1 230 230 GLN CB C 13 31.6 0.5 . 1 . . . . . . . . 4076 1 1989 . 1 1 230 230 GLN HB2 H 1 1.77 0.06 . 2 . . . . . . . . 4076 1 1990 . 1 1 230 230 GLN HB3 H 1 1.77 0.06 . 2 . . . . . . . . 4076 1 1991 . 1 1 230 230 GLN CG C 13 33.5 0.5 . 1 . . . . . . . . 4076 1 1992 . 1 1 230 230 GLN C C 13 173.49 0.09 . 1 . . . . . . . . 4076 1 1993 . 1 1 231 231 GLN N N 15 125.8 0.1 . 1 . . . . . . . . 4076 1 1994 . 1 1 231 231 GLN H H 1 8.78 0.007 . 1 . . . . . . . . 4076 1 1995 . 1 1 231 231 GLN CA C 13 55.4 0.5 . 1 . . . . . . . . 4076 1 1996 . 1 1 231 231 GLN HA H 1 4.94 0.06 . 1 . . . . . . . . 4076 1 1997 . 1 1 231 231 GLN CB C 13 31.1 0.5 . 1 . . . . . . . . 4076 1 1998 . 1 1 231 231 GLN HB2 H 1 2.14 0.06 . 2 . . . . . . . . 4076 1 1999 . 1 1 231 231 GLN HB3 H 1 2.40 0.06 . 2 . . . . . . . . 4076 1 2000 . 1 1 231 231 GLN CG C 13 34.6 0.5 . 1 . . . . . . . . 4076 1 2001 . 1 1 231 231 GLN C C 13 175.25 0.09 . 1 . . . . . . . . 4076 1 2002 . 1 1 232 232 TYR N N 15 120.0 0.1 . 1 . . . . . . . . 4076 1 2003 . 1 1 232 232 TYR H H 1 7.57 0.007 . 1 . . . . . . . . 4076 1 2004 . 1 1 232 232 TYR CA C 13 58.3 0.5 . 1 . . . . . . . . 4076 1 2005 . 1 1 232 232 TYR HA H 1 4.88 0.06 . 1 . . . . . . . . 4076 1 2006 . 1 1 232 232 TYR CB C 13 41.5 0.5 . 1 . . . . . . . . 4076 1 2007 . 1 1 232 232 TYR HB2 H 1 2.81 0.06 . 2 . . . . . . . . 4076 1 2008 . 1 1 232 232 TYR HB3 H 1 2.81 0.06 . 2 . . . . . . . . 4076 1 2009 . 1 1 233 233 ASP N N 15 119.2 0.1 . 1 . . . . . . . . 4076 1 2010 . 1 1 233 233 ASP H H 1 8.86 0.007 . 1 . . . . . . . . 4076 1 2011 . 1 1 233 233 ASP CA C 13 53.6 0.5 . 1 . . . . . . . . 4076 1 2012 . 1 1 233 233 ASP HA H 1 4.60 0.06 . 1 . . . . . . . . 4076 1 2013 . 1 1 233 233 ASP CB C 13 41.4 0.5 . 1 . . . . . . . . 4076 1 2014 . 1 1 233 233 ASP C C 13 177.41 0.09 . 1 . . . . . . . . 4076 1 2015 . 1 1 234 234 SER N N 15 116.8 0.1 . 1 . . . . . . . . 4076 1 2016 . 1 1 234 234 SER H H 1 8.73 0.007 . 1 . . . . . . . . 4076 1 2017 . 1 1 234 234 SER CA C 13 61.6 0.5 . 1 . . . . . . . . 4076 1 2018 . 1 1 234 234 SER HA H 1 4.16 0.06 . 1 . . . . . . . . 4076 1 2019 . 1 1 234 234 SER CB C 13 63.1 0.5 . 1 . . . . . . . . 4076 1 2020 . 1 1 234 234 SER HB2 H 1 3.96 0.06 . 2 . . . . . . . . 4076 1 2021 . 1 1 234 234 SER HB3 H 1 3.96 0.06 . 2 . . . . . . . . 4076 1 2022 . 1 1 234 234 SER C C 13 175.09 0.09 . 1 . . . . . . . . 4076 1 2023 . 1 1 235 235 ASN N N 15 117.6 0.1 . 1 . . . . . . . . 4076 1 2024 . 1 1 235 235 ASN H H 1 7.91 0.007 . 1 . . . . . . . . 4076 1 2025 . 1 1 235 235 ASN CA C 13 53.4 0.5 . 1 . . . . . . . . 4076 1 2026 . 1 1 235 235 ASN HA H 1 4.83 0.06 . 1 . . . . . . . . 4076 1 2027 . 1 1 235 235 ASN CB C 13 39.5 0.5 . 1 . . . . . . . . 4076 1 2028 . 1 1 235 235 ASN HB2 H 1 2.90 0.06 . 2 . . . . . . . . 4076 1 2029 . 1 1 235 235 ASN HB3 H 1 2.90 0.06 . 2 . . . . . . . . 4076 1 2030 . 1 1 235 235 ASN C C 13 175.89 0.09 . 1 . . . . . . . . 4076 1 2031 . 1 1 236 236 GLY N N 15 111.3 0.1 . 1 . . . . . . . . 4076 1 2032 . 1 1 236 236 GLY H H 1 8.39 0.007 . 1 . . . . . . . . 4076 1 2033 . 1 1 236 236 GLY CA C 13 46.8 0.5 . 1 . . . . . . . . 4076 1 2034 . 1 1 236 236 GLY HA2 H 1 4.03 0.06 . 2 . . . . . . . . 4076 1 2035 . 1 1 236 236 GLY HA3 H 1 4.03 0.06 . 2 . . . . . . . . 4076 1 2036 . 1 1 236 236 GLY C C 13 174.82 0.09 . 1 . . . . . . . . 4076 1 2037 . 1 1 237 237 THR N N 15 114.7 0.1 . 1 . . . . . . . . 4076 1 2038 . 1 1 237 237 THR H H 1 9.34 0.007 . 1 . . . . . . . . 4076 1 2039 . 1 1 237 237 THR CA C 13 63.4 0.5 . 1 . . . . . . . . 4076 1 2040 . 1 1 237 237 THR HA H 1 4.48 0.06 . 1 . . . . . . . . 4076 1 2041 . 1 1 237 237 THR CB C 13 70.2 0.5 . 1 . . . . . . . . 4076 1 2042 . 1 1 237 237 THR HB H 1 4.33 0.06 . 1 . . . . . . . . 4076 1 2043 . 1 1 237 237 THR CG2 C 13 21.3 0.5 . 1 . . . . . . . . 4076 1 2044 . 1 1 237 237 THR C C 13 174.64 0.09 . 1 . . . . . . . . 4076 1 2045 . 1 1 238 238 LYS N N 15 123.4 0.1 . 1 . . . . . . . . 4076 1 2046 . 1 1 238 238 LYS H H 1 8.39 0.007 . 1 . . . . . . . . 4076 1 2047 . 1 1 238 238 LYS CA C 13 55.0 0.5 . 1 . . . . . . . . 4076 1 2048 . 1 1 238 238 LYS HA H 1 4.66 0.06 . 1 . . . . . . . . 4076 1 2049 . 1 1 238 238 LYS CB C 13 35.2 0.5 . 1 . . . . . . . . 4076 1 2050 . 1 1 238 238 LYS HB2 H 1 1.77 0.06 . 2 . . . . . . . . 4076 1 2051 . 1 1 238 238 LYS HB3 H 1 1.77 0.06 . 2 . . . . . . . . 4076 1 2052 . 1 1 238 238 LYS CG C 13 23.6 0.5 . 1 . . . . . . . . 4076 1 2053 . 1 1 238 238 LYS CD C 13 29.2 0.5 . 1 . . . . . . . . 4076 1 2054 . 1 1 238 238 LYS CE C 13 42.2 0.5 . 1 . . . . . . . . 4076 1 2055 . 1 1 238 238 LYS C C 13 174.44 0.09 . 1 . . . . . . . . 4076 1 2056 . 1 1 239 239 LEU N N 15 124.2 0.1 . 1 . . . . . . . . 4076 1 2057 . 1 1 239 239 LEU H H 1 8.05 0.007 . 1 . . . . . . . . 4076 1 2058 . 1 1 239 239 LEU CA C 13 55.2 0.5 . 1 . . . . . . . . 4076 1 2059 . 1 1 239 239 LEU HA H 1 3.90 0.06 . 1 . . . . . . . . 4076 1 2060 . 1 1 239 239 LEU CB C 13 42.7 0.5 . 1 . . . . . . . . 4076 1 2061 . 1 1 239 239 LEU HB2 H 1 1.35 0.06 . 2 . . . . . . . . 4076 1 2062 . 1 1 239 239 LEU HB3 H 1 1.35 0.06 . 2 . . . . . . . . 4076 1 2063 . 1 1 239 239 LEU CG C 13 27.0 0.5 . 1 . . . . . . . . 4076 1 2064 . 1 1 239 239 LEU CD1 C 13 25.5 0.5 . 2 . . . . . . . . 4076 1 2065 . 1 1 239 239 LEU CD2 C 13 25.5 0.5 . 2 . . . . . . . . 4076 1 2066 . 1 1 239 239 LEU C C 13 177.05 0.09 . 1 . . . . . . . . 4076 1 2067 . 1 1 240 240 GLU N N 15 122.9 0.1 . 1 . . . . . . . . 4076 1 2068 . 1 1 240 240 GLU H H 1 8.62 0.007 . 1 . . . . . . . . 4076 1 2069 . 1 1 240 240 GLU CA C 13 54.7 0.5 . 1 . . . . . . . . 4076 1 2070 . 1 1 240 240 GLU HA H 1 4.61 0.06 . 1 . . . . . . . . 4076 1 2071 . 1 1 240 240 GLU CB C 13 33.1 0.5 . 1 . . . . . . . . 4076 1 2072 . 1 1 240 240 GLU HB2 H 1 1.76 0.06 . 2 . . . . . . . . 4076 1 2073 . 1 1 240 240 GLU HB3 H 1 1.87 0.06 . 2 . . . . . . . . 4076 1 2074 . 1 1 240 240 GLU CG C 13 35.9 0.5 . 1 . . . . . . . . 4076 1 2075 . 1 1 240 240 GLU HG2 H 1 2.09 0.06 . 2 . . . . . . . . 4076 1 2076 . 1 1 240 240 GLU HG3 H 1 2.09 0.06 . 2 . . . . . . . . 4076 1 2077 . 1 1 240 240 GLU C C 13 177.71 0.09 . 1 . . . . . . . . 4076 1 2078 . 1 1 241 241 GLY N N 15 113.0 0.1 . 1 . . . . . . . . 4076 1 2079 . 1 1 241 241 GLY H H 1 8.69 0.007 . 1 . . . . . . . . 4076 1 2080 . 1 1 241 241 GLY CA C 13 46.5 0.5 . 1 . . . . . . . . 4076 1 2081 . 1 1 241 241 GLY HA2 H 1 3.79 0.06 . 2 . . . . . . . . 4076 1 2082 . 1 1 241 241 GLY HA3 H 1 3.96 0.06 . 2 . . . . . . . . 4076 1 2083 . 1 1 241 241 GLY C C 13 173.60 0.09 . 1 . . . . . . . . 4076 1 2084 . 1 1 242 242 SER N N 15 118.6 0.1 . 1 . . . . . . . . 4076 1 2085 . 1 1 242 242 SER H H 1 8.12 0.007 . 1 . . . . . . . . 4076 1 2086 . 1 1 242 242 SER CA C 13 57.0 0.5 . 1 . . . . . . . . 4076 1 2087 . 1 1 242 242 SER HA H 1 4.70 0.06 . 1 . . . . . . . . 4076 1 2088 . 1 1 242 242 SER CB C 13 65.5 0.5 . 1 . . . . . . . . 4076 1 2089 . 1 1 242 242 SER HB2 H 1 3.66 0.06 . 2 . . . . . . . . 4076 1 2090 . 1 1 242 242 SER HB3 H 1 3.81 0.06 . 2 . . . . . . . . 4076 1 2091 . 1 1 242 242 SER C C 13 173.14 0.09 . 1 . . . . . . . . 4076 1 2092 . 1 1 243 243 ALA N N 15 126.9 0.1 . 1 . . . . . . . . 4076 1 2093 . 1 1 243 243 ALA H H 1 8.44 0.007 . 1 . . . . . . . . 4076 1 2094 . 1 1 243 243 ALA CA C 13 52.3 0.5 . 1 . . . . . . . . 4076 1 2095 . 1 1 243 243 ALA HA H 1 4.43 0.06 . 1 . . . . . . . . 4076 1 2096 . 1 1 243 243 ALA CB C 13 18.7 0.5 . 1 . . . . . . . . 4076 1 2097 . 1 1 243 243 ALA HB1 H 1 1.21 0.06 . 1 . . . . . . . . 4076 1 2098 . 1 1 243 243 ALA HB2 H 1 1.21 0.06 . 1 . . . . . . . . 4076 1 2099 . 1 1 243 243 ALA HB3 H 1 1.21 0.06 . 1 . . . . . . . . 4076 1 2100 . 1 1 243 243 ALA C C 13 177.42 0.09 . 1 . . . . . . . . 4076 1 2101 . 1 1 244 244 VAL N N 15 123.7 0.1 . 1 . . . . . . . . 4076 1 2102 . 1 1 244 244 VAL H H 1 8.64 0.007 . 1 . . . . . . . . 4076 1 2103 . 1 1 244 244 VAL CA C 13 61.1 0.5 . 1 . . . . . . . . 4076 1 2104 . 1 1 244 244 VAL HA H 1 4.32 0.06 . 1 . . . . . . . . 4076 1 2105 . 1 1 244 244 VAL CB C 13 34.9 0.5 . 1 . . . . . . . . 4076 1 2106 . 1 1 244 244 VAL HB H 1 2.00 0.06 . 1 . . . . . . . . 4076 1 2107 . 1 1 244 244 VAL CG1 C 13 20.7 0.5 . 2 . . . . . . . . 4076 1 2108 . 1 1 244 244 VAL CG2 C 13 20.7 0.5 . 2 . . . . . . . . 4076 1 2109 . 1 1 244 244 VAL C C 13 175.10 0.09 . 1 . . . . . . . . 4076 1 2110 . 1 1 245 245 GLU N N 15 127.9 0.1 . 1 . . . . . . . . 4076 1 2111 . 1 1 245 245 GLU H H 1 8.54 0.007 . 1 . . . . . . . . 4076 1 2112 . 1 1 245 245 GLU CA C 13 56.8 0.5 . 1 . . . . . . . . 4076 1 2113 . 1 1 245 245 GLU HA H 1 4.40 0.06 . 1 . . . . . . . . 4076 1 2114 . 1 1 245 245 GLU CB C 13 31.0 0.5 . 1 . . . . . . . . 4076 1 2115 . 1 1 245 245 GLU HB2 H 1 1.51 0.06 . 2 . . . . . . . . 4076 1 2116 . 1 1 245 245 GLU HB3 H 1 1.94 0.06 . 2 . . . . . . . . 4076 1 2117 . 1 1 245 245 GLU CG C 13 36.7 0.5 . 1 . . . . . . . . 4076 1 2118 . 1 1 245 245 GLU C C 13 176.29 0.09 . 1 . . . . . . . . 4076 1 2119 . 1 1 246 246 ILE N N 15 129.3 0.1 . 1 . . . . . . . . 4076 1 2120 . 1 1 246 246 ILE H H 1 8.86 0.007 . 1 . . . . . . . . 4076 1 2121 . 1 1 246 246 ILE CA C 13 61.2 0.5 . 1 . . . . . . . . 4076 1 2122 . 1 1 246 246 ILE HA H 1 4.06 0.06 . 1 . . . . . . . . 4076 1 2123 . 1 1 246 246 ILE CB C 13 37.5 0.5 . 1 . . . . . . . . 4076 1 2124 . 1 1 246 246 ILE HB H 1 1.86 0.06 . 1 . . . . . . . . 4076 1 2125 . 1 1 246 246 ILE CG2 C 13 18.0 0.5 . 2 . . . . . . . . 4076 1 2126 . 1 1 246 246 ILE C C 13 177.12 0.09 . 1 . . . . . . . . 4076 1 2127 . 1 1 247 247 THR N N 15 118.4 0.1 . 1 . . . . . . . . 4076 1 2128 . 1 1 247 247 THR H H 1 9.37 0.007 . 1 . . . . . . . . 4076 1 2129 . 1 1 247 247 THR CA C 13 61.7 0.5 . 1 . . . . . . . . 4076 1 2130 . 1 1 247 247 THR HA H 1 4.86 0.06 . 1 . . . . . . . . 4076 1 2131 . 1 1 247 247 THR CB C 13 71.2 0.5 . 1 . . . . . . . . 4076 1 2132 . 1 1 247 247 THR HB H 1 4.50 0.06 . 1 . . . . . . . . 4076 1 2133 . 1 1 247 247 THR CG2 C 13 21.0 0.5 . 1 . . . . . . . . 4076 1 2134 . 1 1 247 247 THR C C 13 173.25 0.09 . 1 . . . . . . . . 4076 1 2135 . 1 1 248 248 LYS N N 15 118.1 0.1 . 1 . . . . . . . . 4076 1 2136 . 1 1 248 248 LYS H H 1 7.27 0.007 . 1 . . . . . . . . 4076 1 2137 . 1 1 248 248 LYS CA C 13 54.6 0.5 . 1 . . . . . . . . 4076 1 2138 . 1 1 248 248 LYS HA H 1 4.74 0.06 . 1 . . . . . . . . 4076 1 2139 . 1 1 248 248 LYS CB C 13 36.1 0.5 . 1 . . . . . . . . 4076 1 2140 . 1 1 248 248 LYS HB2 H 1 1.69 0.06 . 2 . . . . . . . . 4076 1 2141 . 1 1 248 248 LYS HB3 H 1 2.12 0.06 . 2 . . . . . . . . 4076 1 2142 . 1 1 248 248 LYS CG C 13 23.8 0.5 . 1 . . . . . . . . 4076 1 2143 . 1 1 248 248 LYS CD C 13 29.2 0.5 . 1 . . . . . . . . 4076 1 2144 . 1 1 248 248 LYS CE C 13 42.0 0.5 . 1 . . . . . . . . 4076 1 2145 . 1 1 248 248 LYS C C 13 176.43 0.09 . 1 . . . . . . . . 4076 1 2146 . 1 1 249 249 LEU N N 15 126.0 0.1 . 1 . . . . . . . . 4076 1 2147 . 1 1 249 249 LEU H H 1 8.93 0.007 . 1 . . . . . . . . 4076 1 2148 . 1 1 249 249 LEU CA C 13 58.0 0.5 . 1 . . . . . . . . 4076 1 2149 . 1 1 249 249 LEU HA H 1 3.61 0.06 . 1 . . . . . . . . 4076 1 2150 . 1 1 249 249 LEU CB C 13 42.0 0.5 . 1 . . . . . . . . 4076 1 2151 . 1 1 249 249 LEU HB2 H 1 1.75 0.06 . 2 . . . . . . . . 4076 1 2152 . 1 1 249 249 LEU HB3 H 1 1.90 0.06 . 2 . . . . . . . . 4076 1 2153 . 1 1 249 249 LEU CG C 13 25.7 0.5 . 1 . . . . . . . . 4076 1 2154 . 1 1 249 249 LEU CD1 C 13 27.5 0.5 . 2 . . . . . . . . 4076 1 2155 . 1 1 249 249 LEU CD2 C 13 23.7 0.5 . 2 . . . . . . . . 4076 1 2156 . 1 1 249 249 LEU C C 13 179.43 0.09 . 1 . . . . . . . . 4076 1 2157 . 1 1 250 250 ASP N N 15 116.3 0.1 . 1 . . . . . . . . 4076 1 2158 . 1 1 250 250 ASP H H 1 8.80 0.007 . 1 . . . . . . . . 4076 1 2159 . 1 1 250 250 ASP CA C 13 57.2 0.5 . 1 . . . . . . . . 4076 1 2160 . 1 1 250 250 ASP HA H 1 4.21 0.06 . 1 . . . . . . . . 4076 1 2161 . 1 1 250 250 ASP CB C 13 40.5 0.5 . 1 . . . . . . . . 4076 1 2162 . 1 1 250 250 ASP HB2 H 1 2.40 0.06 . 2 . . . . . . . . 4076 1 2163 . 1 1 250 250 ASP HB3 H 1 2.69 0.06 . 2 . . . . . . . . 4076 1 2164 . 1 1 250 250 ASP C C 13 178.07 0.09 . 1 . . . . . . . . 4076 1 2165 . 1 1 251 251 GLU N N 15 117.0 0.1 . 1 . . . . . . . . 4076 1 2166 . 1 1 251 251 GLU H H 1 7.22 0.007 . 1 . . . . . . . . 4076 1 2167 . 1 1 251 251 GLU CA C 13 58.5 0.5 . 1 . . . . . . . . 4076 1 2168 . 1 1 251 251 GLU HA H 1 4.11 0.06 . 1 . . . . . . . . 4076 1 2169 . 1 1 251 251 GLU CB C 13 30.8 0.5 . 1 . . . . . . . . 4076 1 2170 . 1 1 251 251 GLU HB2 H 1 1.99 0.06 . 2 . . . . . . . . 4076 1 2171 . 1 1 251 251 GLU HB3 H 1 1.99 0.06 . 2 . . . . . . . . 4076 1 2172 . 1 1 251 251 GLU CG C 13 37.2 0.5 . 1 . . . . . . . . 4076 1 2173 . 1 1 251 251 GLU C C 13 179.62 0.09 . 1 . . . . . . . . 4076 1 2174 . 1 1 252 252 ILE N N 15 121.2 0.1 . 1 . . . . . . . . 4076 1 2175 . 1 1 252 252 ILE H H 1 7.32 0.007 . 1 . . . . . . . . 4076 1 2176 . 1 1 252 252 ILE CA C 13 64.8 0.5 . 1 . . . . . . . . 4076 1 2177 . 1 1 252 252 ILE HA H 1 3.67 0.06 . 1 . . . . . . . . 4076 1 2178 . 1 1 252 252 ILE CB C 13 37.7 0.5 . 1 . . . . . . . . 4076 1 2179 . 1 1 252 252 ILE HB H 1 1.86 0.06 . 1 . . . . . . . . 4076 1 2180 . 1 1 252 252 ILE CG1 C 13 29.7 0.5 . 2 . . . . . . . . 4076 1 2181 . 1 1 252 252 ILE CD1 C 13 17.3 0.5 . 1 . . . . . . . . 4076 1 2182 . 1 1 252 252 ILE C C 13 176.96 0.09 . 1 . . . . . . . . 4076 1 2183 . 1 1 253 253 LYS N N 15 118.9 0.1 . 1 . . . . . . . . 4076 1 2184 . 1 1 253 253 LYS H H 1 7.42 0.007 . 1 . . . . . . . . 4076 1 2185 . 1 1 253 253 LYS CA C 13 61.2 0.5 . 1 . . . . . . . . 4076 1 2186 . 1 1 253 253 LYS HA H 1 3.57 0.06 . 1 . . . . . . . . 4076 1 2187 . 1 1 253 253 LYS CB C 13 31.6 0.5 . 1 . . . . . . . . 4076 1 2188 . 1 1 253 253 LYS HB2 H 1 1.91 0.06 . 2 . . . . . . . . 4076 1 2189 . 1 1 253 253 LYS HB3 H 1 1.91 0.06 . 2 . . . . . . . . 4076 1 2190 . 1 1 253 253 LYS CG C 13 27.0 0.5 . 1 . . . . . . . . 4076 1 2191 . 1 1 253 253 LYS CD C 13 29.5 0.5 . 1 . . . . . . . . 4076 1 2192 . 1 1 253 253 LYS CE C 13 45.7 0.5 . 1 . . . . . . . . 4076 1 2193 . 1 1 253 253 LYS C C 13 178.94 0.09 . 1 . . . . . . . . 4076 1 2194 . 1 1 254 254 ASN N N 15 115.6 0.1 . 1 . . . . . . . . 4076 1 2195 . 1 1 254 254 ASN H H 1 8.02 0.007 . 1 . . . . . . . . 4076 1 2196 . 1 1 254 254 ASN CA C 13 55.8 0.5 . 1 . . . . . . . . 4076 1 2197 . 1 1 254 254 ASN HA H 1 4.27 0.06 . 1 . . . . . . . . 4076 1 2198 . 1 1 254 254 ASN CB C 13 38.3 0.5 . 1 . . . . . . . . 4076 1 2199 . 1 1 254 254 ASN HB2 H 1 2.77 0.06 . 2 . . . . . . . . 4076 1 2200 . 1 1 254 254 ASN HB3 H 1 2.77 0.06 . 2 . . . . . . . . 4076 1 2201 . 1 1 254 254 ASN C C 13 177.65 0.09 . 1 . . . . . . . . 4076 1 2202 . 1 1 255 255 ALA N N 15 122.1 0.1 . 1 . . . . . . . . 4076 1 2203 . 1 1 255 255 ALA H H 1 7.38 0.007 . 1 . . . . . . . . 4076 1 2204 . 1 1 255 255 ALA CA C 13 53.8 0.5 . 1 . . . . . . . . 4076 1 2205 . 1 1 255 255 ALA HA H 1 4.18 0.06 . 1 . . . . . . . . 4076 1 2206 . 1 1 255 255 ALA CB C 13 17.6 0.5 . 1 . . . . . . . . 4076 1 2207 . 1 1 255 255 ALA HB1 H 1 2.06 0.06 . 1 . . . . . . . . 4076 1 2208 . 1 1 255 255 ALA HB2 H 1 2.06 0.06 . 1 . . . . . . . . 4076 1 2209 . 1 1 255 255 ALA HB3 H 1 2.06 0.06 . 1 . . . . . . . . 4076 1 2210 . 1 1 255 255 ALA C C 13 177.19 0.09 . 1 . . . . . . . . 4076 1 2211 . 1 1 256 256 LEU N N 15 117.3 0.1 . 1 . . . . . . . . 4076 1 2212 . 1 1 256 256 LEU H H 1 7.30 0.007 . 1 . . . . . . . . 4076 1 2213 . 1 1 256 256 LEU CA C 13 54.2 0.5 . 1 . . . . . . . . 4076 1 2214 . 1 1 256 256 LEU HA H 1 4.17 0.06 . 1 . . . . . . . . 4076 1 2215 . 1 1 256 256 LEU CB C 13 41.6 0.5 . 1 . . . . . . . . 4076 1 2216 . 1 1 256 256 LEU HB2 H 1 1.64 0.06 . 2 . . . . . . . . 4076 1 2217 . 1 1 256 256 LEU HB3 H 1 1.86 0.06 . 2 . . . . . . . . 4076 1 2218 . 1 1 256 256 LEU CG C 13 25.6 0.5 . 1 . . . . . . . . 4076 1 2219 . 1 1 256 256 LEU CD1 C 13 21.4 0.5 . 2 . . . . . . . . 4076 1 2220 . 1 1 256 256 LEU CD2 C 13 21.4 0.5 . 2 . . . . . . . . 4076 1 2221 . 1 1 256 256 LEU C C 13 175.65 0.09 . 1 . . . . . . . . 4076 1 2222 . 1 1 257 257 LYS N N 15 124.5 0.1 . 1 . . . . . . . . 4076 1 2223 . 1 1 257 257 LYS H H 1 6.88 0.007 . 1 . . . . . . . . 4076 1 2224 . 1 1 257 257 LYS CA C 13 59.1 0.5 . 1 . . . . . . . . 4076 1 2225 . 1 1 257 257 LYS CB C 13 33.8 0.5 . 1 . . . . . . . . 4076 1 stop_ save_