data_17711 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17711 _Entry.Title ; Solution structure of the core SMN-Gemin2 complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-06-15 _Entry.Accession_date 2011-06-15 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _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 Kathryn Sarachan . L. . 17711 2 Kathleen Valentine . . . 17711 3 Kushol Gupta . . . 17711 4 Veronica Moorman . . . 17711 5 John Gledhill . . . 17711 6 Matthew Bernens . . . 17711 7 Cecilia Tommos . . . 17711 8 A. Wand . Joshua . 17711 9 Gregory 'Van Duyne' . . . 17711 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 17711 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID Gemin2 . 17711 SMN . 17711 'snRNP assembly' . 17711 'Spinal Muscular Atrophy' . 17711 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17711 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 914 17711 '15N chemical shifts' 206 17711 '1H chemical shifts' 1425 17711 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 2 . . 2012-07-01 2011-06-15 update BMRB 'update entry citation' 17711 1 . . 2012-06-05 2011-06-15 original author 'original release' 17711 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LEH 'BMRB Entry Tracking System' 17711 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17711 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22607171 _Citation.Full_citation . _Citation.Title 'Solution structure of the core SMN-Gemin2 complex.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biochem J.' _Citation.Journal_name_full 'The Biochemical journal' _Citation.Journal_volume 445 _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 361 _Citation.Page_last 370 _Citation.Year 2012 _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 Kathryn Sarachan . L. . 17711 1 2 Kathleen Valentine . G. . 17711 1 3 Kushol Gupta . . . 17711 1 4 Veronica Moorman . R. . 17711 1 5 John 'Gledhill Jr' . M. . 17711 1 6 Matthew Bernens . . . 17711 1 7 Cecilia Tommos . . . 17711 1 8 'A. Joshua' Wand . . . 17711 1 9 Gregory 'Van Duyne' . D. . 17711 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17711 _Assembly.ID 1 _Assembly.Name 'SMN-Gemin2 complex' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 gemin2 1 $gemin2 A . yes native no no . . . 17711 1 2 smn 2 $smn B . yes native no no . . . 17711 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_gemin2 _Entity.Sf_category entity _Entity.Sf_framecode gemin2 _Entity.Entry_ID 17711 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name gemin2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GYSPTLQWQQQQVAQFSTVR QNVNKHRSHWKSQQLDSNVT MPKSEDEEGWKKFCLGEKLC ADGAVGPATNESPGIDYVQI GFPPLLSIVSRMNQATVTSV LEYLSNWFGERDFTPELGRW LYALLACLEKPLLPEAHSLI RQLARRCSEVRLLVDSKDDE RVPALNLLICLVSRYFDQRD LADEPSLEY ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'The C-terminal residues Leu-Glu-Tyr are a non-native cloning artifact.' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 189 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'Gemin2 residues 95-280' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 21609.596 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2LEH . "Solution Structure Of The Core Smn-Gemin2 Complex" . . . . . 99.47 189 100.00 100.00 3.13e-135 . . . . 17711 1 2 no PDB 3S6N . "Crystal Structure Of The Gemin2-Binding Domain Of Smn, Gemin2 In Complex With Smd1D2FEG FROM HUMAN" . . . . . 98.41 280 100.00 100.00 3.37e-133 . . . . 17711 1 3 no DBJ BAB03509 . "SMN interacting protein 1-gamma [Homo sapiens]" . . . . . 81.48 250 100.00 100.00 3.98e-108 . . . . 17711 1 4 no DBJ BAG36665 . "unnamed protein product [Homo sapiens]" . . . . . 98.41 280 100.00 100.00 3.37e-133 . . . . 17711 1 5 no EMBL CAC16117 . "survival interacting protein 1 [Homo sapiens]" . . . . . 98.41 269 100.00 100.00 4.49e-133 . . . . 17711 1 6 no GB AAB82297 . "survival of motor neuron protein interacting protein 1 [Homo sapiens]" . . . . . 98.41 280 100.00 100.00 3.37e-133 . . . . 17711 1 7 no GB AAI04969 . "Survival of motor neuron protein interacting protein 1 [Homo sapiens]" . . . . . 98.41 280 100.00 100.00 3.37e-133 . . . . 17711 1 8 no GB AIC50129 . "GEMIN2, partial [synthetic construct]" . . . . . 98.41 280 100.00 100.00 3.37e-133 . . . . 17711 1 9 no GB EAW65825 . "survival of motor neuron protein interacting protein 1, isoform CRA_a [Homo sapiens]" . . . . . 98.41 280 100.00 100.00 3.37e-133 . . . . 17711 1 10 no GB EAW65829 . "survival of motor neuron protein interacting protein 1, isoform CRA_e [Homo sapiens]" . . . . . 81.48 250 100.00 100.00 3.98e-108 . . . . 17711 1 11 no REF NP_001009183 . "gem-associated protein 2 isoform gamma [Homo sapiens]" . . . . . 81.48 250 100.00 100.00 3.98e-108 . . . . 17711 1 12 no REF NP_003607 . "gem-associated protein 2 isoform alpha [Homo sapiens]" . . . . . 98.41 280 100.00 100.00 3.37e-133 . . . . 17711 1 13 no REF XP_001092707 . "PREDICTED: survival of motor neuron protein-interacting protein 1 isoform 3 [Macaca mulatta]" . . . . . 98.41 269 100.00 100.00 4.49e-133 . . . . 17711 1 14 no REF XP_001145975 . "PREDICTED: gem-associated protein 2 isoform X3 [Pan troglodytes]" . . . . . 81.48 250 100.00 100.00 3.98e-108 . . . . 17711 1 15 no REF XP_002807275 . "PREDICTED: gem-associated protein 2 isoform X1 [Callithrix jacchus]" . . . . . 98.41 269 98.92 100.00 2.31e-132 . . . . 17711 1 16 no SP O14893 . "RecName: Full=Gem-associated protein 2; Short=Gemin-2; AltName: Full=Component of gems 2; AltName: Full=Survival of motor neuro" . . . . . 98.41 280 100.00 100.00 3.37e-133 . . . . 17711 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 95 GLY . 17711 1 2 96 TYR . 17711 1 3 97 SER . 17711 1 4 98 PRO . 17711 1 5 99 THR . 17711 1 6 100 LEU . 17711 1 7 101 GLN . 17711 1 8 102 TRP . 17711 1 9 103 GLN . 17711 1 10 104 GLN . 17711 1 11 105 GLN . 17711 1 12 106 GLN . 17711 1 13 107 VAL . 17711 1 14 108 ALA . 17711 1 15 109 GLN . 17711 1 16 110 PHE . 17711 1 17 111 SER . 17711 1 18 112 THR . 17711 1 19 113 VAL . 17711 1 20 114 ARG . 17711 1 21 115 GLN . 17711 1 22 116 ASN . 17711 1 23 117 VAL . 17711 1 24 118 ASN . 17711 1 25 119 LYS . 17711 1 26 120 HIS . 17711 1 27 121 ARG . 17711 1 28 122 SER . 17711 1 29 123 HIS . 17711 1 30 124 TRP . 17711 1 31 125 LYS . 17711 1 32 126 SER . 17711 1 33 127 GLN . 17711 1 34 128 GLN . 17711 1 35 129 LEU . 17711 1 36 130 ASP . 17711 1 37 131 SER . 17711 1 38 132 ASN . 17711 1 39 133 VAL . 17711 1 40 134 THR . 17711 1 41 135 MET . 17711 1 42 136 PRO . 17711 1 43 137 LYS . 17711 1 44 138 SER . 17711 1 45 139 GLU . 17711 1 46 140 ASP . 17711 1 47 141 GLU . 17711 1 48 142 GLU . 17711 1 49 143 GLY . 17711 1 50 144 TRP . 17711 1 51 145 LYS . 17711 1 52 146 LYS . 17711 1 53 147 PHE . 17711 1 54 148 CYS . 17711 1 55 149 LEU . 17711 1 56 150 GLY . 17711 1 57 151 GLU . 17711 1 58 152 LYS . 17711 1 59 153 LEU . 17711 1 60 154 CYS . 17711 1 61 155 ALA . 17711 1 62 156 ASP . 17711 1 63 157 GLY . 17711 1 64 158 ALA . 17711 1 65 159 VAL . 17711 1 66 160 GLY . 17711 1 67 161 PRO . 17711 1 68 162 ALA . 17711 1 69 163 THR . 17711 1 70 164 ASN . 17711 1 71 165 GLU . 17711 1 72 166 SER . 17711 1 73 167 PRO . 17711 1 74 168 GLY . 17711 1 75 169 ILE . 17711 1 76 170 ASP . 17711 1 77 171 TYR . 17711 1 78 172 VAL . 17711 1 79 173 GLN . 17711 1 80 174 ILE . 17711 1 81 175 GLY . 17711 1 82 176 PHE . 17711 1 83 177 PRO . 17711 1 84 178 PRO . 17711 1 85 179 LEU . 17711 1 86 180 LEU . 17711 1 87 181 SER . 17711 1 88 182 ILE . 17711 1 89 183 VAL . 17711 1 90 184 SER . 17711 1 91 185 ARG . 17711 1 92 186 MET . 17711 1 93 187 ASN . 17711 1 94 188 GLN . 17711 1 95 189 ALA . 17711 1 96 190 THR . 17711 1 97 191 VAL . 17711 1 98 192 THR . 17711 1 99 193 SER . 17711 1 100 194 VAL . 17711 1 101 195 LEU . 17711 1 102 196 GLU . 17711 1 103 197 TYR . 17711 1 104 198 LEU . 17711 1 105 199 SER . 17711 1 106 200 ASN . 17711 1 107 201 TRP . 17711 1 108 202 PHE . 17711 1 109 203 GLY . 17711 1 110 204 GLU . 17711 1 111 205 ARG . 17711 1 112 206 ASP . 17711 1 113 207 PHE . 17711 1 114 208 THR . 17711 1 115 209 PRO . 17711 1 116 210 GLU . 17711 1 117 211 LEU . 17711 1 118 212 GLY . 17711 1 119 213 ARG . 17711 1 120 214 TRP . 17711 1 121 215 LEU . 17711 1 122 216 TYR . 17711 1 123 217 ALA . 17711 1 124 218 LEU . 17711 1 125 219 LEU . 17711 1 126 220 ALA . 17711 1 127 221 CYS . 17711 1 128 222 LEU . 17711 1 129 223 GLU . 17711 1 130 224 LYS . 17711 1 131 225 PRO . 17711 1 132 226 LEU . 17711 1 133 227 LEU . 17711 1 134 228 PRO . 17711 1 135 229 GLU . 17711 1 136 230 ALA . 17711 1 137 231 HIS . 17711 1 138 232 SER . 17711 1 139 233 LEU . 17711 1 140 234 ILE . 17711 1 141 235 ARG . 17711 1 142 236 GLN . 17711 1 143 237 LEU . 17711 1 144 238 ALA . 17711 1 145 239 ARG . 17711 1 146 240 ARG . 17711 1 147 241 CYS . 17711 1 148 242 SER . 17711 1 149 243 GLU . 17711 1 150 244 VAL . 17711 1 151 245 ARG . 17711 1 152 246 LEU . 17711 1 153 247 LEU . 17711 1 154 248 VAL . 17711 1 155 249 ASP . 17711 1 156 250 SER . 17711 1 157 251 LYS . 17711 1 158 252 ASP . 17711 1 159 253 ASP . 17711 1 160 254 GLU . 17711 1 161 255 ARG . 17711 1 162 256 VAL . 17711 1 163 257 PRO . 17711 1 164 258 ALA . 17711 1 165 259 LEU . 17711 1 166 260 ASN . 17711 1 167 261 LEU . 17711 1 168 262 LEU . 17711 1 169 263 ILE . 17711 1 170 264 CYS . 17711 1 171 265 LEU . 17711 1 172 266 VAL . 17711 1 173 267 SER . 17711 1 174 268 ARG . 17711 1 175 269 TYR . 17711 1 176 270 PHE . 17711 1 177 271 ASP . 17711 1 178 272 GLN . 17711 1 179 273 ARG . 17711 1 180 274 ASP . 17711 1 181 275 LEU . 17711 1 182 276 ALA . 17711 1 183 277 ASP . 17711 1 184 278 GLU . 17711 1 185 279 PRO . 17711 1 186 280 SER . 17711 1 187 281 LEU . 17711 1 188 282 GLU . 17711 1 189 283 TYR . 17711 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 17711 1 . TYR 2 2 17711 1 . SER 3 3 17711 1 . PRO 4 4 17711 1 . THR 5 5 17711 1 . LEU 6 6 17711 1 . GLN 7 7 17711 1 . TRP 8 8 17711 1 . GLN 9 9 17711 1 . GLN 10 10 17711 1 . GLN 11 11 17711 1 . GLN 12 12 17711 1 . VAL 13 13 17711 1 . ALA 14 14 17711 1 . GLN 15 15 17711 1 . PHE 16 16 17711 1 . SER 17 17 17711 1 . THR 18 18 17711 1 . VAL 19 19 17711 1 . ARG 20 20 17711 1 . GLN 21 21 17711 1 . ASN 22 22 17711 1 . VAL 23 23 17711 1 . ASN 24 24 17711 1 . LYS 25 25 17711 1 . HIS 26 26 17711 1 . ARG 27 27 17711 1 . SER 28 28 17711 1 . HIS 29 29 17711 1 . TRP 30 30 17711 1 . LYS 31 31 17711 1 . SER 32 32 17711 1 . GLN 33 33 17711 1 . GLN 34 34 17711 1 . LEU 35 35 17711 1 . ASP 36 36 17711 1 . SER 37 37 17711 1 . ASN 38 38 17711 1 . VAL 39 39 17711 1 . THR 40 40 17711 1 . MET 41 41 17711 1 . PRO 42 42 17711 1 . LYS 43 43 17711 1 . SER 44 44 17711 1 . GLU 45 45 17711 1 . ASP 46 46 17711 1 . GLU 47 47 17711 1 . GLU 48 48 17711 1 . GLY 49 49 17711 1 . TRP 50 50 17711 1 . LYS 51 51 17711 1 . LYS 52 52 17711 1 . PHE 53 53 17711 1 . CYS 54 54 17711 1 . LEU 55 55 17711 1 . GLY 56 56 17711 1 . GLU 57 57 17711 1 . LYS 58 58 17711 1 . LEU 59 59 17711 1 . CYS 60 60 17711 1 . ALA 61 61 17711 1 . ASP 62 62 17711 1 . GLY 63 63 17711 1 . ALA 64 64 17711 1 . VAL 65 65 17711 1 . GLY 66 66 17711 1 . PRO 67 67 17711 1 . ALA 68 68 17711 1 . THR 69 69 17711 1 . ASN 70 70 17711 1 . GLU 71 71 17711 1 . SER 72 72 17711 1 . PRO 73 73 17711 1 . GLY 74 74 17711 1 . ILE 75 75 17711 1 . ASP 76 76 17711 1 . TYR 77 77 17711 1 . VAL 78 78 17711 1 . GLN 79 79 17711 1 . ILE 80 80 17711 1 . GLY 81 81 17711 1 . PHE 82 82 17711 1 . PRO 83 83 17711 1 . PRO 84 84 17711 1 . LEU 85 85 17711 1 . LEU 86 86 17711 1 . SER 87 87 17711 1 . ILE 88 88 17711 1 . VAL 89 89 17711 1 . SER 90 90 17711 1 . ARG 91 91 17711 1 . MET 92 92 17711 1 . ASN 93 93 17711 1 . GLN 94 94 17711 1 . ALA 95 95 17711 1 . THR 96 96 17711 1 . VAL 97 97 17711 1 . THR 98 98 17711 1 . SER 99 99 17711 1 . VAL 100 100 17711 1 . LEU 101 101 17711 1 . GLU 102 102 17711 1 . TYR 103 103 17711 1 . LEU 104 104 17711 1 . SER 105 105 17711 1 . ASN 106 106 17711 1 . TRP 107 107 17711 1 . PHE 108 108 17711 1 . GLY 109 109 17711 1 . GLU 110 110 17711 1 . ARG 111 111 17711 1 . ASP 112 112 17711 1 . PHE 113 113 17711 1 . THR 114 114 17711 1 . PRO 115 115 17711 1 . GLU 116 116 17711 1 . LEU 117 117 17711 1 . GLY 118 118 17711 1 . ARG 119 119 17711 1 . TRP 120 120 17711 1 . LEU 121 121 17711 1 . TYR 122 122 17711 1 . ALA 123 123 17711 1 . LEU 124 124 17711 1 . LEU 125 125 17711 1 . ALA 126 126 17711 1 . CYS 127 127 17711 1 . LEU 128 128 17711 1 . GLU 129 129 17711 1 . LYS 130 130 17711 1 . PRO 131 131 17711 1 . LEU 132 132 17711 1 . LEU 133 133 17711 1 . PRO 134 134 17711 1 . GLU 135 135 17711 1 . ALA 136 136 17711 1 . HIS 137 137 17711 1 . SER 138 138 17711 1 . LEU 139 139 17711 1 . ILE 140 140 17711 1 . ARG 141 141 17711 1 . GLN 142 142 17711 1 . LEU 143 143 17711 1 . ALA 144 144 17711 1 . ARG 145 145 17711 1 . ARG 146 146 17711 1 . CYS 147 147 17711 1 . SER 148 148 17711 1 . GLU 149 149 17711 1 . VAL 150 150 17711 1 . ARG 151 151 17711 1 . LEU 152 152 17711 1 . LEU 153 153 17711 1 . VAL 154 154 17711 1 . ASP 155 155 17711 1 . SER 156 156 17711 1 . LYS 157 157 17711 1 . ASP 158 158 17711 1 . ASP 159 159 17711 1 . GLU 160 160 17711 1 . ARG 161 161 17711 1 . VAL 162 162 17711 1 . PRO 163 163 17711 1 . ALA 164 164 17711 1 . LEU 165 165 17711 1 . ASN 166 166 17711 1 . LEU 167 167 17711 1 . LEU 168 168 17711 1 . ILE 169 169 17711 1 . CYS 170 170 17711 1 . LEU 171 171 17711 1 . VAL 172 172 17711 1 . SER 173 173 17711 1 . ARG 174 174 17711 1 . TYR 175 175 17711 1 . PHE 176 176 17711 1 . ASP 177 177 17711 1 . GLN 178 178 17711 1 . ARG 179 179 17711 1 . ASP 180 180 17711 1 . LEU 181 181 17711 1 . ALA 182 182 17711 1 . ASP 183 183 17711 1 . GLU 184 184 17711 1 . PRO 185 185 17711 1 . SER 186 186 17711 1 . LEU 187 187 17711 1 . GLU 188 188 17711 1 . TYR 189 189 17711 1 stop_ save_ save_smn _Entity.Sf_category entity _Entity.Sf_framecode smn _Entity.Entry_ID 17711 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name smn _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GQSDDSDIWDDTALIKAYDK AVASFK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 26 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'Gemin2-binding domain; SMN residues 26-51' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 2863.100 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-30 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2LEH . "Solution Structure Of The Core Smn-Gemin2 Complex" . . . . . 100.00 26 100.00 100.00 1.62e-07 . . . . 17711 2 2 no PDB 3S6N . "Crystal Structure Of The Gemin2-Binding Domain Of Smn, Gemin2 In Complex With Smd1D2FEG FROM HUMAN" . . . . . 100.00 37 100.00 100.00 1.03e-07 . . . . 17711 2 3 no DBJ BAD51989 . "survival of motor neuron 1, telomeric isoform d [Macaca fascicularis]" . . . . . 100.00 294 100.00 100.00 4.16e-08 . . . . 17711 2 4 no DBJ BAE02007 . "unnamed protein product [Macaca fascicularis]" . . . . . 100.00 294 100.00 100.00 4.00e-08 . . . . 17711 2 5 no DBJ BAE26061 . "unnamed protein product [Mus musculus]" . . . . . 100.00 288 100.00 100.00 9.22e-08 . . . . 17711 2 6 no DBJ BAE39854 . "unnamed protein product [Mus musculus]" . . . . . 100.00 288 100.00 100.00 6.13e-08 . . . . 17711 2 7 no DBJ BAF82358 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 282 100.00 100.00 3.70e-08 . . . . 17711 2 8 no EMBL CAA73356 . "survival motor neuron [Mus musculus]" . . . . . 100.00 288 100.00 100.00 6.13e-08 . . . . 17711 2 9 no EMBL CAB41938 . "SMN protein [Danio rerio]" . . . . . 100.00 281 100.00 100.00 8.31e-07 . . . . 17711 2 10 no EMBL CAH89989 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 294 100.00 100.00 3.84e-08 . . . . 17711 2 11 no EMBL CDQ72355 . "unnamed protein product [Oncorhynchus mykiss]" . . . . . 100.00 278 100.00 100.00 3.15e-07 . . . . 17711 2 12 no GB AAA64505 . "putative open reading frame; duplicate of the functional spinal muscular atrophy gene, cDNA clone BCD514, GenBank Accession Num" . . . . . 100.00 293 100.00 100.00 3.04e-08 . . . . 17711 2 13 no GB AAA66242 . "survival motor neuron [Homo sapiens]" . . . . . 100.00 294 100.00 100.00 2.66e-08 . . . . 17711 2 14 no GB AAB58318 . "survival motor neuron protein [Canis lupus familiaris]" . . . . . 100.00 287 100.00 100.00 1.24e-07 . . . . 17711 2 15 no GB AAB96377 . "survival of motor neuron [Rattus norvegicus]" . . . . . 100.00 289 100.00 100.00 9.30e-08 . . . . 17711 2 16 no GB AAC01747 . "survival motor neuron [Rattus norvegicus]" . . . . . 100.00 288 100.00 100.00 7.68e-08 . . . . 17711 2 17 no PRF 2208336A . "SMN gene" . . . . . 100.00 294 100.00 100.00 2.89e-08 . . . . 17711 2 18 no REF NP_000335 . "survival motor neuron protein isoform d [Homo sapiens]" . . . . . 100.00 294 100.00 100.00 2.66e-08 . . . . 17711 2 19 no REF NP_001003226 . "survival motor neuron protein [Canis lupus familiaris]" . . . . . 100.00 287 100.00 100.00 1.24e-07 . . . . 17711 2 20 no REF NP_001009328 . "survival of motor neuron protein [Felis catus]" . . . . . 100.00 290 100.00 100.00 1.53e-07 . . . . 17711 2 21 no REF NP_001124207 . "survival motor neuron protein [Sus scrofa]" . . . . . 100.00 293 100.00 100.00 9.04e-08 . . . . 17711 2 22 no REF NP_001124942 . "survival motor neuron protein [Pongo abelii]" . . . . . 100.00 294 100.00 100.00 3.84e-08 . . . . 17711 2 23 no SP O02771 . "RecName: Full=Survival motor neuron protein [Canis lupus familiaris]" . . . . . 100.00 287 100.00 100.00 1.24e-07 . . . . 17711 2 24 no SP O35876 . "RecName: Full=Survival motor neuron protein [Rattus norvegicus]" . . . . . 100.00 289 100.00 100.00 9.30e-08 . . . . 17711 2 25 no SP P97801 . "RecName: Full=Survival motor neuron protein [Mus musculus]" . . . . . 100.00 288 100.00 100.00 6.13e-08 . . . . 17711 2 26 no SP Q16637 . "RecName: Full=Survival motor neuron protein; AltName: Full=Component of gems 1; AltName: Full=Gemin-1 [Homo sapiens]" . . . . . 100.00 294 100.00 100.00 2.66e-08 . . . . 17711 2 27 no SP Q4R4F8 . "RecName: Full=Survival motor neuron protein [Macaca fascicularis]" . . . . . 100.00 294 100.00 100.00 4.00e-08 . . . . 17711 2 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 26 GLY . 17711 2 2 27 GLN . 17711 2 3 28 SER . 17711 2 4 29 ASP . 17711 2 5 30 ASP . 17711 2 6 31 SER . 17711 2 7 32 ASP . 17711 2 8 33 ILE . 17711 2 9 34 TRP . 17711 2 10 35 ASP . 17711 2 11 36 ASP . 17711 2 12 37 THR . 17711 2 13 38 ALA . 17711 2 14 39 LEU . 17711 2 15 40 ILE . 17711 2 16 41 LYS . 17711 2 17 42 ALA . 17711 2 18 43 TYR . 17711 2 19 44 ASP . 17711 2 20 45 LYS . 17711 2 21 46 ALA . 17711 2 22 47 VAL . 17711 2 23 48 ALA . 17711 2 24 49 SER . 17711 2 25 50 PHE . 17711 2 26 51 LYS . 17711 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 17711 2 . GLN 2 2 17711 2 . SER 3 3 17711 2 . ASP 4 4 17711 2 . ASP 5 5 17711 2 . SER 6 6 17711 2 . ASP 7 7 17711 2 . ILE 8 8 17711 2 . TRP 9 9 17711 2 . ASP 10 10 17711 2 . ASP 11 11 17711 2 . THR 12 12 17711 2 . ALA 13 13 17711 2 . LEU 14 14 17711 2 . ILE 15 15 17711 2 . LYS 16 16 17711 2 . ALA 17 17 17711 2 . TYR 18 18 17711 2 . ASP 19 19 17711 2 . LYS 20 20 17711 2 . ALA 21 21 17711 2 . VAL 22 22 17711 2 . ALA 23 23 17711 2 . SER 24 24 17711 2 . PHE 25 25 17711 2 . LYS 26 26 17711 2 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 17711 _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 $gemin2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17711 1 2 2 $smn . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17711 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 17711 _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 $gemin2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pKS987 . . . . . . 17711 1 2 2 $smn . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pKS1449 . . . . . . 17711 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17711 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 gemin2 '[U-99% 13C; U-99% 15N]' . . 1 $gemin2 . . 1.0 . . mM . . . . 17711 1 2 smn '[U-99% 13C; U-99% 15N]' . . 2 $smn . . 1.0 . . mM . . . . 17711 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 17711 1 4 DTT 'natural abundance' . . . . . . 50 . . mM . . . . 17711 1 5 EDTA 'natural abundance' . . . . . . 50 . . uM . . . . 17711 1 6 'sodium azide' 'natural abundance' . . . . . . 200 . . nM . . . . 17711 1 7 'sodium phosphate' 'natural abundance' . . . . . . 34.25 . . mM . . . . 17711 1 8 'potassium phosphate' 'natural abundance' . . . . . . 15.75 . . mM . . . . 17711 1 9 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17711 1 10 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17711 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 17711 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 gemin2 '[U-99% 13C; U-99% 15N]' . . 1 $gemin2 . . 1.0 . . mM . . . . 17711 2 2 smn '[U-99% 13C; U-99% 15N]' . . 2 $smn . . 1.0 . . mM . . . . 17711 2 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 17711 2 4 DTT '[U-98% 2H]' . . . . . . 50 . . mM . . . . 17711 2 5 EDTA 'natural abundance' . . . . . . 50 . . uM . . . . 17711 2 6 'sodium azide' 'natural abundance' . . . . . . 200 . . nM . . . . 17711 2 7 'sodium phosphate' 'natural abundance' . . . . . . 34.25 . . mM . . . . 17711 2 8 'potassium phosphate' 'natural abundance' . . . . . . 15.75 . . mM . . . . 17711 2 9 D2O 'natural abundance' . . . . . . 100 . . % . . . . 17711 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 17711 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 gemin2 '[U-10% 13C; U-99% 15N]' . . 1 $gemin2 . . 1.0 . . mM . . . . 17711 3 2 smn '[U-10% 13C; U-99% 15N]' . . 2 $smn . . 1.0 . . mM . . . . 17711 3 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 17711 3 4 DTT 'natural abundance' . . . . . . 50 . . mM . . . . 17711 3 5 EDTA 'natural abundance' . . . . . . 50 . . uM . . . . 17711 3 6 'sodium azide' 'natural abundance' . . . . . . 200 . . nM . . . . 17711 3 7 'sodium phosphate' 'natural abundance' . . . . . . 34.25 . . mM . . . . 17711 3 8 'potassium phosphate' 'natural abundance' . . . . . . 15.75 . . mM . . . . 17711 3 9 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17711 3 10 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17711 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 17711 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 gemin2 '[U-98% 15N]-Leu' . . 1 $gemin2 . . 1.0 . . mM . . . . 17711 4 2 smn 'natural abundance' . . 2 $smn . . 1.0 . . mM . . . . 17711 4 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 17711 4 4 DTT 'natural abundance' . . . . . . 50 . . mM . . . . 17711 4 5 EDTA 'natural abundance' . . . . . . 50 . . uM . . . . 17711 4 6 'sodium azide' 'natural abundance' . . . . . . 200 . . nM . . . . 17711 4 7 'sodium phosphate' 'natural abundance' . . . . . . 34.25 . . mM . . . . 17711 4 8 'potassium phosphate' 'natural abundance' . . . . . . 15.75 . . mM . . . . 17711 4 9 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17711 4 10 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17711 4 stop_ save_ save_sample_5 _Sample.Sf_category sample _Sample.Sf_framecode sample_5 _Sample.Entry_ID 17711 _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 gemin2 'natural abundance' . . 1 $gemin2 . . 1.0 . . mM . . . . 17711 5 2 smn '[U-99% 15N]' . . 2 $smn . . 1.0 . . mM . . . . 17711 5 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 17711 5 4 DTT 'natural abundance' . . . . . . 50 . . mM . . . . 17711 5 5 EDTA 'natural abundance' . . . . . . 50 . . uM . . . . 17711 5 6 'sodium azide' 'natural abundance' . . . . . . 200 . . nM . . . . 17711 5 7 'sodium phosphate' 'natural abundance' . . . . . . 34.25 . . mM . . . . 17711 5 8 'potassium phosphate' 'natural abundance' . . . . . . 15.75 . . mM . . . . 17711 5 9 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17711 5 10 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17711 5 stop_ save_ save_sample_6 _Sample.Sf_category sample _Sample.Sf_framecode sample_6 _Sample.Entry_ID 17711 _Sample.ID 6 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 gemin2 '[U-99% 15N]' . . 1 $gemin2 . . 1.0 . . mM . . . . 17711 6 2 smn '[U-99% 15N]' . . 2 $smn . . 1.0 . . mM . . . . 17711 6 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 17711 6 4 DTT 'natural abundance' . . . . . . 50 . . mM . . . . 17711 6 5 EDTA 'natural abundance' . . . . . . 50 . . uM . . . . 17711 6 6 'sodium azide' 'natural abundance' . . . . . . 200 . . nM . . . . 17711 6 7 'sodium phosphate' 'natural abundance' . . . . . . 34.25 . . mM . . . . 17711 6 8 'potassium phosphate' 'natural abundance' . . . . . . 15.75 . . mM . . . . 17711 6 9 'bacteriophage Pf1 strain LP11-92' 'natural abundance' . . . . . . 12 . . mg/ml . . . . 17711 6 10 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17711 6 11 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17711 6 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17711 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.5 . pH 17711 1 pressure 1 . atm 17711 1 temperature 298.15 . K 17711 1 stop_ save_ ############################ # Computer software used # ############################ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 17711 _Software.ID 1 _Software.Name 'X-PLOR NIH' _Software.Version v2.26 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 17711 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17711 1 'structure solution' 17711 1 stop_ save_ save_Felix _Software.Sf_category software _Software.Sf_framecode Felix _Software.Entry_ID 17711 _Software.ID 2 _Software.Name FELIX _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 17711 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17711 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 17711 _Software.ID 3 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 17711 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17711 3 'peak picking' 17711 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17711 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17711 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 17711 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 750 . . . 17711 1 2 spectrometer_2 Bruker Avance . 500 . . . 17711 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 17711 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 3 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 6 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 7 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 8 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 10 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 11 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 12 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 13 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 14 '3D HCCH-TOCSY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 15 '2D 1H-15N HSQC' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 16 '2D 1H-15N HSQC' no . . . . . . . . . . 5 $sample_5 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 17 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 18 '4D HNCH-NOESY-HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 19 '4D HCCH-NOESY-HMQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17711 1 20 '2D 1H-15N HSQC IPAP' no . . . . . . . . . . 6 $sample_6 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17711 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17711 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 17711 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17711 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 17711 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17711 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17711 1 2 '3D HNCA' . . . 17711 1 3 '3D HN(CO)CA' . . . 17711 1 4 '3D HNCACB' . . . 17711 1 5 '3D CBCA(CO)NH' . . . 17711 1 6 '3D HN(CA)CO' . . . 17711 1 7 '3D HNCO' . . . 17711 1 8 '3D H(CCO)NH' . . . 17711 1 9 '3D HCCH-TOCSY' . . . 17711 1 10 '3D 1H-15N NOESY' . . . 17711 1 11 '3D 1H-13C NOESY' . . . 17711 1 12 '2D 1H-13C HSQC aromatic' . . . 17711 1 13 '3D 1H-13C NOESY aromatic' . . . 17711 1 14 '3D HCCH-TOCSY aromatic' . . . 17711 1 15 '2D 1H-15N HSQC' . . . 17711 1 17 '2D 1H-13C HSQC' . . . 17711 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.9192 0.000 . 2 . . . A 95 GLY HA2 . 17711 1 2 . 1 1 1 1 GLY HA3 H 1 3.9192 0.000 . 2 . . . . 95 GLY HA3 . 17711 1 3 . 1 1 1 1 GLY CA C 13 44.9772 0.000 . 1 . . . A 95 GLY CA . 17711 1 4 . 1 1 2 2 TYR HA H 1 4.5002 0.008 . 1 . . . A 96 TYR HA . 17711 1 5 . 1 1 2 2 TYR HB2 H 1 2.9202 0.008 . 2 . . . A 96 TYR HB2 . 17711 1 6 . 1 1 2 2 TYR HB3 H 1 2.7422 0.011 . 2 . . . . 96 TYR HB3 . 17711 1 7 . 1 1 2 2 TYR HD1 H 1 6.9452 0.003 . 3 . . . A 96 TYR HD1 . 17711 1 8 . 1 1 2 2 TYR HD2 H 1 6.9452 0.003 . 3 . . . A 96 TYR HD2 . 17711 1 9 . 1 1 2 2 TYR HE1 H 1 6.7192 0.001 . 3 . . . A 96 TYR HE1 . 17711 1 10 . 1 1 2 2 TYR HE2 H 1 6.7192 0.001 . 3 . . . A 96 TYR HE2 . 17711 1 11 . 1 1 2 2 TYR C C 13 175.1852 0.000 . 1 . . . A 96 TYR C . 17711 1 12 . 1 1 2 2 TYR CA C 13 57.5772 0.100 . 1 . . . A 96 TYR CA . 17711 1 13 . 1 1 2 2 TYR CB C 13 38.9752 0.092 . 1 . . . A 96 TYR CB . 17711 1 14 . 1 1 2 2 TYR CD1 C 13 133.0652 0.008 . 3 . . . A 96 TYR CD1 . 17711 1 15 . 1 1 2 2 TYR CD2 C 13 133.0652 0.008 . 3 . . . A 96 TYR CD2 . 17711 1 16 . 1 1 2 2 TYR CE1 C 13 118.4692 0.030 . 3 . . . A 96 TYR CE1 . 17711 1 17 . 1 1 2 2 TYR CE2 C 13 118.4692 0.030 . 3 . . . A 96 TYR CE2 . 17711 1 18 . 1 1 3 3 SER H H 1 7.9762 0.009 . 1 . . . . 97 SER H . 17711 1 19 . 1 1 3 3 SER HA H 1 4.4452 0.011 . 1 . . . A 97 SER HA . 17711 1 20 . 1 1 3 3 SER HB2 H 1 3.7182 0.011 . 2 . . . A 97 SER HB2 . 17711 1 21 . 1 1 3 3 SER HB3 H 1 3.6292 0.006 . 2 . . . . 97 SER HB3 . 17711 1 22 . 1 1 3 3 SER C C 13 172.7472 0.000 . 1 . . . A 97 SER C . 17711 1 23 . 1 1 3 3 SER CA C 13 56.4282 0.038 . 1 . . . A 97 SER CA . 17711 1 24 . 1 1 3 3 SER CB C 13 63.5542 0.131 . 1 . . . A 97 SER CB . 17711 1 25 . 1 1 3 3 SER N N 15 117.1652 0.075 . 1 . . . A 97 SER N . 17711 1 26 . 1 1 4 4 PRO HA H 1 4.6082 0.006 . 1 . . . A 98 PRO HA . 17711 1 27 . 1 1 4 4 PRO HB2 H 1 2.1362 0.005 . 2 . . . A 98 PRO HB2 . 17711 1 28 . 1 1 4 4 PRO HB3 H 1 1.9312 0.008 . 2 . . . . 98 PRO HB3 . 17711 1 29 . 1 1 4 4 PRO HG2 H 1 2.0392 0.029 . 2 . . . A 98 PRO HG2 . 17711 1 30 . 1 1 4 4 PRO HG3 H 1 2.0392 0.029 . 2 . . . . 98 PRO HG3 . 17711 1 31 . 1 1 4 4 PRO HD2 H 1 3.6012 0.000 . 2 . . . A 98 PRO HD2 . 17711 1 32 . 1 1 4 4 PRO HD3 H 1 3.6012 0.000 . 2 . . . . 98 PRO HD3 . 17711 1 33 . 1 1 4 4 PRO C C 13 177.2812 0.000 . 1 . . . A 98 PRO C . 17711 1 34 . 1 1 4 4 PRO CA C 13 62.2432 0.108 . 1 . . . A 98 PRO CA . 17711 1 35 . 1 1 4 4 PRO CB C 13 32.6372 0.119 . 1 . . . A 98 PRO CB . 17711 1 36 . 1 1 4 4 PRO CG C 13 27.7632 0.300 . 1 . . . A 98 PRO CG . 17711 1 37 . 1 1 4 4 PRO CD C 13 50.5782 0.000 . 1 . . . A 98 PRO CD . 17711 1 38 . 1 1 5 5 THR H H 1 8.6342 0.011 . 1 . . . . 99 THR H . 17711 1 39 . 1 1 5 5 THR HA H 1 4.2432 0.006 . 1 . . . A 99 THR HA . 17711 1 40 . 1 1 5 5 THR HB H 1 4.7452 0.011 . 1 . . . A 99 THR HB . 17711 1 41 . 1 1 5 5 THR HG21 H 1 1.4182 0.006 . 1 . . . A 99 THR HG21 . 17711 1 42 . 1 1 5 5 THR HG22 H 1 1.4182 0.006 . 1 . . . A 99 THR HG22 . 17711 1 43 . 1 1 5 5 THR HG23 H 1 1.4182 0.006 . 1 . . . A 99 THR HG23 . 17711 1 44 . 1 1 5 5 THR C C 13 175.8502 0.035 . 1 . . . A 99 THR C . 17711 1 45 . 1 1 5 5 THR CA C 13 61.8532 0.101 . 1 . . . A 99 THR CA . 17711 1 46 . 1 1 5 5 THR CB C 13 70.6512 0.102 . 1 . . . A 99 THR CB . 17711 1 47 . 1 1 5 5 THR CG2 C 13 22.0732 0.077 . 1 . . . A 99 THR CG2 . 17711 1 48 . 1 1 5 5 THR N N 15 113.4402 0.100 . 1 . . . A 99 THR N . 17711 1 49 . 1 1 6 6 LEU H H 1 9.0262 0.010 . 1 . . . . 100 LEU H . 17711 1 50 . 1 1 6 6 LEU HA H 1 4.0962 0.007 . 1 . . . A 100 LEU HA . 17711 1 51 . 1 1 6 6 LEU HB2 H 1 1.6982 0.008 . 2 . . . A 100 LEU HB2 . 17711 1 52 . 1 1 6 6 LEU HB3 H 1 1.6612 0.005 . 2 . . . . 100 LEU HB3 . 17711 1 53 . 1 1 6 6 LEU HG H 1 1.6382 0.006 . 1 . . . A 100 LEU HG . 17711 1 54 . 1 1 6 6 LEU HD11 H 1 0.9442 0.013 . 2 . . . A 100 LEU HD11 . 17711 1 55 . 1 1 6 6 LEU HD12 H 1 0.9442 0.013 . 2 . . . A 100 LEU HD12 . 17711 1 56 . 1 1 6 6 LEU HD13 H 1 0.9442 0.013 . 2 . . . A 100 LEU HD13 . 17711 1 57 . 1 1 6 6 LEU HD21 H 1 0.9442 0.013 . 2 . . . A 100 LEU HD21 . 17711 1 58 . 1 1 6 6 LEU HD22 H 1 0.9442 0.013 . 2 . . . A 100 LEU HD22 . 17711 1 59 . 1 1 6 6 LEU HD23 H 1 0.9442 0.013 . 2 . . . A 100 LEU HD23 . 17711 1 60 . 1 1 6 6 LEU C C 13 179.1522 0.000 . 1 . . . A 100 LEU C . 17711 1 61 . 1 1 6 6 LEU CA C 13 58.1272 0.166 . 1 . . . A 100 LEU CA . 17711 1 62 . 1 1 6 6 LEU CB C 13 41.2702 0.104 . 1 . . . A 100 LEU CB . 17711 1 63 . 1 1 6 6 LEU CG C 13 27.1102 0.067 . 1 . . . A 100 LEU CG . 17711 1 64 . 1 1 6 6 LEU CD1 C 13 23.9992 0.129 . 2 . . . A 100 LEU CD1 . 17711 1 65 . 1 1 6 6 LEU CD2 C 13 23.9992 0.129 . 2 . . . A 100 LEU CD2 . 17711 1 66 . 1 1 6 6 LEU N N 15 122.8122 0.122 . 1 . . . A 100 LEU N . 17711 1 67 . 1 1 7 7 GLN H H 1 8.5802 0.010 . 1 . . . . 101 GLN H . 17711 1 68 . 1 1 7 7 GLN HA H 1 4.1262 0.031 . 1 . . . A 101 GLN HA . 17711 1 69 . 1 1 7 7 GLN HB2 H 1 2.1352 0.021 . 2 . . . A 101 GLN HB2 . 17711 1 70 . 1 1 7 7 GLN HB3 H 1 2.1352 0.021 . 2 . . . . 101 GLN HB3 . 17711 1 71 . 1 1 7 7 GLN HG2 H 1 2.4642 0.022 . 2 . . . A 101 GLN HG2 . 17711 1 72 . 1 1 7 7 GLN HG3 H 1 2.4642 0.022 . 2 . . . . 101 GLN HG3 . 17711 1 73 . 1 1 7 7 GLN C C 13 178.2192 0.003 . 1 . . . A 101 GLN C . 17711 1 74 . 1 1 7 7 GLN CA C 13 59.8032 0.062 . 1 . . . A 101 GLN CA . 17711 1 75 . 1 1 7 7 GLN CB C 13 28.1372 0.033 . 1 . . . A 101 GLN CB . 17711 1 76 . 1 1 7 7 GLN CG C 13 34.0682 0.042 . 1 . . . A 101 GLN CG . 17711 1 77 . 1 1 7 7 GLN N N 15 117.9082 0.059 . 1 . . . A 101 GLN N . 17711 1 78 . 1 1 8 8 TRP H H 1 8.2122 0.008 . 1 . . . . 102 TRP H . 17711 1 79 . 1 1 8 8 TRP HA H 1 4.1552 0.024 . 1 . . . A 102 TRP HA . 17711 1 80 . 1 1 8 8 TRP HB2 H 1 3.5092 0.017 . 2 . . . A 102 TRP HB2 . 17711 1 81 . 1 1 8 8 TRP HB3 H 1 3.3782 0.029 . 2 . . . . 102 TRP HB3 . 17711 1 82 . 1 1 8 8 TRP HD1 H 1 7.3862 0.008 . 1 . . . A 102 TRP HD1 . 17711 1 83 . 1 1 8 8 TRP HE1 H 1 10.3452 0.000 . 1 . . . A 102 TRP HE1 . 17711 1 84 . 1 1 8 8 TRP C C 13 178.6852 0.033 . 1 . . . A 102 TRP C . 17711 1 85 . 1 1 8 8 TRP CA C 13 62.5792 0.102 . 1 . . . A 102 TRP CA . 17711 1 86 . 1 1 8 8 TRP CB C 13 29.0292 0.167 . 1 . . . A 102 TRP CB . 17711 1 87 . 1 1 8 8 TRP CD1 C 13 128.4322 0.105 . 1 . . . A 102 TRP CD1 . 17711 1 88 . 1 1 8 8 TRP N N 15 121.7842 0.108 . 1 . . . A 102 TRP N . 17711 1 89 . 1 1 8 8 TRP NE1 N 15 130.9702 0.000 . 1 . . . A 102 TRP NE1 . 17711 1 90 . 1 1 9 9 GLN H H 1 8.3782 0.009 . 1 . . . . 103 GLN H . 17711 1 91 . 1 1 9 9 GLN HA H 1 3.9802 0.020 . 1 . . . A 103 GLN HA . 17711 1 92 . 1 1 9 9 GLN HB2 H 1 2.0882 0.002 . 2 . . . A 103 GLN HB2 . 17711 1 93 . 1 1 9 9 GLN HB3 H 1 2.0882 0.002 . 2 . . . . 103 GLN HB3 . 17711 1 94 . 1 1 9 9 GLN HG2 H 1 2.4822 0.015 . 2 . . . A 103 GLN HG2 . 17711 1 95 . 1 1 9 9 GLN HG3 H 1 2.4822 0.015 . 2 . . . . 103 GLN HG3 . 17711 1 96 . 1 1 9 9 GLN C C 13 178.0502 0.000 . 1 . . . A 103 GLN C . 17711 1 97 . 1 1 9 9 GLN CA C 13 60.0482 0.100 . 1 . . . A 103 GLN CA . 17711 1 98 . 1 1 9 9 GLN CB C 13 27.8082 0.050 . 1 . . . A 103 GLN CB . 17711 1 99 . 1 1 9 9 GLN CG C 13 34.0942 0.003 . 1 . . . A 103 GLN CG . 17711 1 100 . 1 1 9 9 GLN N N 15 117.0242 0.100 . 1 . . . A 103 GLN N . 17711 1 101 . 1 1 10 10 GLN H H 1 8.6912 0.009 . 1 . . . . 104 GLN H . 17711 1 102 . 1 1 10 10 GLN HA H 1 3.9182 0.018 . 1 . . . A 104 GLN HA . 17711 1 103 . 1 1 10 10 GLN HB2 H 1 2.1172 0.020 . 2 . . . A 104 GLN HB2 . 17711 1 104 . 1 1 10 10 GLN HB3 H 1 2.1172 0.020 . 2 . . . . 104 GLN HB3 . 17711 1 105 . 1 1 10 10 GLN HG2 H 1 2.5272 0.007 . 2 . . . A 104 GLN HG2 . 17711 1 106 . 1 1 10 10 GLN HG3 H 1 2.3772 0.006 . 2 . . . . 104 GLN HG3 . 17711 1 107 . 1 1 10 10 GLN HE21 H 1 7.3432 0.001 . 2 . . . A 104 GLN HE21 . 17711 1 108 . 1 1 10 10 GLN HE22 H 1 6.8222 0.005 . 2 . . . A 104 GLN HE22 . 17711 1 109 . 1 1 10 10 GLN C C 13 179.6752 0.031 . 1 . . . A 104 GLN C . 17711 1 110 . 1 1 10 10 GLN CA C 13 59.0032 0.068 . 1 . . . A 104 GLN CA . 17711 1 111 . 1 1 10 10 GLN CB C 13 28.0172 0.074 . 1 . . . A 104 GLN CB . 17711 1 112 . 1 1 10 10 GLN CG C 13 33.9302 0.098 . 1 . . . A 104 GLN CG . 17711 1 113 . 1 1 10 10 GLN N N 15 117.4402 0.102 . 1 . . . A 104 GLN N . 17711 1 114 . 1 1 10 10 GLN NE2 N 15 110.5112 0.072 . 1 . . . A 104 GLN NE2 . 17711 1 115 . 1 1 11 11 GLN H H 1 8.1522 0.008 . 1 . . . . 105 GLN H . 17711 1 116 . 1 1 11 11 GLN HA H 1 4.0482 0.009 . 1 . . . A 105 GLN HA . 17711 1 117 . 1 1 11 11 GLN HB2 H 1 2.1012 0.027 . 2 . . . A 105 GLN HB2 . 17711 1 118 . 1 1 11 11 GLN HB3 H 1 2.1012 0.027 . 2 . . . . 105 GLN HB3 . 17711 1 119 . 1 1 11 11 GLN HG2 H 1 2.4692 0.024 . 2 . . . A 105 GLN HG2 . 17711 1 120 . 1 1 11 11 GLN HG3 H 1 2.4692 0.024 . 2 . . . . 105 GLN HG3 . 17711 1 121 . 1 1 11 11 GLN C C 13 178.9732 0.016 . 1 . . . A 105 GLN C . 17711 1 122 . 1 1 11 11 GLN CA C 13 58.7562 0.108 . 1 . . . A 105 GLN CA . 17711 1 123 . 1 1 11 11 GLN CB C 13 27.8812 0.129 . 1 . . . A 105 GLN CB . 17711 1 124 . 1 1 11 11 GLN CG C 13 33.8302 0.074 . 1 . . . A 105 GLN CG . 17711 1 125 . 1 1 11 11 GLN N N 15 120.6432 0.097 . 1 . . . A 105 GLN N . 17711 1 126 . 1 1 12 12 GLN H H 1 8.0602 0.011 . 1 . . . . 106 GLN H . 17711 1 127 . 1 1 12 12 GLN HA H 1 3.8992 0.020 . 1 . . . A 106 GLN HA . 17711 1 128 . 1 1 12 12 GLN HB2 H 1 1.6342 0.012 . 2 . . . A 106 GLN HB2 . 17711 1 129 . 1 1 12 12 GLN HB3 H 1 1.6342 0.012 . 2 . . . . 106 GLN HB3 . 17711 1 130 . 1 1 12 12 GLN HG2 H 1 1.2742 0.010 . 2 . . . A 106 GLN HG2 . 17711 1 131 . 1 1 12 12 GLN HG3 H 1 0.6082 0.009 . 2 . . . . 106 GLN HG3 . 17711 1 132 . 1 1 12 12 GLN HE21 H 1 6.4742 0.003 . 2 . . . A 106 GLN HE21 . 17711 1 133 . 1 1 12 12 GLN HE22 H 1 6.4742 0.003 . 2 . . . A 106 GLN HE22 . 17711 1 134 . 1 1 12 12 GLN C C 13 180.3832 0.031 . 1 . . . A 106 GLN C . 17711 1 135 . 1 1 12 12 GLN CA C 13 57.2482 0.126 . 1 . . . A 106 GLN CA . 17711 1 136 . 1 1 12 12 GLN CB C 13 25.9742 0.070 . 1 . . . A 106 GLN CB . 17711 1 137 . 1 1 12 12 GLN CG C 13 30.8512 0.183 . 1 . . . A 106 GLN CG . 17711 1 138 . 1 1 12 12 GLN N N 15 117.5282 0.067 . 1 . . . A 106 GLN N . 17711 1 139 . 1 1 12 12 GLN NE2 N 15 111.5252 0.119 . 1 . . . A 106 GLN NE2 . 17711 1 140 . 1 1 13 13 VAL H H 1 8.1212 0.012 . 1 . . . . 107 VAL H . 17711 1 141 . 1 1 13 13 VAL HA H 1 3.5102 0.015 . 1 . . . A 107 VAL HA . 17711 1 142 . 1 1 13 13 VAL HB H 1 2.1942 0.004 . 1 . . . A 107 VAL HB . 17711 1 143 . 1 1 13 13 VAL HG11 H 1 1.0252 0.008 . 1 . . . A 107 VAL HG11 . 17711 1 144 . 1 1 13 13 VAL HG12 H 1 1.0252 0.008 . 1 . . . A 107 VAL HG12 . 17711 1 145 . 1 1 13 13 VAL HG13 H 1 1.0252 0.008 . 1 . . . A 107 VAL HG13 . 17711 1 146 . 1 1 13 13 VAL HG21 H 1 1.1132 0.014 . 1 . . . A 107 VAL HG21 . 17711 1 147 . 1 1 13 13 VAL HG22 H 1 1.1132 0.014 . 1 . . . A 107 VAL HG22 . 17711 1 148 . 1 1 13 13 VAL HG23 H 1 1.1132 0.014 . 1 . . . A 107 VAL HG23 . 17711 1 149 . 1 1 13 13 VAL C C 13 177.3352 0.024 . 1 . . . A 107 VAL C . 17711 1 150 . 1 1 13 13 VAL CA C 13 67.4612 0.077 . 1 . . . A 107 VAL CA . 17711 1 151 . 1 1 13 13 VAL CB C 13 31.6682 0.109 . 1 . . . A 107 VAL CB . 17711 1 152 . 1 1 13 13 VAL CG1 C 13 24.5732 0.089 . 1 . . . A 107 VAL CG1 . 17711 1 153 . 1 1 13 13 VAL CG2 C 13 22.0312 0.105 . 1 . . . A 107 VAL CG2 . 17711 1 154 . 1 1 13 13 VAL N N 15 122.0912 0.048 . 1 . . . A 107 VAL N . 17711 1 155 . 1 1 14 14 ALA H H 1 7.8212 0.009 . 1 . . . . 108 ALA H . 17711 1 156 . 1 1 14 14 ALA HA H 1 4.2142 0.010 . 1 . . . A 108 ALA HA . 17711 1 157 . 1 1 14 14 ALA HB1 H 1 1.5182 0.009 . 1 . . . A 108 ALA HB1 . 17711 1 158 . 1 1 14 14 ALA HB2 H 1 1.5182 0.009 . 1 . . . A 108 ALA HB2 . 17711 1 159 . 1 1 14 14 ALA HB3 H 1 1.5182 0.009 . 1 . . . A 108 ALA HB3 . 17711 1 160 . 1 1 14 14 ALA C C 13 181.0952 0.018 . 1 . . . A 108 ALA C . 17711 1 161 . 1 1 14 14 ALA CA C 13 55.3992 0.059 . 1 . . . A 108 ALA CA . 17711 1 162 . 1 1 14 14 ALA CB C 13 17.8942 0.101 . 1 . . . A 108 ALA CB . 17711 1 163 . 1 1 14 14 ALA N N 15 123.1582 0.144 . 1 . . . A 108 ALA N . 17711 1 164 . 1 1 15 15 GLN H H 1 8.1832 0.010 . 1 . . . . 109 GLN H . 17711 1 165 . 1 1 15 15 GLN HA H 1 4.1302 0.016 . 1 . . . A 109 GLN HA . 17711 1 166 . 1 1 15 15 GLN HB2 H 1 2.1232 0.014 . 2 . . . A 109 GLN HB2 . 17711 1 167 . 1 1 15 15 GLN HB3 H 1 2.1232 0.014 . 2 . . . . 109 GLN HB3 . 17711 1 168 . 1 1 15 15 GLN HG2 H 1 2.5102 0.026 . 2 . . . A 109 GLN HG2 . 17711 1 169 . 1 1 15 15 GLN HG3 H 1 2.5102 0.026 . 2 . . . . 109 GLN HG3 . 17711 1 170 . 1 1 15 15 GLN C C 13 178.5272 0.015 . 1 . . . A 109 GLN C . 17711 1 171 . 1 1 15 15 GLN CA C 13 58.5542 0.097 . 1 . . . A 109 GLN CA . 17711 1 172 . 1 1 15 15 GLN CB C 13 28.2922 0.080 . 1 . . . A 109 GLN CB . 17711 1 173 . 1 1 15 15 GLN CG C 13 33.9002 0.099 . 1 . . . A 109 GLN CG . 17711 1 174 . 1 1 15 15 GLN N N 15 117.3562 0.122 . 1 . . . A 109 GLN N . 17711 1 175 . 1 1 16 16 PHE H H 1 8.2272 0.010 . 1 . . . . 110 PHE H . 17711 1 176 . 1 1 16 16 PHE HA H 1 4.4142 0.013 . 1 . . . A 110 PHE HA . 17711 1 177 . 1 1 16 16 PHE HB2 H 1 3.1272 0.016 . 2 . . . A 110 PHE HB2 . 17711 1 178 . 1 1 16 16 PHE HB3 H 1 2.6602 0.010 . 2 . . . . 110 PHE HB3 . 17711 1 179 . 1 1 16 16 PHE HD1 H 1 6.8302 0.000 . 3 . . . A 110 PHE HD1 . 17711 1 180 . 1 1 16 16 PHE HD2 H 1 6.8302 0.000 . 3 . . . A 110 PHE HD2 . 17711 1 181 . 1 1 16 16 PHE C C 13 177.0322 0.000 . 1 . . . A 110 PHE C . 17711 1 182 . 1 1 16 16 PHE CA C 13 60.2962 0.094 . 1 . . . A 110 PHE CA . 17711 1 183 . 1 1 16 16 PHE CB C 13 39.8762 0.149 . 1 . . . A 110 PHE CB . 17711 1 184 . 1 1 16 16 PHE CD1 C 13 133.1052 0.000 . 3 . . . A 110 PHE CD1 . 17711 1 185 . 1 1 16 16 PHE CD2 C 13 133.1052 0.000 . 3 . . . A 110 PHE CD2 . 17711 1 186 . 1 1 16 16 PHE N N 15 121.2282 0.112 . 1 . . . A 110 PHE N . 17711 1 187 . 1 1 17 17 SER H H 1 8.2222 0.010 . 1 . . . . 111 SER H . 17711 1 188 . 1 1 17 17 SER HA H 1 3.8312 0.011 . 1 . . . A 111 SER HA . 17711 1 189 . 1 1 17 17 SER HB2 H 1 4.1832 0.010 . 2 . . . A 111 SER HB2 . 17711 1 190 . 1 1 17 17 SER HB3 H 1 4.1832 0.010 . 2 . . . . 111 SER HB3 . 17711 1 191 . 1 1 17 17 SER C C 13 177.3822 0.000 . 1 . . . A 111 SER C . 17711 1 192 . 1 1 17 17 SER CA C 13 62.1412 0.149 . 1 . . . A 111 SER CA . 17711 1 193 . 1 1 17 17 SER CB C 13 62.8152 0.102 . 1 . . . A 111 SER CB . 17711 1 194 . 1 1 17 17 SER N N 15 113.3222 0.089 . 1 . . . A 111 SER N . 17711 1 195 . 1 1 18 18 THR H H 1 7.5292 0.009 . 1 . . . . 112 THR H . 17711 1 196 . 1 1 18 18 THR HA H 1 3.9192 0.009 . 1 . . . A 112 THR HA . 17711 1 197 . 1 1 18 18 THR HB H 1 4.3062 0.012 . 1 . . . A 112 THR HB . 17711 1 198 . 1 1 18 18 THR HG21 H 1 1.2372 0.009 . 1 . . . A 112 THR HG21 . 17711 1 199 . 1 1 18 18 THR HG22 H 1 1.2372 0.009 . 1 . . . A 112 THR HG22 . 17711 1 200 . 1 1 18 18 THR HG23 H 1 1.2372 0.009 . 1 . . . A 112 THR HG23 . 17711 1 201 . 1 1 18 18 THR C C 13 176.0282 0.000 . 1 . . . A 112 THR C . 17711 1 202 . 1 1 18 18 THR CA C 13 66.6682 0.093 . 1 . . . A 112 THR CA . 17711 1 203 . 1 1 18 18 THR CB C 13 68.5902 0.104 . 1 . . . A 112 THR CB . 17711 1 204 . 1 1 18 18 THR CG2 C 13 22.2242 0.118 . 1 . . . A 112 THR CG2 . 17711 1 205 . 1 1 18 18 THR N N 15 118.3302 0.122 . 1 . . . A 112 THR N . 17711 1 206 . 1 1 19 19 VAL H H 1 7.9672 0.012 . 1 . . . . 113 VAL H . 17711 1 207 . 1 1 19 19 VAL HA H 1 3.6342 0.011 . 1 . . . A 113 VAL HA . 17711 1 208 . 1 1 19 19 VAL HB H 1 2.1912 0.006 . 1 . . . A 113 VAL HB . 17711 1 209 . 1 1 19 19 VAL HG11 H 1 0.9292 0.003 . 1 . . . A 113 VAL HG11 . 17711 1 210 . 1 1 19 19 VAL HG12 H 1 0.9292 0.003 . 1 . . . A 113 VAL HG12 . 17711 1 211 . 1 1 19 19 VAL HG13 H 1 0.9292 0.003 . 1 . . . A 113 VAL HG13 . 17711 1 212 . 1 1 19 19 VAL HG21 H 1 1.2582 0.005 . 1 . . . A 113 VAL HG21 . 17711 1 213 . 1 1 19 19 VAL HG22 H 1 1.2582 0.005 . 1 . . . A 113 VAL HG22 . 17711 1 214 . 1 1 19 19 VAL HG23 H 1 1.2582 0.005 . 1 . . . A 113 VAL HG23 . 17711 1 215 . 1 1 19 19 VAL C C 13 178.4492 0.013 . 1 . . . A 113 VAL C . 17711 1 216 . 1 1 19 19 VAL CA C 13 67.1932 0.116 . 1 . . . A 113 VAL CA . 17711 1 217 . 1 1 19 19 VAL CB C 13 31.8562 0.045 . 1 . . . A 113 VAL CB . 17711 1 218 . 1 1 19 19 VAL CG1 C 13 20.9912 0.076 . 1 . . . A 113 VAL CG1 . 17711 1 219 . 1 1 19 19 VAL CG2 C 13 22.7932 0.082 . 1 . . . A 113 VAL CG2 . 17711 1 220 . 1 1 19 19 VAL N N 15 124.5372 0.091 . 1 . . . A 113 VAL N . 17711 1 221 . 1 1 20 20 ARG H H 1 8.2132 0.016 . 1 . . . . 114 ARG H . 17711 1 222 . 1 1 20 20 ARG HA H 1 3.5332 0.016 . 1 . . . A 114 ARG HA . 17711 1 223 . 1 1 20 20 ARG HB2 H 1 1.7802 0.011 . 2 . . . A 114 ARG HB2 . 17711 1 224 . 1 1 20 20 ARG HB3 H 1 1.4682 0.008 . 2 . . . . 114 ARG HB3 . 17711 1 225 . 1 1 20 20 ARG HG2 H 1 1.6432 0.004 . 2 . . . A 114 ARG HG2 . 17711 1 226 . 1 1 20 20 ARG HG3 H 1 0.4392 0.012 . 2 . . . . 114 ARG HG3 . 17711 1 227 . 1 1 20 20 ARG C C 13 179.3502 0.014 . 1 . . . A 114 ARG C . 17711 1 228 . 1 1 20 20 ARG CA C 13 60.0022 0.150 . 1 . . . A 114 ARG CA . 17711 1 229 . 1 1 20 20 ARG CB C 13 30.3912 0.108 . 1 . . . A 114 ARG CB . 17711 1 230 . 1 1 20 20 ARG CG C 13 27.1032 0.166 . 1 . . . A 114 ARG CG . 17711 1 231 . 1 1 20 20 ARG CD C 13 41.4922 0.000 . 1 . . . A 114 ARG CD . 17711 1 232 . 1 1 20 20 ARG N N 15 118.4812 0.126 . 1 . . . A 114 ARG N . 17711 1 233 . 1 1 21 21 GLN H H 1 7.8222 0.010 . 1 . . . . 115 GLN H . 17711 1 234 . 1 1 21 21 GLN HA H 1 4.0892 0.017 . 1 . . . A 115 GLN HA . 17711 1 235 . 1 1 21 21 GLN HB2 H 1 2.1662 0.020 . 2 . . . A 115 GLN HB2 . 17711 1 236 . 1 1 21 21 GLN HB3 H 1 2.1662 0.020 . 2 . . . . 115 GLN HB3 . 17711 1 237 . 1 1 21 21 GLN HG2 H 1 2.4652 0.031 . 2 . . . A 115 GLN HG2 . 17711 1 238 . 1 1 21 21 GLN HG3 H 1 2.4652 0.031 . 2 . . . . 115 GLN HG3 . 17711 1 239 . 1 1 21 21 GLN C C 13 178.7002 0.035 . 1 . . . A 115 GLN C . 17711 1 240 . 1 1 21 21 GLN CA C 13 58.8282 0.085 . 1 . . . A 115 GLN CA . 17711 1 241 . 1 1 21 21 GLN CB C 13 28.2302 0.116 . 1 . . . A 115 GLN CB . 17711 1 242 . 1 1 21 21 GLN CG C 13 34.0102 0.128 . 1 . . . A 115 GLN CG . 17711 1 243 . 1 1 21 21 GLN N N 15 119.1792 0.117 . 1 . . . A 115 GLN N . 17711 1 244 . 1 1 22 22 ASN H H 1 7.9382 0.013 . 1 . . . . 116 ASN H . 17711 1 245 . 1 1 22 22 ASN HA H 1 4.3342 0.017 . 1 . . . A 116 ASN HA . 17711 1 246 . 1 1 22 22 ASN HB2 H 1 2.5832 0.016 . 2 . . . A 116 ASN HB2 . 17711 1 247 . 1 1 22 22 ASN HB3 H 1 2.5832 0.016 . 2 . . . . 116 ASN HB3 . 17711 1 248 . 1 1 22 22 ASN C C 13 178.1002 0.000 . 1 . . . A 116 ASN C . 17711 1 249 . 1 1 22 22 ASN CA C 13 56.0522 0.113 . 1 . . . A 116 ASN CA . 17711 1 250 . 1 1 22 22 ASN CB C 13 37.5262 0.111 . 1 . . . A 116 ASN CB . 17711 1 251 . 1 1 22 22 ASN N N 15 120.0542 0.058 . 1 . . . A 116 ASN N . 17711 1 252 . 1 1 23 23 VAL H H 1 8.5252 0.010 . 1 . . . . 117 VAL H . 17711 1 253 . 1 1 23 23 VAL HA H 1 3.6992 0.007 . 1 . . . A 117 VAL HA . 17711 1 254 . 1 1 23 23 VAL HB H 1 2.1982 0.007 . 1 . . . A 117 VAL HB . 17711 1 255 . 1 1 23 23 VAL HG11 H 1 0.9302 0.008 . 1 . . . A 117 VAL HG11 . 17711 1 256 . 1 1 23 23 VAL HG12 H 1 0.9302 0.008 . 1 . . . A 117 VAL HG12 . 17711 1 257 . 1 1 23 23 VAL HG13 H 1 0.9302 0.008 . 1 . . . A 117 VAL HG13 . 17711 1 258 . 1 1 23 23 VAL HG21 H 1 1.0442 0.013 . 1 . . . A 117 VAL HG21 . 17711 1 259 . 1 1 23 23 VAL HG22 H 1 1.0442 0.013 . 1 . . . A 117 VAL HG22 . 17711 1 260 . 1 1 23 23 VAL HG23 H 1 1.0442 0.013 . 1 . . . A 117 VAL HG23 . 17711 1 261 . 1 1 23 23 VAL C C 13 178.1032 0.006 . 1 . . . A 117 VAL C . 17711 1 262 . 1 1 23 23 VAL CA C 13 66.9072 0.168 . 1 . . . A 117 VAL CA . 17711 1 263 . 1 1 23 23 VAL CB C 13 31.5752 0.070 . 1 . . . A 117 VAL CB . 17711 1 264 . 1 1 23 23 VAL CG1 C 13 21.2182 0.126 . 1 . . . A 117 VAL CG1 . 17711 1 265 . 1 1 23 23 VAL CG2 C 13 24.0142 0.086 . 1 . . . A 117 VAL CG2 . 17711 1 266 . 1 1 23 23 VAL N N 15 122.2512 0.077 . 1 . . . A 117 VAL N . 17711 1 267 . 1 1 24 24 ASN H H 1 7.7852 0.008 . 1 . . . . 118 ASN H . 17711 1 268 . 1 1 24 24 ASN HA H 1 4.4342 0.015 . 1 . . . A 118 ASN HA . 17711 1 269 . 1 1 24 24 ASN HB2 H 1 2.8502 0.008 . 2 . . . A 118 ASN HB2 . 17711 1 270 . 1 1 24 24 ASN HB3 H 1 2.8502 0.008 . 2 . . . . 118 ASN HB3 . 17711 1 271 . 1 1 24 24 ASN C C 13 178.0862 0.013 . 1 . . . A 118 ASN C . 17711 1 272 . 1 1 24 24 ASN CA C 13 56.5012 0.157 . 1 . . . A 118 ASN CA . 17711 1 273 . 1 1 24 24 ASN CB C 13 38.9542 0.104 . 1 . . . A 118 ASN CB . 17711 1 274 . 1 1 24 24 ASN N N 15 116.0502 0.077 . 1 . . . A 118 ASN N . 17711 1 275 . 1 1 25 25 LYS H H 1 8.2832 0.010 . 1 . . . . 119 LYS H . 17711 1 276 . 1 1 25 25 LYS HA H 1 4.0432 0.008 . 1 . . . A 119 LYS HA . 17711 1 277 . 1 1 25 25 LYS HB2 H 1 1.7792 0.013 . 2 . . . A 119 LYS HB2 . 17711 1 278 . 1 1 25 25 LYS HB3 H 1 1.5112 0.013 . 2 . . . . 119 LYS HB3 . 17711 1 279 . 1 1 25 25 LYS HG2 H 1 1.2662 0.013 . 2 . . . A 119 LYS HG2 . 17711 1 280 . 1 1 25 25 LYS HG3 H 1 1.0332 0.015 . 2 . . . . 119 LYS HG3 . 17711 1 281 . 1 1 25 25 LYS HD2 H 1 1.5392 0.016 . 2 . . . A 119 LYS HD2 . 17711 1 282 . 1 1 25 25 LYS HD3 H 1 1.5392 0.016 . 2 . . . . 119 LYS HD3 . 17711 1 283 . 1 1 25 25 LYS HE2 H 1 2.8402 0.020 . 2 . . . A 119 LYS HE2 . 17711 1 284 . 1 1 25 25 LYS HE3 H 1 2.8402 0.020 . 2 . . . . 119 LYS HE3 . 17711 1 285 . 1 1 25 25 LYS C C 13 178.5862 0.029 . 1 . . . A 119 LYS C . 17711 1 286 . 1 1 25 25 LYS CA C 13 59.1382 0.144 . 1 . . . A 119 LYS CA . 17711 1 287 . 1 1 25 25 LYS CB C 13 32.8842 0.100 . 1 . . . A 119 LYS CB . 17711 1 288 . 1 1 25 25 LYS CG C 13 24.7682 0.092 . 1 . . . A 119 LYS CG . 17711 1 289 . 1 1 25 25 LYS CD C 13 29.3842 0.087 . 1 . . . A 119 LYS CD . 17711 1 290 . 1 1 25 25 LYS CE C 13 41.7572 0.097 . 1 . . . A 119 LYS CE . 17711 1 291 . 1 1 25 25 LYS N N 15 119.4252 0.109 . 1 . . . A 119 LYS N . 17711 1 292 . 1 1 26 26 HIS H H 1 7.6562 0.021 . 1 . . . . 120 HIS H . 17711 1 293 . 1 1 26 26 HIS HA H 1 5.1222 0.012 . 1 . . . A 120 HIS HA . 17711 1 294 . 1 1 26 26 HIS HB2 H 1 3.6712 0.013 . 2 . . . A 120 HIS HB2 . 17711 1 295 . 1 1 26 26 HIS HB3 H 1 3.4502 0.019 . 2 . . . . 120 HIS HB3 . 17711 1 296 . 1 1 26 26 HIS HD2 H 1 6.9002 0.008 . 1 . . . A 120 HIS HD2 . 17711 1 297 . 1 1 26 26 HIS HE1 H 1 7.7572 0.003 . 1 . . . A 120 HIS HE1 . 17711 1 298 . 1 1 26 26 HIS C C 13 175.9552 0.049 . 1 . . . A 120 HIS C . 17711 1 299 . 1 1 26 26 HIS CA C 13 56.4612 0.059 . 1 . . . A 120 HIS CA . 17711 1 300 . 1 1 26 26 HIS CB C 13 31.1242 0.092 . 1 . . . A 120 HIS CB . 17711 1 301 . 1 1 26 26 HIS CD2 C 13 120.1972 0.041 . 1 . . . A 120 HIS CD2 . 17711 1 302 . 1 1 26 26 HIS CE1 C 13 138.4402 0.069 . 1 . . . A 120 HIS CE1 . 17711 1 303 . 1 1 26 26 HIS N N 15 114.2002 0.148 . 1 . . . A 120 HIS N . 17711 1 304 . 1 1 27 27 ARG H H 1 7.8262 0.020 . 1 . . . . 121 ARG H . 17711 1 305 . 1 1 27 27 ARG HA H 1 4.2622 0.008 . 1 . . . A 121 ARG HA . 17711 1 306 . 1 1 27 27 ARG HB2 H 1 2.3332 0.010 . 2 . . . A 121 ARG HB2 . 17711 1 307 . 1 1 27 27 ARG HB3 H 1 1.9762 0.013 . 2 . . . . 121 ARG HB3 . 17711 1 308 . 1 1 27 27 ARG HG2 H 1 1.9682 0.000 . 2 . . . A 121 ARG HG2 . 17711 1 309 . 1 1 27 27 ARG HG3 H 1 1.7192 0.012 . 2 . . . . 121 ARG HG3 . 17711 1 310 . 1 1 27 27 ARG HD2 H 1 3.4332 0.022 . 2 . . . A 121 ARG HD2 . 17711 1 311 . 1 1 27 27 ARG HD3 H 1 3.3722 0.026 . 2 . . . . 121 ARG HD3 . 17711 1 312 . 1 1 27 27 ARG C C 13 177.9342 0.017 . 1 . . . A 121 ARG C . 17711 1 313 . 1 1 27 27 ARG CA C 13 61.2632 0.080 . 1 . . . A 121 ARG CA . 17711 1 314 . 1 1 27 27 ARG CB C 13 30.3982 0.055 . 1 . . . A 121 ARG CB . 17711 1 315 . 1 1 27 27 ARG CG C 13 28.9722 0.115 . 1 . . . A 121 ARG CG . 17711 1 316 . 1 1 27 27 ARG CD C 13 43.5912 0.097 . 1 . . . A 121 ARG CD . 17711 1 317 . 1 1 27 27 ARG N N 15 122.6482 0.073 . 1 . . . A 121 ARG N . 17711 1 318 . 1 1 28 28 SER H H 1 8.7932 0.014 . 1 . . . . 122 SER H . 17711 1 319 . 1 1 28 28 SER HA H 1 4.1012 0.016 . 1 . . . A 122 SER HA . 17711 1 320 . 1 1 28 28 SER HB2 H 1 3.9692 0.013 . 2 . . . A 122 SER HB2 . 17711 1 321 . 1 1 28 28 SER HB3 H 1 3.9692 0.013 . 2 . . . . 122 SER HB3 . 17711 1 322 . 1 1 28 28 SER C C 13 176.5282 0.000 . 1 . . . A 122 SER C . 17711 1 323 . 1 1 28 28 SER CA C 13 61.9742 0.087 . 1 . . . A 122 SER CA . 17711 1 324 . 1 1 28 28 SER CB C 13 62.3892 0.073 . 1 . . . A 122 SER CB . 17711 1 325 . 1 1 28 28 SER N N 15 112.2832 0.080 . 1 . . . A 122 SER N . 17711 1 326 . 1 1 29 29 HIS H H 1 7.8772 0.008 . 1 . . . . 123 HIS H . 17711 1 327 . 1 1 29 29 HIS HA H 1 4.0862 0.029 . 1 . . . A 123 HIS HA . 17711 1 328 . 1 1 29 29 HIS HB2 H 1 2.9462 0.020 . 2 . . . A 123 HIS HB2 . 17711 1 329 . 1 1 29 29 HIS HB3 H 1 2.9462 0.020 . 2 . . . . 123 HIS HB3 . 17711 1 330 . 1 1 29 29 HIS HD2 H 1 7.0272 0.000 . 1 . . . A 123 HIS HD2 . 17711 1 331 . 1 1 29 29 HIS HE1 H 1 7.3892 0.005 . 1 . . . A 123 HIS HE1 . 17711 1 332 . 1 1 29 29 HIS C C 13 177.8902 0.003 . 1 . . . A 123 HIS C . 17711 1 333 . 1 1 29 29 HIS CA C 13 59.2622 0.092 . 1 . . . A 123 HIS CA . 17711 1 334 . 1 1 29 29 HIS CB C 13 29.2352 0.040 . 1 . . . A 123 HIS CB . 17711 1 335 . 1 1 29 29 HIS CE1 C 13 137.5602 0.063 . 1 . . . A 123 HIS CE1 . 17711 1 336 . 1 1 29 29 HIS N N 15 121.3222 0.151 . 1 . . . A 123 HIS N . 17711 1 337 . 1 1 30 30 TRP H H 1 7.8952 0.009 . 1 . . . . 124 TRP H . 17711 1 338 . 1 1 30 30 TRP HA H 1 4.1882 0.023 . 1 . . . A 124 TRP HA . 17711 1 339 . 1 1 30 30 TRP HB2 H 1 3.1032 0.017 . 2 . . . A 124 TRP HB2 . 17711 1 340 . 1 1 30 30 TRP HB3 H 1 3.1032 0.017 . 2 . . . . 124 TRP HB3 . 17711 1 341 . 1 1 30 30 TRP HD1 H 1 7.5542 0.003 . 1 . . . A 124 TRP HD1 . 17711 1 342 . 1 1 30 30 TRP HE1 H 1 10.4712 0.008 . 1 . . . A 124 TRP HE1 . 17711 1 343 . 1 1 30 30 TRP HZ2 H 1 7.3332 0.003 . 1 . . . A 124 TRP HZ2 . 17711 1 344 . 1 1 30 30 TRP HH2 H 1 7.1892 0.001 . 1 . . . A 124 TRP HH2 . 17711 1 345 . 1 1 30 30 TRP C C 13 178.2752 0.010 . 1 . . . A 124 TRP C . 17711 1 346 . 1 1 30 30 TRP CA C 13 60.3682 0.081 . 1 . . . A 124 TRP CA . 17711 1 347 . 1 1 30 30 TRP CB C 13 29.6882 0.034 . 1 . . . A 124 TRP CB . 17711 1 348 . 1 1 30 30 TRP CD1 C 13 128.3502 0.069 . 1 . . . A 124 TRP CD1 . 17711 1 349 . 1 1 30 30 TRP CH2 C 13 122.7542 0.025 . 1 . . . A 124 TRP CH2 . 17711 1 350 . 1 1 30 30 TRP N N 15 120.2172 0.106 . 1 . . . A 124 TRP N . 17711 1 351 . 1 1 30 30 TRP NE1 N 15 128.3712 0.024 . 1 . . . A 124 TRP NE1 . 17711 1 352 . 1 1 31 31 LYS H H 1 8.5192 0.016 . 1 . . . . 125 LYS H . 17711 1 353 . 1 1 31 31 LYS HA H 1 4.0852 0.022 . 1 . . . A 125 LYS HA . 17711 1 354 . 1 1 31 31 LYS HB2 H 1 1.8032 0.016 . 2 . . . A 125 LYS HB2 . 17711 1 355 . 1 1 31 31 LYS HB3 H 1 1.8032 0.016 . 2 . . . . 125 LYS HB3 . 17711 1 356 . 1 1 31 31 LYS HG2 H 1 1.4162 0.027 . 2 . . . A 125 LYS HG2 . 17711 1 357 . 1 1 31 31 LYS HG3 H 1 1.4162 0.027 . 2 . . . . 125 LYS HG3 . 17711 1 358 . 1 1 31 31 LYS HD2 H 1 1.6682 0.018 . 2 . . . A 125 LYS HD2 . 17711 1 359 . 1 1 31 31 LYS HD3 H 1 1.6682 0.018 . 2 . . . . 125 LYS HD3 . 17711 1 360 . 1 1 31 31 LYS HE2 H 1 2.9532 0.024 . 2 . . . A 125 LYS HE2 . 17711 1 361 . 1 1 31 31 LYS HE3 H 1 2.9532 0.024 . 2 . . . . 125 LYS HE3 . 17711 1 362 . 1 1 31 31 LYS C C 13 176.3172 0.036 . 1 . . . A 125 LYS C . 17711 1 363 . 1 1 31 31 LYS CA C 13 58.5492 0.066 . 1 . . . A 125 LYS CA . 17711 1 364 . 1 1 31 31 LYS CB C 13 32.2442 0.088 . 1 . . . A 125 LYS CB . 17711 1 365 . 1 1 31 31 LYS CG C 13 24.9632 0.162 . 1 . . . A 125 LYS CG . 17711 1 366 . 1 1 31 31 LYS CD C 13 29.4082 0.201 . 1 . . . A 125 LYS CD . 17711 1 367 . 1 1 31 31 LYS CE C 13 42.0512 0.107 . 1 . . . A 125 LYS CE . 17711 1 368 . 1 1 31 31 LYS N N 15 117.7372 0.062 . 1 . . . A 125 LYS N . 17711 1 369 . 1 1 32 32 SER H H 1 7.2792 0.015 . 1 . . . . 126 SER H . 17711 1 370 . 1 1 32 32 SER HA H 1 4.4042 0.004 . 1 . . . A 126 SER HA . 17711 1 371 . 1 1 32 32 SER HB2 H 1 3.8832 0.005 . 2 . . . A 126 SER HB2 . 17711 1 372 . 1 1 32 32 SER HB3 H 1 3.8832 0.005 . 2 . . . . 126 SER HB3 . 17711 1 373 . 1 1 32 32 SER C C 13 174.6632 0.023 . 1 . . . A 126 SER C . 17711 1 374 . 1 1 32 32 SER CA C 13 58.8162 0.025 . 1 . . . A 126 SER CA . 17711 1 375 . 1 1 32 32 SER CB C 13 64.0642 0.051 . 1 . . . A 126 SER CB . 17711 1 376 . 1 1 32 32 SER N N 15 111.4372 0.076 . 1 . . . A 126 SER N . 17711 1 377 . 1 1 33 33 GLN H H 1 7.2142 0.013 . 1 . . . . 127 GLN H . 17711 1 378 . 1 1 33 33 GLN HA H 1 4.1432 0.004 . 1 . . . A 127 GLN HA . 17711 1 379 . 1 1 33 33 GLN HB2 H 1 2.1462 0.030 . 2 . . . A 127 GLN HB2 . 17711 1 380 . 1 1 33 33 GLN HB3 H 1 1.9492 0.015 . 2 . . . . 127 GLN HB3 . 17711 1 381 . 1 1 33 33 GLN HG2 H 1 2.2122 0.007 . 2 . . . A 127 GLN HG2 . 17711 1 382 . 1 1 33 33 GLN HG3 H 1 2.0702 0.011 . 2 . . . . 127 GLN HG3 . 17711 1 383 . 1 1 33 33 GLN C C 13 175.6752 0.029 . 1 . . . A 127 GLN C . 17711 1 384 . 1 1 33 33 GLN CA C 13 54.5982 0.059 . 1 . . . A 127 GLN CA . 17711 1 385 . 1 1 33 33 GLN CB C 13 29.0162 0.130 . 1 . . . A 127 GLN CB . 17711 1 386 . 1 1 33 33 GLN CG C 13 33.1082 0.066 . 1 . . . A 127 GLN CG . 17711 1 387 . 1 1 33 33 GLN N N 15 121.0652 0.074 . 1 . . . A 127 GLN N . 17711 1 388 . 1 1 34 34 GLN H H 1 8.6152 0.007 . 1 . . . . 128 GLN H . 17711 1 389 . 1 1 34 34 GLN HA H 1 4.1682 0.011 . 1 . . . A 128 GLN HA . 17711 1 390 . 1 1 34 34 GLN HB2 H 1 2.0222 0.008 . 2 . . . A 128 GLN HB2 . 17711 1 391 . 1 1 34 34 GLN HB3 H 1 2.0222 0.008 . 2 . . . . 128 GLN HB3 . 17711 1 392 . 1 1 34 34 GLN HG2 H 1 2.3972 0.010 . 2 . . . A 128 GLN HG2 . 17711 1 393 . 1 1 34 34 GLN HG3 H 1 2.3972 0.010 . 2 . . . . 128 GLN HG3 . 17711 1 394 . 1 1 34 34 GLN C C 13 176.2522 0.009 . 1 . . . A 128 GLN C . 17711 1 395 . 1 1 34 34 GLN CA C 13 56.2792 0.129 . 1 . . . A 128 GLN CA . 17711 1 396 . 1 1 34 34 GLN CB C 13 29.1232 0.073 . 1 . . . A 128 GLN CB . 17711 1 397 . 1 1 34 34 GLN CG C 13 33.7472 0.106 . 1 . . . A 128 GLN CG . 17711 1 398 . 1 1 34 34 GLN N N 15 122.7902 0.082 . 1 . . . A 128 GLN N . 17711 1 399 . 1 1 35 35 LEU H H 1 8.4782 0.011 . 1 . . . . 129 LEU H . 17711 1 400 . 1 1 35 35 LEU HA H 1 4.3932 0.010 . 1 . . . A 129 LEU HA . 17711 1 401 . 1 1 35 35 LEU HB2 H 1 1.6082 0.000 . 2 . . . A 129 LEU HB2 . 17711 1 402 . 1 1 35 35 LEU HB3 H 1 1.5552 0.012 . 2 . . . . 129 LEU HB3 . 17711 1 403 . 1 1 35 35 LEU HG H 1 1.6732 0.013 . 1 . . . A 129 LEU HG . 17711 1 404 . 1 1 35 35 LEU HD11 H 1 0.8512 0.010 . 2 . . . A 129 LEU HD11 . 17711 1 405 . 1 1 35 35 LEU HD12 H 1 0.8512 0.010 . 2 . . . A 129 LEU HD12 . 17711 1 406 . 1 1 35 35 LEU HD13 H 1 0.8512 0.010 . 2 . . . A 129 LEU HD13 . 17711 1 407 . 1 1 35 35 LEU HD21 H 1 0.8512 0.010 . 2 . . . A 129 LEU HD21 . 17711 1 408 . 1 1 35 35 LEU HD22 H 1 0.8512 0.010 . 2 . . . A 129 LEU HD22 . 17711 1 409 . 1 1 35 35 LEU HD23 H 1 0.8512 0.010 . 2 . . . A 129 LEU HD23 . 17711 1 410 . 1 1 35 35 LEU C C 13 177.3272 0.008 . 1 . . . A 129 LEU C . 17711 1 411 . 1 1 35 35 LEU CA C 13 54.3672 0.052 . 1 . . . A 129 LEU CA . 17711 1 412 . 1 1 35 35 LEU CB C 13 43.2722 0.326 . 1 . . . A 129 LEU CB . 17711 1 413 . 1 1 35 35 LEU CG C 13 26.8262 0.090 . 1 . . . A 129 LEU CG . 17711 1 414 . 1 1 35 35 LEU CD1 C 13 24.1962 0.171 . 2 . . . A 129 LEU CD1 . 17711 1 415 . 1 1 35 35 LEU CD2 C 13 24.1962 0.171 . 2 . . . A 129 LEU CD2 . 17711 1 416 . 1 1 35 35 LEU N N 15 125.9012 0.052 . 1 . . . A 129 LEU N . 17711 1 417 . 1 1 36 36 ASP H H 1 8.5752 0.010 . 1 . . . . 130 ASP H . 17711 1 418 . 1 1 36 36 ASP HA H 1 4.5272 0.012 . 1 . . . A 130 ASP HA . 17711 1 419 . 1 1 36 36 ASP HB2 H 1 2.7462 0.014 . 2 . . . A 130 ASP HB2 . 17711 1 420 . 1 1 36 36 ASP HB3 H 1 2.7462 0.014 . 2 . . . . 130 ASP HB3 . 17711 1 421 . 1 1 36 36 ASP C C 13 177.4252 0.025 . 1 . . . A 130 ASP C . 17711 1 422 . 1 1 36 36 ASP CA C 13 55.0882 0.054 . 1 . . . A 130 ASP CA . 17711 1 423 . 1 1 36 36 ASP CB C 13 41.9682 0.109 . 1 . . . A 130 ASP CB . 17711 1 424 . 1 1 36 36 ASP N N 15 123.3372 0.058 . 1 . . . A 130 ASP N . 17711 1 425 . 1 1 37 37 SER H H 1 8.5572 0.010 . 1 . . . . 131 SER H . 17711 1 426 . 1 1 37 37 SER HA H 1 4.2022 0.012 . 1 . . . A 131 SER HA . 17711 1 427 . 1 1 37 37 SER HB2 H 1 3.9392 0.008 . 2 . . . A 131 SER HB2 . 17711 1 428 . 1 1 37 37 SER HB3 H 1 3.9392 0.008 . 2 . . . . 131 SER HB3 . 17711 1 429 . 1 1 37 37 SER C C 13 174.6322 0.000 . 1 . . . A 131 SER C . 17711 1 430 . 1 1 37 37 SER CA C 13 60.4652 0.110 . 1 . . . A 131 SER CA . 17711 1 431 . 1 1 37 37 SER CB C 13 63.1702 0.100 . 1 . . . A 131 SER CB . 17711 1 432 . 1 1 37 37 SER N N 15 117.8912 0.050 . 1 . . . A 131 SER N . 17711 1 433 . 1 1 38 38 ASN H H 1 8.6202 0.008 . 1 . . . . 132 ASN H . 17711 1 434 . 1 1 38 38 ASN HA H 1 4.6722 0.011 . 1 . . . A 132 ASN HA . 17711 1 435 . 1 1 38 38 ASN HB2 H 1 2.9632 0.015 . 2 . . . A 132 ASN HB2 . 17711 1 436 . 1 1 38 38 ASN HB3 H 1 2.8512 0.009 . 2 . . . . 132 ASN HB3 . 17711 1 437 . 1 1 38 38 ASN C C 13 174.7532 0.024 . 1 . . . A 132 ASN C . 17711 1 438 . 1 1 38 38 ASN CA C 13 53.6732 0.117 . 1 . . . A 132 ASN CA . 17711 1 439 . 1 1 38 38 ASN CB C 13 38.3342 0.114 . 1 . . . A 132 ASN CB . 17711 1 440 . 1 1 38 38 ASN N N 15 118.0462 0.077 . 1 . . . A 132 ASN N . 17711 1 441 . 1 1 39 39 VAL H H 1 7.7982 0.011 . 1 . . . . 133 VAL H . 17711 1 442 . 1 1 39 39 VAL HA H 1 3.7872 0.011 . 1 . . . A 133 VAL HA . 17711 1 443 . 1 1 39 39 VAL HB H 1 2.1352 0.008 . 1 . . . A 133 VAL HB . 17711 1 444 . 1 1 39 39 VAL HG11 H 1 0.8512 0.019 . 1 . . . A 133 VAL HG11 . 17711 1 445 . 1 1 39 39 VAL HG12 H 1 0.8512 0.019 . 1 . . . A 133 VAL HG12 . 17711 1 446 . 1 1 39 39 VAL HG13 H 1 0.8512 0.019 . 1 . . . A 133 VAL HG13 . 17711 1 447 . 1 1 39 39 VAL HG21 H 1 0.6652 0.011 . 1 . . . A 133 VAL HG21 . 17711 1 448 . 1 1 39 39 VAL HG22 H 1 0.6652 0.011 . 1 . . . A 133 VAL HG22 . 17711 1 449 . 1 1 39 39 VAL HG23 H 1 0.6652 0.011 . 1 . . . A 133 VAL HG23 . 17711 1 450 . 1 1 39 39 VAL C C 13 174.8932 0.033 . 1 . . . A 133 VAL C . 17711 1 451 . 1 1 39 39 VAL CA C 13 62.5492 0.079 . 1 . . . A 133 VAL CA . 17711 1 452 . 1 1 39 39 VAL CB C 13 31.8792 0.152 . 1 . . . A 133 VAL CB . 17711 1 453 . 1 1 39 39 VAL CG1 C 13 21.2162 0.071 . 1 . . . A 133 VAL CG1 . 17711 1 454 . 1 1 39 39 VAL CG2 C 13 21.5092 0.076 . 1 . . . A 133 VAL CG2 . 17711 1 455 . 1 1 39 39 VAL N N 15 121.4042 0.028 . 1 . . . A 133 VAL N . 17711 1 456 . 1 1 40 40 THR H H 1 8.2062 0.010 . 1 . . . . 134 THR H . 17711 1 457 . 1 1 40 40 THR HA H 1 4.2312 0.008 . 1 . . . A 134 THR HA . 17711 1 458 . 1 1 40 40 THR HB H 1 3.8802 0.007 . 1 . . . A 134 THR HB . 17711 1 459 . 1 1 40 40 THR HG21 H 1 0.9922 0.012 . 1 . . . A 134 THR HG21 . 17711 1 460 . 1 1 40 40 THR HG22 H 1 0.9922 0.012 . 1 . . . A 134 THR HG22 . 17711 1 461 . 1 1 40 40 THR HG23 H 1 0.9922 0.012 . 1 . . . A 134 THR HG23 . 17711 1 462 . 1 1 40 40 THR C C 13 173.7982 0.000 . 1 . . . A 134 THR C . 17711 1 463 . 1 1 40 40 THR CA C 13 60.7952 0.082 . 1 . . . A 134 THR CA . 17711 1 464 . 1 1 40 40 THR CB C 13 69.5482 0.109 . 1 . . . A 134 THR CB . 17711 1 465 . 1 1 40 40 THR CG2 C 13 21.4242 0.119 . 1 . . . A 134 THR CG2 . 17711 1 466 . 1 1 40 40 THR N N 15 123.7512 0.085 . 1 . . . A 134 THR N . 17711 1 467 . 1 1 41 41 MET H H 1 8.5712 0.009 . 1 . . . . 135 MET H . 17711 1 468 . 1 1 41 41 MET HA H 1 3.3302 0.007 . 1 . . . A 135 MET HA . 17711 1 469 . 1 1 41 41 MET HB2 H 1 2.1612 0.088 . 2 . . . A 135 MET HB2 . 17711 1 470 . 1 1 41 41 MET HB3 H 1 2.0222 0.015 . 2 . . . . 135 MET HB3 . 17711 1 471 . 1 1 41 41 MET HG2 H 1 1.6202 0.018 . 2 . . . A 135 MET HG2 . 17711 1 472 . 1 1 41 41 MET HG3 H 1 1.6202 0.018 . 2 . . . . 135 MET HG3 . 17711 1 473 . 1 1 41 41 MET HE1 H 1 2.1482 0.005 . 1 . . . A 135 MET HE1 . 17711 1 474 . 1 1 41 41 MET HE2 H 1 2.1482 0.005 . 1 . . . A 135 MET HE2 . 17711 1 475 . 1 1 41 41 MET HE3 H 1 2.1482 0.005 . 1 . . . A 135 MET HE3 . 17711 1 476 . 1 1 41 41 MET C C 13 172.9952 0.000 . 1 . . . A 135 MET C . 17711 1 477 . 1 1 41 41 MET CA C 13 53.7142 0.100 . 1 . . . A 135 MET CA . 17711 1 478 . 1 1 41 41 MET CB C 13 32.1752 0.041 . 1 . . . A 135 MET CB . 17711 1 479 . 1 1 41 41 MET CG C 13 32.2362 0.088 . 1 . . . A 135 MET CG . 17711 1 480 . 1 1 41 41 MET CE C 13 17.1812 0.045 . 1 . . . A 135 MET CE . 17711 1 481 . 1 1 41 41 MET N N 15 126.7302 0.049 . 1 . . . A 135 MET N . 17711 1 482 . 1 1 42 42 PRO HA H 1 4.0712 0.009 . 1 . . . A 136 PRO HA . 17711 1 483 . 1 1 42 42 PRO HB2 H 1 1.7952 0.005 . 2 . . . A 136 PRO HB2 . 17711 1 484 . 1 1 42 42 PRO HB3 H 1 0.4422 0.013 . 2 . . . . 136 PRO HB3 . 17711 1 485 . 1 1 42 42 PRO HG2 H 1 0.8782 0.012 . 2 . . . A 136 PRO HG2 . 17711 1 486 . 1 1 42 42 PRO HG3 H 1 -0.1008 0.011 . 2 . . . . 136 PRO HG3 . 17711 1 487 . 1 1 42 42 PRO HD2 H 1 2.3482 0.010 . 2 . . . A 136 PRO HD2 . 17711 1 488 . 1 1 42 42 PRO HD3 H 1 0.3352 0.089 . 2 . . . . 136 PRO HD3 . 17711 1 489 . 1 1 42 42 PRO C C 13 175.4962 0.018 . 1 . . . A 136 PRO C . 17711 1 490 . 1 1 42 42 PRO CA C 13 61.5362 0.082 . 1 . . . A 136 PRO CA . 17711 1 491 . 1 1 42 42 PRO CB C 13 30.4772 0.116 . 1 . . . A 136 PRO CB . 17711 1 492 . 1 1 42 42 PRO CG C 13 26.5822 0.154 . 1 . . . A 136 PRO CG . 17711 1 493 . 1 1 42 42 PRO CD C 13 48.8102 0.108 . 1 . . . A 136 PRO CD . 17711 1 494 . 1 1 43 43 LYS H H 1 8.7352 0.005 . 1 . . . . 137 LYS H . 17711 1 495 . 1 1 43 43 LYS HA H 1 4.2522 0.006 . 1 . . . A 137 LYS HA . 17711 1 496 . 1 1 43 43 LYS HB2 H 1 2.1582 0.010 . 2 . . . A 137 LYS HB2 . 17711 1 497 . 1 1 43 43 LYS HB3 H 1 1.7112 0.010 . 2 . . . . 137 LYS HB3 . 17711 1 498 . 1 1 43 43 LYS HG2 H 1 1.6342 0.003 . 2 . . . A 137 LYS HG2 . 17711 1 499 . 1 1 43 43 LYS HG3 H 1 1.5692 0.002 . 2 . . . . 137 LYS HG3 . 17711 1 500 . 1 1 43 43 LYS HD2 H 1 1.7282 0.014 . 2 . . . A 137 LYS HD2 . 17711 1 501 . 1 1 43 43 LYS HD3 H 1 1.7282 0.014 . 2 . . . . 137 LYS HD3 . 17711 1 502 . 1 1 43 43 LYS HE2 H 1 3.0262 0.003 . 2 . . . A 137 LYS HE2 . 17711 1 503 . 1 1 43 43 LYS HE3 H 1 3.0262 0.003 . 2 . . . . 137 LYS HE3 . 17711 1 504 . 1 1 43 43 LYS C C 13 179.9642 0.001 . 1 . . . A 137 LYS C . 17711 1 505 . 1 1 43 43 LYS CA C 13 56.6512 0.043 . 1 . . . A 137 LYS CA . 17711 1 506 . 1 1 43 43 LYS CB C 13 32.2932 0.078 . 1 . . . A 137 LYS CB . 17711 1 507 . 1 1 43 43 LYS CG C 13 25.4372 0.050 . 1 . . . A 137 LYS CG . 17711 1 508 . 1 1 43 43 LYS CD C 13 28.8272 0.063 . 1 . . . A 137 LYS CD . 17711 1 509 . 1 1 43 43 LYS CE C 13 41.9882 0.119 . 1 . . . A 137 LYS CE . 17711 1 510 . 1 1 43 43 LYS N N 15 120.6472 0.086 . 1 . . . A 137 LYS N . 17711 1 511 . 1 1 44 44 SER H H 1 9.0942 0.009 . 1 . . . . 138 SER H . 17711 1 512 . 1 1 44 44 SER HA H 1 4.1702 0.021 . 1 . . . A 138 SER HA . 17711 1 513 . 1 1 44 44 SER HB2 H 1 3.8982 0.022 . 2 . . . A 138 SER HB2 . 17711 1 514 . 1 1 44 44 SER HB3 H 1 3.8982 0.022 . 2 . . . . 138 SER HB3 . 17711 1 515 . 1 1 44 44 SER C C 13 175.1712 0.000 . 1 . . . A 138 SER C . 17711 1 516 . 1 1 44 44 SER CA C 13 63.3242 0.119 . 1 . . . A 138 SER CA . 17711 1 517 . 1 1 44 44 SER CB C 13 62.8602 0.125 . 1 . . . A 138 SER CB . 17711 1 518 . 1 1 44 44 SER N N 15 118.9292 0.076 . 1 . . . A 138 SER N . 17711 1 519 . 1 1 45 45 GLU H H 1 9.3032 0.006 . 1 . . . . 139 GLU H . 17711 1 520 . 1 1 45 45 GLU HA H 1 4.3722 0.012 . 1 . . . A 139 GLU HA . 17711 1 521 . 1 1 45 45 GLU HB2 H 1 2.1652 0.004 . 2 . . . A 139 GLU HB2 . 17711 1 522 . 1 1 45 45 GLU HB3 H 1 1.7452 0.003 . 2 . . . . 139 GLU HB3 . 17711 1 523 . 1 1 45 45 GLU HG2 H 1 2.3322 0.005 . 2 . . . A 139 GLU HG2 . 17711 1 524 . 1 1 45 45 GLU HG3 H 1 2.2552 0.002 . 2 . . . . 139 GLU HG3 . 17711 1 525 . 1 1 45 45 GLU C C 13 175.7382 0.018 . 1 . . . A 139 GLU C . 17711 1 526 . 1 1 45 45 GLU CA C 13 57.5432 0.105 . 1 . . . A 139 GLU CA . 17711 1 527 . 1 1 45 45 GLU CB C 13 28.8012 0.033 . 1 . . . A 139 GLU CB . 17711 1 528 . 1 1 45 45 GLU CG C 13 35.9312 0.169 . 1 . . . A 139 GLU CG . 17711 1 529 . 1 1 45 45 GLU N N 15 117.1372 0.063 . 1 . . . A 139 GLU N . 17711 1 530 . 1 1 46 46 ASP H H 1 7.8542 0.008 . 1 . . . . 140 ASP H . 17711 1 531 . 1 1 46 46 ASP HA H 1 4.6262 0.019 . 1 . . . A 140 ASP HA . 17711 1 532 . 1 1 46 46 ASP HB2 H 1 3.2742 0.010 . 2 . . . A 140 ASP HB2 . 17711 1 533 . 1 1 46 46 ASP HB3 H 1 2.3712 0.015 . 2 . . . . 140 ASP HB3 . 17711 1 534 . 1 1 46 46 ASP C C 13 173.7752 0.000 . 1 . . . A 140 ASP C . 17711 1 535 . 1 1 46 46 ASP CA C 13 52.4452 0.092 . 1 . . . A 140 ASP CA . 17711 1 536 . 1 1 46 46 ASP CB C 13 39.8642 0.113 . 1 . . . A 140 ASP CB . 17711 1 537 . 1 1 46 46 ASP N N 15 121.2752 0.084 . 1 . . . A 140 ASP N . 17711 1 538 . 1 1 47 47 GLU H H 1 7.3992 0.009 . 1 . . . . 141 GLU H . 17711 1 539 . 1 1 47 47 GLU HA H 1 2.3172 0.013 . 1 . . . A 141 GLU HA . 17711 1 540 . 1 1 47 47 GLU HB2 H 1 1.6562 0.010 . 2 . . . A 141 GLU HB2 . 17711 1 541 . 1 1 47 47 GLU HB3 H 1 1.4532 0.023 . 2 . . . . 141 GLU HB3 . 17711 1 542 . 1 1 47 47 GLU HG2 H 1 1.9382 0.018 . 2 . . . A 141 GLU HG2 . 17711 1 543 . 1 1 47 47 GLU HG3 H 1 1.7362 0.016 . 2 . . . . 141 GLU HG3 . 17711 1 544 . 1 1 47 47 GLU C C 13 177.6952 0.035 . 1 . . . A 141 GLU C . 17711 1 545 . 1 1 47 47 GLU CA C 13 59.2412 0.104 . 1 . . . A 141 GLU CA . 17711 1 546 . 1 1 47 47 GLU CB C 13 29.7792 0.177 . 1 . . . A 141 GLU CB . 17711 1 547 . 1 1 47 47 GLU CG C 13 35.4032 0.061 . 1 . . . A 141 GLU CG . 17711 1 548 . 1 1 47 47 GLU N N 15 127.7902 0.047 . 1 . . . A 141 GLU N . 17711 1 549 . 1 1 48 48 GLU H H 1 8.5562 0.011 . 1 . . . . 142 GLU H . 17711 1 550 . 1 1 48 48 GLU HA H 1 3.9212 0.037 . 1 . . . A 142 GLU HA . 17711 1 551 . 1 1 48 48 GLU HB2 H 1 1.9992 0.012 . 2 . . . A 142 GLU HB2 . 17711 1 552 . 1 1 48 48 GLU HB3 H 1 1.9992 0.012 . 2 . . . . 142 GLU HB3 . 17711 1 553 . 1 1 48 48 GLU HG2 H 1 2.3322 0.022 . 2 . . . A 142 GLU HG2 . 17711 1 554 . 1 1 48 48 GLU HG3 H 1 2.3322 0.022 . 2 . . . . 142 GLU HG3 . 17711 1 555 . 1 1 48 48 GLU C C 13 179.4542 0.011 . 1 . . . A 142 GLU C . 17711 1 556 . 1 1 48 48 GLU CA C 13 58.8912 0.064 . 1 . . . A 142 GLU CA . 17711 1 557 . 1 1 48 48 GLU CB C 13 29.0182 0.085 . 1 . . . A 142 GLU CB . 17711 1 558 . 1 1 48 48 GLU CG C 13 36.3882 0.106 . 1 . . . A 142 GLU CG . 17711 1 559 . 1 1 48 48 GLU N N 15 116.4052 0.123 . 1 . . . A 142 GLU N . 17711 1 560 . 1 1 49 49 GLY H H 1 8.2742 0.007 . 1 . . . . 143 GLY H . 17711 1 561 . 1 1 49 49 GLY HA2 H 1 3.6392 0.014 . 2 . . . A 143 GLY HA2 . 17711 1 562 . 1 1 49 49 GLY HA3 H 1 3.6392 0.014 . 2 . . . . 143 GLY HA3 . 17711 1 563 . 1 1 49 49 GLY C C 13 177.6242 0.008 . 1 . . . A 143 GLY C . 17711 1 564 . 1 1 49 49 GLY CA C 13 47.2912 0.099 . 1 . . . A 143 GLY CA . 17711 1 565 . 1 1 49 49 GLY N N 15 108.7152 0.104 . 1 . . . A 143 GLY N . 17711 1 566 . 1 1 50 50 TRP H H 1 8.4292 0.007 . 1 . . . . 144 TRP H . 17711 1 567 . 1 1 50 50 TRP HA H 1 4.1782 0.016 . 1 . . . A 144 TRP HA . 17711 1 568 . 1 1 50 50 TRP HB2 H 1 3.3022 0.014 . 2 . . . A 144 TRP HB2 . 17711 1 569 . 1 1 50 50 TRP HB3 H 1 3.0282 0.014 . 2 . . . . 144 TRP HB3 . 17711 1 570 . 1 1 50 50 TRP HD1 H 1 7.2712 0.009 . 1 . . . A 144 TRP HD1 . 17711 1 571 . 1 1 50 50 TRP HE1 H 1 8.1462 0.006 . 1 . . . A 144 TRP HE1 . 17711 1 572 . 1 1 50 50 TRP HZ2 H 1 7.0962 0.004 . 1 . . . A 144 TRP HZ2 . 17711 1 573 . 1 1 50 50 TRP HZ3 H 1 6.4482 0.002 . 1 . . . A 144 TRP HZ3 . 17711 1 574 . 1 1 50 50 TRP HH2 H 1 6.7262 0.005 . 1 . . . A 144 TRP HH2 . 17711 1 575 . 1 1 50 50 TRP C C 13 178.4112 0.015 . 1 . . . A 144 TRP C . 17711 1 576 . 1 1 50 50 TRP CA C 13 61.9702 0.066 . 1 . . . A 144 TRP CA . 17711 1 577 . 1 1 50 50 TRP CB C 13 30.1102 0.135 . 1 . . . A 144 TRP CB . 17711 1 578 . 1 1 50 50 TRP CD1 C 13 128.2382 0.087 . 1 . . . A 144 TRP CD1 . 17711 1 579 . 1 1 50 50 TRP CZ2 C 13 115.1562 0.182 . 1 . . . A 144 TRP CZ2 . 17711 1 580 . 1 1 50 50 TRP CH2 C 13 123.6472 0.087 . 1 . . . A 144 TRP CH2 . 17711 1 581 . 1 1 50 50 TRP N N 15 123.2572 0.140 . 1 . . . A 144 TRP N . 17711 1 582 . 1 1 50 50 TRP NE1 N 15 127.0622 0.034 . 1 . . . A 144 TRP NE1 . 17711 1 583 . 1 1 51 51 LYS H H 1 7.9552 0.008 . 1 . . . . 145 LYS H . 17711 1 584 . 1 1 51 51 LYS HA H 1 3.4672 0.008 . 1 . . . A 145 LYS HA . 17711 1 585 . 1 1 51 51 LYS HB2 H 1 1.8022 0.024 . 2 . . . A 145 LYS HB2 . 17711 1 586 . 1 1 51 51 LYS HB3 H 1 1.8022 0.024 . 2 . . . . 145 LYS HB3 . 17711 1 587 . 1 1 51 51 LYS HG2 H 1 1.6582 0.014 . 2 . . . A 145 LYS HG2 . 17711 1 588 . 1 1 51 51 LYS HG3 H 1 1.6582 0.014 . 2 . . . . 145 LYS HG3 . 17711 1 589 . 1 1 51 51 LYS C C 13 177.6482 0.003 . 1 . . . A 145 LYS C . 17711 1 590 . 1 1 51 51 LYS CA C 13 61.3962 0.107 . 1 . . . A 145 LYS CA . 17711 1 591 . 1 1 51 51 LYS CB C 13 32.3202 0.119 . 1 . . . A 145 LYS CB . 17711 1 592 . 1 1 51 51 LYS CG C 13 27.1042 0.146 . 1 . . . A 145 LYS CG . 17711 1 593 . 1 1 51 51 LYS N N 15 119.4302 0.104 . 1 . . . A 145 LYS N . 17711 1 594 . 1 1 52 52 LYS H H 1 7.6502 0.008 . 1 . . . . 146 LYS H . 17711 1 595 . 1 1 52 52 LYS HA H 1 3.7532 0.019 . 1 . . . A 146 LYS HA . 17711 1 596 . 1 1 52 52 LYS HB2 H 1 1.7592 0.005 . 2 . . . A 146 LYS HB2 . 17711 1 597 . 1 1 52 52 LYS HB3 H 1 1.7592 0.005 . 2 . . . . 146 LYS HB3 . 17711 1 598 . 1 1 52 52 LYS HG2 H 1 1.5252 0.007 . 2 . . . A 146 LYS HG2 . 17711 1 599 . 1 1 52 52 LYS HG3 H 1 1.2982 0.005 . 2 . . . . 146 LYS HG3 . 17711 1 600 . 1 1 52 52 LYS HD2 H 1 1.6642 0.017 . 2 . . . A 146 LYS HD2 . 17711 1 601 . 1 1 52 52 LYS HD3 H 1 1.6642 0.017 . 2 . . . . 146 LYS HD3 . 17711 1 602 . 1 1 52 52 LYS HE2 H 1 2.9182 0.010 . 2 . . . A 146 LYS HE2 . 17711 1 603 . 1 1 52 52 LYS HE3 H 1 2.9182 0.010 . 2 . . . . 146 LYS HE3 . 17711 1 604 . 1 1 52 52 LYS C C 13 179.4912 0.028 . 1 . . . A 146 LYS C . 17711 1 605 . 1 1 52 52 LYS CA C 13 59.4672 0.085 . 1 . . . A 146 LYS CA . 17711 1 606 . 1 1 52 52 LYS CB C 13 32.5542 0.063 . 1 . . . A 146 LYS CB . 17711 1 607 . 1 1 52 52 LYS CG C 13 26.2222 0.083 . 1 . . . A 146 LYS CG . 17711 1 608 . 1 1 52 52 LYS CD C 13 29.5262 0.192 . 1 . . . A 146 LYS CD . 17711 1 609 . 1 1 52 52 LYS CE C 13 42.0682 0.147 . 1 . . . A 146 LYS CE . 17711 1 610 . 1 1 52 52 LYS N N 15 116.6852 0.042 . 1 . . . A 146 LYS N . 17711 1 611 . 1 1 53 53 PHE H H 1 8.4332 0.010 . 1 . . . . 147 PHE H . 17711 1 612 . 1 1 53 53 PHE HA H 1 4.1482 0.008 . 1 . . . A 147 PHE HA . 17711 1 613 . 1 1 53 53 PHE HB2 H 1 3.0312 0.023 . 2 . . . A 147 PHE HB2 . 17711 1 614 . 1 1 53 53 PHE HB3 H 1 2.8242 0.013 . 2 . . . . 147 PHE HB3 . 17711 1 615 . 1 1 53 53 PHE HD1 H 1 7.1412 0.005 . 3 . . . A 147 PHE HD1 . 17711 1 616 . 1 1 53 53 PHE HD2 H 1 7.1412 0.005 . 3 . . . A 147 PHE HD2 . 17711 1 617 . 1 1 53 53 PHE HE1 H 1 6.8392 0.017 . 3 . . . A 147 PHE HE1 . 17711 1 618 . 1 1 53 53 PHE HE2 H 1 6.8392 0.017 . 3 . . . A 147 PHE HE2 . 17711 1 619 . 1 1 53 53 PHE C C 13 175.4162 0.037 . 1 . . . A 147 PHE C . 17711 1 620 . 1 1 53 53 PHE CA C 13 61.7822 0.101 . 1 . . . A 147 PHE CA . 17711 1 621 . 1 1 53 53 PHE CB C 13 40.3962 0.097 . 1 . . . A 147 PHE CB . 17711 1 622 . 1 1 53 53 PHE CD1 C 13 133.3442 0.065 . 3 . . . A 147 PHE CD1 . 17711 1 623 . 1 1 53 53 PHE CD2 C 13 133.3442 0.065 . 3 . . . A 147 PHE CD2 . 17711 1 624 . 1 1 53 53 PHE CE1 C 13 130.8072 0.199 . 3 . . . A 147 PHE CE1 . 17711 1 625 . 1 1 53 53 PHE CE2 C 13 130.8072 0.199 . 3 . . . A 147 PHE CE2 . 17711 1 626 . 1 1 53 53 PHE N N 15 122.7912 0.128 . 1 . . . A 147 PHE N . 17711 1 627 . 1 1 54 54 CYS H H 1 8.1422 0.011 . 1 . . . . 148 CYS H . 17711 1 628 . 1 1 54 54 CYS HA H 1 4.0212 0.008 . 1 . . . A 148 CYS HA . 17711 1 629 . 1 1 54 54 CYS HB2 H 1 2.0102 0.007 . 2 . . . A 148 CYS HB2 . 17711 1 630 . 1 1 54 54 CYS HB3 H 1 1.5732 0.011 . 2 . . . . 148 CYS HB3 . 17711 1 631 . 1 1 54 54 CYS C C 13 175.1462 0.025 . 1 . . . A 148 CYS C . 17711 1 632 . 1 1 54 54 CYS CA C 13 62.2652 0.129 . 1 . . . A 148 CYS CA . 17711 1 633 . 1 1 54 54 CYS CB C 13 27.8802 0.142 . 1 . . . A 148 CYS CB . 17711 1 634 . 1 1 54 54 CYS N N 15 113.2762 0.120 . 1 . . . A 148 CYS N . 17711 1 635 . 1 1 55 55 LEU H H 1 7.6832 0.012 . 1 . . . . 149 LEU H . 17711 1 636 . 1 1 55 55 LEU HA H 1 4.2182 0.011 . 1 . . . A 149 LEU HA . 17711 1 637 . 1 1 55 55 LEU HB2 H 1 1.3232 0.013 . 2 . . . A 149 LEU HB2 . 17711 1 638 . 1 1 55 55 LEU HB3 H 1 1.0082 0.016 . 2 . . . . 149 LEU HB3 . 17711 1 639 . 1 1 55 55 LEU HG H 1 0.9152 0.009 . 1 . . . A 149 LEU HG . 17711 1 640 . 1 1 55 55 LEU HD11 H 1 -0.6808 0.011 . 1 . . . A 149 LEU HD11 . 17711 1 641 . 1 1 55 55 LEU HD12 H 1 -0.6808 0.011 . 1 . . . A 149 LEU HD12 . 17711 1 642 . 1 1 55 55 LEU HD13 H 1 -0.6808 0.011 . 1 . . . A 149 LEU HD13 . 17711 1 643 . 1 1 55 55 LEU HD21 H 1 0.1902 0.007 . 1 . . . A 149 LEU HD21 . 17711 1 644 . 1 1 55 55 LEU HD22 H 1 0.1902 0.007 . 1 . . . A 149 LEU HD22 . 17711 1 645 . 1 1 55 55 LEU HD23 H 1 0.1902 0.007 . 1 . . . A 149 LEU HD23 . 17711 1 646 . 1 1 55 55 LEU C C 13 177.5342 0.007 . 1 . . . A 149 LEU C . 17711 1 647 . 1 1 55 55 LEU CA C 13 54.2522 0.148 . 1 . . . A 149 LEU CA . 17711 1 648 . 1 1 55 55 LEU CB C 13 41.9742 0.136 . 1 . . . A 149 LEU CB . 17711 1 649 . 1 1 55 55 LEU CG C 13 26.5072 0.170 . 1 . . . A 149 LEU CG . 17711 1 650 . 1 1 55 55 LEU CD1 C 13 23.2352 0.084 . 1 . . . A 149 LEU CD1 . 17711 1 651 . 1 1 55 55 LEU CD2 C 13 20.9562 0.103 . 1 . . . A 149 LEU CD2 . 17711 1 652 . 1 1 55 55 LEU N N 15 112.7562 0.105 . 1 . . . A 149 LEU N . 17711 1 653 . 1 1 56 56 GLY H H 1 7.6142 0.009 . 1 . . . . 150 GLY H . 17711 1 654 . 1 1 56 56 GLY HA2 H 1 3.9432 0.016 . 2 . . . A 150 GLY HA2 . 17711 1 655 . 1 1 56 56 GLY HA3 H 1 3.4892 0.008 . 2 . . . . 150 GLY HA3 . 17711 1 656 . 1 1 56 56 GLY C C 13 173.3752 0.052 . 1 . . . A 150 GLY C . 17711 1 657 . 1 1 56 56 GLY CA C 13 44.6662 0.091 . 1 . . . A 150 GLY CA . 17711 1 658 . 1 1 56 56 GLY N N 15 107.0922 0.120 . 1 . . . A 150 GLY N . 17711 1 659 . 1 1 57 57 GLU H H 1 8.3402 0.006 . 1 . . . . 151 GLU H . 17711 1 660 . 1 1 57 57 GLU HG2 H 1 2.3612 0.000 . 2 . . . A 151 GLU HG2 . 17711 1 661 . 1 1 57 57 GLU HG3 H 1 2.3612 0.000 . 2 . . . . 151 GLU HG3 . 17711 1 662 . 1 1 57 57 GLU CG C 13 33.7612 0.000 . 1 . . . A 151 GLU CG . 17711 1 663 . 1 1 57 57 GLU N N 15 118.3642 0.144 . 1 . . . A 151 GLU N . 17711 1 664 . 1 1 58 58 LYS HA H 1 4.1062 0.031 . 1 . . . A 152 LYS HA . 17711 1 665 . 1 1 58 58 LYS HB2 H 1 1.8262 0.000 . 2 . . . A 152 LYS HB2 . 17711 1 666 . 1 1 58 58 LYS HB3 H 1 1.8262 0.000 . 2 . . . . 152 LYS HB3 . 17711 1 667 . 1 1 58 58 LYS HG2 H 1 1.4442 0.014 . 2 . . . A 152 LYS HG2 . 17711 1 668 . 1 1 58 58 LYS HG3 H 1 1.4442 0.014 . 2 . . . . 152 LYS HG3 . 17711 1 669 . 1 1 58 58 LYS HE2 H 1 2.9622 0.021 . 2 . . . A 152 LYS HE2 . 17711 1 670 . 1 1 58 58 LYS HE3 H 1 2.9622 0.021 . 2 . . . . 152 LYS HE3 . 17711 1 671 . 1 1 58 58 LYS C C 13 178.2312 0.000 . 1 . . . A 152 LYS C . 17711 1 672 . 1 1 58 58 LYS CA C 13 58.8852 0.070 . 1 . . . A 152 LYS CA . 17711 1 673 . 1 1 58 58 LYS CB C 13 32.2132 0.176 . 1 . . . A 152 LYS CB . 17711 1 674 . 1 1 58 58 LYS CG C 13 25.0712 0.129 . 1 . . . A 152 LYS CG . 17711 1 675 . 1 1 58 58 LYS CD C 13 29.2412 0.000 . 1 . . . A 152 LYS CD . 17711 1 676 . 1 1 58 58 LYS CE C 13 41.8662 0.074 . 1 . . . A 152 LYS CE . 17711 1 677 . 1 1 59 59 LEU H H 1 8.0752 0.011 . 1 . . . . 153 LEU H . 17711 1 678 . 1 1 59 59 LEU HA H 1 4.3852 0.007 . 1 . . . A 153 LEU HA . 17711 1 679 . 1 1 59 59 LEU HB2 H 1 1.6332 0.015 . 2 . . . A 153 LEU HB2 . 17711 1 680 . 1 1 59 59 LEU HB3 H 1 1.6332 0.015 . 2 . . . . 153 LEU HB3 . 17711 1 681 . 1 1 59 59 LEU HG H 1 1.7302 0.008 . 1 . . . A 153 LEU HG . 17711 1 682 . 1 1 59 59 LEU HD11 H 1 0.9862 0.014 . 2 . . . A 153 LEU HD11 . 17711 1 683 . 1 1 59 59 LEU HD12 H 1 0.9862 0.014 . 2 . . . A 153 LEU HD12 . 17711 1 684 . 1 1 59 59 LEU HD13 H 1 0.9862 0.014 . 2 . . . A 153 LEU HD13 . 17711 1 685 . 1 1 59 59 LEU HD21 H 1 0.9862 0.014 . 2 . . . A 153 LEU HD21 . 17711 1 686 . 1 1 59 59 LEU HD22 H 1 0.9862 0.014 . 2 . . . A 153 LEU HD22 . 17711 1 687 . 1 1 59 59 LEU HD23 H 1 0.9862 0.014 . 2 . . . A 153 LEU HD23 . 17711 1 688 . 1 1 59 59 LEU C C 13 178.4632 0.000 . 1 . . . A 153 LEU C . 17711 1 689 . 1 1 59 59 LEU CA C 13 56.1882 0.075 . 1 . . . A 153 LEU CA . 17711 1 690 . 1 1 59 59 LEU CB C 13 42.1572 0.108 . 1 . . . A 153 LEU CB . 17711 1 691 . 1 1 59 59 LEU CG C 13 27.8492 0.087 . 1 . . . A 153 LEU CG . 17711 1 692 . 1 1 59 59 LEU CD1 C 13 24.4172 0.256 . 2 . . . A 153 LEU CD1 . 17711 1 693 . 1 1 59 59 LEU CD2 C 13 24.4172 0.256 . 2 . . . A 153 LEU CD2 . 17711 1 694 . 1 1 59 59 LEU N N 15 119.6572 0.089 . 1 . . . A 153 LEU N . 17711 1 695 . 1 1 60 60 CYS H H 1 7.6852 0.011 . 1 . . . . 154 CYS H . 17711 1 696 . 1 1 60 60 CYS HA H 1 4.5482 0.008 . 1 . . . A 154 CYS HA . 17711 1 697 . 1 1 60 60 CYS HB2 H 1 2.9472 0.007 . 2 . . . A 154 CYS HB2 . 17711 1 698 . 1 1 60 60 CYS HB3 H 1 2.7162 0.013 . 2 . . . . 154 CYS HB3 . 17711 1 699 . 1 1 60 60 CYS C C 13 174.5262 0.000 . 1 . . . A 154 CYS C . 17711 1 700 . 1 1 60 60 CYS CA C 13 60.4722 0.114 . 1 . . . A 154 CYS CA . 17711 1 701 . 1 1 60 60 CYS CB C 13 27.9452 0.137 . 1 . . . A 154 CYS CB . 17711 1 702 . 1 1 60 60 CYS N N 15 116.1582 0.070 . 1 . . . A 154 CYS N . 17711 1 703 . 1 1 61 61 ALA H H 1 7.9282 0.008 . 1 . . . . 155 ALA H . 17711 1 704 . 1 1 61 61 ALA HA H 1 4.3802 0.019 . 1 . . . A 155 ALA HA . 17711 1 705 . 1 1 61 61 ALA HB1 H 1 1.4602 0.013 . 1 . . . A 155 ALA HB1 . 17711 1 706 . 1 1 61 61 ALA HB2 H 1 1.4602 0.013 . 1 . . . A 155 ALA HB2 . 17711 1 707 . 1 1 61 61 ALA HB3 H 1 1.4602 0.013 . 1 . . . A 155 ALA HB3 . 17711 1 708 . 1 1 61 61 ALA C C 13 177.3912 0.014 . 1 . . . A 155 ALA C . 17711 1 709 . 1 1 61 61 ALA CA C 13 52.7272 0.062 . 1 . . . A 155 ALA CA . 17711 1 710 . 1 1 61 61 ALA CB C 13 19.3542 0.109 . 1 . . . A 155 ALA CB . 17711 1 711 . 1 1 61 61 ALA N N 15 124.1472 0.089 . 1 . . . A 155 ALA N . 17711 1 712 . 1 1 62 62 ASP H H 1 8.3162 0.006 . 1 . . . . 156 ASP H . 17711 1 713 . 1 1 62 62 ASP HA H 1 4.6082 0.010 . 1 . . . A 156 ASP HA . 17711 1 714 . 1 1 62 62 ASP HB2 H 1 2.7032 0.011 . 2 . . . A 156 ASP HB2 . 17711 1 715 . 1 1 62 62 ASP HB3 H 1 2.7032 0.011 . 2 . . . . 156 ASP HB3 . 17711 1 716 . 1 1 62 62 ASP C C 13 176.7962 0.014 . 1 . . . A 156 ASP C . 17711 1 717 . 1 1 62 62 ASP CA C 13 54.6302 0.073 . 1 . . . A 156 ASP CA . 17711 1 718 . 1 1 62 62 ASP CB C 13 41.1692 0.082 . 1 . . . A 156 ASP CB . 17711 1 719 . 1 1 62 62 ASP N N 15 119.6032 0.128 . 1 . . . A 156 ASP N . 17711 1 720 . 1 1 63 63 GLY H H 1 8.3592 0.005 . 1 . . . . 157 GLY H . 17711 1 721 . 1 1 63 63 GLY HA2 H 1 3.9582 0.017 . 2 . . . A 157 GLY HA2 . 17711 1 722 . 1 1 63 63 GLY HA3 H 1 3.9582 0.017 . 2 . . . . 157 GLY HA3 . 17711 1 723 . 1 1 63 63 GLY C C 13 173.8652 0.018 . 1 . . . A 157 GLY C . 17711 1 724 . 1 1 63 63 GLY CA C 13 45.4142 0.113 . 1 . . . A 157 GLY CA . 17711 1 725 . 1 1 63 63 GLY N N 15 109.2052 0.065 . 1 . . . A 157 GLY N . 17711 1 726 . 1 1 64 64 ALA H H 1 8.0802 0.010 . 1 . . . . 158 ALA H . 17711 1 727 . 1 1 64 64 ALA HA H 1 4.3712 0.006 . 1 . . . A 158 ALA HA . 17711 1 728 . 1 1 64 64 ALA HB1 H 1 1.3972 0.008 . 1 . . . A 158 ALA HB1 . 17711 1 729 . 1 1 64 64 ALA HB2 H 1 1.3972 0.008 . 1 . . . A 158 ALA HB2 . 17711 1 730 . 1 1 64 64 ALA HB3 H 1 1.3972 0.008 . 1 . . . A 158 ALA HB3 . 17711 1 731 . 1 1 64 64 ALA C C 13 177.6422 0.017 . 1 . . . A 158 ALA C . 17711 1 732 . 1 1 64 64 ALA CA C 13 52.4642 0.063 . 1 . . . A 158 ALA CA . 17711 1 733 . 1 1 64 64 ALA CB C 13 19.3642 0.086 . 1 . . . A 158 ALA CB . 17711 1 734 . 1 1 64 64 ALA N N 15 123.5882 0.064 . 1 . . . A 158 ALA N . 17711 1 735 . 1 1 65 65 VAL H H 1 8.1182 0.006 . 1 . . . . 159 VAL H . 17711 1 736 . 1 1 65 65 VAL HA H 1 4.1722 0.004 . 1 . . . A 159 VAL HA . 17711 1 737 . 1 1 65 65 VAL HB H 1 2.1012 0.002 . 1 . . . A 159 VAL HB . 17711 1 738 . 1 1 65 65 VAL HG11 H 1 0.9532 0.005 . 2 . . . A 159 VAL HG11 . 17711 1 739 . 1 1 65 65 VAL HG12 H 1 0.9532 0.005 . 2 . . . A 159 VAL HG12 . 17711 1 740 . 1 1 65 65 VAL HG13 H 1 0.9532 0.005 . 2 . . . A 159 VAL HG13 . 17711 1 741 . 1 1 65 65 VAL HG21 H 1 0.9532 0.005 . 2 . . . A 159 VAL HG21 . 17711 1 742 . 1 1 65 65 VAL HG22 H 1 0.9532 0.005 . 2 . . . A 159 VAL HG22 . 17711 1 743 . 1 1 65 65 VAL HG23 H 1 0.9532 0.005 . 2 . . . A 159 VAL HG23 . 17711 1 744 . 1 1 65 65 VAL C C 13 176.3312 0.013 . 1 . . . A 159 VAL C . 17711 1 745 . 1 1 65 65 VAL CA C 13 62.0912 0.117 . 1 . . . A 159 VAL CA . 17711 1 746 . 1 1 65 65 VAL CB C 13 32.9352 0.059 . 1 . . . A 159 VAL CB . 17711 1 747 . 1 1 65 65 VAL CG1 C 13 20.9582 0.173 . 2 . . . A 159 VAL CG1 . 17711 1 748 . 1 1 65 65 VAL CG2 C 13 20.9582 0.173 . 2 . . . A 159 VAL CG2 . 17711 1 749 . 1 1 65 65 VAL N N 15 118.9252 0.050 . 1 . . . A 159 VAL N . 17711 1 750 . 1 1 66 66 GLY H H 1 8.3112 0.007 . 1 . . . . 160 GLY H . 17711 1 751 . 1 1 66 66 GLY HA2 H 1 4.1782 0.008 . 2 . . . A 160 GLY HA2 . 17711 1 752 . 1 1 66 66 GLY HA3 H 1 4.0082 0.012 . 2 . . . . 160 GLY HA3 . 17711 1 753 . 1 1 66 66 GLY C C 13 171.6202 0.000 . 1 . . . A 160 GLY C . 17711 1 754 . 1 1 66 66 GLY CA C 13 44.4732 0.116 . 1 . . . A 160 GLY CA . 17711 1 755 . 1 1 66 66 GLY N N 15 112.6552 0.049 . 1 . . . A 160 GLY N . 17711 1 756 . 1 1 67 67 PRO HA H 1 4.4222 0.007 . 1 . . . A 161 PRO HA . 17711 1 757 . 1 1 67 67 PRO HB2 H 1 2.2592 0.008 . 2 . . . A 161 PRO HB2 . 17711 1 758 . 1 1 67 67 PRO HB3 H 1 1.9322 0.007 . 2 . . . . 161 PRO HB3 . 17711 1 759 . 1 1 67 67 PRO HG2 H 1 1.9942 0.011 . 2 . . . A 161 PRO HG2 . 17711 1 760 . 1 1 67 67 PRO HG3 H 1 1.9942 0.011 . 2 . . . . 161 PRO HG3 . 17711 1 761 . 1 1 67 67 PRO HD2 H 1 3.6142 0.003 . 2 . . . A 161 PRO HD2 . 17711 1 762 . 1 1 67 67 PRO HD3 H 1 3.6142 0.003 . 2 . . . . 161 PRO HD3 . 17711 1 763 . 1 1 67 67 PRO C C 13 176.8082 0.020 . 1 . . . A 161 PRO C . 17711 1 764 . 1 1 67 67 PRO CA C 13 63.1012 0.094 . 1 . . . A 161 PRO CA . 17711 1 765 . 1 1 67 67 PRO CB C 13 32.2032 0.089 . 1 . . . A 161 PRO CB . 17711 1 766 . 1 1 67 67 PRO CG C 13 27.2062 0.128 . 1 . . . A 161 PRO CG . 17711 1 767 . 1 1 67 67 PRO CD C 13 49.8352 0.101 . 1 . . . A 161 PRO CD . 17711 1 768 . 1 1 68 68 ALA H H 1 8.4642 0.007 . 1 . . . . 162 ALA H . 17711 1 769 . 1 1 68 68 ALA HA H 1 4.3802 0.007 . 1 . . . A 162 ALA HA . 17711 1 770 . 1 1 68 68 ALA HB1 H 1 1.4002 0.006 . 1 . . . A 162 ALA HB1 . 17711 1 771 . 1 1 68 68 ALA HB2 H 1 1.4002 0.006 . 1 . . . A 162 ALA HB2 . 17711 1 772 . 1 1 68 68 ALA HB3 H 1 1.4002 0.006 . 1 . . . A 162 ALA HB3 . 17711 1 773 . 1 1 68 68 ALA C C 13 178.0262 0.011 . 1 . . . A 162 ALA C . 17711 1 774 . 1 1 68 68 ALA CA C 13 52.4502 0.047 . 1 . . . A 162 ALA CA . 17711 1 775 . 1 1 68 68 ALA CB C 13 19.2402 0.105 . 1 . . . A 162 ALA CB . 17711 1 776 . 1 1 68 68 ALA N N 15 124.3482 0.056 . 1 . . . A 162 ALA N . 17711 1 777 . 1 1 69 69 THR H H 1 8.1662 0.009 . 1 . . . . 163 THR H . 17711 1 778 . 1 1 69 69 THR HA H 1 4.3282 0.007 . 1 . . . A 163 THR HA . 17711 1 779 . 1 1 69 69 THR HB H 1 4.2412 0.006 . 1 . . . A 163 THR HB . 17711 1 780 . 1 1 69 69 THR HG21 H 1 1.1832 0.005 . 1 . . . A 163 THR HG21 . 17711 1 781 . 1 1 69 69 THR HG22 H 1 1.1832 0.005 . 1 . . . A 163 THR HG22 . 17711 1 782 . 1 1 69 69 THR HG23 H 1 1.1832 0.005 . 1 . . . A 163 THR HG23 . 17711 1 783 . 1 1 69 69 THR C C 13 174.3552 0.018 . 1 . . . A 163 THR C . 17711 1 784 . 1 1 69 69 THR CA C 13 61.6702 0.081 . 1 . . . A 163 THR CA . 17711 1 785 . 1 1 69 69 THR CB C 13 69.9712 0.138 . 1 . . . A 163 THR CB . 17711 1 786 . 1 1 69 69 THR CG2 C 13 21.5482 0.093 . 1 . . . A 163 THR CG2 . 17711 1 787 . 1 1 69 69 THR N N 15 113.1282 0.029 . 1 . . . A 163 THR N . 17711 1 788 . 1 1 70 70 ASN H H 1 8.4332 0.007 . 1 . . . . 164 ASN H . 17711 1 789 . 1 1 70 70 ASN HA H 1 4.6972 0.006 . 1 . . . A 164 ASN HA . 17711 1 790 . 1 1 70 70 ASN HB2 H 1 2.8312 0.010 . 2 . . . A 164 ASN HB2 . 17711 1 791 . 1 1 70 70 ASN HB3 H 1 2.7572 0.010 . 2 . . . . 164 ASN HB3 . 17711 1 792 . 1 1 70 70 ASN C C 13 174.9882 0.016 . 1 . . . A 164 ASN C . 17711 1 793 . 1 1 70 70 ASN CA C 13 53.4272 0.077 . 1 . . . A 164 ASN CA . 17711 1 794 . 1 1 70 70 ASN CB C 13 38.9272 0.137 . 1 . . . A 164 ASN CB . 17711 1 795 . 1 1 70 70 ASN N N 15 120.3192 0.055 . 1 . . . A 164 ASN N . 17711 1 796 . 1 1 71 71 GLU H H 1 8.3552 0.007 . 1 . . . . 165 GLU H . 17711 1 797 . 1 1 71 71 GLU HA H 1 4.2892 0.006 . 1 . . . A 165 GLU HA . 17711 1 798 . 1 1 71 71 GLU HB2 H 1 2.0542 0.009 . 2 . . . A 165 GLU HB2 . 17711 1 799 . 1 1 71 71 GLU HB3 H 1 1.9242 0.077 . 2 . . . . 165 GLU HB3 . 17711 1 800 . 1 1 71 71 GLU HG2 H 1 2.2152 0.011 . 2 . . . A 165 GLU HG2 . 17711 1 801 . 1 1 71 71 GLU HG3 H 1 2.2152 0.011 . 2 . . . . 165 GLU HG3 . 17711 1 802 . 1 1 71 71 GLU C C 13 176.1772 0.018 . 1 . . . A 165 GLU C . 17711 1 803 . 1 1 71 71 GLU CA C 13 56.5772 0.031 . 1 . . . A 165 GLU CA . 17711 1 804 . 1 1 71 71 GLU CB C 13 30.4172 0.095 . 1 . . . A 165 GLU CB . 17711 1 805 . 1 1 71 71 GLU CG C 13 36.2452 0.060 . 1 . . . A 165 GLU CG . 17711 1 806 . 1 1 71 71 GLU N N 15 120.8682 0.041 . 1 . . . A 165 GLU N . 17711 1 807 . 1 1 72 72 SER H H 1 8.3262 0.008 . 1 . . . . 166 SER H . 17711 1 808 . 1 1 72 72 SER HA H 1 4.7402 0.004 . 1 . . . A 166 SER HA . 17711 1 809 . 1 1 72 72 SER HB2 H 1 3.8482 0.004 . 2 . . . A 166 SER HB2 . 17711 1 810 . 1 1 72 72 SER HB3 H 1 3.8062 0.001 . 2 . . . . 166 SER HB3 . 17711 1 811 . 1 1 72 72 SER C C 13 172.6942 0.000 . 1 . . . A 166 SER C . 17711 1 812 . 1 1 72 72 SER CA C 13 56.1982 0.125 . 1 . . . A 166 SER CA . 17711 1 813 . 1 1 72 72 SER CB C 13 63.4072 0.127 . 1 . . . A 166 SER CB . 17711 1 814 . 1 1 72 72 SER N N 15 117.8332 0.022 . 1 . . . A 166 SER N . 17711 1 815 . 1 1 73 73 PRO HA H 1 4.4292 0.010 . 1 . . . A 167 PRO HA . 17711 1 816 . 1 1 73 73 PRO HB2 H 1 2.2532 0.008 . 2 . . . A 167 PRO HB2 . 17711 1 817 . 1 1 73 73 PRO HB3 H 1 1.9482 0.012 . 2 . . . . 167 PRO HB3 . 17711 1 818 . 1 1 73 73 PRO HG2 H 1 1.9972 0.004 . 2 . . . A 167 PRO HG2 . 17711 1 819 . 1 1 73 73 PRO HG3 H 1 1.9972 0.004 . 2 . . . . 167 PRO HG3 . 17711 1 820 . 1 1 73 73 PRO HD2 H 1 3.7622 0.004 . 2 . . . A 167 PRO HD2 . 17711 1 821 . 1 1 73 73 PRO HD3 H 1 3.7092 0.005 . 2 . . . . 167 PRO HD3 . 17711 1 822 . 1 1 73 73 PRO C C 13 177.2652 0.023 . 1 . . . A 167 PRO C . 17711 1 823 . 1 1 73 73 PRO CA C 13 63.4222 0.121 . 1 . . . A 167 PRO CA . 17711 1 824 . 1 1 73 73 PRO CB C 13 32.0822 0.069 . 1 . . . A 167 PRO CB . 17711 1 825 . 1 1 73 73 PRO CG C 13 27.2242 0.069 . 1 . . . A 167 PRO CG . 17711 1 826 . 1 1 73 73 PRO CD C 13 50.6682 0.052 . 1 . . . A 167 PRO CD . 17711 1 827 . 1 1 74 74 GLY H H 1 8.2582 0.007 . 1 . . . . 168 GLY H . 17711 1 828 . 1 1 74 74 GLY HA2 H 1 3.8962 0.009 . 2 . . . A 168 GLY HA2 . 17711 1 829 . 1 1 74 74 GLY HA3 H 1 3.8962 0.009 . 2 . . . . 168 GLY HA3 . 17711 1 830 . 1 1 74 74 GLY C C 13 173.5902 0.027 . 1 . . . A 168 GLY C . 17711 1 831 . 1 1 74 74 GLY CA C 13 45.0592 0.082 . 1 . . . A 168 GLY CA . 17711 1 832 . 1 1 74 74 GLY N N 15 108.8372 0.052 . 1 . . . A 168 GLY N . 17711 1 833 . 1 1 75 75 ILE H H 1 7.9752 0.008 . 1 . . . . 169 ILE H . 17711 1 834 . 1 1 75 75 ILE HA H 1 4.0012 0.011 . 1 . . . A 169 ILE HA . 17711 1 835 . 1 1 75 75 ILE HB H 1 1.6542 0.008 . 1 . . . A 169 ILE HB . 17711 1 836 . 1 1 75 75 ILE HG12 H 1 1.3192 0.010 . 2 . . . A 169 ILE HG12 . 17711 1 837 . 1 1 75 75 ILE HG13 H 1 1.0122 0.012 . 2 . . . . 169 ILE HG13 . 17711 1 838 . 1 1 75 75 ILE HG21 H 1 0.5832 0.005 . 1 . . . A 169 ILE HG21 . 17711 1 839 . 1 1 75 75 ILE HG22 H 1 0.5832 0.005 . 1 . . . A 169 ILE HG22 . 17711 1 840 . 1 1 75 75 ILE HG23 H 1 0.5832 0.005 . 1 . . . A 169 ILE HG23 . 17711 1 841 . 1 1 75 75 ILE HD11 H 1 0.7832 0.008 . 1 . . . A 169 ILE HD11 . 17711 1 842 . 1 1 75 75 ILE HD12 H 1 0.7832 0.008 . 1 . . . A 169 ILE HD12 . 17711 1 843 . 1 1 75 75 ILE HD13 H 1 0.7832 0.008 . 1 . . . A 169 ILE HD13 . 17711 1 844 . 1 1 75 75 ILE C C 13 175.2752 0.016 . 1 . . . A 169 ILE C . 17711 1 845 . 1 1 75 75 ILE CA C 13 60.8782 0.103 . 1 . . . A 169 ILE CA . 17711 1 846 . 1 1 75 75 ILE CB C 13 38.6252 0.071 . 1 . . . A 169 ILE CB . 17711 1 847 . 1 1 75 75 ILE CG1 C 13 27.1052 0.090 . 1 . . . A 169 ILE CG1 . 17711 1 848 . 1 1 75 75 ILE CG2 C 13 17.5252 0.039 . 1 . . . A 169 ILE CG2 . 17711 1 849 . 1 1 75 75 ILE CD1 C 13 13.0192 0.197 . 1 . . . A 169 ILE CD1 . 17711 1 850 . 1 1 75 75 ILE N N 15 119.6912 0.049 . 1 . . . A 169 ILE N . 17711 1 851 . 1 1 76 76 ASP H H 1 8.1412 0.005 . 1 . . . . 170 ASP H . 17711 1 852 . 1 1 76 76 ASP HA H 1 4.5522 0.007 . 1 . . . A 170 ASP HA . 17711 1 853 . 1 1 76 76 ASP HB2 H 1 2.6852 0.014 . 2 . . . A 170 ASP HB2 . 17711 1 854 . 1 1 76 76 ASP HB3 H 1 2.4792 0.020 . 2 . . . . 170 ASP HB3 . 17711 1 855 . 1 1 76 76 ASP C C 13 176.5152 0.024 . 1 . . . A 170 ASP C . 17711 1 856 . 1 1 76 76 ASP CA C 13 53.2502 0.147 . 1 . . . A 170 ASP CA . 17711 1 857 . 1 1 76 76 ASP CB C 13 40.9852 0.106 . 1 . . . A 170 ASP CB . 17711 1 858 . 1 1 76 76 ASP N N 15 124.5832 0.041 . 1 . . . A 170 ASP N . 17711 1 859 . 1 1 77 77 TYR H H 1 8.0562 0.009 . 1 . . . . 171 TYR H . 17711 1 860 . 1 1 77 77 TYR HA H 1 4.1352 0.014 . 1 . . . A 171 TYR HA . 17711 1 861 . 1 1 77 77 TYR HB2 H 1 2.0772 0.020 . 2 . . . A 171 TYR HB2 . 17711 1 862 . 1 1 77 77 TYR HB3 H 1 1.9102 0.024 . 2 . . . . 171 TYR HB3 . 17711 1 863 . 1 1 77 77 TYR HD1 H 1 6.9812 0.013 . 3 . . . A 171 TYR HD1 . 17711 1 864 . 1 1 77 77 TYR HD2 H 1 6.9812 0.013 . 3 . . . A 171 TYR HD2 . 17711 1 865 . 1 1 77 77 TYR HE1 H 1 6.7482 0.016 . 3 . . . A 171 TYR HE1 . 17711 1 866 . 1 1 77 77 TYR HE2 H 1 6.7482 0.016 . 3 . . . A 171 TYR HE2 . 17711 1 867 . 1 1 77 77 TYR C C 13 177.2142 0.018 . 1 . . . A 171 TYR C . 17711 1 868 . 1 1 77 77 TYR CA C 13 58.5772 0.081 . 1 . . . A 171 TYR CA . 17711 1 869 . 1 1 77 77 TYR CB C 13 36.9112 0.064 . 1 . . . A 171 TYR CB . 17711 1 870 . 1 1 77 77 TYR CD1 C 13 133.0372 0.144 . 3 . . . A 171 TYR CD1 . 17711 1 871 . 1 1 77 77 TYR CD2 C 13 133.0372 0.144 . 3 . . . A 171 TYR CD2 . 17711 1 872 . 1 1 77 77 TYR CE1 C 13 118.1782 0.222 . 3 . . . A 171 TYR CE1 . 17711 1 873 . 1 1 77 77 TYR CE2 C 13 118.1782 0.222 . 3 . . . A 171 TYR CE2 . 17711 1 874 . 1 1 77 77 TYR N N 15 122.4142 0.052 . 1 . . . A 171 TYR N . 17711 1 875 . 1 1 78 78 VAL H H 1 7.8862 0.007 . 1 . . . . 172 VAL H . 17711 1 876 . 1 1 78 78 VAL HA H 1 3.8292 0.007 . 1 . . . A 172 VAL HA . 17711 1 877 . 1 1 78 78 VAL HB H 1 2.1322 0.014 . 1 . . . A 172 VAL HB . 17711 1 878 . 1 1 78 78 VAL HG11 H 1 0.9022 0.017 . 1 . . . A 172 VAL HG11 . 17711 1 879 . 1 1 78 78 VAL HG12 H 1 0.9022 0.017 . 1 . . . A 172 VAL HG12 . 17711 1 880 . 1 1 78 78 VAL HG13 H 1 0.9022 0.017 . 1 . . . A 172 VAL HG13 . 17711 1 881 . 1 1 78 78 VAL HG21 H 1 1.0192 0.011 . 1 . . . A 172 VAL HG21 . 17711 1 882 . 1 1 78 78 VAL HG22 H 1 1.0192 0.011 . 1 . . . A 172 VAL HG22 . 17711 1 883 . 1 1 78 78 VAL HG23 H 1 1.0192 0.011 . 1 . . . A 172 VAL HG23 . 17711 1 884 . 1 1 78 78 VAL CA C 13 64.8612 0.092 . 1 . . . A 172 VAL CA . 17711 1 885 . 1 1 78 78 VAL CB C 13 31.7682 0.053 . 1 . . . A 172 VAL CB . 17711 1 886 . 1 1 78 78 VAL CG1 C 13 21.4982 0.042 . 1 . . . A 172 VAL CG1 . 17711 1 887 . 1 1 78 78 VAL CG2 C 13 22.2262 0.116 . 1 . . . A 172 VAL CG2 . 17711 1 888 . 1 1 78 78 VAL N N 15 120.3352 0.098 . 1 . . . A 172 VAL N . 17711 1 889 . 1 1 79 79 GLN H H 1 7.6212 0.010 . 1 . . . . 173 GLN H . 17711 1 890 . 1 1 79 79 GLN HA H 1 4.2002 0.013 . 1 . . . A 173 GLN HA . 17711 1 891 . 1 1 79 79 GLN HB2 H 1 2.1012 0.010 . 2 . . . A 173 GLN HB2 . 17711 1 892 . 1 1 79 79 GLN HB3 H 1 2.1012 0.010 . 2 . . . . 173 GLN HB3 . 17711 1 893 . 1 1 79 79 GLN HG2 H 1 2.3272 0.021 . 2 . . . A 173 GLN HG2 . 17711 1 894 . 1 1 79 79 GLN HG3 H 1 2.3272 0.021 . 2 . . . . 173 GLN HG3 . 17711 1 895 . 1 1 79 79 GLN CA C 13 57.9392 0.098 . 1 . . . A 173 GLN CA . 17711 1 896 . 1 1 79 79 GLN CB C 13 29.6892 0.073 . 1 . . . A 173 GLN CB . 17711 1 897 . 1 1 79 79 GLN CG C 13 33.8032 0.073 . 1 . . . A 173 GLN CG . 17711 1 898 . 1 1 79 79 GLN N N 15 118.3042 0.105 . 1 . . . A 173 GLN N . 17711 1 899 . 1 1 80 80 ILE H H 1 7.8822 0.005 . 1 . . . . 174 ILE H . 17711 1 900 . 1 1 80 80 ILE HA H 1 4.3942 0.010 . 1 . . . A 174 ILE HA . 17711 1 901 . 1 1 80 80 ILE HB H 1 2.0502 0.014 . 1 . . . A 174 ILE HB . 17711 1 902 . 1 1 80 80 ILE HG12 H 1 1.5432 0.017 . 2 . . . A 174 ILE HG12 . 17711 1 903 . 1 1 80 80 ILE HG13 H 1 1.0222 0.009 . 2 . . . . 174 ILE HG13 . 17711 1 904 . 1 1 80 80 ILE HG21 H 1 0.8812 0.010 . 1 . . . A 174 ILE HG21 . 17711 1 905 . 1 1 80 80 ILE HG22 H 1 0.8812 0.010 . 1 . . . A 174 ILE HG22 . 17711 1 906 . 1 1 80 80 ILE HG23 H 1 0.8812 0.010 . 1 . . . A 174 ILE HG23 . 17711 1 907 . 1 1 80 80 ILE HD11 H 1 0.7892 0.003 . 1 . . . A 174 ILE HD11 . 17711 1 908 . 1 1 80 80 ILE HD12 H 1 0.7892 0.003 . 1 . . . A 174 ILE HD12 . 17711 1 909 . 1 1 80 80 ILE HD13 H 1 0.7892 0.003 . 1 . . . A 174 ILE HD13 . 17711 1 910 . 1 1 80 80 ILE C C 13 175.6882 0.000 . 1 . . . A 174 ILE C . 17711 1 911 . 1 1 80 80 ILE CA C 13 61.9282 0.111 . 1 . . . A 174 ILE CA . 17711 1 912 . 1 1 80 80 ILE CB C 13 39.3162 0.066 . 1 . . . A 174 ILE CB . 17711 1 913 . 1 1 80 80 ILE CG1 C 13 26.1752 0.113 . 1 . . . A 174 ILE CG1 . 17711 1 914 . 1 1 80 80 ILE CG2 C 13 17.9792 0.075 . 1 . . . A 174 ILE CG2 . 17711 1 915 . 1 1 80 80 ILE CD1 C 13 14.1042 0.128 . 1 . . . A 174 ILE CD1 . 17711 1 916 . 1 1 80 80 ILE N N 15 114.0152 0.123 . 1 . . . A 174 ILE N . 17711 1 917 . 1 1 81 81 GLY H H 1 7.8182 0.006 . 1 . . . . 175 GLY H . 17711 1 918 . 1 1 81 81 GLY HA2 H 1 3.6942 0.012 . 2 . . . A 175 GLY HA2 . 17711 1 919 . 1 1 81 81 GLY HA3 H 1 3.2482 0.012 . 2 . . . . 175 GLY HA3 . 17711 1 920 . 1 1 81 81 GLY C C 13 172.6152 0.017 . 1 . . . A 175 GLY C . 17711 1 921 . 1 1 81 81 GLY CA C 13 44.2822 0.105 . 1 . . . A 175 GLY CA . 17711 1 922 . 1 1 81 81 GLY N N 15 112.3212 0.061 . 1 . . . A 175 GLY N . 17711 1 923 . 1 1 82 82 PHE H H 1 8.6472 0.007 . 1 . . . . 176 PHE H . 17711 1 924 . 1 1 82 82 PHE HA H 1 4.1882 0.025 . 1 . . . A 176 PHE HA . 17711 1 925 . 1 1 82 82 PHE HB2 H 1 2.4202 0.019 . 2 . . . A 176 PHE HB2 . 17711 1 926 . 1 1 82 82 PHE HB3 H 1 2.0332 0.008 . 2 . . . . 176 PHE HB3 . 17711 1 927 . 1 1 82 82 PHE HD1 H 1 6.7282 0.009 . 3 . . . A 176 PHE HD1 . 17711 1 928 . 1 1 82 82 PHE HD2 H 1 6.7282 0.009 . 3 . . . A 176 PHE HD2 . 17711 1 929 . 1 1 82 82 PHE HE1 H 1 7.1122 0.011 . 3 . . . A 176 PHE HE1 . 17711 1 930 . 1 1 82 82 PHE HE2 H 1 7.1122 0.011 . 3 . . . A 176 PHE HE2 . 17711 1 931 . 1 1 82 82 PHE C C 13 176.9782 0.000 . 1 . . . A 176 PHE C . 17711 1 932 . 1 1 82 82 PHE CB C 13 38.8482 0.057 . 1 . . . A 176 PHE CB . 17711 1 933 . 1 1 82 82 PHE CD1 C 13 132.5932 0.127 . 3 . . . A 176 PHE CD1 . 17711 1 934 . 1 1 82 82 PHE CD2 C 13 132.5932 0.127 . 3 . . . A 176 PHE CD2 . 17711 1 935 . 1 1 82 82 PHE CE1 C 13 131.4192 0.148 . 3 . . . A 176 PHE CE1 . 17711 1 936 . 1 1 82 82 PHE CE2 C 13 131.4192 0.148 . 3 . . . A 176 PHE CE2 . 17711 1 937 . 1 1 82 82 PHE N N 15 122.1882 0.091 . 1 . . . A 176 PHE N . 17711 1 938 . 1 1 83 83 PRO HG2 H 1 1.9182 0.003 . 2 . . . A 177 PRO HG2 . 17711 1 939 . 1 1 83 83 PRO HG3 H 1 1.7202 0.002 . 2 . . . . 177 PRO HG3 . 17711 1 940 . 1 1 83 83 PRO HD2 H 1 3.3662 0.005 . 2 . . . A 177 PRO HD2 . 17711 1 941 . 1 1 83 83 PRO HD3 H 1 3.1712 0.035 . 2 . . . . 177 PRO HD3 . 17711 1 942 . 1 1 83 83 PRO CG C 13 26.1712 0.065 . 1 . . . A 177 PRO CG . 17711 1 943 . 1 1 83 83 PRO CD C 13 49.4552 0.117 . 1 . . . A 177 PRO CD . 17711 1 944 . 1 1 84 84 PRO HG2 H 1 2.1422 0.000 . 2 . . . A 178 PRO HG2 . 17711 1 945 . 1 1 84 84 PRO HG3 H 1 1.5002 0.001 . 2 . . . . 178 PRO HG3 . 17711 1 946 . 1 1 84 84 PRO HD2 H 1 2.7862 0.014 . 2 . . . A 178 PRO HD2 . 17711 1 947 . 1 1 84 84 PRO HD3 H 1 2.1292 0.016 . 2 . . . . 178 PRO HD3 . 17711 1 948 . 1 1 84 84 PRO C C 13 174.1332 0.000 . 1 . . . A 178 PRO C . 17711 1 949 . 1 1 84 84 PRO CA C 13 61.5752 0.046 . 1 . . . A 178 PRO CA . 17711 1 950 . 1 1 84 84 PRO CG C 13 30.9472 0.055 . 1 . . . A 178 PRO CG . 17711 1 951 . 1 1 84 84 PRO CD C 13 48.6692 0.096 . 1 . . . A 178 PRO CD . 17711 1 952 . 1 1 85 85 LEU H H 1 8.1232 0.010 . 1 . . . . 179 LEU H . 17711 1 953 . 1 1 85 85 LEU HA H 1 3.9502 0.006 . 1 . . . A 179 LEU HA . 17711 1 954 . 1 1 85 85 LEU HB2 H 1 1.7652 0.000 . 2 . . . A 179 LEU HB2 . 17711 1 955 . 1 1 85 85 LEU HB3 H 1 1.2742 0.000 . 2 . . . . 179 LEU HB3 . 17711 1 956 . 1 1 85 85 LEU HG H 1 1.5352 0.009 . 1 . . . A 179 LEU HG . 17711 1 957 . 1 1 85 85 LEU HD11 H 1 0.9242 0.006 . 1 . . . A 179 LEU HD11 . 17711 1 958 . 1 1 85 85 LEU HD12 H 1 0.9242 0.006 . 1 . . . A 179 LEU HD12 . 17711 1 959 . 1 1 85 85 LEU HD13 H 1 0.9242 0.006 . 1 . . . A 179 LEU HD13 . 17711 1 960 . 1 1 85 85 LEU HD21 H 1 0.5602 0.005 . 1 . . . A 179 LEU HD21 . 17711 1 961 . 1 1 85 85 LEU HD22 H 1 0.5602 0.005 . 1 . . . A 179 LEU HD22 . 17711 1 962 . 1 1 85 85 LEU HD23 H 1 0.5602 0.005 . 1 . . . A 179 LEU HD23 . 17711 1 963 . 1 1 85 85 LEU C C 13 178.3672 0.000 . 1 . . . A 179 LEU C . 17711 1 964 . 1 1 85 85 LEU CA C 13 54.0632 0.102 . 1 . . . A 179 LEU CA . 17711 1 965 . 1 1 85 85 LEU CB C 13 40.9902 0.026 . 1 . . . A 179 LEU CB . 17711 1 966 . 1 1 85 85 LEU CG C 13 26.7122 0.082 . 1 . . . A 179 LEU CG . 17711 1 967 . 1 1 85 85 LEU CD1 C 13 24.5332 0.088 . 1 . . . A 179 LEU CD1 . 17711 1 968 . 1 1 85 85 LEU CD2 C 13 21.8992 0.109 . 1 . . . A 179 LEU CD2 . 17711 1 969 . 1 1 85 85 LEU N N 15 123.6092 0.113 . 1 . . . A 179 LEU N . 17711 1 970 . 1 1 86 86 LEU H H 1 8.7952 0.010 . 1 . . . . 180 LEU H . 17711 1 971 . 1 1 86 86 LEU HA H 1 3.8282 0.015 . 1 . . . A 180 LEU HA . 17711 1 972 . 1 1 86 86 LEU HB2 H 1 1.1742 0.011 . 2 . . . A 180 LEU HB2 . 17711 1 973 . 1 1 86 86 LEU HB3 H 1 0.3592 0.015 . 2 . . . . 180 LEU HB3 . 17711 1 974 . 1 1 86 86 LEU HG H 1 1.4002 0.008 . 1 . . . A 180 LEU HG . 17711 1 975 . 1 1 86 86 LEU HD11 H 1 0.5382 0.013 . 1 . . . A 180 LEU HD11 . 17711 1 976 . 1 1 86 86 LEU HD12 H 1 0.5382 0.013 . 1 . . . A 180 LEU HD12 . 17711 1 977 . 1 1 86 86 LEU HD13 H 1 0.5382 0.013 . 1 . . . A 180 LEU HD13 . 17711 1 978 . 1 1 86 86 LEU HD21 H 1 0.6752 0.014 . 1 . . . A 180 LEU HD21 . 17711 1 979 . 1 1 86 86 LEU HD22 H 1 0.6752 0.014 . 1 . . . A 180 LEU HD22 . 17711 1 980 . 1 1 86 86 LEU HD23 H 1 0.6752 0.014 . 1 . . . A 180 LEU HD23 . 17711 1 981 . 1 1 86 86 LEU CA C 13 58.8072 0.164 . 1 . . . A 180 LEU CA . 17711 1 982 . 1 1 86 86 LEU CB C 13 40.2762 0.103 . 1 . . . A 180 LEU CB . 17711 1 983 . 1 1 86 86 LEU CG C 13 27.3842 0.076 . 1 . . . A 180 LEU CG . 17711 1 984 . 1 1 86 86 LEU CD1 C 13 25.8702 0.099 . 1 . . . A 180 LEU CD1 . 17711 1 985 . 1 1 86 86 LEU CD2 C 13 23.7372 0.108 . 1 . . . A 180 LEU CD2 . 17711 1 986 . 1 1 86 86 LEU N N 15 128.5722 0.119 . 1 . . . A 180 LEU N . 17711 1 987 . 1 1 87 87 SER HB2 H 1 3.9352 0.000 . 2 . . . A 181 SER HB2 . 17711 1 988 . 1 1 87 87 SER HB3 H 1 3.9352 0.000 . 2 . . . . 181 SER HB3 . 17711 1 989 . 1 1 87 87 SER C C 13 174.6422 0.000 . 1 . . . A 181 SER C . 17711 1 990 . 1 1 87 87 SER CA C 13 60.9872 0.032 . 1 . . . A 181 SER CA . 17711 1 991 . 1 1 87 87 SER CB C 13 61.7412 0.000 . 1 . . . A 181 SER CB . 17711 1 992 . 1 1 88 88 ILE H H 1 6.9842 0.067 . 1 . . . . 182 ILE H . 17711 1 993 . 1 1 88 88 ILE HA H 1 4.1492 0.006 . 1 . . . A 182 ILE HA . 17711 1 994 . 1 1 88 88 ILE HB H 1 2.1162 0.009 . 1 . . . A 182 ILE HB . 17711 1 995 . 1 1 88 88 ILE HG12 H 1 1.8942 0.012 . 2 . . . A 182 ILE HG12 . 17711 1 996 . 1 1 88 88 ILE HG13 H 1 1.0432 0.012 . 2 . . . . 182 ILE HG13 . 17711 1 997 . 1 1 88 88 ILE HG21 H 1 1.3432 0.007 . 1 . . . A 182 ILE HG21 . 17711 1 998 . 1 1 88 88 ILE HG22 H 1 1.3432 0.007 . 1 . . . A 182 ILE HG22 . 17711 1 999 . 1 1 88 88 ILE HG23 H 1 1.3432 0.007 . 1 . . . A 182 ILE HG23 . 17711 1 1000 . 1 1 88 88 ILE HD11 H 1 1.1822 0.019 . 1 . . . A 182 ILE HD11 . 17711 1 1001 . 1 1 88 88 ILE HD12 H 1 1.1822 0.019 . 1 . . . A 182 ILE HD12 . 17711 1 1002 . 1 1 88 88 ILE HD13 H 1 1.1822 0.019 . 1 . . . A 182 ILE HD13 . 17711 1 1003 . 1 1 88 88 ILE C C 13 177.8772 0.000 . 1 . . . A 182 ILE C . 17711 1 1004 . 1 1 88 88 ILE CA C 13 64.3612 0.120 . 1 . . . A 182 ILE CA . 17711 1 1005 . 1 1 88 88 ILE CB C 13 39.6462 0.086 . 1 . . . A 182 ILE CB . 17711 1 1006 . 1 1 88 88 ILE CG1 C 13 28.8372 0.141 . 1 . . . A 182 ILE CG1 . 17711 1 1007 . 1 1 88 88 ILE CG2 C 13 17.2192 0.082 . 1 . . . A 182 ILE CG2 . 17711 1 1008 . 1 1 88 88 ILE CD1 C 13 13.8512 0.778 . 1 . . . A 182 ILE CD1 . 17711 1 1009 . 1 1 88 88 ILE N N 15 119.6052 0.041 . 1 . . . A 182 ILE N . 17711 1 1010 . 1 1 89 89 VAL H H 1 8.4972 0.007 . 1 . . . . 183 VAL H . 17711 1 1011 . 1 1 89 89 VAL HA H 1 4.2432 0.013 . 1 . . . A 183 VAL HA . 17711 1 1012 . 1 1 89 89 VAL HB H 1 2.5142 0.011 . 1 . . . A 183 VAL HB . 17711 1 1013 . 1 1 89 89 VAL HG11 H 1 0.8412 0.007 . 1 . . . A 183 VAL HG11 . 17711 1 1014 . 1 1 89 89 VAL HG12 H 1 0.8412 0.007 . 1 . . . A 183 VAL HG12 . 17711 1 1015 . 1 1 89 89 VAL HG13 H 1 0.8412 0.007 . 1 . . . A 183 VAL HG13 . 17711 1 1016 . 1 1 89 89 VAL HG21 H 1 0.7412 0.007 . 1 . . . A 183 VAL HG21 . 17711 1 1017 . 1 1 89 89 VAL HG22 H 1 0.7412 0.007 . 1 . . . A 183 VAL HG22 . 17711 1 1018 . 1 1 89 89 VAL HG23 H 1 0.7412 0.007 . 1 . . . A 183 VAL HG23 . 17711 1 1019 . 1 1 89 89 VAL C C 13 179.8932 0.028 . 1 . . . A 183 VAL C . 17711 1 1020 . 1 1 89 89 VAL CA C 13 65.0752 0.097 . 1 . . . A 183 VAL CA . 17711 1 1021 . 1 1 89 89 VAL CB C 13 30.9862 0.100 . 1 . . . A 183 VAL CB . 17711 1 1022 . 1 1 89 89 VAL CG1 C 13 22.2732 0.062 . 1 . . . A 183 VAL CG1 . 17711 1 1023 . 1 1 89 89 VAL CG2 C 13 19.9172 0.063 . 1 . . . A 183 VAL CG2 . 17711 1 1024 . 1 1 89 89 VAL N N 15 110.7972 0.059 . 1 . . . A 183 VAL N . 17711 1 1025 . 1 1 90 90 SER H H 1 8.5882 0.011 . 1 . . . . 184 SER H . 17711 1 1026 . 1 1 90 90 SER HA H 1 4.1742 0.011 . 1 . . . A 184 SER HA . 17711 1 1027 . 1 1 90 90 SER HB2 H 1 3.8602 0.006 . 2 . . . A 184 SER HB2 . 17711 1 1028 . 1 1 90 90 SER HB3 H 1 3.8602 0.006 . 2 . . . . 184 SER HB3 . 17711 1 1029 . 1 1 90 90 SER C C 13 173.9842 0.007 . 1 . . . A 184 SER C . 17711 1 1030 . 1 1 90 90 SER CA C 13 62.2532 0.119 . 1 . . . A 184 SER CA . 17711 1 1031 . 1 1 90 90 SER CB C 13 63.3382 0.043 . 1 . . . A 184 SER CB . 17711 1 1032 . 1 1 90 90 SER N N 15 115.5632 0.079 . 1 . . . A 184 SER N . 17711 1 1033 . 1 1 91 91 ARG H H 1 7.2382 0.011 . 1 . . . . 185 ARG H . 17711 1 1034 . 1 1 91 91 ARG HA H 1 4.2432 0.000 . 1 . . . A 185 ARG HA . 17711 1 1035 . 1 1 91 91 ARG HB2 H 1 2.0032 0.017 . 2 . . . A 185 ARG HB2 . 17711 1 1036 . 1 1 91 91 ARG HB3 H 1 2.0032 0.017 . 2 . . . . 185 ARG HB3 . 17711 1 1037 . 1 1 91 91 ARG HG2 H 1 1.7672 0.000 . 2 . . . A 185 ARG HG2 . 17711 1 1038 . 1 1 91 91 ARG HG3 H 1 1.7672 0.000 . 2 . . . . 185 ARG HG3 . 17711 1 1039 . 1 1 91 91 ARG HD2 H 1 2.8252 0.018 . 2 . . . A 185 ARG HD2 . 17711 1 1040 . 1 1 91 91 ARG HD3 H 1 2.8252 0.018 . 2 . . . . 185 ARG HD3 . 17711 1 1041 . 1 1 91 91 ARG C C 13 176.0212 0.015 . 1 . . . A 185 ARG C . 17711 1 1042 . 1 1 91 91 ARG CA C 13 56.2032 0.082 . 1 . . . A 185 ARG CA . 17711 1 1043 . 1 1 91 91 ARG CB C 13 31.5152 0.030 . 1 . . . A 185 ARG CB . 17711 1 1044 . 1 1 91 91 ARG CG C 13 28.6742 0.000 . 1 . . . A 185 ARG CG . 17711 1 1045 . 1 1 91 91 ARG N N 15 116.2022 0.102 . 1 . . . A 185 ARG N . 17711 1 1046 . 1 1 92 92 MET H H 1 7.3492 0.009 . 1 . . . . 186 MET H . 17711 1 1047 . 1 1 92 92 MET HA H 1 4.4162 0.007 . 1 . . . A 186 MET HA . 17711 1 1048 . 1 1 92 92 MET HB2 H 1 2.1272 0.011 . 2 . . . A 186 MET HB2 . 17711 1 1049 . 1 1 92 92 MET HB3 H 1 1.8902 0.007 . 2 . . . . 186 MET HB3 . 17711 1 1050 . 1 1 92 92 MET HG2 H 1 2.3052 0.003 . 2 . . . A 186 MET HG2 . 17711 1 1051 . 1 1 92 92 MET HG3 H 1 2.3052 0.003 . 2 . . . . 186 MET HG3 . 17711 1 1052 . 1 1 92 92 MET HE1 H 1 1.6632 0.007 . 1 . . . A 186 MET HE1 . 17711 1 1053 . 1 1 92 92 MET HE2 H 1 1.6632 0.007 . 1 . . . A 186 MET HE2 . 17711 1 1054 . 1 1 92 92 MET HE3 H 1 1.6632 0.007 . 1 . . . A 186 MET HE3 . 17711 1 1055 . 1 1 92 92 MET C C 13 175.7342 0.013 . 1 . . . A 186 MET C . 17711 1 1056 . 1 1 92 92 MET CA C 13 55.8302 0.107 . 1 . . . A 186 MET CA . 17711 1 1057 . 1 1 92 92 MET CB C 13 34.7382 0.112 . 1 . . . A 186 MET CB . 17711 1 1058 . 1 1 92 92 MET CG C 13 32.2152 0.055 . 1 . . . A 186 MET CG . 17711 1 1059 . 1 1 92 92 MET CE C 13 18.3622 0.051 . 1 . . . A 186 MET CE . 17711 1 1060 . 1 1 92 92 MET N N 15 119.4792 0.134 . 1 . . . A 186 MET N . 17711 1 1061 . 1 1 93 93 ASN H H 1 8.7782 0.005 . 1 . . . . 187 ASN H . 17711 1 1062 . 1 1 93 93 ASN HA H 1 4.7502 0.011 . 1 . . . A 187 ASN HA . 17711 1 1063 . 1 1 93 93 ASN HB2 H 1 3.4792 0.017 . 2 . . . A 187 ASN HB2 . 17711 1 1064 . 1 1 93 93 ASN HB3 H 1 3.1072 0.012 . 2 . . . . 187 ASN HB3 . 17711 1 1065 . 1 1 93 93 ASN C C 13 175.0222 0.000 . 1 . . . A 187 ASN C . 17711 1 1066 . 1 1 93 93 ASN CA C 13 51.6252 0.080 . 1 . . . A 187 ASN CA . 17711 1 1067 . 1 1 93 93 ASN CB C 13 37.5332 0.191 . 1 . . . A 187 ASN CB . 17711 1 1068 . 1 1 93 93 ASN N N 15 123.1862 0.073 . 1 . . . A 187 ASN N . 17711 1 1069 . 1 1 94 94 GLN H H 1 8.8202 0.012 . 1 . . . . 188 GLN H . 17711 1 1070 . 1 1 94 94 GLN HA H 1 3.8932 0.020 . 1 . . . A 188 GLN HA . 17711 1 1071 . 1 1 94 94 GLN HB2 H 1 2.0772 0.038 . 2 . . . A 188 GLN HB2 . 17711 1 1072 . 1 1 94 94 GLN HB3 H 1 2.0772 0.038 . 2 . . . . 188 GLN HB3 . 17711 1 1073 . 1 1 94 94 GLN HG2 H 1 2.5322 0.008 . 2 . . . A 188 GLN HG2 . 17711 1 1074 . 1 1 94 94 GLN HG3 H 1 2.5322 0.008 . 2 . . . . 188 GLN HG3 . 17711 1 1075 . 1 1 94 94 GLN C C 13 178.7142 0.031 . 1 . . . A 188 GLN C . 17711 1 1076 . 1 1 94 94 GLN CA C 13 59.0632 0.098 . 1 . . . A 188 GLN CA . 17711 1 1077 . 1 1 94 94 GLN CB C 13 28.3472 0.113 . 1 . . . A 188 GLN CB . 17711 1 1078 . 1 1 94 94 GLN CG C 13 34.7792 0.005 . 1 . . . A 188 GLN CG . 17711 1 1079 . 1 1 94 94 GLN N N 15 117.9292 0.082 . 1 . . . A 188 GLN N . 17711 1 1080 . 1 1 95 95 ALA H H 1 8.5432 0.013 . 1 . . . . 189 ALA H . 17711 1 1081 . 1 1 95 95 ALA HA H 1 4.0442 0.010 . 1 . . . A 189 ALA HA . 17711 1 1082 . 1 1 95 95 ALA HB1 H 1 1.4032 0.009 . 1 . . . A 189 ALA HB1 . 17711 1 1083 . 1 1 95 95 ALA HB2 H 1 1.4032 0.009 . 1 . . . A 189 ALA HB2 . 17711 1 1084 . 1 1 95 95 ALA HB3 H 1 1.4032 0.009 . 1 . . . A 189 ALA HB3 . 17711 1 1085 . 1 1 95 95 ALA C C 13 180.1982 0.003 . 1 . . . A 189 ALA C . 17711 1 1086 . 1 1 95 95 ALA CA C 13 55.1112 0.114 . 1 . . . A 189 ALA CA . 17711 1 1087 . 1 1 95 95 ALA CB C 13 17.6592 0.103 . 1 . . . A 189 ALA CB . 17711 1 1088 . 1 1 95 95 ALA N N 15 123.9622 0.101 . 1 . . . A 189 ALA N . 17711 1 1089 . 1 1 96 96 THR H H 1 8.2862 0.010 . 1 . . . . 190 THR H . 17711 1 1090 . 1 1 96 96 THR HA H 1 3.7102 0.013 . 1 . . . A 190 THR HA . 17711 1 1091 . 1 1 96 96 THR HB H 1 4.1692 0.006 . 1 . . . A 190 THR HB . 17711 1 1092 . 1 1 96 96 THR HG21 H 1 1.0212 0.012 . 1 . . . A 190 THR HG21 . 17711 1 1093 . 1 1 96 96 THR HG22 H 1 1.0212 0.012 . 1 . . . A 190 THR HG22 . 17711 1 1094 . 1 1 96 96 THR HG23 H 1 1.0212 0.012 . 1 . . . A 190 THR HG23 . 17711 1 1095 . 1 1 96 96 THR C C 13 174.7502 0.000 . 1 . . . A 190 THR C . 17711 1 1096 . 1 1 96 96 THR CA C 13 67.3932 0.156 . 1 . . . A 190 THR CA . 17711 1 1097 . 1 1 96 96 THR CB C 13 68.1052 0.115 . 1 . . . A 190 THR CB . 17711 1 1098 . 1 1 96 96 THR CG2 C 13 21.4182 0.155 . 1 . . . A 190 THR CG2 . 17711 1 1099 . 1 1 96 96 THR N N 15 117.2792 0.088 . 1 . . . A 190 THR N . 17711 1 1100 . 1 1 97 97 VAL H H 1 8.6412 0.007 . 1 . . . . 191 VAL H . 17711 1 1101 . 1 1 97 97 VAL HA H 1 3.1862 0.007 . 1 . . . A 191 VAL HA . 17711 1 1102 . 1 1 97 97 VAL HB H 1 2.0182 0.009 . 1 . . . A 191 VAL HB . 17711 1 1103 . 1 1 97 97 VAL HG11 H 1 0.7922 0.007 . 1 . . . A 191 VAL HG11 . 17711 1 1104 . 1 1 97 97 VAL HG12 H 1 0.7922 0.007 . 1 . . . A 191 VAL HG12 . 17711 1 1105 . 1 1 97 97 VAL HG13 H 1 0.7922 0.007 . 1 . . . A 191 VAL HG13 . 17711 1 1106 . 1 1 97 97 VAL HG21 H 1 0.8992 0.008 . 1 . . . A 191 VAL HG21 . 17711 1 1107 . 1 1 97 97 VAL HG22 H 1 0.8992 0.008 . 1 . . . A 191 VAL HG22 . 17711 1 1108 . 1 1 97 97 VAL HG23 H 1 0.8992 0.008 . 1 . . . A 191 VAL HG23 . 17711 1 1109 . 1 1 97 97 VAL C C 13 176.8822 0.000 . 1 . . . A 191 VAL C . 17711 1 1110 . 1 1 97 97 VAL CA C 13 67.5272 0.134 . 1 . . . A 191 VAL CA . 17711 1 1111 . 1 1 97 97 VAL CB C 13 32.1232 0.089 . 1 . . . A 191 VAL CB . 17711 1 1112 . 1 1 97 97 VAL CG1 C 13 22.7052 0.075 . 1 . . . A 191 VAL CG1 . 17711 1 1113 . 1 1 97 97 VAL CG2 C 13 23.7762 0.122 . 1 . . . A 191 VAL CG2 . 17711 1 1114 . 1 1 97 97 VAL N N 15 122.2392 0.058 . 1 . . . A 191 VAL N . 17711 1 1115 . 1 1 98 98 THR H H 1 7.7452 0.009 . 1 . . . . 192 THR H . 17711 1 1116 . 1 1 98 98 THR HA H 1 3.4592 0.012 . 1 . . . A 192 THR HA . 17711 1 1117 . 1 1 98 98 THR HB H 1 4.1162 0.014 . 1 . . . A 192 THR HB . 17711 1 1118 . 1 1 98 98 THR HG21 H 1 1.0212 0.005 . 1 . . . A 192 THR HG21 . 17711 1 1119 . 1 1 98 98 THR HG22 H 1 1.0212 0.005 . 1 . . . A 192 THR HG22 . 17711 1 1120 . 1 1 98 98 THR HG23 H 1 1.0212 0.005 . 1 . . . A 192 THR HG23 . 17711 1 1121 . 1 1 98 98 THR C C 13 175.6662 0.000 . 1 . . . A 192 THR C . 17711 1 1122 . 1 1 98 98 THR CA C 13 67.5332 0.130 . 1 . . . A 192 THR CA . 17711 1 1123 . 1 1 98 98 THR CB C 13 68.2482 0.092 . 1 . . . A 192 THR CB . 17711 1 1124 . 1 1 98 98 THR CG2 C 13 21.5812 0.106 . 1 . . . A 192 THR CG2 . 17711 1 1125 . 1 1 98 98 THR N N 15 111.8942 0.093 . 1 . . . A 192 THR N . 17711 1 1126 . 1 1 99 99 SER H H 1 7.8642 0.010 . 1 . . . . 193 SER H . 17711 1 1127 . 1 1 99 99 SER HA H 1 3.7132 0.024 . 1 . . . A 193 SER HA . 17711 1 1128 . 1 1 99 99 SER HB2 H 1 4.1652 0.011 . 2 . . . A 193 SER HB2 . 17711 1 1129 . 1 1 99 99 SER HB3 H 1 4.1652 0.011 . 2 . . . . 193 SER HB3 . 17711 1 1130 . 1 1 99 99 SER C C 13 173.2262 0.000 . 1 . . . A 193 SER C . 17711 1 1131 . 1 1 99 99 SER CA C 13 62.7462 0.137 . 1 . . . A 193 SER CA . 17711 1 1132 . 1 1 99 99 SER CB C 13 68.1622 0.166 . 1 . . . A 193 SER CB . 17711 1 1133 . 1 1 99 99 SER N N 15 118.6862 0.089 . 1 . . . A 193 SER N . 17711 1 1134 . 1 1 100 100 VAL H H 1 8.1852 0.008 . 1 . . . . 194 VAL H . 17711 1 1135 . 1 1 100 100 VAL HA H 1 2.9002 0.005 . 1 . . . A 194 VAL HA . 17711 1 1136 . 1 1 100 100 VAL HB H 1 1.3162 0.010 . 1 . . . A 194 VAL HB . 17711 1 1137 . 1 1 100 100 VAL HG11 H 1 0.3752 0.006 . 1 . . . A 194 VAL HG11 . 17711 1 1138 . 1 1 100 100 VAL HG12 H 1 0.3752 0.006 . 1 . . . A 194 VAL HG12 . 17711 1 1139 . 1 1 100 100 VAL HG13 H 1 0.3752 0.006 . 1 . . . A 194 VAL HG13 . 17711 1 1140 . 1 1 100 100 VAL HG21 H 1 -0.7728 0.004 . 1 . . . A 194 VAL HG21 . 17711 1 1141 . 1 1 100 100 VAL HG22 H 1 -0.7728 0.004 . 1 . . . A 194 VAL HG22 . 17711 1 1142 . 1 1 100 100 VAL HG23 H 1 -0.7728 0.004 . 1 . . . A 194 VAL HG23 . 17711 1 1143 . 1 1 100 100 VAL C C 13 177.8452 0.006 . 1 . . . A 194 VAL C . 17711 1 1144 . 1 1 100 100 VAL CA C 13 66.9582 0.077 . 1 . . . A 194 VAL CA . 17711 1 1145 . 1 1 100 100 VAL CB C 13 30.1142 0.062 . 1 . . . A 194 VAL CB . 17711 1 1146 . 1 1 100 100 VAL CG1 C 13 22.8572 0.071 . 1 . . . A 194 VAL CG1 . 17711 1 1147 . 1 1 100 100 VAL CG2 C 13 20.8482 0.085 . 1 . . . A 194 VAL CG2 . 17711 1 1148 . 1 1 100 100 VAL N N 15 120.0002 0.122 . 1 . . . A 194 VAL N . 17711 1 1149 . 1 1 101 101 LEU H H 1 7.9602 0.008 . 1 . . . . 195 LEU H . 17711 1 1150 . 1 1 101 101 LEU HA H 1 3.8212 0.015 . 1 . . . A 195 LEU HA . 17711 1 1151 . 1 1 101 101 LEU HB2 H 1 1.7282 0.000 . 2 . . . A 195 LEU HB2 . 17711 1 1152 . 1 1 101 101 LEU HB3 H 1 1.6892 0.019 . 2 . . . . 195 LEU HB3 . 17711 1 1153 . 1 1 101 101 LEU HG H 1 1.5272 0.015 . 1 . . . A 195 LEU HG . 17711 1 1154 . 1 1 101 101 LEU HD11 H 1 0.7832 0.013 . 1 . . . A 195 LEU HD11 . 17711 1 1155 . 1 1 101 101 LEU HD12 H 1 0.7832 0.013 . 1 . . . A 195 LEU HD12 . 17711 1 1156 . 1 1 101 101 LEU HD13 H 1 0.7832 0.013 . 1 . . . A 195 LEU HD13 . 17711 1 1157 . 1 1 101 101 LEU HD21 H 1 0.7412 0.011 . 1 . . . A 195 LEU HD21 . 17711 1 1158 . 1 1 101 101 LEU HD22 H 1 0.7412 0.011 . 1 . . . A 195 LEU HD22 . 17711 1 1159 . 1 1 101 101 LEU HD23 H 1 0.7412 0.011 . 1 . . . A 195 LEU HD23 . 17711 1 1160 . 1 1 101 101 LEU C C 13 178.9742 0.000 . 1 . . . A 195 LEU C . 17711 1 1161 . 1 1 101 101 LEU CA C 13 58.5512 0.157 . 1 . . . A 195 LEU CA . 17711 1 1162 . 1 1 101 101 LEU CB C 13 41.6362 0.063 . 1 . . . A 195 LEU CB . 17711 1 1163 . 1 1 101 101 LEU CG C 13 27.0242 0.000 . 1 . . . A 195 LEU CG . 17711 1 1164 . 1 1 101 101 LEU CD1 C 13 24.5192 0.089 . 1 . . . A 195 LEU CD1 . 17711 1 1165 . 1 1 101 101 LEU CD2 C 13 25.6402 0.101 . 1 . . . A 195 LEU CD2 . 17711 1 1166 . 1 1 101 101 LEU N N 15 120.3292 0.097 . 1 . . . A 195 LEU N . 17711 1 1167 . 1 1 102 102 GLU H H 1 7.7842 0.008 . 1 . . . . 196 GLU H . 17711 1 1168 . 1 1 102 102 GLU HA H 1 4.3992 0.000 . 1 . . . A 196 GLU HA . 17711 1 1169 . 1 1 102 102 GLU HB2 H 1 2.2102 0.008 . 2 . . . A 196 GLU HB2 . 17711 1 1170 . 1 1 102 102 GLU HB3 H 1 1.9322 0.013 . 2 . . . . 196 GLU HB3 . 17711 1 1171 . 1 1 102 102 GLU HG2 H 1 2.2172 0.014 . 2 . . . A 196 GLU HG2 . 17711 1 1172 . 1 1 102 102 GLU HG3 H 1 2.2172 0.014 . 2 . . . . 196 GLU HG3 . 17711 1 1173 . 1 1 102 102 GLU C C 13 178.1342 0.029 . 1 . . . A 196 GLU C . 17711 1 1174 . 1 1 102 102 GLU CA C 13 59.9922 0.059 . 1 . . . A 196 GLU CA . 17711 1 1175 . 1 1 102 102 GLU CB C 13 28.1552 0.012 . 1 . . . A 196 GLU CB . 17711 1 1176 . 1 1 102 102 GLU CG C 13 35.3792 0.122 . 1 . . . A 196 GLU CG . 17711 1 1177 . 1 1 102 102 GLU N N 15 122.8062 0.052 . 1 . . . A 196 GLU N . 17711 1 1178 . 1 1 103 103 TYR H H 1 8.4362 0.007 . 1 . . . . 197 TYR H . 17711 1 1179 . 1 1 103 103 TYR HA H 1 4.6572 0.015 . 1 . . . A 197 TYR HA . 17711 1 1180 . 1 1 103 103 TYR HB2 H 1 3.2432 0.019 . 2 . . . A 197 TYR HB2 . 17711 1 1181 . 1 1 103 103 TYR HB3 H 1 3.0292 0.030 . 2 . . . . 197 TYR HB3 . 17711 1 1182 . 1 1 103 103 TYR HD1 H 1 7.2382 0.000 . 3 . . . A 197 TYR HD1 . 17711 1 1183 . 1 1 103 103 TYR HD2 H 1 7.2382 0.000 . 3 . . . A 197 TYR HD2 . 17711 1 1184 . 1 1 103 103 TYR HE1 H 1 7.4542 0.015 . 3 . . . A 197 TYR HE1 . 17711 1 1185 . 1 1 103 103 TYR HE2 H 1 7.4542 0.015 . 3 . . . A 197 TYR HE2 . 17711 1 1186 . 1 1 103 103 TYR C C 13 179.8722 0.026 . 1 . . . A 197 TYR C . 17711 1 1187 . 1 1 103 103 TYR CA C 13 57.8212 0.203 . 1 . . . A 197 TYR CA . 17711 1 1188 . 1 1 103 103 TYR CB C 13 36.7862 0.119 . 1 . . . A 197 TYR CB . 17711 1 1189 . 1 1 103 103 TYR CE1 C 13 114.8832 0.095 . 3 . . . A 197 TYR CE1 . 17711 1 1190 . 1 1 103 103 TYR CE2 C 13 114.8832 0.095 . 3 . . . A 197 TYR CE2 . 17711 1 1191 . 1 1 103 103 TYR N N 15 120.4102 0.075 . 1 . . . A 197 TYR N . 17711 1 1192 . 1 1 104 104 LEU H H 1 8.9722 0.008 . 1 . . . . 198 LEU H . 17711 1 1193 . 1 1 104 104 LEU HA H 1 4.2262 0.011 . 1 . . . A 198 LEU HA . 17711 1 1194 . 1 1 104 104 LEU HB2 H 1 1.7892 0.000 . 2 . . . A 198 LEU HB2 . 17711 1 1195 . 1 1 104 104 LEU HB3 H 1 1.3012 0.004 . 2 . . . . 198 LEU HB3 . 17711 1 1196 . 1 1 104 104 LEU HG H 1 1.8882 0.014 . 1 . . . A 198 LEU HG . 17711 1 1197 . 1 1 104 104 LEU HD11 H 1 0.7452 0.007 . 1 . . . A 198 LEU HD11 . 17711 1 1198 . 1 1 104 104 LEU HD12 H 1 0.7452 0.007 . 1 . . . A 198 LEU HD12 . 17711 1 1199 . 1 1 104 104 LEU HD13 H 1 0.7452 0.007 . 1 . . . A 198 LEU HD13 . 17711 1 1200 . 1 1 104 104 LEU HD21 H 1 0.4972 0.037 . 1 . . . A 198 LEU HD21 . 17711 1 1201 . 1 1 104 104 LEU HD22 H 1 0.4972 0.037 . 1 . . . A 198 LEU HD22 . 17711 1 1202 . 1 1 104 104 LEU HD23 H 1 0.4972 0.037 . 1 . . . A 198 LEU HD23 . 17711 1 1203 . 1 1 104 104 LEU C C 13 179.5372 0.000 . 1 . . . A 198 LEU C . 17711 1 1204 . 1 1 104 104 LEU CA C 13 57.6332 0.069 . 1 . . . A 198 LEU CA . 17711 1 1205 . 1 1 104 104 LEU CB C 13 40.8662 0.205 . 1 . . . A 198 LEU CB . 17711 1 1206 . 1 1 104 104 LEU CG C 13 26.6152 0.197 . 1 . . . A 198 LEU CG . 17711 1 1207 . 1 1 104 104 LEU CD1 C 13 26.0062 0.130 . 1 . . . A 198 LEU CD1 . 17711 1 1208 . 1 1 104 104 LEU CD2 C 13 20.5532 0.069 . 1 . . . A 198 LEU CD2 . 17711 1 1209 . 1 1 104 104 LEU N N 15 117.4342 0.100 . 1 . . . A 198 LEU N . 17711 1 1210 . 1 1 105 105 SER H H 1 8.6132 0.011 . 1 . . . . 199 SER H . 17711 1 1211 . 1 1 105 105 SER HA H 1 4.3452 0.041 . 1 . . . A 199 SER HA . 17711 1 1212 . 1 1 105 105 SER HB2 H 1 4.0572 0.008 . 2 . . . A 199 SER HB2 . 17711 1 1213 . 1 1 105 105 SER HB3 H 1 4.0572 0.008 . 2 . . . . 199 SER HB3 . 17711 1 1214 . 1 1 105 105 SER C C 13 177.6632 0.000 . 1 . . . A 199 SER C . 17711 1 1215 . 1 1 105 105 SER CA C 13 62.9392 0.117 . 1 . . . A 199 SER CA . 17711 1 1216 . 1 1 105 105 SER CB C 13 62.7822 0.066 . 1 . . . A 199 SER CB . 17711 1 1217 . 1 1 105 105 SER N N 15 117.1482 0.113 . 1 . . . A 199 SER N . 17711 1 1218 . 1 1 106 106 ASN H H 1 8.9372 0.012 . 1 . . . . 200 ASN H . 17711 1 1219 . 1 1 106 106 ASN HA H 1 4.5332 0.008 . 1 . . . A 200 ASN HA . 17711 1 1220 . 1 1 106 106 ASN HB2 H 1 3.3232 0.010 . 2 . . . A 200 ASN HB2 . 17711 1 1221 . 1 1 106 106 ASN HB3 H 1 3.0182 0.011 . 2 . . . . 200 ASN HB3 . 17711 1 1222 . 1 1 106 106 ASN C C 13 178.8042 0.000 . 1 . . . A 200 ASN C . 17711 1 1223 . 1 1 106 106 ASN CA C 13 55.6382 0.129 . 1 . . . A 200 ASN CA . 17711 1 1224 . 1 1 106 106 ASN CB C 13 36.9522 0.107 . 1 . . . A 200 ASN CB . 17711 1 1225 . 1 1 106 106 ASN N N 15 122.4932 0.120 . 1 . . . A 200 ASN N . 17711 1 1226 . 1 1 107 107 TRP H H 1 8.0972 0.009 . 1 . . . . 201 TRP H . 17711 1 1227 . 1 1 107 107 TRP HA H 1 4.2822 0.010 . 1 . . . A 201 TRP HA . 17711 1 1228 . 1 1 107 107 TRP HB2 H 1 3.1922 0.004 . 2 . . . A 201 TRP HB2 . 17711 1 1229 . 1 1 107 107 TRP HB3 H 1 3.1922 0.004 . 2 . . . . 201 TRP HB3 . 17711 1 1230 . 1 1 107 107 TRP HE1 H 1 11.5112 0.000 . 1 . . . A 201 TRP HE1 . 17711 1 1231 . 1 1 107 107 TRP C C 13 177.9742 0.000 . 1 . . . A 201 TRP C . 17711 1 1232 . 1 1 107 107 TRP CA C 13 61.5752 0.105 . 1 . . . A 201 TRP CA . 17711 1 1233 . 1 1 107 107 TRP CB C 13 29.5152 0.098 . 1 . . . A 201 TRP CB . 17711 1 1234 . 1 1 107 107 TRP N N 15 122.6142 0.056 . 1 . . . A 201 TRP N . 17711 1 1235 . 1 1 107 107 TRP NE1 N 15 120.1722 0.000 . 1 . . . A 201 TRP NE1 . 17711 1 1236 . 1 1 108 108 PHE H H 1 8.7662 0.014 . 1 . . . . 202 PHE H . 17711 1 1237 . 1 1 108 108 PHE HA H 1 4.5232 0.018 . 1 . . . A 202 PHE HA . 17711 1 1238 . 1 1 108 108 PHE HB2 H 1 2.4052 0.008 . 2 . . . A 202 PHE HB2 . 17711 1 1239 . 1 1 108 108 PHE HB3 H 1 2.0482 0.002 . 2 . . . . 202 PHE HB3 . 17711 1 1240 . 1 1 108 108 PHE C C 13 176.9842 0.000 . 1 . . . A 202 PHE C . 17711 1 1241 . 1 1 108 108 PHE CA C 13 55.4532 0.156 . 1 . . . A 202 PHE CA . 17711 1 1242 . 1 1 108 108 PHE CB C 13 34.3682 0.110 . 1 . . . A 202 PHE CB . 17711 1 1243 . 1 1 108 108 PHE N N 15 117.5522 0.096 . 1 . . . A 202 PHE N . 17711 1 1244 . 1 1 109 109 GLY H H 1 8.2742 0.005 . 1 . . . . 203 GLY H . 17711 1 1245 . 1 1 109 109 GLY HA2 H 1 3.9912 0.007 . 2 . . . A 203 GLY HA2 . 17711 1 1246 . 1 1 109 109 GLY HA3 H 1 3.5082 0.015 . 2 . . . . 203 GLY HA3 . 17711 1 1247 . 1 1 109 109 GLY C C 13 173.5372 0.049 . 1 . . . A 203 GLY C . 17711 1 1248 . 1 1 109 109 GLY CA C 13 46.9272 0.066 . 1 . . . A 203 GLY CA . 17711 1 1249 . 1 1 109 109 GLY N N 15 105.5652 0.046 . 1 . . . A 203 GLY N . 17711 1 1250 . 1 1 110 110 GLU H H 1 7.0802 0.014 . 1 . . . . 204 GLU H . 17711 1 1251 . 1 1 110 110 GLU HA H 1 4.4742 0.015 . 1 . . . A 204 GLU HA . 17711 1 1252 . 1 1 110 110 GLU HB2 H 1 2.0662 0.013 . 2 . . . A 204 GLU HB2 . 17711 1 1253 . 1 1 110 110 GLU HB3 H 1 1.8002 0.010 . 2 . . . . 204 GLU HB3 . 17711 1 1254 . 1 1 110 110 GLU HG2 H 1 2.1442 0.002 . 2 . . . A 204 GLU HG2 . 17711 1 1255 . 1 1 110 110 GLU HG3 H 1 2.1442 0.002 . 2 . . . . 204 GLU HG3 . 17711 1 1256 . 1 1 110 110 GLU C C 13 175.8192 0.000 . 1 . . . A 204 GLU C . 17711 1 1257 . 1 1 110 110 GLU CA C 13 55.3432 0.090 . 1 . . . A 204 GLU CA . 17711 1 1258 . 1 1 110 110 GLU CB C 13 31.8022 0.068 . 1 . . . A 204 GLU CB . 17711 1 1259 . 1 1 110 110 GLU CG C 13 35.9982 0.071 . 1 . . . A 204 GLU CG . 17711 1 1260 . 1 1 110 110 GLU N N 15 114.6252 0.042 . 1 . . . A 204 GLU N . 17711 1 1261 . 1 1 111 111 ARG H H 1 7.3512 0.014 . 1 . . . . 205 ARG H . 17711 1 1262 . 1 1 111 111 ARG HA H 1 4.4742 0.008 . 1 . . . A 205 ARG HA . 17711 1 1263 . 1 1 111 111 ARG HB2 H 1 1.2722 0.011 . 2 . . . A 205 ARG HB2 . 17711 1 1264 . 1 1 111 111 ARG HB3 H 1 0.5812 0.007 . 2 . . . . 205 ARG HB3 . 17711 1 1265 . 1 1 111 111 ARG HG2 H 1 0.8592 0.006 . 2 . . . A 205 ARG HG2 . 17711 1 1266 . 1 1 111 111 ARG HG3 H 1 0.2992 0.013 . 2 . . . . 205 ARG HG3 . 17711 1 1267 . 1 1 111 111 ARG HD2 H 1 2.5432 0.005 . 2 . . . A 205 ARG HD2 . 17711 1 1268 . 1 1 111 111 ARG HD3 H 1 2.0112 0.008 . 2 . . . . 205 ARG HD3 . 17711 1 1269 . 1 1 111 111 ARG C C 13 173.8252 0.000 . 1 . . . A 205 ARG C . 17711 1 1270 . 1 1 111 111 ARG CA C 13 54.2142 0.116 . 1 . . . A 205 ARG CA . 17711 1 1271 . 1 1 111 111 ARG CB C 13 32.0102 0.159 . 1 . . . A 205 ARG CB . 17711 1 1272 . 1 1 111 111 ARG CG C 13 26.6392 0.139 . 1 . . . A 205 ARG CG . 17711 1 1273 . 1 1 111 111 ARG CD C 13 42.0352 0.096 . 1 . . . A 205 ARG CD . 17711 1 1274 . 1 1 111 111 ARG N N 15 120.6452 0.113 . 1 . . . A 205 ARG N . 17711 1 1275 . 1 1 112 112 ASP H H 1 7.6352 0.005 . 1 . . . . 206 ASP H . 17711 1 1276 . 1 1 112 112 ASP HA H 1 4.8152 0.010 . 1 . . . A 206 ASP HA . 17711 1 1277 . 1 1 112 112 ASP HB2 H 1 2.7212 0.008 . 2 . . . A 206 ASP HB2 . 17711 1 1278 . 1 1 112 112 ASP HB3 H 1 2.6522 0.004 . 2 . . . . 206 ASP HB3 . 17711 1 1279 . 1 1 112 112 ASP C C 13 175.5512 0.009 . 1 . . . A 206 ASP C . 17711 1 1280 . 1 1 112 112 ASP CA C 13 52.8862 0.085 . 1 . . . A 206 ASP CA . 17711 1 1281 . 1 1 112 112 ASP CB C 13 42.3472 0.119 . 1 . . . A 206 ASP CB . 17711 1 1282 . 1 1 112 112 ASP N N 15 116.7722 0.093 . 1 . . . A 206 ASP N . 17711 1 1283 . 1 1 113 113 PHE H H 1 9.0162 0.017 . 1 . . . . 207 PHE H . 17711 1 1284 . 1 1 113 113 PHE HA H 1 4.0322 0.010 . 1 . . . A 207 PHE HA . 17711 1 1285 . 1 1 113 113 PHE HB2 H 1 3.2382 0.009 . 2 . . . A 207 PHE HB2 . 17711 1 1286 . 1 1 113 113 PHE HB3 H 1 2.7742 0.027 . 2 . . . . 207 PHE HB3 . 17711 1 1287 . 1 1 113 113 PHE HD1 H 1 6.8212 0.013 . 3 . . . A 207 PHE HD1 . 17711 1 1288 . 1 1 113 113 PHE HD2 H 1 6.8212 0.013 . 3 . . . A 207 PHE HD2 . 17711 1 1289 . 1 1 113 113 PHE HE1 H 1 7.5272 0.018 . 3 . . . A 207 PHE HE1 . 17711 1 1290 . 1 1 113 113 PHE HE2 H 1 7.5272 0.018 . 3 . . . A 207 PHE HE2 . 17711 1 1291 . 1 1 113 113 PHE HZ H 1 7.1722 0.007 . 1 . . . A 207 PHE HZ . 17711 1 1292 . 1 1 113 113 PHE C C 13 174.7032 0.000 . 1 . . . A 207 PHE C . 17711 1 1293 . 1 1 113 113 PHE CA C 13 60.1712 0.094 . 1 . . . A 207 PHE CA . 17711 1 1294 . 1 1 113 113 PHE CB C 13 40.8922 0.139 . 1 . . . A 207 PHE CB . 17711 1 1295 . 1 1 113 113 PHE CD1 C 13 131.1982 0.168 . 3 . . . A 207 PHE CD1 . 17711 1 1296 . 1 1 113 113 PHE CD2 C 13 131.1982 0.168 . 3 . . . A 207 PHE CD2 . 17711 1 1297 . 1 1 113 113 PHE CE1 C 13 131.2742 0.085 . 3 . . . A 207 PHE CE1 . 17711 1 1298 . 1 1 113 113 PHE CE2 C 13 131.2742 0.085 . 3 . . . A 207 PHE CE2 . 17711 1 1299 . 1 1 113 113 PHE CZ C 13 129.1562 0.026 . 1 . . . A 207 PHE CZ . 17711 1 1300 . 1 1 113 113 PHE N N 15 119.5792 0.106 . 1 . . . A 207 PHE N . 17711 1 1301 . 1 1 114 114 THR H H 1 5.7602 0.012 . 1 . . . . 208 THR H . 17711 1 1302 . 1 1 114 114 THR HA H 1 4.8912 0.013 . 1 . . . A 208 THR HA . 17711 1 1303 . 1 1 114 114 THR HB H 1 4.6042 0.008 . 1 . . . A 208 THR HB . 17711 1 1304 . 1 1 114 114 THR HG21 H 1 1.3632 0.008 . 1 . . . A 208 THR HG21 . 17711 1 1305 . 1 1 114 114 THR HG22 H 1 1.3632 0.008 . 1 . . . A 208 THR HG22 . 17711 1 1306 . 1 1 114 114 THR HG23 H 1 1.3632 0.008 . 1 . . . A 208 THR HG23 . 17711 1 1307 . 1 1 114 114 THR C C 13 173.4132 0.000 . 1 . . . A 208 THR C . 17711 1 1308 . 1 1 114 114 THR CA C 13 57.9532 0.062 . 1 . . . A 208 THR CA . 17711 1 1309 . 1 1 114 114 THR CB C 13 70.3422 0.152 . 1 . . . A 208 THR CB . 17711 1 1310 . 1 1 114 114 THR CG2 C 13 22.3842 0.106 . 1 . . . A 208 THR CG2 . 17711 1 1311 . 1 1 114 114 THR N N 15 116.5522 0.105 . 1 . . . A 208 THR N . 17711 1 1312 . 1 1 115 115 PRO HA H 1 4.2512 0.009 . 1 . . . A 209 PRO HA . 17711 1 1313 . 1 1 115 115 PRO HB2 H 1 2.5452 0.011 . 2 . . . A 209 PRO HB2 . 17711 1 1314 . 1 1 115 115 PRO HB3 H 1 1.8172 0.004 . 2 . . . . 209 PRO HB3 . 17711 1 1315 . 1 1 115 115 PRO HG2 H 1 2.1212 0.021 . 2 . . . A 209 PRO HG2 . 17711 1 1316 . 1 1 115 115 PRO HG3 H 1 2.1212 0.021 . 2 . . . . 209 PRO HG3 . 17711 1 1317 . 1 1 115 115 PRO HD2 H 1 3.8852 0.000 . 2 . . . A 209 PRO HD2 . 17711 1 1318 . 1 1 115 115 PRO HD3 H 1 3.8852 0.000 . 2 . . . . 209 PRO HD3 . 17711 1 1319 . 1 1 115 115 PRO C C 13 177.2412 0.000 . 1 . . . A 209 PRO C . 17711 1 1320 . 1 1 115 115 PRO CA C 13 65.2672 0.103 . 1 . . . A 209 PRO CA . 17711 1 1321 . 1 1 115 115 PRO CB C 13 32.1542 0.061 . 1 . . . A 209 PRO CB . 17711 1 1322 . 1 1 115 115 PRO CG C 13 28.1492 0.124 . 1 . . . A 209 PRO CG . 17711 1 1323 . 1 1 115 115 PRO CD C 13 50.8612 0.000 . 1 . . . A 209 PRO CD . 17711 1 1324 . 1 1 116 116 GLU H H 1 8.9702 0.007 . 1 . . . . 210 GLU H . 17711 1 1325 . 1 1 116 116 GLU HA H 1 3.8522 0.010 . 1 . . . A 210 GLU HA . 17711 1 1326 . 1 1 116 116 GLU HB2 H 1 1.9712 0.010 . 2 . . . A 210 GLU HB2 . 17711 1 1327 . 1 1 116 116 GLU HB3 H 1 1.8512 0.014 . 2 . . . . 210 GLU HB3 . 17711 1 1328 . 1 1 116 116 GLU HG2 H 1 2.6532 0.011 . 2 . . . A 210 GLU HG2 . 17711 1 1329 . 1 1 116 116 GLU HG3 H 1 2.2132 0.009 . 2 . . . . 210 GLU HG3 . 17711 1 1330 . 1 1 116 116 GLU C C 13 179.2932 0.017 . 1 . . . A 210 GLU C . 17711 1 1331 . 1 1 116 116 GLU CA C 13 61.1742 0.072 . 1 . . . A 210 GLU CA . 17711 1 1332 . 1 1 116 116 GLU CB C 13 28.3432 0.196 . 1 . . . A 210 GLU CB . 17711 1 1333 . 1 1 116 116 GLU CG C 13 37.5942 0.091 . 1 . . . A 210 GLU CG . 17711 1 1334 . 1 1 116 116 GLU N N 15 115.8082 0.077 . 1 . . . A 210 GLU N . 17711 1 1335 . 1 1 117 117 LEU H H 1 6.9782 0.011 . 1 . . . . 211 LEU H . 17711 1 1336 . 1 1 117 117 LEU HA H 1 3.8482 0.002 . 1 . . . A 211 LEU HA . 17711 1 1337 . 1 1 117 117 LEU HB2 H 1 1.2682 0.017 . 2 . . . A 211 LEU HB2 . 17711 1 1338 . 1 1 117 117 LEU HB3 H 1 1.2682 0.017 . 2 . . . . 211 LEU HB3 . 17711 1 1339 . 1 1 117 117 LEU HG H 1 1.1632 0.018 . 1 . . . A 211 LEU HG . 17711 1 1340 . 1 1 117 117 LEU HD11 H 1 0.9222 0.009 . 1 . . . A 211 LEU HD11 . 17711 1 1341 . 1 1 117 117 LEU HD12 H 1 0.9222 0.009 . 1 . . . A 211 LEU HD12 . 17711 1 1342 . 1 1 117 117 LEU HD13 H 1 0.9222 0.009 . 1 . . . A 211 LEU HD13 . 17711 1 1343 . 1 1 117 117 LEU HD21 H 1 0.5992 0.025 . 1 . . . A 211 LEU HD21 . 17711 1 1344 . 1 1 117 117 LEU HD22 H 1 0.5992 0.025 . 1 . . . A 211 LEU HD22 . 17711 1 1345 . 1 1 117 117 LEU HD23 H 1 0.5992 0.025 . 1 . . . A 211 LEU HD23 . 17711 1 1346 . 1 1 117 117 LEU C C 13 178.1092 0.000 . 1 . . . A 211 LEU C . 17711 1 1347 . 1 1 117 117 LEU CA C 13 57.5882 0.093 . 1 . . . A 211 LEU CA . 17711 1 1348 . 1 1 117 117 LEU CB C 13 41.8052 0.085 . 1 . . . A 211 LEU CB . 17711 1 1349 . 1 1 117 117 LEU CG C 13 27.0332 0.079 . 1 . . . A 211 LEU CG . 17711 1 1350 . 1 1 117 117 LEU CD1 C 13 23.9462 0.115 . 1 . . . A 211 LEU CD1 . 17711 1 1351 . 1 1 117 117 LEU CD2 C 13 26.9192 0.095 . 1 . . . A 211 LEU CD2 . 17711 1 1352 . 1 1 117 117 LEU N N 15 117.9462 0.096 . 1 . . . A 211 LEU N . 17711 1 1353 . 1 1 118 118 GLY H H 1 8.0002 0.008 . 1 . . . . 212 GLY H . 17711 1 1354 . 1 1 118 118 GLY HA2 H 1 4.2832 0.009 . 2 . . . A 212 GLY HA2 . 17711 1 1355 . 1 1 118 118 GLY HA3 H 1 3.4992 0.011 . 2 . . . . 212 GLY HA3 . 17711 1 1356 . 1 1 118 118 GLY C C 13 174.5642 0.000 . 1 . . . A 212 GLY C . 17711 1 1357 . 1 1 118 118 GLY CA C 13 48.8682 0.119 . 1 . . . A 212 GLY CA . 17711 1 1358 . 1 1 118 118 GLY N N 15 106.4032 0.063 . 1 . . . A 212 GLY N . 17711 1 1359 . 1 1 119 119 ARG H H 1 8.1652 0.007 . 1 . . . . 213 ARG H . 17711 1 1360 . 1 1 119 119 ARG HA H 1 2.8902 0.013 . 1 . . . A 213 ARG HA . 17711 1 1361 . 1 1 119 119 ARG HB2 H 1 1.3042 0.012 . 2 . . . A 213 ARG HB2 . 17711 1 1362 . 1 1 119 119 ARG HB3 H 1 1.3042 0.012 . 2 . . . . 213 ARG HB3 . 17711 1 1363 . 1 1 119 119 ARG HG2 H 1 1.1532 0.008 . 2 . . . A 213 ARG HG2 . 17711 1 1364 . 1 1 119 119 ARG HG3 H 1 0.8222 0.017 . 2 . . . . 213 ARG HG3 . 17711 1 1365 . 1 1 119 119 ARG HD2 H 1 2.9952 0.010 . 2 . . . A 213 ARG HD2 . 17711 1 1366 . 1 1 119 119 ARG HD3 H 1 2.7802 0.012 . 2 . . . . 213 ARG HD3 . 17711 1 1367 . 1 1 119 119 ARG C C 13 179.3272 0.004 . 1 . . . A 213 ARG C . 17711 1 1368 . 1 1 119 119 ARG CA C 13 59.7722 0.119 . 1 . . . A 213 ARG CA . 17711 1 1369 . 1 1 119 119 ARG CB C 13 29.4602 0.217 . 1 . . . A 213 ARG CB . 17711 1 1370 . 1 1 119 119 ARG CG C 13 29.0462 0.223 . 1 . . . A 213 ARG CG . 17711 1 1371 . 1 1 119 119 ARG CD C 13 44.5022 0.145 . 1 . . . A 213 ARG CD . 17711 1 1372 . 1 1 119 119 ARG N N 15 118.3092 0.122 . 1 . . . A 213 ARG N . 17711 1 1373 . 1 1 120 120 TRP H H 1 7.1212 0.016 . 1 . . . . 214 TRP H . 17711 1 1374 . 1 1 120 120 TRP HA H 1 3.9582 0.015 . 1 . . . A 214 TRP HA . 17711 1 1375 . 1 1 120 120 TRP HB2 H 1 3.0892 0.020 . 2 . . . A 214 TRP HB2 . 17711 1 1376 . 1 1 120 120 TRP HB3 H 1 3.0892 0.020 . 2 . . . . 214 TRP HB3 . 17711 1 1377 . 1 1 120 120 TRP HD1 H 1 7.1492 0.012 . 1 . . . A 214 TRP HD1 . 17711 1 1378 . 1 1 120 120 TRP HE1 H 1 11.0672 0.017 . 1 . . . A 214 TRP HE1 . 17711 1 1379 . 1 1 120 120 TRP HE3 H 1 7.4422 0.010 . 1 . . . A 214 TRP HE3 . 17711 1 1380 . 1 1 120 120 TRP HZ2 H 1 7.4552 0.004 . 1 . . . A 214 TRP HZ2 . 17711 1 1381 . 1 1 120 120 TRP HZ3 H 1 6.8222 0.014 . 1 . . . A 214 TRP HZ3 . 17711 1 1382 . 1 1 120 120 TRP HH2 H 1 7.1422 0.000 . 1 . . . A 214 TRP HH2 . 17711 1 1383 . 1 1 120 120 TRP C C 13 178.2372 0.000 . 1 . . . A 214 TRP C . 17711 1 1384 . 1 1 120 120 TRP CA C 13 62.8102 0.095 . 1 . . . A 214 TRP CA . 17711 1 1385 . 1 1 120 120 TRP CB C 13 30.0512 0.086 . 1 . . . A 214 TRP CB . 17711 1 1386 . 1 1 120 120 TRP CD1 C 13 126.4712 0.105 . 1 . . . A 214 TRP CD1 . 17711 1 1387 . 1 1 120 120 TRP CE3 C 13 120.4782 0.131 . 1 . . . A 214 TRP CE3 . 17711 1 1388 . 1 1 120 120 TRP CZ2 C 13 116.1242 0.022 . 1 . . . A 214 TRP CZ2 . 17711 1 1389 . 1 1 120 120 TRP CZ3 C 13 121.9302 0.162 . 1 . . . A 214 TRP CZ3 . 17711 1 1390 . 1 1 120 120 TRP N N 15 118.7412 0.047 . 1 . . . A 214 TRP N . 17711 1 1391 . 1 1 120 120 TRP NE1 N 15 131.5652 0.038 . 1 . . . A 214 TRP NE1 . 17711 1 1392 . 1 1 121 121 LEU H H 1 8.8332 0.006 . 1 . . . . 215 LEU H . 17711 1 1393 . 1 1 121 121 LEU HA H 1 4.0112 0.007 . 1 . . . A 215 LEU HA . 17711 1 1394 . 1 1 121 121 LEU HB2 H 1 2.2062 0.020 . 2 . . . A 215 LEU HB2 . 17711 1 1395 . 1 1 121 121 LEU HB3 H 1 1.2232 0.015 . 2 . . . . 215 LEU HB3 . 17711 1 1396 . 1 1 121 121 LEU HD11 H 1 0.7812 0.012 . 1 . . . A 215 LEU HD11 . 17711 1 1397 . 1 1 121 121 LEU HD12 H 1 0.7812 0.012 . 1 . . . A 215 LEU HD12 . 17711 1 1398 . 1 1 121 121 LEU HD13 H 1 0.7812 0.012 . 1 . . . A 215 LEU HD13 . 17711 1 1399 . 1 1 121 121 LEU HD21 H 1 0.8632 0.014 . 1 . . . A 215 LEU HD21 . 17711 1 1400 . 1 1 121 121 LEU HD22 H 1 0.8632 0.014 . 1 . . . A 215 LEU HD22 . 17711 1 1401 . 1 1 121 121 LEU HD23 H 1 0.8632 0.014 . 1 . . . A 215 LEU HD23 . 17711 1 1402 . 1 1 121 121 LEU C C 13 178.1462 0.000 . 1 . . . A 215 LEU C . 17711 1 1403 . 1 1 121 121 LEU CA C 13 58.6892 0.122 . 1 . . . A 215 LEU CA . 17711 1 1404 . 1 1 121 121 LEU CB C 13 42.0802 0.104 . 1 . . . A 215 LEU CB . 17711 1 1405 . 1 1 121 121 LEU CD1 C 13 26.5102 0.133 . 1 . . . A 215 LEU CD1 . 17711 1 1406 . 1 1 121 121 LEU CD2 C 13 23.0462 0.142 . 1 . . . A 215 LEU CD2 . 17711 1 1407 . 1 1 121 121 LEU N N 15 117.9522 0.090 . 1 . . . A 215 LEU N . 17711 1 1408 . 1 1 122 122 TYR H H 1 8.6812 0.009 . 1 . . . . 216 TYR H . 17711 1 1409 . 1 1 122 122 TYR HA H 1 3.8022 0.016 . 1 . . . A 216 TYR HA . 17711 1 1410 . 1 1 122 122 TYR HB2 H 1 3.1972 0.013 . 2 . . . A 216 TYR HB2 . 17711 1 1411 . 1 1 122 122 TYR HB3 H 1 3.0462 0.015 . 2 . . . . 216 TYR HB3 . 17711 1 1412 . 1 1 122 122 TYR HD1 H 1 6.8362 0.011 . 3 . . . A 216 TYR HD1 . 17711 1 1413 . 1 1 122 122 TYR HD2 H 1 6.8362 0.011 . 3 . . . A 216 TYR HD2 . 17711 1 1414 . 1 1 122 122 TYR HE1 H 1 6.5152 0.017 . 3 . . . A 216 TYR HE1 . 17711 1 1415 . 1 1 122 122 TYR HE2 H 1 6.5152 0.017 . 3 . . . A 216 TYR HE2 . 17711 1 1416 . 1 1 122 122 TYR C C 13 176.1292 0.000 . 1 . . . A 216 TYR C . 17711 1 1417 . 1 1 122 122 TYR CA C 13 62.6162 0.101 . 1 . . . A 216 TYR CA . 17711 1 1418 . 1 1 122 122 TYR CB C 13 40.4572 0.128 . 1 . . . A 216 TYR CB . 17711 1 1419 . 1 1 122 122 TYR CD1 C 13 133.1602 0.108 . 3 . . . A 216 TYR CD1 . 17711 1 1420 . 1 1 122 122 TYR CD2 C 13 133.1602 0.108 . 3 . . . A 216 TYR CD2 . 17711 1 1421 . 1 1 122 122 TYR CE1 C 13 118.2862 0.046 . 3 . . . A 216 TYR CE1 . 17711 1 1422 . 1 1 122 122 TYR CE2 C 13 118.2862 0.046 . 3 . . . A 216 TYR CE2 . 17711 1 1423 . 1 1 122 122 TYR N N 15 117.9892 0.083 . 1 . . . A 216 TYR N . 17711 1 1424 . 1 1 123 123 ALA H H 1 8.1832 0.009 . 1 . . . . 217 ALA H . 17711 1 1425 . 1 1 123 123 ALA HA H 1 3.9032 0.011 . 1 . . . A 217 ALA HA . 17711 1 1426 . 1 1 123 123 ALA HB1 H 1 1.3272 0.009 . 1 . . . A 217 ALA HB1 . 17711 1 1427 . 1 1 123 123 ALA HB2 H 1 1.3272 0.009 . 1 . . . A 217 ALA HB2 . 17711 1 1428 . 1 1 123 123 ALA HB3 H 1 1.3272 0.009 . 1 . . . A 217 ALA HB3 . 17711 1 1429 . 1 1 123 123 ALA C C 13 179.0652 0.051 . 1 . . . A 217 ALA C . 17711 1 1430 . 1 1 123 123 ALA CA C 13 55.2652 0.096 . 1 . . . A 217 ALA CA . 17711 1 1431 . 1 1 123 123 ALA CB C 13 20.3032 0.082 . 1 . . . A 217 ALA CB . 17711 1 1432 . 1 1 123 123 ALA N N 15 119.7012 0.113 . 1 . . . A 217 ALA N . 17711 1 1433 . 1 1 124 124 LEU H H 1 8.6172 0.014 . 1 . . . . 218 LEU H . 17711 1 1434 . 1 1 124 124 LEU HA H 1 4.0182 0.011 . 1 . . . A 218 LEU HA . 17711 1 1435 . 1 1 124 124 LEU HB2 H 1 2.0612 0.014 . 2 . . . A 218 LEU HB2 . 17711 1 1436 . 1 1 124 124 LEU HB3 H 1 2.0612 0.014 . 2 . . . . 218 LEU HB3 . 17711 1 1437 . 1 1 124 124 LEU HG H 1 1.2622 0.002 . 1 . . . A 218 LEU HG . 17711 1 1438 . 1 1 124 124 LEU HD11 H 1 0.7762 0.010 . 1 . . . A 218 LEU HD11 . 17711 1 1439 . 1 1 124 124 LEU HD12 H 1 0.7762 0.010 . 1 . . . A 218 LEU HD12 . 17711 1 1440 . 1 1 124 124 LEU HD13 H 1 0.7762 0.010 . 1 . . . A 218 LEU HD13 . 17711 1 1441 . 1 1 124 124 LEU HD21 H 1 0.8492 0.008 . 1 . . . A 218 LEU HD21 . 17711 1 1442 . 1 1 124 124 LEU HD22 H 1 0.8492 0.008 . 1 . . . A 218 LEU HD22 . 17711 1 1443 . 1 1 124 124 LEU HD23 H 1 0.8492 0.008 . 1 . . . A 218 LEU HD23 . 17711 1 1444 . 1 1 124 124 LEU C C 13 179.7272 0.000 . 1 . . . A 218 LEU C . 17711 1 1445 . 1 1 124 124 LEU CA C 13 58.4552 0.162 . 1 . . . A 218 LEU CA . 17711 1 1446 . 1 1 124 124 LEU CB C 13 41.0902 0.166 . 1 . . . A 218 LEU CB . 17711 1 1447 . 1 1 124 124 LEU CG C 13 25.7592 0.080 . 1 . . . A 218 LEU CG . 17711 1 1448 . 1 1 124 124 LEU CD1 C 13 25.9982 0.150 . 1 . . . A 218 LEU CD1 . 17711 1 1449 . 1 1 124 124 LEU CD2 C 13 26.9142 0.062 . 1 . . . A 218 LEU CD2 . 17711 1 1450 . 1 1 124 124 LEU N N 15 116.5712 0.076 . 1 . . . A 218 LEU N . 17711 1 1451 . 1 1 125 125 LEU H H 1 8.3422 0.007 . 1 . . . . 219 LEU H . 17711 1 1452 . 1 1 125 125 LEU HA H 1 4.0332 0.011 . 1 . . . A 219 LEU HA . 17711 1 1453 . 1 1 125 125 LEU HB2 H 1 2.2272 0.008 . 2 . . . A 219 LEU HB2 . 17711 1 1454 . 1 1 125 125 LEU HB3 H 1 2.2272 0.008 . 2 . . . . 219 LEU HB3 . 17711 1 1455 . 1 1 125 125 LEU HG H 1 2.0542 0.006 . 1 . . . A 219 LEU HG . 17711 1 1456 . 1 1 125 125 LEU HD11 H 1 0.7442 0.008 . 1 . . . A 219 LEU HD11 . 17711 1 1457 . 1 1 125 125 LEU HD12 H 1 0.7442 0.008 . 1 . . . A 219 LEU HD12 . 17711 1 1458 . 1 1 125 125 LEU HD13 H 1 0.7442 0.008 . 1 . . . A 219 LEU HD13 . 17711 1 1459 . 1 1 125 125 LEU HD21 H 1 0.5762 0.006 . 1 . . . A 219 LEU HD21 . 17711 1 1460 . 1 1 125 125 LEU HD22 H 1 0.5762 0.006 . 1 . . . A 219 LEU HD22 . 17711 1 1461 . 1 1 125 125 LEU HD23 H 1 0.5762 0.006 . 1 . . . A 219 LEU HD23 . 17711 1 1462 . 1 1 125 125 LEU C C 13 179.9572 0.000 . 1 . . . A 219 LEU C . 17711 1 1463 . 1 1 125 125 LEU CA C 13 58.2892 0.059 . 1 . . . A 219 LEU CA . 17711 1 1464 . 1 1 125 125 LEU CB C 13 41.1982 0.164 . 1 . . . A 219 LEU CB . 17711 1 1465 . 1 1 125 125 LEU CG C 13 26.9192 0.111 . 1 . . . A 219 LEU CG . 17711 1 1466 . 1 1 125 125 LEU CD1 C 13 25.8022 0.069 . 1 . . . A 219 LEU CD1 . 17711 1 1467 . 1 1 125 125 LEU CD2 C 13 22.7452 0.085 . 1 . . . A 219 LEU CD2 . 17711 1 1468 . 1 1 125 125 LEU N N 15 117.7672 0.114 . 1 . . . A 219 LEU N . 17711 1 1469 . 1 1 126 126 ALA H H 1 8.5482 0.007 . 1 . . . . 220 ALA H . 17711 1 1470 . 1 1 126 126 ALA HA H 1 3.6342 0.010 . 1 . . . A 220 ALA HA . 17711 1 1471 . 1 1 126 126 ALA HB1 H 1 1.2822 0.009 . 1 . . . A 220 ALA HB1 . 17711 1 1472 . 1 1 126 126 ALA HB2 H 1 1.2822 0.009 . 1 . . . A 220 ALA HB2 . 17711 1 1473 . 1 1 126 126 ALA HB3 H 1 1.2822 0.009 . 1 . . . A 220 ALA HB3 . 17711 1 1474 . 1 1 126 126 ALA C C 13 177.2572 0.028 . 1 . . . A 220 ALA C . 17711 1 1475 . 1 1 126 126 ALA CA C 13 54.6292 0.084 . 1 . . . A 220 ALA CA . 17711 1 1476 . 1 1 126 126 ALA CB C 13 17.5262 0.057 . 1 . . . A 220 ALA CB . 17711 1 1477 . 1 1 126 126 ALA N N 15 120.1572 0.067 . 1 . . . A 220 ALA N . 17711 1 1478 . 1 1 127 127 CYS H H 1 7.3452 0.009 . 1 . . . . 221 CYS H . 17711 1 1479 . 1 1 127 127 CYS HA H 1 4.2152 0.007 . 1 . . . A 221 CYS HA . 17711 1 1480 . 1 1 127 127 CYS HB2 H 1 3.0102 0.010 . 2 . . . A 221 CYS HB2 . 17711 1 1481 . 1 1 127 127 CYS HB3 H 1 3.0102 0.010 . 2 . . . . 221 CYS HB3 . 17711 1 1482 . 1 1 127 127 CYS C C 13 175.4432 0.023 . 1 . . . A 221 CYS C . 17711 1 1483 . 1 1 127 127 CYS CA C 13 60.7302 0.113 . 1 . . . A 221 CYS CA . 17711 1 1484 . 1 1 127 127 CYS CB C 13 29.1762 0.126 . 1 . . . A 221 CYS CB . 17711 1 1485 . 1 1 127 127 CYS N N 15 112.0952 0.085 . 1 . . . A 221 CYS N . 17711 1 1486 . 1 1 128 128 LEU H H 1 7.3932 0.011 . 1 . . . . 222 LEU H . 17711 1 1487 . 1 1 128 128 LEU HA H 1 4.4432 0.008 . 1 . . . A 222 LEU HA . 17711 1 1488 . 1 1 128 128 LEU HB2 H 1 1.7812 0.016 . 2 . . . A 222 LEU HB2 . 17711 1 1489 . 1 1 128 128 LEU HB3 H 1 1.6862 0.006 . 2 . . . . 222 LEU HB3 . 17711 1 1490 . 1 1 128 128 LEU HG H 1 1.7032 0.007 . 1 . . . A 222 LEU HG . 17711 1 1491 . 1 1 128 128 LEU HD11 H 1 0.6792 0.011 . 1 . . . A 222 LEU HD11 . 17711 1 1492 . 1 1 128 128 LEU HD12 H 1 0.6792 0.011 . 1 . . . A 222 LEU HD12 . 17711 1 1493 . 1 1 128 128 LEU HD13 H 1 0.6792 0.011 . 1 . . . A 222 LEU HD13 . 17711 1 1494 . 1 1 128 128 LEU HD21 H 1 0.5332 0.006 . 1 . . . A 222 LEU HD21 . 17711 1 1495 . 1 1 128 128 LEU HD22 H 1 0.5332 0.006 . 1 . . . A 222 LEU HD22 . 17711 1 1496 . 1 1 128 128 LEU HD23 H 1 0.5332 0.006 . 1 . . . A 222 LEU HD23 . 17711 1 1497 . 1 1 128 128 LEU C C 13 176.7002 0.012 . 1 . . . A 222 LEU C . 17711 1 1498 . 1 1 128 128 LEU CA C 13 55.5412 0.125 . 1 . . . A 222 LEU CA . 17711 1 1499 . 1 1 128 128 LEU CB C 13 43.1272 0.075 . 1 . . . A 222 LEU CB . 17711 1 1500 . 1 1 128 128 LEU CG C 13 25.9812 0.098 . 1 . . . A 222 LEU CG . 17711 1 1501 . 1 1 128 128 LEU CD1 C 13 24.2692 0.089 . 1 . . . A 222 LEU CD1 . 17711 1 1502 . 1 1 128 128 LEU CD2 C 13 25.1292 0.104 . 1 . . . A 222 LEU CD2 . 17711 1 1503 . 1 1 128 128 LEU N N 15 123.8372 0.058 . 1 . . . A 222 LEU N . 17711 1 1504 . 1 1 129 129 GLU H H 1 8.8472 0.008 . 1 . . . . 223 GLU H . 17711 1 1505 . 1 1 129 129 GLU HA H 1 4.2872 0.018 . 1 . . . A 223 GLU HA . 17711 1 1506 . 1 1 129 129 GLU HB2 H 1 1.9482 0.027 . 2 . . . A 223 GLU HB2 . 17711 1 1507 . 1 1 129 129 GLU HB3 H 1 1.7662 0.005 . 2 . . . . 223 GLU HB3 . 17711 1 1508 . 1 1 129 129 GLU HG2 H 1 2.3392 0.016 . 2 . . . A 223 GLU HG2 . 17711 1 1509 . 1 1 129 129 GLU HG3 H 1 2.3392 0.016 . 2 . . . . 223 GLU HG3 . 17711 1 1510 . 1 1 129 129 GLU C C 13 175.0482 0.016 . 1 . . . A 223 GLU C . 17711 1 1511 . 1 1 129 129 GLU CA C 13 56.5992 0.037 . 1 . . . A 223 GLU CA . 17711 1 1512 . 1 1 129 129 GLU CB C 13 30.8682 0.132 . 1 . . . A 223 GLU CB . 17711 1 1513 . 1 1 129 129 GLU CG C 13 36.5602 0.127 . 1 . . . A 223 GLU CG . 17711 1 1514 . 1 1 129 129 GLU N N 15 127.1562 0.049 . 1 . . . A 223 GLU N . 17711 1 1515 . 1 1 130 130 LYS H H 1 8.3492 0.016 . 1 . . . . 224 LYS H . 17711 1 1516 . 1 1 130 130 LYS HA H 1 4.4422 0.009 . 1 . . . A 224 LYS HA . 17711 1 1517 . 1 1 130 130 LYS HB2 H 1 1.8532 0.000 . 2 . . . A 224 LYS HB2 . 17711 1 1518 . 1 1 130 130 LYS HB3 H 1 1.6432 0.000 . 2 . . . . 224 LYS HB3 . 17711 1 1519 . 1 1 130 130 LYS HG2 H 1 1.4622 0.009 . 2 . . . A 224 LYS HG2 . 17711 1 1520 . 1 1 130 130 LYS HG3 H 1 1.4622 0.009 . 2 . . . . 224 LYS HG3 . 17711 1 1521 . 1 1 130 130 LYS HE2 H 1 2.7852 0.000 . 2 . . . A 224 LYS HE2 . 17711 1 1522 . 1 1 130 130 LYS HE3 H 1 2.7852 0.000 . 2 . . . . 224 LYS HE3 . 17711 1 1523 . 1 1 130 130 LYS C C 13 175.1512 0.000 . 1 . . . A 224 LYS C . 17711 1 1524 . 1 1 130 130 LYS CA C 13 54.2112 0.087 . 1 . . . A 224 LYS CA . 17711 1 1525 . 1 1 130 130 LYS CB C 13 33.6332 0.046 . 1 . . . A 224 LYS CB . 17711 1 1526 . 1 1 130 130 LYS CG C 13 25.4722 0.361 . 1 . . . A 224 LYS CG . 17711 1 1527 . 1 1 130 130 LYS N N 15 119.2842 0.091 . 1 . . . A 224 LYS N . 17711 1 1528 . 1 1 131 131 PRO HA H 1 4.5122 0.007 . 1 . . . A 225 PRO HA . 17711 1 1529 . 1 1 131 131 PRO HB2 H 1 2.4152 0.007 . 2 . . . A 225 PRO HB2 . 17711 1 1530 . 1 1 131 131 PRO HB3 H 1 2.0342 0.012 . 2 . . . . 225 PRO HB3 . 17711 1 1531 . 1 1 131 131 PRO HG2 H 1 1.9362 0.009 . 2 . . . A 225 PRO HG2 . 17711 1 1532 . 1 1 131 131 PRO HG3 H 1 1.9362 0.009 . 2 . . . . 225 PRO HG3 . 17711 1 1533 . 1 1 131 131 PRO HD2 H 1 3.5382 0.000 . 2 . . . A 225 PRO HD2 . 17711 1 1534 . 1 1 131 131 PRO HD3 H 1 3.5382 0.000 . 2 . . . . 225 PRO HD3 . 17711 1 1535 . 1 1 131 131 PRO C C 13 175.7132 0.000 . 1 . . . A 225 PRO C . 17711 1 1536 . 1 1 131 131 PRO CA C 13 61.8202 0.065 . 1 . . . A 225 PRO CA . 17711 1 1537 . 1 1 131 131 PRO CB C 13 34.3132 0.043 . 1 . . . A 225 PRO CB . 17711 1 1538 . 1 1 131 131 PRO CG C 13 25.0282 0.060 . 1 . . . A 225 PRO CG . 17711 1 1539 . 1 1 131 131 PRO CD C 13 50.6702 0.000 . 1 . . . A 225 PRO CD . 17711 1 1540 . 1 1 132 132 LEU H H 1 8.7162 0.006 . 1 . . . . 226 LEU H . 17711 1 1541 . 1 1 132 132 LEU HA H 1 4.3652 0.013 . 1 . . . A 226 LEU HA . 17711 1 1542 . 1 1 132 132 LEU HB2 H 1 1.5712 0.025 . 2 . . . A 226 LEU HB2 . 17711 1 1543 . 1 1 132 132 LEU HB3 H 1 1.5712 0.025 . 2 . . . . 226 LEU HB3 . 17711 1 1544 . 1 1 132 132 LEU HG H 1 1.8622 0.008 . 1 . . . A 226 LEU HG . 17711 1 1545 . 1 1 132 132 LEU HD11 H 1 0.9062 0.006 . 1 . . . A 226 LEU HD11 . 17711 1 1546 . 1 1 132 132 LEU HD12 H 1 0.9062 0.006 . 1 . . . A 226 LEU HD12 . 17711 1 1547 . 1 1 132 132 LEU HD13 H 1 0.9062 0.006 . 1 . . . A 226 LEU HD13 . 17711 1 1548 . 1 1 132 132 LEU HD21 H 1 0.8132 0.005 . 1 . . . A 226 LEU HD21 . 17711 1 1549 . 1 1 132 132 LEU HD22 H 1 0.8132 0.005 . 1 . . . A 226 LEU HD22 . 17711 1 1550 . 1 1 132 132 LEU HD23 H 1 0.8132 0.005 . 1 . . . A 226 LEU HD23 . 17711 1 1551 . 1 1 132 132 LEU C C 13 178.5582 0.020 . 1 . . . A 226 LEU C . 17711 1 1552 . 1 1 132 132 LEU CA C 13 55.0792 0.089 . 1 . . . A 226 LEU CA . 17711 1 1553 . 1 1 132 132 LEU CB C 13 42.5832 0.140 . 1 . . . A 226 LEU CB . 17711 1 1554 . 1 1 132 132 LEU CG C 13 27.7812 0.020 . 1 . . . A 226 LEU CG . 17711 1 1555 . 1 1 132 132 LEU CD1 C 13 26.3292 0.052 . 1 . . . A 226 LEU CD1 . 17711 1 1556 . 1 1 132 132 LEU CD2 C 13 23.9862 0.066 . 1 . . . A 226 LEU CD2 . 17711 1 1557 . 1 1 132 132 LEU N N 15 122.6472 0.075 . 1 . . . A 226 LEU N . 17711 1 1558 . 1 1 133 133 LEU H H 1 9.0302 0.013 . 1 . . . . 227 LEU H . 17711 1 1559 . 1 1 133 133 LEU HA H 1 4.5632 0.012 . 1 . . . A 227 LEU HA . 17711 1 1560 . 1 1 133 133 LEU HB2 H 1 1.8372 0.011 . 2 . . . A 227 LEU HB2 . 17711 1 1561 . 1 1 133 133 LEU HB3 H 1 1.6502 0.012 . 2 . . . . 227 LEU HB3 . 17711 1 1562 . 1 1 133 133 LEU HG H 1 1.9372 0.006 . 1 . . . A 227 LEU HG . 17711 1 1563 . 1 1 133 133 LEU HD11 H 1 0.9812 0.014 . 1 . . . A 227 LEU HD11 . 17711 1 1564 . 1 1 133 133 LEU HD12 H 1 0.9812 0.014 . 1 . . . A 227 LEU HD12 . 17711 1 1565 . 1 1 133 133 LEU HD13 H 1 0.9812 0.014 . 1 . . . A 227 LEU HD13 . 17711 1 1566 . 1 1 133 133 LEU HD21 H 1 1.0022 0.009 . 1 . . . A 227 LEU HD21 . 17711 1 1567 . 1 1 133 133 LEU HD22 H 1 1.0022 0.009 . 1 . . . A 227 LEU HD22 . 17711 1 1568 . 1 1 133 133 LEU HD23 H 1 1.0022 0.009 . 1 . . . A 227 LEU HD23 . 17711 1 1569 . 1 1 133 133 LEU C C 13 176.4062 0.000 . 1 . . . A 227 LEU C . 17711 1 1570 . 1 1 133 133 LEU CA C 13 53.8122 0.095 . 1 . . . A 227 LEU CA . 17711 1 1571 . 1 1 133 133 LEU CB C 13 40.2022 0.121 . 1 . . . A 227 LEU CB . 17711 1 1572 . 1 1 133 133 LEU CG C 13 27.6322 0.051 . 1 . . . A 227 LEU CG . 17711 1 1573 . 1 1 133 133 LEU CD1 C 13 25.1172 0.069 . 1 . . . A 227 LEU CD1 . 17711 1 1574 . 1 1 133 133 LEU CD2 C 13 22.7062 0.088 . 1 . . . A 227 LEU CD2 . 17711 1 1575 . 1 1 133 133 LEU N N 15 125.5332 0.040 . 1 . . . A 227 LEU N . 17711 1 1576 . 1 1 134 134 PRO HA H 1 4.2952 0.008 . 1 . . . A 228 PRO HA . 17711 1 1577 . 1 1 134 134 PRO HB2 H 1 2.4012 0.005 . 2 . . . A 228 PRO HB2 . 17711 1 1578 . 1 1 134 134 PRO HB3 H 1 1.9342 0.039 . 2 . . . . 228 PRO HB3 . 17711 1 1579 . 1 1 134 134 PRO HG2 H 1 1.9662 0.011 . 2 . . . A 228 PRO HG2 . 17711 1 1580 . 1 1 134 134 PRO HG3 H 1 1.9662 0.011 . 2 . . . . 228 PRO HG3 . 17711 1 1581 . 1 1 134 134 PRO HD2 H 1 3.9012 0.018 . 2 . . . A 228 PRO HD2 . 17711 1 1582 . 1 1 134 134 PRO HD3 H 1 3.8412 0.019 . 2 . . . . 228 PRO HD3 . 17711 1 1583 . 1 1 134 134 PRO C C 13 179.4492 0.004 . 1 . . . A 228 PRO C . 17711 1 1584 . 1 1 134 134 PRO CA C 13 66.3502 0.141 . 1 . . . A 228 PRO CA . 17711 1 1585 . 1 1 134 134 PRO CB C 13 31.9572 0.163 . 1 . . . A 228 PRO CB . 17711 1 1586 . 1 1 134 134 PRO CG C 13 27.7272 0.000 . 1 . . . A 228 PRO CG . 17711 1 1587 . 1 1 134 134 PRO CD C 13 50.1962 0.161 . 1 . . . A 228 PRO CD . 17711 1 1588 . 1 1 135 135 GLU H H 1 9.5762 0.009 . 1 . . . . 229 GLU H . 17711 1 1589 . 1 1 135 135 GLU HA H 1 4.1212 0.011 . 1 . . . A 229 GLU HA . 17711 1 1590 . 1 1 135 135 GLU HB2 H 1 2.0042 0.002 . 2 . . . A 229 GLU HB2 . 17711 1 1591 . 1 1 135 135 GLU HB3 H 1 1.9492 0.008 . 2 . . . . 229 GLU HB3 . 17711 1 1592 . 1 1 135 135 GLU HG2 H 1 2.3692 0.005 . 2 . . . A 229 GLU HG2 . 17711 1 1593 . 1 1 135 135 GLU HG3 H 1 2.2872 0.014 . 2 . . . . 229 GLU HG3 . 17711 1 1594 . 1 1 135 135 GLU C C 13 178.7712 0.015 . 1 . . . A 229 GLU C . 17711 1 1595 . 1 1 135 135 GLU CA C 13 59.8862 0.099 . 1 . . . A 229 GLU CA . 17711 1 1596 . 1 1 135 135 GLU CB C 13 28.5162 0.107 . 1 . . . A 229 GLU CB . 17711 1 1597 . 1 1 135 135 GLU CG C 13 36.5802 0.073 . 1 . . . A 229 GLU CG . 17711 1 1598 . 1 1 135 135 GLU N N 15 116.8972 0.047 . 1 . . . A 229 GLU N . 17711 1 1599 . 1 1 136 136 ALA H H 1 7.3632 0.007 . 1 . . . . 230 ALA H . 17711 1 1600 . 1 1 136 136 ALA HA H 1 4.0632 0.012 . 1 . . . A 230 ALA HA . 17711 1 1601 . 1 1 136 136 ALA HB1 H 1 1.5482 0.011 . 1 . . . A 230 ALA HB1 . 17711 1 1602 . 1 1 136 136 ALA HB2 H 1 1.5482 0.011 . 1 . . . A 230 ALA HB2 . 17711 1 1603 . 1 1 136 136 ALA HB3 H 1 1.5482 0.011 . 1 . . . A 230 ALA HB3 . 17711 1 1604 . 1 1 136 136 ALA C C 13 178.4642 0.034 . 1 . . . A 230 ALA C . 17711 1 1605 . 1 1 136 136 ALA CA C 13 54.7862 0.114 . 1 . . . A 230 ALA CA . 17711 1 1606 . 1 1 136 136 ALA CB C 13 19.2942 0.090 . 1 . . . A 230 ALA CB . 17711 1 1607 . 1 1 136 136 ALA N N 15 121.4902 0.070 . 1 . . . A 230 ALA N . 17711 1 1608 . 1 1 137 137 HIS H H 1 8.1602 0.008 . 1 . . . . 231 HIS H . 17711 1 1609 . 1 1 137 137 HIS HA H 1 4.0032 0.016 . 1 . . . A 231 HIS HA . 17711 1 1610 . 1 1 137 137 HIS HB2 H 1 3.3322 0.013 . 2 . . . A 231 HIS HB2 . 17711 1 1611 . 1 1 137 137 HIS HB3 H 1 3.0712 0.016 . 2 . . . . 231 HIS HB3 . 17711 1 1612 . 1 1 137 137 HIS HD2 H 1 6.8932 0.010 . 1 . . . A 231 HIS HD2 . 17711 1 1613 . 1 1 137 137 HIS HE1 H 1 7.8752 0.002 . 1 . . . A 231 HIS HE1 . 17711 1 1614 . 1 1 137 137 HIS C C 13 176.5482 0.013 . 1 . . . A 231 HIS C . 17711 1 1615 . 1 1 137 137 HIS CA C 13 60.0352 0.186 . 1 . . . A 231 HIS CA . 17711 1 1616 . 1 1 137 137 HIS CB C 13 30.6362 0.132 . 1 . . . A 231 HIS CB . 17711 1 1617 . 1 1 137 137 HIS CD2 C 13 118.4872 0.180 . 1 . . . A 231 HIS CD2 . 17711 1 1618 . 1 1 137 137 HIS CE1 C 13 138.5532 0.039 . 1 . . . A 231 HIS CE1 . 17711 1 1619 . 1 1 137 137 HIS N N 15 118.0352 0.071 . 1 . . . A 231 HIS N . 17711 1 1620 . 1 1 138 138 SER H H 1 7.9522 0.009 . 1 . . . . 232 SER H . 17711 1 1621 . 1 1 138 138 SER HA H 1 4.0552 0.008 . 1 . . . A 232 SER HA . 17711 1 1622 . 1 1 138 138 SER HB2 H 1 3.9532 0.011 . 2 . . . A 232 SER HB2 . 17711 1 1623 . 1 1 138 138 SER HB3 H 1 3.9532 0.011 . 2 . . . . 232 SER HB3 . 17711 1 1624 . 1 1 138 138 SER C C 13 177.6042 0.000 . 1 . . . A 232 SER C . 17711 1 1625 . 1 1 138 138 SER CA C 13 61.5622 0.142 . 1 . . . A 232 SER CA . 17711 1 1626 . 1 1 138 138 SER CB C 13 62.6592 0.096 . 1 . . . A 232 SER CB . 17711 1 1627 . 1 1 138 138 SER N N 15 111.4302 0.069 . 1 . . . A 232 SER N . 17711 1 1628 . 1 1 139 139 LEU H H 1 7.6332 0.007 . 1 . . . . 233 LEU H . 17711 1 1629 . 1 1 139 139 LEU HA H 1 4.1242 0.018 . 1 . . . A 233 LEU HA . 17711 1 1630 . 1 1 139 139 LEU HB2 H 1 1.9072 0.015 . 2 . . . A 233 LEU HB2 . 17711 1 1631 . 1 1 139 139 LEU HB3 H 1 1.3842 0.010 . 2 . . . . 233 LEU HB3 . 17711 1 1632 . 1 1 139 139 LEU HG H 1 1.7352 0.009 . 1 . . . A 233 LEU HG . 17711 1 1633 . 1 1 139 139 LEU HD11 H 1 0.8182 0.009 . 1 . . . A 233 LEU HD11 . 17711 1 1634 . 1 1 139 139 LEU HD12 H 1 0.8182 0.009 . 1 . . . A 233 LEU HD12 . 17711 1 1635 . 1 1 139 139 LEU HD13 H 1 0.8182 0.009 . 1 . . . A 233 LEU HD13 . 17711 1 1636 . 1 1 139 139 LEU HD21 H 1 0.8392 0.015 . 1 . . . A 233 LEU HD21 . 17711 1 1637 . 1 1 139 139 LEU HD22 H 1 0.8392 0.015 . 1 . . . A 233 LEU HD22 . 17711 1 1638 . 1 1 139 139 LEU HD23 H 1 0.8392 0.015 . 1 . . . A 233 LEU HD23 . 17711 1 1639 . 1 1 139 139 LEU C C 13 179.9542 0.006 . 1 . . . A 233 LEU C . 17711 1 1640 . 1 1 139 139 LEU CA C 13 57.8822 0.127 . 1 . . . A 233 LEU CA . 17711 1 1641 . 1 1 139 139 LEU CB C 13 42.6902 0.109 . 1 . . . A 233 LEU CB . 17711 1 1642 . 1 1 139 139 LEU CG C 13 26.8522 0.115 . 1 . . . A 233 LEU CG . 17711 1 1643 . 1 1 139 139 LEU CD1 C 13 25.8572 0.078 . 1 . . . A 233 LEU CD1 . 17711 1 1644 . 1 1 139 139 LEU CD2 C 13 24.3232 0.081 . 1 . . . A 233 LEU CD2 . 17711 1 1645 . 1 1 139 139 LEU N N 15 121.4872 0.100 . 1 . . . A 233 LEU N . 17711 1 1646 . 1 1 140 140 ILE H H 1 8.4632 0.013 . 1 . . . . 234 ILE H . 17711 1 1647 . 1 1 140 140 ILE HA H 1 4.0222 0.010 . 1 . . . A 234 ILE HA . 17711 1 1648 . 1 1 140 140 ILE HB H 1 1.8812 0.009 . 1 . . . A 234 ILE HB . 17711 1 1649 . 1 1 140 140 ILE HG12 H 1 1.7082 0.010 . 2 . . . A 234 ILE HG12 . 17711 1 1650 . 1 1 140 140 ILE HG13 H 1 1.7082 0.010 . 2 . . . . 234 ILE HG13 . 17711 1 1651 . 1 1 140 140 ILE HG21 H 1 0.6712 0.006 . 1 . . . A 234 ILE HG21 . 17711 1 1652 . 1 1 140 140 ILE HG22 H 1 0.6712 0.006 . 1 . . . A 234 ILE HG22 . 17711 1 1653 . 1 1 140 140 ILE HG23 H 1 0.6712 0.006 . 1 . . . A 234 ILE HG23 . 17711 1 1654 . 1 1 140 140 ILE HD11 H 1 0.6082 0.011 . 1 . . . A 234 ILE HD11 . 17711 1 1655 . 1 1 140 140 ILE HD12 H 1 0.6082 0.011 . 1 . . . A 234 ILE HD12 . 17711 1 1656 . 1 1 140 140 ILE HD13 H 1 0.6082 0.011 . 1 . . . A 234 ILE HD13 . 17711 1 1657 . 1 1 140 140 ILE C C 13 177.6282 0.000 . 1 . . . A 234 ILE C . 17711 1 1658 . 1 1 140 140 ILE CA C 13 65.8372 0.109 . 1 . . . A 234 ILE CA . 17711 1 1659 . 1 1 140 140 ILE CB C 13 36.7692 0.162 . 1 . . . A 234 ILE CB . 17711 1 1660 . 1 1 140 140 ILE CG1 C 13 25.9332 0.344 . 1 . . . A 234 ILE CG1 . 17711 1 1661 . 1 1 140 140 ILE CG2 C 13 17.6712 0.086 . 1 . . . A 234 ILE CG2 . 17711 1 1662 . 1 1 140 140 ILE CD1 C 13 15.7292 0.090 . 1 . . . A 234 ILE CD1 . 17711 1 1663 . 1 1 140 140 ILE N N 15 113.7302 0.082 . 1 . . . A 234 ILE N . 17711 1 1664 . 1 1 141 141 ARG H H 1 7.3392 0.011 . 1 . . . . 235 ARG H . 17711 1 1665 . 1 1 141 141 ARG HA H 1 3.8122 0.006 . 1 . . . A 235 ARG HA . 17711 1 1666 . 1 1 141 141 ARG C C 13 178.2362 0.000 . 1 . . . A 235 ARG C . 17711 1 1667 . 1 1 141 141 ARG CA C 13 60.3582 0.111 . 1 . . . A 235 ARG CA . 17711 1 1668 . 1 1 141 141 ARG N N 15 121.9942 0.145 . 1 . . . A 235 ARG N . 17711 1 1669 . 1 1 142 142 GLN H H 1 7.8332 0.008 . 1 . . . . 236 GLN H . 17711 1 1670 . 1 1 142 142 GLN HA H 1 4.0352 0.014 . 1 . . . A 236 GLN HA . 17711 1 1671 . 1 1 142 142 GLN HB2 H 1 2.2262 0.010 . 2 . . . A 236 GLN HB2 . 17711 1 1672 . 1 1 142 142 GLN HB3 H 1 2.2262 0.010 . 2 . . . . 236 GLN HB3 . 17711 1 1673 . 1 1 142 142 GLN HG2 H 1 2.4342 0.014 . 2 . . . A 236 GLN HG2 . 17711 1 1674 . 1 1 142 142 GLN HG3 H 1 2.4342 0.014 . 2 . . . . 236 GLN HG3 . 17711 1 1675 . 1 1 142 142 GLN C C 13 178.7592 0.000 . 1 . . . A 236 GLN C . 17711 1 1676 . 1 1 142 142 GLN CA C 13 58.8022 0.095 . 1 . . . A 236 GLN CA . 17711 1 1677 . 1 1 142 142 GLN CB C 13 28.1192 0.108 . 1 . . . A 236 GLN CB . 17711 1 1678 . 1 1 142 142 GLN CG C 13 33.6992 0.130 . 1 . . . A 236 GLN CG . 17711 1 1679 . 1 1 142 142 GLN N N 15 119.3912 0.069 . 1 . . . A 236 GLN N . 17711 1 1680 . 1 1 143 143 LEU H H 1 8.3682 0.010 . 1 . . . . 237 LEU H . 17711 1 1681 . 1 1 143 143 LEU HA H 1 4.3472 0.012 . 1 . . . A 237 LEU HA . 17711 1 1682 . 1 1 143 143 LEU HB2 H 1 1.9622 0.012 . 2 . . . A 237 LEU HB2 . 17711 1 1683 . 1 1 143 143 LEU HB3 H 1 1.8412 0.010 . 2 . . . . 237 LEU HB3 . 17711 1 1684 . 1 1 143 143 LEU HG H 1 1.7562 0.019 . 1 . . . A 237 LEU HG . 17711 1 1685 . 1 1 143 143 LEU HD11 H 1 1.1642 0.005 . 1 . . . A 237 LEU HD11 . 17711 1 1686 . 1 1 143 143 LEU HD12 H 1 1.1642 0.005 . 1 . . . A 237 LEU HD12 . 17711 1 1687 . 1 1 143 143 LEU HD13 H 1 1.1642 0.005 . 1 . . . A 237 LEU HD13 . 17711 1 1688 . 1 1 143 143 LEU HD21 H 1 1.0302 0.008 . 1 . . . A 237 LEU HD21 . 17711 1 1689 . 1 1 143 143 LEU HD22 H 1 1.0302 0.008 . 1 . . . A 237 LEU HD22 . 17711 1 1690 . 1 1 143 143 LEU HD23 H 1 1.0302 0.008 . 1 . . . A 237 LEU HD23 . 17711 1 1691 . 1 1 143 143 LEU C C 13 179.0322 0.000 . 1 . . . A 237 LEU C . 17711 1 1692 . 1 1 143 143 LEU CA C 13 58.0302 0.096 . 1 . . . A 237 LEU CA . 17711 1 1693 . 1 1 143 143 LEU CB C 13 42.0652 0.098 . 1 . . . A 237 LEU CB . 17711 1 1694 . 1 1 143 143 LEU CG C 13 27.5632 0.071 . 1 . . . A 237 LEU CG . 17711 1 1695 . 1 1 143 143 LEU CD1 C 13 24.8012 0.056 . 1 . . . A 237 LEU CD1 . 17711 1 1696 . 1 1 143 143 LEU CD2 C 13 25.5162 0.128 . 1 . . . A 237 LEU CD2 . 17711 1 1697 . 1 1 143 143 LEU N N 15 121.1782 0.093 . 1 . . . A 237 LEU N . 17711 1 1698 . 1 1 144 144 ALA H H 1 8.1452 0.007 . 1 . . . . 238 ALA H . 17711 1 1699 . 1 1 144 144 ALA HA H 1 3.9512 0.007 . 1 . . . A 238 ALA HA . 17711 1 1700 . 1 1 144 144 ALA HB1 H 1 1.5582 0.009 . 1 . . . A 238 ALA HB1 . 17711 1 1701 . 1 1 144 144 ALA HB2 H 1 1.5582 0.009 . 1 . . . A 238 ALA HB2 . 17711 1 1702 . 1 1 144 144 ALA HB3 H 1 1.5582 0.009 . 1 . . . A 238 ALA HB3 . 17711 1 1703 . 1 1 144 144 ALA C C 13 179.5202 0.023 . 1 . . . A 238 ALA C . 17711 1 1704 . 1 1 144 144 ALA CA C 13 55.8942 0.078 . 1 . . . A 238 ALA CA . 17711 1 1705 . 1 1 144 144 ALA CB C 13 18.1622 0.108 . 1 . . . A 238 ALA CB . 17711 1 1706 . 1 1 144 144 ALA N N 15 121.7542 0.081 . 1 . . . A 238 ALA N . 17711 1 1707 . 1 1 145 145 ARG H H 1 8.1372 0.007 . 1 . . . . 239 ARG H . 17711 1 1708 . 1 1 145 145 ARG HA H 1 4.0102 0.005 . 1 . . . A 239 ARG HA . 17711 1 1709 . 1 1 145 145 ARG HB2 H 1 1.9202 0.007 . 2 . . . A 239 ARG HB2 . 17711 1 1710 . 1 1 145 145 ARG HB3 H 1 1.9202 0.007 . 2 . . . . 239 ARG HB3 . 17711 1 1711 . 1 1 145 145 ARG HG2 H 1 1.8372 0.002 . 2 . . . A 239 ARG HG2 . 17711 1 1712 . 1 1 145 145 ARG HG3 H 1 1.5922 0.007 . 2 . . . . 239 ARG HG3 . 17711 1 1713 . 1 1 145 145 ARG HD2 H 1 3.1862 0.006 . 2 . . . A 239 ARG HD2 . 17711 1 1714 . 1 1 145 145 ARG HD3 H 1 3.1862 0.006 . 2 . . . . 239 ARG HD3 . 17711 1 1715 . 1 1 145 145 ARG C C 13 179.0552 0.004 . 1 . . . A 239 ARG C . 17711 1 1716 . 1 1 145 145 ARG CA C 13 59.8832 0.137 . 1 . . . A 239 ARG CA . 17711 1 1717 . 1 1 145 145 ARG CB C 13 29.5462 0.081 . 1 . . . A 239 ARG CB . 17711 1 1718 . 1 1 145 145 ARG CG C 13 27.9202 0.176 . 1 . . . A 239 ARG CG . 17711 1 1719 . 1 1 145 145 ARG CD C 13 43.1742 0.076 . 1 . . . A 239 ARG CD . 17711 1 1720 . 1 1 145 145 ARG N N 15 118.1202 0.086 . 1 . . . A 239 ARG N . 17711 1 1721 . 1 1 146 146 ARG H H 1 8.3792 0.009 . 1 . . . . 240 ARG H . 17711 1 1722 . 1 1 146 146 ARG C C 13 178.4912 0.025 . 1 . . . A 240 ARG C . 17711 1 1723 . 1 1 146 146 ARG CA C 13 57.8082 0.145 . 1 . . . A 240 ARG CA . 17711 1 1724 . 1 1 146 146 ARG N N 15 121.3722 0.050 . 1 . . . A 240 ARG N . 17711 1 1725 . 1 1 147 147 CYS H H 1 8.5652 0.008 . 1 . . . . 241 CYS H . 17711 1 1726 . 1 1 147 147 CYS HA H 1 4.1782 0.011 . 1 . . . A 241 CYS HA . 17711 1 1727 . 1 1 147 147 CYS HB2 H 1 3.4092 0.014 . 2 . . . A 241 CYS HB2 . 17711 1 1728 . 1 1 147 147 CYS HB3 H 1 2.5502 0.010 . 2 . . . . 241 CYS HB3 . 17711 1 1729 . 1 1 147 147 CYS C C 13 176.5512 0.019 . 1 . . . A 241 CYS C . 17711 1 1730 . 1 1 147 147 CYS CA C 13 64.8452 0.117 . 1 . . . A 241 CYS CA . 17711 1 1731 . 1 1 147 147 CYS CB C 13 27.3642 0.161 . 1 . . . A 241 CYS CB . 17711 1 1732 . 1 1 147 147 CYS N N 15 116.1842 0.049 . 1 . . . A 241 CYS N . 17711 1 1733 . 1 1 148 148 SER H H 1 8.1152 0.008 . 1 . . . . 242 SER H . 17711 1 1734 . 1 1 148 148 SER HA H 1 3.9862 0.025 . 1 . . . A 242 SER HA . 17711 1 1735 . 1 1 148 148 SER HB2 H 1 4.0172 0.006 . 2 . . . A 242 SER HB2 . 17711 1 1736 . 1 1 148 148 SER HB3 H 1 4.0172 0.006 . 2 . . . . 242 SER HB3 . 17711 1 1737 . 1 1 148 148 SER CA C 13 62.0002 0.159 . 1 . . . A 242 SER CA . 17711 1 1738 . 1 1 148 148 SER CB C 13 62.7692 0.199 . 1 . . . A 242 SER CB . 17711 1 1739 . 1 1 148 148 SER N N 15 114.6972 0.089 . 1 . . . A 242 SER N . 17711 1 1740 . 1 1 149 149 GLU H H 1 8.0432 0.009 . 1 . . . . 243 GLU H . 17711 1 1741 . 1 1 149 149 GLU HA H 1 4.0232 0.010 . 1 . . . A 243 GLU HA . 17711 1 1742 . 1 1 149 149 GLU HB2 H 1 2.1422 0.024 . 2 . . . A 243 GLU HB2 . 17711 1 1743 . 1 1 149 149 GLU HB3 H 1 2.1422 0.024 . 2 . . . . 243 GLU HB3 . 17711 1 1744 . 1 1 149 149 GLU HG2 H 1 2.4042 0.017 . 2 . . . A 243 GLU HG2 . 17711 1 1745 . 1 1 149 149 GLU HG3 H 1 2.1952 0.014 . 2 . . . . 243 GLU HG3 . 17711 1 1746 . 1 1 149 149 GLU C C 13 179.4842 0.000 . 1 . . . A 243 GLU C . 17711 1 1747 . 1 1 149 149 GLU CA C 13 59.3942 0.112 . 1 . . . A 243 GLU CA . 17711 1 1748 . 1 1 149 149 GLU CB C 13 30.0092 0.150 . 1 . . . A 243 GLU CB . 17711 1 1749 . 1 1 149 149 GLU CG C 13 36.3862 0.096 . 1 . . . A 243 GLU CG . 17711 1 1750 . 1 1 149 149 GLU N N 15 122.3802 0.054 . 1 . . . A 243 GLU N . 17711 1 1751 . 1 1 150 150 VAL H H 1 8.3132 0.014 . 1 . . . . 244 VAL H . 17711 1 1752 . 1 1 150 150 VAL HA H 1 3.7232 0.009 . 1 . . . A 244 VAL HA . 17711 1 1753 . 1 1 150 150 VAL HB H 1 2.1842 0.016 . 1 . . . A 244 VAL HB . 17711 1 1754 . 1 1 150 150 VAL HG11 H 1 1.1112 0.008 . 2 . . . A 244 VAL HG11 . 17711 1 1755 . 1 1 150 150 VAL HG12 H 1 1.1112 0.008 . 2 . . . A 244 VAL HG12 . 17711 1 1756 . 1 1 150 150 VAL HG13 H 1 1.1112 0.008 . 2 . . . A 244 VAL HG13 . 17711 1 1757 . 1 1 150 150 VAL HG21 H 1 1.1112 0.008 . 2 . . . A 244 VAL HG21 . 17711 1 1758 . 1 1 150 150 VAL HG22 H 1 1.1112 0.008 . 2 . . . A 244 VAL HG22 . 17711 1 1759 . 1 1 150 150 VAL HG23 H 1 1.1112 0.008 . 2 . . . A 244 VAL HG23 . 17711 1 1760 . 1 1 150 150 VAL C C 13 178.3042 0.000 . 1 . . . A 244 VAL C . 17711 1 1761 . 1 1 150 150 VAL CA C 13 65.9672 0.126 . 1 . . . A 244 VAL CA . 17711 1 1762 . 1 1 150 150 VAL CB C 13 31.6012 0.110 . 1 . . . A 244 VAL CB . 17711 1 1763 . 1 1 150 150 VAL CG1 C 13 22.5052 0.105 . 2 . . . A 244 VAL CG1 . 17711 1 1764 . 1 1 150 150 VAL CG2 C 13 22.5052 0.105 . 2 . . . A 244 VAL CG2 . 17711 1 1765 . 1 1 150 150 VAL N N 15 118.3362 0.077 . 1 . . . A 244 VAL N . 17711 1 1766 . 1 1 151 151 ARG H H 1 8.1152 0.007 . 1 . . . . 245 ARG H . 17711 1 1767 . 1 1 151 151 ARG HA H 1 3.7282 0.011 . 1 . . . A 245 ARG HA . 17711 1 1768 . 1 1 151 151 ARG HB2 H 1 2.1422 0.011 . 2 . . . A 245 ARG HB2 . 17711 1 1769 . 1 1 151 151 ARG HB3 H 1 1.7402 0.010 . 2 . . . . 245 ARG HB3 . 17711 1 1770 . 1 1 151 151 ARG HG2 H 1 1.5472 0.000 . 2 . . . A 245 ARG HG2 . 17711 1 1771 . 1 1 151 151 ARG HG3 H 1 1.5472 0.000 . 2 . . . . 245 ARG HG3 . 17711 1 1772 . 1 1 151 151 ARG HD2 H 1 3.0192 0.116 . 2 . . . A 245 ARG HD2 . 17711 1 1773 . 1 1 151 151 ARG C C 13 177.2552 0.012 . 1 . . . A 245 ARG C . 17711 1 1774 . 1 1 151 151 ARG CA C 13 59.5862 0.104 . 1 . . . A 245 ARG CA . 17711 1 1775 . 1 1 151 151 ARG CB C 13 30.7942 0.173 . 1 . . . A 245 ARG CB . 17711 1 1776 . 1 1 151 151 ARG CG C 13 26.5342 0.000 . 1 . . . A 245 ARG CG . 17711 1 1777 . 1 1 151 151 ARG N N 15 120.2122 0.041 . 1 . . . A 245 ARG N . 17711 1 1778 . 1 1 152 152 LEU H H 1 7.2822 0.010 . 1 . . . . 246 LEU H . 17711 1 1779 . 1 1 152 152 LEU HA H 1 4.1892 0.007 . 1 . . . A 246 LEU HA . 17711 1 1780 . 1 1 152 152 LEU HB2 H 1 1.8852 0.008 . 2 . . . A 246 LEU HB2 . 17711 1 1781 . 1 1 152 152 LEU HB3 H 1 1.6402 0.009 . 2 . . . . 246 LEU HB3 . 17711 1 1782 . 1 1 152 152 LEU HG H 1 1.8802 0.004 . 1 . . . A 246 LEU HG . 17711 1 1783 . 1 1 152 152 LEU HD11 H 1 0.9512 0.009 . 1 . . . A 246 LEU HD11 . 17711 1 1784 . 1 1 152 152 LEU HD12 H 1 0.9512 0.009 . 1 . . . A 246 LEU HD12 . 17711 1 1785 . 1 1 152 152 LEU HD13 H 1 0.9512 0.009 . 1 . . . A 246 LEU HD13 . 17711 1 1786 . 1 1 152 152 LEU HD21 H 1 0.9192 0.006 . 1 . . . A 246 LEU HD21 . 17711 1 1787 . 1 1 152 152 LEU HD22 H 1 0.9192 0.006 . 1 . . . A 246 LEU HD22 . 17711 1 1788 . 1 1 152 152 LEU HD23 H 1 0.9192 0.006 . 1 . . . A 246 LEU HD23 . 17711 1 1789 . 1 1 152 152 LEU C C 13 178.2792 0.017 . 1 . . . A 246 LEU C . 17711 1 1790 . 1 1 152 152 LEU CA C 13 56.7642 0.112 . 1 . . . A 246 LEU CA . 17711 1 1791 . 1 1 152 152 LEU CB C 13 42.3302 0.060 . 1 . . . A 246 LEU CB . 17711 1 1792 . 1 1 152 152 LEU CG C 13 26.7852 0.107 . 1 . . . A 246 LEU CG . 17711 1 1793 . 1 1 152 152 LEU CD1 C 13 25.0852 0.084 . 1 . . . A 246 LEU CD1 . 17711 1 1794 . 1 1 152 152 LEU CD2 C 13 23.5012 0.136 . 1 . . . A 246 LEU CD2 . 17711 1 1795 . 1 1 152 152 LEU N N 15 116.3832 0.070 . 1 . . . A 246 LEU N . 17711 1 1796 . 1 1 153 153 LEU H H 1 7.5482 0.008 . 1 . . . . 247 LEU H . 17711 1 1797 . 1 1 153 153 LEU HA H 1 4.3392 0.007 . 1 . . . A 247 LEU HA . 17711 1 1798 . 1 1 153 153 LEU HB2 H 1 1.9612 0.009 . 2 . . . A 247 LEU HB2 . 17711 1 1799 . 1 1 153 153 LEU HB3 H 1 1.6822 0.018 . 2 . . . . 247 LEU HB3 . 17711 1 1800 . 1 1 153 153 LEU HG H 1 1.8352 0.016 . 1 . . . A 247 LEU HG . 17711 1 1801 . 1 1 153 153 LEU HD11 H 1 0.9382 0.008 . 1 . . . A 247 LEU HD11 . 17711 1 1802 . 1 1 153 153 LEU HD12 H 1 0.9382 0.008 . 1 . . . A 247 LEU HD12 . 17711 1 1803 . 1 1 153 153 LEU HD13 H 1 0.9382 0.008 . 1 . . . A 247 LEU HD13 . 17711 1 1804 . 1 1 153 153 LEU HD21 H 1 0.8622 0.017 . 1 . . . A 247 LEU HD21 . 17711 1 1805 . 1 1 153 153 LEU HD22 H 1 0.8622 0.017 . 1 . . . A 247 LEU HD22 . 17711 1 1806 . 1 1 153 153 LEU HD23 H 1 0.8622 0.017 . 1 . . . A 247 LEU HD23 . 17711 1 1807 . 1 1 153 153 LEU C C 13 177.9302 0.011 . 1 . . . A 247 LEU C . 17711 1 1808 . 1 1 153 153 LEU CA C 13 55.0242 0.039 . 1 . . . A 247 LEU CA . 17711 1 1809 . 1 1 153 153 LEU CB C 13 42.2542 0.104 . 1 . . . A 247 LEU CB . 17711 1 1810 . 1 1 153 153 LEU CG C 13 26.4862 0.088 . 1 . . . A 247 LEU CG . 17711 1 1811 . 1 1 153 153 LEU CD1 C 13 25.3282 0.043 . 1 . . . A 247 LEU CD1 . 17711 1 1812 . 1 1 153 153 LEU CD2 C 13 22.4942 0.098 . 1 . . . A 247 LEU CD2 . 17711 1 1813 . 1 1 153 153 LEU N N 15 117.4332 0.065 . 1 . . . A 247 LEU N . 17711 1 1814 . 1 1 154 154 VAL H H 1 7.3262 0.009 . 1 . . . . 248 VAL H . 17711 1 1815 . 1 1 154 154 VAL HA H 1 4.0072 0.005 . 1 . . . A 248 VAL HA . 17711 1 1816 . 1 1 154 154 VAL HB H 1 2.2242 0.004 . 1 . . . A 248 VAL HB . 17711 1 1817 . 1 1 154 154 VAL HG11 H 1 0.9682 0.014 . 1 . . . A 248 VAL HG11 . 17711 1 1818 . 1 1 154 154 VAL HG12 H 1 0.9682 0.014 . 1 . . . A 248 VAL HG12 . 17711 1 1819 . 1 1 154 154 VAL HG13 H 1 0.9682 0.014 . 1 . . . A 248 VAL HG13 . 17711 1 1820 . 1 1 154 154 VAL HG21 H 1 0.9112 0.007 . 1 . . . A 248 VAL HG21 . 17711 1 1821 . 1 1 154 154 VAL HG22 H 1 0.9112 0.007 . 1 . . . A 248 VAL HG22 . 17711 1 1822 . 1 1 154 154 VAL HG23 H 1 0.9112 0.007 . 1 . . . A 248 VAL HG23 . 17711 1 1823 . 1 1 154 154 VAL C C 13 176.0932 0.001 . 1 . . . A 248 VAL C . 17711 1 1824 . 1 1 154 154 VAL CA C 13 62.7532 0.076 . 1 . . . A 248 VAL CA . 17711 1 1825 . 1 1 154 154 VAL CB C 13 32.1422 0.077 . 1 . . . A 248 VAL CB . 17711 1 1826 . 1 1 154 154 VAL CG1 C 13 22.0572 0.071 . 1 . . . A 248 VAL CG1 . 17711 1 1827 . 1 1 154 154 VAL CG2 C 13 20.3912 0.061 . 1 . . . A 248 VAL CG2 . 17711 1 1828 . 1 1 154 154 VAL N N 15 118.0092 0.062 . 1 . . . A 248 VAL N . 17711 1 1829 . 1 1 155 155 ASP H H 1 8.6532 0.008 . 1 . . . . 249 ASP H . 17711 1 1830 . 1 1 155 155 ASP HA H 1 4.6392 0.009 . 1 . . . A 249 ASP HA . 17711 1 1831 . 1 1 155 155 ASP HB2 H 1 2.7302 0.015 . 2 . . . A 249 ASP HB2 . 17711 1 1832 . 1 1 155 155 ASP HB3 H 1 2.7302 0.015 . 2 . . . . 249 ASP HB3 . 17711 1 1833 . 1 1 155 155 ASP C C 13 176.1712 0.024 . 1 . . . A 249 ASP C . 17711 1 1834 . 1 1 155 155 ASP CA C 13 55.0312 0.123 . 1 . . . A 249 ASP CA . 17711 1 1835 . 1 1 155 155 ASP CB C 13 42.0892 0.110 . 1 . . . A 249 ASP CB . 17711 1 1836 . 1 1 155 155 ASP N N 15 123.8892 0.050 . 1 . . . A 249 ASP N . 17711 1 1837 . 1 1 156 156 SER H H 1 7.7592 0.010 . 1 . . . . 250 SER H . 17711 1 1838 . 1 1 156 156 SER HA H 1 4.5922 0.005 . 1 . . . A 250 SER HA . 17711 1 1839 . 1 1 156 156 SER HB2 H 1 3.9642 0.005 . 2 . . . A 250 SER HB2 . 17711 1 1840 . 1 1 156 156 SER HB3 H 1 3.8042 0.007 . 2 . . . . 250 SER HB3 . 17711 1 1841 . 1 1 156 156 SER C C 13 174.6732 0.000 . 1 . . . A 250 SER C . 17711 1 1842 . 1 1 156 156 SER CA C 13 57.6262 0.094 . 1 . . . A 250 SER CA . 17711 1 1843 . 1 1 156 156 SER CB C 13 64.5362 0.138 . 1 . . . A 250 SER CB . 17711 1 1844 . 1 1 156 156 SER N N 15 113.5092 0.100 . 1 . . . A 250 SER N . 17711 1 1845 . 1 1 157 157 LYS H H 1 8.6422 0.008 . 1 . . . . 251 LYS H . 17711 1 1846 . 1 1 157 157 LYS HA H 1 4.0652 0.011 . 1 . . . A 251 LYS HA . 17711 1 1847 . 1 1 157 157 LYS HB2 H 1 1.8062 0.011 . 2 . . . A 251 LYS HB2 . 17711 1 1848 . 1 1 157 157 LYS HB3 H 1 1.8062 0.011 . 2 . . . . 251 LYS HB3 . 17711 1 1849 . 1 1 157 157 LYS HG2 H 1 1.3952 0.009 . 2 . . . A 251 LYS HG2 . 17711 1 1850 . 1 1 157 157 LYS HG3 H 1 1.3952 0.009 . 2 . . . . 251 LYS HG3 . 17711 1 1851 . 1 1 157 157 LYS HD2 H 1 1.6192 0.010 . 2 . . . A 251 LYS HD2 . 17711 1 1852 . 1 1 157 157 LYS HD3 H 1 1.6192 0.010 . 2 . . . . 251 LYS HD3 . 17711 1 1853 . 1 1 157 157 LYS HE2 H 1 2.9702 0.000 . 2 . . . A 251 LYS HE2 . 17711 1 1854 . 1 1 157 157 LYS HE3 H 1 2.9702 0.000 . 2 . . . . 251 LYS HE3 . 17711 1 1855 . 1 1 157 157 LYS C C 13 175.8372 0.021 . 1 . . . A 251 LYS C . 17711 1 1856 . 1 1 157 157 LYS CA C 13 57.4902 0.092 . 1 . . . A 251 LYS CA . 17711 1 1857 . 1 1 157 157 LYS CB C 13 32.1002 0.145 . 1 . . . A 251 LYS CB . 17711 1 1858 . 1 1 157 157 LYS CG C 13 24.5872 0.140 . 1 . . . A 251 LYS CG . 17711 1 1859 . 1 1 157 157 LYS CD C 13 29.1102 0.062 . 1 . . . A 251 LYS CD . 17711 1 1860 . 1 1 157 157 LYS CE C 13 42.0132 0.000 . 1 . . . A 251 LYS CE . 17711 1 1861 . 1 1 157 157 LYS N N 15 123.0892 0.048 . 1 . . . A 251 LYS N . 17711 1 1862 . 1 1 158 158 ASP H H 1 7.9762 0.007 . 1 . . . . 252 ASP H . 17711 1 1863 . 1 1 158 158 ASP HA H 1 4.6242 0.006 . 1 . . . A 252 ASP HA . 17711 1 1864 . 1 1 158 158 ASP HB2 H 1 2.8042 0.008 . 2 . . . A 252 ASP HB2 . 17711 1 1865 . 1 1 158 158 ASP HB3 H 1 2.5302 0.008 . 2 . . . . 252 ASP HB3 . 17711 1 1866 . 1 1 158 158 ASP C C 13 175.4682 0.034 . 1 . . . A 252 ASP C . 17711 1 1867 . 1 1 158 158 ASP CA C 13 54.1102 0.086 . 1 . . . A 252 ASP CA . 17711 1 1868 . 1 1 158 158 ASP CB C 13 41.0982 0.109 . 1 . . . A 252 ASP CB . 17711 1 1869 . 1 1 158 158 ASP N N 15 117.4312 0.066 . 1 . . . A 252 ASP N . 17711 1 1870 . 1 1 159 159 ASP H H 1 7.4582 0.014 . 1 . . . . 253 ASP H . 17711 1 1871 . 1 1 159 159 ASP HA H 1 4.4522 0.005 . 1 . . . A 253 ASP HA . 17711 1 1872 . 1 1 159 159 ASP HB2 H 1 2.7812 0.013 . 2 . . . A 253 ASP HB2 . 17711 1 1873 . 1 1 159 159 ASP HB3 H 1 2.7812 0.013 . 2 . . . . 253 ASP HB3 . 17711 1 1874 . 1 1 159 159 ASP CA C 13 55.1202 0.136 . 1 . . . A 253 ASP CA . 17711 1 1875 . 1 1 159 159 ASP CB C 13 43.6012 0.109 . 1 . . . A 253 ASP CB . 17711 1 1876 . 1 1 159 159 ASP N N 15 122.2472 0.055 . 1 . . . A 253 ASP N . 17711 1 1877 . 1 1 160 160 GLU H H 1 7.9012 0.007 . 1 . . . . 254 GLU H . 17711 1 1878 . 1 1 160 160 GLU HG2 H 1 2.4172 0.007 . 2 . . . A 254 GLU HG2 . 17711 1 1879 . 1 1 160 160 GLU HG3 H 1 2.4172 0.007 . 2 . . . . 254 GLU HG3 . 17711 1 1880 . 1 1 160 160 GLU CA C 13 58.6282 0.001 . 1 . . . A 254 GLU CA . 17711 1 1881 . 1 1 160 160 GLU CB C 13 29.6952 0.000 . 1 . . . A 254 GLU CB . 17711 1 1882 . 1 1 160 160 GLU CG C 13 36.4722 0.009 . 1 . . . A 254 GLU CG . 17711 1 1883 . 1 1 160 160 GLU N N 15 126.0312 0.004 . 1 . . . A 254 GLU N . 17711 1 1884 . 1 1 161 161 ARG H H 1 9.3132 0.012 . 1 . . . . 255 ARG H . 17711 1 1885 . 1 1 161 161 ARG HA H 1 4.1872 0.009 . 1 . . . A 255 ARG HA . 17711 1 1886 . 1 1 161 161 ARG C C 13 177.3342 0.000 . 1 . . . A 255 ARG C . 17711 1 1887 . 1 1 161 161 ARG CA C 13 58.5402 0.019 . 1 . . . A 255 ARG CA . 17711 1 1888 . 1 1 161 161 ARG N N 15 119.1132 0.085 . 1 . . . A 255 ARG N . 17711 1 1889 . 1 1 162 162 VAL H H 1 7.7632 0.007 . 1 . . . . 256 VAL H . 17711 1 1890 . 1 1 162 162 VAL HA H 1 3.3252 0.013 . 1 . . . A 256 VAL HA . 17711 1 1891 . 1 1 162 162 VAL HB H 1 2.3092 0.008 . 1 . . . A 256 VAL HB . 17711 1 1892 . 1 1 162 162 VAL HG11 H 1 1.0502 0.010 . 1 . . . A 256 VAL HG11 . 17711 1 1893 . 1 1 162 162 VAL HG12 H 1 1.0502 0.010 . 1 . . . A 256 VAL HG12 . 17711 1 1894 . 1 1 162 162 VAL HG13 H 1 1.0502 0.010 . 1 . . . A 256 VAL HG13 . 17711 1 1895 . 1 1 162 162 VAL HG21 H 1 0.7652 0.004 . 1 . . . A 256 VAL HG21 . 17711 1 1896 . 1 1 162 162 VAL HG22 H 1 0.7652 0.004 . 1 . . . A 256 VAL HG22 . 17711 1 1897 . 1 1 162 162 VAL HG23 H 1 0.7652 0.004 . 1 . . . A 256 VAL HG23 . 17711 1 1898 . 1 1 162 162 VAL CA C 13 69.4972 0.098 . 1 . . . A 256 VAL CA . 17711 1 1899 . 1 1 162 162 VAL CB C 13 29.5012 0.048 . 1 . . . A 256 VAL CB . 17711 1 1900 . 1 1 162 162 VAL CG1 C 13 25.3762 0.080 . 1 . . . A 256 VAL CG1 . 17711 1 1901 . 1 1 162 162 VAL CG2 C 13 21.6302 0.052 . 1 . . . A 256 VAL CG2 . 17711 1 1902 . 1 1 162 162 VAL N N 15 116.5952 0.096 . 1 . . . A 256 VAL N . 17711 1 1903 . 1 1 163 163 PRO HA H 1 3.5782 0.014 . 1 . . . A 257 PRO HA . 17711 1 1904 . 1 1 163 163 PRO HB2 H 1 2.2382 0.019 . 2 . . . A 257 PRO HB2 . 17711 1 1905 . 1 1 163 163 PRO HB3 H 1 1.8922 0.014 . 2 . . . . 257 PRO HB3 . 17711 1 1906 . 1 1 163 163 PRO HG2 H 1 2.0682 0.007 . 2 . . . A 257 PRO HG2 . 17711 1 1907 . 1 1 163 163 PRO HG3 H 1 1.7362 0.010 . 2 . . . . 257 PRO HG3 . 17711 1 1908 . 1 1 163 163 PRO HD2 H 1 3.5602 0.023 . 2 . . . A 257 PRO HD2 . 17711 1 1909 . 1 1 163 163 PRO HD3 H 1 3.5602 0.023 . 2 . . . . 257 PRO HD3 . 17711 1 1910 . 1 1 163 163 PRO C C 13 177.7042 0.024 . 1 . . . A 257 PRO C . 17711 1 1911 . 1 1 163 163 PRO CA C 13 66.1712 0.135 . 1 . . . A 257 PRO CA . 17711 1 1912 . 1 1 163 163 PRO CB C 13 31.6692 0.133 . 1 . . . A 257 PRO CB . 17711 1 1913 . 1 1 163 163 PRO CG C 13 28.4132 0.176 . 1 . . . A 257 PRO CG . 17711 1 1914 . 1 1 163 163 PRO CD C 13 49.2102 0.215 . 1 . . . A 257 PRO CD . 17711 1 1915 . 1 1 164 164 ALA H H 1 6.6312 0.017 . 1 . . . . 258 ALA H . 17711 1 1916 . 1 1 164 164 ALA HA H 1 3.9502 0.017 . 1 . . . A 258 ALA HA . 17711 1 1917 . 1 1 164 164 ALA HB1 H 1 1.5802 0.008 . 1 . . . A 258 ALA HB1 . 17711 1 1918 . 1 1 164 164 ALA HB2 H 1 1.5802 0.008 . 1 . . . A 258 ALA HB2 . 17711 1 1919 . 1 1 164 164 ALA HB3 H 1 1.5802 0.008 . 1 . . . A 258 ALA HB3 . 17711 1 1920 . 1 1 164 164 ALA C C 13 179.0462 0.022 . 1 . . . A 258 ALA C . 17711 1 1921 . 1 1 164 164 ALA CA C 13 55.1222 0.193 . 1 . . . A 258 ALA CA . 17711 1 1922 . 1 1 164 164 ALA CB C 13 21.0152 0.066 . 1 . . . A 258 ALA CB . 17711 1 1923 . 1 1 164 164 ALA N N 15 117.2522 0.064 . 1 . . . A 258 ALA N . 17711 1 1924 . 1 1 165 165 LEU H H 1 7.8172 0.012 . 1 . . . . 259 LEU H . 17711 1 1925 . 1 1 165 165 LEU HA H 1 3.7592 0.019 . 1 . . . A 259 LEU HA . 17711 1 1926 . 1 1 165 165 LEU HB2 H 1 1.7062 0.010 . 2 . . . A 259 LEU HB2 . 17711 1 1927 . 1 1 165 165 LEU HB3 H 1 1.0682 0.023 . 2 . . . . 259 LEU HB3 . 17711 1 1928 . 1 1 165 165 LEU HG H 1 1.4382 0.002 . 1 . . . A 259 LEU HG . 17711 1 1929 . 1 1 165 165 LEU HD11 H 1 0.6332 0.008 . 1 . . . A 259 LEU HD11 . 17711 1 1930 . 1 1 165 165 LEU HD12 H 1 0.6332 0.008 . 1 . . . A 259 LEU HD12 . 17711 1 1931 . 1 1 165 165 LEU HD13 H 1 0.6332 0.008 . 1 . . . A 259 LEU HD13 . 17711 1 1932 . 1 1 165 165 LEU HD21 H 1 0.5812 0.008 . 1 . . . A 259 LEU HD21 . 17711 1 1933 . 1 1 165 165 LEU HD22 H 1 0.5812 0.008 . 1 . . . A 259 LEU HD22 . 17711 1 1934 . 1 1 165 165 LEU HD23 H 1 0.5812 0.008 . 1 . . . A 259 LEU HD23 . 17711 1 1935 . 1 1 165 165 LEU C C 13 178.6762 0.000 . 1 . . . A 259 LEU C . 17711 1 1936 . 1 1 165 165 LEU CA C 13 58.0272 0.109 . 1 . . . A 259 LEU CA . 17711 1 1937 . 1 1 165 165 LEU CB C 13 41.2562 0.074 . 1 . . . A 259 LEU CB . 17711 1 1938 . 1 1 165 165 LEU CG C 13 26.1092 0.267 . 1 . . . A 259 LEU CG . 17711 1 1939 . 1 1 165 165 LEU CD1 C 13 25.7082 0.138 . 1 . . . A 259 LEU CD1 . 17711 1 1940 . 1 1 165 165 LEU CD2 C 13 22.3252 0.065 . 1 . . . A 259 LEU CD2 . 17711 1 1941 . 1 1 165 165 LEU N N 15 117.7412 0.068 . 1 . . . A 259 LEU N . 17711 1 1942 . 1 1 166 166 ASN H H 1 8.4592 0.009 . 1 . . . . 260 ASN H . 17711 1 1943 . 1 1 166 166 ASN HA H 1 4.1822 0.011 . 1 . . . A 260 ASN HA . 17711 1 1944 . 1 1 166 166 ASN HB2 H 1 2.8092 0.019 . 2 . . . A 260 ASN HB2 . 17711 1 1945 . 1 1 166 166 ASN HB3 H 1 2.8092 0.019 . 2 . . . . 260 ASN HB3 . 17711 1 1946 . 1 1 166 166 ASN C C 13 178.8722 0.002 . 1 . . . A 260 ASN C . 17711 1 1947 . 1 1 166 166 ASN CA C 13 55.7502 0.076 . 1 . . . A 260 ASN CA . 17711 1 1948 . 1 1 166 166 ASN CB C 13 37.6152 0.274 . 1 . . . A 260 ASN CB . 17711 1 1949 . 1 1 166 166 ASN N N 15 116.0852 0.113 . 1 . . . A 260 ASN N . 17711 1 1950 . 1 1 167 167 LEU H H 1 8.4982 0.017 . 1 . . . . 261 LEU H . 17711 1 1951 . 1 1 167 167 LEU HA H 1 4.1632 0.003 . 1 . . . A 261 LEU HA . 17711 1 1952 . 1 1 167 167 LEU HD11 H 1 0.7622 0.000 . 1 . . . A 261 LEU HD11 . 17711 1 1953 . 1 1 167 167 LEU HD12 H 1 0.7622 0.000 . 1 . . . A 261 LEU HD12 . 17711 1 1954 . 1 1 167 167 LEU HD13 H 1 0.7622 0.000 . 1 . . . A 261 LEU HD13 . 17711 1 1955 . 1 1 167 167 LEU HD21 H 1 0.9902 0.007 . 1 . . . A 261 LEU HD21 . 17711 1 1956 . 1 1 167 167 LEU HD22 H 1 0.9902 0.007 . 1 . . . A 261 LEU HD22 . 17711 1 1957 . 1 1 167 167 LEU HD23 H 1 0.9902 0.007 . 1 . . . A 261 LEU HD23 . 17711 1 1958 . 1 1 167 167 LEU C C 13 176.0742 0.000 . 1 . . . A 261 LEU C . 17711 1 1959 . 1 1 167 167 LEU CA C 13 54.4222 0.031 . 1 . . . A 261 LEU CA . 17711 1 1960 . 1 1 167 167 LEU CB C 13 41.0842 0.000 . 1 . . . A 261 LEU CB . 17711 1 1961 . 1 1 167 167 LEU CD1 C 13 25.8212 0.000 . 1 . . . A 261 LEU CD1 . 17711 1 1962 . 1 1 167 167 LEU CD2 C 13 22.2232 0.046 . 1 . . . A 261 LEU CD2 . 17711 1 1963 . 1 1 167 167 LEU N N 15 122.5472 0.149 . 1 . . . A 261 LEU N . 17711 1 1964 . 1 1 168 168 LEU H H 1 8.2952 0.007 . 1 . . . . 262 LEU H . 17711 1 1965 . 1 1 168 168 LEU HA H 1 3.9132 0.007 . 1 . . . A 262 LEU HA . 17711 1 1966 . 1 1 168 168 LEU HB2 H 1 2.3202 0.018 . 2 . . . A 262 LEU HB2 . 17711 1 1967 . 1 1 168 168 LEU HB3 H 1 1.2722 0.014 . 2 . . . . 262 LEU HB3 . 17711 1 1968 . 1 1 168 168 LEU HG H 1 1.1452 0.014 . 1 . . . A 262 LEU HG . 17711 1 1969 . 1 1 168 168 LEU HD11 H 1 0.8462 0.003 . 1 . . . A 262 LEU HD11 . 17711 1 1970 . 1 1 168 168 LEU HD12 H 1 0.8462 0.003 . 1 . . . A 262 LEU HD12 . 17711 1 1971 . 1 1 168 168 LEU HD13 H 1 0.8462 0.003 . 1 . . . A 262 LEU HD13 . 17711 1 1972 . 1 1 168 168 LEU HD21 H 1 0.8592 0.005 . 1 . . . A 262 LEU HD21 . 17711 1 1973 . 1 1 168 168 LEU HD22 H 1 0.8592 0.005 . 1 . . . A 262 LEU HD22 . 17711 1 1974 . 1 1 168 168 LEU HD23 H 1 0.8592 0.005 . 1 . . . A 262 LEU HD23 . 17711 1 1975 . 1 1 168 168 LEU C C 13 178.9472 0.000 . 1 . . . A 262 LEU C . 17711 1 1976 . 1 1 168 168 LEU CA C 13 58.9942 0.087 . 1 . . . A 262 LEU CA . 17711 1 1977 . 1 1 168 168 LEU CB C 13 42.0382 0.124 . 1 . . . A 262 LEU CB . 17711 1 1978 . 1 1 168 168 LEU CG C 13 27.1322 0.146 . 1 . . . A 262 LEU CG . 17711 1 1979 . 1 1 168 168 LEU CD1 C 13 26.9672 0.060 . 1 . . . A 262 LEU CD1 . 17711 1 1980 . 1 1 168 168 LEU CD2 C 13 23.2352 0.037 . 1 . . . A 262 LEU CD2 . 17711 1 1981 . 1 1 168 168 LEU N N 15 118.9242 0.173 . 1 . . . A 262 LEU N . 17711 1 1982 . 1 1 169 169 ILE H H 1 8.1372 0.008 . 1 . . . . 263 ILE H . 17711 1 1983 . 1 1 169 169 ILE HA H 1 3.4292 0.010 . 1 . . . A 263 ILE HA . 17711 1 1984 . 1 1 169 169 ILE HB H 1 1.7512 0.010 . 1 . . . A 263 ILE HB . 17711 1 1985 . 1 1 169 169 ILE HG12 H 1 1.8982 0.007 . 2 . . . A 263 ILE HG12 . 17711 1 1986 . 1 1 169 169 ILE HG13 H 1 0.9672 0.014 . 2 . . . . 263 ILE HG13 . 17711 1 1987 . 1 1 169 169 ILE HG21 H 1 0.9492 0.009 . 1 . . . A 263 ILE HG21 . 17711 1 1988 . 1 1 169 169 ILE HG22 H 1 0.9492 0.009 . 1 . . . A 263 ILE HG22 . 17711 1 1989 . 1 1 169 169 ILE HG23 H 1 0.9492 0.009 . 1 . . . A 263 ILE HG23 . 17711 1 1990 . 1 1 169 169 ILE HD11 H 1 0.7452 0.011 . 1 . . . A 263 ILE HD11 . 17711 1 1991 . 1 1 169 169 ILE HD12 H 1 0.7452 0.011 . 1 . . . A 263 ILE HD12 . 17711 1 1992 . 1 1 169 169 ILE HD13 H 1 0.7452 0.011 . 1 . . . A 263 ILE HD13 . 17711 1 1993 . 1 1 169 169 ILE C C 13 178.4962 0.000 . 1 . . . A 263 ILE C . 17711 1 1994 . 1 1 169 169 ILE CA C 13 66.9812 0.112 . 1 . . . A 263 ILE CA . 17711 1 1995 . 1 1 169 169 ILE CB C 13 39.1302 0.161 . 1 . . . A 263 ILE CB . 17711 1 1996 . 1 1 169 169 ILE CG1 C 13 30.7262 0.088 . 1 . . . A 263 ILE CG1 . 17711 1 1997 . 1 1 169 169 ILE CG2 C 13 17.1952 0.098 . 1 . . . A 263 ILE CG2 . 17711 1 1998 . 1 1 169 169 ILE CD1 C 13 13.0342 0.073 . 1 . . . A 263 ILE CD1 . 17711 1 1999 . 1 1 169 169 ILE N N 15 117.7762 0.077 . 1 . . . A 263 ILE N . 17711 1 2000 . 1 1 170 170 CYS H H 1 8.1422 0.010 . 1 . . . . 264 CYS H . 17711 1 2001 . 1 1 170 170 CYS HA H 1 4.3952 0.013 . 1 . . . A 264 CYS HA . 17711 1 2002 . 1 1 170 170 CYS HB2 H 1 3.4282 0.013 . 2 . . . A 264 CYS HB2 . 17711 1 2003 . 1 1 170 170 CYS HB3 H 1 3.1932 0.008 . 2 . . . . 264 CYS HB3 . 17711 1 2004 . 1 1 170 170 CYS C C 13 176.1242 0.024 . 1 . . . A 264 CYS C . 17711 1 2005 . 1 1 170 170 CYS CA C 13 61.5712 0.079 . 1 . . . A 264 CYS CA . 17711 1 2006 . 1 1 170 170 CYS CB C 13 25.9552 0.158 . 1 . . . A 264 CYS CB . 17711 1 2007 . 1 1 170 170 CYS N N 15 121.2782 0.184 . 1 . . . A 264 CYS N . 17711 1 2008 . 1 1 171 171 LEU H H 1 8.8362 0.016 . 1 . . . . 265 LEU H . 17711 1 2009 . 1 1 171 171 LEU HA H 1 3.9632 0.018 . 1 . . . A 265 LEU HA . 17711 1 2010 . 1 1 171 171 LEU HB2 H 1 1.7952 0.015 . 2 . . . A 265 LEU HB2 . 17711 1 2011 . 1 1 171 171 LEU HB3 H 1 0.8432 0.023 . 2 . . . . 265 LEU HB3 . 17711 1 2012 . 1 1 171 171 LEU HG H 1 1.9662 0.009 . 1 . . . A 265 LEU HG . 17711 1 2013 . 1 1 171 171 LEU HD11 H 1 0.0272 0.009 . 1 . . . A 265 LEU HD11 . 17711 1 2014 . 1 1 171 171 LEU HD12 H 1 0.0272 0.009 . 1 . . . A 265 LEU HD12 . 17711 1 2015 . 1 1 171 171 LEU HD13 H 1 0.0272 0.009 . 1 . . . A 265 LEU HD13 . 17711 1 2016 . 1 1 171 171 LEU HD21 H 1 0.2292 0.008 . 1 . . . A 265 LEU HD21 . 17711 1 2017 . 1 1 171 171 LEU HD22 H 1 0.2292 0.008 . 1 . . . A 265 LEU HD22 . 17711 1 2018 . 1 1 171 171 LEU HD23 H 1 0.2292 0.008 . 1 . . . A 265 LEU HD23 . 17711 1 2019 . 1 1 171 171 LEU C C 13 180.2742 0.041 . 1 . . . A 265 LEU C . 17711 1 2020 . 1 1 171 171 LEU CA C 13 58.4272 0.078 . 1 . . . A 265 LEU CA . 17711 1 2021 . 1 1 171 171 LEU CB C 13 40.7852 0.112 . 1 . . . A 265 LEU CB . 17711 1 2022 . 1 1 171 171 LEU CG C 13 25.1422 0.096 . 1 . . . A 265 LEU CG . 17711 1 2023 . 1 1 171 171 LEU CD1 C 13 24.2232 0.087 . 1 . . . A 265 LEU CD1 . 17711 1 2024 . 1 1 171 171 LEU CD2 C 13 19.9602 0.093 . 1 . . . A 265 LEU CD2 . 17711 1 2025 . 1 1 171 171 LEU N N 15 118.5062 0.122 . 1 . . . A 265 LEU N . 17711 1 2026 . 1 1 172 172 VAL H H 1 8.3072 0.011 . 1 . . . . 266 VAL H . 17711 1 2027 . 1 1 172 172 VAL HA H 1 3.8132 0.011 . 1 . . . A 266 VAL HA . 17711 1 2028 . 1 1 172 172 VAL HB H 1 2.1332 0.015 . 1 . . . A 266 VAL HB . 17711 1 2029 . 1 1 172 172 VAL HG11 H 1 0.8272 0.008 . 1 . . . A 266 VAL HG11 . 17711 1 2030 . 1 1 172 172 VAL HG12 H 1 0.8272 0.008 . 1 . . . A 266 VAL HG12 . 17711 1 2031 . 1 1 172 172 VAL HG13 H 1 0.8272 0.008 . 1 . . . A 266 VAL HG13 . 17711 1 2032 . 1 1 172 172 VAL HG21 H 1 1.1492 0.013 . 1 . . . A 266 VAL HG21 . 17711 1 2033 . 1 1 172 172 VAL HG22 H 1 1.1492 0.013 . 1 . . . A 266 VAL HG22 . 17711 1 2034 . 1 1 172 172 VAL HG23 H 1 1.1492 0.013 . 1 . . . A 266 VAL HG23 . 17711 1 2035 . 1 1 172 172 VAL CA C 13 68.2052 0.101 . 1 . . . A 266 VAL CA . 17711 1 2036 . 1 1 172 172 VAL CB C 13 32.2562 0.101 . 1 . . . A 266 VAL CB . 17711 1 2037 . 1 1 172 172 VAL CG1 C 13 20.6462 0.083 . 1 . . . A 266 VAL CG1 . 17711 1 2038 . 1 1 172 172 VAL CG2 C 13 22.5882 0.072 . 1 . . . A 266 VAL CG2 . 17711 1 2039 . 1 1 172 172 VAL N N 15 118.3512 0.251 . 1 . . . A 266 VAL N . 17711 1 2040 . 1 1 173 173 SER H H 1 8.5262 0.011 . 1 . . . . 267 SER H . 17711 1 2041 . 1 1 173 173 SER HA H 1 4.0512 0.012 . 1 . . . A 267 SER HA . 17711 1 2042 . 1 1 173 173 SER HB2 H 1 3.6272 0.023 . 2 . . . A 267 SER HB2 . 17711 1 2043 . 1 1 173 173 SER HB3 H 1 3.6272 0.023 . 2 . . . . 267 SER HB3 . 17711 1 2044 . 1 1 173 173 SER C C 13 175.5892 0.000 . 1 . . . A 267 SER C . 17711 1 2045 . 1 1 173 173 SER CA C 13 60.6182 0.099 . 1 . . . A 267 SER CA . 17711 1 2046 . 1 1 173 173 SER CB C 13 63.7782 0.158 . 1 . . . A 267 SER CB . 17711 1 2047 . 1 1 173 173 SER N N 15 112.3602 0.097 . 1 . . . A 267 SER N . 17711 1 2048 . 1 1 174 174 ARG H H 1 8.7332 0.010 . 1 . . . . 268 ARG H . 17711 1 2049 . 1 1 174 174 ARG HA H 1 4.5802 0.017 . 1 . . . A 268 ARG HA . 17711 1 2050 . 1 1 174 174 ARG HB2 H 1 1.9812 0.000 . 2 . . . A 268 ARG HB2 . 17711 1 2051 . 1 1 174 174 ARG HB3 H 1 1.9812 0.000 . 2 . . . . 268 ARG HB3 . 17711 1 2052 . 1 1 174 174 ARG HG2 H 1 1.8672 0.006 . 2 . . . A 268 ARG HG2 . 17711 1 2053 . 1 1 174 174 ARG HG3 H 1 1.8672 0.006 . 2 . . . . 268 ARG HG3 . 17711 1 2054 . 1 1 174 174 ARG HD2 H 1 3.1252 0.049 . 2 . . . A 268 ARG HD2 . 17711 1 2055 . 1 1 174 174 ARG HD3 H 1 3.1252 0.049 . 2 . . . . 268 ARG HD3 . 17711 1 2056 . 1 1 174 174 ARG C C 13 177.6812 0.021 . 1 . . . A 268 ARG C . 17711 1 2057 . 1 1 174 174 ARG CA C 13 56.4552 0.083 . 1 . . . A 268 ARG CA . 17711 1 2058 . 1 1 174 174 ARG CB C 13 31.0502 0.153 . 1 . . . A 268 ARG CB . 17711 1 2059 . 1 1 174 174 ARG CG C 13 27.8812 0.158 . 1 . . . A 268 ARG CG . 17711 1 2060 . 1 1 174 174 ARG CD C 13 43.0822 0.060 . 1 . . . A 268 ARG CD . 17711 1 2061 . 1 1 174 174 ARG N N 15 116.8672 0.141 . 1 . . . A 268 ARG N . 17711 1 2062 . 1 1 175 175 TYR H H 1 7.8232 0.012 . 1 . . . . 269 TYR H . 17711 1 2063 . 1 1 175 175 TYR HA H 1 4.2972 0.018 . 1 . . . A 269 TYR HA . 17711 1 2064 . 1 1 175 175 TYR HB2 H 1 2.7632 0.008 . 2 . . . A 269 TYR HB2 . 17711 1 2065 . 1 1 175 175 TYR HB3 H 1 2.7632 0.008 . 2 . . . . 269 TYR HB3 . 17711 1 2066 . 1 1 175 175 TYR HD1 H 1 6.1582 0.009 . 3 . . . A 269 TYR HD1 . 17711 1 2067 . 1 1 175 175 TYR HD2 H 1 6.1582 0.009 . 3 . . . A 269 TYR HD2 . 17711 1 2068 . 1 1 175 175 TYR HE1 H 1 6.4032 0.011 . 3 . . . A 269 TYR HE1 . 17711 1 2069 . 1 1 175 175 TYR HE2 H 1 6.4032 0.011 . 3 . . . A 269 TYR HE2 . 17711 1 2070 . 1 1 175 175 TYR C C 13 175.9922 0.029 . 1 . . . A 269 TYR C . 17711 1 2071 . 1 1 175 175 TYR CA C 13 61.9272 0.093 . 1 . . . A 269 TYR CA . 17711 1 2072 . 1 1 175 175 TYR CB C 13 39.0072 0.105 . 1 . . . A 269 TYR CB . 17711 1 2073 . 1 1 175 175 TYR CD1 C 13 133.1232 0.131 . 3 . . . A 269 TYR CD1 . 17711 1 2074 . 1 1 175 175 TYR CD2 C 13 133.1232 0.131 . 3 . . . A 269 TYR CD2 . 17711 1 2075 . 1 1 175 175 TYR CE1 C 13 118.0372 0.120 . 3 . . . A 269 TYR CE1 . 17711 1 2076 . 1 1 175 175 TYR CE2 C 13 118.0372 0.120 . 3 . . . A 269 TYR CE2 . 17711 1 2077 . 1 1 175 175 TYR N N 15 119.1132 0.128 . 1 . . . A 269 TYR N . 17711 1 2078 . 1 1 176 176 PHE H H 1 7.8512 0.008 . 1 . . . . 270 PHE H . 17711 1 2079 . 1 1 176 176 PHE HA H 1 4.4732 0.008 . 1 . . . A 270 PHE HA . 17711 1 2080 . 1 1 176 176 PHE HB2 H 1 3.6082 0.010 . 2 . . . A 270 PHE HB2 . 17711 1 2081 . 1 1 176 176 PHE HB3 H 1 3.4322 0.021 . 2 . . . . 270 PHE HB3 . 17711 1 2082 . 1 1 176 176 PHE HD1 H 1 7.4142 0.010 . 3 . . . A 270 PHE HD1 . 17711 1 2083 . 1 1 176 176 PHE HD2 H 1 7.4142 0.010 . 3 . . . A 270 PHE HD2 . 17711 1 2084 . 1 1 176 176 PHE C C 13 175.6422 0.000 . 1 . . . A 270 PHE C . 17711 1 2085 . 1 1 176 176 PHE CA C 13 59.2032 0.100 . 1 . . . A 270 PHE CA . 17711 1 2086 . 1 1 176 176 PHE CB C 13 38.3722 0.203 . 1 . . . A 270 PHE CB . 17711 1 2087 . 1 1 176 176 PHE CD1 C 13 132.4402 0.049 . 3 . . . A 270 PHE CD1 . 17711 1 2088 . 1 1 176 176 PHE CD2 C 13 132.4402 0.049 . 3 . . . A 270 PHE CD2 . 17711 1 2089 . 1 1 176 176 PHE N N 15 113.2532 0.065 . 1 . . . A 270 PHE N . 17711 1 2090 . 1 1 177 177 ASP H H 1 6.9852 0.010 . 1 . . . . 271 ASP H . 17711 1 2091 . 1 1 177 177 ASP HA H 1 4.3462 0.006 . 1 . . . A 271 ASP HA . 17711 1 2092 . 1 1 177 177 ASP HB2 H 1 3.0382 0.005 . 2 . . . A 271 ASP HB2 . 17711 1 2093 . 1 1 177 177 ASP HB3 H 1 2.6392 0.007 . 2 . . . . 271 ASP HB3 . 17711 1 2094 . 1 1 177 177 ASP C C 13 175.4212 0.110 . 1 . . . A 271 ASP C . 17711 1 2095 . 1 1 177 177 ASP CA C 13 56.3292 0.051 . 1 . . . A 271 ASP CA . 17711 1 2096 . 1 1 177 177 ASP CB C 13 39.4892 0.070 . 1 . . . A 271 ASP CB . 17711 1 2097 . 1 1 177 177 ASP N N 15 112.6152 0.114 . 1 . . . A 271 ASP N . 17711 1 2098 . 1 1 178 178 GLN H H 1 7.8972 0.011 . 1 . . . . 272 GLN H . 17711 1 2099 . 1 1 178 178 GLN HA H 1 4.7562 0.001 . 1 . . . A 272 GLN HA . 17711 1 2100 . 1 1 178 178 GLN HB2 H 1 1.8622 0.000 . 2 . . . A 272 GLN HB2 . 17711 1 2101 . 1 1 178 178 GLN HB3 H 1 1.8622 0.000 . 2 . . . . 272 GLN HB3 . 17711 1 2102 . 1 1 178 178 GLN C C 13 176.5802 0.020 . 1 . . . A 272 GLN C . 17711 1 2103 . 1 1 178 178 GLN CA C 13 52.0562 0.012 . 1 . . . A 272 GLN CA . 17711 1 2104 . 1 1 178 178 GLN CB C 13 26.2242 0.000 . 1 . . . A 272 GLN CB . 17711 1 2105 . 1 1 178 178 GLN N N 15 118.6042 0.107 . 1 . . . A 272 GLN N . 17711 1 2106 . 1 1 179 179 ARG H H 1 7.8002 0.004 . 1 . . . . 273 ARG H . 17711 1 2107 . 1 1 179 179 ARG HA H 1 3.8772 0.011 . 1 . . . A 273 ARG HA . 17711 1 2108 . 1 1 179 179 ARG HB2 H 1 1.8672 0.010 . 2 . . . A 273 ARG HB2 . 17711 1 2109 . 1 1 179 179 ARG HB3 H 1 1.8672 0.010 . 2 . . . . 273 ARG HB3 . 17711 1 2110 . 1 1 179 179 ARG HG2 H 1 1.6802 0.008 . 2 . . . A 273 ARG HG2 . 17711 1 2111 . 1 1 179 179 ARG HG3 H 1 1.6802 0.008 . 2 . . . . 273 ARG HG3 . 17711 1 2112 . 1 1 179 179 ARG HD2 H 1 3.2152 0.023 . 2 . . . A 273 ARG HD2 . 17711 1 2113 . 1 1 179 179 ARG HD3 H 1 3.2152 0.023 . 2 . . . . 273 ARG HD3 . 17711 1 2114 . 1 1 179 179 ARG C C 13 177.2942 0.022 . 1 . . . A 273 ARG C . 17711 1 2115 . 1 1 179 179 ARG CA C 13 59.1502 0.085 . 1 . . . A 273 ARG CA . 17711 1 2116 . 1 1 179 179 ARG CB C 13 30.2492 0.078 . 1 . . . A 273 ARG CB . 17711 1 2117 . 1 1 179 179 ARG CG C 13 27.4102 0.077 . 1 . . . A 273 ARG CG . 17711 1 2118 . 1 1 179 179 ARG CD C 13 42.9992 0.089 . 1 . . . A 273 ARG CD . 17711 1 2119 . 1 1 179 179 ARG N N 15 120.7692 0.056 . 1 . . . A 273 ARG N . 17711 1 2120 . 1 1 180 180 ASP H H 1 9.1192 0.010 . 1 . . . . 274 ASP H . 17711 1 2121 . 1 1 180 180 ASP HA H 1 4.3942 0.002 . 1 . . . A 274 ASP HA . 17711 1 2122 . 1 1 180 180 ASP HB2 H 1 2.7182 0.011 . 2 . . . A 274 ASP HB2 . 17711 1 2123 . 1 1 180 180 ASP HB3 H 1 2.7182 0.011 . 2 . . . . 274 ASP HB3 . 17711 1 2124 . 1 1 180 180 ASP C C 13 176.2872 0.021 . 1 . . . A 274 ASP C . 17711 1 2125 . 1 1 180 180 ASP CA C 13 55.0132 0.043 . 1 . . . A 274 ASP CA . 17711 1 2126 . 1 1 180 180 ASP CB C 13 38.7432 0.080 . 1 . . . A 274 ASP CB . 17711 1 2127 . 1 1 180 180 ASP N N 15 116.5312 0.085 . 1 . . . A 274 ASP N . 17711 1 2128 . 1 1 181 181 LEU H H 1 7.7482 0.007 . 1 . . . . 275 LEU H . 17711 1 2129 . 1 1 181 181 LEU HA H 1 4.4222 0.007 . 1 . . . A 275 LEU HA . 17711 1 2130 . 1 1 181 181 LEU HB2 H 1 1.6302 0.021 . 2 . . . A 275 LEU HB2 . 17711 1 2131 . 1 1 181 181 LEU HB3 H 1 1.6302 0.021 . 2 . . . . 275 LEU HB3 . 17711 1 2132 . 1 1 181 181 LEU HG H 1 1.5472 0.013 . 1 . . . A 275 LEU HG . 17711 1 2133 . 1 1 181 181 LEU HD11 H 1 0.7662 0.014 . 1 . . . A 275 LEU HD11 . 17711 1 2134 . 1 1 181 181 LEU HD12 H 1 0.7662 0.014 . 1 . . . A 275 LEU HD12 . 17711 1 2135 . 1 1 181 181 LEU HD13 H 1 0.7662 0.014 . 1 . . . A 275 LEU HD13 . 17711 1 2136 . 1 1 181 181 LEU HD21 H 1 0.7372 0.009 . 1 . . . A 275 LEU HD21 . 17711 1 2137 . 1 1 181 181 LEU HD22 H 1 0.7372 0.009 . 1 . . . A 275 LEU HD22 . 17711 1 2138 . 1 1 181 181 LEU HD23 H 1 0.7372 0.009 . 1 . . . A 275 LEU HD23 . 17711 1 2139 . 1 1 181 181 LEU C C 13 175.7752 0.000 . 1 . . . A 275 LEU C . 17711 1 2140 . 1 1 181 181 LEU CA C 13 53.9862 0.162 . 1 . . . A 275 LEU CA . 17711 1 2141 . 1 1 181 181 LEU CB C 13 41.1892 0.099 . 1 . . . A 275 LEU CB . 17711 1 2142 . 1 1 181 181 LEU CG C 13 26.8082 0.203 . 1 . . . A 275 LEU CG . 17711 1 2143 . 1 1 181 181 LEU CD1 C 13 22.2572 0.036 . 1 . . . A 275 LEU CD1 . 17711 1 2144 . 1 1 181 181 LEU CD2 C 13 22.3942 0.073 . 1 . . . A 275 LEU CD2 . 17711 1 2145 . 1 1 181 181 LEU N N 15 119.4492 0.040 . 1 . . . A 275 LEU N . 17711 1 2146 . 1 1 182 182 ALA H H 1 7.1832 0.014 . 1 . . . . 276 ALA H . 17711 1 2147 . 1 1 182 182 ALA HA H 1 4.1932 0.006 . 1 . . . A 276 ALA HA . 17711 1 2148 . 1 1 182 182 ALA HB1 H 1 1.2942 0.006 . 1 . . . A 276 ALA HB1 . 17711 1 2149 . 1 1 182 182 ALA HB2 H 1 1.2942 0.006 . 1 . . . A 276 ALA HB2 . 17711 1 2150 . 1 1 182 182 ALA HB3 H 1 1.2942 0.006 . 1 . . . A 276 ALA HB3 . 17711 1 2151 . 1 1 182 182 ALA C C 13 178.1512 0.012 . 1 . . . A 276 ALA C . 17711 1 2152 . 1 1 182 182 ALA CA C 13 52.1932 0.119 . 1 . . . A 276 ALA CA . 17711 1 2153 . 1 1 182 182 ALA CB C 13 19.7892 0.070 . 1 . . . A 276 ALA CB . 17711 1 2154 . 1 1 182 182 ALA N N 15 120.1382 0.097 . 1 . . . A 276 ALA N . 17711 1 2155 . 1 1 183 183 ASP H H 1 8.9062 0.010 . 1 . . . . 277 ASP H . 17711 1 2156 . 1 1 183 183 ASP HA H 1 4.6752 0.005 . 1 . . . A 277 ASP HA . 17711 1 2157 . 1 1 183 183 ASP HB2 H 1 2.5662 0.026 . 2 . . . A 277 ASP HB2 . 17711 1 2158 . 1 1 183 183 ASP HB3 H 1 2.5662 0.026 . 2 . . . . 277 ASP HB3 . 17711 1 2159 . 1 1 183 183 ASP C C 13 175.8322 0.027 . 1 . . . A 277 ASP C . 17711 1 2160 . 1 1 183 183 ASP CA C 13 54.4972 0.133 . 1 . . . A 277 ASP CA . 17711 1 2161 . 1 1 183 183 ASP CB C 13 41.1282 0.109 . 1 . . . A 277 ASP CB . 17711 1 2162 . 1 1 183 183 ASP N N 15 120.4812 0.042 . 1 . . . A 277 ASP N . 17711 1 2163 . 1 1 184 184 GLU H H 1 8.5482 0.010 . 1 . . . . 278 GLU H . 17711 1 2164 . 1 1 184 184 GLU HA H 1 4.7242 0.004 . 1 . . . A 278 GLU HA . 17711 1 2165 . 1 1 184 184 GLU HB2 H 1 2.0252 0.013 . 2 . . . A 278 GLU HB2 . 17711 1 2166 . 1 1 184 184 GLU HB3 H 1 1.8782 0.019 . 2 . . . . 278 GLU HB3 . 17711 1 2167 . 1 1 184 184 GLU HG2 H 1 2.2542 0.000 . 2 . . . A 278 GLU HG2 . 17711 1 2168 . 1 1 184 184 GLU HG3 H 1 2.2032 0.004 . 2 . . . . 278 GLU HG3 . 17711 1 2169 . 1 1 184 184 GLU C C 13 174.4682 0.000 . 1 . . . A 278 GLU C . 17711 1 2170 . 1 1 184 184 GLU CA C 13 53.4122 0.046 . 1 . . . A 278 GLU CA . 17711 1 2171 . 1 1 184 184 GLU CB C 13 30.2652 0.201 . 1 . . . A 278 GLU CB . 17711 1 2172 . 1 1 184 184 GLU CG C 13 35.4312 0.156 . 1 . . . A 278 GLU CG . 17711 1 2173 . 1 1 184 184 GLU N N 15 125.4112 0.108 . 1 . . . A 278 GLU N . 17711 1 2174 . 1 1 185 185 PRO HA H 1 4.4012 0.022 . 1 . . . A 279 PRO HA . 17711 1 2175 . 1 1 185 185 PRO HB2 H 1 2.2692 0.010 . 2 . . . A 279 PRO HB2 . 17711 1 2176 . 1 1 185 185 PRO HB3 H 1 1.9582 0.000 . 2 . . . . 279 PRO HB3 . 17711 1 2177 . 1 1 185 185 PRO HG2 H 1 1.9932 0.025 . 2 . . . A 279 PRO HG2 . 17711 1 2178 . 1 1 185 185 PRO HG3 H 1 1.2972 0.000 . 2 . . . . 279 PRO HG3 . 17711 1 2179 . 1 1 185 185 PRO HD2 H 1 3.7632 0.006 . 2 . . . A 279 PRO HD2 . 17711 1 2180 . 1 1 185 185 PRO HD3 H 1 3.7052 0.010 . 2 . . . . 279 PRO HD3 . 17711 1 2181 . 1 1 185 185 PRO C C 13 176.7742 0.023 . 1 . . . A 279 PRO C . 17711 1 2182 . 1 1 185 185 PRO CA C 13 63.2222 0.080 . 1 . . . A 279 PRO CA . 17711 1 2183 . 1 1 185 185 PRO CB C 13 32.2372 0.126 . 1 . . . A 279 PRO CB . 17711 1 2184 . 1 1 185 185 PRO CG C 13 27.3532 0.170 . 1 . . . A 279 PRO CG . 17711 1 2185 . 1 1 185 185 PRO CD C 13 50.6162 0.044 . 1 . . . A 279 PRO CD . 17711 1 2186 . 1 1 186 186 SER H H 1 8.2812 0.008 . 1 . . . . 280 SER H . 17711 1 2187 . 1 1 186 186 SER HA H 1 4.4002 0.003 . 1 . . . A 280 SER HA . 17711 1 2188 . 1 1 186 186 SER HB2 H 1 3.8492 0.011 . 2 . . . A 280 SER HB2 . 17711 1 2189 . 1 1 186 186 SER HB3 H 1 3.8492 0.011 . 2 . . . . 280 SER HB3 . 17711 1 2190 . 1 1 186 186 SER C C 13 174.3672 0.018 . 1 . . . A 280 SER C . 17711 1 2191 . 1 1 186 186 SER CA C 13 58.3112 0.104 . 1 . . . A 280 SER CA . 17711 1 2192 . 1 1 186 186 SER CB C 13 63.7312 0.113 . 1 . . . A 280 SER CB . 17711 1 2193 . 1 1 186 186 SER N N 15 115.7672 0.047 . 1 . . . A 280 SER N . 17711 1 2194 . 1 1 187 187 LEU H H 1 8.2412 0.007 . 1 . . . . 281 LEU H . 17711 1 2195 . 1 1 187 187 LEU HA H 1 4.3762 0.005 . 1 . . . A 281 LEU HA . 17711 1 2196 . 1 1 187 187 LEU HB2 H 1 1.5662 0.022 . 2 . . . A 281 LEU HB2 . 17711 1 2197 . 1 1 187 187 LEU HB3 H 1 1.5662 0.022 . 2 . . . . 281 LEU HB3 . 17711 1 2198 . 1 1 187 187 LEU HG H 1 1.6072 0.012 . 1 . . . A 281 LEU HG . 17711 1 2199 . 1 1 187 187 LEU HD11 H 1 0.9162 0.006 . 1 . . . A 281 LEU HD11 . 17711 1 2200 . 1 1 187 187 LEU HD12 H 1 0.9162 0.006 . 1 . . . A 281 LEU HD12 . 17711 1 2201 . 1 1 187 187 LEU HD13 H 1 0.9162 0.006 . 1 . . . A 281 LEU HD13 . 17711 1 2202 . 1 1 187 187 LEU HD21 H 1 0.8592 0.005 . 1 . . . A 281 LEU HD21 . 17711 1 2203 . 1 1 187 187 LEU HD22 H 1 0.8592 0.005 . 1 . . . A 281 LEU HD22 . 17711 1 2204 . 1 1 187 187 LEU HD23 H 1 0.8592 0.005 . 1 . . . A 281 LEU HD23 . 17711 1 2205 . 1 1 187 187 LEU C C 13 176.9132 0.010 . 1 . . . A 281 LEU C . 17711 1 2206 . 1 1 187 187 LEU CA C 13 55.0222 0.086 . 1 . . . A 281 LEU CA . 17711 1 2207 . 1 1 187 187 LEU CB C 13 42.4992 0.067 . 1 . . . A 281 LEU CB . 17711 1 2208 . 1 1 187 187 LEU CG C 13 27.0192 0.072 . 1 . . . A 281 LEU CG . 17711 1 2209 . 1 1 187 187 LEU CD1 C 13 24.7422 0.155 . 1 . . . A 281 LEU CD1 . 17711 1 2210 . 1 1 187 187 LEU CD2 C 13 23.4912 0.108 . 1 . . . A 281 LEU CD2 . 17711 1 2211 . 1 1 187 187 LEU N N 15 123.9482 0.027 . 1 . . . A 281 LEU N . 17711 1 2212 . 1 1 188 188 GLU H H 1 8.2302 0.005 . 1 . . . . 282 GLU H . 17711 1 2213 . 1 1 188 188 GLU HA H 1 4.2472 0.003 . 1 . . . A 282 GLU HA . 17711 1 2214 . 1 1 188 188 GLU HB2 H 1 1.9752 0.012 . 2 . . . A 282 GLU HB2 . 17711 1 2215 . 1 1 188 188 GLU HB3 H 1 1.8162 0.009 . 2 . . . . 282 GLU HB3 . 17711 1 2216 . 1 1 188 188 GLU HG2 H 1 2.1472 0.013 . 2 . . . A 282 GLU HG2 . 17711 1 2217 . 1 1 188 188 GLU HG3 H 1 2.1472 0.013 . 2 . . . . 282 GLU HG3 . 17711 1 2218 . 1 1 188 188 GLU C C 13 174.9142 0.021 . 1 . . . A 282 GLU C . 17711 1 2219 . 1 1 188 188 GLU CA C 13 56.3692 0.079 . 1 . . . A 282 GLU CA . 17711 1 2220 . 1 1 188 188 GLU CB C 13 30.6572 0.057 . 1 . . . A 282 GLU CB . 17711 1 2221 . 1 1 188 188 GLU CG C 13 36.2672 0.091 . 1 . . . A 282 GLU CG . 17711 1 2222 . 1 1 188 188 GLU N N 15 121.5522 0.038 . 1 . . . A 282 GLU N . 17711 1 2223 . 1 1 189 189 TYR H H 1 7.6392 0.007 . 1 . . . . 283 TYR H . 17711 1 2224 . 1 1 189 189 TYR HA H 1 4.3662 0.008 . 1 . . . A 283 TYR HA . 17711 1 2225 . 1 1 189 189 TYR HB2 H 1 3.0292 0.008 . 2 . . . A 283 TYR HB2 . 17711 1 2226 . 1 1 189 189 TYR HB3 H 1 2.8852 0.007 . 2 . . . . 283 TYR HB3 . 17711 1 2227 . 1 1 189 189 TYR HD1 H 1 7.0672 0.013 . 3 . . . A 283 TYR HD1 . 17711 1 2228 . 1 1 189 189 TYR HD2 H 1 7.0672 0.013 . 3 . . . A 283 TYR HD2 . 17711 1 2229 . 1 1 189 189 TYR HE1 H 1 6.7792 0.013 . 3 . . . A 283 TYR HE1 . 17711 1 2230 . 1 1 189 189 TYR HE2 H 1 6.7792 0.013 . 3 . . . A 283 TYR HE2 . 17711 1 2231 . 1 1 189 189 TYR C C 13 180.2402 0.000 . 1 . . . A 283 TYR C . 17711 1 2232 . 1 1 189 189 TYR CA C 13 58.9982 0.040 . 1 . . . A 283 TYR CA . 17711 1 2233 . 1 1 189 189 TYR CB C 13 39.4582 0.102 . 1 . . . A 283 TYR CB . 17711 1 2234 . 1 1 189 189 TYR CD1 C 13 133.5212 0.168 . 3 . . . A 283 TYR CD1 . 17711 1 2235 . 1 1 189 189 TYR CD2 C 13 133.5212 0.168 . 3 . . . A 283 TYR CD2 . 17711 1 2236 . 1 1 189 189 TYR CE1 C 13 118.1702 0.119 . 3 . . . A 283 TYR CE1 . 17711 1 2237 . 1 1 189 189 TYR CE2 C 13 118.1702 0.119 . 3 . . . A 283 TYR CE2 . 17711 1 2238 . 1 1 189 189 TYR N N 15 125.7052 0.027 . 1 . . . A 283 TYR N . 17711 1 2239 . 2 2 2 2 GLN HA H 1 4.3762 0.007 . 1 . . . B 27 GLN HA . 17711 1 2240 . 2 2 2 2 GLN HB2 H 1 2.0682 0.037 . 2 . . . B 27 GLN HB2 . 17711 1 2241 . 2 2 2 2 GLN HB3 H 1 2.0682 0.037 . 2 . . . . 27 GLN HB3 . 17711 1 2242 . 2 2 2 2 GLN HG2 H 1 2.3852 0.008 . 2 . . . B 27 GLN HG2 . 17711 1 2243 . 2 2 2 2 GLN HG3 H 1 2.3852 0.008 . 2 . . . . 27 GLN HG3 . 17711 1 2244 . 2 2 2 2 GLN HE21 H 1 7.6222 0.000 . 2 . . . B 27 GLN HE21 . 17711 1 2245 . 2 2 2 2 GLN HE22 H 1 6.8642 0.000 . 2 . . . B 27 GLN HE22 . 17711 1 2246 . 2 2 2 2 GLN C C 13 176.3182 0.053 . 1 . . . B 27 GLN C . 17711 1 2247 . 2 2 2 2 GLN CA C 13 56.4212 0.078 . 1 . . . B 27 GLN CA . 17711 1 2248 . 2 2 2 2 GLN CB C 13 29.5252 0.079 . 1 . . . B 27 GLN CB . 17711 1 2249 . 2 2 2 2 GLN CG C 13 33.7362 0.106 . 1 . . . B 27 GLN CG . 17711 1 2250 . 2 2 2 2 GLN NE2 N 15 112.6672 0.000 . 1 . . . B 27 GLN NE2 . 17711 1 2251 . 2 2 3 3 SER H H 1 8.5672 0.008 . 1 . . . . 28 SER H . 17711 1 2252 . 2 2 3 3 SER HA H 1 4.4652 0.009 . 1 . . . B 28 SER HA . 17711 1 2253 . 2 2 3 3 SER HB2 H 1 3.8702 0.020 . 2 . . . B 28 SER HB2 . 17711 1 2254 . 2 2 3 3 SER HB3 H 1 3.8702 0.020 . 2 . . . . 28 SER HB3 . 17711 1 2255 . 2 2 3 3 SER C C 13 174.2782 0.038 . 1 . . . B 28 SER C . 17711 1 2256 . 2 2 3 3 SER CA C 13 58.4752 0.059 . 1 . . . B 28 SER CA . 17711 1 2257 . 2 2 3 3 SER CB C 13 63.6532 0.187 . 1 . . . B 28 SER CB . 17711 1 2258 . 2 2 3 3 SER N N 15 116.7872 0.056 . 1 . . . B 28 SER N . 17711 1 2259 . 2 2 4 4 ASP H H 1 8.3132 0.008 . 1 . . . . 29 ASP H . 17711 1 2260 . 2 2 4 4 ASP HA H 1 4.6162 0.010 . 1 . . . B 29 ASP HA . 17711 1 2261 . 2 2 4 4 ASP HB2 H 1 2.6982 0.015 . 2 . . . B 29 ASP HB2 . 17711 1 2262 . 2 2 4 4 ASP HB3 H 1 2.6982 0.015 . 2 . . . . 29 ASP HB3 . 17711 1 2263 . 2 2 4 4 ASP C C 13 176.0802 0.023 . 1 . . . B 29 ASP C . 17711 1 2264 . 2 2 4 4 ASP CA C 13 54.4522 0.075 . 1 . . . B 29 ASP CA . 17711 1 2265 . 2 2 4 4 ASP CB C 13 41.1052 0.090 . 1 . . . B 29 ASP CB . 17711 1 2266 . 2 2 4 4 ASP N N 15 122.0502 0.050 . 1 . . . B 29 ASP N . 17711 1 2267 . 2 2 5 5 ASP H H 1 8.2792 0.007 . 1 . . . . 30 ASP H . 17711 1 2268 . 2 2 5 5 ASP HA H 1 4.6082 0.002 . 1 . . . B 30 ASP HA . 17711 1 2269 . 2 2 5 5 ASP HB2 H 1 2.6942 0.011 . 2 . . . B 30 ASP HB2 . 17711 1 2270 . 2 2 5 5 ASP HB3 H 1 2.6942 0.011 . 2 . . . . 30 ASP HB3 . 17711 1 2271 . 2 2 5 5 ASP C C 13 176.5802 0.029 . 1 . . . B 30 ASP C . 17711 1 2272 . 2 2 5 5 ASP CA C 13 54.5642 0.033 . 1 . . . B 30 ASP CA . 17711 1 2273 . 2 2 5 5 ASP CB C 13 40.9832 0.088 . 1 . . . B 30 ASP CB . 17711 1 2274 . 2 2 5 5 ASP N N 15 120.9312 0.057 . 1 . . . B 30 ASP N . 17711 1 2275 . 2 2 6 6 SER H H 1 8.2442 0.008 . 1 . . . . 31 SER H . 17711 1 2276 . 2 2 6 6 SER HA H 1 4.3162 0.007 . 1 . . . B 31 SER HA . 17711 1 2277 . 2 2 6 6 SER HB2 H 1 3.8392 0.008 . 2 . . . B 31 SER HB2 . 17711 1 2278 . 2 2 6 6 SER HB3 H 1 3.8392 0.008 . 2 . . . . 31 SER HB3 . 17711 1 2279 . 2 2 6 6 SER C C 13 174.4182 0.019 . 1 . . . B 31 SER C . 17711 1 2280 . 2 2 6 6 SER CA C 13 59.1542 0.066 . 1 . . . B 31 SER CA . 17711 1 2281 . 2 2 6 6 SER CB C 13 63.7802 0.089 . 1 . . . B 31 SER CB . 17711 1 2282 . 2 2 6 6 SER N N 15 115.7282 0.030 . 1 . . . B 31 SER N . 17711 1 2283 . 2 2 7 7 ASP H H 1 8.2802 0.005 . 1 . . . . 32 ASP H . 17711 1 2284 . 2 2 7 7 ASP HA H 1 4.5752 0.012 . 1 . . . B 32 ASP HA . 17711 1 2285 . 2 2 7 7 ASP HB2 H 1 2.5582 0.014 . 2 . . . B 32 ASP HB2 . 17711 1 2286 . 2 2 7 7 ASP HB3 H 1 2.5582 0.014 . 2 . . . . 32 ASP HB3 . 17711 1 2287 . 2 2 7 7 ASP C C 13 175.8962 0.047 . 1 . . . B 32 ASP C . 17711 1 2288 . 2 2 7 7 ASP CA C 13 54.3932 0.082 . 1 . . . B 32 ASP CA . 17711 1 2289 . 2 2 7 7 ASP CB C 13 41.0082 0.091 . 1 . . . B 32 ASP CB . 17711 1 2290 . 2 2 7 7 ASP N N 15 122.0392 0.118 . 1 . . . B 32 ASP N . 17711 1 2291 . 2 2 8 8 ILE H H 1 7.7332 0.006 . 1 . . . . 33 ILE H . 17711 1 2292 . 2 2 8 8 ILE HA H 1 3.9562 0.010 . 1 . . . B 33 ILE HA . 17711 1 2293 . 2 2 8 8 ILE HB H 1 1.6242 0.008 . 1 . . . B 33 ILE HB . 17711 1 2294 . 2 2 8 8 ILE HG12 H 1 1.1512 0.005 . 2 . . . B 33 ILE HG12 . 17711 1 2295 . 2 2 8 8 ILE HG13 H 1 0.9382 0.008 . 2 . . . . 33 ILE HG13 . 17711 1 2296 . 2 2 8 8 ILE HG21 H 1 0.6232 0.008 . 1 . . . B 33 ILE HG21 . 17711 1 2297 . 2 2 8 8 ILE HG22 H 1 0.6232 0.008 . 1 . . . B 33 ILE HG22 . 17711 1 2298 . 2 2 8 8 ILE HG23 H 1 0.6232 0.008 . 1 . . . B 33 ILE HG23 . 17711 1 2299 . 2 2 8 8 ILE HD11 H 1 0.6782 0.014 . 1 . . . B 33 ILE HD11 . 17711 1 2300 . 2 2 8 8 ILE HD12 H 1 0.6782 0.014 . 1 . . . B 33 ILE HD12 . 17711 1 2301 . 2 2 8 8 ILE HD13 H 1 0.6782 0.014 . 1 . . . B 33 ILE HD13 . 17711 1 2302 . 2 2 8 8 ILE C C 13 175.7422 0.054 . 1 . . . B 33 ILE C . 17711 1 2303 . 2 2 8 8 ILE CA C 13 61.2072 0.136 . 1 . . . B 33 ILE CA . 17711 1 2304 . 2 2 8 8 ILE CB C 13 38.5862 0.077 . 1 . . . B 33 ILE CB . 17711 1 2305 . 2 2 8 8 ILE CG1 C 13 27.0312 0.076 . 1 . . . B 33 ILE CG1 . 17711 1 2306 . 2 2 8 8 ILE CG2 C 13 17.1432 0.054 . 1 . . . B 33 ILE CG2 . 17711 1 2307 . 2 2 8 8 ILE CD1 C 13 12.8622 0.059 . 1 . . . B 33 ILE CD1 . 17711 1 2308 . 2 2 8 8 ILE N N 15 119.8342 0.056 . 1 . . . B 33 ILE N . 17711 1 2309 . 2 2 9 9 TRP H H 1 8.2762 0.012 . 1 . . . . 34 TRP H . 17711 1 2310 . 2 2 9 9 TRP HA H 1 4.6562 0.015 . 1 . . . B 34 TRP HA . 17711 1 2311 . 2 2 9 9 TRP HB2 H 1 3.1802 0.014 . 2 . . . B 34 TRP HB2 . 17711 1 2312 . 2 2 9 9 TRP HB3 H 1 2.9762 0.017 . 2 . . . . 34 TRP HB3 . 17711 1 2313 . 2 2 9 9 TRP HD1 H 1 7.0362 0.007 . 1 . . . B 34 TRP HD1 . 17711 1 2314 . 2 2 9 9 TRP HE1 H 1 9.8822 0.011 . 1 . . . B 34 TRP HE1 . 17711 1 2315 . 2 2 9 9 TRP HE3 H 1 7.2512 0.008 . 1 . . . B 34 TRP HE3 . 17711 1 2316 . 2 2 9 9 TRP HZ2 H 1 7.1742 0.009 . 1 . . . B 34 TRP HZ2 . 17711 1 2317 . 2 2 9 9 TRP HZ3 H 1 6.6452 0.004 . 1 . . . B 34 TRP HZ3 . 17711 1 2318 . 2 2 9 9 TRP HH2 H 1 6.9712 0.006 . 1 . . . B 34 TRP HH2 . 17711 1 2319 . 2 2 9 9 TRP CA C 13 56.3412 0.119 . 1 . . . B 34 TRP CA . 17711 1 2320 . 2 2 9 9 TRP CB C 13 29.1072 0.098 . 1 . . . B 34 TRP CB . 17711 1 2321 . 2 2 9 9 TRP CD1 C 13 126.9502 0.074 . 1 . . . B 34 TRP CD1 . 17711 1 2322 . 2 2 9 9 TRP CE3 C 13 121.0332 0.000 . 1 . . . B 34 TRP CE3 . 17711 1 2323 . 2 2 9 9 TRP CZ2 C 13 114.3972 0.142 . 1 . . . B 34 TRP CZ2 . 17711 1 2324 . 2 2 9 9 TRP CZ3 C 13 121.1832 0.103 . 1 . . . B 34 TRP CZ3 . 17711 1 2325 . 2 2 9 9 TRP CH2 C 13 124.5102 0.055 . 1 . . . B 34 TRP CH2 . 17711 1 2326 . 2 2 9 9 TRP N N 15 126.5562 0.094 . 1 . . . B 34 TRP N . 17711 1 2327 . 2 2 9 9 TRP NE1 N 15 128.8832 0.015 . 1 . . . B 34 TRP NE1 . 17711 1 2328 . 2 2 10 10 ASP H H 1 8.0062 0.002 . 1 . . . . 35 ASP H . 17711 1 2329 . 2 2 10 10 ASP HA H 1 4.3942 0.000 . 1 . . . B 35 ASP HA . 17711 1 2330 . 2 2 10 10 ASP CA C 13 52.6222 0.079 . 1 . . . B 35 ASP CA . 17711 1 2331 . 2 2 10 10 ASP N N 15 123.4902 0.061 . 1 . . . B 35 ASP N . 17711 1 2332 . 2 2 11 11 ASP HB2 H 1 2.7772 0.000 . 2 . . . B 36 ASP HB2 . 17711 1 2333 . 2 2 11 11 ASP HB3 H 1 2.7772 0.000 . 2 . . . . 36 ASP HB3 . 17711 1 2334 . 2 2 11 11 ASP C C 13 178.8332 0.000 . 1 . . . B 36 ASP C . 17711 1 2335 . 2 2 11 11 ASP CA C 13 56.0282 0.006 . 1 . . . B 36 ASP CA . 17711 1 2336 . 2 2 11 11 ASP CB C 13 41.6252 0.000 . 1 . . . B 36 ASP CB . 17711 1 2337 . 2 2 12 12 THR H H 1 8.1502 0.013 . 1 . . . . 37 THR H . 17711 1 2338 . 2 2 12 12 THR HA H 1 4.2582 0.009 . 1 . . . B 37 THR HA . 17711 1 2339 . 2 2 12 12 THR HB H 1 4.5552 0.010 . 1 . . . B 37 THR HB . 17711 1 2340 . 2 2 12 12 THR HG21 H 1 1.0952 0.009 . 1 . . . B 37 THR HG21 . 17711 1 2341 . 2 2 12 12 THR HG22 H 1 1.0952 0.009 . 1 . . . B 37 THR HG22 . 17711 1 2342 . 2 2 12 12 THR HG23 H 1 1.0952 0.009 . 1 . . . B 37 THR HG23 . 17711 1 2343 . 2 2 12 12 THR C C 13 175.1652 0.000 . 1 . . . B 37 THR C . 17711 1 2344 . 2 2 12 12 THR CA C 13 61.0172 0.103 . 1 . . . B 37 THR CA . 17711 1 2345 . 2 2 12 12 THR CB C 13 68.7452 0.117 . 1 . . . B 37 THR CB . 17711 1 2346 . 2 2 12 12 THR CG2 C 13 22.2062 0.069 . 1 . . . B 37 THR CG2 . 17711 1 2347 . 2 2 12 12 THR N N 15 105.6422 0.074 . 1 . . . B 37 THR N . 17711 1 2348 . 2 2 13 13 ALA H H 1 7.4592 0.008 . 1 . . . . 38 ALA H . 17711 1 2349 . 2 2 13 13 ALA HA H 1 3.7022 0.010 . 1 . . . B 38 ALA HA . 17711 1 2350 . 2 2 13 13 ALA HB1 H 1 0.9572 0.022 . 1 . . . B 38 ALA HB1 . 17711 1 2351 . 2 2 13 13 ALA HB2 H 1 0.9572 0.022 . 1 . . . B 38 ALA HB2 . 17711 1 2352 . 2 2 13 13 ALA HB3 H 1 0.9572 0.022 . 1 . . . B 38 ALA HB3 . 17711 1 2353 . 2 2 13 13 ALA C C 13 180.1702 0.005 . 1 . . . B 38 ALA C . 17711 1 2354 . 2 2 13 13 ALA CA C 13 56.4082 0.090 . 1 . . . B 38 ALA CA . 17711 1 2355 . 2 2 13 13 ALA CB C 13 19.1602 0.090 . 1 . . . B 38 ALA CB . 17711 1 2356 . 2 2 13 13 ALA N N 15 122.7182 0.095 . 1 . . . B 38 ALA N . 17711 1 2357 . 2 2 14 14 LEU H H 1 8.7672 0.009 . 1 . . . . 39 LEU H . 17711 1 2358 . 2 2 14 14 LEU HA H 1 4.2102 0.012 . 1 . . . B 39 LEU HA . 17711 1 2359 . 2 2 14 14 LEU HB2 H 1 1.8162 0.003 . 2 . . . B 39 LEU HB2 . 17711 1 2360 . 2 2 14 14 LEU HB3 H 1 1.3442 0.035 . 2 . . . . 39 LEU HB3 . 17711 1 2361 . 2 2 14 14 LEU HG H 1 1.5232 0.008 . 1 . . . B 39 LEU HG . 17711 1 2362 . 2 2 14 14 LEU HD11 H 1 0.7652 0.014 . 1 . . . B 39 LEU HD11 . 17711 1 2363 . 2 2 14 14 LEU HD12 H 1 0.7652 0.014 . 1 . . . B 39 LEU HD12 . 17711 1 2364 . 2 2 14 14 LEU HD13 H 1 0.7652 0.014 . 1 . . . B 39 LEU HD13 . 17711 1 2365 . 2 2 14 14 LEU HD21 H 1 0.7492 0.007 . 1 . . . B 39 LEU HD21 . 17711 1 2366 . 2 2 14 14 LEU HD22 H 1 0.7492 0.007 . 1 . . . B 39 LEU HD22 . 17711 1 2367 . 2 2 14 14 LEU HD23 H 1 0.7492 0.007 . 1 . . . B 39 LEU HD23 . 17711 1 2368 . 2 2 14 14 LEU C C 13 178.8352 0.000 . 1 . . . B 39 LEU C . 17711 1 2369 . 2 2 14 14 LEU CA C 13 57.7352 0.079 . 1 . . . B 39 LEU CA . 17711 1 2370 . 2 2 14 14 LEU CB C 13 41.3182 0.091 . 1 . . . B 39 LEU CB . 17711 1 2371 . 2 2 14 14 LEU CG C 13 26.2562 0.462 . 1 . . . B 39 LEU CG . 17711 1 2372 . 2 2 14 14 LEU CD1 C 13 25.9042 0.115 . 1 . . . B 39 LEU CD1 . 17711 1 2373 . 2 2 14 14 LEU CD2 C 13 23.4942 0.130 . 1 . . . B 39 LEU CD2 . 17711 1 2374 . 2 2 14 14 LEU N N 15 115.8382 0.091 . 1 . . . B 39 LEU N . 17711 1 2375 . 2 2 15 15 ILE H H 1 6.9472 0.008 . 1 . . . . 40 ILE H . 17711 1 2376 . 2 2 15 15 ILE HA H 1 3.4062 0.009 . 1 . . . B 40 ILE HA . 17711 1 2377 . 2 2 15 15 ILE HB H 1 1.9022 0.008 . 1 . . . B 40 ILE HB . 17711 1 2378 . 2 2 15 15 ILE HG12 H 1 1.2972 0.010 . 2 . . . B 40 ILE HG12 . 17711 1 2379 . 2 2 15 15 ILE HG13 H 1 0.7632 0.011 . 2 . . . . 40 ILE HG13 . 17711 1 2380 . 2 2 15 15 ILE HG21 H 1 0.8052 0.007 . 1 . . . B 40 ILE HG21 . 17711 1 2381 . 2 2 15 15 ILE HG22 H 1 0.8052 0.007 . 1 . . . B 40 ILE HG22 . 17711 1 2382 . 2 2 15 15 ILE HG23 H 1 0.8052 0.007 . 1 . . . B 40 ILE HG23 . 17711 1 2383 . 2 2 15 15 ILE HD11 H 1 0.6682 0.008 . 1 . . . B 40 ILE HD11 . 17711 1 2384 . 2 2 15 15 ILE HD12 H 1 0.6682 0.008 . 1 . . . B 40 ILE HD12 . 17711 1 2385 . 2 2 15 15 ILE HD13 H 1 0.6682 0.008 . 1 . . . B 40 ILE HD13 . 17711 1 2386 . 2 2 15 15 ILE C C 13 177.2072 0.000 . 1 . . . B 40 ILE C . 17711 1 2387 . 2 2 15 15 ILE CA C 13 65.7822 0.099 . 1 . . . B 40 ILE CA . 17711 1 2388 . 2 2 15 15 ILE CB C 13 38.7682 0.090 . 1 . . . B 40 ILE CB . 17711 1 2389 . 2 2 15 15 ILE CG1 C 13 29.8282 0.138 . 1 . . . B 40 ILE CG1 . 17711 1 2390 . 2 2 15 15 ILE CG2 C 13 18.2612 0.061 . 1 . . . B 40 ILE CG2 . 17711 1 2391 . 2 2 15 15 ILE CD1 C 13 15.8972 0.077 . 1 . . . B 40 ILE CD1 . 17711 1 2392 . 2 2 15 15 ILE N N 15 121.8492 0.080 . 1 . . . B 40 ILE N . 17711 1 2393 . 2 2 16 16 LYS H H 1 7.8332 0.008 . 1 . . . . 41 LYS H . 17711 1 2394 . 2 2 16 16 LYS HA H 1 4.0302 0.007 . 1 . . . B 41 LYS HA . 17711 1 2395 . 2 2 16 16 LYS HB2 H 1 1.6982 0.025 . 2 . . . B 41 LYS HB2 . 17711 1 2396 . 2 2 16 16 LYS HB3 H 1 1.6982 0.025 . 2 . . . . 41 LYS HB3 . 17711 1 2397 . 2 2 16 16 LYS HG2 H 1 1.4342 0.025 . 2 . . . B 41 LYS HG2 . 17711 1 2398 . 2 2 16 16 LYS HG3 H 1 1.4342 0.025 . 2 . . . . 41 LYS HG3 . 17711 1 2399 . 2 2 16 16 LYS HD2 H 1 1.5652 0.015 . 2 . . . B 41 LYS HD2 . 17711 1 2400 . 2 2 16 16 LYS HD3 H 1 1.5652 0.015 . 2 . . . . 41 LYS HD3 . 17711 1 2401 . 2 2 16 16 LYS HE2 H 1 2.9122 0.007 . 2 . . . B 41 LYS HE2 . 17711 1 2402 . 2 2 16 16 LYS HE3 H 1 2.9122 0.007 . 2 . . . . 41 LYS HE3 . 17711 1 2403 . 2 2 16 16 LYS C C 13 179.5032 0.025 . 1 . . . B 41 LYS C . 17711 1 2404 . 2 2 16 16 LYS CA C 13 59.1542 0.122 . 1 . . . B 41 LYS CA . 17711 1 2405 . 2 2 16 16 LYS CB C 13 32.7692 0.116 . 1 . . . B 41 LYS CB . 17711 1 2406 . 2 2 16 16 LYS CG C 13 25.8412 0.100 . 1 . . . B 41 LYS CG . 17711 1 2407 . 2 2 16 16 LYS CD C 13 29.4142 0.101 . 1 . . . B 41 LYS CD . 17711 1 2408 . 2 2 16 16 LYS CE C 13 41.8922 0.182 . 1 . . . B 41 LYS CE . 17711 1 2409 . 2 2 16 16 LYS N N 15 116.2512 0.108 . 1 . . . B 41 LYS N . 17711 1 2410 . 2 2 17 17 ALA H H 1 7.9652 0.008 . 1 . . . . 42 ALA H . 17711 1 2411 . 2 2 17 17 ALA HA H 1 4.0452 0.008 . 1 . . . B 42 ALA HA . 17711 1 2412 . 2 2 17 17 ALA HB1 H 1 1.7262 0.006 . 1 . . . B 42 ALA HB1 . 17711 1 2413 . 2 2 17 17 ALA HB2 H 1 1.7262 0.006 . 1 . . . B 42 ALA HB2 . 17711 1 2414 . 2 2 17 17 ALA HB3 H 1 1.7262 0.006 . 1 . . . B 42 ALA HB3 . 17711 1 2415 . 2 2 17 17 ALA C C 13 180.1362 0.052 . 1 . . . B 42 ALA C . 17711 1 2416 . 2 2 17 17 ALA CA C 13 55.3872 0.110 . 1 . . . B 42 ALA CA . 17711 1 2417 . 2 2 17 17 ALA CB C 13 18.5062 0.067 . 1 . . . B 42 ALA CB . 17711 1 2418 . 2 2 17 17 ALA N N 15 121.9532 0.063 . 1 . . . B 42 ALA N . 17711 1 2419 . 2 2 18 18 TYR H H 1 7.6602 0.007 . 1 . . . . 43 TYR H . 17711 1 2420 . 2 2 18 18 TYR HA H 1 3.1322 0.009 . 1 . . . B 43 TYR HA . 17711 1 2421 . 2 2 18 18 TYR HB2 H 1 2.8382 0.018 . 2 . . . B 43 TYR HB2 . 17711 1 2422 . 2 2 18 18 TYR HB3 H 1 2.2602 0.018 . 2 . . . . 43 TYR HB3 . 17711 1 2423 . 2 2 18 18 TYR HD1 H 1 6.9172 0.009 . 3 . . . B 43 TYR HD1 . 17711 1 2424 . 2 2 18 18 TYR HD2 H 1 6.9172 0.009 . 3 . . . B 43 TYR HD2 . 17711 1 2425 . 2 2 18 18 TYR HE1 H 1 6.5322 0.012 . 3 . . . B 43 TYR HE1 . 17711 1 2426 . 2 2 18 18 TYR HE2 H 1 6.5322 0.012 . 3 . . . B 43 TYR HE2 . 17711 1 2427 . 2 2 18 18 TYR HH H 1 9.4152 0.000 . 1 . . . B 43 TYR HH . 17711 1 2428 . 2 2 18 18 TYR C C 13 176.0512 0.022 . 1 . . . B 43 TYR C . 17711 1 2429 . 2 2 18 18 TYR CA C 13 61.6942 0.070 . 1 . . . B 43 TYR CA . 17711 1 2430 . 2 2 18 18 TYR CB C 13 37.4292 0.223 . 1 . . . B 43 TYR CB . 17711 1 2431 . 2 2 18 18 TYR CD1 C 13 129.3572 0.000 . 3 . . . B 43 TYR CD1 . 17711 1 2432 . 2 2 18 18 TYR CD2 C 13 129.3572 0.000 . 3 . . . B 43 TYR CD2 . 17711 1 2433 . 2 2 18 18 TYR CE1 C 13 118.2222 0.193 . 3 . . . B 43 TYR CE1 . 17711 1 2434 . 2 2 18 18 TYR CE2 C 13 118.2222 0.193 . 3 . . . B 43 TYR CE2 . 17711 1 2435 . 2 2 18 18 TYR N N 15 121.9492 0.057 . 1 . . . B 43 TYR N . 17711 1 2436 . 2 2 19 19 ASP H H 1 8.4362 0.011 . 1 . . . . 44 ASP H . 17711 1 2437 . 2 2 19 19 ASP HA H 1 4.1292 0.009 . 1 . . . B 44 ASP HA . 17711 1 2438 . 2 2 19 19 ASP HB2 H 1 2.7062 0.019 . 2 . . . B 44 ASP HB2 . 17711 1 2439 . 2 2 19 19 ASP HB3 H 1 2.5442 0.013 . 2 . . . . 44 ASP HB3 . 17711 1 2440 . 2 2 19 19 ASP C C 13 179.7612 0.000 . 1 . . . B 44 ASP C . 17711 1 2441 . 2 2 19 19 ASP CA C 13 57.3412 0.162 . 1 . . . B 44 ASP CA . 17711 1 2442 . 2 2 19 19 ASP CB C 13 39.6102 0.134 . 1 . . . B 44 ASP CB . 17711 1 2443 . 2 2 19 19 ASP N N 15 119.0592 0.089 . 1 . . . B 44 ASP N . 17711 1 2444 . 2 2 20 20 LYS H H 1 8.2082 0.012 . 1 . . . . 45 LYS H . 17711 1 2445 . 2 2 20 20 LYS HA H 1 4.0172 0.010 . 1 . . . B 45 LYS HA . 17711 1 2446 . 2 2 20 20 LYS HB2 H 1 1.8762 0.014 . 2 . . . B 45 LYS HB2 . 17711 1 2447 . 2 2 20 20 LYS HB3 H 1 1.8762 0.014 . 2 . . . . 45 LYS HB3 . 17711 1 2448 . 2 2 20 20 LYS HG2 H 1 1.4232 0.035 . 2 . . . B 45 LYS HG2 . 17711 1 2449 . 2 2 20 20 LYS HG3 H 1 1.4232 0.035 . 2 . . . . 45 LYS HG3 . 17711 1 2450 . 2 2 20 20 LYS HD2 H 1 1.6462 0.012 . 2 . . . B 45 LYS HD2 . 17711 1 2451 . 2 2 20 20 LYS HD3 H 1 1.6462 0.012 . 2 . . . . 45 LYS HD3 . 17711 1 2452 . 2 2 20 20 LYS HE2 H 1 2.9382 0.013 . 2 . . . B 45 LYS HE2 . 17711 1 2453 . 2 2 20 20 LYS HE3 H 1 2.9382 0.013 . 2 . . . . 45 LYS HE3 . 17711 1 2454 . 2 2 20 20 LYS C C 13 178.7742 0.000 . 1 . . . B 45 LYS C . 17711 1 2455 . 2 2 20 20 LYS CA C 13 59.0192 0.089 . 1 . . . B 45 LYS CA . 17711 1 2456 . 2 2 20 20 LYS CB C 13 32.7652 0.074 . 1 . . . B 45 LYS CB . 17711 1 2457 . 2 2 20 20 LYS CG C 13 25.0872 0.034 . 1 . . . B 45 LYS CG . 17711 1 2458 . 2 2 20 20 LYS CD C 13 29.4792 0.109 . 1 . . . B 45 LYS CD . 17711 1 2459 . 2 2 20 20 LYS CE C 13 42.0312 0.118 . 1 . . . B 45 LYS CE . 17711 1 2460 . 2 2 20 20 LYS N N 15 119.9972 0.064 . 1 . . . B 45 LYS N . 17711 1 2461 . 2 2 21 21 ALA H H 1 7.8482 0.007 . 1 . . . . 46 ALA H . 17711 1 2462 . 2 2 21 21 ALA HA H 1 4.1612 0.011 . 1 . . . B 46 ALA HA . 17711 1 2463 . 2 2 21 21 ALA HB1 H 1 1.4392 0.011 . 1 . . . B 46 ALA HB1 . 17711 1 2464 . 2 2 21 21 ALA HB2 H 1 1.4392 0.011 . 1 . . . B 46 ALA HB2 . 17711 1 2465 . 2 2 21 21 ALA HB3 H 1 1.4392 0.011 . 1 . . . B 46 ALA HB3 . 17711 1 2466 . 2 2 21 21 ALA C C 13 181.1622 0.000 . 1 . . . B 46 ALA C . 17711 1 2467 . 2 2 21 21 ALA CA C 13 55.4272 0.111 . 1 . . . B 46 ALA CA . 17711 1 2468 . 2 2 21 21 ALA CB C 13 19.4412 0.116 . 1 . . . B 46 ALA CB . 17711 1 2469 . 2 2 21 21 ALA N N 15 123.9042 0.136 . 1 . . . B 46 ALA N . 17711 1 2470 . 2 2 22 22 VAL H H 1 8.1392 0.009 . 1 . . . . 47 VAL H . 17711 1 2471 . 2 2 22 22 VAL HA H 1 3.7202 0.008 . 1 . . . B 47 VAL HA . 17711 1 2472 . 2 2 22 22 VAL HB H 1 2.0192 0.006 . 1 . . . B 47 VAL HB . 17711 1 2473 . 2 2 22 22 VAL HG11 H 1 0.6442 0.017 . 1 . . . B 47 VAL HG11 . 17711 1 2474 . 2 2 22 22 VAL HG12 H 1 0.6442 0.017 . 1 . . . B 47 VAL HG12 . 17711 1 2475 . 2 2 22 22 VAL HG13 H 1 0.6442 0.017 . 1 . . . B 47 VAL HG13 . 17711 1 2476 . 2 2 22 22 VAL HG21 H 1 0.5922 0.015 . 1 . . . B 47 VAL HG21 . 17711 1 2477 . 2 2 22 22 VAL HG22 H 1 0.5922 0.015 . 1 . . . B 47 VAL HG22 . 17711 1 2478 . 2 2 22 22 VAL HG23 H 1 0.5922 0.015 . 1 . . . B 47 VAL HG23 . 17711 1 2479 . 2 2 22 22 VAL C C 13 177.5272 0.000 . 1 . . . B 47 VAL C . 17711 1 2480 . 2 2 22 22 VAL CA C 13 65.3162 0.111 . 1 . . . B 47 VAL CA . 17711 1 2481 . 2 2 22 22 VAL CB C 13 31.6872 0.071 . 1 . . . B 47 VAL CB . 17711 1 2482 . 2 2 22 22 VAL CG1 C 13 21.3262 0.164 . 1 . . . B 47 VAL CG1 . 17711 1 2483 . 2 2 22 22 VAL CG2 C 13 20.8682 0.140 . 1 . . . B 47 VAL CG2 . 17711 1 2484 . 2 2 22 22 VAL N N 15 114.4472 0.114 . 1 . . . B 47 VAL N . 17711 1 2485 . 2 2 23 23 ALA H H 1 7.5392 0.007 . 1 . . . . 48 ALA H . 17711 1 2486 . 2 2 23 23 ALA HA H 1 4.3132 0.010 . 1 . . . B 48 ALA HA . 17711 1 2487 . 2 2 23 23 ALA HB1 H 1 1.4802 0.016 . 1 . . . B 48 ALA HB1 . 17711 1 2488 . 2 2 23 23 ALA HB2 H 1 1.4802 0.016 . 1 . . . B 48 ALA HB2 . 17711 1 2489 . 2 2 23 23 ALA HB3 H 1 1.4802 0.016 . 1 . . . B 48 ALA HB3 . 17711 1 2490 . 2 2 23 23 ALA C C 13 178.3502 0.019 . 1 . . . B 48 ALA C . 17711 1 2491 . 2 2 23 23 ALA CA C 13 53.4062 0.076 . 1 . . . B 48 ALA CA . 17711 1 2492 . 2 2 23 23 ALA CB C 13 18.7752 0.095 . 1 . . . B 48 ALA CB . 17711 1 2493 . 2 2 23 23 ALA N N 15 121.3842 0.044 . 1 . . . B 48 ALA N . 17711 1 2494 . 2 2 24 24 SER H H 1 7.7712 0.006 . 1 . . . . 49 SER H . 17711 1 2495 . 2 2 24 24 SER HA H 1 4.4122 0.007 . 1 . . . B 49 SER HA . 17711 1 2496 . 2 2 24 24 SER HB2 H 1 4.1122 0.009 . 2 . . . B 49 SER HB2 . 17711 1 2497 . 2 2 24 24 SER HB3 H 1 4.0072 0.008 . 2 . . . . 49 SER HB3 . 17711 1 2498 . 2 2 24 24 SER C C 13 174.2942 0.009 . 1 . . . B 49 SER C . 17711 1 2499 . 2 2 24 24 SER CA C 13 59.5382 0.087 . 1 . . . B 49 SER CA . 17711 1 2500 . 2 2 24 24 SER CB C 13 64.0162 0.122 . 1 . . . B 49 SER CB . 17711 1 2501 . 2 2 24 24 SER N N 15 112.8012 0.075 . 1 . . . B 49 SER N . 17711 1 2502 . 2 2 25 25 PHE H H 1 7.7872 0.006 . 1 . . . . 50 PHE H . 17711 1 2503 . 2 2 25 25 PHE HA H 1 4.0472 0.013 . 1 . . . B 50 PHE HA . 17711 1 2504 . 2 2 25 25 PHE HB2 H 1 2.9072 0.012 . 2 . . . B 50 PHE HB2 . 17711 1 2505 . 2 2 25 25 PHE HB3 H 1 3.0252 0.020 . 2 . . . . 50 PHE HB3 . 17711 1 2506 . 2 2 25 25 PHE HD1 H 1 6.6312 0.019 . 3 . . . B 50 PHE HD1 . 17711 1 2507 . 2 2 25 25 PHE HD2 H 1 6.6312 0.019 . 3 . . . B 50 PHE HD2 . 17711 1 2508 . 2 2 25 25 PHE HE1 H 1 6.9842 0.024 . 3 . . . B 50 PHE HE1 . 17711 1 2509 . 2 2 25 25 PHE HE2 H 1 6.9842 0.024 . 3 . . . B 50 PHE HE2 . 17711 1 2510 . 2 2 25 25 PHE HZ H 1 6.6392 0.021 . 1 . . . B 50 PHE HZ . 17711 1 2511 . 2 2 25 25 PHE C C 13 173.8712 0.022 . 1 . . . B 50 PHE C . 17711 1 2512 . 2 2 25 25 PHE CA C 13 59.0542 0.092 . 1 . . . B 50 PHE CA . 17711 1 2513 . 2 2 25 25 PHE CB C 13 39.6632 0.123 . 1 . . . B 50 PHE CB . 17711 1 2514 . 2 2 25 25 PHE CD1 C 13 131.6612 0.251 . 3 . . . B 50 PHE CD1 . 17711 1 2515 . 2 2 25 25 PHE CD2 C 13 131.6612 0.251 . 3 . . . B 50 PHE CD2 . 17711 1 2516 . 2 2 25 25 PHE CE1 C 13 131.2702 0.345 . 3 . . . B 50 PHE CE1 . 17711 1 2517 . 2 2 25 25 PHE CE2 C 13 131.2702 0.345 . 3 . . . B 50 PHE CE2 . 17711 1 2518 . 2 2 25 25 PHE CZ C 13 132.3432 0.133 . 1 . . . B 50 PHE CZ . 17711 1 2519 . 2 2 25 25 PHE N N 15 122.7832 0.054 . 1 . . . B 50 PHE N . 17711 1 2520 . 2 2 26 26 LYS H H 1 7.1822 0.007 . 1 . . . . 51 LYS H . 17711 1 2521 . 2 2 26 26 LYS HA H 1 3.9482 0.009 . 1 . . . B 51 LYS HA . 17711 1 2522 . 2 2 26 26 LYS HB2 H 1 1.7432 0.013 . 2 . . . B 51 LYS HB2 . 17711 1 2523 . 2 2 26 26 LYS HB3 H 1 1.6392 0.010 . 2 . . . . 51 LYS HB3 . 17711 1 2524 . 2 2 26 26 LYS HG2 H 1 1.3382 0.014 . 2 . . . B 51 LYS HG2 . 17711 1 2525 . 2 2 26 26 LYS HG3 H 1 1.3382 0.014 . 2 . . . . 51 LYS HG3 . 17711 1 2526 . 2 2 26 26 LYS HD2 H 1 1.6532 0.010 . 2 . . . B 51 LYS HD2 . 17711 1 2527 . 2 2 26 26 LYS HD3 H 1 1.6532 0.010 . 2 . . . . 51 LYS HD3 . 17711 1 2528 . 2 2 26 26 LYS HE2 H 1 2.9742 0.015 . 2 . . . B 51 LYS HE2 . 17711 1 2529 . 2 2 26 26 LYS HE3 H 1 2.9742 0.015 . 2 . . . . 51 LYS HE3 . 17711 1 2530 . 2 2 26 26 LYS C C 13 180.4482 0.000 . 1 . . . B 51 LYS C . 17711 1 2531 . 2 2 26 26 LYS CA C 13 57.6472 0.128 . 1 . . . B 51 LYS CA . 17711 1 2532 . 2 2 26 26 LYS CB C 13 34.0762 0.074 . 1 . . . B 51 LYS CB . 17711 1 2533 . 2 2 26 26 LYS CG C 13 24.5472 0.047 . 1 . . . B 51 LYS CG . 17711 1 2534 . 2 2 26 26 LYS CD C 13 29.1962 0.151 . 1 . . . B 51 LYS CD . 17711 1 2535 . 2 2 26 26 LYS CE C 13 42.0912 0.155 . 1 . . . B 51 LYS CE . 17711 1 2536 . 2 2 26 26 LYS N N 15 127.7332 0.063 . 1 . . . B 51 LYS N . 17711 1 stop_ save_