data_17416 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17416 _Entry.Title ; Aquifex aeolicus LpxC/CHIR-090 complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-01-19 _Entry.Accession_date 2011-01-19 _Entry.Last_release_date 2011-02-16 _Entry.Original_release_date 2011-02-16 _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 _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 Pei Zhou . . . 17416 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17416 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 1095 17416 '15N chemical shifts' 266 17416 '1H chemical shifts' 2021 17416 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-02-16 2011-01-19 original author . 17416 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17416 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 18025458 _Citation.Full_citation . _Citation.Title 'Structure of the deacetylase LpxC bound to the antibiotic CHIR-090: Time-dependent inhibition and specificity in ligand binding' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full . _Citation.Journal_volume 104 _Citation.Journal_issue 47 _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 18433 _Citation.Page_last 18438 _Citation.Year 2007 _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 Adam Barb . W. . 17416 1 2 Ling Jiang . . . 17416 1 3 Christian Raetz . R.H. . 17416 1 4 Pei Zhou . . . 17416 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID antibiotic 17416 1 CHIR-090 17416 1 'lipid A' 17416 1 LpxC 17416 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17416 _Assembly.ID 1 _Assembly.Name LpxC/CHIR-090 _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _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 AaLpxC 1 $AaLpxC A . yes native no no . . . 17416 1 2 CHIR-090 2 $C90 A . no native no no . . . 17416 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2JT2 . . . . . . 17416 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_AaLpxC _Entity.Sf_category entity _Entity.Sf_framecode AaLpxC _Entity.Entry_ID 17416 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name AaLpxC _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGLEKTVKEKLSFEGVGIHT GEYSKLIIHPEKEGTGIRFF KNGVYIPARHEFVVHTNHST DLGFKGQRIKTVEHILSVLH LLEITNVTIEVIGNEIPILD GSGWEFYEAIRKNILNQNRE IDYFVVEEPIIVEDEGRLIK AEPSDTLEVTYEGEFKNFLG RQKFTFVEGNEEEIVLARTF AFDWEIEHIKKVGLGKGGSL KNTLVLGKDKVYNPEGLRYE NEPVRHKVFDLIGDLYLLGS PVKGKFYSFRGGHSLNVKLV KELAKKQKLTRDLP ; _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 274 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _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 1P42 . "Crystal Structure Of Aquifex Aeolicus Lpxc Deacetylase (zinc-inhibited Form)" . . . . . 98.54 270 100.00 100.00 0.00e+00 . . . . 17416 1 2 no PDB 1XXE . "Rdc Refined Solution Structure Of The AalpxcTU-514 Complex" . . . . . 100.00 282 99.64 99.64 0.00e+00 . . . . 17416 1 3 no PDB 1YH8 . "Crystal Structure Of Aquifex Aeolicus Lpxc Deacetylase Complexed With Palmitate" . . . . . 98.54 270 100.00 100.00 0.00e+00 . . . . 17416 1 4 no PDB 1YHC . "Crystal Structure Of Aquifex Aeolicus Lpxc Deacetylase Complexed With Cacodylate" . . . . . 98.54 270 100.00 100.00 0.00e+00 . . . . 17416 1 5 no PDB 2GO3 . "Crystal Structure Of Aquifex Aeolicus Lpxc Complexed With Imidazole." . . . . . 97.45 267 100.00 100.00 0.00e+00 . . . . 17416 1 6 no PDB 2GO4 . "Crystal Structure Of Aquifex Aeolicus Lpxc Complexed With Tu-514" . . . . . 97.45 267 100.00 100.00 0.00e+00 . . . . 17416 1 7 no PDB 2IER . "Crystal Structure Of Aquifex Aeolicus Lpxc Complexed With Uridine 5'- Diphosphate" . . . . . 98.91 271 100.00 100.00 0.00e+00 . . . . 17416 1 8 no PDB 2IES . "Crystal Structure Of Aquifex Aeolicus Lpxc Complexed With Pyrophosphate" . . . . . 98.91 271 100.00 100.00 0.00e+00 . . . . 17416 1 9 no PDB 2J65 . "Structure Of Lpxc From Aquifex Aeolicus In Complex With Udp" . . . . . 98.91 271 100.00 100.00 0.00e+00 . . . . 17416 1 10 no PDB 2JT2 . "Solution Structure Of The Aquifex Aeolicus Lpxc- Chir-090 Complex" . . . . . 100.00 274 100.00 100.00 0.00e+00 . . . . 17416 1 11 no PDB 2O3Z . "X-Ray Crystal Structure Of Lpxc Complexed With 3-Heptyloxybenzoate" . . . . . 98.91 271 100.00 100.00 0.00e+00 . . . . 17416 1 12 no PDB 3P3C . "Crystal Structure Of The Aquifex Aeolicus LpxcLPC-009 Complex" . . . . . 99.64 274 100.00 100.00 0.00e+00 . . . . 17416 1 13 no PDB 3P76 . "X-Ray Crystal Structure Of Aquifex Aeolicus Lpxc Complexed Sch1379777" . . . . . 98.91 271 100.00 100.00 0.00e+00 . . . . 17416 1 14 no PDB 4OZE . "A.aolicus Lpxc In Complex With Native Product" . . . . . 100.00 282 99.64 99.64 0.00e+00 . . . . 17416 1 15 no PDB 4U3B . "Lpxc From A.aaeolicus In Complex With The Mmp Inhibitor 4-[[4-(4- Chlorophenoxy)phenyl]sulfanylmethyl]tetrahydropyran-4-carbohy" . . . . . 98.91 271 100.00 100.00 0.00e+00 . . . . 17416 1 16 no PDB 4U3D . "Lpxc From A.aaeolicus In Complex With 4-[[4-[2-[4-(morpholinomethyl) Phenyl]ethynyl]phenoxy]methyl]tetrahydropyran-4-carbohydro" . . . . . 98.91 271 100.00 100.00 0.00e+00 . . . . 17416 1 17 no GB AAC07605 . "UDP-3-0-acyl N-acetylglcosamine deacetylase [Aquifex aeolicus VF5]" . . . . . 100.00 282 99.64 99.64 0.00e+00 . . . . 17416 1 18 no REF NP_214214 . "UDP-3-O-[3-hydroxymyristoyl] N-acetylglucosamine deacetylase [Aquifex aeolicus VF5]" . . . . . 100.00 282 99.64 99.64 0.00e+00 . . . . 17416 1 19 no REF WP_010881151 . "UDP-3-O-[3-hydroxymyristoyl] N-acetylglucosamine deacetylase [Aquifex aeolicus]" . . . . . 100.00 282 99.64 99.64 0.00e+00 . . . . 17416 1 20 no SP O67648 . "RecName: Full=UDP-3-O-[3-hydroxymyristoyl] N-acetylglucosamine deacetylase; AltName: Full=UDP-3-O-acyl-GlcNAc deacetylase" . . . . . 100.00 282 99.64 99.64 0.00e+00 . . . . 17416 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 . MET . 17416 1 2 . GLY . 17416 1 3 . LEU . 17416 1 4 . GLU . 17416 1 5 . LYS . 17416 1 6 . THR . 17416 1 7 . VAL . 17416 1 8 . LYS . 17416 1 9 . GLU . 17416 1 10 . LYS . 17416 1 11 . LEU . 17416 1 12 . SER . 17416 1 13 . PHE . 17416 1 14 . GLU . 17416 1 15 . GLY . 17416 1 16 . VAL . 17416 1 17 . GLY . 17416 1 18 . ILE . 17416 1 19 . HIS . 17416 1 20 . THR . 17416 1 21 . GLY . 17416 1 22 . GLU . 17416 1 23 . TYR . 17416 1 24 . SER . 17416 1 25 . LYS . 17416 1 26 . LEU . 17416 1 27 . ILE . 17416 1 28 . ILE . 17416 1 29 . HIS . 17416 1 30 . PRO . 17416 1 31 . GLU . 17416 1 32 . LYS . 17416 1 33 . GLU . 17416 1 34 . GLY . 17416 1 35 . THR . 17416 1 36 . GLY . 17416 1 37 . ILE . 17416 1 38 . ARG . 17416 1 39 . PHE . 17416 1 40 . PHE . 17416 1 41 . LYS . 17416 1 42 . ASN . 17416 1 43 . GLY . 17416 1 44 . VAL . 17416 1 45 . TYR . 17416 1 46 . ILE . 17416 1 47 . PRO . 17416 1 48 . ALA . 17416 1 49 . ARG . 17416 1 50 . HIS . 17416 1 51 . GLU . 17416 1 52 . PHE . 17416 1 53 . VAL . 17416 1 54 . VAL . 17416 1 55 . HIS . 17416 1 56 . THR . 17416 1 57 . ASN . 17416 1 58 . HIS . 17416 1 59 . SER . 17416 1 60 . THR . 17416 1 61 . ASP . 17416 1 62 . LEU . 17416 1 63 . GLY . 17416 1 64 . PHE . 17416 1 65 . LYS . 17416 1 66 . GLY . 17416 1 67 . GLN . 17416 1 68 . ARG . 17416 1 69 . ILE . 17416 1 70 . LYS . 17416 1 71 . THR . 17416 1 72 . VAL . 17416 1 73 . GLU . 17416 1 74 . HIS . 17416 1 75 . ILE . 17416 1 76 . LEU . 17416 1 77 . SER . 17416 1 78 . VAL . 17416 1 79 . LEU . 17416 1 80 . HIS . 17416 1 81 . LEU . 17416 1 82 . LEU . 17416 1 83 . GLU . 17416 1 84 . ILE . 17416 1 85 . THR . 17416 1 86 . ASN . 17416 1 87 . VAL . 17416 1 88 . THR . 17416 1 89 . ILE . 17416 1 90 . GLU . 17416 1 91 . VAL . 17416 1 92 . ILE . 17416 1 93 . GLY . 17416 1 94 . ASN . 17416 1 95 . GLU . 17416 1 96 . ILE . 17416 1 97 . PRO . 17416 1 98 . ILE . 17416 1 99 . LEU . 17416 1 100 . ASP . 17416 1 101 . GLY . 17416 1 102 . SER . 17416 1 103 . GLY . 17416 1 104 . TRP . 17416 1 105 . GLU . 17416 1 106 . PHE . 17416 1 107 . TYR . 17416 1 108 . GLU . 17416 1 109 . ALA . 17416 1 110 . ILE . 17416 1 111 . ARG . 17416 1 112 . LYS . 17416 1 113 . ASN . 17416 1 114 . ILE . 17416 1 115 . LEU . 17416 1 116 . ASN . 17416 1 117 . GLN . 17416 1 118 . ASN . 17416 1 119 . ARG . 17416 1 120 . GLU . 17416 1 121 . ILE . 17416 1 122 . ASP . 17416 1 123 . TYR . 17416 1 124 . PHE . 17416 1 125 . VAL . 17416 1 126 . VAL . 17416 1 127 . GLU . 17416 1 128 . GLU . 17416 1 129 . PRO . 17416 1 130 . ILE . 17416 1 131 . ILE . 17416 1 132 . VAL . 17416 1 133 . GLU . 17416 1 134 . ASP . 17416 1 135 . GLU . 17416 1 136 . GLY . 17416 1 137 . ARG . 17416 1 138 . LEU . 17416 1 139 . ILE . 17416 1 140 . LYS . 17416 1 141 . ALA . 17416 1 142 . GLU . 17416 1 143 . PRO . 17416 1 144 . SER . 17416 1 145 . ASP . 17416 1 146 . THR . 17416 1 147 . LEU . 17416 1 148 . GLU . 17416 1 149 . VAL . 17416 1 150 . THR . 17416 1 151 . TYR . 17416 1 152 . GLU . 17416 1 153 . GLY . 17416 1 154 . GLU . 17416 1 155 . PHE . 17416 1 156 . LYS . 17416 1 157 . ASN . 17416 1 158 . PHE . 17416 1 159 . LEU . 17416 1 160 . GLY . 17416 1 161 . ARG . 17416 1 162 . GLN . 17416 1 163 . LYS . 17416 1 164 . PHE . 17416 1 165 . THR . 17416 1 166 . PHE . 17416 1 167 . VAL . 17416 1 168 . GLU . 17416 1 169 . GLY . 17416 1 170 . ASN . 17416 1 171 . GLU . 17416 1 172 . GLU . 17416 1 173 . GLU . 17416 1 174 . ILE . 17416 1 175 . VAL . 17416 1 176 . LEU . 17416 1 177 . ALA . 17416 1 178 . ARG . 17416 1 179 . THR . 17416 1 180 . PHE . 17416 1 181 . ALA . 17416 1 182 . PHE . 17416 1 183 . ASP . 17416 1 184 . TRP . 17416 1 185 . GLU . 17416 1 186 . ILE . 17416 1 187 . GLU . 17416 1 188 . HIS . 17416 1 189 . ILE . 17416 1 190 . LYS . 17416 1 191 . LYS . 17416 1 192 . VAL . 17416 1 193 . GLY . 17416 1 194 . LEU . 17416 1 195 . GLY . 17416 1 196 . LYS . 17416 1 197 . GLY . 17416 1 198 . GLY . 17416 1 199 . SER . 17416 1 200 . LEU . 17416 1 201 . LYS . 17416 1 202 . ASN . 17416 1 203 . THR . 17416 1 204 . LEU . 17416 1 205 . VAL . 17416 1 206 . LEU . 17416 1 207 . GLY . 17416 1 208 . LYS . 17416 1 209 . ASP . 17416 1 210 . LYS . 17416 1 211 . VAL . 17416 1 212 . TYR . 17416 1 213 . ASN . 17416 1 214 . PRO . 17416 1 215 . GLU . 17416 1 216 . GLY . 17416 1 217 . LEU . 17416 1 218 . ARG . 17416 1 219 . TYR . 17416 1 220 . GLU . 17416 1 221 . ASN . 17416 1 222 . GLU . 17416 1 223 . PRO . 17416 1 224 . VAL . 17416 1 225 . ARG . 17416 1 226 . HIS . 17416 1 227 . LYS . 17416 1 228 . VAL . 17416 1 229 . PHE . 17416 1 230 . ASP . 17416 1 231 . LEU . 17416 1 232 . ILE . 17416 1 233 . GLY . 17416 1 234 . ASP . 17416 1 235 . LEU . 17416 1 236 . TYR . 17416 1 237 . LEU . 17416 1 238 . LEU . 17416 1 239 . GLY . 17416 1 240 . SER . 17416 1 241 . PRO . 17416 1 242 . VAL . 17416 1 243 . LYS . 17416 1 244 . GLY . 17416 1 245 . LYS . 17416 1 246 . PHE . 17416 1 247 . TYR . 17416 1 248 . SER . 17416 1 249 . PHE . 17416 1 250 . ARG . 17416 1 251 . GLY . 17416 1 252 . GLY . 17416 1 253 . HIS . 17416 1 254 . SER . 17416 1 255 . LEU . 17416 1 256 . ASN . 17416 1 257 . VAL . 17416 1 258 . LYS . 17416 1 259 . LEU . 17416 1 260 . VAL . 17416 1 261 . LYS . 17416 1 262 . GLU . 17416 1 263 . LEU . 17416 1 264 . ALA . 17416 1 265 . LYS . 17416 1 266 . LYS . 17416 1 267 . GLN . 17416 1 268 . LYS . 17416 1 269 . LEU . 17416 1 270 . THR . 17416 1 271 . ARG . 17416 1 272 . ASP . 17416 1 273 . LEU . 17416 1 274 . PRO . 17416 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 . MET 1 1 17416 1 . GLY 2 2 17416 1 . LEU 3 3 17416 1 . GLU 4 4 17416 1 . LYS 5 5 17416 1 . THR 6 6 17416 1 . VAL 7 7 17416 1 . LYS 8 8 17416 1 . GLU 9 9 17416 1 . LYS 10 10 17416 1 . LEU 11 11 17416 1 . SER 12 12 17416 1 . PHE 13 13 17416 1 . GLU 14 14 17416 1 . GLY 15 15 17416 1 . VAL 16 16 17416 1 . GLY 17 17 17416 1 . ILE 18 18 17416 1 . HIS 19 19 17416 1 . THR 20 20 17416 1 . GLY 21 21 17416 1 . GLU 22 22 17416 1 . TYR 23 23 17416 1 . SER 24 24 17416 1 . LYS 25 25 17416 1 . LEU 26 26 17416 1 . ILE 27 27 17416 1 . ILE 28 28 17416 1 . HIS 29 29 17416 1 . PRO 30 30 17416 1 . GLU 31 31 17416 1 . LYS 32 32 17416 1 . GLU 33 33 17416 1 . GLY 34 34 17416 1 . THR 35 35 17416 1 . GLY 36 36 17416 1 . ILE 37 37 17416 1 . ARG 38 38 17416 1 . PHE 39 39 17416 1 . PHE 40 40 17416 1 . LYS 41 41 17416 1 . ASN 42 42 17416 1 . GLY 43 43 17416 1 . VAL 44 44 17416 1 . TYR 45 45 17416 1 . ILE 46 46 17416 1 . PRO 47 47 17416 1 . ALA 48 48 17416 1 . ARG 49 49 17416 1 . HIS 50 50 17416 1 . GLU 51 51 17416 1 . PHE 52 52 17416 1 . VAL 53 53 17416 1 . VAL 54 54 17416 1 . HIS 55 55 17416 1 . THR 56 56 17416 1 . ASN 57 57 17416 1 . HIS 58 58 17416 1 . SER 59 59 17416 1 . THR 60 60 17416 1 . ASP 61 61 17416 1 . LEU 62 62 17416 1 . GLY 63 63 17416 1 . PHE 64 64 17416 1 . LYS 65 65 17416 1 . GLY 66 66 17416 1 . GLN 67 67 17416 1 . ARG 68 68 17416 1 . ILE 69 69 17416 1 . LYS 70 70 17416 1 . THR 71 71 17416 1 . VAL 72 72 17416 1 . GLU 73 73 17416 1 . HIS 74 74 17416 1 . ILE 75 75 17416 1 . LEU 76 76 17416 1 . SER 77 77 17416 1 . VAL 78 78 17416 1 . LEU 79 79 17416 1 . HIS 80 80 17416 1 . LEU 81 81 17416 1 . LEU 82 82 17416 1 . GLU 83 83 17416 1 . ILE 84 84 17416 1 . THR 85 85 17416 1 . ASN 86 86 17416 1 . VAL 87 87 17416 1 . THR 88 88 17416 1 . ILE 89 89 17416 1 . GLU 90 90 17416 1 . VAL 91 91 17416 1 . ILE 92 92 17416 1 . GLY 93 93 17416 1 . ASN 94 94 17416 1 . GLU 95 95 17416 1 . ILE 96 96 17416 1 . PRO 97 97 17416 1 . ILE 98 98 17416 1 . LEU 99 99 17416 1 . ASP 100 100 17416 1 . GLY 101 101 17416 1 . SER 102 102 17416 1 . GLY 103 103 17416 1 . TRP 104 104 17416 1 . GLU 105 105 17416 1 . PHE 106 106 17416 1 . TYR 107 107 17416 1 . GLU 108 108 17416 1 . ALA 109 109 17416 1 . ILE 110 110 17416 1 . ARG 111 111 17416 1 . LYS 112 112 17416 1 . ASN 113 113 17416 1 . ILE 114 114 17416 1 . LEU 115 115 17416 1 . ASN 116 116 17416 1 . GLN 117 117 17416 1 . ASN 118 118 17416 1 . ARG 119 119 17416 1 . GLU 120 120 17416 1 . ILE 121 121 17416 1 . ASP 122 122 17416 1 . TYR 123 123 17416 1 . PHE 124 124 17416 1 . VAL 125 125 17416 1 . VAL 126 126 17416 1 . GLU 127 127 17416 1 . GLU 128 128 17416 1 . PRO 129 129 17416 1 . ILE 130 130 17416 1 . ILE 131 131 17416 1 . VAL 132 132 17416 1 . GLU 133 133 17416 1 . ASP 134 134 17416 1 . GLU 135 135 17416 1 . GLY 136 136 17416 1 . ARG 137 137 17416 1 . LEU 138 138 17416 1 . ILE 139 139 17416 1 . LYS 140 140 17416 1 . ALA 141 141 17416 1 . GLU 142 142 17416 1 . PRO 143 143 17416 1 . SER 144 144 17416 1 . ASP 145 145 17416 1 . THR 146 146 17416 1 . LEU 147 147 17416 1 . GLU 148 148 17416 1 . VAL 149 149 17416 1 . THR 150 150 17416 1 . TYR 151 151 17416 1 . GLU 152 152 17416 1 . GLY 153 153 17416 1 . GLU 154 154 17416 1 . PHE 155 155 17416 1 . LYS 156 156 17416 1 . ASN 157 157 17416 1 . PHE 158 158 17416 1 . LEU 159 159 17416 1 . GLY 160 160 17416 1 . ARG 161 161 17416 1 . GLN 162 162 17416 1 . LYS 163 163 17416 1 . PHE 164 164 17416 1 . THR 165 165 17416 1 . PHE 166 166 17416 1 . VAL 167 167 17416 1 . GLU 168 168 17416 1 . GLY 169 169 17416 1 . ASN 170 170 17416 1 . GLU 171 171 17416 1 . GLU 172 172 17416 1 . GLU 173 173 17416 1 . ILE 174 174 17416 1 . VAL 175 175 17416 1 . LEU 176 176 17416 1 . ALA 177 177 17416 1 . ARG 178 178 17416 1 . THR 179 179 17416 1 . PHE 180 180 17416 1 . ALA 181 181 17416 1 . PHE 182 182 17416 1 . ASP 183 183 17416 1 . TRP 184 184 17416 1 . GLU 185 185 17416 1 . ILE 186 186 17416 1 . GLU 187 187 17416 1 . HIS 188 188 17416 1 . ILE 189 189 17416 1 . LYS 190 190 17416 1 . LYS 191 191 17416 1 . VAL 192 192 17416 1 . GLY 193 193 17416 1 . LEU 194 194 17416 1 . GLY 195 195 17416 1 . LYS 196 196 17416 1 . GLY 197 197 17416 1 . GLY 198 198 17416 1 . SER 199 199 17416 1 . LEU 200 200 17416 1 . LYS 201 201 17416 1 . ASN 202 202 17416 1 . THR 203 203 17416 1 . LEU 204 204 17416 1 . VAL 205 205 17416 1 . LEU 206 206 17416 1 . GLY 207 207 17416 1 . LYS 208 208 17416 1 . ASP 209 209 17416 1 . LYS 210 210 17416 1 . VAL 211 211 17416 1 . TYR 212 212 17416 1 . ASN 213 213 17416 1 . PRO 214 214 17416 1 . GLU 215 215 17416 1 . GLY 216 216 17416 1 . LEU 217 217 17416 1 . ARG 218 218 17416 1 . TYR 219 219 17416 1 . GLU 220 220 17416 1 . ASN 221 221 17416 1 . GLU 222 222 17416 1 . PRO 223 223 17416 1 . VAL 224 224 17416 1 . ARG 225 225 17416 1 . HIS 226 226 17416 1 . LYS 227 227 17416 1 . VAL 228 228 17416 1 . PHE 229 229 17416 1 . ASP 230 230 17416 1 . LEU 231 231 17416 1 . ILE 232 232 17416 1 . GLY 233 233 17416 1 . ASP 234 234 17416 1 . LEU 235 235 17416 1 . TYR 236 236 17416 1 . LEU 237 237 17416 1 . LEU 238 238 17416 1 . GLY 239 239 17416 1 . SER 240 240 17416 1 . PRO 241 241 17416 1 . VAL 242 242 17416 1 . LYS 243 243 17416 1 . GLY 244 244 17416 1 . LYS 245 245 17416 1 . PHE 246 246 17416 1 . TYR 247 247 17416 1 . SER 248 248 17416 1 . PHE 249 249 17416 1 . ARG 250 250 17416 1 . GLY 251 251 17416 1 . GLY 252 252 17416 1 . HIS 253 253 17416 1 . SER 254 254 17416 1 . LEU 255 255 17416 1 . ASN 256 256 17416 1 . VAL 257 257 17416 1 . LYS 258 258 17416 1 . LEU 259 259 17416 1 . VAL 260 260 17416 1 . LYS 261 261 17416 1 . GLU 262 262 17416 1 . LEU 263 263 17416 1 . ALA 264 264 17416 1 . LYS 265 265 17416 1 . LYS 266 266 17416 1 . GLN 267 267 17416 1 . LYS 268 268 17416 1 . LEU 269 269 17416 1 . THR 270 270 17416 1 . ARG 271 271 17416 1 . ASP 272 272 17416 1 . LEU 273 273 17416 1 . PRO 274 274 17416 1 stop_ save_ save_C90 _Entity.Sf_category entity _Entity.Sf_framecode C90 _Entity.Entry_ID 17416 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name C90 _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _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 . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID C90 _Entity.Nonpolymer_comp_label $chem_comp_C90 _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . C90 . 17416 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 17416 _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 $AaLpxC . 63363 organism . 'Aquifex aeolicus' 'Aquifex aeolicus' . . Bacteria . Aquifex aeolicus . . . . . . . . . . . . . . . . . . . . . 17416 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 17416 _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 $AaLpxC . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET21a . . . . . . 17416 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_C90 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_C90 _Chem_comp.Entry_ID 17416 _Chem_comp.ID C90 _Chem_comp.Provenance . _Chem_comp.Name N-{(1S,2R)-2-hydroxy-1-[(hydroxyamino)carbonyl]propyl}-4-{[4-(morpholin-4-ylmethyl)phenyl]ethynyl}benzamide _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code C90 _Chem_comp.Ambiguous_flag . _Chem_comp.Initial_date 2007-08-16 _Chem_comp.Modified_date 2008-10-14 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code C90 _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic no _Chem_comp.Aromatic yes _Chem_comp.Formula 'C24 H27 N3 O5' _Chem_comp.Formula_weight 437.488 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 2JT2 _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Thu Jan 20 13:37:29 2011 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID CC(C(C(=O)NO)NC(=O)c1ccc(cc1)C#Cc2ccc(cc2)CN3CCOCC3)O SMILES 'OpenEye OEToolkits' 1.5.0 17416 C90 C[C@H]([C@@H](C(=O)NO)NC(=O)c1ccc(cc1)C#Cc2ccc(cc2)CN3CCOCC3)O SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 17416 C90 C[C@@H](O)[C@H](NC(=O)c1ccc(cc1)C#Cc2ccc(CN3CCOCC3)cc2)C(=O)NO SMILES_CANONICAL CACTVS 3.341 17416 C90 C[CH](O)[CH](NC(=O)c1ccc(cc1)C#Cc2ccc(CN3CCOCC3)cc2)C(=O)NO SMILES CACTVS 3.341 17416 C90 FQYBTYFKOHPWQT-XYZKCQMDDY InChIKey InChI 1.02b 17416 C90 InChI=1/C24H27N3O5/c1-17(28)22(24(30)26-31)25-23(29)21-10-8-19(9-11-21)3-2-18-4-6-20(7-5-18)16-27-12-14-32-15-13-27/h4-11,17,22,28,31H,12-16H2,1H3,(H,25,29)(H,26,30)/t17-,22+/m1/s1/f/h25-26H InChI InChI 1.02b 17416 C90 O=C(NO)C(NC(=O)c3ccc(C#Cc1ccc(cc1)CN2CCOCC2)cc3)C(O)C SMILES ACDLabs 10.04 17416 C90 stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID N-[(1S,2R)-2-hydroxy-1-(hydroxycarbamoyl)propyl]-4-{[4-(morpholin-4-ylmethyl)phenyl]ethynyl}benzamide 'SYSTEMATIC NAME' ACDLabs 10.04 17416 C90 N-[(2S,3R)-3-hydroxy-1-(hydroxyamino)-1-oxo-butan-2-yl]-4-[2-[4-(morpholin-4-ylmethyl)phenyl]ethynyl]benzamide 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 17416 C90 stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID C5 . C5 . . C . . N 0 . . . . no no . . . . -15.851 . 15.485 . -2.778 . -7.638 0.343 -1.275 1 . 17416 C90 C6 . C6 . . C . . N 0 . . . . yes no . . . . -14.945 . 14.380 . -2.277 . -6.144 0.433 -1.093 2 . 17416 C90 C9 . C9 . . C . . N 0 . . . . yes no . . . . -13.272 . 12.330 . -1.357 . -3.400 0.598 -0.760 3 . 17416 C90 C10 . C10 . . C . . N 0 . . . . no no . . . . -12.430 . 11.272 . -0.890 . -1.981 0.683 -0.587 4 . 17416 C90 O1 . O1 . . O . . N 0 . . . . no no . . . . -19.687 . 14.678 . -2.265 . -9.910 -1.695 1.591 5 . 17416 C90 C11 . C11 . . C . . N 0 . . . . no no . . . . -11.716 . 10.355 . -0.491 . -0.818 0.753 -0.445 6 . 17416 C90 C12 . C12 . . C . . N 0 . . . . yes no . . . . -10.901 . 9.277 . -0.025 . 0.601 0.839 -0.272 7 . 17416 C90 C19 . C19 . . C . . R 0 . . . . no no . . . . -8.135 . 2.768 . 1.142 . 7.382 -0.162 1.633 8 . 17416 C90 C15 . C15 . . C . . N 0 . . . . yes no . . . . -9.332 . 7.159 . 0.914 . 3.341 1.004 0.061 9 . 17416 C90 C16 . C16 . . C . . N 0 . . . . no no . . . . -8.560 . 6.104 . 1.404 . 4.804 1.092 0.239 10 . 17416 C90 C18 . C18 . . C . . S 0 . . . . no no . . . . -7.306 . 4.052 . 1.138 . 7.030 0.105 0.168 11 . 17416 C90 C21 . C21 . . C . . N 0 . . . . no no . . . . -8.404 . 2.326 . -0.300 . 6.600 0.799 2.529 12 . 17416 C90 C22 . C22 . . C . . N 0 . . . . no no . . . . -6.071 . 3.865 . 0.260 . 7.705 -0.920 -0.706 13 . 17416 C90 CA1 . CA1 . . C . . N 0 . . . . no no . . . . -19.055 . 14.829 . -0.979 . -8.491 -1.855 1.663 14 . 17416 C90 CA2 . CA2 . . C . . N 0 . . . . no no . . . . -19.086 . 13.630 . -3.049 . -10.324 -0.364 1.269 15 . 17416 C90 CB1 . CB1 . . C . . N 0 . . . . no no . . . . -17.552 . 15.052 . -1.154 . -7.871 -1.467 0.317 16 . 17416 C90 CB2 . CB2 . . C . . N 0 . . . . no no . . . . -17.586 . 13.889 . -3.215 . -9.723 0.038 -0.080 17 . 17416 C90 N4 . N4 . . N . . N 0 . . . . no no . . . . -17.248 . 15.143 . -2.569 . -8.259 -0.089 -0.016 18 . 17416 C90 CC1 . CC1 . . C . . N 0 . . . . yes no . . . . -14.508 . 14.376 . -0.946 . -5.352 -0.673 -1.349 19 . 17416 C90 CC2 . CC2 . . C . . N 0 . . . . yes no . . . . -14.542 . 13.359 . -3.146 . -5.572 1.622 -0.677 20 . 17416 C90 CD1 . CD1 . . C . . N 0 . . . . yes no . . . . -13.671 . 13.350 . -0.487 . -3.985 -0.598 -1.185 21 . 17416 C90 CD2 . CD2 . . C . . N 0 . . . . yes no . . . . -13.708 . 12.334 . -2.686 . -4.206 1.712 -0.508 22 . 17416 C90 CE1 . CE1 . . C . . N 0 . . . . yes no . . . . -10.932 . 8.035 . -0.677 . 1.407 -0.275 -0.535 23 . 17416 C90 CE2 . CE2 . . C . . N 0 . . . . yes no . . . . -10.084 . 9.455 . 1.096 . 1.184 2.038 0.154 24 . 17416 C90 CF1 . CF1 . . C . . N 0 . . . . yes no . . . . -10.145 . 6.977 . -0.209 . 2.760 -0.193 -0.370 25 . 17416 C90 CF . CF . . C . . N 0 . . . . yes no . . . . -9.304 . 8.396 . 1.565 . 2.537 2.119 0.319 26 . 17416 C90 O16 . O16 . . O . . N 0 . . . . no no . . . . -8.311 . 6.064 . 2.593 . 5.309 2.134 0.610 27 . 17416 C90 N17 . N17 . . N . . N 0 . . . . no no . . . . -8.121 . 5.175 . 0.596 . 5.578 0.018 -0.009 28 . 17416 C90 O20 . O20 . . O . . N 0 . . . . no no . . . . -7.425 . 1.748 . 1.830 . 7.041 -1.509 1.967 29 . 17416 C90 N23 . N23 . . N . . N 0 . . . . no no . . . . -4.915 . 3.734 . 0.850 . 9.049 -1.024 -0.708 30 . 17416 C90 O22 . O22 . . O . . N 0 . . . . no no . . . . -6.169 . 3.845 . -0.949 . 7.040 -1.652 -1.408 31 . 17416 C90 O24 . O24 . . O . . N 0 . . . . no no . . . . -3.823 . 3.577 . 0.123 . 9.684 -1.987 -1.530 32 . 17416 C90 H51 . H51 . . H . . N 0 . . . . no no . . . . -15.675 . 15.633 . -3.854 . -8.029 1.320 -1.557 33 . 17416 C90 H52 . H52 . . H . . N 0 . . . . no no . . . . -15.626 . 16.406 . -2.220 . -7.865 -0.380 -2.059 34 . 17416 C90 H19 . H19 . . H . . N 0 . . . . no no . . . . -9.093 . 2.952 . 1.650 . 8.451 -0.010 1.783 35 . 17416 C90 H18 . H18 . . H . . N 0 . . . . no no . . . . -6.997 . 4.282 . 2.168 . 7.371 1.102 -0.111 36 . 17416 C90 H211 . H211 . . H . . N 0 . . . . no no . . . . -8.468 . 3.211 . -0.949 . 6.851 0.609 3.573 37 . 17416 C90 H212 . H212 . . H . . N 0 . . . . no no . . . . -7.584 . 1.678 . -0.644 . 6.860 1.827 2.275 38 . 17416 C90 H213 . H213 . . H . . N 0 . . . . no no . . . . -9.353 . 1.771 . -0.342 . 5.531 0.647 2.379 39 . 17416 C90 HA11 . HA11 . . H . . N 0 . . . . no no . . . . -19.492 . 15.695 . -0.460 . -8.091 -1.212 2.447 40 . 17416 C90 HA12 . HA12 . . H . . N 0 . . . . no no . . . . -19.217 . 13.915 . -0.389 . -8.253 -2.894 1.888 41 . 17416 C90 HA21 . HA21 . . H . . N 0 . . . . no no . . . . -19.561 . 13.601 . -4.041 . -11.412 -0.326 1.208 42 . 17416 C90 HA22 . HA22 . . H . . N 0 . . . . no no . . . . -19.230 . 12.668 . -2.535 . -9.978 0.322 2.042 43 . 17416 C90 HB11 . HB11 . . H . . N 0 . . . . no no . . . . -17.000 . 14.210 . -0.711 . -6.785 -1.533 0.385 44 . 17416 C90 HB12 . HB12 . . H . . N 0 . . . . no no . . . . -17.254 . 15.984 . -0.650 . -8.229 -2.145 -0.457 45 . 17416 C90 HB21 . HB21 . . H . . N 0 . . . . no no . . . . -17.016 . 13.070 . -2.752 . -10.111 -0.615 -0.862 46 . 17416 C90 HB22 . HB22 . . H . . N 0 . . . . no no . . . . -17.335 . 13.943 . -4.285 . -9.988 1.072 -0.303 47 . 17416 C90 HC1 . HC1 . . H . . N 0 . . . . no no . . . . -14.816 . 15.163 . -0.274 . -5.806 -1.596 -1.677 48 . 17416 C90 HC2 . HC2 . . H . . N 0 . . . . no no . . . . -14.875 . 13.363 . -4.173 . -6.196 2.481 -0.484 49 . 17416 C90 HD1 . HD1 . . H . . N 0 . . . . no no . . . . -13.334 . 13.347 . 0.539 . -3.368 -1.462 -1.381 50 . 17416 C90 HD2 . HD2 . . H . . N 0 . . . . no no . . . . -13.401 . 11.546 . -3.357 . -3.761 2.640 -0.183 51 . 17416 C90 HE1 . HE1 . . H . . N 0 . . . . no no . . . . -11.564 . 7.895 . -1.541 . 0.958 -1.199 -0.867 52 . 17416 C90 HE2 . HE2 . . H . . N 0 . . . . no no . . . . -10.056 . 10.411 . 1.598 . 0.563 2.899 0.353 53 . 17416 C90 HF1 . HF1 . . H . . N 0 . . . . no no . . . . -10.165 . 6.022 . -0.714 . 3.382 -1.052 -0.573 54 . 17416 C90 HF . HF . . H . . N 0 . . . . no no . . . . -8.677 . 8.533 . 2.434 . 2.986 3.043 0.651 55 . 17416 C90 HN17 . HN17 . . H . . N 0 . . . . no no . . . . -8.331 . 5.218 . -0.381 . 5.175 -0.813 -0.304 56 . 17416 C90 HO20 . HO20 . . H . . N 0 . . . . no no . . . . -7.266 . 1.020 . 1.241 . 6.103 -1.716 1.856 57 . 17416 C90 HN23 . HN23 . . H . . N 0 . . . . no no . . . . -4.856 . 3.752 . 1.848 . 9.582 -0.439 -0.147 58 . 17416 C90 HO24 . HO24 . . H . . N 0 . . . . no no . . . . -4.057 . 3.539 . -0.797 . 10.648 -1.986 -1.463 59 . 17416 C90 stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING CB2 CA2 no N 1 . 17416 C90 2 . SING CB2 N4 no N 2 . 17416 C90 3 . DOUB CC2 CD2 no N 3 . 17416 C90 4 . SING CC2 C6 no N 4 . 17416 C90 5 . SING CA2 O1 yes N 5 . 17416 C90 6 . SING C5 N4 no N 6 . 17416 C90 7 . SING C5 C6 yes N 7 . 17416 C90 8 . SING CD2 C9 no N 8 . 17416 C90 9 . SING N4 CB1 no N 9 . 17416 C90 10 . DOUB C6 CC1 no N 10 . 17416 C90 11 . SING O1 CA1 yes N 11 . 17416 C90 12 . SING C9 C10 no N 12 . 17416 C90 13 . DOUB C9 CD1 no N 13 . 17416 C90 14 . SING CB1 CA1 no N 14 . 17416 C90 15 . DOUB O22 C22 yes N 15 . 17416 C90 16 . SING CC1 CD1 no N 16 . 17416 C90 17 . TRIP C10 C11 no N 17 . 17416 C90 18 . DOUB CE1 CF1 no N 18 . 17416 C90 19 . SING CE1 C12 no N 19 . 17416 C90 20 . SING C11 C12 no N 20 . 17416 C90 21 . SING C21 C19 no N 21 . 17416 C90 22 . SING CF1 C15 no N 22 . 17416 C90 23 . DOUB C12 CE2 no N 23 . 17416 C90 24 . SING O24 N23 no N 24 . 17416 C90 25 . SING C22 N23 no N 25 . 17416 C90 26 . SING C22 C18 no N 26 . 17416 C90 27 . SING N17 C18 no N 27 . 17416 C90 28 . SING N17 C16 no N 28 . 17416 C90 29 . SING C15 C16 no N 29 . 17416 C90 30 . DOUB C15 CF no N 30 . 17416 C90 31 . SING CE2 CF no N 31 . 17416 C90 32 . SING C18 C19 no N 32 . 17416 C90 33 . SING C19 O20 no N 33 . 17416 C90 34 . DOUB C16 O16 no N 34 . 17416 C90 35 . SING C5 H51 no N 35 . 17416 C90 36 . SING C5 H52 no N 36 . 17416 C90 37 . SING C19 H19 no N 37 . 17416 C90 38 . SING C18 H18 yes N 38 . 17416 C90 39 . SING C21 H211 no N 39 . 17416 C90 40 . SING C21 H212 yes N 40 . 17416 C90 41 . SING C21 H213 yes N 41 . 17416 C90 42 . SING CA1 HA11 no N 42 . 17416 C90 43 . SING CA1 HA12 no N 43 . 17416 C90 44 . SING CA2 HA21 yes N 44 . 17416 C90 45 . SING CA2 HA22 no N 45 . 17416 C90 46 . SING CB1 HB11 yes N 46 . 17416 C90 47 . SING CB1 HB12 yes N 47 . 17416 C90 48 . SING CB2 HB21 no N 48 . 17416 C90 49 . SING CB2 HB22 yes N 49 . 17416 C90 50 . SING CC1 HC1 no N 50 . 17416 C90 51 . SING CC2 HC2 yes N 51 . 17416 C90 52 . SING CD1 HD1 no N 52 . 17416 C90 53 . SING CD2 HD2 no N 53 . 17416 C90 54 . SING CE1 HE1 no N 54 . 17416 C90 55 . SING CE2 HE2 no N 55 . 17416 C90 56 . SING CF1 HF1 no N 56 . 17416 C90 57 . SING CF HF no N 57 . 17416 C90 58 . SING N17 HN17 no N 58 . 17416 C90 59 . SING O20 HO20 no N 59 . 17416 C90 60 . SING N23 HN23 no N 60 . 17416 C90 61 . SING O24 HO24 no N 61 . 17416 C90 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17416 _Sample.ID 1 _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 AaLpxC '[U-100% 13C; U-100% 15N]' . . 1 $AaLpxC . . . 0.5 1 mM . . . . 17416 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17416 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17416 1 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 17416 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 17416 1 pH 6.5 . pH 17416 1 pressure 1 . atm 17416 1 temperature 313 . K 17416 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 17416 _Software.ID 1 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17416 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17416 1 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 17416 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17416 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 17416 _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 Varian INOVA . 800 . . . 17416 1 2 spectrometer_2 Varian INOVA . 600 . . . 17416 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 17416 _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 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17416 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17416 1 3 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17416 1 4 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17416 1 5 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17416 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 17416 _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 . indirect 0.251449530 . . . . . . . . . 17416 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17416 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 17416 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 17416 _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 '3D HNCA' . . . 17416 1 2 '3D HNCACB' . . . 17416 1 3 '3D HCCH-TOCSY' . . . 17416 1 4 '3D 1H-15N NOESY' . . . 17416 1 5 '3D 1H-13C NOESY' . . . 17416 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 MET HB2 H 1 1.392 0.020 . 2 . . . . 1 MET HB2 . 17416 1 2 . 1 1 2 2 GLY HA2 H 1 4.055 0.020 . 2 . . . . 2 GLY HA2 . 17416 1 3 . 1 1 2 2 GLY HA3 H 1 4.205 0.020 . 2 . . . . 2 GLY HA3 . 17416 1 4 . 1 1 2 2 GLY C C 13 175.415 0.400 . 1 . . . . 2 GLY C . 17416 1 5 . 1 1 2 2 GLY CA C 13 43.125 0.400 . 1 . . . . 2 GLY CA . 17416 1 6 . 1 1 3 3 LEU H H 1 8.550 0.020 . 1 . . . . 3 LEU H . 17416 1 7 . 1 1 3 3 LEU HA H 1 4.738 0.020 . 1 . . . . 3 LEU HA . 17416 1 8 . 1 1 3 3 LEU HB2 H 1 2.178 0.020 . 2 . . . . 3 LEU HB2 . 17416 1 9 . 1 1 3 3 LEU HB3 H 1 2.271 0.020 . 2 . . . . 3 LEU HB3 . 17416 1 10 . 1 1 3 3 LEU HD11 H 1 0.992 0.020 . 2 . . . . 3 LEU HD1 . 17416 1 11 . 1 1 3 3 LEU HD12 H 1 0.992 0.020 . 2 . . . . 3 LEU HD1 . 17416 1 12 . 1 1 3 3 LEU HD13 H 1 0.992 0.020 . 2 . . . . 3 LEU HD1 . 17416 1 13 . 1 1 3 3 LEU HD21 H 1 0.798 0.020 . 2 . . . . 3 LEU HD2 . 17416 1 14 . 1 1 3 3 LEU HD22 H 1 0.798 0.020 . 2 . . . . 3 LEU HD2 . 17416 1 15 . 1 1 3 3 LEU HD23 H 1 0.798 0.020 . 2 . . . . 3 LEU HD2 . 17416 1 16 . 1 1 3 3 LEU C C 13 177.302 0.400 . 1 . . . . 3 LEU C . 17416 1 17 . 1 1 3 3 LEU CA C 13 54.303 0.400 . 1 . . . . 3 LEU CA . 17416 1 18 . 1 1 3 3 LEU CD1 C 13 25.102 0.400 . 1 . . . . 3 LEU CD1 . 17416 1 19 . 1 1 3 3 LEU CD2 C 13 22.306 0.400 . 1 . . . . 3 LEU CD2 . 17416 1 20 . 1 1 3 3 LEU N N 15 121.601 0.400 . 1 . . . . 3 LEU N . 17416 1 21 . 1 1 4 4 GLU H H 1 8.924 0.020 . 1 . . . . 4 GLU H . 17416 1 22 . 1 1 4 4 GLU HA H 1 3.840 0.020 . 1 . . . . 4 GLU HA . 17416 1 23 . 1 1 4 4 GLU HB2 H 1 1.577 0.020 . 2 . . . . 4 GLU HB2 . 17416 1 24 . 1 1 4 4 GLU HB3 H 1 1.577 0.020 . 2 . . . . 4 GLU HB3 . 17416 1 25 . 1 1 4 4 GLU HG2 H 1 1.813 0.020 . 2 . . . . 4 GLU HG2 . 17416 1 26 . 1 1 4 4 GLU HG3 H 1 1.813 0.020 . 2 . . . . 4 GLU HG3 . 17416 1 27 . 1 1 4 4 GLU C C 13 174.378 0.400 . 1 . . . . 4 GLU C . 17416 1 28 . 1 1 4 4 GLU CA C 13 58.672 0.400 . 1 . . . . 4 GLU CA . 17416 1 29 . 1 1 4 4 GLU N N 15 120.108 0.400 . 1 . . . . 4 GLU N . 17416 1 30 . 1 1 5 5 LYS H H 1 7.545 0.020 . 1 . . . . 5 LYS H . 17416 1 31 . 1 1 5 5 LYS HA H 1 5.271 0.020 . 1 . . . . 5 LYS HA . 17416 1 32 . 1 1 5 5 LYS HB2 H 1 1.938 0.020 . 2 . . . . 5 LYS HB2 . 17416 1 33 . 1 1 5 5 LYS HB3 H 1 1.938 0.020 . 2 . . . . 5 LYS HB3 . 17416 1 34 . 1 1 5 5 LYS HG2 H 1 1.580 0.020 . 2 . . . . 5 LYS HG2 . 17416 1 35 . 1 1 5 5 LYS HG3 H 1 1.779 0.020 . 2 . . . . 5 LYS HG3 . 17416 1 36 . 1 1 5 5 LYS HE2 H 1 3.030 0.020 . 2 . . . . 5 LYS HE2 . 17416 1 37 . 1 1 5 5 LYS HE3 H 1 3.030 0.020 . 2 . . . . 5 LYS HE3 . 17416 1 38 . 1 1 5 5 LYS C C 13 176.037 0.400 . 1 . . . . 5 LYS C . 17416 1 39 . 1 1 5 5 LYS CA C 13 55.276 0.400 . 1 . . . . 5 LYS CA . 17416 1 40 . 1 1 5 5 LYS CB C 13 39.396 0.400 . 1 . . . . 5 LYS CB . 17416 1 41 . 1 1 5 5 LYS CG C 13 23.859 0.400 . 1 . . . . 5 LYS CG . 17416 1 42 . 1 1 5 5 LYS N N 15 115.923 0.400 . 1 . . . . 5 LYS N . 17416 1 43 . 1 1 6 6 THR H H 1 8.543 0.020 . 1 . . . . 6 THR H . 17416 1 44 . 1 1 6 6 THR HA H 1 4.761 0.020 . 1 . . . . 6 THR HA . 17416 1 45 . 1 1 6 6 THR HB H 1 4.390 0.020 . 1 . . . . 6 THR HB . 17416 1 46 . 1 1 6 6 THR HG1 H 1 6.712 0.020 . 1 . . . . 6 THR HG1 . 17416 1 47 . 1 1 6 6 THR HG21 H 1 1.326 0.020 . 1 . . . . 6 THR HG2 . 17416 1 48 . 1 1 6 6 THR HG22 H 1 1.326 0.020 . 1 . . . . 6 THR HG2 . 17416 1 49 . 1 1 6 6 THR HG23 H 1 1.326 0.020 . 1 . . . . 6 THR HG2 . 17416 1 50 . 1 1 6 6 THR C C 13 174.186 0.400 . 1 . . . . 6 THR C . 17416 1 51 . 1 1 6 6 THR CA C 13 58.382 0.400 . 1 . . . . 6 THR CA . 17416 1 52 . 1 1 6 6 THR CB C 13 72.067 0.400 . 1 . . . . 6 THR CB . 17416 1 53 . 1 1 6 6 THR CG2 C 13 17.986 0.400 . 1 . . . . 6 THR CG2 . 17416 1 54 . 1 1 6 6 THR N N 15 116.586 0.400 . 1 . . . . 6 THR N . 17416 1 55 . 1 1 7 7 VAL H H 1 8.193 0.020 . 1 . . . . 7 VAL H . 17416 1 56 . 1 1 7 7 VAL HA H 1 5.411 0.020 . 1 . . . . 7 VAL HA . 17416 1 57 . 1 1 7 7 VAL HB H 1 2.330 0.020 . 1 . . . . 7 VAL HB . 17416 1 58 . 1 1 7 7 VAL HG11 H 1 0.810 0.020 . 2 . . . . 7 VAL HG1 . 17416 1 59 . 1 1 7 7 VAL HG12 H 1 0.810 0.020 . 2 . . . . 7 VAL HG1 . 17416 1 60 . 1 1 7 7 VAL HG13 H 1 0.810 0.020 . 2 . . . . 7 VAL HG1 . 17416 1 61 . 1 1 7 7 VAL HG21 H 1 0.678 0.020 . 2 . . . . 7 VAL HG2 . 17416 1 62 . 1 1 7 7 VAL HG22 H 1 0.678 0.020 . 2 . . . . 7 VAL HG2 . 17416 1 63 . 1 1 7 7 VAL HG23 H 1 0.678 0.020 . 2 . . . . 7 VAL HG2 . 17416 1 64 . 1 1 7 7 VAL C C 13 176.546 0.400 . 1 . . . . 7 VAL C . 17416 1 65 . 1 1 7 7 VAL CA C 13 58.414 0.400 . 1 . . . . 7 VAL CA . 17416 1 66 . 1 1 7 7 VAL CB C 13 34.154 0.400 . 1 . . . . 7 VAL CB . 17416 1 67 . 1 1 7 7 VAL CG1 C 13 22.302 0.400 . 1 . . . . 7 VAL CG1 . 17416 1 68 . 1 1 7 7 VAL CG2 C 13 18.233 0.400 . 1 . . . . 7 VAL CG2 . 17416 1 69 . 1 1 7 7 VAL N N 15 110.926 0.400 . 1 . . . . 7 VAL N . 17416 1 70 . 1 1 8 8 LYS H H 1 8.592 0.020 . 1 . . . . 8 LYS H . 17416 1 71 . 1 1 8 8 LYS HA H 1 3.973 0.020 . 1 . . . . 8 LYS HA . 17416 1 72 . 1 1 8 8 LYS HB2 H 1 1.802 0.020 . 2 . . . . 8 LYS HB2 . 17416 1 73 . 1 1 8 8 LYS HB3 H 1 1.802 0.020 . 2 . . . . 8 LYS HB3 . 17416 1 74 . 1 1 8 8 LYS HG2 H 1 1.391 0.020 . 2 . . . . 8 LYS HG2 . 17416 1 75 . 1 1 8 8 LYS HG3 H 1 1.481 0.020 . 2 . . . . 8 LYS HG3 . 17416 1 76 . 1 1 8 8 LYS HD2 H 1 1.743 0.020 . 2 . . . . 8 LYS HD2 . 17416 1 77 . 1 1 8 8 LYS HD3 H 1 1.743 0.020 . 2 . . . . 8 LYS HD3 . 17416 1 78 . 1 1 8 8 LYS HE2 H 1 3.080 0.020 . 2 . . . . 8 LYS HE2 . 17416 1 79 . 1 1 8 8 LYS HE3 H 1 3.080 0.020 . 2 . . . . 8 LYS HE3 . 17416 1 80 . 1 1 8 8 LYS C C 13 175.548 0.400 . 1 . . . . 8 LYS C . 17416 1 81 . 1 1 8 8 LYS CA C 13 58.101 0.400 . 1 . . . . 8 LYS CA . 17416 1 82 . 1 1 8 8 LYS CB C 13 33.884 0.400 . 1 . . . . 8 LYS CB . 17416 1 83 . 1 1 8 8 LYS CG C 13 25.384 0.400 . 1 . . . . 8 LYS CG . 17416 1 84 . 1 1 8 8 LYS CD C 13 29.690 0.400 . 1 . . . . 8 LYS CD . 17416 1 85 . 1 1 8 8 LYS CE C 13 41.609 0.400 . 1 . . . . 8 LYS CE . 17416 1 86 . 1 1 8 8 LYS N N 15 117.919 0.400 . 1 . . . . 8 LYS N . 17416 1 87 . 1 1 9 9 GLU H H 1 7.502 0.020 . 1 . . . . 9 GLU H . 17416 1 88 . 1 1 9 9 GLU HA H 1 4.491 0.020 . 1 . . . . 9 GLU HA . 17416 1 89 . 1 1 9 9 GLU HB2 H 1 1.867 0.020 . 2 . . . . 9 GLU HB2 . 17416 1 90 . 1 1 9 9 GLU HB3 H 1 1.867 0.020 . 2 . . . . 9 GLU HB3 . 17416 1 91 . 1 1 9 9 GLU HG2 H 1 2.093 0.020 . 2 . . . . 9 GLU HG2 . 17416 1 92 . 1 1 9 9 GLU HG3 H 1 2.093 0.020 . 2 . . . . 9 GLU HG3 . 17416 1 93 . 1 1 9 9 GLU C C 13 173.214 0.400 . 1 . . . . 9 GLU C . 17416 1 94 . 1 1 9 9 GLU CA C 13 53.330 0.400 . 1 . . . . 9 GLU CA . 17416 1 95 . 1 1 9 9 GLU CB C 13 32.703 0.400 . 1 . . . . 9 GLU CB . 17416 1 96 . 1 1 9 9 GLU CG C 13 35.043 0.400 . 1 . . . . 9 GLU CG . 17416 1 97 . 1 1 9 9 GLU N N 15 113.635 0.400 . 1 . . . . 9 GLU N . 17416 1 98 . 1 1 10 10 LYS H H 1 8.080 0.020 . 1 . . . . 10 LYS H . 17416 1 99 . 1 1 10 10 LYS HA H 1 4.835 0.020 . 1 . . . . 10 LYS HA . 17416 1 100 . 1 1 10 10 LYS HB2 H 1 1.437 0.020 . 2 . . . . 10 LYS HB2 . 17416 1 101 . 1 1 10 10 LYS HB3 H 1 1.594 0.020 . 2 . . . . 10 LYS HB3 . 17416 1 102 . 1 1 10 10 LYS HG2 H 1 1.320 0.020 . 2 . . . . 10 LYS HG2 . 17416 1 103 . 1 1 10 10 LYS HG3 H 1 1.403 0.020 . 2 . . . . 10 LYS HG3 . 17416 1 104 . 1 1 10 10 LYS HD2 H 1 1.708 0.020 . 2 . . . . 10 LYS HD2 . 17416 1 105 . 1 1 10 10 LYS HD3 H 1 1.531 0.020 . 2 . . . . 10 LYS HD3 . 17416 1 106 . 1 1 10 10 LYS HE2 H 1 2.981 0.020 . 2 . . . . 10 LYS HE2 . 17416 1 107 . 1 1 10 10 LYS HE3 H 1 2.981 0.020 . 2 . . . . 10 LYS HE3 . 17416 1 108 . 1 1 10 10 LYS C C 13 176.812 0.400 . 1 . . . . 10 LYS C . 17416 1 109 . 1 1 10 10 LYS CA C 13 56.492 0.400 . 1 . . . . 10 LYS CA . 17416 1 110 . 1 1 10 10 LYS CB C 13 32.821 0.400 . 1 . . . . 10 LYS CB . 17416 1 111 . 1 1 10 10 LYS CG C 13 24.513 0.400 . 1 . . . . 10 LYS CG . 17416 1 112 . 1 1 10 10 LYS CD C 13 29.453 0.400 . 1 . . . . 10 LYS CD . 17416 1 113 . 1 1 10 10 LYS CE C 13 41.324 0.400 . 1 . . . . 10 LYS CE . 17416 1 114 . 1 1 10 10 LYS N N 15 116.868 0.400 . 1 . . . . 10 LYS N . 17416 1 115 . 1 1 11 11 LEU H H 1 7.975 0.020 . 1 . . . . 11 LEU H . 17416 1 116 . 1 1 11 11 LEU HA H 1 4.674 0.020 . 1 . . . . 11 LEU HA . 17416 1 117 . 1 1 11 11 LEU HB2 H 1 1.560 0.020 . 2 . . . . 11 LEU HB2 . 17416 1 118 . 1 1 11 11 LEU HB3 H 1 1.384 0.020 . 2 . . . . 11 LEU HB3 . 17416 1 119 . 1 1 11 11 LEU HG H 1 1.875 0.020 . 1 . . . . 11 LEU HG . 17416 1 120 . 1 1 11 11 LEU HD11 H 1 0.898 0.020 . 2 . . . . 11 LEU HD1 . 17416 1 121 . 1 1 11 11 LEU HD12 H 1 0.898 0.020 . 2 . . . . 11 LEU HD1 . 17416 1 122 . 1 1 11 11 LEU HD13 H 1 0.898 0.020 . 2 . . . . 11 LEU HD1 . 17416 1 123 . 1 1 11 11 LEU HD21 H 1 0.792 0.020 . 2 . . . . 11 LEU HD2 . 17416 1 124 . 1 1 11 11 LEU HD22 H 1 0.792 0.020 . 2 . . . . 11 LEU HD2 . 17416 1 125 . 1 1 11 11 LEU HD23 H 1 0.792 0.020 . 2 . . . . 11 LEU HD2 . 17416 1 126 . 1 1 11 11 LEU C C 13 175.353 0.400 . 1 . . . . 11 LEU C . 17416 1 127 . 1 1 11 11 LEU CA C 13 53.081 0.400 . 1 . . . . 11 LEU CA . 17416 1 128 . 1 1 11 11 LEU CB C 13 45.915 0.400 . 1 . . . . 11 LEU CB . 17416 1 129 . 1 1 11 11 LEU CG C 13 26.234 0.400 . 1 . . . . 11 LEU CG . 17416 1 130 . 1 1 11 11 LEU CD1 C 13 27.304 0.400 . 1 . . . . 11 LEU CD1 . 17416 1 131 . 1 1 11 11 LEU CD2 C 13 23.856 0.400 . 1 . . . . 11 LEU CD2 . 17416 1 132 . 1 1 11 11 LEU N N 15 122.683 0.400 . 1 . . . . 11 LEU N . 17416 1 133 . 1 1 12 12 SER H H 1 8.102 0.020 . 1 . . . . 12 SER H . 17416 1 134 . 1 1 12 12 SER HA H 1 5.592 0.020 . 1 . . . . 12 SER HA . 17416 1 135 . 1 1 12 12 SER HB2 H 1 3.646 0.020 . 2 . . . . 12 SER HB2 . 17416 1 136 . 1 1 12 12 SER HB3 H 1 3.646 0.020 . 2 . . . . 12 SER HB3 . 17416 1 137 . 1 1 12 12 SER C C 13 172.821 0.400 . 1 . . . . 12 SER C . 17416 1 138 . 1 1 12 12 SER CA C 13 56.488 0.400 . 1 . . . . 12 SER CA . 17416 1 139 . 1 1 12 12 SER CB C 13 65.815 0.400 . 1 . . . . 12 SER CB . 17416 1 140 . 1 1 12 12 SER N N 15 115.533 0.400 . 1 . . . . 12 SER N . 17416 1 141 . 1 1 13 13 PHE H H 1 8.750 0.020 . 1 . . . . 13 PHE H . 17416 1 142 . 1 1 13 13 PHE HA H 1 4.906 0.020 . 1 . . . . 13 PHE HA . 17416 1 143 . 1 1 13 13 PHE HB2 H 1 2.670 0.020 . 2 . . . . 13 PHE HB2 . 17416 1 144 . 1 1 13 13 PHE HB3 H 1 3.122 0.020 . 2 . . . . 13 PHE HB3 . 17416 1 145 . 1 1 13 13 PHE HD1 H 1 7.192 0.020 . 1 . . . . 13 PHE HD1 . 17416 1 146 . 1 1 13 13 PHE HD2 H 1 7.192 0.020 . 1 . . . . 13 PHE HD2 . 17416 1 147 . 1 1 13 13 PHE HE1 H 1 7.172 0.020 . 1 . . . . 13 PHE HE1 . 17416 1 148 . 1 1 13 13 PHE HE2 H 1 7.172 0.020 . 1 . . . . 13 PHE HE2 . 17416 1 149 . 1 1 13 13 PHE HZ H 1 7.302 0.020 . 1 . . . . 13 PHE HZ . 17416 1 150 . 1 1 13 13 PHE C C 13 174.086 0.400 . 1 . . . . 13 PHE C . 17416 1 151 . 1 1 13 13 PHE CA C 13 56.499 0.400 . 1 . . . . 13 PHE CA . 17416 1 152 . 1 1 13 13 PHE CB C 13 44.100 0.400 . 1 . . . . 13 PHE CB . 17416 1 153 . 1 1 13 13 PHE N N 15 118.750 0.400 . 1 . . . . 13 PHE N . 17416 1 154 . 1 1 14 14 GLU H H 1 8.845 0.020 . 1 . . . . 14 GLU H . 17416 1 155 . 1 1 14 14 GLU HA H 1 5.349 0.020 . 1 . . . . 14 GLU HA . 17416 1 156 . 1 1 14 14 GLU HB2 H 1 2.258 0.020 . 2 . . . . 14 GLU HB2 . 17416 1 157 . 1 1 14 14 GLU HB3 H 1 2.258 0.020 . 2 . . . . 14 GLU HB3 . 17416 1 158 . 1 1 14 14 GLU HG2 H 1 2.233 0.020 . 2 . . . . 14 GLU HG2 . 17416 1 159 . 1 1 14 14 GLU HG3 H 1 2.114 0.020 . 2 . . . . 14 GLU HG3 . 17416 1 160 . 1 1 14 14 GLU C C 13 173.696 0.400 . 1 . . . . 14 GLU C . 17416 1 161 . 1 1 14 14 GLU CA C 13 54.666 0.400 . 1 . . . . 14 GLU CA . 17416 1 162 . 1 1 14 14 GLU CB C 13 35.053 0.400 . 1 . . . . 14 GLU CB . 17416 1 163 . 1 1 14 14 GLU CG C 13 33.425 0.400 . 1 . . . . 14 GLU CG . 17416 1 164 . 1 1 14 14 GLU N N 15 117.540 0.400 . 1 . . . . 14 GLU N . 17416 1 165 . 1 1 15 15 GLY H H 1 8.107 0.020 . 1 . . . . 15 GLY H . 17416 1 166 . 1 1 15 15 GLY HA2 H 1 3.863 0.020 . 2 . . . . 15 GLY HA2 . 17416 1 167 . 1 1 15 15 GLY HA3 H 1 4.477 0.020 . 2 . . . . 15 GLY HA3 . 17416 1 168 . 1 1 15 15 GLY C C 13 171.645 0.400 . 1 . . . . 15 GLY C . 17416 1 169 . 1 1 15 15 GLY CA C 13 45.017 0.400 . 1 . . . . 15 GLY CA . 17416 1 170 . 1 1 15 15 GLY N N 15 105.667 0.400 . 1 . . . . 15 GLY N . 17416 1 171 . 1 1 16 16 VAL H H 1 8.347 0.020 . 1 . . . . 16 VAL H . 17416 1 172 . 1 1 16 16 VAL HA H 1 4.554 0.020 . 1 . . . . 16 VAL HA . 17416 1 173 . 1 1 16 16 VAL HB H 1 1.735 0.020 . 1 . . . . 16 VAL HB . 17416 1 174 . 1 1 16 16 VAL HG11 H 1 0.755 0.020 . 2 . . . . 16 VAL HG1 . 17416 1 175 . 1 1 16 16 VAL HG12 H 1 0.755 0.020 . 2 . . . . 16 VAL HG1 . 17416 1 176 . 1 1 16 16 VAL HG13 H 1 0.755 0.020 . 2 . . . . 16 VAL HG1 . 17416 1 177 . 1 1 16 16 VAL HG21 H 1 0.740 0.020 . 2 . . . . 16 VAL HG2 . 17416 1 178 . 1 1 16 16 VAL HG22 H 1 0.740 0.020 . 2 . . . . 16 VAL HG2 . 17416 1 179 . 1 1 16 16 VAL HG23 H 1 0.740 0.020 . 2 . . . . 16 VAL HG2 . 17416 1 180 . 1 1 16 16 VAL C C 13 176.521 0.400 . 1 . . . . 16 VAL C . 17416 1 181 . 1 1 16 16 VAL CA C 13 60.257 0.400 . 1 . . . . 16 VAL CA . 17416 1 182 . 1 1 16 16 VAL CB C 13 33.605 0.400 . 1 . . . . 16 VAL CB . 17416 1 183 . 1 1 16 16 VAL CG1 C 13 20.163 0.400 . 1 . . . . 16 VAL CG1 . 17416 1 184 . 1 1 16 16 VAL CG2 C 13 20.441 0.400 . 1 . . . . 16 VAL CG2 . 17416 1 185 . 1 1 16 16 VAL N N 15 117.803 0.400 . 1 . . . . 16 VAL N . 17416 1 186 . 1 1 17 17 GLY H H 1 8.171 0.020 . 1 . . . . 17 GLY H . 17416 1 187 . 1 1 17 17 GLY HA2 H 1 3.458 0.020 . 2 . . . . 17 GLY HA2 . 17416 1 188 . 1 1 17 17 GLY HA3 H 1 4.145 0.020 . 2 . . . . 17 GLY HA3 . 17416 1 189 . 1 1 17 17 GLY C C 13 174.770 0.400 . 1 . . . . 17 GLY C . 17416 1 190 . 1 1 17 17 GLY CA C 13 44.094 0.400 . 1 . . . . 17 GLY CA . 17416 1 191 . 1 1 17 17 GLY N N 15 111.206 0.400 . 1 . . . . 17 GLY N . 17416 1 192 . 1 1 18 18 ILE H H 1 8.580 0.020 . 1 . . . . 18 ILE H . 17416 1 193 . 1 1 18 18 ILE HA H 1 3.361 0.020 . 1 . . . . 18 ILE HA . 17416 1 194 . 1 1 18 18 ILE HB H 1 1.200 0.020 . 1 . . . . 18 ILE HB . 17416 1 195 . 1 1 18 18 ILE HG12 H 1 0.522 0.020 . 2 . . . . 18 ILE HG12 . 17416 1 196 . 1 1 18 18 ILE HG13 H 1 0.522 0.020 . 2 . . . . 18 ILE HG13 . 17416 1 197 . 1 1 18 18 ILE HG21 H 1 -0.019 0.020 . 1 . . . . 18 ILE HG2 . 17416 1 198 . 1 1 18 18 ILE HG22 H 1 -0.019 0.020 . 1 . . . . 18 ILE HG2 . 17416 1 199 . 1 1 18 18 ILE HG23 H 1 -0.019 0.020 . 1 . . . . 18 ILE HG2 . 17416 1 200 . 1 1 18 18 ILE HD11 H 1 0.539 0.020 . 1 . . . . 18 ILE HD1 . 17416 1 201 . 1 1 18 18 ILE HD12 H 1 0.539 0.020 . 1 . . . . 18 ILE HD1 . 17416 1 202 . 1 1 18 18 ILE HD13 H 1 0.539 0.020 . 1 . . . . 18 ILE HD1 . 17416 1 203 . 1 1 18 18 ILE C C 13 174.768 0.400 . 1 . . . . 18 ILE C . 17416 1 204 . 1 1 18 18 ILE CA C 13 63.642 0.400 . 1 . . . . 18 ILE CA . 17416 1 205 . 1 1 18 18 ILE CB C 13 36.587 0.400 . 1 . . . . 18 ILE CB . 17416 1 206 . 1 1 18 18 ILE CG1 C 13 30.074 0.400 . 1 . . . . 18 ILE CG1 . 17416 1 207 . 1 1 18 18 ILE CG2 C 13 15.446 0.400 . 1 . . . . 18 ILE CG2 . 17416 1 208 . 1 1 18 18 ILE CD1 C 13 14.236 0.400 . 1 . . . . 18 ILE CD1 . 17416 1 209 . 1 1 18 18 ILE N N 15 126.865 0.400 . 1 . . . . 18 ILE N . 17416 1 210 . 1 1 19 19 HIS H H 1 9.714 0.020 . 1 . . . . 19 HIS H . 17416 1 211 . 1 1 19 19 HIS HA H 1 4.923 0.020 . 1 . . . . 19 HIS HA . 17416 1 212 . 1 1 19 19 HIS HB2 H 1 2.833 0.020 . 2 . . . . 19 HIS HB2 . 17416 1 213 . 1 1 19 19 HIS HB3 H 1 2.872 0.020 . 2 . . . . 19 HIS HB3 . 17416 1 214 . 1 1 19 19 HIS HD2 H 1 7.024 0.020 . 1 . . . . 19 HIS HD2 . 17416 1 215 . 1 1 19 19 HIS HE1 H 1 7.127 0.020 . 1 . . . . 19 HIS HE1 . 17416 1 216 . 1 1 19 19 HIS C C 13 179.348 0.400 . 1 . . . . 19 HIS C . 17416 1 217 . 1 1 19 19 HIS CA C 13 59.305 0.400 . 1 . . . . 19 HIS CA . 17416 1 218 . 1 1 19 19 HIS CB C 13 31.936 0.400 . 1 . . . . 19 HIS CB . 17416 1 219 . 1 1 19 19 HIS N N 15 123.866 0.400 . 1 . . . . 19 HIS N . 17416 1 220 . 1 1 20 20 THR H H 1 10.550 0.020 . 1 . . . . 20 THR H . 17416 1 221 . 1 1 20 20 THR HA H 1 4.078 0.020 . 1 . . . . 20 THR HA . 17416 1 222 . 1 1 20 20 THR HB H 1 4.087 0.020 . 1 . . . . 20 THR HB . 17416 1 223 . 1 1 20 20 THR HG1 H 1 5.582 0.020 . 1 . . . . 20 THR HG1 . 17416 1 224 . 1 1 20 20 THR HG21 H 1 1.196 0.020 . 1 . . . . 20 THR HG2 . 17416 1 225 . 1 1 20 20 THR HG22 H 1 1.196 0.020 . 1 . . . . 20 THR HG2 . 17416 1 226 . 1 1 20 20 THR HG23 H 1 1.196 0.020 . 1 . . . . 20 THR HG2 . 17416 1 227 . 1 1 20 20 THR C C 13 178.080 0.400 . 1 . . . . 20 THR C . 17416 1 228 . 1 1 20 20 THR CA C 13 63.322 0.400 . 1 . . . . 20 THR CA . 17416 1 229 . 1 1 20 20 THR CB C 13 70.827 0.400 . 1 . . . . 20 THR CB . 17416 1 230 . 1 1 20 20 THR CG2 C 13 21.973 0.400 . 1 . . . . 20 THR CG2 . 17416 1 231 . 1 1 20 20 THR N N 15 111.757 0.400 . 1 . . . . 20 THR N . 17416 1 232 . 1 1 21 21 GLY H H 1 7.662 0.020 . 1 . . . . 21 GLY H . 17416 1 233 . 1 1 21 21 GLY HA2 H 1 3.532 0.020 . 2 . . . . 21 GLY HA2 . 17416 1 234 . 1 1 21 21 GLY HA3 H 1 3.289 0.020 . 2 . . . . 21 GLY HA3 . 17416 1 235 . 1 1 21 21 GLY C C 13 172.626 0.400 . 1 . . . . 21 GLY C . 17416 1 236 . 1 1 21 21 GLY CA C 13 45.622 0.400 . 1 . . . . 21 GLY CA . 17416 1 237 . 1 1 21 21 GLY N N 15 109.324 0.400 . 1 . . . . 21 GLY N . 17416 1 238 . 1 1 22 22 GLU H H 1 7.453 0.020 . 1 . . . . 22 GLU H . 17416 1 239 . 1 1 22 22 GLU HA H 1 4.473 0.020 . 1 . . . . 22 GLU HA . 17416 1 240 . 1 1 22 22 GLU HB2 H 1 1.924 0.020 . 2 . . . . 22 GLU HB2 . 17416 1 241 . 1 1 22 22 GLU HB3 H 1 1.924 0.020 . 2 . . . . 22 GLU HB3 . 17416 1 242 . 1 1 22 22 GLU HG2 H 1 2.113 0.020 . 2 . . . . 22 GLU HG2 . 17416 1 243 . 1 1 22 22 GLU HG3 H 1 2.290 0.020 . 2 . . . . 22 GLU HG3 . 17416 1 244 . 1 1 22 22 GLU C C 13 176.231 0.400 . 1 . . . . 22 GLU C . 17416 1 245 . 1 1 22 22 GLU CA C 13 54.225 0.400 . 1 . . . . 22 GLU CA . 17416 1 246 . 1 1 22 22 GLU CB C 13 32.249 0.400 . 1 . . . . 22 GLU CB . 17416 1 247 . 1 1 22 22 GLU CG C 13 36.240 0.400 . 1 . . . . 22 GLU CG . 17416 1 248 . 1 1 22 22 GLU N N 15 117.801 0.400 . 1 . . . . 22 GLU N . 17416 1 249 . 1 1 23 23 TYR H H 1 8.784 0.020 . 1 . . . . 23 TYR H . 17416 1 250 . 1 1 23 23 TYR HA H 1 4.370 0.020 . 1 . . . . 23 TYR HA . 17416 1 251 . 1 1 23 23 TYR HB2 H 1 2.880 0.020 . 2 . . . . 23 TYR HB2 . 17416 1 252 . 1 1 23 23 TYR HB3 H 1 3.029 0.020 . 2 . . . . 23 TYR HB3 . 17416 1 253 . 1 1 23 23 TYR HD1 H 1 7.021 0.020 . 1 . . . . 23 TYR HD1 . 17416 1 254 . 1 1 23 23 TYR HD2 H 1 7.021 0.020 . 1 . . . . 23 TYR HD2 . 17416 1 255 . 1 1 23 23 TYR HE1 H 1 6.737 0.020 . 1 . . . . 23 TYR HE1 . 17416 1 256 . 1 1 23 23 TYR HE2 H 1 6.737 0.020 . 1 . . . . 23 TYR HE2 . 17416 1 257 . 1 1 23 23 TYR C C 13 175.448 0.400 . 1 . . . . 23 TYR C . 17416 1 258 . 1 1 23 23 TYR CA C 13 59.301 0.400 . 1 . . . . 23 TYR CA . 17416 1 259 . 1 1 23 23 TYR CB C 13 38.773 0.400 . 1 . . . . 23 TYR CB . 17416 1 260 . 1 1 23 23 TYR N N 15 124.532 0.400 . 1 . . . . 23 TYR N . 17416 1 261 . 1 1 24 24 SER H H 1 8.280 0.020 . 1 . . . . 24 SER H . 17416 1 262 . 1 1 24 24 SER HA H 1 5.020 0.020 . 1 . . . . 24 SER HA . 17416 1 263 . 1 1 24 24 SER HB2 H 1 3.696 0.020 . 2 . . . . 24 SER HB2 . 17416 1 264 . 1 1 24 24 SER HB3 H 1 3.696 0.020 . 2 . . . . 24 SER HB3 . 17416 1 265 . 1 1 24 24 SER C C 13 171.163 0.400 . 1 . . . . 24 SER C . 17416 1 266 . 1 1 24 24 SER CA C 13 56.787 0.400 . 1 . . . . 24 SER CA . 17416 1 267 . 1 1 24 24 SER CB C 13 66.752 0.400 . 1 . . . . 24 SER CB . 17416 1 268 . 1 1 24 24 SER N N 15 123.349 0.400 . 1 . . . . 24 SER N . 17416 1 269 . 1 1 25 25 LYS H H 1 8.149 0.020 . 1 . . . . 25 LYS H . 17416 1 270 . 1 1 25 25 LYS HA H 1 5.080 0.020 . 1 . . . . 25 LYS HA . 17416 1 271 . 1 1 25 25 LYS HB2 H 1 1.891 0.020 . 2 . . . . 25 LYS HB2 . 17416 1 272 . 1 1 25 25 LYS HB3 H 1 1.891 0.020 . 2 . . . . 25 LYS HB3 . 17416 1 273 . 1 1 25 25 LYS HG2 H 1 1.325 0.020 . 2 . . . . 25 LYS HG2 . 17416 1 274 . 1 1 25 25 LYS HG3 H 1 1.523 0.020 . 2 . . . . 25 LYS HG3 . 17416 1 275 . 1 1 25 25 LYS HD2 H 1 1.731 0.020 . 2 . . . . 25 LYS HD2 . 17416 1 276 . 1 1 25 25 LYS HD3 H 1 1.731 0.020 . 2 . . . . 25 LYS HD3 . 17416 1 277 . 1 1 25 25 LYS HE2 H 1 2.911 0.020 . 2 . . . . 25 LYS HE2 . 17416 1 278 . 1 1 25 25 LYS HE3 H 1 2.911 0.020 . 2 . . . . 25 LYS HE3 . 17416 1 279 . 1 1 25 25 LYS C C 13 173.696 0.400 . 1 . . . . 25 LYS C . 17416 1 280 . 1 1 25 25 LYS CA C 13 54.394 0.400 . 1 . . . . 25 LYS CA . 17416 1 281 . 1 1 25 25 LYS CB C 13 36.228 0.400 . 1 . . . . 25 LYS CB . 17416 1 282 . 1 1 25 25 LYS CG C 13 25.454 0.400 . 1 . . . . 25 LYS CG . 17416 1 283 . 1 1 25 25 LYS CD C 13 29.669 0.400 . 1 . . . . 25 LYS CD . 17416 1 284 . 1 1 25 25 LYS CE C 13 41.895 0.400 . 1 . . . . 25 LYS CE . 17416 1 285 . 1 1 25 25 LYS N N 15 120.946 0.400 . 1 . . . . 25 LYS N . 17416 1 286 . 1 1 26 26 LEU H H 1 9.286 0.020 . 1 . . . . 26 LEU H . 17416 1 287 . 1 1 26 26 LEU HA H 1 5.768 0.020 . 1 . . . . 26 LEU HA . 17416 1 288 . 1 1 26 26 LEU HB2 H 1 1.706 0.020 . 2 . . . . 26 LEU HB2 . 17416 1 289 . 1 1 26 26 LEU HB3 H 1 1.759 0.020 . 2 . . . . 26 LEU HB3 . 17416 1 290 . 1 1 26 26 LEU HG H 1 1.678 0.020 . 1 . . . . 26 LEU HG . 17416 1 291 . 1 1 26 26 LEU HD11 H 1 1.011 0.020 . 2 . . . . 26 LEU HD1 . 17416 1 292 . 1 1 26 26 LEU HD12 H 1 1.011 0.020 . 2 . . . . 26 LEU HD1 . 17416 1 293 . 1 1 26 26 LEU HD13 H 1 1.011 0.020 . 2 . . . . 26 LEU HD1 . 17416 1 294 . 1 1 26 26 LEU HD21 H 1 1.034 0.020 . 2 . . . . 26 LEU HD2 . 17416 1 295 . 1 1 26 26 LEU HD22 H 1 1.034 0.020 . 2 . . . . 26 LEU HD2 . 17416 1 296 . 1 1 26 26 LEU HD23 H 1 1.034 0.020 . 2 . . . . 26 LEU HD2 . 17416 1 297 . 1 1 26 26 LEU C C 13 176.132 0.400 . 1 . . . . 26 LEU C . 17416 1 298 . 1 1 26 26 LEU CA C 13 52.732 0.400 . 1 . . . . 26 LEU CA . 17416 1 299 . 1 1 26 26 LEU CB C 13 46.852 0.400 . 1 . . . . 26 LEU CB . 17416 1 300 . 1 1 26 26 LEU CD1 C 13 26.688 0.400 . 1 . . . . 26 LEU CD1 . 17416 1 301 . 1 1 26 26 LEU CD2 C 13 27.512 0.400 . 1 . . . . 26 LEU CD2 . 17416 1 302 . 1 1 26 26 LEU N N 15 122.676 0.400 . 1 . . . . 26 LEU N . 17416 1 303 . 1 1 27 27 ILE H H 1 9.270 0.020 . 1 . . . . 27 ILE H . 17416 1 304 . 1 1 27 27 ILE HA H 1 4.843 0.020 . 1 . . . . 27 ILE HA . 17416 1 305 . 1 1 27 27 ILE HB H 1 1.760 0.020 . 1 . . . . 27 ILE HB . 17416 1 306 . 1 1 27 27 ILE HG12 H 1 1.051 0.020 . 2 . . . . 27 ILE HG12 . 17416 1 307 . 1 1 27 27 ILE HG13 H 1 1.430 0.020 . 2 . . . . 27 ILE HG13 . 17416 1 308 . 1 1 27 27 ILE HG21 H 1 0.275 0.020 . 1 . . . . 27 ILE HG2 . 17416 1 309 . 1 1 27 27 ILE HG22 H 1 0.275 0.020 . 1 . . . . 27 ILE HG2 . 17416 1 310 . 1 1 27 27 ILE HG23 H 1 0.275 0.020 . 1 . . . . 27 ILE HG2 . 17416 1 311 . 1 1 27 27 ILE HD11 H 1 0.840 0.020 . 1 . . . . 27 ILE HD1 . 17416 1 312 . 1 1 27 27 ILE HD12 H 1 0.840 0.020 . 1 . . . . 27 ILE HD1 . 17416 1 313 . 1 1 27 27 ILE HD13 H 1 0.840 0.020 . 1 . . . . 27 ILE HD1 . 17416 1 314 . 1 1 27 27 ILE C C 13 174.865 0.400 . 1 . . . . 27 ILE C . 17416 1 315 . 1 1 27 27 ILE CA C 13 60.825 0.400 . 1 . . . . 27 ILE CA . 17416 1 316 . 1 1 27 27 ILE CB C 13 41.318 0.400 . 1 . . . . 27 ILE CB . 17416 1 317 . 1 1 27 27 ILE CG1 C 13 27.915 0.400 . 1 . . . . 27 ILE CG1 . 17416 1 318 . 1 1 27 27 ILE CG2 C 13 17.960 0.400 . 1 . . . . 27 ILE CG2 . 17416 1 319 . 1 1 27 27 ILE CD1 C 13 14.245 0.400 . 1 . . . . 27 ILE CD1 . 17416 1 320 . 1 1 27 27 ILE N N 15 123.499 0.400 . 1 . . . . 27 ILE N . 17416 1 321 . 1 1 28 28 ILE H H 1 9.540 0.020 . 1 . . . . 28 ILE H . 17416 1 322 . 1 1 28 28 ILE HA H 1 4.588 0.020 . 1 . . . . 28 ILE HA . 17416 1 323 . 1 1 28 28 ILE HB H 1 1.997 0.020 . 1 . . . . 28 ILE HB . 17416 1 324 . 1 1 28 28 ILE HG12 H 1 1.785 0.020 . 2 . . . . 28 ILE HG12 . 17416 1 325 . 1 1 28 28 ILE HG13 H 1 1.785 0.020 . 2 . . . . 28 ILE HG13 . 17416 1 326 . 1 1 28 28 ILE HG21 H 1 0.775 0.020 . 1 . . . . 28 ILE HG2 . 17416 1 327 . 1 1 28 28 ILE HG22 H 1 0.775 0.020 . 1 . . . . 28 ILE HG2 . 17416 1 328 . 1 1 28 28 ILE HG23 H 1 0.775 0.020 . 1 . . . . 28 ILE HG2 . 17416 1 329 . 1 1 28 28 ILE HD11 H 1 0.882 0.020 . 1 . . . . 28 ILE HD1 . 17416 1 330 . 1 1 28 28 ILE HD12 H 1 0.882 0.020 . 1 . . . . 28 ILE HD1 . 17416 1 331 . 1 1 28 28 ILE HD13 H 1 0.882 0.020 . 1 . . . . 28 ILE HD1 . 17416 1 332 . 1 1 28 28 ILE C C 13 174.086 0.400 . 1 . . . . 28 ILE C . 17416 1 333 . 1 1 28 28 ILE CA C 13 60.761 0.400 . 1 . . . . 28 ILE CA . 17416 1 334 . 1 1 28 28 ILE CB C 13 37.832 0.400 . 1 . . . . 28 ILE CB . 17416 1 335 . 1 1 28 28 ILE CG1 C 13 27.926 0.400 . 1 . . . . 28 ILE CG1 . 17416 1 336 . 1 1 28 28 ILE CG2 C 13 18.258 0.400 . 1 . . . . 28 ILE CG2 . 17416 1 337 . 1 1 28 28 ILE CD1 C 13 13.607 0.400 . 1 . . . . 28 ILE CD1 . 17416 1 338 . 1 1 28 28 ILE N N 15 126.854 0.400 . 1 . . . . 28 ILE N . 17416 1 339 . 1 1 29 29 HIS H H 1 9.468 0.020 . 1 . . . . 29 HIS H . 17416 1 340 . 1 1 29 29 HIS HA H 1 4.892 0.020 . 1 . . . . 29 HIS HA . 17416 1 341 . 1 1 29 29 HIS HB2 H 1 3.007 0.020 . 2 . . . . 29 HIS HB2 . 17416 1 342 . 1 1 29 29 HIS HB3 H 1 3.007 0.020 . 2 . . . . 29 HIS HB3 . 17416 1 343 . 1 1 29 29 HIS HD2 H 1 6.940 0.020 . 1 . . . . 29 HIS HD2 . 17416 1 344 . 1 1 29 29 HIS HE1 H 1 7.740 0.020 . 1 . . . . 29 HIS HE1 . 17416 1 345 . 1 1 29 29 HIS CA C 13 53.703 0.400 . 1 . . . . 29 HIS CA . 17416 1 346 . 1 1 29 29 HIS CB C 13 32.843 0.400 . 1 . . . . 29 HIS CB . 17416 1 347 . 1 1 29 29 HIS N N 15 125.483 0.400 . 1 . . . . 29 HIS N . 17416 1 348 . 1 1 30 30 PRO HA H 1 4.640 0.020 . 1 . . . . 30 PRO HA . 17416 1 349 . 1 1 30 30 PRO HB2 H 1 2.733 0.020 . 2 . . . . 30 PRO HB2 . 17416 1 350 . 1 1 30 30 PRO HB3 H 1 1.772 0.020 . 2 . . . . 30 PRO HB3 . 17416 1 351 . 1 1 30 30 PRO HG2 H 1 1.762 0.020 . 2 . . . . 30 PRO HG2 . 17416 1 352 . 1 1 30 30 PRO HG3 H 1 1.941 0.020 . 2 . . . . 30 PRO HG3 . 17416 1 353 . 1 1 30 30 PRO HD2 H 1 3.532 0.020 . 2 . . . . 30 PRO HD2 . 17416 1 354 . 1 1 30 30 PRO HD3 H 1 3.844 0.020 . 2 . . . . 30 PRO HD3 . 17416 1 355 . 1 1 30 30 PRO C C 13 177.592 0.400 . 1 . . . . 30 PRO C . 17416 1 356 . 1 1 30 30 PRO CA C 13 62.112 0.400 . 1 . . . . 30 PRO CA . 17416 1 357 . 1 1 30 30 PRO CB C 13 32.534 0.400 . 1 . . . . 30 PRO CB . 17416 1 358 . 1 1 30 30 PRO CG C 13 26.693 0.400 . 1 . . . . 30 PRO CG . 17416 1 359 . 1 1 30 30 PRO CD C 13 50.934 0.400 . 1 . . . . 30 PRO CD . 17416 1 360 . 1 1 31 31 GLU H H 1 7.786 0.020 . 1 . . . . 31 GLU H . 17416 1 361 . 1 1 31 31 GLU HA H 1 4.869 0.020 . 1 . . . . 31 GLU HA . 17416 1 362 . 1 1 31 31 GLU HB2 H 1 2.004 0.020 . 2 . . . . 31 GLU HB2 . 17416 1 363 . 1 1 31 31 GLU HB3 H 1 2.333 0.020 . 2 . . . . 31 GLU HB3 . 17416 1 364 . 1 1 31 31 GLU HG2 H 1 2.025 0.020 . 2 . . . . 31 GLU HG2 . 17416 1 365 . 1 1 31 31 GLU HG3 H 1 1.026 0.020 . 2 . . . . 31 GLU HG3 . 17416 1 366 . 1 1 31 31 GLU C C 13 175.256 0.400 . 1 . . . . 31 GLU C . 17416 1 367 . 1 1 31 31 GLU CA C 13 53.664 0.400 . 1 . . . . 31 GLU CA . 17416 1 368 . 1 1 31 31 GLU CB C 13 35.046 0.400 . 1 . . . . 31 GLU CB . 17416 1 369 . 1 1 31 31 GLU CG C 13 35.356 0.400 . 1 . . . . 31 GLU CG . 17416 1 370 . 1 1 31 31 GLU N N 15 118.359 0.400 . 1 . . . . 31 GLU N . 17416 1 371 . 1 1 32 32 LYS H H 1 8.025 0.020 . 1 . . . . 32 LYS H . 17416 1 372 . 1 1 32 32 LYS HA H 1 4.081 0.020 . 1 . . . . 32 LYS HA . 17416 1 373 . 1 1 32 32 LYS HB2 H 1 1.799 0.020 . 2 . . . . 32 LYS HB2 . 17416 1 374 . 1 1 32 32 LYS HB3 H 1 1.854 0.020 . 2 . . . . 32 LYS HB3 . 17416 1 375 . 1 1 32 32 LYS HG2 H 1 1.468 0.020 . 2 . . . . 32 LYS HG2 . 17416 1 376 . 1 1 32 32 LYS HG3 H 1 1.468 0.020 . 2 . . . . 32 LYS HG3 . 17416 1 377 . 1 1 32 32 LYS HD2 H 1 1.665 0.020 . 2 . . . . 32 LYS HD2 . 17416 1 378 . 1 1 32 32 LYS HD3 H 1 1.665 0.020 . 2 . . . . 32 LYS HD3 . 17416 1 379 . 1 1 32 32 LYS HE2 H 1 2.998 0.020 . 2 . . . . 32 LYS HE2 . 17416 1 380 . 1 1 32 32 LYS HE3 H 1 2.998 0.020 . 2 . . . . 32 LYS HE3 . 17416 1 381 . 1 1 32 32 LYS C C 13 176.226 0.400 . 1 . . . . 32 LYS C . 17416 1 382 . 1 1 32 32 LYS CA C 13 55.598 0.400 . 1 . . . . 32 LYS CA . 17416 1 383 . 1 1 32 32 LYS CB C 13 33.928 0.400 . 1 . . . . 32 LYS CB . 17416 1 384 . 1 1 32 32 LYS CG C 13 23.954 0.400 . 1 . . . . 32 LYS CG . 17416 1 385 . 1 1 32 32 LYS CD C 13 28.798 0.400 . 1 . . . . 32 LYS CD . 17416 1 386 . 1 1 32 32 LYS CE C 13 41.622 0.400 . 1 . . . . 32 LYS CE . 17416 1 387 . 1 1 32 32 LYS N N 15 117.681 0.400 . 1 . . . . 32 LYS N . 17416 1 388 . 1 1 33 33 GLU H H 1 9.160 0.020 . 1 . . . . 33 GLU H . 17416 1 389 . 1 1 33 33 GLU HA H 1 4.038 0.020 . 1 . . . . 33 GLU HA . 17416 1 390 . 1 1 33 33 GLU HB2 H 1 1.712 0.020 . 2 . . . . 33 GLU HB2 . 17416 1 391 . 1 1 33 33 GLU HB3 H 1 1.871 0.020 . 2 . . . . 33 GLU HB3 . 17416 1 392 . 1 1 33 33 GLU HG2 H 1 2.178 0.020 . 2 . . . . 33 GLU HG2 . 17416 1 393 . 1 1 33 33 GLU HG3 H 1 2.269 0.020 . 2 . . . . 33 GLU HG3 . 17416 1 394 . 1 1 33 33 GLU C C 13 177.398 0.400 . 1 . . . . 33 GLU C . 17416 1 395 . 1 1 33 33 GLU CA C 13 57.851 0.400 . 1 . . . . 33 GLU CA . 17416 1 396 . 1 1 33 33 GLU CB C 13 29.368 0.400 . 1 . . . . 33 GLU CB . 17416 1 397 . 1 1 33 33 GLU CG C 13 37.347 0.400 . 1 . . . . 33 GLU CG . 17416 1 398 . 1 1 33 33 GLU N N 15 121.319 0.400 . 1 . . . . 33 GLU N . 17416 1 399 . 1 1 34 34 GLY H H 1 9.438 0.020 . 1 . . . . 34 GLY H . 17416 1 400 . 1 1 34 34 GLY HA2 H 1 3.913 0.020 . 2 . . . . 34 GLY HA2 . 17416 1 401 . 1 1 34 34 GLY HA3 H 1 3.913 0.020 . 2 . . . . 34 GLY HA3 . 17416 1 402 . 1 1 34 34 GLY C C 13 174.571 0.400 . 1 . . . . 34 GLY C . 17416 1 403 . 1 1 34 34 GLY CA C 13 45.574 0.400 . 1 . . . . 34 GLY CA . 17416 1 404 . 1 1 34 34 GLY N N 15 110.125 0.400 . 1 . . . . 34 GLY N . 17416 1 405 . 1 1 35 35 THR H H 1 7.619 0.020 . 1 . . . . 35 THR H . 17416 1 406 . 1 1 35 35 THR HA H 1 3.876 0.020 . 1 . . . . 35 THR HA . 17416 1 407 . 1 1 35 35 THR HB H 1 3.870 0.020 . 1 . . . . 35 THR HB . 17416 1 408 . 1 1 35 35 THR HG21 H 1 0.913 0.020 . 1 . . . . 35 THR HG2 . 17416 1 409 . 1 1 35 35 THR HG22 H 1 0.913 0.020 . 1 . . . . 35 THR HG2 . 17416 1 410 . 1 1 35 35 THR HG23 H 1 0.913 0.020 . 1 . . . . 35 THR HG2 . 17416 1 411 . 1 1 35 35 THR C C 13 175.837 0.400 . 1 . . . . 35 THR C . 17416 1 412 . 1 1 35 35 THR CA C 13 65.844 0.400 . 1 . . . . 35 THR CA . 17416 1 413 . 1 1 35 35 THR CB C 13 68.941 0.400 . 1 . . . . 35 THR CB . 17416 1 414 . 1 1 35 35 THR CG2 C 13 20.469 0.400 . 1 . . . . 35 THR CG2 . 17416 1 415 . 1 1 35 35 THR N N 15 117.778 0.400 . 1 . . . . 35 THR N . 17416 1 416 . 1 1 36 36 GLY H H 1 8.659 0.020 . 1 . . . . 36 GLY H . 17416 1 417 . 1 1 36 36 GLY HA2 H 1 4.086 0.020 . 2 . . . . 36 GLY HA2 . 17416 1 418 . 1 1 36 36 GLY HA3 H 1 4.086 0.020 . 2 . . . . 36 GLY HA3 . 17416 1 419 . 1 1 36 36 GLY C C 13 172.818 0.400 . 1 . . . . 36 GLY C . 17416 1 420 . 1 1 36 36 GLY CA C 13 43.980 0.400 . 1 . . . . 36 GLY CA . 17416 1 421 . 1 1 36 36 GLY N N 15 109.998 0.400 . 1 . . . . 36 GLY N . 17416 1 422 . 1 1 37 37 ILE H H 1 8.049 0.020 . 1 . . . . 37 ILE H . 17416 1 423 . 1 1 37 37 ILE HA H 1 4.496 0.020 . 1 . . . . 37 ILE HA . 17416 1 424 . 1 1 37 37 ILE HB H 1 1.736 0.020 . 1 . . . . 37 ILE HB . 17416 1 425 . 1 1 37 37 ILE HG12 H 1 1.102 0.020 . 2 . . . . 37 ILE HG12 . 17416 1 426 . 1 1 37 37 ILE HG13 H 1 1.102 0.020 . 2 . . . . 37 ILE HG13 . 17416 1 427 . 1 1 37 37 ILE HG21 H 1 0.182 0.020 . 1 . . . . 37 ILE HG2 . 17416 1 428 . 1 1 37 37 ILE HG22 H 1 0.182 0.020 . 1 . . . . 37 ILE HG2 . 17416 1 429 . 1 1 37 37 ILE HG23 H 1 0.182 0.020 . 1 . . . . 37 ILE HG2 . 17416 1 430 . 1 1 37 37 ILE HD11 H 1 0.506 0.020 . 1 . . . . 37 ILE HD1 . 17416 1 431 . 1 1 37 37 ILE HD12 H 1 0.506 0.020 . 1 . . . . 37 ILE HD1 . 17416 1 432 . 1 1 37 37 ILE HD13 H 1 0.506 0.020 . 1 . . . . 37 ILE HD1 . 17416 1 433 . 1 1 37 37 ILE C C 13 176.619 0.400 . 1 . . . . 37 ILE C . 17416 1 434 . 1 1 37 37 ILE CA C 13 58.394 0.400 . 1 . . . . 37 ILE CA . 17416 1 435 . 1 1 37 37 ILE CB C 13 35.354 0.400 . 1 . . . . 37 ILE CB . 17416 1 436 . 1 1 37 37 ILE CG1 C 13 25.971 0.400 . 1 . . . . 37 ILE CG1 . 17416 1 437 . 1 1 37 37 ILE CG2 C 13 17.359 0.400 . 1 . . . . 37 ILE CG2 . 17416 1 438 . 1 1 37 37 ILE CD1 C 13 11.755 0.400 . 1 . . . . 37 ILE CD1 . 17416 1 439 . 1 1 37 37 ILE N N 15 116.292 0.400 . 1 . . . . 37 ILE N . 17416 1 440 . 1 1 38 38 ARG H H 1 7.950 0.020 . 1 . . . . 38 ARG H . 17416 1 441 . 1 1 38 38 ARG HA H 1 4.857 0.020 . 1 . . . . 38 ARG HA . 17416 1 442 . 1 1 38 38 ARG HB2 H 1 1.698 0.020 . 2 . . . . 38 ARG HB2 . 17416 1 443 . 1 1 38 38 ARG HB3 H 1 2.337 0.020 . 2 . . . . 38 ARG HB3 . 17416 1 444 . 1 1 38 38 ARG HG2 H 1 1.449 0.020 . 2 . . . . 38 ARG HG2 . 17416 1 445 . 1 1 38 38 ARG HG3 H 1 1.617 0.020 . 2 . . . . 38 ARG HG3 . 17416 1 446 . 1 1 38 38 ARG HD2 H 1 2.584 0.020 . 2 . . . . 38 ARG HD2 . 17416 1 447 . 1 1 38 38 ARG HD3 H 1 2.851 0.020 . 2 . . . . 38 ARG HD3 . 17416 1 448 . 1 1 38 38 ARG C C 13 173.894 0.400 . 1 . . . . 38 ARG C . 17416 1 449 . 1 1 38 38 ARG CA C 13 53.704 0.400 . 1 . . . . 38 ARG CA . 17416 1 450 . 1 1 38 38 ARG CB C 13 33.185 0.400 . 1 . . . . 38 ARG CB . 17416 1 451 . 1 1 38 38 ARG CG C 13 25.413 0.400 . 1 . . . . 38 ARG CG . 17416 1 452 . 1 1 38 38 ARG CD C 13 43.435 0.400 . 1 . . . . 38 ARG CD . 17416 1 453 . 1 1 38 38 ARG N N 15 123.203 0.400 . 1 . . . . 38 ARG N . 17416 1 454 . 1 1 39 39 PHE H H 1 9.103 0.020 . 1 . . . . 39 PHE H . 17416 1 455 . 1 1 39 39 PHE HA H 1 5.393 0.020 . 1 . . . . 39 PHE HA . 17416 1 456 . 1 1 39 39 PHE HB2 H 1 2.980 0.020 . 2 . . . . 39 PHE HB2 . 17416 1 457 . 1 1 39 39 PHE HB3 H 1 2.870 0.020 . 2 . . . . 39 PHE HB3 . 17416 1 458 . 1 1 39 39 PHE HD1 H 1 7.161 0.020 . 1 . . . . 39 PHE HD1 . 17416 1 459 . 1 1 39 39 PHE HD2 H 1 7.161 0.020 . 1 . . . . 39 PHE HD2 . 17416 1 460 . 1 1 39 39 PHE HE1 H 1 6.940 0.020 . 1 . . . . 39 PHE HE1 . 17416 1 461 . 1 1 39 39 PHE HE2 H 1 6.940 0.020 . 1 . . . . 39 PHE HE2 . 17416 1 462 . 1 1 39 39 PHE HZ H 1 6.871 0.020 . 1 . . . . 39 PHE HZ . 17416 1 463 . 1 1 39 39 PHE C C 13 175.253 0.400 . 1 . . . . 39 PHE C . 17416 1 464 . 1 1 39 39 PHE CA C 13 56.463 0.400 . 1 . . . . 39 PHE CA . 17416 1 465 . 1 1 39 39 PHE CB C 13 40.767 0.400 . 1 . . . . 39 PHE CB . 17416 1 466 . 1 1 39 39 PHE N N 15 120.661 0.400 . 1 . . . . 39 PHE N . 17416 1 467 . 1 1 40 40 PHE H H 1 8.911 0.020 . 1 . . . . 40 PHE H . 17416 1 468 . 1 1 40 40 PHE HA H 1 5.434 0.020 . 1 . . . . 40 PHE HA . 17416 1 469 . 1 1 40 40 PHE HB2 H 1 2.555 0.020 . 2 . . . . 40 PHE HB2 . 17416 1 470 . 1 1 40 40 PHE HB3 H 1 2.373 0.020 . 2 . . . . 40 PHE HB3 . 17416 1 471 . 1 1 40 40 PHE HD1 H 1 6.117 0.020 . 1 . . . . 40 PHE HD1 . 17416 1 472 . 1 1 40 40 PHE HD2 H 1 6.117 0.020 . 1 . . . . 40 PHE HD2 . 17416 1 473 . 1 1 40 40 PHE HE1 H 1 6.817 0.020 . 1 . . . . 40 PHE HE1 . 17416 1 474 . 1 1 40 40 PHE HE2 H 1 6.817 0.020 . 1 . . . . 40 PHE HE2 . 17416 1 475 . 1 1 40 40 PHE HZ H 1 7.069 0.020 . 1 . . . . 40 PHE HZ . 17416 1 476 . 1 1 40 40 PHE C C 13 173.112 0.400 . 1 . . . . 40 PHE C . 17416 1 477 . 1 1 40 40 PHE CA C 13 55.572 0.400 . 1 . . . . 40 PHE CA . 17416 1 478 . 1 1 40 40 PHE CB C 13 42.779 0.400 . 1 . . . . 40 PHE CB . 17416 1 479 . 1 1 40 40 PHE N N 15 123.451 0.400 . 1 . . . . 40 PHE N . 17416 1 480 . 1 1 41 41 LYS H H 1 8.401 0.020 . 1 . . . . 41 LYS H . 17416 1 481 . 1 1 41 41 LYS HA H 1 4.641 0.020 . 1 . . . . 41 LYS HA . 17416 1 482 . 1 1 41 41 LYS HB2 H 1 1.414 0.020 . 2 . . . . 41 LYS HB2 . 17416 1 483 . 1 1 41 41 LYS HB3 H 1 1.665 0.020 . 2 . . . . 41 LYS HB3 . 17416 1 484 . 1 1 41 41 LYS HG2 H 1 1.192 0.020 . 2 . . . . 41 LYS HG2 . 17416 1 485 . 1 1 41 41 LYS HG3 H 1 1.585 0.020 . 2 . . . . 41 LYS HG3 . 17416 1 486 . 1 1 41 41 LYS HD2 H 1 1.390 0.020 . 2 . . . . 41 LYS HD2 . 17416 1 487 . 1 1 41 41 LYS HD3 H 1 1.640 0.020 . 2 . . . . 41 LYS HD3 . 17416 1 488 . 1 1 41 41 LYS HE2 H 1 3.304 0.020 . 2 . . . . 41 LYS HE2 . 17416 1 489 . 1 1 41 41 LYS HE3 H 1 3.304 0.020 . 2 . . . . 41 LYS HE3 . 17416 1 490 . 1 1 41 41 LYS C C 13 175.063 0.400 . 1 . . . . 41 LYS C . 17416 1 491 . 1 1 41 41 LYS CA C 13 54.702 0.400 . 1 . . . . 41 LYS CA . 17416 1 492 . 1 1 41 41 LYS CB C 13 36.289 0.400 . 1 . . . . 41 LYS CB . 17416 1 493 . 1 1 41 41 LYS CG C 13 24.809 0.400 . 1 . . . . 41 LYS CG . 17416 1 494 . 1 1 41 41 LYS CD C 13 30.705 0.400 . 1 . . . . 41 LYS CD . 17416 1 495 . 1 1 41 41 LYS CE C 13 42.481 0.400 . 1 . . . . 41 LYS CE . 17416 1 496 . 1 1 41 41 LYS N N 15 127.126 0.400 . 1 . . . . 41 LYS N . 17416 1 497 . 1 1 42 42 ASN H H 1 9.070 0.020 . 1 . . . . 42 ASN H . 17416 1 498 . 1 1 42 42 ASN HA H 1 4.240 0.020 . 1 . . . . 42 ASN HA . 17416 1 499 . 1 1 42 42 ASN HB2 H 1 2.474 0.020 . 2 . . . . 42 ASN HB2 . 17416 1 500 . 1 1 42 42 ASN HB3 H 1 2.966 0.020 . 2 . . . . 42 ASN HB3 . 17416 1 501 . 1 1 42 42 ASN C C 13 174.575 0.400 . 1 . . . . 42 ASN C . 17416 1 502 . 1 1 42 42 ASN CA C 13 53.711 0.400 . 1 . . . . 42 ASN CA . 17416 1 503 . 1 1 42 42 ASN CB C 13 36.577 0.400 . 1 . . . . 42 ASN CB . 17416 1 504 . 1 1 42 42 ASN N N 15 124.026 0.400 . 1 . . . . 42 ASN N . 17416 1 505 . 1 1 43 43 GLY H H 1 6.759 0.020 . 1 . . . . 43 GLY H . 17416 1 506 . 1 1 43 43 GLY HA2 H 1 3.381 0.020 . 2 . . . . 43 GLY HA2 . 17416 1 507 . 1 1 43 43 GLY HA3 H 1 4.054 0.020 . 2 . . . . 43 GLY HA3 . 17416 1 508 . 1 1 43 43 GLY C C 13 173.305 0.400 . 1 . . . . 43 GLY C . 17416 1 509 . 1 1 43 43 GLY CA C 13 45.319 0.400 . 1 . . . . 43 GLY CA . 17416 1 510 . 1 1 43 43 GLY N N 15 100.262 0.400 . 1 . . . . 43 GLY N . 17416 1 511 . 1 1 44 44 VAL H H 1 7.393 0.020 . 1 . . . . 44 VAL H . 17416 1 512 . 1 1 44 44 VAL HA H 1 4.191 0.020 . 1 . . . . 44 VAL HA . 17416 1 513 . 1 1 44 44 VAL HB H 1 2.072 0.020 . 1 . . . . 44 VAL HB . 17416 1 514 . 1 1 44 44 VAL HG11 H 1 0.985 0.020 . 2 . . . . 44 VAL HG1 . 17416 1 515 . 1 1 44 44 VAL HG12 H 1 0.985 0.020 . 2 . . . . 44 VAL HG1 . 17416 1 516 . 1 1 44 44 VAL HG13 H 1 0.985 0.020 . 2 . . . . 44 VAL HG1 . 17416 1 517 . 1 1 44 44 VAL HG21 H 1 0.897 0.020 . 2 . . . . 44 VAL HG2 . 17416 1 518 . 1 1 44 44 VAL HG22 H 1 0.897 0.020 . 2 . . . . 44 VAL HG2 . 17416 1 519 . 1 1 44 44 VAL HG23 H 1 0.897 0.020 . 2 . . . . 44 VAL HG2 . 17416 1 520 . 1 1 44 44 VAL C C 13 174.671 0.400 . 1 . . . . 44 VAL C . 17416 1 521 . 1 1 44 44 VAL CA C 13 61.021 0.400 . 1 . . . . 44 VAL CA . 17416 1 522 . 1 1 44 44 VAL CB C 13 34.498 0.400 . 1 . . . . 44 VAL CB . 17416 1 523 . 1 1 44 44 VAL CG1 C 13 21.378 0.400 . 1 . . . . 44 VAL CG1 . 17416 1 524 . 1 1 44 44 VAL CG2 C 13 21.380 0.400 . 1 . . . . 44 VAL CG2 . 17416 1 525 . 1 1 44 44 VAL N N 15 122.259 0.400 . 1 . . . . 44 VAL N . 17416 1 526 . 1 1 45 45 TYR H H 1 8.378 0.020 . 1 . . . . 45 TYR H . 17416 1 527 . 1 1 45 45 TYR HA H 1 5.301 0.020 . 1 . . . . 45 TYR HA . 17416 1 528 . 1 1 45 45 TYR HB2 H 1 2.589 0.020 . 2 . . . . 45 TYR HB2 . 17416 1 529 . 1 1 45 45 TYR HB3 H 1 2.915 0.020 . 2 . . . . 45 TYR HB3 . 17416 1 530 . 1 1 45 45 TYR HD1 H 1 6.960 0.020 . 1 . . . . 45 TYR HD1 . 17416 1 531 . 1 1 45 45 TYR HD2 H 1 6.960 0.020 . 1 . . . . 45 TYR HD2 . 17416 1 532 . 1 1 45 45 TYR HE1 H 1 6.503 0.020 . 1 . . . . 45 TYR HE1 . 17416 1 533 . 1 1 45 45 TYR HE2 H 1 6.503 0.020 . 1 . . . . 45 TYR HE2 . 17416 1 534 . 1 1 45 45 TYR C C 13 175.938 0.400 . 1 . . . . 45 TYR C . 17416 1 535 . 1 1 45 45 TYR CA C 13 58.042 0.400 . 1 . . . . 45 TYR CA . 17416 1 536 . 1 1 45 45 TYR CB C 13 39.964 0.400 . 1 . . . . 45 TYR CB . 17416 1 537 . 1 1 45 45 TYR N N 15 123.624 0.400 . 1 . . . . 45 TYR N . 17416 1 538 . 1 1 46 46 ILE H H 1 9.107 0.020 . 1 . . . . 46 ILE H . 17416 1 539 . 1 1 46 46 ILE HA H 1 4.060 0.020 . 1 . . . . 46 ILE HA . 17416 1 540 . 1 1 46 46 ILE HB H 1 1.674 0.020 . 1 . . . . 46 ILE HB . 17416 1 541 . 1 1 46 46 ILE HG12 H 1 0.959 0.020 . 2 . . . . 46 ILE HG12 . 17416 1 542 . 1 1 46 46 ILE HG13 H 1 1.567 0.020 . 2 . . . . 46 ILE HG13 . 17416 1 543 . 1 1 46 46 ILE HG21 H 1 0.647 0.020 . 1 . . . . 46 ILE HG2 . 17416 1 544 . 1 1 46 46 ILE HG22 H 1 0.647 0.020 . 1 . . . . 46 ILE HG2 . 17416 1 545 . 1 1 46 46 ILE HG23 H 1 0.647 0.020 . 1 . . . . 46 ILE HG2 . 17416 1 546 . 1 1 46 46 ILE HD11 H 1 0.710 0.020 . 1 . . . . 46 ILE HD1 . 17416 1 547 . 1 1 46 46 ILE HD12 H 1 0.710 0.020 . 1 . . . . 46 ILE HD1 . 17416 1 548 . 1 1 46 46 ILE HD13 H 1 0.710 0.020 . 1 . . . . 46 ILE HD1 . 17416 1 549 . 1 1 46 46 ILE CA C 13 58.101 0.400 . 1 . . . . 46 ILE CA . 17416 1 550 . 1 1 46 46 ILE CB C 13 40.746 0.400 . 1 . . . . 46 ILE CB . 17416 1 551 . 1 1 46 46 ILE CG1 C 13 27.608 0.400 . 1 . . . . 46 ILE CG1 . 17416 1 552 . 1 1 46 46 ILE CG2 C 13 18.563 0.400 . 1 . . . . 46 ILE CG2 . 17416 1 553 . 1 1 46 46 ILE CD1 C 13 14.543 0.400 . 1 . . . . 46 ILE CD1 . 17416 1 554 . 1 1 46 46 ILE N N 15 122.408 0.400 . 1 . . . . 46 ILE N . 17416 1 555 . 1 1 47 47 PRO HA H 1 4.124 0.020 . 1 . . . . 47 PRO HA . 17416 1 556 . 1 1 47 47 PRO HB2 H 1 2.260 0.020 . 2 . . . . 47 PRO HB2 . 17416 1 557 . 1 1 47 47 PRO HB3 H 1 2.260 0.020 . 2 . . . . 47 PRO HB3 . 17416 1 558 . 1 1 47 47 PRO HG2 H 1 1.458 0.020 . 2 . . . . 47 PRO HG2 . 17416 1 559 . 1 1 47 47 PRO HG3 H 1 1.458 0.020 . 2 . . . . 47 PRO HG3 . 17416 1 560 . 1 1 47 47 PRO HD2 H 1 1.369 0.020 . 2 . . . . 47 PRO HD2 . 17416 1 561 . 1 1 47 47 PRO HD3 H 1 3.159 0.020 . 2 . . . . 47 PRO HD3 . 17416 1 562 . 1 1 47 47 PRO C C 13 175.059 0.400 . 1 . . . . 47 PRO C . 17416 1 563 . 1 1 47 47 PRO CA C 13 62.994 0.400 . 1 . . . . 47 PRO CA . 17416 1 564 . 1 1 47 47 PRO CD C 13 49.662 0.400 . 1 . . . . 47 PRO CD . 17416 1 565 . 1 1 48 48 ALA H H 1 7.736 0.020 . 1 . . . . 48 ALA H . 17416 1 566 . 1 1 48 48 ALA HA H 1 4.499 0.020 . 1 . . . . 48 ALA HA . 17416 1 567 . 1 1 48 48 ALA HB1 H 1 1.070 0.020 . 1 . . . . 48 ALA HB . 17416 1 568 . 1 1 48 48 ALA HB2 H 1 1.070 0.020 . 1 . . . . 48 ALA HB . 17416 1 569 . 1 1 48 48 ALA HB3 H 1 1.070 0.020 . 1 . . . . 48 ALA HB . 17416 1 570 . 1 1 48 48 ALA C C 13 177.983 0.400 . 1 . . . . 48 ALA C . 17416 1 571 . 1 1 48 48 ALA CA C 13 49.629 0.400 . 1 . . . . 48 ALA CA . 17416 1 572 . 1 1 48 48 ALA CB C 13 17.049 0.400 . 1 . . . . 48 ALA CB . 17416 1 573 . 1 1 48 48 ALA N N 15 124.693 0.400 . 1 . . . . 48 ALA N . 17416 1 574 . 1 1 49 49 ARG H H 1 8.044 0.020 . 1 . . . . 49 ARG H . 17416 1 575 . 1 1 49 49 ARG HA H 1 5.164 0.020 . 1 . . . . 49 ARG HA . 17416 1 576 . 1 1 49 49 ARG HB2 H 1 1.491 0.020 . 2 . . . . 49 ARG HB2 . 17416 1 577 . 1 1 49 49 ARG HB3 H 1 2.301 0.020 . 2 . . . . 49 ARG HB3 . 17416 1 578 . 1 1 49 49 ARG HG2 H 1 1.469 0.020 . 2 . . . . 49 ARG HG2 . 17416 1 579 . 1 1 49 49 ARG HG3 H 1 1.572 0.020 . 2 . . . . 49 ARG HG3 . 17416 1 580 . 1 1 49 49 ARG HD2 H 1 3.178 0.020 . 2 . . . . 49 ARG HD2 . 17416 1 581 . 1 1 49 49 ARG HD3 H 1 3.333 0.020 . 2 . . . . 49 ARG HD3 . 17416 1 582 . 1 1 49 49 ARG C C 13 174.767 0.400 . 1 . . . . 49 ARG C . 17416 1 583 . 1 1 49 49 ARG CA C 13 53.386 0.400 . 1 . . . . 49 ARG CA . 17416 1 584 . 1 1 49 49 ARG CB C 13 36.853 0.400 . 1 . . . . 49 ARG CB . 17416 1 585 . 1 1 49 49 ARG CG C 13 28.228 0.400 . 1 . . . . 49 ARG CG . 17416 1 586 . 1 1 49 49 ARG CD C 13 43.047 0.400 . 1 . . . . 49 ARG CD . 17416 1 587 . 1 1 49 49 ARG N N 15 118.632 0.400 . 1 . . . . 49 ARG N . 17416 1 588 . 1 1 50 50 HIS H H 1 8.047 0.020 . 1 . . . . 50 HIS H . 17416 1 589 . 1 1 50 50 HIS HA H 1 4.102 0.020 . 1 . . . . 50 HIS HA . 17416 1 590 . 1 1 50 50 HIS HB2 H 1 2.745 0.020 . 2 . . . . 50 HIS HB2 . 17416 1 591 . 1 1 50 50 HIS HB3 H 1 2.881 0.020 . 2 . . . . 50 HIS HB3 . 17416 1 592 . 1 1 50 50 HIS HD1 H 1 7.118 0.020 . 1 . . . . 50 HIS HD1 . 17416 1 593 . 1 1 50 50 HIS HD2 H 1 7.108 0.020 . 1 . . . . 50 HIS HD2 . 17416 1 594 . 1 1 50 50 HIS HE1 H 1 7.120 0.020 . 1 . . . . 50 HIS HE1 . 17416 1 595 . 1 1 50 50 HIS C C 13 176.130 0.400 . 1 . . . . 50 HIS C . 17416 1 596 . 1 1 50 50 HIS CA C 13 58.424 0.400 . 1 . . . . 50 HIS CA . 17416 1 597 . 1 1 50 50 HIS CB C 13 31.054 0.400 . 1 . . . . 50 HIS CB . 17416 1 598 . 1 1 50 50 HIS N N 15 118.629 0.400 . 1 . . . . 50 HIS N . 17416 1 599 . 1 1 51 51 GLU H H 1 8.962 0.020 . 1 . . . . 51 GLU H . 17416 1 600 . 1 1 51 51 GLU HA H 1 3.757 0.020 . 1 . . . . 51 GLU HA . 17416 1 601 . 1 1 51 51 GLU HB2 H 1 1.205 0.020 . 2 . . . . 51 GLU HB2 . 17416 1 602 . 1 1 51 51 GLU HB3 H 1 1.299 0.020 . 2 . . . . 51 GLU HB3 . 17416 1 603 . 1 1 51 51 GLU HG2 H 1 1.741 0.020 . 2 . . . . 51 GLU HG2 . 17416 1 604 . 1 1 51 51 GLU HG3 H 1 1.921 0.020 . 2 . . . . 51 GLU HG3 . 17416 1 605 . 1 1 51 51 GLU C C 13 176.911 0.400 . 1 . . . . 51 GLU C . 17416 1 606 . 1 1 51 51 GLU CA C 13 59.592 0.400 . 1 . . . . 51 GLU CA . 17416 1 607 . 1 1 51 51 GLU CB C 13 27.644 0.400 . 1 . . . . 51 GLU CB . 17416 1 608 . 1 1 51 51 GLU CG C 13 36.208 0.400 . 1 . . . . 51 GLU CG . 17416 1 609 . 1 1 51 51 GLU N N 15 122.249 0.400 . 1 . . . . 51 GLU N . 17416 1 610 . 1 1 52 52 PHE H H 1 7.909 0.020 . 1 . . . . 52 PHE H . 17416 1 611 . 1 1 52 52 PHE HA H 1 4.606 0.020 . 1 . . . . 52 PHE HA . 17416 1 612 . 1 1 52 52 PHE HB2 H 1 2.981 0.020 . 2 . . . . 52 PHE HB2 . 17416 1 613 . 1 1 52 52 PHE HB3 H 1 3.731 0.020 . 2 . . . . 52 PHE HB3 . 17416 1 614 . 1 1 52 52 PHE HD1 H 1 7.164 0.020 . 1 . . . . 52 PHE HD1 . 17416 1 615 . 1 1 52 52 PHE HD2 H 1 7.164 0.020 . 1 . . . . 52 PHE HD2 . 17416 1 616 . 1 1 52 52 PHE HE1 H 1 7.146 0.020 . 1 . . . . 52 PHE HE1 . 17416 1 617 . 1 1 52 52 PHE HE2 H 1 7.146 0.020 . 1 . . . . 52 PHE HE2 . 17416 1 618 . 1 1 52 52 PHE C C 13 174.474 0.400 . 1 . . . . 52 PHE C . 17416 1 619 . 1 1 52 52 PHE CA C 13 57.480 0.400 . 1 . . . . 52 PHE CA . 17416 1 620 . 1 1 52 52 PHE CB C 13 38.175 0.400 . 1 . . . . 52 PHE CB . 17416 1 621 . 1 1 52 52 PHE N N 15 115.526 0.400 . 1 . . . . 52 PHE N . 17416 1 622 . 1 1 53 53 VAL H H 1 7.265 0.020 . 1 . . . . 53 VAL H . 17416 1 623 . 1 1 53 53 VAL HA H 1 4.264 0.020 . 1 . . . . 53 VAL HA . 17416 1 624 . 1 1 53 53 VAL HB H 1 2.136 0.020 . 1 . . . . 53 VAL HB . 17416 1 625 . 1 1 53 53 VAL HG11 H 1 1.021 0.020 . 2 . . . . 53 VAL HG1 . 17416 1 626 . 1 1 53 53 VAL HG12 H 1 1.021 0.020 . 2 . . . . 53 VAL HG1 . 17416 1 627 . 1 1 53 53 VAL HG13 H 1 1.021 0.020 . 2 . . . . 53 VAL HG1 . 17416 1 628 . 1 1 53 53 VAL HG21 H 1 1.025 0.020 . 2 . . . . 53 VAL HG2 . 17416 1 629 . 1 1 53 53 VAL HG22 H 1 1.025 0.020 . 2 . . . . 53 VAL HG2 . 17416 1 630 . 1 1 53 53 VAL HG23 H 1 1.025 0.020 . 2 . . . . 53 VAL HG2 . 17416 1 631 . 1 1 53 53 VAL C C 13 177.690 0.400 . 1 . . . . 53 VAL C . 17416 1 632 . 1 1 53 53 VAL CA C 13 63.606 0.400 . 1 . . . . 53 VAL CA . 17416 1 633 . 1 1 53 53 VAL CB C 13 31.936 0.400 . 1 . . . . 53 VAL CB . 17416 1 634 . 1 1 53 53 VAL CG1 C 13 22.584 0.400 . 1 . . . . 53 VAL CG1 . 17416 1 635 . 1 1 53 53 VAL CG2 C 13 24.798 0.400 . 1 . . . . 53 VAL CG2 . 17416 1 636 . 1 1 53 53 VAL N N 15 120.501 0.400 . 1 . . . . 53 VAL N . 17416 1 637 . 1 1 54 54 VAL H H 1 8.846 0.020 . 1 . . . . 54 VAL H . 17416 1 638 . 1 1 54 54 VAL HA H 1 4.717 0.020 . 1 . . . . 54 VAL HA . 17416 1 639 . 1 1 54 54 VAL HB H 1 2.323 0.020 . 1 . . . . 54 VAL HB . 17416 1 640 . 1 1 54 54 VAL HG11 H 1 0.938 0.020 . 2 . . . . 54 VAL HG1 . 17416 1 641 . 1 1 54 54 VAL HG12 H 1 0.938 0.020 . 2 . . . . 54 VAL HG1 . 17416 1 642 . 1 1 54 54 VAL HG13 H 1 0.938 0.020 . 2 . . . . 54 VAL HG1 . 17416 1 643 . 1 1 54 54 VAL HG21 H 1 0.581 0.020 . 2 . . . . 54 VAL HG2 . 17416 1 644 . 1 1 54 54 VAL HG22 H 1 0.581 0.020 . 2 . . . . 54 VAL HG2 . 17416 1 645 . 1 1 54 54 VAL HG23 H 1 0.581 0.020 . 2 . . . . 54 VAL HG2 . 17416 1 646 . 1 1 54 54 VAL C C 13 175.645 0.400 . 1 . . . . 54 VAL C . 17416 1 647 . 1 1 54 54 VAL CA C 13 60.458 0.400 . 1 . . . . 54 VAL CA . 17416 1 648 . 1 1 54 54 VAL CB C 13 32.788 0.400 . 1 . . . . 54 VAL CB . 17416 1 649 . 1 1 54 54 VAL CG1 C 13 20.785 0.400 . 1 . . . . 54 VAL CG1 . 17416 1 650 . 1 1 54 54 VAL CG2 C 13 17.656 0.400 . 1 . . . . 54 VAL CG2 . 17416 1 651 . 1 1 54 54 VAL N N 15 120.930 0.400 . 1 . . . . 54 VAL N . 17416 1 652 . 1 1 55 55 HIS H H 1 7.503 0.020 . 1 . . . . 55 HIS H . 17416 1 653 . 1 1 55 55 HIS HA H 1 4.746 0.020 . 1 . . . . 55 HIS HA . 17416 1 654 . 1 1 55 55 HIS HB2 H 1 3.195 0.020 . 2 . . . . 55 HIS HB2 . 17416 1 655 . 1 1 55 55 HIS HB3 H 1 2.887 0.020 . 2 . . . . 55 HIS HB3 . 17416 1 656 . 1 1 55 55 HIS HD2 H 1 6.674 0.020 . 1 . . . . 55 HIS HD2 . 17416 1 657 . 1 1 55 55 HIS HE1 H 1 6.684 0.020 . 1 . . . . 55 HIS HE1 . 17416 1 658 . 1 1 55 55 HIS C C 13 172.429 0.400 . 1 . . . . 55 HIS C . 17416 1 659 . 1 1 55 55 HIS CA C 13 58.105 0.400 . 1 . . . . 55 HIS CA . 17416 1 660 . 1 1 55 55 HIS CB C 13 32.816 0.400 . 1 . . . . 55 HIS CB . 17416 1 661 . 1 1 55 55 HIS N N 15 120.930 0.400 . 1 . . . . 55 HIS N . 17416 1 662 . 1 1 56 56 THR H H 1 6.953 0.020 . 1 . . . . 56 THR H . 17416 1 663 . 1 1 56 56 THR HA H 1 5.140 0.020 . 1 . . . . 56 THR HA . 17416 1 664 . 1 1 56 56 THR HB H 1 3.831 0.020 . 1 . . . . 56 THR HB . 17416 1 665 . 1 1 56 56 THR HG21 H 1 1.224 0.020 . 1 . . . . 56 THR HG2 . 17416 1 666 . 1 1 56 56 THR HG22 H 1 1.224 0.020 . 1 . . . . 56 THR HG2 . 17416 1 667 . 1 1 56 56 THR HG23 H 1 1.224 0.020 . 1 . . . . 56 THR HG2 . 17416 1 668 . 1 1 56 56 THR C C 13 172.530 0.400 . 1 . . . . 56 THR C . 17416 1 669 . 1 1 56 56 THR CA C 13 59.643 0.400 . 1 . . . . 56 THR CA . 17416 1 670 . 1 1 56 56 THR CB C 13 72.358 0.400 . 1 . . . . 56 THR CB . 17416 1 671 . 1 1 56 56 THR CG2 C 13 23.582 0.400 . 1 . . . . 56 THR CG2 . 17416 1 672 . 1 1 56 56 THR N N 15 114.078 0.400 . 1 . . . . 56 THR N . 17416 1 673 . 1 1 57 57 ASN H H 1 6.432 0.020 . 1 . . . . 57 ASN H . 17416 1 674 . 1 1 57 57 ASN HA H 1 4.339 0.020 . 1 . . . . 57 ASN HA . 17416 1 675 . 1 1 57 57 ASN HB2 H 1 3.067 0.020 . 2 . . . . 57 ASN HB2 . 17416 1 676 . 1 1 57 57 ASN HB3 H 1 2.902 0.020 . 2 . . . . 57 ASN HB3 . 17416 1 677 . 1 1 57 57 ASN HD21 H 1 7.114 0.020 . 2 . . . . 57 ASN HD21 . 17416 1 678 . 1 1 57 57 ASN HD22 H 1 7.114 0.020 . 2 . . . . 57 ASN HD22 . 17416 1 679 . 1 1 57 57 ASN C C 13 174.867 0.400 . 1 . . . . 57 ASN C . 17416 1 680 . 1 1 57 57 ASN CB C 13 41.571 0.400 . 1 . . . . 57 ASN CB . 17416 1 681 . 1 1 57 57 ASN N N 15 118.755 0.400 . 1 . . . . 57 ASN N . 17416 1 682 . 1 1 58 58 HIS H H 1 7.258 0.020 . 1 . . . . 58 HIS H . 17416 1 683 . 1 1 58 58 HIS HA H 1 4.935 0.020 . 1 . . . . 58 HIS HA . 17416 1 684 . 1 1 58 58 HIS HB2 H 1 2.459 0.020 . 2 . . . . 58 HIS HB2 . 17416 1 685 . 1 1 58 58 HIS HB3 H 1 2.880 0.020 . 2 . . . . 58 HIS HB3 . 17416 1 686 . 1 1 58 58 HIS HD2 H 1 7.157 0.020 . 1 . . . . 58 HIS HD2 . 17416 1 687 . 1 1 58 58 HIS N N 15 119.298 0.400 . 1 . . . . 58 HIS N . 17416 1 688 . 1 1 59 59 SER HA H 1 3.644 0.020 . 1 . . . . 59 SER HA . 17416 1 689 . 1 1 59 59 SER HB2 H 1 3.735 0.020 . 2 . . . . 59 SER HB2 . 17416 1 690 . 1 1 59 59 SER HB3 H 1 3.735 0.020 . 2 . . . . 59 SER HB3 . 17416 1 691 . 1 1 59 59 SER C C 13 176.814 0.400 . 1 . . . . 59 SER C . 17416 1 692 . 1 1 59 59 SER CA C 13 60.125 0.400 . 1 . . . . 59 SER CA . 17416 1 693 . 1 1 59 59 SER CB C 13 62.079 0.400 . 1 . . . . 59 SER CB . 17416 1 694 . 1 1 60 60 THR H H 1 7.758 0.020 . 1 . . . . 60 THR H . 17416 1 695 . 1 1 60 60 THR HA H 1 4.458 0.020 . 1 . . . . 60 THR HA . 17416 1 696 . 1 1 60 60 THR HB H 1 3.827 0.020 . 1 . . . . 60 THR HB . 17416 1 697 . 1 1 60 60 THR HG21 H 1 0.922 0.020 . 1 . . . . 60 THR HG2 . 17416 1 698 . 1 1 60 60 THR HG22 H 1 0.922 0.020 . 1 . . . . 60 THR HG2 . 17416 1 699 . 1 1 60 60 THR HG23 H 1 0.922 0.020 . 1 . . . . 60 THR HG2 . 17416 1 700 . 1 1 60 60 THR C C 13 173.015 0.400 . 1 . . . . 60 THR C . 17416 1 701 . 1 1 60 60 THR CA C 13 62.371 0.400 . 1 . . . . 60 THR CA . 17416 1 702 . 1 1 60 60 THR CB C 13 68.054 0.400 . 1 . . . . 60 THR CB . 17416 1 703 . 1 1 60 60 THR CG2 C 13 23.594 0.400 . 1 . . . . 60 THR CG2 . 17416 1 704 . 1 1 60 60 THR N N 15 124.966 0.400 . 1 . . . . 60 THR N . 17416 1 705 . 1 1 61 61 ASP H H 1 8.517 0.020 . 1 . . . . 61 ASP H . 17416 1 706 . 1 1 61 61 ASP HA H 1 5.473 0.020 . 1 . . . . 61 ASP HA . 17416 1 707 . 1 1 61 61 ASP HB2 H 1 2.381 0.020 . 2 . . . . 61 ASP HB2 . 17416 1 708 . 1 1 61 61 ASP HB3 H 1 2.596 0.020 . 2 . . . . 61 ASP HB3 . 17416 1 709 . 1 1 61 61 ASP C C 13 176.424 0.400 . 1 . . . . 61 ASP C . 17416 1 710 . 1 1 61 61 ASP CA C 13 51.796 0.400 . 1 . . . . 61 ASP CA . 17416 1 711 . 1 1 61 61 ASP CB C 13 43.128 0.400 . 1 . . . . 61 ASP CB . 17416 1 712 . 1 1 61 61 ASP N N 15 123.610 0.400 . 1 . . . . 61 ASP N . 17416 1 713 . 1 1 62 62 LEU H H 1 8.263 0.020 . 1 . . . . 62 LEU H . 17416 1 714 . 1 1 62 62 LEU HA H 1 5.537 0.020 . 1 . . . . 62 LEU HA . 17416 1 715 . 1 1 62 62 LEU HB2 H 1 1.213 0.020 . 2 . . . . 62 LEU HB2 . 17416 1 716 . 1 1 62 62 LEU HB3 H 1 1.415 0.020 . 2 . . . . 62 LEU HB3 . 17416 1 717 . 1 1 62 62 LEU HG H 1 1.541 0.020 . 1 . . . . 62 LEU HG . 17416 1 718 . 1 1 62 62 LEU HD11 H 1 0.748 0.020 . 2 . . . . 62 LEU HD1 . 17416 1 719 . 1 1 62 62 LEU HD12 H 1 0.748 0.020 . 2 . . . . 62 LEU HD1 . 17416 1 720 . 1 1 62 62 LEU HD13 H 1 0.748 0.020 . 2 . . . . 62 LEU HD1 . 17416 1 721 . 1 1 62 62 LEU HD21 H 1 0.740 0.020 . 2 . . . . 62 LEU HD2 . 17416 1 722 . 1 1 62 62 LEU HD22 H 1 0.740 0.020 . 2 . . . . 62 LEU HD2 . 17416 1 723 . 1 1 62 62 LEU HD23 H 1 0.740 0.020 . 2 . . . . 62 LEU HD2 . 17416 1 724 . 1 1 62 62 LEU C C 13 176.423 0.400 . 1 . . . . 62 LEU C . 17416 1 725 . 1 1 62 62 LEU CA C 13 52.443 0.400 . 1 . . . . 62 LEU CA . 17416 1 726 . 1 1 62 62 LEU CB C 13 46.232 0.400 . 1 . . . . 62 LEU CB . 17416 1 727 . 1 1 62 62 LEU CG C 13 26.967 0.400 . 1 . . . . 62 LEU CG . 17416 1 728 . 1 1 62 62 LEU CD1 C 13 26.995 0.400 . 1 . . . . 62 LEU CD1 . 17416 1 729 . 1 1 62 62 LEU CD2 C 13 23.272 0.400 . 1 . . . . 62 LEU CD2 . 17416 1 730 . 1 1 62 62 LEU N N 15 120.924 0.400 . 1 . . . . 62 LEU N . 17416 1 731 . 1 1 63 63 GLY H H 1 9.238 0.020 . 1 . . . . 63 GLY H . 17416 1 732 . 1 1 63 63 GLY HA2 H 1 4.855 0.020 . 2 . . . . 63 GLY HA2 . 17416 1 733 . 1 1 63 63 GLY HA3 H 1 3.887 0.020 . 2 . . . . 63 GLY HA3 . 17416 1 734 . 1 1 63 63 GLY C C 13 171.748 0.400 . 1 . . . . 63 GLY C . 17416 1 735 . 1 1 63 63 GLY CA C 13 47.134 0.400 . 1 . . . . 63 GLY CA . 17416 1 736 . 1 1 63 63 GLY N N 15 106.872 0.400 . 1 . . . . 63 GLY N . 17416 1 737 . 1 1 64 64 PHE H H 1 8.391 0.020 . 1 . . . . 64 PHE H . 17416 1 738 . 1 1 64 64 PHE HA H 1 4.945 0.020 . 1 . . . . 64 PHE HA . 17416 1 739 . 1 1 64 64 PHE HB2 H 1 3.813 0.020 . 2 . . . . 64 PHE HB2 . 17416 1 740 . 1 1 64 64 PHE HB3 H 1 2.689 0.020 . 2 . . . . 64 PHE HB3 . 17416 1 741 . 1 1 64 64 PHE HD1 H 1 7.559 0.020 . 1 . . . . 64 PHE HD1 . 17416 1 742 . 1 1 64 64 PHE HD2 H 1 7.559 0.020 . 1 . . . . 64 PHE HD2 . 17416 1 743 . 1 1 64 64 PHE HE1 H 1 7.540 0.020 . 1 . . . . 64 PHE HE1 . 17416 1 744 . 1 1 64 64 PHE HE2 H 1 7.540 0.020 . 1 . . . . 64 PHE HE2 . 17416 1 745 . 1 1 64 64 PHE HZ H 1 7.538 0.020 . 1 . . . . 64 PHE HZ . 17416 1 746 . 1 1 64 64 PHE C C 13 174.282 0.400 . 1 . . . . 64 PHE C . 17416 1 747 . 1 1 64 64 PHE CA C 13 57.385 0.400 . 1 . . . . 64 PHE CA . 17416 1 748 . 1 1 64 64 PHE CB C 13 42.800 0.400 . 1 . . . . 64 PHE CB . 17416 1 749 . 1 1 64 64 PHE N N 15 118.629 0.400 . 1 . . . . 64 PHE N . 17416 1 750 . 1 1 65 65 LYS H H 1 8.550 0.020 . 1 . . . . 65 LYS H . 17416 1 751 . 1 1 65 65 LYS HA H 1 3.565 0.020 . 1 . . . . 65 LYS HA . 17416 1 752 . 1 1 65 65 LYS HB2 H 1 1.397 0.020 . 2 . . . . 65 LYS HB2 . 17416 1 753 . 1 1 65 65 LYS HB3 H 1 1.856 0.020 . 2 . . . . 65 LYS HB3 . 17416 1 754 . 1 1 65 65 LYS HG2 H 1 0.339 0.020 . 2 . . . . 65 LYS HG2 . 17416 1 755 . 1 1 65 65 LYS HG3 H 1 0.650 0.020 . 2 . . . . 65 LYS HG3 . 17416 1 756 . 1 1 65 65 LYS HD2 H 1 1.410 0.020 . 2 . . . . 65 LYS HD2 . 17416 1 757 . 1 1 65 65 LYS HD3 H 1 1.410 0.020 . 2 . . . . 65 LYS HD3 . 17416 1 758 . 1 1 65 65 LYS HE2 H 1 2.799 0.020 . 2 . . . . 65 LYS HE2 . 17416 1 759 . 1 1 65 65 LYS HE3 H 1 2.872 0.020 . 2 . . . . 65 LYS HE3 . 17416 1 760 . 1 1 65 65 LYS CA C 13 57.015 0.400 . 1 . . . . 65 LYS CA . 17416 1 761 . 1 1 65 65 LYS CB C 13 30.455 0.400 . 1 . . . . 65 LYS CB . 17416 1 762 . 1 1 65 65 LYS CG C 13 24.514 0.400 . 1 . . . . 65 LYS CG . 17416 1 763 . 1 1 65 65 LYS CD C 13 29.090 0.400 . 1 . . . . 65 LYS CD . 17416 1 764 . 1 1 65 65 LYS CE C 13 41.902 0.400 . 1 . . . . 65 LYS CE . 17416 1 765 . 1 1 65 65 LYS N N 15 124.442 0.400 . 1 . . . . 65 LYS N . 17416 1 766 . 1 1 66 66 GLY HA2 H 1 3.583 0.020 . 2 . . . . 66 GLY HA2 . 17416 1 767 . 1 1 66 66 GLY HA3 H 1 4.121 0.020 . 2 . . . . 66 GLY HA3 . 17416 1 768 . 1 1 66 66 GLY C C 13 174.317 0.400 . 1 . . . . 66 GLY C . 17416 1 769 . 1 1 66 66 GLY CA C 13 45.300 0.400 . 1 . . . . 66 GLY CA . 17416 1 770 . 1 1 67 67 GLN H H 1 7.971 0.020 . 1 . . . . 67 GLN H . 17416 1 771 . 1 1 67 67 GLN HA H 1 4.556 0.020 . 1 . . . . 67 GLN HA . 17416 1 772 . 1 1 67 67 GLN HB2 H 1 1.816 0.020 . 2 . . . . 67 GLN HB2 . 17416 1 773 . 1 1 67 67 GLN HB3 H 1 1.816 0.020 . 2 . . . . 67 GLN HB3 . 17416 1 774 . 1 1 67 67 GLN HG2 H 1 2.313 0.020 . 2 . . . . 67 GLN HG2 . 17416 1 775 . 1 1 67 67 GLN HG3 H 1 2.313 0.020 . 2 . . . . 67 GLN HG3 . 17416 1 776 . 1 1 67 67 GLN HE21 H 1 6.980 0.020 . 2 . . . . 67 GLN HE21 . 17416 1 777 . 1 1 67 67 GLN HE22 H 1 7.463 0.020 . 2 . . . . 67 GLN HE22 . 17416 1 778 . 1 1 67 67 GLN N N 15 119.163 0.400 . 1 . . . . 67 GLN N . 17416 1 779 . 1 1 67 67 GLN NE2 N 15 113.766 0.400 . 1 . . . . 67 GLN NE2 . 17416 1 780 . 1 1 68 68 ARG HA H 1 5.208 0.020 . 1 . . . . 68 ARG HA . 17416 1 781 . 1 1 68 68 ARG HB2 H 1 1.624 0.020 . 2 . . . . 68 ARG HB2 . 17416 1 782 . 1 1 68 68 ARG HB3 H 1 1.624 0.020 . 2 . . . . 68 ARG HB3 . 17416 1 783 . 1 1 68 68 ARG HG2 H 1 1.335 0.020 . 2 . . . . 68 ARG HG2 . 17416 1 784 . 1 1 68 68 ARG HG3 H 1 1.472 0.020 . 2 . . . . 68 ARG HG3 . 17416 1 785 . 1 1 68 68 ARG HD2 H 1 3.034 0.020 . 2 . . . . 68 ARG HD2 . 17416 1 786 . 1 1 68 68 ARG HD3 H 1 3.034 0.020 . 2 . . . . 68 ARG HD3 . 17416 1 787 . 1 1 68 68 ARG C C 13 175.063 0.400 . 1 . . . . 68 ARG C . 17416 1 788 . 1 1 68 68 ARG CA C 13 54.676 0.400 . 1 . . . . 68 ARG CA . 17416 1 789 . 1 1 68 68 ARG CB C 13 33.907 0.400 . 1 . . . . 68 ARG CB . 17416 1 790 . 1 1 68 68 ARG CG C 13 27.335 0.400 . 1 . . . . 68 ARG CG . 17416 1 791 . 1 1 68 68 ARG CD C 13 43.349 0.400 . 1 . . . . 68 ARG CD . 17416 1 792 . 1 1 69 69 ILE H H 1 9.099 0.020 . 1 . . . . 69 ILE H . 17416 1 793 . 1 1 69 69 ILE HA H 1 3.885 0.020 . 1 . . . . 69 ILE HA . 17416 1 794 . 1 1 69 69 ILE HB H 1 1.072 0.020 . 1 . . . . 69 ILE HB . 17416 1 795 . 1 1 69 69 ILE HG12 H 1 0.651 0.020 . 2 . . . . 69 ILE HG12 . 17416 1 796 . 1 1 69 69 ILE HG13 H 1 1.157 0.020 . 2 . . . . 69 ILE HG13 . 17416 1 797 . 1 1 69 69 ILE HG21 H 1 0.425 0.020 . 1 . . . . 69 ILE HG2 . 17416 1 798 . 1 1 69 69 ILE HG22 H 1 0.425 0.020 . 1 . . . . 69 ILE HG2 . 17416 1 799 . 1 1 69 69 ILE HG23 H 1 0.425 0.020 . 1 . . . . 69 ILE HG2 . 17416 1 800 . 1 1 69 69 ILE HD11 H 1 0.581 0.020 . 1 . . . . 69 ILE HD1 . 17416 1 801 . 1 1 69 69 ILE HD12 H 1 0.581 0.020 . 1 . . . . 69 ILE HD1 . 17416 1 802 . 1 1 69 69 ILE HD13 H 1 0.581 0.020 . 1 . . . . 69 ILE HD1 . 17416 1 803 . 1 1 69 69 ILE C C 13 174.086 0.400 . 1 . . . . 69 ILE C . 17416 1 804 . 1 1 69 69 ILE CA C 13 60.159 0.400 . 1 . . . . 69 ILE CA . 17416 1 805 . 1 1 69 69 ILE CB C 13 41.311 0.400 . 1 . . . . 69 ILE CB . 17416 1 806 . 1 1 69 69 ILE CG1 C 13 27.373 0.400 . 1 . . . . 69 ILE CG1 . 17416 1 807 . 1 1 69 69 ILE CG2 C 13 18.568 0.400 . 1 . . . . 69 ILE CG2 . 17416 1 808 . 1 1 69 69 ILE CD1 C 13 15.728 0.400 . 1 . . . . 69 ILE CD1 . 17416 1 809 . 1 1 69 69 ILE N N 15 122.865 0.400 . 1 . . . . 69 ILE N . 17416 1 810 . 1 1 70 70 LYS H H 1 8.106 0.020 . 1 . . . . 70 LYS H . 17416 1 811 . 1 1 70 70 LYS HA H 1 4.415 0.020 . 1 . . . . 70 LYS HA . 17416 1 812 . 1 1 70 70 LYS HB2 H 1 1.740 0.020 . 2 . . . . 70 LYS HB2 . 17416 1 813 . 1 1 70 70 LYS HB3 H 1 1.740 0.020 . 2 . . . . 70 LYS HB3 . 17416 1 814 . 1 1 70 70 LYS HG2 H 1 1.287 0.020 . 2 . . . . 70 LYS HG2 . 17416 1 815 . 1 1 70 70 LYS HG3 H 1 1.554 0.020 . 2 . . . . 70 LYS HG3 . 17416 1 816 . 1 1 70 70 LYS HE2 H 1 2.612 0.020 . 2 . . . . 70 LYS HE2 . 17416 1 817 . 1 1 70 70 LYS HE3 H 1 2.789 0.020 . 2 . . . . 70 LYS HE3 . 17416 1 818 . 1 1 70 70 LYS C C 13 176.035 0.400 . 1 . . . . 70 LYS C . 17416 1 819 . 1 1 70 70 LYS CA C 13 56.473 0.400 . 1 . . . . 70 LYS CA . 17416 1 820 . 1 1 70 70 LYS CB C 13 32.871 0.400 . 1 . . . . 70 LYS CB . 17416 1 821 . 1 1 70 70 LYS CG C 13 23.859 0.400 . 1 . . . . 70 LYS CG . 17416 1 822 . 1 1 70 70 LYS CE C 13 39.396 0.400 . 1 . . . . 70 LYS CE . 17416 1 823 . 1 1 70 70 LYS N N 15 124.834 0.400 . 1 . . . . 70 LYS N . 17416 1 824 . 1 1 71 71 THR H H 1 8.170 0.020 . 1 . . . . 71 THR H . 17416 1 825 . 1 1 71 71 THR HA H 1 4.160 0.020 . 1 . . . . 71 THR HA . 17416 1 826 . 1 1 71 71 THR HB H 1 4.699 0.020 . 1 . . . . 71 THR HB . 17416 1 827 . 1 1 71 71 THR HG21 H 1 1.162 0.020 . 1 . . . . 71 THR HG2 . 17416 1 828 . 1 1 71 71 THR HG22 H 1 1.162 0.020 . 1 . . . . 71 THR HG2 . 17416 1 829 . 1 1 71 71 THR HG23 H 1 1.162 0.020 . 1 . . . . 71 THR HG2 . 17416 1 830 . 1 1 71 71 THR C C 13 175.355 0.400 . 1 . . . . 71 THR C . 17416 1 831 . 1 1 71 71 THR CA C 13 61.793 0.400 . 1 . . . . 71 THR CA . 17416 1 832 . 1 1 71 71 THR CB C 13 64.254 0.400 . 1 . . . . 71 THR CB . 17416 1 833 . 1 1 71 71 THR CG2 C 13 24.792 0.400 . 1 . . . . 71 THR CG2 . 17416 1 834 . 1 1 71 71 THR N N 15 116.072 0.400 . 1 . . . . 71 THR N . 17416 1 835 . 1 1 72 72 VAL H H 1 8.394 0.020 . 1 . . . . 72 VAL H . 17416 1 836 . 1 1 72 72 VAL HA H 1 4.091 0.020 . 1 . . . . 72 VAL HA . 17416 1 837 . 1 1 72 72 VAL HB H 1 2.204 0.020 . 1 . . . . 72 VAL HB . 17416 1 838 . 1 1 72 72 VAL HG11 H 1 0.274 0.020 . 2 . . . . 72 VAL HG1 . 17416 1 839 . 1 1 72 72 VAL HG12 H 1 0.274 0.020 . 2 . . . . 72 VAL HG1 . 17416 1 840 . 1 1 72 72 VAL HG13 H 1 0.274 0.020 . 2 . . . . 72 VAL HG1 . 17416 1 841 . 1 1 72 72 VAL HG21 H 1 0.706 0.020 . 2 . . . . 72 VAL HG2 . 17416 1 842 . 1 1 72 72 VAL HG22 H 1 0.706 0.020 . 2 . . . . 72 VAL HG2 . 17416 1 843 . 1 1 72 72 VAL HG23 H 1 0.706 0.020 . 2 . . . . 72 VAL HG2 . 17416 1 844 . 1 1 72 72 VAL C C 13 177.985 0.400 . 1 . . . . 72 VAL C . 17416 1 845 . 1 1 72 72 VAL CA C 13 62.410 0.400 . 1 . . . . 72 VAL CA . 17416 1 846 . 1 1 72 72 VAL CB C 13 31.935 0.400 . 1 . . . . 72 VAL CB . 17416 1 847 . 1 1 72 72 VAL CG1 C 13 21.379 0.400 . 1 . . . . 72 VAL CG1 . 17416 1 848 . 1 1 72 72 VAL CG2 C 13 17.358 0.400 . 1 . . . . 72 VAL CG2 . 17416 1 849 . 1 1 72 72 VAL N N 15 113.098 0.400 . 1 . . . . 72 VAL N . 17416 1 850 . 1 1 73 73 GLU H H 1 10.255 0.020 . 1 . . . . 73 GLU H . 17416 1 851 . 1 1 73 73 GLU HA H 1 4.218 0.020 . 1 . . . . 73 GLU HA . 17416 1 852 . 1 1 73 73 GLU HB2 H 1 2.264 0.020 . 2 . . . . 73 GLU HB2 . 17416 1 853 . 1 1 73 73 GLU HB3 H 1 1.731 0.020 . 2 . . . . 73 GLU HB3 . 17416 1 854 . 1 1 73 73 GLU HG2 H 1 1.750 0.020 . 2 . . . . 73 GLU HG2 . 17416 1 855 . 1 1 73 73 GLU HG3 H 1 1.875 0.020 . 2 . . . . 73 GLU HG3 . 17416 1 856 . 1 1 73 73 GLU CA C 13 59.299 0.400 . 1 . . . . 73 GLU CA . 17416 1 857 . 1 1 73 73 GLU CB C 13 27.277 0.400 . 1 . . . . 73 GLU CB . 17416 1 858 . 1 1 73 73 GLU CG C 13 31.628 0.400 . 1 . . . . 73 GLU CG . 17416 1 859 . 1 1 73 73 GLU N N 15 119.848 0.400 . 1 . . . . 73 GLU N . 17416 1 860 . 1 1 74 74 HIS H H 1 8.223 0.020 . 1 . . . . 74 HIS H . 17416 1 861 . 1 1 74 74 HIS HA H 1 4.802 0.020 . 1 . . . . 74 HIS HA . 17416 1 862 . 1 1 74 74 HIS HB2 H 1 4.007 0.020 . 2 . . . . 74 HIS HB2 . 17416 1 863 . 1 1 74 74 HIS HB3 H 1 4.007 0.020 . 2 . . . . 74 HIS HB3 . 17416 1 864 . 1 1 74 74 HIS HD2 H 1 7.181 0.020 . 1 . . . . 74 HIS HD2 . 17416 1 865 . 1 1 74 74 HIS HE1 H 1 8.136 0.020 . 1 . . . . 74 HIS HE1 . 17416 1 866 . 1 1 74 74 HIS C C 13 171.359 0.400 . 1 . . . . 74 HIS C . 17416 1 867 . 1 1 74 74 HIS CA C 13 56.798 0.400 . 1 . . . . 74 HIS CA . 17416 1 868 . 1 1 74 74 HIS CB C 13 66.430 0.400 . 1 . . . . 74 HIS CB . 17416 1 869 . 1 1 74 74 HIS N N 15 117.409 0.400 . 1 . . . . 74 HIS N . 17416 1 870 . 1 1 75 75 ILE H H 1 8.425 0.020 . 1 . . . . 75 ILE H . 17416 1 871 . 1 1 75 75 ILE HA H 1 3.806 0.020 . 1 . . . . 75 ILE HA . 17416 1 872 . 1 1 75 75 ILE HB H 1 1.076 0.020 . 1 . . . . 75 ILE HB . 17416 1 873 . 1 1 75 75 ILE HG12 H 1 0.678 0.020 . 2 . . . . 75 ILE HG12 . 17416 1 874 . 1 1 75 75 ILE HG13 H 1 0.774 0.020 . 2 . . . . 75 ILE HG13 . 17416 1 875 . 1 1 75 75 ILE HG21 H 1 1.070 0.020 . 1 . . . . 75 ILE HG2 . 17416 1 876 . 1 1 75 75 ILE HG22 H 1 1.070 0.020 . 1 . . . . 75 ILE HG2 . 17416 1 877 . 1 1 75 75 ILE HG23 H 1 1.070 0.020 . 1 . . . . 75 ILE HG2 . 17416 1 878 . 1 1 75 75 ILE HD11 H 1 0.117 0.020 . 1 . . . . 75 ILE HD1 . 17416 1 879 . 1 1 75 75 ILE HD12 H 1 0.117 0.020 . 1 . . . . 75 ILE HD1 . 17416 1 880 . 1 1 75 75 ILE HD13 H 1 0.117 0.020 . 1 . . . . 75 ILE HD1 . 17416 1 881 . 1 1 75 75 ILE C C 13 176.423 0.400 . 1 . . . . 75 ILE C . 17416 1 882 . 1 1 75 75 ILE CA C 13 61.491 0.400 . 1 . . . . 75 ILE CA . 17416 1 883 . 1 1 75 75 ILE CB C 13 36.857 0.400 . 1 . . . . 75 ILE CB . 17416 1 884 . 1 1 75 75 ILE CG1 C 13 29.965 0.400 . 1 . . . . 75 ILE CG1 . 17416 1 885 . 1 1 75 75 ILE CG2 C 13 17.961 0.400 . 1 . . . . 75 ILE CG2 . 17416 1 886 . 1 1 75 75 ILE CD1 C 13 12.933 0.400 . 1 . . . . 75 ILE CD1 . 17416 1 887 . 1 1 75 75 ILE N N 15 118.218 0.400 . 1 . . . . 75 ILE N . 17416 1 888 . 1 1 76 76 LEU H H 1 7.691 0.020 . 1 . . . . 76 LEU H . 17416 1 889 . 1 1 76 76 LEU HA H 1 4.045 0.020 . 1 . . . . 76 LEU HA . 17416 1 890 . 1 1 76 76 LEU HB2 H 1 1.569 0.020 . 2 . . . . 76 LEU HB2 . 17416 1 891 . 1 1 76 76 LEU HB3 H 1 1.813 0.020 . 2 . . . . 76 LEU HB3 . 17416 1 892 . 1 1 76 76 LEU HG H 1 1.979 0.020 . 1 . . . . 76 LEU HG . 17416 1 893 . 1 1 76 76 LEU HD11 H 1 0.771 0.020 . 2 . . . . 76 LEU HD1 . 17416 1 894 . 1 1 76 76 LEU HD12 H 1 0.771 0.020 . 2 . . . . 76 LEU HD1 . 17416 1 895 . 1 1 76 76 LEU HD13 H 1 0.771 0.020 . 2 . . . . 76 LEU HD1 . 17416 1 896 . 1 1 76 76 LEU HD21 H 1 0.721 0.020 . 2 . . . . 76 LEU HD2 . 17416 1 897 . 1 1 76 76 LEU HD22 H 1 0.721 0.020 . 2 . . . . 76 LEU HD2 . 17416 1 898 . 1 1 76 76 LEU HD23 H 1 0.721 0.020 . 2 . . . . 76 LEU HD2 . 17416 1 899 . 1 1 76 76 LEU C C 13 178.276 0.400 . 1 . . . . 76 LEU C . 17416 1 900 . 1 1 76 76 LEU CA C 13 58.045 0.400 . 1 . . . . 76 LEU CA . 17416 1 901 . 1 1 76 76 LEU CB C 13 40.950 0.400 . 1 . . . . 76 LEU CB . 17416 1 902 . 1 1 76 76 LEU CG C 13 27.588 0.400 . 1 . . . . 76 LEU CG . 17416 1 903 . 1 1 76 76 LEU CD1 C 13 26.315 0.400 . 1 . . . . 76 LEU CD1 . 17416 1 904 . 1 1 76 76 LEU CD2 C 13 22.901 0.400 . 1 . . . . 76 LEU CD2 . 17416 1 905 . 1 1 76 76 LEU N N 15 120.370 0.400 . 1 . . . . 76 LEU N . 17416 1 906 . 1 1 77 77 SER H H 1 7.472 0.020 . 1 . . . . 77 SER H . 17416 1 907 . 1 1 77 77 SER HA H 1 3.505 0.020 . 1 . . . . 77 SER HA . 17416 1 908 . 1 1 77 77 SER HB2 H 1 3.212 0.020 . 2 . . . . 77 SER HB2 . 17416 1 909 . 1 1 77 77 SER HB3 H 1 3.002 0.020 . 2 . . . . 77 SER HB3 . 17416 1 910 . 1 1 77 77 SER C C 13 177.107 0.400 . 1 . . . . 77 SER C . 17416 1 911 . 1 1 77 77 SER CA C 13 61.174 0.400 . 1 . . . . 77 SER CA . 17416 1 912 . 1 1 77 77 SER CB C 13 61.769 0.400 . 1 . . . . 77 SER CB . 17416 1 913 . 1 1 77 77 SER N N 15 114.033 0.400 . 1 . . . . 77 SER N . 17416 1 914 . 1 1 78 78 VAL H H 1 7.306 0.020 . 1 . . . . 78 VAL H . 17416 1 915 . 1 1 78 78 VAL HA H 1 3.581 0.020 . 1 . . . . 78 VAL HA . 17416 1 916 . 1 1 78 78 VAL HB H 1 2.240 0.020 . 1 . . . . 78 VAL HB . 17416 1 917 . 1 1 78 78 VAL HG11 H 1 1.709 0.020 . 2 . . . . 78 VAL HG1 . 17416 1 918 . 1 1 78 78 VAL HG12 H 1 1.709 0.020 . 2 . . . . 78 VAL HG1 . 17416 1 919 . 1 1 78 78 VAL HG13 H 1 1.709 0.020 . 2 . . . . 78 VAL HG1 . 17416 1 920 . 1 1 78 78 VAL HG21 H 1 1.047 0.020 . 2 . . . . 78 VAL HG2 . 17416 1 921 . 1 1 78 78 VAL HG22 H 1 1.047 0.020 . 2 . . . . 78 VAL HG2 . 17416 1 922 . 1 1 78 78 VAL HG23 H 1 1.047 0.020 . 2 . . . . 78 VAL HG2 . 17416 1 923 . 1 1 78 78 VAL C C 13 177.106 0.400 . 1 . . . . 78 VAL C . 17416 1 924 . 1 1 78 78 VAL CA C 13 68.035 0.400 . 1 . . . . 78 VAL CA . 17416 1 925 . 1 1 78 78 VAL CB C 13 31.637 0.400 . 1 . . . . 78 VAL CB . 17416 1 926 . 1 1 78 78 VAL CG1 C 13 24.490 0.400 . 1 . . . . 78 VAL CG1 . 17416 1 927 . 1 1 78 78 VAL CG2 C 13 22.285 0.400 . 1 . . . . 78 VAL CG2 . 17416 1 928 . 1 1 78 78 VAL N N 15 114.966 0.400 . 1 . . . . 78 VAL N . 17416 1 929 . 1 1 79 79 LEU H H 1 7.734 0.020 . 1 . . . . 79 LEU H . 17416 1 930 . 1 1 79 79 LEU HA H 1 3.892 0.020 . 1 . . . . 79 LEU HA . 17416 1 931 . 1 1 79 79 LEU HB2 H 1 1.681 0.020 . 2 . . . . 79 LEU HB2 . 17416 1 932 . 1 1 79 79 LEU HB3 H 1 2.060 0.020 . 2 . . . . 79 LEU HB3 . 17416 1 933 . 1 1 79 79 LEU HG H 1 1.700 0.020 . 1 . . . . 79 LEU HG . 17416 1 934 . 1 1 79 79 LEU HD11 H 1 0.682 0.020 . 2 . . . . 79 LEU HD1 . 17416 1 935 . 1 1 79 79 LEU HD12 H 1 0.682 0.020 . 2 . . . . 79 LEU HD1 . 17416 1 936 . 1 1 79 79 LEU HD13 H 1 0.682 0.020 . 2 . . . . 79 LEU HD1 . 17416 1 937 . 1 1 79 79 LEU HD21 H 1 0.675 0.020 . 2 . . . . 79 LEU HD2 . 17416 1 938 . 1 1 79 79 LEU HD22 H 1 0.675 0.020 . 2 . . . . 79 LEU HD2 . 17416 1 939 . 1 1 79 79 LEU HD23 H 1 0.675 0.020 . 2 . . . . 79 LEU HD2 . 17416 1 940 . 1 1 79 79 LEU C C 13 177.302 0.400 . 1 . . . . 79 LEU C . 17416 1 941 . 1 1 79 79 LEU CA C 13 58.077 0.400 . 1 . . . . 79 LEU CA . 17416 1 942 . 1 1 79 79 LEU CB C 13 40.328 0.400 . 1 . . . . 79 LEU CB . 17416 1 943 . 1 1 79 79 LEU CG C 13 27.277 0.400 . 1 . . . . 79 LEU CG . 17416 1 944 . 1 1 79 79 LEU CD1 C 13 27.301 0.400 . 1 . . . . 79 LEU CD1 . 17416 1 945 . 1 1 79 79 LEU CD2 C 13 21.977 0.400 . 1 . . . . 79 LEU CD2 . 17416 1 946 . 1 1 79 79 LEU N N 15 115.819 0.400 . 1 . . . . 79 LEU N . 17416 1 947 . 1 1 80 80 HIS H H 1 8.269 0.020 . 1 . . . . 80 HIS H . 17416 1 948 . 1 1 80 80 HIS HA H 1 3.477 0.020 . 1 . . . . 80 HIS HA . 17416 1 949 . 1 1 80 80 HIS HB2 H 1 2.577 0.020 . 2 . . . . 80 HIS HB2 . 17416 1 950 . 1 1 80 80 HIS HB3 H 1 3.117 0.020 . 2 . . . . 80 HIS HB3 . 17416 1 951 . 1 1 80 80 HIS HD2 H 1 6.594 0.020 . 1 . . . . 80 HIS HD2 . 17416 1 952 . 1 1 80 80 HIS HE1 H 1 7.100 0.020 . 1 . . . . 80 HIS HE1 . 17416 1 953 . 1 1 80 80 HIS C C 13 179.539 0.400 . 1 . . . . 80 HIS C . 17416 1 954 . 1 1 80 80 HIS CA C 13 56.778 0.400 . 1 . . . . 80 HIS CA . 17416 1 955 . 1 1 80 80 HIS CB C 13 29.729 0.400 . 1 . . . . 80 HIS CB . 17416 1 956 . 1 1 80 80 HIS N N 15 119.970 0.400 . 1 . . . . 80 HIS N . 17416 1 957 . 1 1 81 81 LEU H H 1 8.697 0.020 . 1 . . . . 81 LEU H . 17416 1 958 . 1 1 81 81 LEU HA H 1 4.012 0.020 . 1 . . . . 81 LEU HA . 17416 1 959 . 1 1 81 81 LEU HB2 H 1 1.373 0.020 . 2 . . . . 81 LEU HB2 . 17416 1 960 . 1 1 81 81 LEU HB3 H 1 2.136 0.020 . 2 . . . . 81 LEU HB3 . 17416 1 961 . 1 1 81 81 LEU HG H 1 1.973 0.020 . 1 . . . . 81 LEU HG . 17416 1 962 . 1 1 81 81 LEU HD11 H 1 0.758 0.020 . 2 . . . . 81 LEU HD1 . 17416 1 963 . 1 1 81 81 LEU HD12 H 1 0.758 0.020 . 2 . . . . 81 LEU HD1 . 17416 1 964 . 1 1 81 81 LEU HD13 H 1 0.758 0.020 . 2 . . . . 81 LEU HD1 . 17416 1 965 . 1 1 81 81 LEU HD21 H 1 0.709 0.020 . 2 . . . . 81 LEU HD2 . 17416 1 966 . 1 1 81 81 LEU HD22 H 1 0.709 0.020 . 2 . . . . 81 LEU HD2 . 17416 1 967 . 1 1 81 81 LEU HD23 H 1 0.709 0.020 . 2 . . . . 81 LEU HD2 . 17416 1 968 . 1 1 81 81 LEU C C 13 179.246 0.400 . 1 . . . . 81 LEU C . 17416 1 969 . 1 1 81 81 LEU CA C 13 57.362 0.400 . 1 . . . . 81 LEU CA . 17416 1 970 . 1 1 81 81 LEU CB C 13 43.125 0.400 . 1 . . . . 81 LEU CB . 17416 1 971 . 1 1 81 81 LEU CG C 13 26.035 0.400 . 1 . . . . 81 LEU CG . 17416 1 972 . 1 1 81 81 LEU CD1 C 13 26.019 0.400 . 1 . . . . 81 LEU CD1 . 17416 1 973 . 1 1 81 81 LEU CD2 C 13 24.187 0.400 . 1 . . . . 81 LEU CD2 . 17416 1 974 . 1 1 81 81 LEU N N 15 118.748 0.400 . 1 . . . . 81 LEU N . 17416 1 975 . 1 1 82 82 LEU H H 1 7.654 0.020 . 1 . . . . 82 LEU H . 17416 1 976 . 1 1 82 82 LEU HA H 1 4.380 0.020 . 1 . . . . 82 LEU HA . 17416 1 977 . 1 1 82 82 LEU HB2 H 1 1.700 0.020 . 2 . . . . 82 LEU HB2 . 17416 1 978 . 1 1 82 82 LEU HB3 H 1 1.584 0.020 . 2 . . . . 82 LEU HB3 . 17416 1 979 . 1 1 82 82 LEU HG H 1 1.842 0.020 . 1 . . . . 82 LEU HG . 17416 1 980 . 1 1 82 82 LEU HD11 H 1 0.687 0.020 . 2 . . . . 82 LEU HD1 . 17416 1 981 . 1 1 82 82 LEU HD12 H 1 0.687 0.020 . 2 . . . . 82 LEU HD1 . 17416 1 982 . 1 1 82 82 LEU HD13 H 1 0.687 0.020 . 2 . . . . 82 LEU HD1 . 17416 1 983 . 1 1 82 82 LEU HD21 H 1 0.859 0.020 . 2 . . . . 82 LEU HD2 . 17416 1 984 . 1 1 82 82 LEU HD22 H 1 0.859 0.020 . 2 . . . . 82 LEU HD2 . 17416 1 985 . 1 1 82 82 LEU HD23 H 1 0.859 0.020 . 2 . . . . 82 LEU HD2 . 17416 1 986 . 1 1 82 82 LEU C C 13 174.476 0.400 . 1 . . . . 82 LEU C . 17416 1 987 . 1 1 82 82 LEU CA C 13 54.376 0.400 . 1 . . . . 82 LEU CA . 17416 1 988 . 1 1 82 82 LEU CB C 13 42.814 0.400 . 1 . . . . 82 LEU CB . 17416 1 989 . 1 1 82 82 LEU CG C 13 26.967 0.400 . 1 . . . . 82 LEU CG . 17416 1 990 . 1 1 82 82 LEU CD1 C 13 26.705 0.400 . 1 . . . . 82 LEU CD1 . 17416 1 991 . 1 1 82 82 LEU CD2 C 13 22.886 0.400 . 1 . . . . 82 LEU CD2 . 17416 1 992 . 1 1 82 82 LEU N N 15 115.533 0.400 . 1 . . . . 82 LEU N . 17416 1 993 . 1 1 83 83 GLU H H 1 7.903 0.020 . 1 . . . . 83 GLU H . 17416 1 994 . 1 1 83 83 GLU HA H 1 3.365 0.020 . 1 . . . . 83 GLU HA . 17416 1 995 . 1 1 83 83 GLU HB2 H 1 2.134 0.020 . 2 . . . . 83 GLU HB2 . 17416 1 996 . 1 1 83 83 GLU HB3 H 1 2.295 0.020 . 2 . . . . 83 GLU HB3 . 17416 1 997 . 1 1 83 83 GLU HG2 H 1 2.239 0.020 . 2 . . . . 83 GLU HG2 . 17416 1 998 . 1 1 83 83 GLU HG3 H 1 2.457 0.020 . 2 . . . . 83 GLU HG3 . 17416 1 999 . 1 1 83 83 GLU C C 13 174.770 0.400 . 1 . . . . 83 GLU C . 17416 1 1000 . 1 1 83 83 GLU CA C 13 58.069 0.400 . 1 . . . . 83 GLU CA . 17416 1 1001 . 1 1 83 83 GLU CB C 13 27.277 0.400 . 1 . . . . 83 GLU CB . 17416 1 1002 . 1 1 83 83 GLU CG C 13 37.892 0.400 . 1 . . . . 83 GLU CG . 17416 1 1003 . 1 1 83 83 GLU N N 15 116.611 0.400 . 1 . . . . 83 GLU N . 17416 1 1004 . 1 1 84 84 ILE H H 1 8.303 0.020 . 1 . . . . 84 ILE H . 17416 1 1005 . 1 1 84 84 ILE HA H 1 3.944 0.020 . 1 . . . . 84 ILE HA . 17416 1 1006 . 1 1 84 84 ILE HB H 1 1.962 0.020 . 1 . . . . 84 ILE HB . 17416 1 1007 . 1 1 84 84 ILE HG12 H 1 1.224 0.020 . 2 . . . . 84 ILE HG12 . 17416 1 1008 . 1 1 84 84 ILE HG13 H 1 1.395 0.020 . 2 . . . . 84 ILE HG13 . 17416 1 1009 . 1 1 84 84 ILE HG21 H 1 0.713 0.020 . 1 . . . . 84 ILE HG2 . 17416 1 1010 . 1 1 84 84 ILE HG22 H 1 0.713 0.020 . 1 . . . . 84 ILE HG2 . 17416 1 1011 . 1 1 84 84 ILE HG23 H 1 0.713 0.020 . 1 . . . . 84 ILE HG2 . 17416 1 1012 . 1 1 84 84 ILE HD11 H 1 0.552 0.020 . 1 . . . . 84 ILE HD1 . 17416 1 1013 . 1 1 84 84 ILE HD12 H 1 0.552 0.020 . 1 . . . . 84 ILE HD1 . 17416 1 1014 . 1 1 84 84 ILE HD13 H 1 0.552 0.020 . 1 . . . . 84 ILE HD1 . 17416 1 1015 . 1 1 84 84 ILE C C 13 177.107 0.400 . 1 . . . . 84 ILE C . 17416 1 1016 . 1 1 84 84 ILE CA C 13 60.154 0.400 . 1 . . . . 84 ILE CA . 17416 1 1017 . 1 1 84 84 ILE CB C 13 35.644 0.400 . 1 . . . . 84 ILE CB . 17416 1 1018 . 1 1 84 84 ILE CG1 C 13 26.755 0.400 . 1 . . . . 84 ILE CG1 . 17416 1 1019 . 1 1 84 84 ILE CG2 C 13 18.251 0.400 . 1 . . . . 84 ILE CG2 . 17416 1 1020 . 1 1 84 84 ILE CD1 C 13 11.130 0.400 . 1 . . . . 84 ILE CD1 . 17416 1 1021 . 1 1 84 84 ILE N N 15 115.777 0.400 . 1 . . . . 84 ILE N . 17416 1 1022 . 1 1 85 85 THR H H 1 8.217 0.020 . 1 . . . . 85 THR H . 17416 1 1023 . 1 1 85 85 THR HA H 1 4.479 0.020 . 1 . . . . 85 THR HA . 17416 1 1024 . 1 1 85 85 THR HB H 1 4.399 0.020 . 1 . . . . 85 THR HB . 17416 1 1025 . 1 1 85 85 THR HG1 H 1 3.010 0.020 . 1 . . . . 85 THR HG1 . 17416 1 1026 . 1 1 85 85 THR HG21 H 1 1.199 0.020 . 1 . . . . 85 THR HG2 . 17416 1 1027 . 1 1 85 85 THR HG22 H 1 1.199 0.020 . 1 . . . . 85 THR HG2 . 17416 1 1028 . 1 1 85 85 THR HG23 H 1 1.199 0.020 . 1 . . . . 85 THR HG2 . 17416 1 1029 . 1 1 85 85 THR C C 13 173.018 0.400 . 1 . . . . 85 THR C . 17416 1 1030 . 1 1 85 85 THR CA C 13 62.131 0.400 . 1 . . . . 85 THR CA . 17416 1 1031 . 1 1 85 85 THR CB C 13 71.544 0.400 . 1 . . . . 85 THR CB . 17416 1 1032 . 1 1 85 85 THR CG2 C 13 20.769 0.400 . 1 . . . . 85 THR CG2 . 17416 1 1033 . 1 1 85 85 THR N N 15 116.608 0.400 . 1 . . . . 85 THR N . 17416 1 1034 . 1 1 86 86 ASN H H 1 7.514 0.020 . 1 . . . . 86 ASN H . 17416 1 1035 . 1 1 86 86 ASN HA H 1 5.412 0.020 . 1 . . . . 86 ASN HA . 17416 1 1036 . 1 1 86 86 ASN HB2 H 1 2.663 0.020 . 2 . . . . 86 ASN HB2 . 17416 1 1037 . 1 1 86 86 ASN HB3 H 1 2.216 0.020 . 2 . . . . 86 ASN HB3 . 17416 1 1038 . 1 1 86 86 ASN C C 13 173.310 0.400 . 1 . . . . 86 ASN C . 17416 1 1039 . 1 1 86 86 ASN CA C 13 51.850 0.400 . 1 . . . . 86 ASN CA . 17416 1 1040 . 1 1 86 86 ASN CB C 13 42.788 0.400 . 1 . . . . 86 ASN CB . 17416 1 1041 . 1 1 86 86 ASN N N 15 118.616 0.400 . 1 . . . . 86 ASN N . 17416 1 1042 . 1 1 87 87 VAL H H 1 8.079 0.020 . 1 . . . . 87 VAL H . 17416 1 1043 . 1 1 87 87 VAL HA H 1 4.636 0.020 . 1 . . . . 87 VAL HA . 17416 1 1044 . 1 1 87 87 VAL HB H 1 1.956 0.020 . 1 . . . . 87 VAL HB . 17416 1 1045 . 1 1 87 87 VAL HG11 H 1 0.891 0.020 . 2 . . . . 87 VAL HG1 . 17416 1 1046 . 1 1 87 87 VAL HG12 H 1 0.891 0.020 . 2 . . . . 87 VAL HG1 . 17416 1 1047 . 1 1 87 87 VAL HG13 H 1 0.891 0.020 . 2 . . . . 87 VAL HG1 . 17416 1 1048 . 1 1 87 87 VAL HG21 H 1 0.771 0.020 . 2 . . . . 87 VAL HG2 . 17416 1 1049 . 1 1 87 87 VAL HG22 H 1 0.771 0.020 . 2 . . . . 87 VAL HG2 . 17416 1 1050 . 1 1 87 87 VAL HG23 H 1 0.771 0.020 . 2 . . . . 87 VAL HG2 . 17416 1 1051 . 1 1 87 87 VAL C C 13 173.697 0.400 . 1 . . . . 87 VAL C . 17416 1 1052 . 1 1 87 87 VAL CA C 13 61.498 0.400 . 1 . . . . 87 VAL CA . 17416 1 1053 . 1 1 87 87 VAL CB C 13 37.475 0.400 . 1 . . . . 87 VAL CB . 17416 1 1054 . 1 1 87 87 VAL CG1 C 13 25.099 0.400 . 1 . . . . 87 VAL CG1 . 17416 1 1055 . 1 1 87 87 VAL CG2 C 13 21.681 0.400 . 1 . . . . 87 VAL CG2 . 17416 1 1056 . 1 1 87 87 VAL N N 15 120.389 0.400 . 1 . . . . 87 VAL N . 17416 1 1057 . 1 1 88 88 THR H H 1 8.219 0.020 . 1 . . . . 88 THR H . 17416 1 1058 . 1 1 88 88 THR HA H 1 5.170 0.020 . 1 . . . . 88 THR HA . 17416 1 1059 . 1 1 88 88 THR HB H 1 3.908 0.020 . 1 . . . . 88 THR HB . 17416 1 1060 . 1 1 88 88 THR HG21 H 1 1.060 0.020 . 1 . . . . 88 THR HG2 . 17416 1 1061 . 1 1 88 88 THR HG22 H 1 1.060 0.020 . 1 . . . . 88 THR HG2 . 17416 1 1062 . 1 1 88 88 THR HG23 H 1 1.060 0.020 . 1 . . . . 88 THR HG2 . 17416 1 1063 . 1 1 88 88 THR C C 13 173.796 0.400 . 1 . . . . 88 THR C . 17416 1 1064 . 1 1 88 88 THR CA C 13 61.505 0.400 . 1 . . . . 88 THR CA . 17416 1 1065 . 1 1 88 88 THR CB C 13 69.842 0.400 . 1 . . . . 88 THR CB . 17416 1 1066 . 1 1 88 88 THR CG2 C 13 23.579 0.400 . 1 . . . . 88 THR CG2 . 17416 1 1067 . 1 1 88 88 THR N N 15 119.786 0.400 . 1 . . . . 88 THR N . 17416 1 1068 . 1 1 89 89 ILE H H 1 9.299 0.020 . 1 . . . . 89 ILE H . 17416 1 1069 . 1 1 89 89 ILE HA H 1 4.579 0.020 . 1 . . . . 89 ILE HA . 17416 1 1070 . 1 1 89 89 ILE HB H 1 1.504 0.020 . 1 . . . . 89 ILE HB . 17416 1 1071 . 1 1 89 89 ILE HG12 H 1 0.540 0.020 . 2 . . . . 89 ILE HG12 . 17416 1 1072 . 1 1 89 89 ILE HG13 H 1 1.148 0.020 . 2 . . . . 89 ILE HG13 . 17416 1 1073 . 1 1 89 89 ILE HG21 H 1 0.809 0.020 . 1 . . . . 89 ILE HG2 . 17416 1 1074 . 1 1 89 89 ILE HG22 H 1 0.809 0.020 . 1 . . . . 89 ILE HG2 . 17416 1 1075 . 1 1 89 89 ILE HG23 H 1 0.809 0.020 . 1 . . . . 89 ILE HG2 . 17416 1 1076 . 1 1 89 89 ILE HD11 H 1 0.071 0.020 . 1 . . . . 89 ILE HD1 . 17416 1 1077 . 1 1 89 89 ILE HD12 H 1 0.071 0.020 . 1 . . . . 89 ILE HD1 . 17416 1 1078 . 1 1 89 89 ILE HD13 H 1 0.071 0.020 . 1 . . . . 89 ILE HD1 . 17416 1 1079 . 1 1 89 89 ILE C C 13 174.474 0.400 . 1 . . . . 89 ILE C . 17416 1 1080 . 1 1 89 89 ILE CA C 13 60.182 0.400 . 1 . . . . 89 ILE CA . 17416 1 1081 . 1 1 89 89 ILE CB C 13 37.236 0.400 . 1 . . . . 89 ILE CB . 17416 1 1082 . 1 1 89 89 ILE CG1 C 13 27.641 0.400 . 1 . . . . 89 ILE CG1 . 17416 1 1083 . 1 1 89 89 ILE CG2 C 13 19.460 0.400 . 1 . . . . 89 ILE CG2 . 17416 1 1084 . 1 1 89 89 ILE CD1 C 13 13.939 0.400 . 1 . . . . 89 ILE CD1 . 17416 1 1085 . 1 1 89 89 ILE N N 15 128.751 0.400 . 1 . . . . 89 ILE N . 17416 1 1086 . 1 1 90 90 GLU H H 1 9.958 0.020 . 1 . . . . 90 GLU H . 17416 1 1087 . 1 1 90 90 GLU HA H 1 5.417 0.020 . 1 . . . . 90 GLU HA . 17416 1 1088 . 1 1 90 90 GLU HB2 H 1 1.774 0.020 . 2 . . . . 90 GLU HB2 . 17416 1 1089 . 1 1 90 90 GLU HB3 H 1 2.041 0.020 . 2 . . . . 90 GLU HB3 . 17416 1 1090 . 1 1 90 90 GLU HG2 H 1 2.708 0.020 . 2 . . . . 90 GLU HG2 . 17416 1 1091 . 1 1 90 90 GLU HG3 H 1 2.708 0.020 . 2 . . . . 90 GLU HG3 . 17416 1 1092 . 1 1 90 90 GLU C C 13 175.158 0.400 . 1 . . . . 90 GLU C . 17416 1 1093 . 1 1 90 90 GLU CA C 13 55.244 0.400 . 1 . . . . 90 GLU CA . 17416 1 1094 . 1 1 90 90 GLU N N 15 132.138 0.400 . 1 . . . . 90 GLU N . 17416 1 1095 . 1 1 91 91 VAL H H 1 8.938 0.020 . 1 . . . . 91 VAL H . 17416 1 1096 . 1 1 91 91 VAL HA H 1 4.656 0.020 . 1 . . . . 91 VAL HA . 17416 1 1097 . 1 1 91 91 VAL HB H 1 1.944 0.020 . 1 . . . . 91 VAL HB . 17416 1 1098 . 1 1 91 91 VAL HG11 H 1 0.672 0.020 . 2 . . . . 91 VAL HG1 . 17416 1 1099 . 1 1 91 91 VAL HG12 H 1 0.672 0.020 . 2 . . . . 91 VAL HG1 . 17416 1 1100 . 1 1 91 91 VAL HG13 H 1 0.672 0.020 . 2 . . . . 91 VAL HG1 . 17416 1 1101 . 1 1 91 91 VAL HG21 H 1 1.081 0.020 . 2 . . . . 91 VAL HG2 . 17416 1 1102 . 1 1 91 91 VAL HG22 H 1 1.081 0.020 . 2 . . . . 91 VAL HG2 . 17416 1 1103 . 1 1 91 91 VAL HG23 H 1 1.081 0.020 . 2 . . . . 91 VAL HG2 . 17416 1 1104 . 1 1 91 91 VAL C C 13 174.672 0.400 . 1 . . . . 91 VAL C . 17416 1 1105 . 1 1 91 91 VAL CA C 13 61.228 0.400 . 1 . . . . 91 VAL CA . 17416 1 1106 . 1 1 91 91 VAL CB C 13 33.886 0.400 . 1 . . . . 91 VAL CB . 17416 1 1107 . 1 1 91 91 VAL CG1 C 13 19.892 0.400 . 1 . . . . 91 VAL CG1 . 17416 1 1108 . 1 1 91 91 VAL CG2 C 13 22.283 0.400 . 1 . . . . 91 VAL CG2 . 17416 1 1109 . 1 1 91 91 VAL N N 15 127.363 0.400 . 1 . . . . 91 VAL N . 17416 1 1110 . 1 1 92 92 ILE H H 1 9.281 0.020 . 1 . . . . 92 ILE H . 17416 1 1111 . 1 1 92 92 ILE HA H 1 4.375 0.020 . 1 . . . . 92 ILE HA . 17416 1 1112 . 1 1 92 92 ILE HB H 1 2.079 0.020 . 1 . . . . 92 ILE HB . 17416 1 1113 . 1 1 92 92 ILE HG12 H 1 1.230 0.020 . 2 . . . . 92 ILE HG12 . 17416 1 1114 . 1 1 92 92 ILE HG13 H 1 1.491 0.020 . 2 . . . . 92 ILE HG13 . 17416 1 1115 . 1 1 92 92 ILE HG21 H 1 1.014 0.020 . 1 . . . . 92 ILE HG2 . 17416 1 1116 . 1 1 92 92 ILE HG22 H 1 1.014 0.020 . 1 . . . . 92 ILE HG2 . 17416 1 1117 . 1 1 92 92 ILE HG23 H 1 1.014 0.020 . 1 . . . . 92 ILE HG2 . 17416 1 1118 . 1 1 92 92 ILE HD11 H 1 0.894 0.020 . 1 . . . . 92 ILE HD1 . 17416 1 1119 . 1 1 92 92 ILE HD12 H 1 0.894 0.020 . 1 . . . . 92 ILE HD1 . 17416 1 1120 . 1 1 92 92 ILE HD13 H 1 0.894 0.020 . 1 . . . . 92 ILE HD1 . 17416 1 1121 . 1 1 92 92 ILE C C 13 175.452 0.400 . 1 . . . . 92 ILE C . 17416 1 1122 . 1 1 92 92 ILE CA C 13 60.774 0.400 . 1 . . . . 92 ILE CA . 17416 1 1123 . 1 1 92 92 ILE CB C 13 37.062 0.400 . 1 . . . . 92 ILE CB . 17416 1 1124 . 1 1 92 92 ILE CG1 C 13 27.658 0.400 . 1 . . . . 92 ILE CG1 . 17416 1 1125 . 1 1 92 92 ILE CG2 C 13 18.254 0.400 . 1 . . . . 92 ILE CG2 . 17416 1 1126 . 1 1 92 92 ILE CD1 C 13 13.964 0.400 . 1 . . . . 92 ILE CD1 . 17416 1 1127 . 1 1 92 92 ILE N N 15 130.869 0.400 . 1 . . . . 92 ILE N . 17416 1 1128 . 1 1 93 93 GLY H H 1 7.801 0.020 . 1 . . . . 93 GLY H . 17416 1 1129 . 1 1 93 93 GLY HA2 H 1 4.839 0.020 . 2 . . . . 93 GLY HA2 . 17416 1 1130 . 1 1 93 93 GLY HA3 H 1 3.921 0.020 . 2 . . . . 93 GLY HA3 . 17416 1 1131 . 1 1 93 93 GLY C C 13 173.309 0.400 . 1 . . . . 93 GLY C . 17416 1 1132 . 1 1 93 93 GLY CA C 13 43.734 0.400 . 1 . . . . 93 GLY CA . 17416 1 1133 . 1 1 93 93 GLY N N 15 111.731 0.400 . 1 . . . . 93 GLY N . 17416 1 1134 . 1 1 94 94 ASN H H 1 8.955 0.020 . 1 . . . . 94 ASN H . 17416 1 1135 . 1 1 94 94 ASN HA H 1 4.833 0.020 . 1 . . . . 94 ASN HA . 17416 1 1136 . 1 1 94 94 ASN HB2 H 1 2.596 0.020 . 2 . . . . 94 ASN HB2 . 17416 1 1137 . 1 1 94 94 ASN HB3 H 1 2.892 0.020 . 2 . . . . 94 ASN HB3 . 17416 1 1138 . 1 1 94 94 ASN C C 13 174.671 0.400 . 1 . . . . 94 ASN C . 17416 1 1139 . 1 1 94 94 ASN CA C 13 53.339 0.400 . 1 . . . . 94 ASN CA . 17416 1 1140 . 1 1 94 94 ASN CB C 13 40.431 0.400 . 1 . . . . 94 ASN CB . 17416 1 1141 . 1 1 94 94 ASN N N 15 114.584 0.400 . 1 . . . . 94 ASN N . 17416 1 1142 . 1 1 95 95 GLU H H 1 7.454 0.020 . 1 . . . . 95 GLU H . 17416 1 1143 . 1 1 95 95 GLU HA H 1 4.863 0.020 . 1 . . . . 95 GLU HA . 17416 1 1144 . 1 1 95 95 GLU HB2 H 1 1.611 0.020 . 2 . . . . 95 GLU HB2 . 17416 1 1145 . 1 1 95 95 GLU HB3 H 1 1.611 0.020 . 2 . . . . 95 GLU HB3 . 17416 1 1146 . 1 1 95 95 GLU HG2 H 1 2.355 0.020 . 2 . . . . 95 GLU HG2 . 17416 1 1147 . 1 1 95 95 GLU HG3 H 1 2.641 0.020 . 2 . . . . 95 GLU HG3 . 17416 1 1148 . 1 1 95 95 GLU C C 13 173.502 0.400 . 1 . . . . 95 GLU C . 17416 1 1149 . 1 1 95 95 GLU CA C 13 54.004 0.400 . 1 . . . . 95 GLU CA . 17416 1 1150 . 1 1 95 95 GLU CG C 13 34.735 0.400 . 1 . . . . 95 GLU CG . 17416 1 1151 . 1 1 95 95 GLU N N 15 120.925 0.400 . 1 . . . . 95 GLU N . 17416 1 1152 . 1 1 96 96 ILE H H 1 7.522 0.020 . 1 . . . . 96 ILE H . 17416 1 1153 . 1 1 96 96 ILE HA H 1 4.102 0.020 . 1 . . . . 96 ILE HA . 17416 1 1154 . 1 1 96 96 ILE HB H 1 2.549 0.020 . 1 . . . . 96 ILE HB . 17416 1 1155 . 1 1 96 96 ILE HG12 H 1 1.657 0.020 . 2 . . . . 96 ILE HG12 . 17416 1 1156 . 1 1 96 96 ILE HG13 H 1 1.657 0.020 . 2 . . . . 96 ILE HG13 . 17416 1 1157 . 1 1 96 96 ILE HG21 H 1 1.241 0.020 . 1 . . . . 96 ILE HG2 . 17416 1 1158 . 1 1 96 96 ILE HG22 H 1 1.241 0.020 . 1 . . . . 96 ILE HG2 . 17416 1 1159 . 1 1 96 96 ILE HG23 H 1 1.241 0.020 . 1 . . . . 96 ILE HG2 . 17416 1 1160 . 1 1 96 96 ILE HD11 H 1 0.726 0.020 . 1 . . . . 96 ILE HD1 . 17416 1 1161 . 1 1 96 96 ILE HD12 H 1 0.726 0.020 . 1 . . . . 96 ILE HD1 . 17416 1 1162 . 1 1 96 96 ILE HD13 H 1 0.726 0.020 . 1 . . . . 96 ILE HD1 . 17416 1 1163 . 1 1 96 96 ILE CA C 13 56.735 0.400 . 1 . . . . 96 ILE CA . 17416 1 1164 . 1 1 96 96 ILE CB C 13 35.059 0.400 . 1 . . . . 96 ILE CB . 17416 1 1165 . 1 1 96 96 ILE CG1 C 13 27.630 0.400 . 1 . . . . 96 ILE CG1 . 17416 1 1166 . 1 1 96 96 ILE CG2 C 13 16.744 0.400 . 1 . . . . 96 ILE CG2 . 17416 1 1167 . 1 1 96 96 ILE CD1 C 13 10.219 0.400 . 1 . . . . 96 ILE CD1 . 17416 1 1168 . 1 1 96 96 ILE N N 15 124.849 0.400 . 1 . . . . 96 ILE N . 17416 1 1169 . 1 1 97 97 PRO HA H 1 3.935 0.020 . 1 . . . . 97 PRO HA . 17416 1 1170 . 1 1 97 97 PRO HB2 H 1 1.616 0.020 . 2 . . . . 97 PRO HB2 . 17416 1 1171 . 1 1 97 97 PRO HB3 H 1 1.892 0.020 . 2 . . . . 97 PRO HB3 . 17416 1 1172 . 1 1 97 97 PRO HG2 H 1 1.689 0.020 . 2 . . . . 97 PRO HG2 . 17416 1 1173 . 1 1 97 97 PRO HG3 H 1 1.898 0.020 . 2 . . . . 97 PRO HG3 . 17416 1 1174 . 1 1 97 97 PRO HD2 H 1 3.565 0.020 . 2 . . . . 97 PRO HD2 . 17416 1 1175 . 1 1 97 97 PRO HD3 H 1 3.765 0.020 . 2 . . . . 97 PRO HD3 . 17416 1 1176 . 1 1 97 97 PRO C C 13 175.939 0.400 . 1 . . . . 97 PRO C . 17416 1 1177 . 1 1 97 97 PRO CA C 13 63.276 0.400 . 1 . . . . 97 PRO CA . 17416 1 1178 . 1 1 97 97 PRO CB C 13 32.224 0.400 . 1 . . . . 97 PRO CB . 17416 1 1179 . 1 1 97 97 PRO CG C 13 27.335 0.400 . 1 . . . . 97 PRO CG . 17416 1 1180 . 1 1 97 97 PRO CD C 13 50.582 0.400 . 1 . . . . 97 PRO CD . 17416 1 1181 . 1 1 98 98 ILE H H 1 8.264 0.020 . 1 . . . . 98 ILE H . 17416 1 1182 . 1 1 98 98 ILE HA H 1 4.540 0.020 . 1 . . . . 98 ILE HA . 17416 1 1183 . 1 1 98 98 ILE HB H 1 2.146 0.020 . 1 . . . . 98 ILE HB . 17416 1 1184 . 1 1 98 98 ILE HG12 H 1 1.329 0.020 . 2 . . . . 98 ILE HG12 . 17416 1 1185 . 1 1 98 98 ILE HG13 H 1 1.499 0.020 . 2 . . . . 98 ILE HG13 . 17416 1 1186 . 1 1 98 98 ILE HG21 H 1 0.920 0.020 . 1 . . . . 98 ILE HG2 . 17416 1 1187 . 1 1 98 98 ILE HG22 H 1 0.920 0.020 . 1 . . . . 98 ILE HG2 . 17416 1 1188 . 1 1 98 98 ILE HG23 H 1 0.920 0.020 . 1 . . . . 98 ILE HG2 . 17416 1 1189 . 1 1 98 98 ILE HD11 H 1 1.181 0.020 . 1 . . . . 98 ILE HD1 . 17416 1 1190 . 1 1 98 98 ILE HD12 H 1 1.181 0.020 . 1 . . . . 98 ILE HD1 . 17416 1 1191 . 1 1 98 98 ILE HD13 H 1 1.181 0.020 . 1 . . . . 98 ILE HD1 . 17416 1 1192 . 1 1 98 98 ILE C C 13 176.425 0.400 . 1 . . . . 98 ILE C . 17416 1 1193 . 1 1 98 98 ILE CA C 13 57.043 0.400 . 1 . . . . 98 ILE CA . 17416 1 1194 . 1 1 98 98 ILE CB C 13 39.073 0.400 . 1 . . . . 98 ILE CB . 17416 1 1195 . 1 1 98 98 ILE CG2 C 13 18.887 0.400 . 1 . . . . 98 ILE CG2 . 17416 1 1196 . 1 1 98 98 ILE CD1 C 13 13.341 0.400 . 1 . . . . 98 ILE CD1 . 17416 1 1197 . 1 1 98 98 ILE N N 15 121.602 0.400 . 1 . . . . 98 ILE N . 17416 1 1198 . 1 1 99 99 LEU H H 1 9.195 0.020 . 1 . . . . 99 LEU H . 17416 1 1199 . 1 1 99 99 LEU HA H 1 3.884 0.020 . 1 . . . . 99 LEU HA . 17416 1 1200 . 1 1 99 99 LEU HB2 H 1 1.375 0.020 . 2 . . . . 99 LEU HB2 . 17416 1 1201 . 1 1 99 99 LEU HB3 H 1 2.170 0.020 . 2 . . . . 99 LEU HB3 . 17416 1 1202 . 1 1 99 99 LEU HG H 1 1.187 0.020 . 1 . . . . 99 LEU HG . 17416 1 1203 . 1 1 99 99 LEU HD11 H 1 0.008 0.020 . 2 . . . . 99 LEU HD1 . 17416 1 1204 . 1 1 99 99 LEU HD12 H 1 0.008 0.020 . 2 . . . . 99 LEU HD1 . 17416 1 1205 . 1 1 99 99 LEU HD13 H 1 0.008 0.020 . 2 . . . . 99 LEU HD1 . 17416 1 1206 . 1 1 99 99 LEU HD21 H 1 0.766 0.020 . 2 . . . . 99 LEU HD2 . 17416 1 1207 . 1 1 99 99 LEU HD22 H 1 0.766 0.020 . 2 . . . . 99 LEU HD2 . 17416 1 1208 . 1 1 99 99 LEU HD23 H 1 0.766 0.020 . 2 . . . . 99 LEU HD2 . 17416 1 1209 . 1 1 99 99 LEU C C 13 176.326 0.400 . 1 . . . . 99 LEU C . 17416 1 1210 . 1 1 99 99 LEU CA C 13 56.152 0.400 . 1 . . . . 99 LEU CA . 17416 1 1211 . 1 1 99 99 LEU CB C 13 35.951 0.400 . 1 . . . . 99 LEU CB . 17416 1 1212 . 1 1 99 99 LEU CG C 13 26.519 0.400 . 1 . . . . 99 LEU CG . 17416 1 1213 . 1 1 99 99 LEU CD1 C 13 26.001 0.400 . 1 . . . . 99 LEU CD1 . 17416 1 1214 . 1 1 99 99 LEU CD2 C 13 22.558 0.400 . 1 . . . . 99 LEU CD2 . 17416 1 1215 . 1 1 99 99 LEU N N 15 124.290 0.400 . 1 . . . . 99 LEU N . 17416 1 1216 . 1 1 100 100 ASP H H 1 7.456 0.020 . 1 . . . . 100 ASP H . 17416 1 1217 . 1 1 100 100 ASP HA H 1 4.841 0.020 . 1 . . . . 100 ASP HA . 17416 1 1218 . 1 1 100 100 ASP HB2 H 1 2.822 0.020 . 2 . . . . 100 ASP HB2 . 17416 1 1219 . 1 1 100 100 ASP HB3 H 1 3.263 0.020 . 2 . . . . 100 ASP HB3 . 17416 1 1220 . 1 1 100 100 ASP C C 13 175.934 0.400 . 1 . . . . 100 ASP C . 17416 1 1221 . 1 1 100 100 ASP CA C 13 53.650 0.400 . 1 . . . . 100 ASP CA . 17416 1 1222 . 1 1 100 100 ASP CB C 13 41.250 0.400 . 1 . . . . 100 ASP CB . 17416 1 1223 . 1 1 100 100 ASP N N 15 121.714 0.400 . 1 . . . . 100 ASP N . 17416 1 1224 . 1 1 101 101 GLY H H 1 8.267 0.020 . 1 . . . . 101 GLY H . 17416 1 1225 . 1 1 101 101 GLY HA2 H 1 3.518 0.020 . 2 . . . . 101 GLY HA2 . 17416 1 1226 . 1 1 101 101 GLY HA3 H 1 4.907 0.020 . 2 . . . . 101 GLY HA3 . 17416 1 1227 . 1 1 101 101 GLY C C 13 173.989 0.400 . 1 . . . . 101 GLY C . 17416 1 1228 . 1 1 101 101 GLY CA C 13 45.916 0.400 . 1 . . . . 101 GLY CA . 17416 1 1229 . 1 1 101 101 GLY N N 15 105.798 0.400 . 1 . . . . 101 GLY N . 17416 1 1230 . 1 1 102 102 SER H H 1 8.577 0.020 . 1 . . . . 102 SER H . 17416 1 1231 . 1 1 102 102 SER HA H 1 4.881 0.020 . 1 . . . . 102 SER HA . 17416 1 1232 . 1 1 102 102 SER HB2 H 1 3.057 0.020 . 2 . . . . 102 SER HB2 . 17416 1 1233 . 1 1 102 102 SER HB3 H 1 3.893 0.020 . 2 . . . . 102 SER HB3 . 17416 1 1234 . 1 1 102 102 SER C C 13 175.739 0.400 . 1 . . . . 102 SER C . 17416 1 1235 . 1 1 102 102 SER CA C 13 56.156 0.400 . 1 . . . . 102 SER CA . 17416 1 1236 . 1 1 102 102 SER CB C 13 67.659 0.400 . 1 . . . . 102 SER CB . 17416 1 1237 . 1 1 102 102 SER N N 15 118.349 0.400 . 1 . . . . 102 SER N . 17416 1 1238 . 1 1 103 103 GLY H H 1 8.410 0.020 . 1 . . . . 103 GLY H . 17416 1 1239 . 1 1 103 103 GLY HA2 H 1 4.549 0.020 . 2 . . . . 103 GLY HA2 . 17416 1 1240 . 1 1 103 103 GLY HA3 H 1 3.543 0.020 . 2 . . . . 103 GLY HA3 . 17416 1 1241 . 1 1 103 103 GLY C C 13 174.671 0.400 . 1 . . . . 103 GLY C . 17416 1 1242 . 1 1 103 103 GLY CA C 13 46.244 0.400 . 1 . . . . 103 GLY CA . 17416 1 1243 . 1 1 103 103 GLY N N 15 108.523 0.400 . 1 . . . . 103 GLY N . 17416 1 1244 . 1 1 104 104 TRP H H 1 8.762 0.020 . 1 . . . . 104 TRP H . 17416 1 1245 . 1 1 104 104 TRP HA H 1 4.243 0.020 . 1 . . . . 104 TRP HA . 17416 1 1246 . 1 1 104 104 TRP HB2 H 1 3.390 0.020 . 2 . . . . 104 TRP HB2 . 17416 1 1247 . 1 1 104 104 TRP HB3 H 1 3.152 0.020 . 2 . . . . 104 TRP HB3 . 17416 1 1248 . 1 1 104 104 TRP HD1 H 1 7.118 0.020 . 1 . . . . 104 TRP HD1 . 17416 1 1249 . 1 1 104 104 TRP HE1 H 1 9.965 0.020 . 1 . . . . 104 TRP HE1 . 17416 1 1250 . 1 1 104 104 TRP HE3 H 1 7.345 0.020 . 1 . . . . 104 TRP HE3 . 17416 1 1251 . 1 1 104 104 TRP HZ2 H 1 7.425 0.020 . 1 . . . . 104 TRP HZ2 . 17416 1 1252 . 1 1 104 104 TRP HZ3 H 1 6.809 0.020 . 1 . . . . 104 TRP HZ3 . 17416 1 1253 . 1 1 104 104 TRP C C 13 176.038 0.400 . 1 . . . . 104 TRP C . 17416 1 1254 . 1 1 104 104 TRP CA C 13 61.491 0.400 . 1 . . . . 104 TRP CA . 17416 1 1255 . 1 1 104 104 TRP CB C 13 31.304 0.400 . 1 . . . . 104 TRP CB . 17416 1 1256 . 1 1 104 104 TRP N N 15 124.015 0.400 . 1 . . . . 104 TRP N . 17416 1 1257 . 1 1 104 104 TRP NE1 N 15 128.204 0.400 . 1 . . . . 104 TRP NE1 . 17416 1 1258 . 1 1 105 105 GLU H H 1 9.101 0.020 . 1 . . . . 105 GLU H . 17416 1 1259 . 1 1 105 105 GLU HA H 1 3.685 0.020 . 1 . . . . 105 GLU HA . 17416 1 1260 . 1 1 105 105 GLU HB2 H 1 1.917 0.020 . 2 . . . . 105 GLU HB2 . 17416 1 1261 . 1 1 105 105 GLU HB3 H 1 1.917 0.020 . 2 . . . . 105 GLU HB3 . 17416 1 1262 . 1 1 105 105 GLU HG2 H 1 2.236 0.020 . 2 . . . . 105 GLU HG2 . 17416 1 1263 . 1 1 105 105 GLU HG3 H 1 2.382 0.020 . 2 . . . . 105 GLU HG3 . 17416 1 1264 . 1 1 105 105 GLU C C 13 180.710 0.400 . 1 . . . . 105 GLU C . 17416 1 1265 . 1 1 105 105 GLU CA C 13 59.883 0.400 . 1 . . . . 105 GLU CA . 17416 1 1266 . 1 1 105 105 GLU CB C 13 28.805 0.400 . 1 . . . . 105 GLU CB . 17416 1 1267 . 1 1 105 105 GLU CG C 13 37.297 0.400 . 1 . . . . 105 GLU CG . 17416 1 1268 . 1 1 105 105 GLU N N 15 115.937 0.400 . 1 . . . . 105 GLU N . 17416 1 1269 . 1 1 106 106 PHE H H 1 6.817 0.020 . 1 . . . . 106 PHE H . 17416 1 1270 . 1 1 106 106 PHE HA H 1 4.319 0.020 . 1 . . . . 106 PHE HA . 17416 1 1271 . 1 1 106 106 PHE HB2 H 1 3.111 0.020 . 2 . . . . 106 PHE HB2 . 17416 1 1272 . 1 1 106 106 PHE HB3 H 1 2.830 0.020 . 2 . . . . 106 PHE HB3 . 17416 1 1273 . 1 1 106 106 PHE HD1 H 1 6.203 0.020 . 1 . . . . 106 PHE HD1 . 17416 1 1274 . 1 1 106 106 PHE HD2 H 1 6.203 0.020 . 1 . . . . 106 PHE HD2 . 17416 1 1275 . 1 1 106 106 PHE HE1 H 1 6.915 0.020 . 1 . . . . 106 PHE HE1 . 17416 1 1276 . 1 1 106 106 PHE HE2 H 1 6.915 0.020 . 1 . . . . 106 PHE HE2 . 17416 1 1277 . 1 1 106 106 PHE HZ H 1 7.217 0.020 . 1 . . . . 106 PHE HZ . 17416 1 1278 . 1 1 106 106 PHE C C 13 176.425 0.400 . 1 . . . . 106 PHE C . 17416 1 1279 . 1 1 106 106 PHE CA C 13 58.679 0.400 . 1 . . . . 106 PHE CA . 17416 1 1280 . 1 1 106 106 PHE CB C 13 39.680 0.400 . 1 . . . . 106 PHE CB . 17416 1 1281 . 1 1 106 106 PHE N N 15 113.463 0.400 . 1 . . . . 106 PHE N . 17416 1 1282 . 1 1 107 107 TYR H H 1 8.523 0.020 . 1 . . . . 107 TYR H . 17416 1 1283 . 1 1 107 107 TYR HA H 1 3.778 0.020 . 1 . . . . 107 TYR HA . 17416 1 1284 . 1 1 107 107 TYR HB2 H 1 2.902 0.020 . 2 . . . . 107 TYR HB2 . 17416 1 1285 . 1 1 107 107 TYR HB3 H 1 3.091 0.020 . 2 . . . . 107 TYR HB3 . 17416 1 1286 . 1 1 107 107 TYR HD1 H 1 6.865 0.020 . 1 . . . . 107 TYR HD1 . 17416 1 1287 . 1 1 107 107 TYR HD2 H 1 6.865 0.020 . 1 . . . . 107 TYR HD2 . 17416 1 1288 . 1 1 107 107 TYR HE1 H 1 6.827 0.020 . 1 . . . . 107 TYR HE1 . 17416 1 1289 . 1 1 107 107 TYR HE2 H 1 6.827 0.020 . 1 . . . . 107 TYR HE2 . 17416 1 1290 . 1 1 107 107 TYR C C 13 175.836 0.400 . 1 . . . . 107 TYR C . 17416 1 1291 . 1 1 107 107 TYR CA C 13 61.799 0.400 . 1 . . . . 107 TYR CA . 17416 1 1292 . 1 1 107 107 TYR CB C 13 39.684 0.400 . 1 . . . . 107 TYR CB . 17416 1 1293 . 1 1 107 107 TYR N N 15 119.672 0.400 . 1 . . . . 107 TYR N . 17416 1 1294 . 1 1 108 108 GLU H H 1 8.709 0.020 . 1 . . . . 108 GLU H . 17416 1 1295 . 1 1 108 108 GLU HA H 1 3.554 0.020 . 1 . . . . 108 GLU HA . 17416 1 1296 . 1 1 108 108 GLU HB2 H 1 1.393 0.020 . 2 . . . . 108 GLU HB2 . 17416 1 1297 . 1 1 108 108 GLU HB3 H 1 1.072 0.020 . 2 . . . . 108 GLU HB3 . 17416 1 1298 . 1 1 108 108 GLU HG2 H 1 1.769 0.020 . 2 . . . . 108 GLU HG2 . 17416 1 1299 . 1 1 108 108 GLU HG3 H 1 1.769 0.020 . 2 . . . . 108 GLU HG3 . 17416 1 1300 . 1 1 108 108 GLU C C 13 178.080 0.400 . 1 . . . . 108 GLU C . 17416 1 1301 . 1 1 108 108 GLU CA C 13 58.689 0.400 . 1 . . . . 108 GLU CA . 17416 1 1302 . 1 1 108 108 GLU CB C 13 28.809 0.400 . 1 . . . . 108 GLU CB . 17416 1 1303 . 1 1 108 108 GLU CG C 13 35.648 0.400 . 1 . . . . 108 GLU CG . 17416 1 1304 . 1 1 108 108 GLU N N 15 118.085 0.400 . 1 . . . . 108 GLU N . 17416 1 1305 . 1 1 109 109 ALA H H 1 6.849 0.020 . 1 . . . . 109 ALA H . 17416 1 1306 . 1 1 109 109 ALA HA H 1 4.164 0.020 . 1 . . . . 109 ALA HA . 17416 1 1307 . 1 1 109 109 ALA HB1 H 1 1.731 0.020 . 1 . . . . 109 ALA HB . 17416 1 1308 . 1 1 109 109 ALA HB2 H 1 1.731 0.020 . 1 . . . . 109 ALA HB . 17416 1 1309 . 1 1 109 109 ALA HB3 H 1 1.731 0.020 . 1 . . . . 109 ALA HB . 17416 1 1310 . 1 1 109 109 ALA C C 13 179.930 0.400 . 1 . . . . 109 ALA C . 17416 1 1311 . 1 1 109 109 ALA CA C 13 54.381 0.400 . 1 . . . . 109 ALA CA . 17416 1 1312 . 1 1 109 109 ALA CB C 13 19.849 0.400 . 1 . . . . 109 ALA CB . 17416 1 1313 . 1 1 109 109 ALA N N 15 117.140 0.400 . 1 . . . . 109 ALA N . 17416 1 1314 . 1 1 110 110 ILE H H 1 8.403 0.020 . 1 . . . . 110 ILE H . 17416 1 1315 . 1 1 110 110 ILE HA H 1 3.500 0.020 . 1 . . . . 110 ILE HA . 17416 1 1316 . 1 1 110 110 ILE HB H 1 1.508 0.020 . 1 . . . . 110 ILE HB . 17416 1 1317 . 1 1 110 110 ILE HG12 H 1 0.771 0.020 . 2 . . . . 110 ILE HG12 . 17416 1 1318 . 1 1 110 110 ILE HG13 H 1 2.179 0.020 . 2 . . . . 110 ILE HG13 . 17416 1 1319 . 1 1 110 110 ILE HG21 H 1 0.628 0.020 . 1 . . . . 110 ILE HG2 . 17416 1 1320 . 1 1 110 110 ILE HG22 H 1 0.628 0.020 . 1 . . . . 110 ILE HG2 . 17416 1 1321 . 1 1 110 110 ILE HG23 H 1 0.628 0.020 . 1 . . . . 110 ILE HG2 . 17416 1 1322 . 1 1 110 110 ILE HD11 H 1 0.659 0.020 . 1 . . . . 110 ILE HD1 . 17416 1 1323 . 1 1 110 110 ILE HD12 H 1 0.659 0.020 . 1 . . . . 110 ILE HD1 . 17416 1 1324 . 1 1 110 110 ILE HD13 H 1 0.659 0.020 . 1 . . . . 110 ILE HD1 . 17416 1 1325 . 1 1 110 110 ILE C C 13 178.370 0.400 . 1 . . . . 110 ILE C . 17416 1 1326 . 1 1 110 110 ILE CA C 13 65.809 0.400 . 1 . . . . 110 ILE CA . 17416 1 1327 . 1 1 110 110 ILE CB C 13 37.537 0.400 . 1 . . . . 110 ILE CB . 17416 1 1328 . 1 1 110 110 ILE CG1 C 13 30.724 0.400 . 1 . . . . 110 ILE CG1 . 17416 1 1329 . 1 1 110 110 ILE CG2 C 13 18.547 0.400 . 1 . . . . 110 ILE CG2 . 17416 1 1330 . 1 1 110 110 ILE CD1 C 13 13.629 0.400 . 1 . . . . 110 ILE CD1 . 17416 1 1331 . 1 1 110 110 ILE N N 15 116.592 0.400 . 1 . . . . 110 ILE N . 17416 1 1332 . 1 1 111 111 ARG H H 1 8.363 0.020 . 1 . . . . 111 ARG H . 17416 1 1333 . 1 1 111 111 ARG HA H 1 3.851 0.020 . 1 . . . . 111 ARG HA . 17416 1 1334 . 1 1 111 111 ARG HB2 H 1 1.404 0.020 . 2 . . . . 111 ARG HB2 . 17416 1 1335 . 1 1 111 111 ARG HB3 H 1 1.561 0.020 . 2 . . . . 111 ARG HB3 . 17416 1 1336 . 1 1 111 111 ARG HG2 H 1 1.615 0.020 . 2 . . . . 111 ARG HG2 . 17416 1 1337 . 1 1 111 111 ARG HG3 H 1 1.286 0.020 . 2 . . . . 111 ARG HG3 . 17416 1 1338 . 1 1 111 111 ARG HD2 H 1 2.412 0.020 . 2 . . . . 111 ARG HD2 . 17416 1 1339 . 1 1 111 111 ARG HD3 H 1 2.851 0.020 . 2 . . . . 111 ARG HD3 . 17416 1 1340 . 1 1 111 111 ARG C C 13 177.398 0.400 . 1 . . . . 111 ARG C . 17416 1 1341 . 1 1 111 111 ARG CA C 13 58.996 0.400 . 1 . . . . 111 ARG CA . 17416 1 1342 . 1 1 111 111 ARG CB C 13 28.805 0.400 . 1 . . . . 111 ARG CB . 17416 1 1343 . 1 1 111 111 ARG CG C 13 26.264 0.400 . 1 . . . . 111 ARG CG . 17416 1 1344 . 1 1 111 111 ARG CD C 13 43.064 0.400 . 1 . . . . 111 ARG CD . 17416 1 1345 . 1 1 111 111 ARG N N 15 117.540 0.400 . 1 . . . . 111 ARG N . 17416 1 1346 . 1 1 112 112 LYS H H 1 6.735 0.020 . 1 . . . . 112 LYS H . 17416 1 1347 . 1 1 112 112 LYS HA H 1 4.348 0.020 . 1 . . . . 112 LYS HA . 17416 1 1348 . 1 1 112 112 LYS HB2 H 1 1.901 0.020 . 2 . . . . 112 LYS HB2 . 17416 1 1349 . 1 1 112 112 LYS HB3 H 1 1.901 0.020 . 2 . . . . 112 LYS HB3 . 17416 1 1350 . 1 1 112 112 LYS HG2 H 1 1.501 0.020 . 2 . . . . 112 LYS HG2 . 17416 1 1351 . 1 1 112 112 LYS HG3 H 1 1.501 0.020 . 2 . . . . 112 LYS HG3 . 17416 1 1352 . 1 1 112 112 LYS HD2 H 1 1.738 0.020 . 2 . . . . 112 LYS HD2 . 17416 1 1353 . 1 1 112 112 LYS HD3 H 1 1.738 0.020 . 2 . . . . 112 LYS HD3 . 17416 1 1354 . 1 1 112 112 LYS HE2 H 1 3.049 0.020 . 2 . . . . 112 LYS HE2 . 17416 1 1355 . 1 1 112 112 LYS HE3 H 1 3.049 0.020 . 2 . . . . 112 LYS HE3 . 17416 1 1356 . 1 1 112 112 LYS C C 13 176.134 0.400 . 1 . . . . 112 LYS C . 17416 1 1357 . 1 1 112 112 LYS CA C 13 56.463 0.400 . 1 . . . . 112 LYS CA . 17416 1 1358 . 1 1 112 112 LYS CB C 13 32.218 0.400 . 1 . . . . 112 LYS CB . 17416 1 1359 . 1 1 112 112 LYS CG C 13 24.524 0.400 . 1 . . . . 112 LYS CG . 17416 1 1360 . 1 1 112 112 LYS CD C 13 28.798 0.400 . 1 . . . . 112 LYS CD . 17416 1 1361 . 1 1 112 112 LYS CE C 13 41.907 0.400 . 1 . . . . 112 LYS CE . 17416 1 1362 . 1 1 112 112 LYS N N 15 115.798 0.400 . 1 . . . . 112 LYS N . 17416 1 1363 . 1 1 113 113 ASN H H 1 8.036 0.020 . 1 . . . . 113 ASN H . 17416 1 1364 . 1 1 113 113 ASN HA H 1 4.989 0.020 . 1 . . . . 113 ASN HA . 17416 1 1365 . 1 1 113 113 ASN HB2 H 1 2.507 0.020 . 2 . . . . 113 ASN HB2 . 17416 1 1366 . 1 1 113 113 ASN HB3 H 1 3.028 0.020 . 2 . . . . 113 ASN HB3 . 17416 1 1367 . 1 1 113 113 ASN HD21 H 1 7.111 0.020 . 2 . . . . 113 ASN HD21 . 17416 1 1368 . 1 1 113 113 ASN HD22 H 1 7.531 0.020 . 2 . . . . 113 ASN HD22 . 17416 1 1369 . 1 1 113 113 ASN C C 13 173.795 0.400 . 1 . . . . 113 ASN C . 17416 1 1370 . 1 1 113 113 ASN CA C 13 53.083 0.400 . 1 . . . . 113 ASN CA . 17416 1 1371 . 1 1 113 113 ASN CB C 13 42.192 0.400 . 1 . . . . 113 ASN CB . 17416 1 1372 . 1 1 113 113 ASN N N 15 119.437 0.400 . 1 . . . . 113 ASN N . 17416 1 1373 . 1 1 113 113 ASN ND2 N 15 114.845 0.400 . 1 . . . . 113 ASN ND2 . 17416 1 1374 . 1 1 114 114 ILE H H 1 7.476 0.020 . 1 . . . . 114 ILE H . 17416 1 1375 . 1 1 114 114 ILE HA H 1 4.003 0.020 . 1 . . . . 114 ILE HA . 17416 1 1376 . 1 1 114 114 ILE HB H 1 1.774 0.020 . 1 . . . . 114 ILE HB . 17416 1 1377 . 1 1 114 114 ILE HG12 H 1 2.042 0.020 . 2 . . . . 114 ILE HG12 . 17416 1 1378 . 1 1 114 114 ILE HG13 H 1 2.042 0.020 . 2 . . . . 114 ILE HG13 . 17416 1 1379 . 1 1 114 114 ILE HG21 H 1 0.894 0.020 . 1 . . . . 114 ILE HG2 . 17416 1 1380 . 1 1 114 114 ILE HG22 H 1 0.894 0.020 . 1 . . . . 114 ILE HG2 . 17416 1 1381 . 1 1 114 114 ILE HG23 H 1 0.894 0.020 . 1 . . . . 114 ILE HG2 . 17416 1 1382 . 1 1 114 114 ILE HD11 H 1 0.968 0.020 . 1 . . . . 114 ILE HD1 . 17416 1 1383 . 1 1 114 114 ILE HD12 H 1 0.968 0.020 . 1 . . . . 114 ILE HD1 . 17416 1 1384 . 1 1 114 114 ILE HD13 H 1 0.968 0.020 . 1 . . . . 114 ILE HD1 . 17416 1 1385 . 1 1 114 114 ILE C C 13 174.865 0.400 . 1 . . . . 114 ILE C . 17416 1 1386 . 1 1 114 114 ILE CA C 13 63.755 0.400 . 1 . . . . 114 ILE CA . 17416 1 1387 . 1 1 114 114 ILE CB C 13 39.065 0.400 . 1 . . . . 114 ILE CB . 17416 1 1388 . 1 1 114 114 ILE CG1 C 13 28.807 0.400 . 1 . . . . 114 ILE CG1 . 17416 1 1389 . 1 1 114 114 ILE CG2 C 13 17.966 0.400 . 1 . . . . 114 ILE CG2 . 17416 1 1390 . 1 1 114 114 ILE CD1 C 13 14.547 0.400 . 1 . . . . 114 ILE CD1 . 17416 1 1391 . 1 1 114 114 ILE N N 15 121.699 0.400 . 1 . . . . 114 ILE N . 17416 1 1392 . 1 1 115 115 LEU H H 1 8.572 0.020 . 1 . . . . 115 LEU H . 17416 1 1393 . 1 1 115 115 LEU HA H 1 4.668 0.020 . 1 . . . . 115 LEU HA . 17416 1 1394 . 1 1 115 115 LEU HB2 H 1 0.864 0.020 . 2 . . . . 115 LEU HB2 . 17416 1 1395 . 1 1 115 115 LEU HB3 H 1 1.546 0.020 . 2 . . . . 115 LEU HB3 . 17416 1 1396 . 1 1 115 115 LEU HG H 1 1.373 0.020 . 1 . . . . 115 LEU HG . 17416 1 1397 . 1 1 115 115 LEU HD11 H 1 0.987 0.020 . 2 . . . . 115 LEU HD1 . 17416 1 1398 . 1 1 115 115 LEU HD12 H 1 0.987 0.020 . 2 . . . . 115 LEU HD1 . 17416 1 1399 . 1 1 115 115 LEU HD13 H 1 0.987 0.020 . 2 . . . . 115 LEU HD1 . 17416 1 1400 . 1 1 115 115 LEU HD21 H 1 0.815 0.020 . 2 . . . . 115 LEU HD2 . 17416 1 1401 . 1 1 115 115 LEU HD22 H 1 0.815 0.020 . 2 . . . . 115 LEU HD2 . 17416 1 1402 . 1 1 115 115 LEU HD23 H 1 0.815 0.020 . 2 . . . . 115 LEU HD2 . 17416 1 1403 . 1 1 115 115 LEU C C 13 175.061 0.400 . 1 . . . . 115 LEU C . 17416 1 1404 . 1 1 115 115 LEU CA C 13 53.343 0.400 . 1 . . . . 115 LEU CA . 17416 1 1405 . 1 1 115 115 LEU CB C 13 44.710 0.400 . 1 . . . . 115 LEU CB . 17416 1 1406 . 1 1 115 115 LEU CG C 13 26.546 0.400 . 1 . . . . 115 LEU CG . 17416 1 1407 . 1 1 115 115 LEU CD1 C 13 23.625 0.400 . 1 . . . . 115 LEU CD1 . 17416 1 1408 . 1 1 115 115 LEU CD2 C 13 25.687 0.400 . 1 . . . . 115 LEU CD2 . 17416 1 1409 . 1 1 115 115 LEU N N 15 129.688 0.400 . 1 . . . . 115 LEU N . 17416 1 1410 . 1 1 116 116 ASN H H 1 8.697 0.020 . 1 . . . . 116 ASN H . 17416 1 1411 . 1 1 116 116 ASN HA H 1 4.822 0.020 . 1 . . . . 116 ASN HA . 17416 1 1412 . 1 1 116 116 ASN HB2 H 1 2.670 0.020 . 2 . . . . 116 ASN HB2 . 17416 1 1413 . 1 1 116 116 ASN HB3 H 1 2.806 0.020 . 2 . . . . 116 ASN HB3 . 17416 1 1414 . 1 1 116 116 ASN C C 13 175.543 0.400 . 1 . . . . 116 ASN C . 17416 1 1415 . 1 1 116 116 ASN CA C 13 54.253 0.400 . 1 . . . . 116 ASN CA . 17416 1 1416 . 1 1 116 116 ASN CB C 13 39.342 0.400 . 1 . . . . 116 ASN CB . 17416 1 1417 . 1 1 116 116 ASN N N 15 125.910 0.400 . 1 . . . . 116 ASN N . 17416 1 1418 . 1 1 117 117 GLN H H 1 9.039 0.020 . 1 . . . . 117 GLN H . 17416 1 1419 . 1 1 117 117 GLN HA H 1 4.451 0.020 . 1 . . . . 117 GLN HA . 17416 1 1420 . 1 1 117 117 GLN HB2 H 1 2.351 0.020 . 2 . . . . 117 GLN HB2 . 17416 1 1421 . 1 1 117 117 GLN HB3 H 1 2.351 0.020 . 2 . . . . 117 GLN HB3 . 17416 1 1422 . 1 1 117 117 GLN HG2 H 1 1.643 0.020 . 2 . . . . 117 GLN HG2 . 17416 1 1423 . 1 1 117 117 GLN HG3 H 1 1.839 0.020 . 2 . . . . 117 GLN HG3 . 17416 1 1424 . 1 1 117 117 GLN HE21 H 1 6.782 0.020 . 2 . . . . 117 GLN HE21 . 17416 1 1425 . 1 1 117 117 GLN HE22 H 1 7.397 0.020 . 2 . . . . 117 GLN HE22 . 17416 1 1426 . 1 1 117 117 GLN C C 13 174.673 0.400 . 1 . . . . 117 GLN C . 17416 1 1427 . 1 1 117 117 GLN CA C 13 54.962 0.400 . 1 . . . . 117 GLN CA . 17416 1 1428 . 1 1 117 117 GLN CB C 13 29.453 0.400 . 1 . . . . 117 GLN CB . 17416 1 1429 . 1 1 117 117 GLN CG C 13 30.385 0.400 . 1 . . . . 117 GLN CG . 17416 1 1430 . 1 1 117 117 GLN N N 15 122.950 0.400 . 1 . . . . 117 GLN N . 17416 1 1431 . 1 1 117 117 GLN NE2 N 15 112.147 0.400 . 1 . . . . 117 GLN NE2 . 17416 1 1432 . 1 1 118 118 ASN H H 1 8.642 0.020 . 1 . . . . 118 ASN H . 17416 1 1433 . 1 1 118 118 ASN HA H 1 4.979 0.020 . 1 . . . . 118 ASN HA . 17416 1 1434 . 1 1 118 118 ASN HB2 H 1 2.751 0.020 . 2 . . . . 118 ASN HB2 . 17416 1 1435 . 1 1 118 118 ASN HB3 H 1 2.889 0.020 . 2 . . . . 118 ASN HB3 . 17416 1 1436 . 1 1 118 118 ASN C C 13 174.964 0.400 . 1 . . . . 118 ASN C . 17416 1 1437 . 1 1 118 118 ASN CA C 13 53.706 0.400 . 1 . . . . 118 ASN CA . 17416 1 1438 . 1 1 118 118 ASN CB C 13 39.342 0.400 . 1 . . . . 118 ASN CB . 17416 1 1439 . 1 1 118 118 ASN N N 15 116.312 0.400 . 1 . . . . 118 ASN N . 17416 1 1440 . 1 1 119 119 ARG H H 1 7.348 0.020 . 1 . . . . 119 ARG H . 17416 1 1441 . 1 1 119 119 ARG HA H 1 4.405 0.020 . 1 . . . . 119 ARG HA . 17416 1 1442 . 1 1 119 119 ARG HB2 H 1 1.481 0.020 . 2 . . . . 119 ARG HB2 . 17416 1 1443 . 1 1 119 119 ARG HB3 H 1 1.656 0.020 . 2 . . . . 119 ARG HB3 . 17416 1 1444 . 1 1 119 119 ARG HG2 H 1 1.695 0.020 . 2 . . . . 119 ARG HG2 . 17416 1 1445 . 1 1 119 119 ARG HG3 H 1 1.695 0.020 . 2 . . . . 119 ARG HG3 . 17416 1 1446 . 1 1 119 119 ARG HD2 H 1 2.990 0.020 . 2 . . . . 119 ARG HD2 . 17416 1 1447 . 1 1 119 119 ARG HD3 H 1 3.156 0.020 . 2 . . . . 119 ARG HD3 . 17416 1 1448 . 1 1 119 119 ARG C C 13 174.377 0.400 . 1 . . . . 119 ARG C . 17416 1 1449 . 1 1 119 119 ARG CA C 13 55.227 0.400 . 1 . . . . 119 ARG CA . 17416 1 1450 . 1 1 119 119 ARG CB C 13 33.181 0.400 . 1 . . . . 119 ARG CB . 17416 1 1451 . 1 1 119 119 ARG N N 15 118.915 0.400 . 1 . . . . 119 ARG N . 17416 1 1452 . 1 1 120 120 GLU H H 1 8.625 0.020 . 1 . . . . 120 GLU H . 17416 1 1453 . 1 1 120 120 GLU HA H 1 4.480 0.020 . 1 . . . . 120 GLU HA . 17416 1 1454 . 1 1 120 120 GLU HB2 H 1 1.907 0.020 . 2 . . . . 120 GLU HB2 . 17416 1 1455 . 1 1 120 120 GLU HB3 H 1 2.049 0.020 . 2 . . . . 120 GLU HB3 . 17416 1 1456 . 1 1 120 120 GLU HG2 H 1 2.260 0.020 . 2 . . . . 120 GLU HG2 . 17416 1 1457 . 1 1 120 120 GLU HG3 H 1 2.416 0.020 . 2 . . . . 120 GLU HG3 . 17416 1 1458 . 1 1 120 120 GLU C C 13 176.426 0.400 . 1 . . . . 120 GLU C . 17416 1 1459 . 1 1 120 120 GLU CA C 13 56.763 0.400 . 1 . . . . 120 GLU CA . 17416 1 1460 . 1 1 120 120 GLU CB C 13 30.186 0.400 . 1 . . . . 120 GLU CB . 17416 1 1461 . 1 1 120 120 GLU CG C 13 36.492 0.400 . 1 . . . . 120 GLU CG . 17416 1 1462 . 1 1 120 120 GLU N N 15 125.105 0.400 . 1 . . . . 120 GLU N . 17416 1 1463 . 1 1 121 121 ILE H H 1 8.386 0.020 . 1 . . . . 121 ILE H . 17416 1 1464 . 1 1 121 121 ILE HA H 1 3.746 0.020 . 1 . . . . 121 ILE HA . 17416 1 1465 . 1 1 121 121 ILE HB H 1 1.062 0.020 . 1 . . . . 121 ILE HB . 17416 1 1466 . 1 1 121 121 ILE HG12 H 1 1.546 0.020 . 2 . . . . 121 ILE HG12 . 17416 1 1467 . 1 1 121 121 ILE HG13 H 1 1.546 0.020 . 2 . . . . 121 ILE HG13 . 17416 1 1468 . 1 1 121 121 ILE HG21 H 1 -0.072 0.020 . 1 . . . . 121 ILE HG2 . 17416 1 1469 . 1 1 121 121 ILE HG22 H 1 -0.072 0.020 . 1 . . . . 121 ILE HG2 . 17416 1 1470 . 1 1 121 121 ILE HG23 H 1 -0.072 0.020 . 1 . . . . 121 ILE HG2 . 17416 1 1471 . 1 1 121 121 ILE HD11 H 1 0.768 0.020 . 1 . . . . 121 ILE HD1 . 17416 1 1472 . 1 1 121 121 ILE HD12 H 1 0.768 0.020 . 1 . . . . 121 ILE HD1 . 17416 1 1473 . 1 1 121 121 ILE HD13 H 1 0.768 0.020 . 1 . . . . 121 ILE HD1 . 17416 1 1474 . 1 1 121 121 ILE C C 13 176.132 0.400 . 1 . . . . 121 ILE C . 17416 1 1475 . 1 1 121 121 ILE CA C 13 62.107 0.400 . 1 . . . . 121 ILE CA . 17416 1 1476 . 1 1 121 121 ILE CB C 13 39.947 0.400 . 1 . . . . 121 ILE CB . 17416 1 1477 . 1 1 121 121 ILE CG2 C 13 15.759 0.400 . 1 . . . . 121 ILE CG2 . 17416 1 1478 . 1 1 121 121 ILE CD1 C 13 14.845 0.400 . 1 . . . . 121 ILE CD1 . 17416 1 1479 . 1 1 121 121 ILE N N 15 122.929 0.400 . 1 . . . . 121 ILE N . 17416 1 1480 . 1 1 122 122 ASP H H 1 8.495 0.020 . 1 . . . . 122 ASP H . 17416 1 1481 . 1 1 122 122 ASP HA H 1 4.889 0.020 . 1 . . . . 122 ASP HA . 17416 1 1482 . 1 1 122 122 ASP HB2 H 1 2.553 0.020 . 2 . . . . 122 ASP HB2 . 17416 1 1483 . 1 1 122 122 ASP HB3 H 1 2.725 0.020 . 2 . . . . 122 ASP HB3 . 17416 1 1484 . 1 1 122 122 ASP C C 13 174.963 0.400 . 1 . . . . 122 ASP C . 17416 1 1485 . 1 1 122 122 ASP CA C 13 52.433 0.400 . 1 . . . . 122 ASP CA . 17416 1 1486 . 1 1 122 122 ASP CB C 13 40.482 0.400 . 1 . . . . 122 ASP CB . 17416 1 1487 . 1 1 122 122 ASP N N 15 127.956 0.400 . 1 . . . . 122 ASP N . 17416 1 1488 . 1 1 123 123 TYR H H 1 7.771 0.020 . 1 . . . . 123 TYR H . 17416 1 1489 . 1 1 123 123 TYR HA H 1 4.265 0.020 . 1 . . . . 123 TYR HA . 17416 1 1490 . 1 1 123 123 TYR HB2 H 1 2.617 0.020 . 2 . . . . 123 TYR HB2 . 17416 1 1491 . 1 1 123 123 TYR HB3 H 1 2.843 0.020 . 2 . . . . 123 TYR HB3 . 17416 1 1492 . 1 1 123 123 TYR HD1 H 1 7.172 0.020 . 1 . . . . 123 TYR HD1 . 17416 1 1493 . 1 1 123 123 TYR HD2 H 1 7.172 0.020 . 1 . . . . 123 TYR HD2 . 17416 1 1494 . 1 1 123 123 TYR HE1 H 1 6.907 0.020 . 1 . . . . 123 TYR HE1 . 17416 1 1495 . 1 1 123 123 TYR HE2 H 1 6.907 0.020 . 1 . . . . 123 TYR HE2 . 17416 1 1496 . 1 1 123 123 TYR C C 13 176.426 0.400 . 1 . . . . 123 TYR C . 17416 1 1497 . 1 1 123 123 TYR CA C 13 59.891 0.400 . 1 . . . . 123 TYR CA . 17416 1 1498 . 1 1 123 123 TYR CB C 13 38.773 0.400 . 1 . . . . 123 TYR CB . 17416 1 1499 . 1 1 123 123 TYR N N 15 122.666 0.400 . 1 . . . . 123 TYR N . 17416 1 1500 . 1 1 124 124 PHE H H 1 9.359 0.020 . 1 . . . . 124 PHE H . 17416 1 1501 . 1 1 124 124 PHE HA H 1 4.440 0.020 . 1 . . . . 124 PHE HA . 17416 1 1502 . 1 1 124 124 PHE HB2 H 1 2.758 0.020 . 2 . . . . 124 PHE HB2 . 17416 1 1503 . 1 1 124 124 PHE HB3 H 1 3.299 0.020 . 2 . . . . 124 PHE HB3 . 17416 1 1504 . 1 1 124 124 PHE HD1 H 1 7.232 0.020 . 1 . . . . 124 PHE HD1 . 17416 1 1505 . 1 1 124 124 PHE HD2 H 1 7.232 0.020 . 1 . . . . 124 PHE HD2 . 17416 1 1506 . 1 1 124 124 PHE HE1 H 1 7.244 0.020 . 1 . . . . 124 PHE HE1 . 17416 1 1507 . 1 1 124 124 PHE HE2 H 1 7.244 0.020 . 1 . . . . 124 PHE HE2 . 17416 1 1508 . 1 1 124 124 PHE HZ H 1 7.236 0.020 . 1 . . . . 124 PHE HZ . 17416 1 1509 . 1 1 124 124 PHE C C 13 174.186 0.400 . 1 . . . . 124 PHE C . 17416 1 1510 . 1 1 124 124 PHE CA C 13 58.405 0.400 . 1 . . . . 124 PHE CA . 17416 1 1511 . 1 1 124 124 PHE CB C 13 39.077 0.400 . 1 . . . . 124 PHE CB . 17416 1 1512 . 1 1 124 124 PHE N N 15 124.022 0.400 . 1 . . . . 124 PHE N . 17416 1 1513 . 1 1 125 125 VAL H H 1 7.886 0.020 . 1 . . . . 125 VAL H . 17416 1 1514 . 1 1 125 125 VAL HA H 1 4.742 0.020 . 1 . . . . 125 VAL HA . 17416 1 1515 . 1 1 125 125 VAL HB H 1 1.915 0.020 . 1 . . . . 125 VAL HB . 17416 1 1516 . 1 1 125 125 VAL HG11 H 1 0.858 0.020 . 2 . . . . 125 VAL HG1 . 17416 1 1517 . 1 1 125 125 VAL HG12 H 1 0.858 0.020 . 2 . . . . 125 VAL HG1 . 17416 1 1518 . 1 1 125 125 VAL HG13 H 1 0.858 0.020 . 2 . . . . 125 VAL HG1 . 17416 1 1519 . 1 1 125 125 VAL HG21 H 1 0.833 0.020 . 2 . . . . 125 VAL HG2 . 17416 1 1520 . 1 1 125 125 VAL HG22 H 1 0.833 0.020 . 2 . . . . 125 VAL HG2 . 17416 1 1521 . 1 1 125 125 VAL HG23 H 1 0.833 0.020 . 2 . . . . 125 VAL HG2 . 17416 1 1522 . 1 1 125 125 VAL C C 13 175.836 0.400 . 1 . . . . 125 VAL C . 17416 1 1523 . 1 1 125 125 VAL CA C 13 60.449 0.400 . 1 . . . . 125 VAL CA . 17416 1 1524 . 1 1 125 125 VAL CB C 13 33.358 0.400 . 1 . . . . 125 VAL CB . 17416 1 1525 . 1 1 125 125 VAL CG1 C 13 21.389 0.400 . 1 . . . . 125 VAL CG1 . 17416 1 1526 . 1 1 125 125 VAL CG2 C 13 20.534 0.400 . 1 . . . . 125 VAL CG2 . 17416 1 1527 . 1 1 125 125 VAL N N 15 128.334 0.400 . 1 . . . . 125 VAL N . 17416 1 1528 . 1 1 126 126 VAL H H 1 8.028 0.020 . 1 . . . . 126 VAL H . 17416 1 1529 . 1 1 126 126 VAL HA H 1 3.848 0.020 . 1 . . . . 126 VAL HA . 17416 1 1530 . 1 1 126 126 VAL HB H 1 1.941 0.020 . 1 . . . . 126 VAL HB . 17416 1 1531 . 1 1 126 126 VAL HG11 H 1 0.610 0.020 . 2 . . . . 126 VAL HG1 . 17416 1 1532 . 1 1 126 126 VAL HG12 H 1 0.610 0.020 . 2 . . . . 126 VAL HG1 . 17416 1 1533 . 1 1 126 126 VAL HG13 H 1 0.610 0.020 . 2 . . . . 126 VAL HG1 . 17416 1 1534 . 1 1 126 126 VAL HG21 H 1 1.138 0.020 . 2 . . . . 126 VAL HG2 . 17416 1 1535 . 1 1 126 126 VAL HG22 H 1 1.138 0.020 . 2 . . . . 126 VAL HG2 . 17416 1 1536 . 1 1 126 126 VAL HG23 H 1 1.138 0.020 . 2 . . . . 126 VAL HG2 . 17416 1 1537 . 1 1 126 126 VAL C C 13 176.619 0.400 . 1 . . . . 126 VAL C . 17416 1 1538 . 1 1 126 126 VAL CA C 13 64.000 0.400 . 1 . . . . 126 VAL CA . 17416 1 1539 . 1 1 126 126 VAL CB C 13 31.933 0.400 . 1 . . . . 126 VAL CB . 17416 1 1540 . 1 1 126 126 VAL CG1 C 13 21.077 0.400 . 1 . . . . 126 VAL CG1 . 17416 1 1541 . 1 1 126 126 VAL CG2 C 13 22.617 0.400 . 1 . . . . 126 VAL CG2 . 17416 1 1542 . 1 1 126 126 VAL N N 15 126.072 0.400 . 1 . . . . 126 VAL N . 17416 1 1543 . 1 1 127 127 GLU H H 1 8.714 0.020 . 1 . . . . 127 GLU H . 17416 1 1544 . 1 1 127 127 GLU HA H 1 4.351 0.020 . 1 . . . . 127 GLU HA . 17416 1 1545 . 1 1 127 127 GLU HB2 H 1 1.949 0.020 . 2 . . . . 127 GLU HB2 . 17416 1 1546 . 1 1 127 127 GLU HB3 H 1 2.100 0.020 . 2 . . . . 127 GLU HB3 . 17416 1 1547 . 1 1 127 127 GLU HG2 H 1 2.147 0.020 . 2 . . . . 127 GLU HG2 . 17416 1 1548 . 1 1 127 127 GLU HG3 H 1 2.343 0.020 . 2 . . . . 127 GLU HG3 . 17416 1 1549 . 1 1 127 127 GLU C C 13 175.840 0.400 . 1 . . . . 127 GLU C . 17416 1 1550 . 1 1 127 127 GLU CA C 13 57.492 0.400 . 1 . . . . 127 GLU CA . 17416 1 1551 . 1 1 127 127 GLU CB C 13 31.933 0.400 . 1 . . . . 127 GLU CB . 17416 1 1552 . 1 1 127 127 GLU CG C 13 36.777 0.400 . 1 . . . . 127 GLU CG . 17416 1 1553 . 1 1 127 127 GLU N N 15 127.637 0.400 . 1 . . . . 127 GLU N . 17416 1 1554 . 1 1 128 128 GLU H H 1 7.607 0.020 . 1 . . . . 128 GLU H . 17416 1 1555 . 1 1 128 128 GLU HA H 1 4.801 0.020 . 1 . . . . 128 GLU HA . 17416 1 1556 . 1 1 128 128 GLU HB2 H 1 1.949 0.020 . 2 . . . . 128 GLU HB2 . 17416 1 1557 . 1 1 128 128 GLU HB3 H 1 2.090 0.020 . 2 . . . . 128 GLU HB3 . 17416 1 1558 . 1 1 128 128 GLU HG2 H 1 2.181 0.020 . 2 . . . . 128 GLU HG2 . 17416 1 1559 . 1 1 128 128 GLU HG3 H 1 2.251 0.020 . 2 . . . . 128 GLU HG3 . 17416 1 1560 . 1 1 128 128 GLU CA C 13 53.044 0.400 . 1 . . . . 128 GLU CA . 17416 1 1561 . 1 1 128 128 GLU CB C 13 31.641 0.400 . 1 . . . . 128 GLU CB . 17416 1 1562 . 1 1 128 128 GLU CG C 13 35.354 0.400 . 1 . . . . 128 GLU CG . 17416 1 1563 . 1 1 128 128 GLU N N 15 117.687 0.400 . 1 . . . . 128 GLU N . 17416 1 1564 . 1 1 129 129 PRO HA H 1 5.194 0.020 . 1 . . . . 129 PRO HA . 17416 1 1565 . 1 1 129 129 PRO HB2 H 1 2.302 0.020 . 2 . . . . 129 PRO HB2 . 17416 1 1566 . 1 1 129 129 PRO HB3 H 1 1.972 0.020 . 2 . . . . 129 PRO HB3 . 17416 1 1567 . 1 1 129 129 PRO HG2 H 1 1.955 0.020 . 2 . . . . 129 PRO HG2 . 17416 1 1568 . 1 1 129 129 PRO HG3 H 1 2.222 0.020 . 2 . . . . 129 PRO HG3 . 17416 1 1569 . 1 1 129 129 PRO HD2 H 1 3.739 0.020 . 2 . . . . 129 PRO HD2 . 17416 1 1570 . 1 1 129 129 PRO HD3 H 1 3.739 0.020 . 2 . . . . 129 PRO HD3 . 17416 1 1571 . 1 1 129 129 PRO C C 13 176.619 0.400 . 1 . . . . 129 PRO C . 17416 1 1572 . 1 1 129 129 PRO CA C 13 62.413 0.400 . 1 . . . . 129 PRO CA . 17416 1 1573 . 1 1 129 129 PRO CB C 13 32.230 0.400 . 1 . . . . 129 PRO CB . 17416 1 1574 . 1 1 129 129 PRO CG C 13 27.925 0.400 . 1 . . . . 129 PRO CG . 17416 1 1575 . 1 1 129 129 PRO CD C 13 50.498 0.400 . 1 . . . . 129 PRO CD . 17416 1 1576 . 1 1 130 130 ILE H H 1 8.667 0.020 . 1 . . . . 130 ILE H . 17416 1 1577 . 1 1 130 130 ILE HA H 1 4.575 0.020 . 1 . . . . 130 ILE HA . 17416 1 1578 . 1 1 130 130 ILE HB H 1 1.825 0.020 . 1 . . . . 130 ILE HB . 17416 1 1579 . 1 1 130 130 ILE HG12 H 1 1.156 0.020 . 2 . . . . 130 ILE HG12 . 17416 1 1580 . 1 1 130 130 ILE HG13 H 1 1.616 0.020 . 2 . . . . 130 ILE HG13 . 17416 1 1581 . 1 1 130 130 ILE HG21 H 1 0.932 0.020 . 1 . . . . 130 ILE HG2 . 17416 1 1582 . 1 1 130 130 ILE HG22 H 1 0.932 0.020 . 1 . . . . 130 ILE HG2 . 17416 1 1583 . 1 1 130 130 ILE HG23 H 1 0.932 0.020 . 1 . . . . 130 ILE HG2 . 17416 1 1584 . 1 1 130 130 ILE HD11 H 1 0.899 0.020 . 1 . . . . 130 ILE HD1 . 17416 1 1585 . 1 1 130 130 ILE HD12 H 1 0.899 0.020 . 1 . . . . 130 ILE HD1 . 17416 1 1586 . 1 1 130 130 ILE HD13 H 1 0.899 0.020 . 1 . . . . 130 ILE HD1 . 17416 1 1587 . 1 1 130 130 ILE C C 13 172.916 0.400 . 1 . . . . 130 ILE C . 17416 1 1588 . 1 1 130 130 ILE CA C 13 59.876 0.400 . 1 . . . . 130 ILE CA . 17416 1 1589 . 1 1 130 130 ILE CB C 13 41.901 0.400 . 1 . . . . 130 ILE CB . 17416 1 1590 . 1 1 130 130 ILE CG1 C 13 27.943 0.400 . 1 . . . . 130 ILE CG1 . 17416 1 1591 . 1 1 130 130 ILE CG2 C 13 17.066 0.400 . 1 . . . . 130 ILE CG2 . 17416 1 1592 . 1 1 130 130 ILE CD1 C 13 13.961 0.400 . 1 . . . . 130 ILE CD1 . 17416 1 1593 . 1 1 130 130 ILE N N 15 121.327 0.400 . 1 . . . . 130 ILE N . 17416 1 1594 . 1 1 131 131 ILE H H 1 8.147 0.020 . 1 . . . . 131 ILE H . 17416 1 1595 . 1 1 131 131 ILE HA H 1 5.144 0.020 . 1 . . . . 131 ILE HA . 17416 1 1596 . 1 1 131 131 ILE HB H 1 1.722 0.020 . 1 . . . . 131 ILE HB . 17416 1 1597 . 1 1 131 131 ILE HG12 H 1 0.997 0.020 . 2 . . . . 131 ILE HG12 . 17416 1 1598 . 1 1 131 131 ILE HG13 H 1 1.645 0.020 . 2 . . . . 131 ILE HG13 . 17416 1 1599 . 1 1 131 131 ILE HG21 H 1 0.920 0.020 . 1 . . . . 131 ILE HG2 . 17416 1 1600 . 1 1 131 131 ILE HG22 H 1 0.920 0.020 . 1 . . . . 131 ILE HG2 . 17416 1 1601 . 1 1 131 131 ILE HG23 H 1 0.920 0.020 . 1 . . . . 131 ILE HG2 . 17416 1 1602 . 1 1 131 131 ILE HD11 H 1 0.909 0.020 . 1 . . . . 131 ILE HD1 . 17416 1 1603 . 1 1 131 131 ILE HD12 H 1 0.909 0.020 . 1 . . . . 131 ILE HD1 . 17416 1 1604 . 1 1 131 131 ILE HD13 H 1 0.909 0.020 . 1 . . . . 131 ILE HD1 . 17416 1 1605 . 1 1 131 131 ILE C C 13 175.547 0.400 . 1 . . . . 131 ILE C . 17416 1 1606 . 1 1 131 131 ILE CA C 13 60.165 0.400 . 1 . . . . 131 ILE CA . 17416 1 1607 . 1 1 131 131 ILE CB C 13 41.614 0.400 . 1 . . . . 131 ILE CB . 17416 1 1608 . 1 1 131 131 ILE CG1 C 13 28.516 0.400 . 1 . . . . 131 ILE CG1 . 17416 1 1609 . 1 1 131 131 ILE CG2 C 13 17.015 0.400 . 1 . . . . 131 ILE CG2 . 17416 1 1610 . 1 1 131 131 ILE CD1 C 13 13.969 0.400 . 1 . . . . 131 ILE CD1 . 17416 1 1611 . 1 1 131 131 ILE N N 15 124.706 0.400 . 1 . . . . 131 ILE N . 17416 1 1612 . 1 1 132 132 VAL H H 1 9.107 0.020 . 1 . . . . 132 VAL H . 17416 1 1613 . 1 1 132 132 VAL HA H 1 4.548 0.020 . 1 . . . . 132 VAL HA . 17416 1 1614 . 1 1 132 132 VAL HB H 1 2.011 0.020 . 1 . . . . 132 VAL HB . 17416 1 1615 . 1 1 132 132 VAL HG11 H 1 0.909 0.020 . 2 . . . . 132 VAL HG1 . 17416 1 1616 . 1 1 132 132 VAL HG12 H 1 0.909 0.020 . 2 . . . . 132 VAL HG1 . 17416 1 1617 . 1 1 132 132 VAL HG13 H 1 0.909 0.020 . 2 . . . . 132 VAL HG1 . 17416 1 1618 . 1 1 132 132 VAL HG21 H 1 0.929 0.020 . 2 . . . . 132 VAL HG2 . 17416 1 1619 . 1 1 132 132 VAL HG22 H 1 0.929 0.020 . 2 . . . . 132 VAL HG2 . 17416 1 1620 . 1 1 132 132 VAL HG23 H 1 0.929 0.020 . 2 . . . . 132 VAL HG2 . 17416 1 1621 . 1 1 132 132 VAL C C 13 173.696 0.400 . 1 . . . . 132 VAL C . 17416 1 1622 . 1 1 132 132 VAL CA C 13 60.759 0.400 . 1 . . . . 132 VAL CA . 17416 1 1623 . 1 1 132 132 VAL CB C 13 34.473 0.400 . 1 . . . . 132 VAL CB . 17416 1 1624 . 1 1 132 132 VAL CG1 C 13 21.681 0.400 . 1 . . . . 132 VAL CG1 . 17416 1 1625 . 1 1 132 132 VAL CG2 C 13 21.077 0.400 . 1 . . . . 132 VAL CG2 . 17416 1 1626 . 1 1 132 132 VAL N N 15 124.291 0.400 . 1 . . . . 132 VAL N . 17416 1 1627 . 1 1 133 133 GLU H H 1 8.486 0.020 . 1 . . . . 133 GLU H . 17416 1 1628 . 1 1 133 133 GLU HA H 1 5.243 0.020 . 1 . . . . 133 GLU HA . 17416 1 1629 . 1 1 133 133 GLU HB2 H 1 1.930 0.020 . 2 . . . . 133 GLU HB2 . 17416 1 1630 . 1 1 133 133 GLU HB3 H 1 2.102 0.020 . 2 . . . . 133 GLU HB3 . 17416 1 1631 . 1 1 133 133 GLU HG2 H 1 2.208 0.020 . 2 . . . . 133 GLU HG2 . 17416 1 1632 . 1 1 133 133 GLU HG3 H 1 2.208 0.020 . 2 . . . . 133 GLU HG3 . 17416 1 1633 . 1 1 133 133 GLU C C 13 175.314 0.400 . 1 . . . . 133 GLU C . 17416 1 1634 . 1 1 133 133 GLU CA C 13 54.959 0.400 . 1 . . . . 133 GLU CA . 17416 1 1635 . 1 1 133 133 GLU CB C 13 33.833 0.400 . 1 . . . . 133 GLU CB . 17416 1 1636 . 1 1 133 133 GLU CG C 13 36.586 0.400 . 1 . . . . 133 GLU CG . 17416 1 1637 . 1 1 133 133 GLU N N 15 123.499 0.400 . 1 . . . . 133 GLU N . 17416 1 1638 . 1 1 134 134 ASP H H 1 8.547 0.020 . 1 . . . . 134 ASP H . 17416 1 1639 . 1 1 134 134 ASP HA H 1 4.715 0.020 . 1 . . . . 134 ASP HA . 17416 1 1640 . 1 1 134 134 ASP HB2 H 1 2.530 0.020 . 2 . . . . 134 ASP HB2 . 17416 1 1641 . 1 1 134 134 ASP HB3 H 1 2.530 0.020 . 2 . . . . 134 ASP HB3 . 17416 1 1642 . 1 1 134 134 ASP C C 13 175.451 0.400 . 1 . . . . 134 ASP C . 17416 1 1643 . 1 1 134 134 ASP CA C 13 54.336 0.400 . 1 . . . . 134 ASP CA . 17416 1 1644 . 1 1 134 134 ASP CB C 13 44.087 0.400 . 1 . . . . 134 ASP CB . 17416 1 1645 . 1 1 134 134 ASP N N 15 121.699 0.400 . 1 . . . . 134 ASP N . 17416 1 1646 . 1 1 135 135 GLU H H 1 9.048 0.020 . 1 . . . . 135 GLU H . 17416 1 1647 . 1 1 135 135 GLU HA H 1 3.961 0.020 . 1 . . . . 135 GLU HA . 17416 1 1648 . 1 1 135 135 GLU HB2 H 1 1.999 0.020 . 2 . . . . 135 GLU HB2 . 17416 1 1649 . 1 1 135 135 GLU HB3 H 1 2.179 0.020 . 2 . . . . 135 GLU HB3 . 17416 1 1650 . 1 1 135 135 GLU HG2 H 1 2.237 0.020 . 2 . . . . 135 GLU HG2 . 17416 1 1651 . 1 1 135 135 GLU HG3 H 1 2.331 0.020 . 2 . . . . 135 GLU HG3 . 17416 1 1652 . 1 1 135 135 GLU C C 13 176.329 0.400 . 1 . . . . 135 GLU C . 17416 1 1653 . 1 1 135 135 GLU CA C 13 57.294 0.400 . 1 . . . . 135 GLU CA . 17416 1 1654 . 1 1 135 135 GLU CB C 13 28.228 0.400 . 1 . . . . 135 GLU CB . 17416 1 1655 . 1 1 135 135 GLU CG C 13 36.492 0.400 . 1 . . . . 135 GLU CG . 17416 1 1656 . 1 1 135 135 GLU N N 15 124.439 0.400 . 1 . . . . 135 GLU N . 17416 1 1657 . 1 1 136 136 GLY H H 1 8.795 0.020 . 1 . . . . 136 GLY H . 17416 1 1658 . 1 1 136 136 GLY HA2 H 1 3.747 0.020 . 2 . . . . 136 GLY HA2 . 17416 1 1659 . 1 1 136 136 GLY HA3 H 1 4.135 0.020 . 2 . . . . 136 GLY HA3 . 17416 1 1660 . 1 1 136 136 GLY C C 13 174.087 0.400 . 1 . . . . 136 GLY C . 17416 1 1661 . 1 1 136 136 GLY CA C 13 45.614 0.400 . 1 . . . . 136 GLY CA . 17416 1 1662 . 1 1 136 136 GLY N N 15 108.904 0.400 . 1 . . . . 136 GLY N . 17416 1 1663 . 1 1 137 137 ARG H H 1 7.878 0.020 . 1 . . . . 137 ARG H . 17416 1 1664 . 1 1 137 137 ARG HA H 1 4.805 0.020 . 1 . . . . 137 ARG HA . 17416 1 1665 . 1 1 137 137 ARG HB2 H 1 1.798 0.020 . 2 . . . . 137 ARG HB2 . 17416 1 1666 . 1 1 137 137 ARG HB3 H 1 1.588 0.020 . 2 . . . . 137 ARG HB3 . 17416 1 1667 . 1 1 137 137 ARG HG2 H 1 1.551 0.020 . 2 . . . . 137 ARG HG2 . 17416 1 1668 . 1 1 137 137 ARG HG3 H 1 1.599 0.020 . 2 . . . . 137 ARG HG3 . 17416 1 1669 . 1 1 137 137 ARG HD2 H 1 3.164 0.020 . 2 . . . . 137 ARG HD2 . 17416 1 1670 . 1 1 137 137 ARG HD3 H 1 3.355 0.020 . 2 . . . . 137 ARG HD3 . 17416 1 1671 . 1 1 137 137 ARG C C 13 175.347 0.400 . 1 . . . . 137 ARG C . 17416 1 1672 . 1 1 137 137 ARG CA C 13 54.363 0.400 . 1 . . . . 137 ARG CA . 17416 1 1673 . 1 1 137 137 ARG CB C 13 32.249 0.400 . 1 . . . . 137 ARG CB . 17416 1 1674 . 1 1 137 137 ARG CG C 13 27.623 0.400 . 1 . . . . 137 ARG CG . 17416 1 1675 . 1 1 137 137 ARG CD C 13 43.617 0.400 . 1 . . . . 137 ARG CD . 17416 1 1676 . 1 1 137 137 ARG N N 15 120.097 0.400 . 1 . . . . 137 ARG N . 17416 1 1677 . 1 1 138 138 LEU H H 1 8.563 0.020 . 1 . . . . 138 LEU H . 17416 1 1678 . 1 1 138 138 LEU HA H 1 5.359 0.020 . 1 . . . . 138 LEU HA . 17416 1 1679 . 1 1 138 138 LEU HB2 H 1 1.847 0.020 . 2 . . . . 138 LEU HB2 . 17416 1 1680 . 1 1 138 138 LEU HB3 H 1 1.783 0.020 . 2 . . . . 138 LEU HB3 . 17416 1 1681 . 1 1 138 138 LEU HG H 1 1.784 0.020 . 1 . . . . 138 LEU HG . 17416 1 1682 . 1 1 138 138 LEU HD11 H 1 0.955 0.020 . 2 . . . . 138 LEU HD1 . 17416 1 1683 . 1 1 138 138 LEU HD12 H 1 0.955 0.020 . 2 . . . . 138 LEU HD1 . 17416 1 1684 . 1 1 138 138 LEU HD13 H 1 0.955 0.020 . 2 . . . . 138 LEU HD1 . 17416 1 1685 . 1 1 138 138 LEU HD21 H 1 0.918 0.020 . 2 . . . . 138 LEU HD2 . 17416 1 1686 . 1 1 138 138 LEU HD22 H 1 0.918 0.020 . 2 . . . . 138 LEU HD2 . 17416 1 1687 . 1 1 138 138 LEU HD23 H 1 0.918 0.020 . 2 . . . . 138 LEU HD2 . 17416 1 1688 . 1 1 138 138 LEU C C 13 174.281 0.400 . 1 . . . . 138 LEU C . 17416 1 1689 . 1 1 138 138 LEU CA C 13 55.278 0.400 . 1 . . . . 138 LEU CA . 17416 1 1690 . 1 1 138 138 LEU CB C 13 46.547 0.400 . 1 . . . . 138 LEU CB . 17416 1 1691 . 1 1 138 138 LEU CG C 13 26.755 0.400 . 1 . . . . 138 LEU CG . 17416 1 1692 . 1 1 138 138 LEU CD1 C 13 25.704 0.400 . 1 . . . . 138 LEU CD1 . 17416 1 1693 . 1 1 138 138 LEU CD2 C 13 26.302 0.400 . 1 . . . . 138 LEU CD2 . 17416 1 1694 . 1 1 138 138 LEU N N 15 121.860 0.400 . 1 . . . . 138 LEU N . 17416 1 1695 . 1 1 139 139 ILE H H 1 9.160 0.020 . 1 . . . . 139 ILE H . 17416 1 1696 . 1 1 139 139 ILE HA H 1 5.610 0.020 . 1 . . . . 139 ILE HA . 17416 1 1697 . 1 1 139 139 ILE HB H 1 1.762 0.020 . 1 . . . . 139 ILE HB . 17416 1 1698 . 1 1 139 139 ILE HG12 H 1 1.327 0.020 . 2 . . . . 139 ILE HG12 . 17416 1 1699 . 1 1 139 139 ILE HG13 H 1 1.824 0.020 . 2 . . . . 139 ILE HG13 . 17416 1 1700 . 1 1 139 139 ILE HG21 H 1 1.094 0.020 . 1 . . . . 139 ILE HG2 . 17416 1 1701 . 1 1 139 139 ILE HG22 H 1 1.094 0.020 . 1 . . . . 139 ILE HG2 . 17416 1 1702 . 1 1 139 139 ILE HG23 H 1 1.094 0.020 . 1 . . . . 139 ILE HG2 . 17416 1 1703 . 1 1 139 139 ILE HD11 H 1 1.060 0.020 . 1 . . . . 139 ILE HD1 . 17416 1 1704 . 1 1 139 139 ILE HD12 H 1 1.060 0.020 . 1 . . . . 139 ILE HD1 . 17416 1 1705 . 1 1 139 139 ILE HD13 H 1 1.060 0.020 . 1 . . . . 139 ILE HD1 . 17416 1 1706 . 1 1 139 139 ILE C C 13 172.627 0.400 . 1 . . . . 139 ILE C . 17416 1 1707 . 1 1 139 139 ILE CA C 13 60.485 0.400 . 1 . . . . 139 ILE CA . 17416 1 1708 . 1 1 139 139 ILE CB C 13 41.903 0.400 . 1 . . . . 139 ILE CB . 17416 1 1709 . 1 1 139 139 ILE CG1 C 13 27.643 0.400 . 1 . . . . 139 ILE CG1 . 17416 1 1710 . 1 1 139 139 ILE CG2 C 13 17.963 0.400 . 1 . . . . 139 ILE CG2 . 17416 1 1711 . 1 1 139 139 ILE CD1 C 13 15.754 0.400 . 1 . . . . 139 ILE CD1 . 17416 1 1712 . 1 1 139 139 ILE N N 15 122.037 0.400 . 1 . . . . 139 ILE N . 17416 1 1713 . 1 1 140 140 LYS H H 1 9.458 0.020 . 1 . . . . 140 LYS H . 17416 1 1714 . 1 1 140 140 LYS HA H 1 5.509 0.020 . 1 . . . . 140 LYS HA . 17416 1 1715 . 1 1 140 140 LYS HB2 H 1 1.986 0.020 . 2 . . . . 140 LYS HB2 . 17416 1 1716 . 1 1 140 140 LYS HB3 H 1 1.849 0.020 . 2 . . . . 140 LYS HB3 . 17416 1 1717 . 1 1 140 140 LYS HG2 H 1 1.220 0.020 . 2 . . . . 140 LYS HG2 . 17416 1 1718 . 1 1 140 140 LYS HG3 H 1 1.440 0.020 . 2 . . . . 140 LYS HG3 . 17416 1 1719 . 1 1 140 140 LYS HD2 H 1 1.613 0.020 . 2 . . . . 140 LYS HD2 . 17416 1 1720 . 1 1 140 140 LYS HD3 H 1 1.613 0.020 . 2 . . . . 140 LYS HD3 . 17416 1 1721 . 1 1 140 140 LYS HE2 H 1 2.760 0.020 . 2 . . . . 140 LYS HE2 . 17416 1 1722 . 1 1 140 140 LYS HE3 H 1 2.760 0.020 . 2 . . . . 140 LYS HE3 . 17416 1 1723 . 1 1 140 140 LYS C C 13 174.574 0.400 . 1 . . . . 140 LYS C . 17416 1 1724 . 1 1 140 140 LYS CA C 13 54.035 0.400 . 1 . . . . 140 LYS CA . 17416 1 1725 . 1 1 140 140 LYS CB C 13 36.844 0.400 . 1 . . . . 140 LYS CB . 17416 1 1726 . 1 1 140 140 LYS CG C 13 25.094 0.400 . 1 . . . . 140 LYS CG . 17416 1 1727 . 1 1 140 140 LYS CD C 13 29.389 0.400 . 1 . . . . 140 LYS CD . 17416 1 1728 . 1 1 140 140 LYS CE C 13 41.337 0.400 . 1 . . . . 140 LYS CE . 17416 1 1729 . 1 1 140 140 LYS N N 15 125.787 0.400 . 1 . . . . 140 LYS N . 17416 1 1730 . 1 1 141 141 ALA H H 1 9.100 0.020 . 1 . . . . 141 ALA H . 17416 1 1731 . 1 1 141 141 ALA HA H 1 5.175 0.020 . 1 . . . . 141 ALA HA . 17416 1 1732 . 1 1 141 141 ALA HB1 H 1 1.248 0.020 . 1 . . . . 141 ALA HB . 17416 1 1733 . 1 1 141 141 ALA HB2 H 1 1.248 0.020 . 1 . . . . 141 ALA HB . 17416 1 1734 . 1 1 141 141 ALA HB3 H 1 1.248 0.020 . 1 . . . . 141 ALA HB . 17416 1 1735 . 1 1 141 141 ALA C C 13 175.645 0.400 . 1 . . . . 141 ALA C . 17416 1 1736 . 1 1 141 141 ALA CA C 13 49.588 0.400 . 1 . . . . 141 ALA CA . 17416 1 1737 . 1 1 141 141 ALA CB C 13 24.476 0.400 . 1 . . . . 141 ALA CB . 17416 1 1738 . 1 1 141 141 ALA N N 15 125.782 0.400 . 1 . . . . 141 ALA N . 17416 1 1739 . 1 1 142 142 GLU H H 1 8.743 0.020 . 1 . . . . 142 GLU H . 17416 1 1740 . 1 1 142 142 GLU HA H 1 4.503 0.020 . 1 . . . . 142 GLU HA . 17416 1 1741 . 1 1 142 142 GLU HB2 H 1 1.880 0.020 . 2 . . . . 142 GLU HB2 . 17416 1 1742 . 1 1 142 142 GLU HB3 H 1 2.074 0.020 . 2 . . . . 142 GLU HB3 . 17416 1 1743 . 1 1 142 142 GLU HG2 H 1 2.023 0.020 . 2 . . . . 142 GLU HG2 . 17416 1 1744 . 1 1 142 142 GLU HG3 H 1 2.100 0.020 . 2 . . . . 142 GLU HG3 . 17416 1 1745 . 1 1 142 142 GLU CA C 13 53.654 0.400 . 1 . . . . 142 GLU CA . 17416 1 1746 . 1 1 142 142 GLU CB C 13 32.560 0.400 . 1 . . . . 142 GLU CB . 17416 1 1747 . 1 1 142 142 GLU CG C 13 37.011 0.400 . 1 . . . . 142 GLU CG . 17416 1 1748 . 1 1 142 142 GLU N N 15 118.084 0.400 . 1 . . . . 142 GLU N . 17416 1 1749 . 1 1 143 143 PRO HA H 1 4.361 0.020 . 1 . . . . 143 PRO HA . 17416 1 1750 . 1 1 143 143 PRO HB2 H 1 2.308 0.020 . 2 . . . . 143 PRO HB2 . 17416 1 1751 . 1 1 143 143 PRO HB3 H 1 1.757 0.020 . 2 . . . . 143 PRO HB3 . 17416 1 1752 . 1 1 143 143 PRO HG2 H 1 2.000 0.020 . 2 . . . . 143 PRO HG2 . 17416 1 1753 . 1 1 143 143 PRO HG3 H 1 1.505 0.020 . 2 . . . . 143 PRO HG3 . 17416 1 1754 . 1 1 143 143 PRO HD2 H 1 2.978 0.020 . 2 . . . . 143 PRO HD2 . 17416 1 1755 . 1 1 143 143 PRO HD3 H 1 3.657 0.020 . 2 . . . . 143 PRO HD3 . 17416 1 1756 . 1 1 143 143 PRO C C 13 176.132 0.400 . 1 . . . . 143 PRO C . 17416 1 1757 . 1 1 143 143 PRO CA C 13 63.353 0.400 . 1 . . . . 143 PRO CA . 17416 1 1758 . 1 1 143 143 PRO CB C 13 32.503 0.400 . 1 . . . . 143 PRO CB . 17416 1 1759 . 1 1 143 143 PRO CG C 13 27.354 0.400 . 1 . . . . 143 PRO CG . 17416 1 1760 . 1 1 143 143 PRO CD C 13 50.582 0.400 . 1 . . . . 143 PRO CD . 17416 1 1761 . 1 1 144 144 SER H H 1 8.381 0.020 . 1 . . . . 144 SER H . 17416 1 1762 . 1 1 144 144 SER HA H 1 4.298 0.020 . 1 . . . . 144 SER HA . 17416 1 1763 . 1 1 144 144 SER HB2 H 1 3.373 0.020 . 2 . . . . 144 SER HB2 . 17416 1 1764 . 1 1 144 144 SER HB3 H 1 3.968 0.020 . 2 . . . . 144 SER HB3 . 17416 1 1765 . 1 1 144 144 SER C C 13 172.918 0.400 . 1 . . . . 144 SER C . 17416 1 1766 . 1 1 144 144 SER CA C 13 57.843 0.400 . 1 . . . . 144 SER CA . 17416 1 1767 . 1 1 144 144 SER CB C 13 64.635 0.400 . 1 . . . . 144 SER CB . 17416 1 1768 . 1 1 144 144 SER N N 15 114.853 0.400 . 1 . . . . 144 SER N . 17416 1 1769 . 1 1 145 145 ASP H H 1 8.271 0.020 . 1 . . . . 145 ASP H . 17416 1 1770 . 1 1 145 145 ASP HA H 1 4.510 0.020 . 1 . . . . 145 ASP HA . 17416 1 1771 . 1 1 145 145 ASP HB2 H 1 2.661 0.020 . 2 . . . . 145 ASP HB2 . 17416 1 1772 . 1 1 145 145 ASP HB3 H 1 2.661 0.020 . 2 . . . . 145 ASP HB3 . 17416 1 1773 . 1 1 145 145 ASP C C 13 175.645 0.400 . 1 . . . . 145 ASP C . 17416 1 1774 . 1 1 145 145 ASP CA C 13 54.798 0.400 . 1 . . . . 145 ASP CA . 17416 1 1775 . 1 1 145 145 ASP CB C 13 40.724 0.400 . 1 . . . . 145 ASP CB . 17416 1 1776 . 1 1 145 145 ASP N N 15 121.724 0.400 . 1 . . . . 145 ASP N . 17416 1 1777 . 1 1 146 146 THR H H 1 7.719 0.020 . 1 . . . . 146 THR H . 17416 1 1778 . 1 1 146 146 THR HA H 1 4.523 0.020 . 1 . . . . 146 THR HA . 17416 1 1779 . 1 1 146 146 THR HB H 1 3.897 0.020 . 1 . . . . 146 THR HB . 17416 1 1780 . 1 1 146 146 THR HG21 H 1 1.055 0.020 . 1 . . . . 146 THR HG2 . 17416 1 1781 . 1 1 146 146 THR HG22 H 1 1.055 0.020 . 1 . . . . 146 THR HG2 . 17416 1 1782 . 1 1 146 146 THR HG23 H 1 1.055 0.020 . 1 . . . . 146 THR HG2 . 17416 1 1783 . 1 1 146 146 THR C C 13 173.992 0.400 . 1 . . . . 146 THR C . 17416 1 1784 . 1 1 146 146 THR CA C 13 59.032 0.400 . 1 . . . . 146 THR CA . 17416 1 1785 . 1 1 146 146 THR CB C 13 71.462 0.400 . 1 . . . . 146 THR CB . 17416 1 1786 . 1 1 146 146 THR CG2 C 13 21.677 0.400 . 1 . . . . 146 THR CG2 . 17416 1 1787 . 1 1 146 146 THR N N 15 110.793 0.400 . 1 . . . . 146 THR N . 17416 1 1788 . 1 1 147 147 LEU H H 1 9.562 0.020 . 1 . . . . 147 LEU H . 17416 1 1789 . 1 1 147 147 LEU HA H 1 5.114 0.020 . 1 . . . . 147 LEU HA . 17416 1 1790 . 1 1 147 147 LEU HB2 H 1 2.052 0.020 . 2 . . . . 147 LEU HB2 . 17416 1 1791 . 1 1 147 147 LEU HB3 H 1 2.116 0.020 . 2 . . . . 147 LEU HB3 . 17416 1 1792 . 1 1 147 147 LEU HG H 1 1.540 0.020 . 1 . . . . 147 LEU HG . 17416 1 1793 . 1 1 147 147 LEU HD11 H 1 1.070 0.020 . 2 . . . . 147 LEU HD1 . 17416 1 1794 . 1 1 147 147 LEU HD12 H 1 1.070 0.020 . 2 . . . . 147 LEU HD1 . 17416 1 1795 . 1 1 147 147 LEU HD13 H 1 1.070 0.020 . 2 . . . . 147 LEU HD1 . 17416 1 1796 . 1 1 147 147 LEU HD21 H 1 0.752 0.020 . 2 . . . . 147 LEU HD2 . 17416 1 1797 . 1 1 147 147 LEU HD22 H 1 0.752 0.020 . 2 . . . . 147 LEU HD2 . 17416 1 1798 . 1 1 147 147 LEU HD23 H 1 0.752 0.020 . 2 . . . . 147 LEU HD2 . 17416 1 1799 . 1 1 147 147 LEU C C 13 174.477 0.400 . 1 . . . . 147 LEU C . 17416 1 1800 . 1 1 147 147 LEU CA C 13 56.162 0.400 . 1 . . . . 147 LEU CA . 17416 1 1801 . 1 1 147 147 LEU CB C 13 41.260 0.400 . 1 . . . . 147 LEU CB . 17416 1 1802 . 1 1 147 147 LEU CG C 13 27.875 0.400 . 1 . . . . 147 LEU CG . 17416 1 1803 . 1 1 147 147 LEU CD1 C 13 22.285 0.400 . 1 . . . . 147 LEU CD1 . 17416 1 1804 . 1 1 147 147 LEU CD2 C 13 25.099 0.400 . 1 . . . . 147 LEU CD2 . 17416 1 1805 . 1 1 147 147 LEU N N 15 126.188 0.400 . 1 . . . . 147 LEU N . 17416 1 1806 . 1 1 148 148 GLU H H 1 8.579 0.020 . 1 . . . . 148 GLU H . 17416 1 1807 . 1 1 148 148 GLU HA H 1 5.418 0.020 . 1 . . . . 148 GLU HA . 17416 1 1808 . 1 1 148 148 GLU HB2 H 1 1.882 0.020 . 2 . . . . 148 GLU HB2 . 17416 1 1809 . 1 1 148 148 GLU HB3 H 1 1.882 0.020 . 2 . . . . 148 GLU HB3 . 17416 1 1810 . 1 1 148 148 GLU HG2 H 1 2.053 0.020 . 2 . . . . 148 GLU HG2 . 17416 1 1811 . 1 1 148 148 GLU HG3 H 1 2.288 0.020 . 2 . . . . 148 GLU HG3 . 17416 1 1812 . 1 1 148 148 GLU C C 13 175.840 0.400 . 1 . . . . 148 GLU C . 17416 1 1813 . 1 1 148 148 GLU CA C 13 54.668 0.400 . 1 . . . . 148 GLU CA . 17416 1 1814 . 1 1 148 148 GLU CG C 13 36.821 0.400 . 1 . . . . 148 GLU CG . 17416 1 1815 . 1 1 148 148 GLU N N 15 128.729 0.400 . 1 . . . . 148 GLU N . 17416 1 1816 . 1 1 149 149 VAL H H 1 9.493 0.020 . 1 . . . . 149 VAL H . 17416 1 1817 . 1 1 149 149 VAL HA H 1 5.138 0.020 . 1 . . . . 149 VAL HA . 17416 1 1818 . 1 1 149 149 VAL HB H 1 2.145 0.020 . 1 . . . . 149 VAL HB . 17416 1 1819 . 1 1 149 149 VAL HG11 H 1 1.060 0.020 . 2 . . . . 149 VAL HG1 . 17416 1 1820 . 1 1 149 149 VAL HG12 H 1 1.060 0.020 . 2 . . . . 149 VAL HG1 . 17416 1 1821 . 1 1 149 149 VAL HG13 H 1 1.060 0.020 . 2 . . . . 149 VAL HG1 . 17416 1 1822 . 1 1 149 149 VAL HG21 H 1 0.991 0.020 . 2 . . . . 149 VAL HG2 . 17416 1 1823 . 1 1 149 149 VAL HG22 H 1 0.991 0.020 . 2 . . . . 149 VAL HG2 . 17416 1 1824 . 1 1 149 149 VAL HG23 H 1 0.991 0.020 . 2 . . . . 149 VAL HG2 . 17416 1 1825 . 1 1 149 149 VAL C C 13 173.892 0.400 . 1 . . . . 149 VAL C . 17416 1 1826 . 1 1 149 149 VAL CA C 13 61.508 0.400 . 1 . . . . 149 VAL CA . 17416 1 1827 . 1 1 149 149 VAL CB C 13 36.253 0.400 . 1 . . . . 149 VAL CB . 17416 1 1828 . 1 1 149 149 VAL CG1 C 13 23.893 0.400 . 1 . . . . 149 VAL CG1 . 17416 1 1829 . 1 1 149 149 VAL CG2 C 13 20.769 0.400 . 1 . . . . 149 VAL CG2 . 17416 1 1830 . 1 1 149 149 VAL N N 15 125.111 0.400 . 1 . . . . 149 VAL N . 17416 1 1831 . 1 1 150 150 THR H H 1 9.197 0.020 . 1 . . . . 150 THR H . 17416 1 1832 . 1 1 150 150 THR HA H 1 5.844 0.020 . 1 . . . . 150 THR HA . 17416 1 1833 . 1 1 150 150 THR HB H 1 4.179 0.020 . 1 . . . . 150 THR HB . 17416 1 1834 . 1 1 150 150 THR HG21 H 1 1.210 0.020 . 1 . . . . 150 THR HG2 . 17416 1 1835 . 1 1 150 150 THR HG22 H 1 1.210 0.020 . 1 . . . . 150 THR HG2 . 17416 1 1836 . 1 1 150 150 THR HG23 H 1 1.210 0.020 . 1 . . . . 150 THR HG2 . 17416 1 1837 . 1 1 150 150 THR C C 13 172.820 0.400 . 1 . . . . 150 THR C . 17416 1 1838 . 1 1 150 150 THR CA C 13 61.193 0.400 . 1 . . . . 150 THR CA . 17416 1 1839 . 1 1 150 150 THR CB C 13 70.782 0.400 . 1 . . . . 150 THR CB . 17416 1 1840 . 1 1 150 150 THR CG2 C 13 21.378 0.400 . 1 . . . . 150 THR CG2 . 17416 1 1841 . 1 1 150 150 THR N N 15 126.035 0.400 . 1 . . . . 150 THR N . 17416 1 1842 . 1 1 151 151 TYR H H 1 8.576 0.020 . 1 . . . . 151 TYR H . 17416 1 1843 . 1 1 151 151 TYR HA H 1 5.345 0.020 . 1 . . . . 151 TYR HA . 17416 1 1844 . 1 1 151 151 TYR HB2 H 1 2.530 0.020 . 2 . . . . 151 TYR HB2 . 17416 1 1845 . 1 1 151 151 TYR HB3 H 1 3.176 0.020 . 2 . . . . 151 TYR HB3 . 17416 1 1846 . 1 1 151 151 TYR HD1 H 1 6.829 0.020 . 1 . . . . 151 TYR HD1 . 17416 1 1847 . 1 1 151 151 TYR HD2 H 1 6.829 0.020 . 1 . . . . 151 TYR HD2 . 17416 1 1848 . 1 1 151 151 TYR HE1 H 1 7.203 0.020 . 1 . . . . 151 TYR HE1 . 17416 1 1849 . 1 1 151 151 TYR HE2 H 1 7.203 0.020 . 1 . . . . 151 TYR HE2 . 17416 1 1850 . 1 1 151 151 TYR C C 13 172.620 0.400 . 1 . . . . 151 TYR C . 17416 1 1851 . 1 1 151 151 TYR CA C 13 56.460 0.400 . 1 . . . . 151 TYR CA . 17416 1 1852 . 1 1 151 151 TYR CB C 13 44.387 0.400 . 1 . . . . 151 TYR CB . 17416 1 1853 . 1 1 151 151 TYR N N 15 126.164 0.400 . 1 . . . . 151 TYR N . 17416 1 1854 . 1 1 152 152 GLU H H 1 8.704 0.020 . 1 . . . . 152 GLU H . 17416 1 1855 . 1 1 152 152 GLU HA H 1 5.365 0.020 . 1 . . . . 152 GLU HA . 17416 1 1856 . 1 1 152 152 GLU HB2 H 1 1.922 0.020 . 2 . . . . 152 GLU HB2 . 17416 1 1857 . 1 1 152 152 GLU HB3 H 1 2.260 0.020 . 2 . . . . 152 GLU HB3 . 17416 1 1858 . 1 1 152 152 GLU HG2 H 1 2.255 0.020 . 2 . . . . 152 GLU HG2 . 17416 1 1859 . 1 1 152 152 GLU HG3 H 1 2.464 0.020 . 2 . . . . 152 GLU HG3 . 17416 1 1860 . 1 1 152 152 GLU C C 13 172.918 0.400 . 1 . . . . 152 GLU C . 17416 1 1861 . 1 1 152 152 GLU CA C 13 54.271 0.400 . 1 . . . . 152 GLU CA . 17416 1 1862 . 1 1 152 152 GLU CB C 13 33.803 0.400 . 1 . . . . 152 GLU CB . 17416 1 1863 . 1 1 152 152 GLU CG C 13 36.208 0.400 . 1 . . . . 152 GLU CG . 17416 1 1864 . 1 1 152 152 GLU N N 15 131.123 0.400 . 1 . . . . 152 GLU N . 17416 1 1865 . 1 1 153 153 GLY H H 1 8.923 0.020 . 1 . . . . 153 GLY H . 17416 1 1866 . 1 1 153 153 GLY HA2 H 1 3.276 0.020 . 2 . . . . 153 GLY HA2 . 17416 1 1867 . 1 1 153 153 GLY HA3 H 1 4.229 0.020 . 2 . . . . 153 GLY HA3 . 17416 1 1868 . 1 1 153 153 GLY C C 13 170.777 0.400 . 1 . . . . 153 GLY C . 17416 1 1869 . 1 1 153 153 GLY CA C 13 43.407 0.400 . 1 . . . . 153 GLY CA . 17416 1 1870 . 1 1 153 153 GLY N N 15 109.937 0.400 . 1 . . . . 153 GLY N . 17416 1 1871 . 1 1 154 154 GLU H H 1 7.389 0.020 . 1 . . . . 154 GLU H . 17416 1 1872 . 1 1 154 154 GLU HA H 1 4.537 0.020 . 1 . . . . 154 GLU HA . 17416 1 1873 . 1 1 154 154 GLU HB2 H 1 1.843 0.020 . 2 . . . . 154 GLU HB2 . 17416 1 1874 . 1 1 154 154 GLU HB3 H 1 1.689 0.020 . 2 . . . . 154 GLU HB3 . 17416 1 1875 . 1 1 154 154 GLU HG2 H 1 2.001 0.020 . 2 . . . . 154 GLU HG2 . 17416 1 1876 . 1 1 154 154 GLU HG3 H 1 2.001 0.020 . 2 . . . . 154 GLU HG3 . 17416 1 1877 . 1 1 154 154 GLU C C 13 173.985 0.400 . 1 . . . . 154 GLU C . 17416 1 1878 . 1 1 154 154 GLU CA C 13 55.250 0.400 . 1 . . . . 154 GLU CA . 17416 1 1879 . 1 1 154 154 GLU CB C 13 32.249 0.400 . 1 . . . . 154 GLU CB . 17416 1 1880 . 1 1 154 154 GLU CG C 13 36.528 0.400 . 1 . . . . 154 GLU CG . 17416 1 1881 . 1 1 154 154 GLU N N 15 119.306 0.400 . 1 . . . . 154 GLU N . 17416 1 1882 . 1 1 155 155 PHE H H 1 8.256 0.020 . 1 . . . . 155 PHE H . 17416 1 1883 . 1 1 155 155 PHE HA H 1 4.842 0.020 . 1 . . . . 155 PHE HA . 17416 1 1884 . 1 1 155 155 PHE HB2 H 1 3.198 0.020 . 2 . . . . 155 PHE HB2 . 17416 1 1885 . 1 1 155 155 PHE HB3 H 1 3.070 0.020 . 2 . . . . 155 PHE HB3 . 17416 1 1886 . 1 1 155 155 PHE HD1 H 1 7.464 0.020 . 1 . . . . 155 PHE HD1 . 17416 1 1887 . 1 1 155 155 PHE HD2 H 1 7.464 0.020 . 1 . . . . 155 PHE HD2 . 17416 1 1888 . 1 1 155 155 PHE HE1 H 1 7.346 0.020 . 1 . . . . 155 PHE HE1 . 17416 1 1889 . 1 1 155 155 PHE HE2 H 1 7.346 0.020 . 1 . . . . 155 PHE HE2 . 17416 1 1890 . 1 1 155 155 PHE HZ H 1 6.902 0.020 . 1 . . . . 155 PHE HZ . 17416 1 1891 . 1 1 155 155 PHE C C 13 176.717 0.400 . 1 . . . . 155 PHE C . 17416 1 1892 . 1 1 155 155 PHE CA C 13 56.442 0.400 . 1 . . . . 155 PHE CA . 17416 1 1893 . 1 1 155 155 PHE CB C 13 40.724 0.400 . 1 . . . . 155 PHE CB . 17416 1 1894 . 1 1 155 155 PHE N N 15 125.649 0.400 . 1 . . . . 155 PHE N . 17416 1 1895 . 1 1 156 156 LYS H H 1 8.228 0.020 . 1 . . . . 156 LYS H . 17416 1 1896 . 1 1 156 156 LYS HA H 1 4.298 0.020 . 1 . . . . 156 LYS HA . 17416 1 1897 . 1 1 156 156 LYS C C 13 175.354 0.400 . 1 . . . . 156 LYS C . 17416 1 1898 . 1 1 156 156 LYS N N 15 122.537 0.400 . 1 . . . . 156 LYS N . 17416 1 1899 . 1 1 157 157 ASN H H 1 7.958 0.020 . 1 . . . . 157 ASN H . 17416 1 1900 . 1 1 157 157 ASN HA H 1 4.983 0.020 . 1 . . . . 157 ASN HA . 17416 1 1901 . 1 1 157 157 ASN HB2 H 1 3.219 0.020 . 2 . . . . 157 ASN HB2 . 17416 1 1902 . 1 1 157 157 ASN HB3 H 1 3.219 0.020 . 2 . . . . 157 ASN HB3 . 17416 1 1903 . 1 1 157 157 ASN HD21 H 1 6.321 0.020 . 2 . . . . 157 ASN HD21 . 17416 1 1904 . 1 1 157 157 ASN HD22 H 1 7.502 0.020 . 2 . . . . 157 ASN HD22 . 17416 1 1905 . 1 1 157 157 ASN C C 13 176.621 0.400 . 1 . . . . 157 ASN C . 17416 1 1906 . 1 1 157 157 ASN CA C 13 51.245 0.400 . 1 . . . . 157 ASN CA . 17416 1 1907 . 1 1 157 157 ASN CB C 13 39.371 0.400 . 1 . . . . 157 ASN CB . 17416 1 1908 . 1 1 157 157 ASN N N 15 117.679 0.400 . 1 . . . . 157 ASN N . 17416 1 1909 . 1 1 157 157 ASN ND2 N 15 109.583 0.400 . 1 . . . . 157 ASN ND2 . 17416 1 1910 . 1 1 158 158 PHE H H 1 7.590 0.020 . 1 . . . . 158 PHE H . 17416 1 1911 . 1 1 158 158 PHE HA H 1 4.521 0.020 . 1 . . . . 158 PHE HA . 17416 1 1912 . 1 1 158 158 PHE HB2 H 1 3.358 0.020 . 2 . . . . 158 PHE HB2 . 17416 1 1913 . 1 1 158 158 PHE HB3 H 1 3.358 0.020 . 2 . . . . 158 PHE HB3 . 17416 1 1914 . 1 1 158 158 PHE HD1 H 1 7.232 0.020 . 1 . . . . 158 PHE HD1 . 17416 1 1915 . 1 1 158 158 PHE HD2 H 1 7.232 0.020 . 1 . . . . 158 PHE HD2 . 17416 1 1916 . 1 1 158 158 PHE HE1 H 1 7.251 0.020 . 1 . . . . 158 PHE HE1 . 17416 1 1917 . 1 1 158 158 PHE HE2 H 1 7.251 0.020 . 1 . . . . 158 PHE HE2 . 17416 1 1918 . 1 1 158 158 PHE HZ H 1 7.038 0.020 . 1 . . . . 158 PHE HZ . 17416 1 1919 . 1 1 158 158 PHE C C 13 175.256 0.400 . 1 . . . . 158 PHE C . 17416 1 1920 . 1 1 158 158 PHE CA C 13 59.248 0.400 . 1 . . . . 158 PHE CA . 17416 1 1921 . 1 1 158 158 PHE CB C 13 38.177 0.400 . 1 . . . . 158 PHE CB . 17416 1 1922 . 1 1 158 158 PHE N N 15 114.732 0.400 . 1 . . . . 158 PHE N . 17416 1 1923 . 1 1 159 159 LEU H H 1 6.657 0.020 . 1 . . . . 159 LEU H . 17416 1 1924 . 1 1 159 159 LEU HA H 1 3.850 0.020 . 1 . . . . 159 LEU HA . 17416 1 1925 . 1 1 159 159 LEU HB2 H 1 1.727 0.020 . 2 . . . . 159 LEU HB2 . 17416 1 1926 . 1 1 159 159 LEU HB3 H 1 1.201 0.020 . 2 . . . . 159 LEU HB3 . 17416 1 1927 . 1 1 159 159 LEU HG H 1 0.483 0.020 . 1 . . . . 159 LEU HG . 17416 1 1928 . 1 1 159 159 LEU HD11 H 1 0.306 0.020 . 2 . . . . 159 LEU HD1 . 17416 1 1929 . 1 1 159 159 LEU HD12 H 1 0.306 0.020 . 2 . . . . 159 LEU HD1 . 17416 1 1930 . 1 1 159 159 LEU HD13 H 1 0.306 0.020 . 2 . . . . 159 LEU HD1 . 17416 1 1931 . 1 1 159 159 LEU HD21 H 1 0.642 0.020 . 2 . . . . 159 LEU HD2 . 17416 1 1932 . 1 1 159 159 LEU HD22 H 1 0.642 0.020 . 2 . . . . 159 LEU HD2 . 17416 1 1933 . 1 1 159 159 LEU HD23 H 1 0.642 0.020 . 2 . . . . 159 LEU HD2 . 17416 1 1934 . 1 1 159 159 LEU C C 13 178.275 0.400 . 1 . . . . 159 LEU C . 17416 1 1935 . 1 1 159 159 LEU CA C 13 56.436 0.400 . 1 . . . . 159 LEU CA . 17416 1 1936 . 1 1 159 159 LEU CB C 13 41.907 0.400 . 1 . . . . 159 LEU CB . 17416 1 1937 . 1 1 159 159 LEU CG C 13 26.262 0.400 . 1 . . . . 159 LEU CG . 17416 1 1938 . 1 1 159 159 LEU CD1 C 13 26.311 0.400 . 1 . . . . 159 LEU CD1 . 17416 1 1939 . 1 1 159 159 LEU CD2 C 13 22.852 0.400 . 1 . . . . 159 LEU CD2 . 17416 1 1940 . 1 1 159 159 LEU N N 15 121.062 0.400 . 1 . . . . 159 LEU N . 17416 1 1941 . 1 1 160 160 GLY H H 1 7.312 0.020 . 1 . . . . 160 GLY H . 17416 1 1942 . 1 1 160 160 GLY HA2 H 1 3.801 0.020 . 2 . . . . 160 GLY HA2 . 17416 1 1943 . 1 1 160 160 GLY HA3 H 1 4.049 0.020 . 2 . . . . 160 GLY HA3 . 17416 1 1944 . 1 1 160 160 GLY C C 13 173.408 0.400 . 1 . . . . 160 GLY C . 17416 1 1945 . 1 1 160 160 GLY CA C 13 46.488 0.400 . 1 . . . . 160 GLY CA . 17416 1 1946 . 1 1 160 160 GLY N N 15 103.492 0.400 . 1 . . . . 160 GLY N . 17416 1 1947 . 1 1 161 161 ARG H H 1 8.294 0.020 . 1 . . . . 161 ARG H . 17416 1 1948 . 1 1 161 161 ARG HA H 1 5.155 0.020 . 1 . . . . 161 ARG HA . 17416 1 1949 . 1 1 161 161 ARG HB2 H 1 1.864 0.020 . 2 . . . . 161 ARG HB2 . 17416 1 1950 . 1 1 161 161 ARG HB3 H 1 2.015 0.020 . 2 . . . . 161 ARG HB3 . 17416 1 1951 . 1 1 161 161 ARG HG2 H 1 1.667 0.020 . 2 . . . . 161 ARG HG2 . 17416 1 1952 . 1 1 161 161 ARG HG3 H 1 1.786 0.020 . 2 . . . . 161 ARG HG3 . 17416 1 1953 . 1 1 161 161 ARG HD2 H 1 3.354 0.020 . 2 . . . . 161 ARG HD2 . 17416 1 1954 . 1 1 161 161 ARG HD3 H 1 3.354 0.020 . 2 . . . . 161 ARG HD3 . 17416 1 1955 . 1 1 161 161 ARG C C 13 176.523 0.400 . 1 . . . . 161 ARG C . 17416 1 1956 . 1 1 161 161 ARG CA C 13 55.282 0.400 . 1 . . . . 161 ARG CA . 17416 1 1957 . 1 1 161 161 ARG CB C 13 30.893 0.400 . 1 . . . . 161 ARG CB . 17416 1 1958 . 1 1 161 161 ARG CG C 13 27.373 0.400 . 1 . . . . 161 ARG CG . 17416 1 1959 . 1 1 161 161 ARG CD C 13 43.332 0.400 . 1 . . . . 161 ARG CD . 17416 1 1960 . 1 1 161 161 ARG N N 15 125.476 0.400 . 1 . . . . 161 ARG N . 17416 1 1961 . 1 1 162 162 GLN H H 1 8.462 0.020 . 1 . . . . 162 GLN H . 17416 1 1962 . 1 1 162 162 GLN HA H 1 5.056 0.020 . 1 . . . . 162 GLN HA . 17416 1 1963 . 1 1 162 162 GLN HB2 H 1 2.273 0.020 . 2 . . . . 162 GLN HB2 . 17416 1 1964 . 1 1 162 162 GLN HB3 H 1 2.273 0.020 . 2 . . . . 162 GLN HB3 . 17416 1 1965 . 1 1 162 162 GLN HG2 H 1 2.345 0.020 . 2 . . . . 162 GLN HG2 . 17416 1 1966 . 1 1 162 162 GLN HG3 H 1 2.502 0.020 . 2 . . . . 162 GLN HG3 . 17416 1 1967 . 1 1 162 162 GLN C C 13 173.988 0.400 . 1 . . . . 162 GLN C . 17416 1 1968 . 1 1 162 162 GLN CA C 13 54.733 0.400 . 1 . . . . 162 GLN CA . 17416 1 1969 . 1 1 162 162 GLN CB C 13 35.356 0.400 . 1 . . . . 162 GLN CB . 17416 1 1970 . 1 1 162 162 GLN CG C 13 34.127 0.400 . 1 . . . . 162 GLN CG . 17416 1 1971 . 1 1 162 162 GLN N N 15 122.946 0.400 . 1 . . . . 162 GLN N . 17416 1 1972 . 1 1 163 163 LYS H H 1 8.708 0.020 . 1 . . . . 163 LYS H . 17416 1 1973 . 1 1 163 163 LYS HA H 1 5.826 0.020 . 1 . . . . 163 LYS HA . 17416 1 1974 . 1 1 163 163 LYS HB2 H 1 1.858 0.020 . 2 . . . . 163 LYS HB2 . 17416 1 1975 . 1 1 163 163 LYS HB3 H 1 1.766 0.020 . 2 . . . . 163 LYS HB3 . 17416 1 1976 . 1 1 163 163 LYS HG2 H 1 1.347 0.020 . 2 . . . . 163 LYS HG2 . 17416 1 1977 . 1 1 163 163 LYS HG3 H 1 1.434 0.020 . 2 . . . . 163 LYS HG3 . 17416 1 1978 . 1 1 163 163 LYS HD2 H 1 1.647 0.020 . 2 . . . . 163 LYS HD2 . 17416 1 1979 . 1 1 163 163 LYS HD3 H 1 1.647 0.020 . 2 . . . . 163 LYS HD3 . 17416 1 1980 . 1 1 163 163 LYS HE2 H 1 2.929 0.020 . 2 . . . . 163 LYS HE2 . 17416 1 1981 . 1 1 163 163 LYS HE3 H 1 2.929 0.020 . 2 . . . . 163 LYS HE3 . 17416 1 1982 . 1 1 163 163 LYS C C 13 174.769 0.400 . 1 . . . . 163 LYS C . 17416 1 1983 . 1 1 163 163 LYS CA C 13 54.984 0.400 . 1 . . . . 163 LYS CA . 17416 1 1984 . 1 1 163 163 LYS CB C 13 37.011 0.400 . 1 . . . . 163 LYS CB . 17416 1 1985 . 1 1 163 163 LYS CG C 13 23.954 0.400 . 1 . . . . 163 LYS CG . 17416 1 1986 . 1 1 163 163 LYS CD C 13 29.653 0.400 . 1 . . . . 163 LYS CD . 17416 1 1987 . 1 1 163 163 LYS CE C 13 41.622 0.400 . 1 . . . . 163 LYS CE . 17416 1 1988 . 1 1 163 163 LYS N N 15 119.853 0.400 . 1 . . . . 163 LYS N . 17416 1 1989 . 1 1 164 164 PHE H H 1 8.525 0.020 . 1 . . . . 164 PHE H . 17416 1 1990 . 1 1 164 164 PHE HA H 1 4.745 0.020 . 1 . . . . 164 PHE HA . 17416 1 1991 . 1 1 164 164 PHE HB2 H 1 2.549 0.020 . 2 . . . . 164 PHE HB2 . 17416 1 1992 . 1 1 164 164 PHE HB3 H 1 3.177 0.020 . 2 . . . . 164 PHE HB3 . 17416 1 1993 . 1 1 164 164 PHE HD1 H 1 7.171 0.020 . 1 . . . . 164 PHE HD1 . 17416 1 1994 . 1 1 164 164 PHE HD2 H 1 7.171 0.020 . 1 . . . . 164 PHE HD2 . 17416 1 1995 . 1 1 164 164 PHE HE1 H 1 7.242 0.020 . 1 . . . . 164 PHE HE1 . 17416 1 1996 . 1 1 164 164 PHE HE2 H 1 7.242 0.020 . 1 . . . . 164 PHE HE2 . 17416 1 1997 . 1 1 164 164 PHE HZ H 1 7.308 0.020 . 1 . . . . 164 PHE HZ . 17416 1 1998 . 1 1 164 164 PHE C C 13 172.525 0.400 . 1 . . . . 164 PHE C . 17416 1 1999 . 1 1 164 164 PHE CA C 13 58.683 0.400 . 1 . . . . 164 PHE CA . 17416 1 2000 . 1 1 164 164 PHE CB C 13 43.689 0.400 . 1 . . . . 164 PHE CB . 17416 1 2001 . 1 1 164 164 PHE N N 15 122.377 0.400 . 1 . . . . 164 PHE N . 17416 1 2002 . 1 1 165 165 THR H H 1 7.223 0.020 . 1 . . . . 165 THR H . 17416 1 2003 . 1 1 165 165 THR HA H 1 4.936 0.020 . 1 . . . . 165 THR HA . 17416 1 2004 . 1 1 165 165 THR HB H 1 3.431 0.020 . 1 . . . . 165 THR HB . 17416 1 2005 . 1 1 165 165 THR HG1 H 1 5.797 0.020 . 1 . . . . 165 THR HG1 . 17416 1 2006 . 1 1 165 165 THR HG21 H 1 0.932 0.020 . 1 . . . . 165 THR HG2 . 17416 1 2007 . 1 1 165 165 THR HG22 H 1 0.932 0.020 . 1 . . . . 165 THR HG2 . 17416 1 2008 . 1 1 165 165 THR HG23 H 1 0.932 0.020 . 1 . . . . 165 THR HG2 . 17416 1 2009 . 1 1 165 165 THR C C 13 172.332 0.400 . 1 . . . . 165 THR C . 17416 1 2010 . 1 1 165 165 THR CA C 13 61.793 0.400 . 1 . . . . 165 THR CA . 17416 1 2011 . 1 1 165 165 THR CB C 13 70.689 0.400 . 1 . . . . 165 THR CB . 17416 1 2012 . 1 1 165 165 THR CG2 C 13 21.383 0.400 . 1 . . . . 165 THR CG2 . 17416 1 2013 . 1 1 165 165 THR N N 15 123.869 0.400 . 1 . . . . 165 THR N . 17416 1 2014 . 1 1 166 166 PHE H H 1 9.561 0.020 . 1 . . . . 166 PHE H . 17416 1 2015 . 1 1 166 166 PHE HA H 1 4.703 0.020 . 1 . . . . 166 PHE HA . 17416 1 2016 . 1 1 166 166 PHE HB2 H 1 3.016 0.020 . 2 . . . . 166 PHE HB2 . 17416 1 2017 . 1 1 166 166 PHE HB3 H 1 3.164 0.020 . 2 . . . . 166 PHE HB3 . 17416 1 2018 . 1 1 166 166 PHE HD1 H 1 6.916 0.020 . 1 . . . . 166 PHE HD1 . 17416 1 2019 . 1 1 166 166 PHE HD2 H 1 6.916 0.020 . 1 . . . . 166 PHE HD2 . 17416 1 2020 . 1 1 166 166 PHE HE1 H 1 6.919 0.020 . 1 . . . . 166 PHE HE1 . 17416 1 2021 . 1 1 166 166 PHE HE2 H 1 6.919 0.020 . 1 . . . . 166 PHE HE2 . 17416 1 2022 . 1 1 166 166 PHE HZ H 1 7.592 0.020 . 1 . . . . 166 PHE HZ . 17416 1 2023 . 1 1 166 166 PHE C C 13 172.724 0.400 . 1 . . . . 166 PHE C . 17416 1 2024 . 1 1 166 166 PHE CA C 13 56.484 0.400 . 1 . . . . 166 PHE CA . 17416 1 2025 . 1 1 166 166 PHE CB C 13 43.097 0.400 . 1 . . . . 166 PHE CB . 17416 1 2026 . 1 1 166 166 PHE N N 15 128.182 0.400 . 1 . . . . 166 PHE N . 17416 1 2027 . 1 1 167 167 VAL H H 1 6.724 0.020 . 1 . . . . 167 VAL H . 17416 1 2028 . 1 1 167 167 VAL HA H 1 4.206 0.020 . 1 . . . . 167 VAL HA . 17416 1 2029 . 1 1 167 167 VAL HB H 1 1.620 0.020 . 1 . . . . 167 VAL HB . 17416 1 2030 . 1 1 167 167 VAL HG11 H 1 0.821 0.020 . 2 . . . . 167 VAL HG1 . 17416 1 2031 . 1 1 167 167 VAL HG12 H 1 0.821 0.020 . 2 . . . . 167 VAL HG1 . 17416 1 2032 . 1 1 167 167 VAL HG13 H 1 0.821 0.020 . 2 . . . . 167 VAL HG1 . 17416 1 2033 . 1 1 167 167 VAL HG21 H 1 0.686 0.020 . 2 . . . . 167 VAL HG2 . 17416 1 2034 . 1 1 167 167 VAL HG22 H 1 0.686 0.020 . 2 . . . . 167 VAL HG2 . 17416 1 2035 . 1 1 167 167 VAL HG23 H 1 0.686 0.020 . 2 . . . . 167 VAL HG2 . 17416 1 2036 . 1 1 167 167 VAL C C 13 173.414 0.400 . 1 . . . . 167 VAL C . 17416 1 2037 . 1 1 167 167 VAL CA C 13 59.594 0.400 . 1 . . . . 167 VAL CA . 17416 1 2038 . 1 1 167 167 VAL CB C 13 34.498 0.400 . 1 . . . . 167 VAL CB . 17416 1 2039 . 1 1 167 167 VAL CG1 C 13 20.785 0.400 . 1 . . . . 167 VAL CG1 . 17416 1 2040 . 1 1 167 167 VAL CG2 C 13 20.494 0.400 . 1 . . . . 167 VAL CG2 . 17416 1 2041 . 1 1 167 167 VAL N N 15 125.228 0.400 . 1 . . . . 167 VAL N . 17416 1 2042 . 1 1 168 168 GLU H H 1 7.381 0.020 . 1 . . . . 168 GLU H . 17416 1 2043 . 1 1 168 168 GLU HA H 1 3.907 0.020 . 1 . . . . 168 GLU HA . 17416 1 2044 . 1 1 168 168 GLU HB2 H 1 2.117 0.020 . 2 . . . . 168 GLU HB2 . 17416 1 2045 . 1 1 168 168 GLU HB3 H 1 2.268 0.020 . 2 . . . . 168 GLU HB3 . 17416 1 2046 . 1 1 168 168 GLU HG2 H 1 2.338 0.020 . 2 . . . . 168 GLU HG2 . 17416 1 2047 . 1 1 168 168 GLU HG3 H 1 2.459 0.020 . 2 . . . . 168 GLU HG3 . 17416 1 2048 . 1 1 168 168 GLU C C 13 175.257 0.400 . 1 . . . . 168 GLU C . 17416 1 2049 . 1 1 168 168 GLU CA C 13 58.102 0.400 . 1 . . . . 168 GLU CA . 17416 1 2050 . 1 1 168 168 GLU CB C 13 30.508 0.400 . 1 . . . . 168 GLU CB . 17416 1 2051 . 1 1 168 168 GLU CG C 13 35.923 0.400 . 1 . . . . 168 GLU CG . 17416 1 2052 . 1 1 168 168 GLU N N 15 122.137 0.400 . 1 . . . . 168 GLU N . 17416 1 2053 . 1 1 169 169 GLY H H 1 9.571 0.020 . 1 . . . . 169 GLY H . 17416 1 2054 . 1 1 169 169 GLY HA2 H 1 4.005 0.020 . 2 . . . . 169 GLY HA2 . 17416 1 2055 . 1 1 169 169 GLY HA3 H 1 4.506 0.020 . 2 . . . . 169 GLY HA3 . 17416 1 2056 . 1 1 169 169 GLY C C 13 175.840 0.400 . 1 . . . . 169 GLY C . 17416 1 2057 . 1 1 169 169 GLY CA C 13 44.788 0.400 . 1 . . . . 169 GLY CA . 17416 1 2058 . 1 1 169 169 GLY N N 15 113.781 0.400 . 1 . . . . 169 GLY N . 17416 1 2059 . 1 1 170 170 ASN H H 1 7.712 0.020 . 1 . . . . 170 ASN H . 17416 1 2060 . 1 1 170 170 ASN HA H 1 5.480 0.020 . 1 . . . . 170 ASN HA . 17416 1 2061 . 1 1 170 170 ASN HB2 H 1 2.793 0.020 . 2 . . . . 170 ASN HB2 . 17416 1 2062 . 1 1 170 170 ASN HB3 H 1 3.164 0.020 . 2 . . . . 170 ASN HB3 . 17416 1 2063 . 1 1 170 170 ASN HD21 H 1 6.779 0.020 . 2 . . . . 170 ASN HD21 . 17416 1 2064 . 1 1 170 170 ASN HD22 H 1 7.151 0.020 . 2 . . . . 170 ASN HD22 . 17416 1 2065 . 1 1 170 170 ASN C C 13 177.205 0.400 . 1 . . . . 170 ASN C . 17416 1 2066 . 1 1 170 170 ASN CA C 13 52.159 0.400 . 1 . . . . 170 ASN CA . 17416 1 2067 . 1 1 170 170 ASN CB C 13 38.202 0.400 . 1 . . . . 170 ASN CB . 17416 1 2068 . 1 1 170 170 ASN N N 15 119.173 0.400 . 1 . . . . 170 ASN N . 17416 1 2069 . 1 1 170 170 ASN ND2 N 15 112.956 0.400 . 1 . . . . 170 ASN ND2 . 17416 1 2070 . 1 1 171 171 GLU H H 1 9.734 0.020 . 1 . . . . 171 GLU H . 17416 1 2071 . 1 1 171 171 GLU HA H 1 4.108 0.020 . 1 . . . . 171 GLU HA . 17416 1 2072 . 1 1 171 171 GLU HB2 H 1 2.092 0.020 . 2 . . . . 171 GLU HB2 . 17416 1 2073 . 1 1 171 171 GLU HB3 H 1 2.296 0.020 . 2 . . . . 171 GLU HB3 . 17416 1 2074 . 1 1 171 171 GLU HG2 H 1 2.566 0.020 . 2 . . . . 171 GLU HG2 . 17416 1 2075 . 1 1 171 171 GLU HG3 H 1 2.665 0.020 . 2 . . . . 171 GLU HG3 . 17416 1 2076 . 1 1 171 171 GLU C C 13 178.179 0.400 . 1 . . . . 171 GLU C . 17416 1 2077 . 1 1 171 171 GLU CA C 13 62.109 0.400 . 1 . . . . 171 GLU CA . 17416 1 2078 . 1 1 171 171 GLU CB C 13 28.210 0.400 . 1 . . . . 171 GLU CB . 17416 1 2079 . 1 1 171 171 GLU CG C 13 37.839 0.400 . 1 . . . . 171 GLU CG . 17416 1 2080 . 1 1 171 171 GLU N N 15 120.919 0.400 . 1 . . . . 171 GLU N . 17416 1 2081 . 1 1 172 172 GLU H H 1 9.488 0.020 . 1 . . . . 172 GLU H . 17416 1 2082 . 1 1 172 172 GLU HA H 1 3.917 0.020 . 1 . . . . 172 GLU HA . 17416 1 2083 . 1 1 172 172 GLU HB2 H 1 2.151 0.020 . 2 . . . . 172 GLU HB2 . 17416 1 2084 . 1 1 172 172 GLU HB3 H 1 2.229 0.020 . 2 . . . . 172 GLU HB3 . 17416 1 2085 . 1 1 172 172 GLU HG2 H 1 2.354 0.020 . 2 . . . . 172 GLU HG2 . 17416 1 2086 . 1 1 172 172 GLU HG3 H 1 2.513 0.020 . 2 . . . . 172 GLU HG3 . 17416 1 2087 . 1 1 172 172 GLU C C 13 176.915 0.400 . 1 . . . . 172 GLU C . 17416 1 2088 . 1 1 172 172 GLU CA C 13 59.870 0.400 . 1 . . . . 172 GLU CA . 17416 1 2089 . 1 1 172 172 GLU CB C 13 28.513 0.400 . 1 . . . . 172 GLU CB . 17416 1 2090 . 1 1 172 172 GLU CG C 13 37.594 0.400 . 1 . . . . 172 GLU CG . 17416 1 2091 . 1 1 172 172 GLU N N 15 120.248 0.400 . 1 . . . . 172 GLU N . 17416 1 2092 . 1 1 173 173 GLU H H 1 7.975 0.020 . 1 . . . . 173 GLU H . 17416 1 2093 . 1 1 173 173 GLU HA H 1 4.199 0.020 . 1 . . . . 173 GLU HA . 17416 1 2094 . 1 1 173 173 GLU HB2 H 1 2.320 0.020 . 2 . . . . 173 GLU HB2 . 17416 1 2095 . 1 1 173 173 GLU HB3 H 1 2.432 0.020 . 2 . . . . 173 GLU HB3 . 17416 1 2096 . 1 1 173 173 GLU HG2 H 1 2.402 0.020 . 2 . . . . 173 GLU HG2 . 17416 1 2097 . 1 1 173 173 GLU HG3 H 1 2.684 0.020 . 2 . . . . 173 GLU HG3 . 17416 1 2098 . 1 1 173 173 GLU C C 13 176.913 0.400 . 1 . . . . 173 GLU C . 17416 1 2099 . 1 1 173 173 GLU CA C 13 57.048 0.400 . 1 . . . . 173 GLU CA . 17416 1 2100 . 1 1 173 173 GLU CB C 13 30.074 0.400 . 1 . . . . 173 GLU CB . 17416 1 2101 . 1 1 173 173 GLU CG C 13 36.208 0.400 . 1 . . . . 173 GLU CG . 17416 1 2102 . 1 1 173 173 GLU N N 15 115.106 0.400 . 1 . . . . 173 GLU N . 17416 1 2103 . 1 1 174 174 ILE H H 1 7.458 0.020 . 1 . . . . 174 ILE H . 17416 1 2104 . 1 1 174 174 ILE HA H 1 4.475 0.020 . 1 . . . . 174 ILE HA . 17416 1 2105 . 1 1 174 174 ILE HB H 1 1.942 0.020 . 1 . . . . 174 ILE HB . 17416 1 2106 . 1 1 174 174 ILE HG12 H 1 1.116 0.020 . 2 . . . . 174 ILE HG12 . 17416 1 2107 . 1 1 174 174 ILE HG13 H 1 1.291 0.020 . 2 . . . . 174 ILE HG13 . 17416 1 2108 . 1 1 174 174 ILE HG21 H 1 0.882 0.020 . 1 . . . . 174 ILE HG2 . 17416 1 2109 . 1 1 174 174 ILE HG22 H 1 0.882 0.020 . 1 . . . . 174 ILE HG2 . 17416 1 2110 . 1 1 174 174 ILE HG23 H 1 0.882 0.020 . 1 . . . . 174 ILE HG2 . 17416 1 2111 . 1 1 174 174 ILE HD11 H 1 0.375 0.020 . 1 . . . . 174 ILE HD1 . 17416 1 2112 . 1 1 174 174 ILE HD12 H 1 0.375 0.020 . 1 . . . . 174 ILE HD1 . 17416 1 2113 . 1 1 174 174 ILE HD13 H 1 0.375 0.020 . 1 . . . . 174 ILE HD1 . 17416 1 2114 . 1 1 174 174 ILE C C 13 176.912 0.400 . 1 . . . . 174 ILE C . 17416 1 2115 . 1 1 174 174 ILE CA C 13 61.559 0.400 . 1 . . . . 174 ILE CA . 17416 1 2116 . 1 1 174 174 ILE CB C 13 41.001 0.400 . 1 . . . . 174 ILE CB . 17416 1 2117 . 1 1 174 174 ILE CG1 C 13 25.664 0.400 . 1 . . . . 174 ILE CG1 . 17416 1 2118 . 1 1 174 174 ILE CG2 C 13 19.460 0.400 . 1 . . . . 174 ILE CG2 . 17416 1 2119 . 1 1 174 174 ILE CD1 C 13 15.478 0.400 . 1 . . . . 174 ILE CD1 . 17416 1 2120 . 1 1 174 174 ILE N N 15 104.895 0.400 . 1 . . . . 174 ILE N . 17416 1 2121 . 1 1 175 175 VAL H H 1 7.418 0.020 . 1 . . . . 175 VAL H . 17416 1 2122 . 1 1 175 175 VAL HA H 1 3.428 0.020 . 1 . . . . 175 VAL HA . 17416 1 2123 . 1 1 175 175 VAL HB H 1 1.884 0.020 . 1 . . . . 175 VAL HB . 17416 1 2124 . 1 1 175 175 VAL HG11 H 1 0.673 0.020 . 2 . . . . 175 VAL HG1 . 17416 1 2125 . 1 1 175 175 VAL HG12 H 1 0.673 0.020 . 2 . . . . 175 VAL HG1 . 17416 1 2126 . 1 1 175 175 VAL HG13 H 1 0.673 0.020 . 2 . . . . 175 VAL HG1 . 17416 1 2127 . 1 1 175 175 VAL HG21 H 1 0.677 0.020 . 2 . . . . 175 VAL HG2 . 17416 1 2128 . 1 1 175 175 VAL HG22 H 1 0.677 0.020 . 2 . . . . 175 VAL HG2 . 17416 1 2129 . 1 1 175 175 VAL HG23 H 1 0.677 0.020 . 2 . . . . 175 VAL HG2 . 17416 1 2130 . 1 1 175 175 VAL C C 13 173.793 0.400 . 1 . . . . 175 VAL C . 17416 1 2131 . 1 1 175 175 VAL CA C 13 64.613 0.400 . 1 . . . . 175 VAL CA . 17416 1 2132 . 1 1 175 175 VAL CB C 13 31.936 0.400 . 1 . . . . 175 VAL CB . 17416 1 2133 . 1 1 175 175 VAL CG1 C 13 21.084 0.400 . 1 . . . . 175 VAL CG1 . 17416 1 2134 . 1 1 175 175 VAL CG2 C 13 19.785 0.400 . 1 . . . . 175 VAL CG2 . 17416 1 2135 . 1 1 175 175 VAL N N 15 115.372 0.400 . 1 . . . . 175 VAL N . 17416 1 2136 . 1 1 176 176 LEU H H 1 7.336 0.020 . 1 . . . . 176 LEU H . 17416 1 2137 . 1 1 176 176 LEU HA H 1 4.538 0.020 . 1 . . . . 176 LEU HA . 17416 1 2138 . 1 1 176 176 LEU HB2 H 1 1.529 0.020 . 2 . . . . 176 LEU HB2 . 17416 1 2139 . 1 1 176 176 LEU HB3 H 1 1.749 0.020 . 2 . . . . 176 LEU HB3 . 17416 1 2140 . 1 1 176 176 LEU HG H 1 1.254 0.020 . 1 . . . . 176 LEU HG . 17416 1 2141 . 1 1 176 176 LEU HD11 H 1 0.478 0.020 . 2 . . . . 176 LEU HD1 . 17416 1 2142 . 1 1 176 176 LEU HD12 H 1 0.478 0.020 . 2 . . . . 176 LEU HD1 . 17416 1 2143 . 1 1 176 176 LEU HD13 H 1 0.478 0.020 . 2 . . . . 176 LEU HD1 . 17416 1 2144 . 1 1 176 176 LEU HD21 H 1 0.172 0.020 . 2 . . . . 176 LEU HD2 . 17416 1 2145 . 1 1 176 176 LEU HD22 H 1 0.172 0.020 . 2 . . . . 176 LEU HD2 . 17416 1 2146 . 1 1 176 176 LEU HD23 H 1 0.172 0.020 . 2 . . . . 176 LEU HD2 . 17416 1 2147 . 1 1 176 176 LEU C C 13 176.816 0.400 . 1 . . . . 176 LEU C . 17416 1 2148 . 1 1 176 176 LEU CA C 13 54.964 0.400 . 1 . . . . 176 LEU CA . 17416 1 2149 . 1 1 176 176 LEU CB C 13 42.477 0.400 . 1 . . . . 176 LEU CB . 17416 1 2150 . 1 1 176 176 LEU CG C 13 28.809 0.400 . 1 . . . . 176 LEU CG . 17416 1 2151 . 1 1 176 176 LEU CD1 C 13 24.805 0.400 . 1 . . . . 176 LEU CD1 . 17416 1 2152 . 1 1 176 176 LEU CD2 C 13 24.452 0.400 . 1 . . . . 176 LEU CD2 . 17416 1 2153 . 1 1 176 176 LEU N N 15 115.262 0.400 . 1 . . . . 176 LEU N . 17416 1 2154 . 1 1 177 177 ALA H H 1 7.168 0.020 . 1 . . . . 177 ALA H . 17416 1 2155 . 1 1 177 177 ALA HA H 1 4.438 0.020 . 1 . . . . 177 ALA HA . 17416 1 2156 . 1 1 177 177 ALA HB1 H 1 1.317 0.020 . 1 . . . . 177 ALA HB . 17416 1 2157 . 1 1 177 177 ALA HB2 H 1 1.317 0.020 . 1 . . . . 177 ALA HB . 17416 1 2158 . 1 1 177 177 ALA HB3 H 1 1.317 0.020 . 1 . . . . 177 ALA HB . 17416 1 2159 . 1 1 177 177 ALA C C 13 177.690 0.400 . 1 . . . . 177 ALA C . 17416 1 2160 . 1 1 177 177 ALA CA C 13 51.848 0.400 . 1 . . . . 177 ALA CA . 17416 1 2161 . 1 1 177 177 ALA CB C 13 19.798 0.400 . 1 . . . . 177 ALA CB . 17416 1 2162 . 1 1 177 177 ALA N N 15 121.575 0.400 . 1 . . . . 177 ALA N . 17416 1 2163 . 1 1 178 178 ARG H H 1 10.616 0.020 . 1 . . . . 178 ARG H . 17416 1 2164 . 1 1 178 178 ARG HA H 1 3.800 0.020 . 1 . . . . 178 ARG HA . 17416 1 2165 . 1 1 178 178 ARG HB2 H 1 1.902 0.020 . 2 . . . . 178 ARG HB2 . 17416 1 2166 . 1 1 178 178 ARG HB3 H 1 1.902 0.020 . 2 . . . . 178 ARG HB3 . 17416 1 2167 . 1 1 178 178 ARG HG2 H 1 1.670 0.020 . 2 . . . . 178 ARG HG2 . 17416 1 2168 . 1 1 178 178 ARG HG3 H 1 1.734 0.020 . 2 . . . . 178 ARG HG3 . 17416 1 2169 . 1 1 178 178 ARG HD2 H 1 3.248 0.020 . 2 . . . . 178 ARG HD2 . 17416 1 2170 . 1 1 178 178 ARG HD3 H 1 3.248 0.020 . 2 . . . . 178 ARG HD3 . 17416 1 2171 . 1 1 178 178 ARG C C 13 174.671 0.400 . 1 . . . . 178 ARG C . 17416 1 2172 . 1 1 178 178 ARG CA C 13 56.485 0.400 . 1 . . . . 178 ARG CA . 17416 1 2173 . 1 1 178 178 ARG CB C 13 30.223 0.400 . 1 . . . . 178 ARG CB . 17416 1 2174 . 1 1 178 178 ARG CG C 13 26.519 0.400 . 1 . . . . 178 ARG CG . 17416 1 2175 . 1 1 178 178 ARG CD C 13 43.037 0.400 . 1 . . . . 178 ARG CD . 17416 1 2176 . 1 1 178 178 ARG N N 15 132.906 0.400 . 1 . . . . 178 ARG N . 17416 1 2177 . 1 1 179 179 THR H H 1 7.186 0.020 . 1 . . . . 179 THR H . 17416 1 2178 . 1 1 179 179 THR HA H 1 3.119 0.020 . 1 . . . . 179 THR HA . 17416 1 2179 . 1 1 179 179 THR HB H 1 4.017 0.020 . 1 . . . . 179 THR HB . 17416 1 2180 . 1 1 179 179 THR HG21 H 1 1.459 0.020 . 1 . . . . 179 THR HG2 . 17416 1 2181 . 1 1 179 179 THR HG22 H 1 1.459 0.020 . 1 . . . . 179 THR HG2 . 17416 1 2182 . 1 1 179 179 THR HG23 H 1 1.459 0.020 . 1 . . . . 179 THR HG2 . 17416 1 2183 . 1 1 179 179 THR C C 13 170.485 0.400 . 1 . . . . 179 THR C . 17416 1 2184 . 1 1 179 179 THR CA C 13 63.603 0.400 . 1 . . . . 179 THR CA . 17416 1 2185 . 1 1 179 179 THR CB C 13 69.542 0.400 . 1 . . . . 179 THR CB . 17416 1 2186 . 1 1 179 179 THR CG2 C 13 20.156 0.400 . 1 . . . . 179 THR CG2 . 17416 1 2187 . 1 1 179 179 THR N N 15 111.991 0.400 . 1 . . . . 179 THR N . 17416 1 2188 . 1 1 180 180 PHE H H 1 6.196 0.020 . 1 . . . . 180 PHE H . 17416 1 2189 . 1 1 180 180 PHE HA H 1 5.831 0.020 . 1 . . . . 180 PHE HA . 17416 1 2190 . 1 1 180 180 PHE HB2 H 1 2.497 0.020 . 2 . . . . 180 PHE HB2 . 17416 1 2191 . 1 1 180 180 PHE HB3 H 1 2.638 0.020 . 2 . . . . 180 PHE HB3 . 17416 1 2192 . 1 1 180 180 PHE HD1 H 1 7.347 0.020 . 1 . . . . 180 PHE HD1 . 17416 1 2193 . 1 1 180 180 PHE HD2 H 1 7.347 0.020 . 1 . . . . 180 PHE HD2 . 17416 1 2194 . 1 1 180 180 PHE HE1 H 1 6.819 0.020 . 1 . . . . 180 PHE HE1 . 17416 1 2195 . 1 1 180 180 PHE HE2 H 1 6.819 0.020 . 1 . . . . 180 PHE HE2 . 17416 1 2196 . 1 1 180 180 PHE HZ H 1 6.751 0.020 . 1 . . . . 180 PHE HZ . 17416 1 2197 . 1 1 180 180 PHE C C 13 171.264 0.400 . 1 . . . . 180 PHE C . 17416 1 2198 . 1 1 180 180 PHE CA C 13 54.037 0.400 . 1 . . . . 180 PHE CA . 17416 1 2199 . 1 1 180 180 PHE CB C 13 43.132 0.400 . 1 . . . . 180 PHE CB . 17416 1 2200 . 1 1 180 180 PHE N N 15 115.923 0.400 . 1 . . . . 180 PHE N . 17416 1 2201 . 1 1 181 181 ALA H H 1 8.040 0.020 . 1 . . . . 181 ALA H . 17416 1 2202 . 1 1 181 181 ALA HA H 1 3.762 0.020 . 1 . . . . 181 ALA HA . 17416 1 2203 . 1 1 181 181 ALA HB1 H 1 0.371 0.020 . 1 . . . . 181 ALA HB . 17416 1 2204 . 1 1 181 181 ALA HB2 H 1 0.371 0.020 . 1 . . . . 181 ALA HB . 17416 1 2205 . 1 1 181 181 ALA HB3 H 1 0.371 0.020 . 1 . . . . 181 ALA HB . 17416 1 2206 . 1 1 181 181 ALA C C 13 174.673 0.400 . 1 . . . . 181 ALA C . 17416 1 2207 . 1 1 181 181 ALA CA C 13 49.647 0.400 . 1 . . . . 181 ALA CA . 17416 1 2208 . 1 1 181 181 ALA CB C 13 21.376 0.400 . 1 . . . . 181 ALA CB . 17416 1 2209 . 1 1 181 181 ALA N N 15 117.806 0.400 . 1 . . . . 181 ALA N . 17416 1 2210 . 1 1 182 182 PHE H H 1 8.500 0.020 . 1 . . . . 182 PHE H . 17416 1 2211 . 1 1 182 182 PHE HA H 1 4.984 0.020 . 1 . . . . 182 PHE HA . 17416 1 2212 . 1 1 182 182 PHE HB2 H 1 1.062 0.020 . 2 . . . . 182 PHE HB2 . 17416 1 2213 . 1 1 182 182 PHE HB3 H 1 1.413 0.020 . 2 . . . . 182 PHE HB3 . 17416 1 2214 . 1 1 182 182 PHE HD1 H 1 6.998 0.020 . 1 . . . . 182 PHE HD1 . 17416 1 2215 . 1 1 182 182 PHE HD2 H 1 6.998 0.020 . 1 . . . . 182 PHE HD2 . 17416 1 2216 . 1 1 182 182 PHE HE1 H 1 7.249 0.020 . 1 . . . . 182 PHE HE1 . 17416 1 2217 . 1 1 182 182 PHE HE2 H 1 7.249 0.020 . 1 . . . . 182 PHE HE2 . 17416 1 2218 . 1 1 182 182 PHE HZ H 1 6.894 0.020 . 1 . . . . 182 PHE HZ . 17416 1 2219 . 1 1 182 182 PHE C C 13 177.986 0.400 . 1 . . . . 182 PHE C . 17416 1 2220 . 1 1 182 182 PHE CA C 13 55.615 0.400 . 1 . . . . 182 PHE CA . 17416 1 2221 . 1 1 182 182 PHE CB C 13 38.177 0.400 . 1 . . . . 182 PHE CB . 17416 1 2222 . 1 1 182 182 PHE N N 15 118.779 0.400 . 1 . . . . 182 PHE N . 17416 1 2223 . 1 1 183 183 ASP H H 1 9.186 0.020 . 1 . . . . 183 ASP H . 17416 1 2224 . 1 1 183 183 ASP HA H 1 3.647 0.020 . 1 . . . . 183 ASP HA . 17416 1 2225 . 1 1 183 183 ASP HB2 H 1 2.911 0.020 . 2 . . . . 183 ASP HB2 . 17416 1 2226 . 1 1 183 183 ASP HB3 H 1 2.377 0.020 . 2 . . . . 183 ASP HB3 . 17416 1 2227 . 1 1 183 183 ASP C C 13 178.864 0.400 . 1 . . . . 183 ASP C . 17416 1 2228 . 1 1 183 183 ASP CA C 13 57.160 0.400 . 1 . . . . 183 ASP CA . 17416 1 2229 . 1 1 183 183 ASP CB C 13 37.576 0.400 . 1 . . . . 183 ASP CB . 17416 1 2230 . 1 1 183 183 ASP N N 15 124.163 0.400 . 1 . . . . 183 ASP N . 17416 1 2231 . 1 1 184 184 TRP H H 1 8.231 0.020 . 1 . . . . 184 TRP H . 17416 1 2232 . 1 1 184 184 TRP HA H 1 4.730 0.020 . 1 . . . . 184 TRP HA . 17416 1 2233 . 1 1 184 184 TRP HB2 H 1 3.423 0.020 . 2 . . . . 184 TRP HB2 . 17416 1 2234 . 1 1 184 184 TRP HB3 H 1 3.620 0.020 . 2 . . . . 184 TRP HB3 . 17416 1 2235 . 1 1 184 184 TRP HD1 H 1 7.291 0.020 . 1 . . . . 184 TRP HD1 . 17416 1 2236 . 1 1 184 184 TRP HE1 H 1 10.349 0.020 . 1 . . . . 184 TRP HE1 . 17416 1 2237 . 1 1 184 184 TRP HE3 H 1 6.931 0.020 . 1 . . . . 184 TRP HE3 . 17416 1 2238 . 1 1 184 184 TRP HZ2 H 1 6.968 0.020 . 1 . . . . 184 TRP HZ2 . 17416 1 2239 . 1 1 184 184 TRP HZ3 H 1 6.983 0.020 . 1 . . . . 184 TRP HZ3 . 17416 1 2240 . 1 1 184 184 TRP HH2 H 1 6.586 0.020 . 1 . . . . 184 TRP HH2 . 17416 1 2241 . 1 1 184 184 TRP C C 13 176.522 0.400 . 1 . . . . 184 TRP C . 17416 1 2242 . 1 1 184 184 TRP CA C 13 59.327 0.400 . 1 . . . . 184 TRP CA . 17416 1 2243 . 1 1 184 184 TRP CB C 13 27.325 0.400 . 1 . . . . 184 TRP CB . 17416 1 2244 . 1 1 184 184 TRP N N 15 119.851 0.400 . 1 . . . . 184 TRP N . 17416 1 2245 . 1 1 184 184 TRP NE1 N 15 131.712 0.400 . 1 . . . . 184 TRP NE1 . 17416 1 2246 . 1 1 185 185 GLU H H 1 7.382 0.020 . 1 . . . . 185 GLU H . 17416 1 2247 . 1 1 185 185 GLU HA H 1 4.576 0.020 . 1 . . . . 185 GLU HA . 17416 1 2248 . 1 1 185 185 GLU HB2 H 1 1.998 0.020 . 2 . . . . 185 GLU HB2 . 17416 1 2249 . 1 1 185 185 GLU HB3 H 1 2.077 0.020 . 2 . . . . 185 GLU HB3 . 17416 1 2250 . 1 1 185 185 GLU HG2 H 1 1.777 0.020 . 2 . . . . 185 GLU HG2 . 17416 1 2251 . 1 1 185 185 GLU HG3 H 1 2.237 0.020 . 2 . . . . 185 GLU HG3 . 17416 1 2252 . 1 1 185 185 GLU C C 13 177.787 0.400 . 1 . . . . 185 GLU C . 17416 1 2253 . 1 1 185 185 GLU CA C 13 56.754 0.400 . 1 . . . . 185 GLU CA . 17416 1 2254 . 1 1 185 185 GLU CB C 13 31.291 0.400 . 1 . . . . 185 GLU CB . 17416 1 2255 . 1 1 185 185 GLU CG C 13 37.040 0.400 . 1 . . . . 185 GLU CG . 17416 1 2256 . 1 1 185 185 GLU N N 15 121.044 0.400 . 1 . . . . 185 GLU N . 17416 1 2257 . 1 1 186 186 ILE H H 1 7.177 0.020 . 1 . . . . 186 ILE H . 17416 1 2258 . 1 1 186 186 ILE HA H 1 3.454 0.020 . 1 . . . . 186 ILE HA . 17416 1 2259 . 1 1 186 186 ILE HB H 1 1.672 0.020 . 1 . . . . 186 ILE HB . 17416 1 2260 . 1 1 186 186 ILE HG12 H 1 0.661 0.020 . 2 . . . . 186 ILE HG12 . 17416 1 2261 . 1 1 186 186 ILE HG13 H 1 1.449 0.020 . 2 . . . . 186 ILE HG13 . 17416 1 2262 . 1 1 186 186 ILE HG21 H 1 0.719 0.020 . 1 . . . . 186 ILE HG2 . 17416 1 2263 . 1 1 186 186 ILE HG22 H 1 0.719 0.020 . 1 . . . . 186 ILE HG2 . 17416 1 2264 . 1 1 186 186 ILE HG23 H 1 0.719 0.020 . 1 . . . . 186 ILE HG2 . 17416 1 2265 . 1 1 186 186 ILE HD11 H 1 -0.083 0.020 . 1 . . . . 186 ILE HD1 . 17416 1 2266 . 1 1 186 186 ILE HD12 H 1 -0.083 0.020 . 1 . . . . 186 ILE HD1 . 17416 1 2267 . 1 1 186 186 ILE HD13 H 1 -0.083 0.020 . 1 . . . . 186 ILE HD1 . 17416 1 2268 . 1 1 186 186 ILE C C 13 177.205 0.400 . 1 . . . . 186 ILE C . 17416 1 2269 . 1 1 186 186 ILE CA C 13 65.822 0.400 . 1 . . . . 186 ILE CA . 17416 1 2270 . 1 1 186 186 ILE CB C 13 37.618 0.400 . 1 . . . . 186 ILE CB . 17416 1 2271 . 1 1 186 186 ILE CG1 C 13 29.118 0.400 . 1 . . . . 186 ILE CG1 . 17416 1 2272 . 1 1 186 186 ILE CG2 C 13 17.966 0.400 . 1 . . . . 186 ILE CG2 . 17416 1 2273 . 1 1 186 186 ILE CD1 C 13 12.339 0.400 . 1 . . . . 186 ILE CD1 . 17416 1 2274 . 1 1 186 186 ILE N N 15 119.846 0.400 . 1 . . . . 186 ILE N . 17416 1 2275 . 1 1 187 187 GLU H H 1 8.497 0.020 . 1 . . . . 187 GLU H . 17416 1 2276 . 1 1 187 187 GLU HA H 1 4.017 0.020 . 1 . . . . 187 GLU HA . 17416 1 2277 . 1 1 187 187 GLU HB2 H 1 1.995 0.020 . 2 . . . . 187 GLU HB2 . 17416 1 2278 . 1 1 187 187 GLU HB3 H 1 2.059 0.020 . 2 . . . . 187 GLU HB3 . 17416 1 2279 . 1 1 187 187 GLU HG2 H 1 2.207 0.020 . 2 . . . . 187 GLU HG2 . 17416 1 2280 . 1 1 187 187 GLU HG3 H 1 2.281 0.020 . 2 . . . . 187 GLU HG3 . 17416 1 2281 . 1 1 187 187 GLU C C 13 178.667 0.400 . 1 . . . . 187 GLU C . 17416 1 2282 . 1 1 187 187 GLU CA C 13 59.589 0.400 . 1 . . . . 187 GLU CA . 17416 1 2283 . 1 1 187 187 GLU CB C 13 29.083 0.400 . 1 . . . . 187 GLU CB . 17416 1 2284 . 1 1 187 187 GLU CG C 13 35.923 0.400 . 1 . . . . 187 GLU CG . 17416 1 2285 . 1 1 187 187 GLU N N 15 118.227 0.400 . 1 . . . . 187 GLU N . 17416 1 2286 . 1 1 188 188 HIS H H 1 7.649 0.020 . 1 . . . . 188 HIS H . 17416 1 2287 . 1 1 188 188 HIS HA H 1 4.386 0.020 . 1 . . . . 188 HIS HA . 17416 1 2288 . 1 1 188 188 HIS HB2 H 1 3.348 0.020 . 2 . . . . 188 HIS HB2 . 17416 1 2289 . 1 1 188 188 HIS HB3 H 1 3.348 0.020 . 2 . . . . 188 HIS HB3 . 17416 1 2290 . 1 1 188 188 HIS HD2 H 1 7.168 0.020 . 1 . . . . 188 HIS HD2 . 17416 1 2291 . 1 1 188 188 HIS C C 13 179.543 0.400 . 1 . . . . 188 HIS C . 17416 1 2292 . 1 1 188 188 HIS CA C 13 59.311 0.400 . 1 . . . . 188 HIS CA . 17416 1 2293 . 1 1 188 188 HIS CB C 13 30.360 0.400 . 1 . . . . 188 HIS CB . 17416 1 2294 . 1 1 188 188 HIS N N 15 119.025 0.400 . 1 . . . . 188 HIS N . 17416 1 2295 . 1 1 189 189 ILE H H 1 8.046 0.020 . 1 . . . . 189 ILE H . 17416 1 2296 . 1 1 189 189 ILE HA H 1 3.563 0.020 . 1 . . . . 189 ILE HA . 17416 1 2297 . 1 1 189 189 ILE HB H 1 1.990 0.020 . 1 . . . . 189 ILE HB . 17416 1 2298 . 1 1 189 189 ILE HG12 H 1 0.971 0.020 . 2 . . . . 189 ILE HG12 . 17416 1 2299 . 1 1 189 189 ILE HG13 H 1 1.808 0.020 . 2 . . . . 189 ILE HG13 . 17416 1 2300 . 1 1 189 189 ILE HG21 H 1 0.760 0.020 . 1 . . . . 189 ILE HG2 . 17416 1 2301 . 1 1 189 189 ILE HG22 H 1 0.760 0.020 . 1 . . . . 189 ILE HG2 . 17416 1 2302 . 1 1 189 189 ILE HG23 H 1 0.760 0.020 . 1 . . . . 189 ILE HG2 . 17416 1 2303 . 1 1 189 189 ILE HD11 H 1 0.728 0.020 . 1 . . . . 189 ILE HD1 . 17416 1 2304 . 1 1 189 189 ILE HD12 H 1 0.728 0.020 . 1 . . . . 189 ILE HD1 . 17416 1 2305 . 1 1 189 189 ILE HD13 H 1 0.728 0.020 . 1 . . . . 189 ILE HD1 . 17416 1 2306 . 1 1 189 189 ILE C C 13 177.690 0.400 . 1 . . . . 189 ILE C . 17416 1 2307 . 1 1 189 189 ILE CA C 13 64.613 0.400 . 1 . . . . 189 ILE CA . 17416 1 2308 . 1 1 189 189 ILE CB C 13 38.131 0.400 . 1 . . . . 189 ILE CB . 17416 1 2309 . 1 1 189 189 ILE CG1 C 13 29.090 0.400 . 1 . . . . 189 ILE CG1 . 17416 1 2310 . 1 1 189 189 ILE CG2 C 13 17.359 0.400 . 1 . . . . 189 ILE CG2 . 17416 1 2311 . 1 1 189 189 ILE CD1 C 13 13.344 0.400 . 1 . . . . 189 ILE CD1 . 17416 1 2312 . 1 1 189 189 ILE N N 15 119.612 0.400 . 1 . . . . 189 ILE N . 17416 1 2313 . 1 1 190 190 LYS H H 1 8.323 0.020 . 1 . . . . 190 LYS H . 17416 1 2314 . 1 1 190 190 LYS HA H 1 4.485 0.020 . 1 . . . . 190 LYS HA . 17416 1 2315 . 1 1 190 190 LYS HB2 H 1 1.903 0.020 . 2 . . . . 190 LYS HB2 . 17416 1 2316 . 1 1 190 190 LYS HB3 H 1 1.903 0.020 . 2 . . . . 190 LYS HB3 . 17416 1 2317 . 1 1 190 190 LYS HG2 H 1 1.580 0.020 . 2 . . . . 190 LYS HG2 . 17416 1 2318 . 1 1 190 190 LYS HG3 H 1 1.762 0.020 . 2 . . . . 190 LYS HG3 . 17416 1 2319 . 1 1 190 190 LYS HD2 H 1 1.734 0.020 . 2 . . . . 190 LYS HD2 . 17416 1 2320 . 1 1 190 190 LYS HD3 H 1 1.734 0.020 . 2 . . . . 190 LYS HD3 . 17416 1 2321 . 1 1 190 190 LYS HE2 H 1 2.969 0.020 . 2 . . . . 190 LYS HE2 . 17416 1 2322 . 1 1 190 190 LYS HE3 H 1 3.052 0.020 . 2 . . . . 190 LYS HE3 . 17416 1 2323 . 1 1 190 190 LYS C C 13 181.491 0.400 . 1 . . . . 190 LYS C . 17416 1 2324 . 1 1 190 190 LYS CA C 13 58.691 0.400 . 1 . . . . 190 LYS CA . 17416 1 2325 . 1 1 190 190 LYS CB C 13 31.934 0.400 . 1 . . . . 190 LYS CB . 17416 1 2326 . 1 1 190 190 LYS CG C 13 25.179 0.400 . 1 . . . . 190 LYS CG . 17416 1 2327 . 1 1 190 190 LYS CD C 13 29.083 0.400 . 1 . . . . 190 LYS CD . 17416 1 2328 . 1 1 190 190 LYS CE C 13 41.537 0.400 . 1 . . . . 190 LYS CE . 17416 1 2329 . 1 1 190 190 LYS N N 15 117.581 0.400 . 1 . . . . 190 LYS N . 17416 1 2330 . 1 1 191 191 LYS H H 1 7.991 0.020 . 1 . . . . 191 LYS H . 17416 1 2331 . 1 1 191 191 LYS HA H 1 4.102 0.020 . 1 . . . . 191 LYS HA . 17416 1 2332 . 1 1 191 191 LYS HB2 H 1 2.101 0.020 . 2 . . . . 191 LYS HB2 . 17416 1 2333 . 1 1 191 191 LYS HB3 H 1 2.024 0.020 . 2 . . . . 191 LYS HB3 . 17416 1 2334 . 1 1 191 191 LYS HG2 H 1 1.543 0.020 . 2 . . . . 191 LYS HG2 . 17416 1 2335 . 1 1 191 191 LYS HG3 H 1 1.647 0.020 . 2 . . . . 191 LYS HG3 . 17416 1 2336 . 1 1 191 191 LYS HD2 H 1 1.768 0.020 . 2 . . . . 191 LYS HD2 . 17416 1 2337 . 1 1 191 191 LYS HD3 H 1 1.768 0.020 . 2 . . . . 191 LYS HD3 . 17416 1 2338 . 1 1 191 191 LYS HE2 H 1 3.035 0.020 . 2 . . . . 191 LYS HE2 . 17416 1 2339 . 1 1 191 191 LYS HE3 H 1 3.035 0.020 . 2 . . . . 191 LYS HE3 . 17416 1 2340 . 1 1 191 191 LYS C C 13 178.763 0.400 . 1 . . . . 191 LYS C . 17416 1 2341 . 1 1 191 191 LYS CA C 13 59.271 0.400 . 1 . . . . 191 LYS CA . 17416 1 2342 . 1 1 191 191 LYS CB C 13 32.226 0.400 . 1 . . . . 191 LYS CB . 17416 1 2343 . 1 1 191 191 LYS CG C 13 25.094 0.400 . 1 . . . . 191 LYS CG . 17416 1 2344 . 1 1 191 191 LYS CD C 13 29.083 0.400 . 1 . . . . 191 LYS CD . 17416 1 2345 . 1 1 191 191 LYS CE C 13 41.907 0.400 . 1 . . . . 191 LYS CE . 17416 1 2346 . 1 1 191 191 LYS N N 15 121.598 0.400 . 1 . . . . 191 LYS N . 17416 1 2347 . 1 1 192 192 VAL H H 1 7.408 0.020 . 1 . . . . 192 VAL H . 17416 1 2348 . 1 1 192 192 VAL HA H 1 4.396 0.020 . 1 . . . . 192 VAL HA . 17416 1 2349 . 1 1 192 192 VAL HB H 1 2.461 0.020 . 1 . . . . 192 VAL HB . 17416 1 2350 . 1 1 192 192 VAL HG11 H 1 0.892 0.020 . 2 . . . . 192 VAL HG1 . 17416 1 2351 . 1 1 192 192 VAL HG12 H 1 0.892 0.020 . 2 . . . . 192 VAL HG1 . 17416 1 2352 . 1 1 192 192 VAL HG13 H 1 0.892 0.020 . 2 . . . . 192 VAL HG1 . 17416 1 2353 . 1 1 192 192 VAL HG21 H 1 0.959 0.020 . 2 . . . . 192 VAL HG2 . 17416 1 2354 . 1 1 192 192 VAL HG22 H 1 0.959 0.020 . 2 . . . . 192 VAL HG2 . 17416 1 2355 . 1 1 192 192 VAL HG23 H 1 0.959 0.020 . 2 . . . . 192 VAL HG2 . 17416 1 2356 . 1 1 192 192 VAL C C 13 176.225 0.400 . 1 . . . . 192 VAL C . 17416 1 2357 . 1 1 192 192 VAL CA C 13 61.289 0.400 . 1 . . . . 192 VAL CA . 17416 1 2358 . 1 1 192 192 VAL CB C 13 30.793 0.400 . 1 . . . . 192 VAL CB . 17416 1 2359 . 1 1 192 192 VAL CG1 C 13 21.104 0.400 . 1 . . . . 192 VAL CG1 . 17416 1 2360 . 1 1 192 192 VAL CG2 C 13 18.900 0.400 . 1 . . . . 192 VAL CG2 . 17416 1 2361 . 1 1 192 192 VAL N N 15 110.809 0.400 . 1 . . . . 192 VAL N . 17416 1 2362 . 1 1 193 193 GLY H H 1 7.696 0.020 . 1 . . . . 193 GLY H . 17416 1 2363 . 1 1 193 193 GLY HA2 H 1 3.733 0.020 . 2 . . . . 193 GLY HA2 . 17416 1 2364 . 1 1 193 193 GLY HA3 H 1 4.402 0.020 . 2 . . . . 193 GLY HA3 . 17416 1 2365 . 1 1 193 193 GLY C C 13 173.503 0.400 . 1 . . . . 193 GLY C . 17416 1 2366 . 1 1 193 193 GLY CA C 13 45.316 0.400 . 1 . . . . 193 GLY CA . 17416 1 2367 . 1 1 193 193 GLY N N 15 108.224 0.400 . 1 . . . . 193 GLY N . 17416 1 2368 . 1 1 194 194 LEU H H 1 7.499 0.020 . 1 . . . . 194 LEU H . 17416 1 2369 . 1 1 194 194 LEU HA H 1 4.871 0.020 . 1 . . . . 194 LEU HA . 17416 1 2370 . 1 1 194 194 LEU HB2 H 1 1.537 0.020 . 2 . . . . 194 LEU HB2 . 17416 1 2371 . 1 1 194 194 LEU HB3 H 1 1.462 0.020 . 2 . . . . 194 LEU HB3 . 17416 1 2372 . 1 1 194 194 LEU HG H 1 1.344 0.020 . 1 . . . . 194 LEU HG . 17416 1 2373 . 1 1 194 194 LEU HD11 H 1 0.652 0.020 . 2 . . . . 194 LEU HD1 . 17416 1 2374 . 1 1 194 194 LEU HD12 H 1 0.652 0.020 . 2 . . . . 194 LEU HD1 . 17416 1 2375 . 1 1 194 194 LEU HD13 H 1 0.652 0.020 . 2 . . . . 194 LEU HD1 . 17416 1 2376 . 1 1 194 194 LEU HD21 H 1 0.545 0.020 . 2 . . . . 194 LEU HD2 . 17416 1 2377 . 1 1 194 194 LEU HD22 H 1 0.545 0.020 . 2 . . . . 194 LEU HD2 . 17416 1 2378 . 1 1 194 194 LEU HD23 H 1 0.545 0.020 . 2 . . . . 194 LEU HD2 . 17416 1 2379 . 1 1 194 194 LEU C C 13 176.715 0.400 . 1 . . . . 194 LEU C . 17416 1 2380 . 1 1 194 194 LEU CA C 13 52.761 0.400 . 1 . . . . 194 LEU CA . 17416 1 2381 . 1 1 194 194 LEU CB C 13 43.125 0.400 . 1 . . . . 194 LEU CB . 17416 1 2382 . 1 1 194 194 LEU CG C 13 26.804 0.400 . 1 . . . . 194 LEU CG . 17416 1 2383 . 1 1 194 194 LEU CD1 C 13 26.610 0.400 . 1 . . . . 194 LEU CD1 . 17416 1 2384 . 1 1 194 194 LEU CD2 C 13 21.983 0.400 . 1 . . . . 194 LEU CD2 . 17416 1 2385 . 1 1 194 194 LEU N N 15 119.569 0.400 . 1 . . . . 194 LEU N . 17416 1 2386 . 1 1 195 195 GLY H H 1 9.802 0.020 . 1 . . . . 195 GLY H . 17416 1 2387 . 1 1 195 195 GLY HA2 H 1 3.491 0.020 . 2 . . . . 195 GLY HA2 . 17416 1 2388 . 1 1 195 195 GLY HA3 H 1 3.646 0.020 . 2 . . . . 195 GLY HA3 . 17416 1 2389 . 1 1 195 195 GLY C C 13 176.425 0.400 . 1 . . . . 195 GLY C . 17416 1 2390 . 1 1 195 195 GLY CA C 13 46.818 0.400 . 1 . . . . 195 GLY CA . 17416 1 2391 . 1 1 195 195 GLY N N 15 107.021 0.400 . 1 . . . . 195 GLY N . 17416 1 2392 . 1 1 196 196 LYS H H 1 7.673 0.020 . 1 . . . . 196 LYS H . 17416 1 2393 . 1 1 196 196 LYS HA H 1 3.779 0.020 . 1 . . . . 196 LYS HA . 17416 1 2394 . 1 1 196 196 LYS HB2 H 1 1.285 0.020 . 2 . . . . 196 LYS HB2 . 17416 1 2395 . 1 1 196 196 LYS HB3 H 1 1.609 0.020 . 2 . . . . 196 LYS HB3 . 17416 1 2396 . 1 1 196 196 LYS HG2 H 1 1.276 0.020 . 2 . . . . 196 LYS HG2 . 17416 1 2397 . 1 1 196 196 LYS HG3 H 1 1.387 0.020 . 2 . . . . 196 LYS HG3 . 17416 1 2398 . 1 1 196 196 LYS HD2 H 1 1.610 0.020 . 2 . . . . 196 LYS HD2 . 17416 1 2399 . 1 1 196 196 LYS HD3 H 1 1.610 0.020 . 2 . . . . 196 LYS HD3 . 17416 1 2400 . 1 1 196 196 LYS HE2 H 1 2.996 0.020 . 2 . . . . 196 LYS HE2 . 17416 1 2401 . 1 1 196 196 LYS HE3 H 1 2.996 0.020 . 2 . . . . 196 LYS HE3 . 17416 1 2402 . 1 1 196 196 LYS C C 13 178.080 0.400 . 1 . . . . 196 LYS C . 17416 1 2403 . 1 1 196 196 LYS CA C 13 59.863 0.400 . 1 . . . . 196 LYS CA . 17416 1 2404 . 1 1 196 196 LYS CB C 13 31.936 0.400 . 1 . . . . 196 LYS CB . 17416 1 2405 . 1 1 196 196 LYS CG C 13 25.949 0.400 . 1 . . . . 196 LYS CG . 17416 1 2406 . 1 1 196 196 LYS CD C 13 29.385 0.400 . 1 . . . . 196 LYS CD . 17416 1 2407 . 1 1 196 196 LYS CE C 13 41.337 0.400 . 1 . . . . 196 LYS CE . 17416 1 2408 . 1 1 196 196 LYS N N 15 118.202 0.400 . 1 . . . . 196 LYS N . 17416 1 2409 . 1 1 197 197 GLY H H 1 8.661 0.020 . 1 . . . . 197 GLY H . 17416 1 2410 . 1 1 197 197 GLY HA2 H 1 3.483 0.020 . 2 . . . . 197 GLY HA2 . 17416 1 2411 . 1 1 197 197 GLY HA3 H 1 4.194 0.020 . 2 . . . . 197 GLY HA3 . 17416 1 2412 . 1 1 197 197 GLY C C 13 174.476 0.400 . 1 . . . . 197 GLY C . 17416 1 2413 . 1 1 197 197 GLY CA C 13 44.097 0.400 . 1 . . . . 197 GLY CA . 17416 1 2414 . 1 1 197 197 GLY N N 15 105.535 0.400 . 1 . . . . 197 GLY N . 17416 1 2415 . 1 1 198 198 GLY H H 1 7.478 0.020 . 1 . . . . 198 GLY H . 17416 1 2416 . 1 1 198 198 GLY HA2 H 1 2.666 0.020 . 2 . . . . 198 GLY HA2 . 17416 1 2417 . 1 1 198 198 GLY HA3 H 1 3.836 0.020 . 2 . . . . 198 GLY HA3 . 17416 1 2418 . 1 1 198 198 GLY C C 13 171.944 0.400 . 1 . . . . 198 GLY C . 17416 1 2419 . 1 1 198 198 GLY CA C 13 45.300 0.400 . 1 . . . . 198 GLY CA . 17416 1 2420 . 1 1 198 198 GLY N N 15 109.444 0.400 . 1 . . . . 198 GLY N . 17416 1 2421 . 1 1 199 199 SER H H 1 8.808 0.020 . 1 . . . . 199 SER H . 17416 1 2422 . 1 1 199 199 SER HA H 1 4.093 0.020 . 1 . . . . 199 SER HA . 17416 1 2423 . 1 1 199 199 SER HB2 H 1 3.575 0.020 . 2 . . . . 199 SER HB2 . 17416 1 2424 . 1 1 199 199 SER HB3 H 1 3.575 0.020 . 2 . . . . 199 SER HB3 . 17416 1 2425 . 1 1 199 199 SER CA C 13 56.496 0.400 . 1 . . . . 199 SER CA . 17416 1 2426 . 1 1 199 199 SER CB C 13 65.844 0.400 . 1 . . . . 199 SER CB . 17416 1 2427 . 1 1 199 199 SER N N 15 119.840 0.400 . 1 . . . . 199 SER N . 17416 1 2428 . 1 1 200 200 LEU H H 1 8.194 0.020 . 1 . . . . 200 LEU H . 17416 1 2429 . 1 1 200 200 LEU HA H 1 4.770 0.020 . 1 . . . . 200 LEU HA . 17416 1 2430 . 1 1 200 200 LEU HB2 H 1 1.856 0.020 . 2 . . . . 200 LEU HB2 . 17416 1 2431 . 1 1 200 200 LEU HB3 H 1 1.902 0.020 . 2 . . . . 200 LEU HB3 . 17416 1 2432 . 1 1 200 200 LEU HG H 1 2.001 0.020 . 1 . . . . 200 LEU HG . 17416 1 2433 . 1 1 200 200 LEU HD11 H 1 1.098 0.020 . 2 . . . . 200 LEU HD1 . 17416 1 2434 . 1 1 200 200 LEU HD12 H 1 1.098 0.020 . 2 . . . . 200 LEU HD1 . 17416 1 2435 . 1 1 200 200 LEU HD13 H 1 1.098 0.020 . 2 . . . . 200 LEU HD1 . 17416 1 2436 . 1 1 200 200 LEU HD21 H 1 0.947 0.020 . 2 . . . . 200 LEU HD2 . 17416 1 2437 . 1 1 200 200 LEU HD22 H 1 0.947 0.020 . 2 . . . . 200 LEU HD2 . 17416 1 2438 . 1 1 200 200 LEU HD23 H 1 0.947 0.020 . 2 . . . . 200 LEU HD2 . 17416 1 2439 . 1 1 200 200 LEU C C 13 177.692 0.400 . 1 . . . . 200 LEU C . 17416 1 2440 . 1 1 200 200 LEU CA C 13 56.463 0.400 . 1 . . . . 200 LEU CA . 17416 1 2441 . 1 1 200 200 LEU CB C 13 40.424 0.400 . 1 . . . . 200 LEU CB . 17416 1 2442 . 1 1 200 200 LEU CG C 13 26.345 0.400 . 1 . . . . 200 LEU CG . 17416 1 2443 . 1 1 200 200 LEU CD1 C 13 26.001 0.400 . 1 . . . . 200 LEU CD1 . 17416 1 2444 . 1 1 200 200 LEU CD2 C 13 23.573 0.400 . 1 . . . . 200 LEU CD2 . 17416 1 2445 . 1 1 200 200 LEU N N 15 117.409 0.400 . 1 . . . . 200 LEU N . 17416 1 2446 . 1 1 201 201 LYS H H 1 8.121 0.020 . 1 . . . . 201 LYS H . 17416 1 2447 . 1 1 201 201 LYS HA H 1 4.240 0.020 . 1 . . . . 201 LYS HA . 17416 1 2448 . 1 1 201 201 LYS HB2 H 1 1.502 0.020 . 2 . . . . 201 LYS HB2 . 17416 1 2449 . 1 1 201 201 LYS HB3 H 1 1.825 0.020 . 2 . . . . 201 LYS HB3 . 17416 1 2450 . 1 1 201 201 LYS HG2 H 1 1.434 0.020 . 2 . . . . 201 LYS HG2 . 17416 1 2451 . 1 1 201 201 LYS HG3 H 1 1.434 0.020 . 2 . . . . 201 LYS HG3 . 17416 1 2452 . 1 1 201 201 LYS HD2 H 1 1.656 0.020 . 2 . . . . 201 LYS HD2 . 17416 1 2453 . 1 1 201 201 LYS HD3 H 1 1.656 0.020 . 2 . . . . 201 LYS HD3 . 17416 1 2454 . 1 1 201 201 LYS HE2 H 1 3.000 0.020 . 2 . . . . 201 LYS HE2 . 17416 1 2455 . 1 1 201 201 LYS HE3 H 1 3.000 0.020 . 2 . . . . 201 LYS HE3 . 17416 1 2456 . 1 1 201 201 LYS C C 13 177.398 0.400 . 1 . . . . 201 LYS C . 17416 1 2457 . 1 1 201 201 LYS CA C 13 56.694 0.400 . 1 . . . . 201 LYS CA . 17416 1 2458 . 1 1 201 201 LYS CG C 13 24.809 0.400 . 1 . . . . 201 LYS CG . 17416 1 2459 . 1 1 201 201 LYS CD C 13 28.513 0.400 . 1 . . . . 201 LYS CD . 17416 1 2460 . 1 1 201 201 LYS CE C 13 41.907 0.400 . 1 . . . . 201 LYS CE . 17416 1 2461 . 1 1 201 201 LYS N N 15 115.250 0.400 . 1 . . . . 201 LYS N . 17416 1 2462 . 1 1 202 202 ASN H H 1 7.244 0.020 . 1 . . . . 202 ASN H . 17416 1 2463 . 1 1 202 202 ASN HA H 1 4.513 0.020 . 1 . . . . 202 ASN HA . 17416 1 2464 . 1 1 202 202 ASN HB2 H 1 2.582 0.020 . 2 . . . . 202 ASN HB2 . 17416 1 2465 . 1 1 202 202 ASN HB3 H 1 2.901 0.020 . 2 . . . . 202 ASN HB3 . 17416 1 2466 . 1 1 202 202 ASN HD21 H 1 6.926 0.020 . 2 . . . . 202 ASN HD21 . 17416 1 2467 . 1 1 202 202 ASN HD22 H 1 8.784 0.020 . 2 . . . . 202 ASN HD22 . 17416 1 2468 . 1 1 202 202 ASN C C 13 170.875 0.400 . 1 . . . . 202 ASN C . 17416 1 2469 . 1 1 202 202 ASN CA C 13 51.862 0.400 . 1 . . . . 202 ASN CA . 17416 1 2470 . 1 1 202 202 ASN CB C 13 40.950 0.400 . 1 . . . . 202 ASN CB . 17416 1 2471 . 1 1 202 202 ASN N N 15 114.046 0.400 . 1 . . . . 202 ASN N . 17416 1 2472 . 1 1 202 202 ASN ND2 N 15 117.544 0.400 . 1 . . . . 202 ASN ND2 . 17416 1 2473 . 1 1 203 203 THR H H 1 7.206 0.020 . 1 . . . . 203 THR H . 17416 1 2474 . 1 1 203 203 THR HA H 1 4.473 0.020 . 1 . . . . 203 THR HA . 17416 1 2475 . 1 1 203 203 THR HB H 1 3.967 0.020 . 1 . . . . 203 THR HB . 17416 1 2476 . 1 1 203 203 THR HG21 H 1 1.032 0.020 . 1 . . . . 203 THR HG2 . 17416 1 2477 . 1 1 203 203 THR HG22 H 1 1.032 0.020 . 1 . . . . 203 THR HG2 . 17416 1 2478 . 1 1 203 203 THR HG23 H 1 1.032 0.020 . 1 . . . . 203 THR HG2 . 17416 1 2479 . 1 1 203 203 THR C C 13 173.796 0.400 . 1 . . . . 203 THR C . 17416 1 2480 . 1 1 203 203 THR CA C 13 62.122 0.400 . 1 . . . . 203 THR CA . 17416 1 2481 . 1 1 203 203 THR CB C 13 72.974 0.400 . 1 . . . . 203 THR CB . 17416 1 2482 . 1 1 203 203 THR CG2 C 13 21.985 0.400 . 1 . . . . 203 THR CG2 . 17416 1 2483 . 1 1 203 203 THR N N 15 110.243 0.400 . 1 . . . . 203 THR N . 17416 1 2484 . 1 1 204 204 LEU H H 1 8.724 0.020 . 1 . . . . 204 LEU H . 17416 1 2485 . 1 1 204 204 LEU HA H 1 4.437 0.020 . 1 . . . . 204 LEU HA . 17416 1 2486 . 1 1 204 204 LEU HB2 H 1 1.822 0.020 . 2 . . . . 204 LEU HB2 . 17416 1 2487 . 1 1 204 204 LEU HB3 H 1 1.822 0.020 . 2 . . . . 204 LEU HB3 . 17416 1 2488 . 1 1 204 204 LEU HG H 1 1.306 0.020 . 1 . . . . 204 LEU HG . 17416 1 2489 . 1 1 204 204 LEU HD11 H 1 0.822 0.020 . 2 . . . . 204 LEU HD1 . 17416 1 2490 . 1 1 204 204 LEU HD12 H 1 0.822 0.020 . 2 . . . . 204 LEU HD1 . 17416 1 2491 . 1 1 204 204 LEU HD13 H 1 0.822 0.020 . 2 . . . . 204 LEU HD1 . 17416 1 2492 . 1 1 204 204 LEU HD21 H 1 0.722 0.020 . 2 . . . . 204 LEU HD2 . 17416 1 2493 . 1 1 204 204 LEU HD22 H 1 0.722 0.020 . 2 . . . . 204 LEU HD2 . 17416 1 2494 . 1 1 204 204 LEU HD23 H 1 0.722 0.020 . 2 . . . . 204 LEU HD2 . 17416 1 2495 . 1 1 204 204 LEU C C 13 173.793 0.400 . 1 . . . . 204 LEU C . 17416 1 2496 . 1 1 204 204 LEU CA C 13 53.910 0.400 . 1 . . . . 204 LEU CA . 17416 1 2497 . 1 1 204 204 LEU CG C 13 27.089 0.400 . 1 . . . . 204 LEU CG . 17416 1 2498 . 1 1 204 204 LEU CD1 C 13 22.862 0.400 . 1 . . . . 204 LEU CD1 . 17416 1 2499 . 1 1 204 204 LEU CD2 C 13 25.403 0.400 . 1 . . . . 204 LEU CD2 . 17416 1 2500 . 1 1 204 204 LEU N N 15 127.222 0.400 . 1 . . . . 204 LEU N . 17416 1 2501 . 1 1 205 205 VAL H H 1 9.249 0.020 . 1 . . . . 205 VAL H . 17416 1 2502 . 1 1 205 205 VAL HA H 1 4.664 0.020 . 1 . . . . 205 VAL HA . 17416 1 2503 . 1 1 205 205 VAL HB H 1 1.618 0.020 . 1 . . . . 205 VAL HB . 17416 1 2504 . 1 1 205 205 VAL HG11 H 1 0.032 0.020 . 2 . . . . 205 VAL HG1 . 17416 1 2505 . 1 1 205 205 VAL HG12 H 1 0.032 0.020 . 2 . . . . 205 VAL HG1 . 17416 1 2506 . 1 1 205 205 VAL HG13 H 1 0.032 0.020 . 2 . . . . 205 VAL HG1 . 17416 1 2507 . 1 1 205 205 VAL HG21 H 1 0.570 0.020 . 2 . . . . 205 VAL HG2 . 17416 1 2508 . 1 1 205 205 VAL HG22 H 1 0.570 0.020 . 2 . . . . 205 VAL HG2 . 17416 1 2509 . 1 1 205 205 VAL HG23 H 1 0.570 0.020 . 2 . . . . 205 VAL HG2 . 17416 1 2510 . 1 1 205 205 VAL C C 13 175.061 0.400 . 1 . . . . 205 VAL C . 17416 1 2511 . 1 1 205 205 VAL CA C 13 61.368 0.400 . 1 . . . . 205 VAL CA . 17416 1 2512 . 1 1 205 205 VAL CB C 13 31.935 0.400 . 1 . . . . 205 VAL CB . 17416 1 2513 . 1 1 205 205 VAL CG1 C 13 20.474 0.400 . 1 . . . . 205 VAL CG1 . 17416 1 2514 . 1 1 205 205 VAL CG2 C 13 23.187 0.400 . 1 . . . . 205 VAL CG2 . 17416 1 2515 . 1 1 205 205 VAL N N 15 129.809 0.400 . 1 . . . . 205 VAL N . 17416 1 2516 . 1 1 206 206 LEU H H 1 8.401 0.020 . 1 . . . . 206 LEU H . 17416 1 2517 . 1 1 206 206 LEU HA H 1 5.042 0.020 . 1 . . . . 206 LEU HA . 17416 1 2518 . 1 1 206 206 LEU HB2 H 1 1.629 0.020 . 2 . . . . 206 LEU HB2 . 17416 1 2519 . 1 1 206 206 LEU HB3 H 1 1.426 0.020 . 2 . . . . 206 LEU HB3 . 17416 1 2520 . 1 1 206 206 LEU HG H 1 1.486 0.020 . 1 . . . . 206 LEU HG . 17416 1 2521 . 1 1 206 206 LEU HD11 H 1 0.383 0.020 . 2 . . . . 206 LEU HD1 . 17416 1 2522 . 1 1 206 206 LEU HD12 H 1 0.383 0.020 . 2 . . . . 206 LEU HD1 . 17416 1 2523 . 1 1 206 206 LEU HD13 H 1 0.383 0.020 . 2 . . . . 206 LEU HD1 . 17416 1 2524 . 1 1 206 206 LEU HD21 H 1 0.904 0.020 . 2 . . . . 206 LEU HD2 . 17416 1 2525 . 1 1 206 206 LEU HD22 H 1 0.904 0.020 . 2 . . . . 206 LEU HD2 . 17416 1 2526 . 1 1 206 206 LEU HD23 H 1 0.904 0.020 . 2 . . . . 206 LEU HD2 . 17416 1 2527 . 1 1 206 206 LEU C C 13 176.035 0.400 . 1 . . . . 206 LEU C . 17416 1 2528 . 1 1 206 206 LEU CA C 13 53.380 0.400 . 1 . . . . 206 LEU CA . 17416 1 2529 . 1 1 206 206 LEU CB C 13 45.300 0.400 . 1 . . . . 206 LEU CB . 17416 1 2530 . 1 1 206 206 LEU CG C 13 27.058 0.400 . 1 . . . . 206 LEU CG . 17416 1 2531 . 1 1 206 206 LEU CD1 C 13 26.336 0.400 . 1 . . . . 206 LEU CD1 . 17416 1 2532 . 1 1 206 206 LEU CD2 C 13 26.004 0.400 . 1 . . . . 206 LEU CD2 . 17416 1 2533 . 1 1 206 206 LEU N N 15 127.132 0.400 . 1 . . . . 206 LEU N . 17416 1 2534 . 1 1 207 207 GLY H H 1 9.003 0.020 . 1 . . . . 207 GLY H . 17416 1 2535 . 1 1 207 207 GLY HA2 H 1 4.095 0.020 . 2 . . . . 207 GLY HA2 . 17416 1 2536 . 1 1 207 207 GLY HA3 H 1 5.546 0.020 . 2 . . . . 207 GLY HA3 . 17416 1 2537 . 1 1 207 207 GLY CA C 13 43.132 0.400 . 1 . . . . 207 GLY CA . 17416 1 2538 . 1 1 207 207 GLY N N 15 108.629 0.400 . 1 . . . . 207 GLY N . 17416 1 2539 . 1 1 208 208 LYS H H 1 7.628 0.020 . 1 . . . . 208 LYS H . 17416 1 2540 . 1 1 208 208 LYS HA H 1 4.474 0.020 . 1 . . . . 208 LYS HA . 17416 1 2541 . 1 1 208 208 LYS HB2 H 1 1.949 0.020 . 2 . . . . 208 LYS HB2 . 17416 1 2542 . 1 1 208 208 LYS HB3 H 1 2.112 0.020 . 2 . . . . 208 LYS HB3 . 17416 1 2543 . 1 1 208 208 LYS HG2 H 1 1.684 0.020 . 2 . . . . 208 LYS HG2 . 17416 1 2544 . 1 1 208 208 LYS HG3 H 1 1.684 0.020 . 2 . . . . 208 LYS HG3 . 17416 1 2545 . 1 1 208 208 LYS HE2 H 1 4.345 0.020 . 2 . . . . 208 LYS HE2 . 17416 1 2546 . 1 1 208 208 LYS HE3 H 1 4.345 0.020 . 2 . . . . 208 LYS HE3 . 17416 1 2547 . 1 1 208 208 LYS CA C 13 59.593 0.400 . 1 . . . . 208 LYS CA . 17416 1 2548 . 1 1 208 208 LYS CB C 13 32.560 0.400 . 1 . . . . 208 LYS CB . 17416 1 2549 . 1 1 208 208 LYS CE C 13 39.396 0.400 . 1 . . . . 208 LYS CE . 17416 1 2550 . 1 1 208 208 LYS N N 15 117.814 0.400 . 1 . . . . 208 LYS N . 17416 1 2551 . 1 1 209 209 ASP H H 1 8.821 0.020 . 1 . . . . 209 ASP H . 17416 1 2552 . 1 1 209 209 ASP HA H 1 4.900 0.020 . 1 . . . . 209 ASP HA . 17416 1 2553 . 1 1 209 209 ASP HB2 H 1 2.633 0.020 . 2 . . . . 209 ASP HB2 . 17416 1 2554 . 1 1 209 209 ASP HB3 H 1 2.717 0.020 . 2 . . . . 209 ASP HB3 . 17416 1 2555 . 1 1 209 209 ASP C C 13 174.671 0.400 . 1 . . . . 209 ASP C . 17416 1 2556 . 1 1 209 209 ASP CA C 13 53.338 0.400 . 1 . . . . 209 ASP CA . 17416 1 2557 . 1 1 209 209 ASP CB C 13 42.477 0.400 . 1 . . . . 209 ASP CB . 17416 1 2558 . 1 1 210 210 LYS H H 1 7.047 0.020 . 1 . . . . 210 LYS H . 17416 1 2559 . 1 1 210 210 LYS HA H 1 4.427 0.020 . 1 . . . . 210 LYS HA . 17416 1 2560 . 1 1 210 210 LYS HB2 H 1 1.604 0.020 . 2 . . . . 210 LYS HB2 . 17416 1 2561 . 1 1 210 210 LYS HB3 H 1 1.644 0.020 . 2 . . . . 210 LYS HB3 . 17416 1 2562 . 1 1 210 210 LYS HG2 H 1 1.537 0.020 . 2 . . . . 210 LYS HG2 . 17416 1 2563 . 1 1 210 210 LYS HG3 H 1 1.737 0.020 . 2 . . . . 210 LYS HG3 . 17416 1 2564 . 1 1 210 210 LYS HD2 H 1 1.303 0.020 . 2 . . . . 210 LYS HD2 . 17416 1 2565 . 1 1 210 210 LYS HD3 H 1 1.303 0.020 . 2 . . . . 210 LYS HD3 . 17416 1 2566 . 1 1 210 210 LYS HE2 H 1 2.973 0.020 . 2 . . . . 210 LYS HE2 . 17416 1 2567 . 1 1 210 210 LYS HE3 H 1 3.172 0.020 . 2 . . . . 210 LYS HE3 . 17416 1 2568 . 1 1 210 210 LYS C C 13 173.988 0.400 . 1 . . . . 210 LYS C . 17416 1 2569 . 1 1 210 210 LYS CA C 13 54.648 0.400 . 1 . . . . 210 LYS CA . 17416 1 2570 . 1 1 210 210 LYS CB C 13 35.046 0.400 . 1 . . . . 210 LYS CB . 17416 1 2571 . 1 1 210 210 LYS CG C 13 26.656 0.400 . 1 . . . . 210 LYS CG . 17416 1 2572 . 1 1 210 210 LYS N N 15 114.426 0.400 . 1 . . . . 210 LYS N . 17416 1 2573 . 1 1 211 211 VAL H H 1 8.504 0.020 . 1 . . . . 211 VAL H . 17416 1 2574 . 1 1 211 211 VAL HA H 1 4.552 0.020 . 1 . . . . 211 VAL HA . 17416 1 2575 . 1 1 211 211 VAL HB H 1 2.184 0.020 . 1 . . . . 211 VAL HB . 17416 1 2576 . 1 1 211 211 VAL HG11 H 1 1.124 0.020 . 2 . . . . 211 VAL HG1 . 17416 1 2577 . 1 1 211 211 VAL HG12 H 1 1.124 0.020 . 2 . . . . 211 VAL HG1 . 17416 1 2578 . 1 1 211 211 VAL HG13 H 1 1.124 0.020 . 2 . . . . 211 VAL HG1 . 17416 1 2579 . 1 1 211 211 VAL HG21 H 1 1.147 0.020 . 2 . . . . 211 VAL HG2 . 17416 1 2580 . 1 1 211 211 VAL HG22 H 1 1.147 0.020 . 2 . . . . 211 VAL HG2 . 17416 1 2581 . 1 1 211 211 VAL HG23 H 1 1.147 0.020 . 2 . . . . 211 VAL HG2 . 17416 1 2582 . 1 1 211 211 VAL C C 13 175.939 0.400 . 1 . . . . 211 VAL C . 17416 1 2583 . 1 1 211 211 VAL CA C 13 61.217 0.400 . 1 . . . . 211 VAL CA . 17416 1 2584 . 1 1 211 211 VAL CB C 13 33.273 0.400 . 1 . . . . 211 VAL CB . 17416 1 2585 . 1 1 211 211 VAL CG1 C 13 21.681 0.400 . 1 . . . . 211 VAL CG1 . 17416 1 2586 . 1 1 211 211 VAL CG2 C 13 21.684 0.400 . 1 . . . . 211 VAL CG2 . 17416 1 2587 . 1 1 211 211 VAL N N 15 120.903 0.400 . 1 . . . . 211 VAL N . 17416 1 2588 . 1 1 212 212 TYR H H 1 9.126 0.020 . 1 . . . . 212 TYR H . 17416 1 2589 . 1 1 212 212 TYR HA H 1 4.071 0.020 . 1 . . . . 212 TYR HA . 17416 1 2590 . 1 1 212 212 TYR HB2 H 1 2.818 0.020 . 2 . . . . 212 TYR HB2 . 17416 1 2591 . 1 1 212 212 TYR HB3 H 1 3.081 0.020 . 2 . . . . 212 TYR HB3 . 17416 1 2592 . 1 1 212 212 TYR HD1 H 1 7.103 0.020 . 1 . . . . 212 TYR HD1 . 17416 1 2593 . 1 1 212 212 TYR HD2 H 1 7.103 0.020 . 1 . . . . 212 TYR HD2 . 17416 1 2594 . 1 1 212 212 TYR HE1 H 1 6.774 0.020 . 1 . . . . 212 TYR HE1 . 17416 1 2595 . 1 1 212 212 TYR HE2 H 1 6.774 0.020 . 1 . . . . 212 TYR HE2 . 17416 1 2596 . 1 1 212 212 TYR C C 13 176.621 0.400 . 1 . . . . 212 TYR C . 17416 1 2597 . 1 1 212 212 TYR CA C 13 61.049 0.400 . 1 . . . . 212 TYR CA . 17416 1 2598 . 1 1 212 212 TYR CB C 13 38.769 0.400 . 1 . . . . 212 TYR CB . 17416 1 2599 . 1 1 212 212 TYR N N 15 125.363 0.400 . 1 . . . . 212 TYR N . 17416 1 2600 . 1 1 213 213 ASN H H 1 8.496 0.020 . 1 . . . . 213 ASN H . 17416 1 2601 . 1 1 213 213 ASN HA H 1 4.590 0.020 . 1 . . . . 213 ASN HA . 17416 1 2602 . 1 1 213 213 ASN HB2 H 1 2.135 0.020 . 2 . . . . 213 ASN HB2 . 17416 1 2603 . 1 1 213 213 ASN HB3 H 1 3.109 0.020 . 2 . . . . 213 ASN HB3 . 17416 1 2604 . 1 1 213 213 ASN HD21 H 1 7.115 0.020 . 2 . . . . 213 ASN HD21 . 17416 1 2605 . 1 1 213 213 ASN HD22 H 1 7.533 0.020 . 2 . . . . 213 ASN HD22 . 17416 1 2606 . 1 1 213 213 ASN CA C 13 53.054 0.400 . 1 . . . . 213 ASN CA . 17416 1 2607 . 1 1 213 213 ASN CB C 13 36.235 0.400 . 1 . . . . 213 ASN CB . 17416 1 2608 . 1 1 213 213 ASN N N 15 117.808 0.400 . 1 . . . . 213 ASN N . 17416 1 2609 . 1 1 214 214 PRO HA H 1 4.307 0.020 . 1 . . . . 214 PRO HA . 17416 1 2610 . 1 1 214 214 PRO HB2 H 1 2.033 0.020 . 2 . . . . 214 PRO HB2 . 17416 1 2611 . 1 1 214 214 PRO HB3 H 1 2.431 0.020 . 2 . . . . 214 PRO HB3 . 17416 1 2612 . 1 1 214 214 PRO HG2 H 1 2.153 0.020 . 2 . . . . 214 PRO HG2 . 17416 1 2613 . 1 1 214 214 PRO HG3 H 1 2.216 0.020 . 2 . . . . 214 PRO HG3 . 17416 1 2614 . 1 1 214 214 PRO HD2 H 1 4.083 0.020 . 2 . . . . 214 PRO HD2 . 17416 1 2615 . 1 1 214 214 PRO HD3 H 1 4.083 0.020 . 2 . . . . 214 PRO HD3 . 17416 1 2616 . 1 1 214 214 PRO C C 13 177.493 0.400 . 1 . . . . 214 PRO C . 17416 1 2617 . 1 1 214 214 PRO CA C 13 65.274 0.400 . 1 . . . . 214 PRO CA . 17416 1 2618 . 1 1 214 214 PRO CB C 13 31.641 0.400 . 1 . . . . 214 PRO CB . 17416 1 2619 . 1 1 214 214 PRO CG C 13 27.373 0.400 . 1 . . . . 214 PRO CG . 17416 1 2620 . 1 1 214 214 PRO CD C 13 51.280 0.400 . 1 . . . . 214 PRO CD . 17416 1 2621 . 1 1 215 215 GLU H H 1 9.800 0.020 . 1 . . . . 215 GLU H . 17416 1 2622 . 1 1 215 215 GLU HA H 1 4.270 0.020 . 1 . . . . 215 GLU HA . 17416 1 2623 . 1 1 215 215 GLU HB2 H 1 2.087 0.020 . 2 . . . . 215 GLU HB2 . 17416 1 2624 . 1 1 215 215 GLU HB3 H 1 2.087 0.020 . 2 . . . . 215 GLU HB3 . 17416 1 2625 . 1 1 215 215 GLU C C 13 177.009 0.400 . 1 . . . . 215 GLU C . 17416 1 2626 . 1 1 215 215 GLU CA C 13 56.603 0.400 . 1 . . . . 215 GLU CA . 17416 1 2627 . 1 1 215 215 GLU N N 15 116.593 0.400 . 1 . . . . 215 GLU N . 17416 1 2628 . 1 1 216 216 GLY H H 1 7.709 0.020 . 1 . . . . 216 GLY H . 17416 1 2629 . 1 1 216 216 GLY HA2 H 1 3.505 0.020 . 2 . . . . 216 GLY HA2 . 17416 1 2630 . 1 1 216 216 GLY HA3 H 1 4.131 0.020 . 2 . . . . 216 GLY HA3 . 17416 1 2631 . 1 1 216 216 GLY C C 13 172.919 0.400 . 1 . . . . 216 GLY C . 17416 1 2632 . 1 1 216 216 GLY CA C 13 44.735 0.400 . 1 . . . . 216 GLY CA . 17416 1 2633 . 1 1 216 216 GLY N N 15 108.371 0.400 . 1 . . . . 216 GLY N . 17416 1 2634 . 1 1 217 217 LEU H H 1 8.280 0.020 . 1 . . . . 217 LEU H . 17416 1 2635 . 1 1 217 217 LEU HA H 1 4.051 0.020 . 1 . . . . 217 LEU HA . 17416 1 2636 . 1 1 217 217 LEU HB2 H 1 1.981 0.020 . 2 . . . . 217 LEU HB2 . 17416 1 2637 . 1 1 217 217 LEU HB3 H 1 1.504 0.020 . 2 . . . . 217 LEU HB3 . 17416 1 2638 . 1 1 217 217 LEU HG H 1 1.789 0.020 . 1 . . . . 217 LEU HG . 17416 1 2639 . 1 1 217 217 LEU HD11 H 1 1.074 0.020 . 2 . . . . 217 LEU HD1 . 17416 1 2640 . 1 1 217 217 LEU HD12 H 1 1.074 0.020 . 2 . . . . 217 LEU HD1 . 17416 1 2641 . 1 1 217 217 LEU HD13 H 1 1.074 0.020 . 2 . . . . 217 LEU HD1 . 17416 1 2642 . 1 1 217 217 LEU HD21 H 1 1.097 0.020 . 2 . . . . 217 LEU HD2 . 17416 1 2643 . 1 1 217 217 LEU HD22 H 1 1.097 0.020 . 2 . . . . 217 LEU HD2 . 17416 1 2644 . 1 1 217 217 LEU HD23 H 1 1.097 0.020 . 2 . . . . 217 LEU HD2 . 17416 1 2645 . 1 1 217 217 LEU C C 13 178.471 0.400 . 1 . . . . 217 LEU C . 17416 1 2646 . 1 1 217 217 LEU CA C 13 55.274 0.400 . 1 . . . . 217 LEU CA . 17416 1 2647 . 1 1 217 217 LEU CB C 13 42.788 0.400 . 1 . . . . 217 LEU CB . 17416 1 2648 . 1 1 217 217 LEU CG C 13 28.222 0.400 . 1 . . . . 217 LEU CG . 17416 1 2649 . 1 1 217 217 LEU CD1 C 13 25.694 0.400 . 1 . . . . 217 LEU CD1 . 17416 1 2650 . 1 1 217 217 LEU CD2 C 13 26.263 0.400 . 1 . . . . 217 LEU CD2 . 17416 1 2651 . 1 1 217 217 LEU N N 15 119.442 0.400 . 1 . . . . 217 LEU N . 17416 1 2652 . 1 1 218 218 ARG H H 1 9.333 0.020 . 1 . . . . 218 ARG H . 17416 1 2653 . 1 1 218 218 ARG HA H 1 3.825 0.020 . 1 . . . . 218 ARG HA . 17416 1 2654 . 1 1 218 218 ARG HB2 H 1 1.772 0.020 . 2 . . . . 218 ARG HB2 . 17416 1 2655 . 1 1 218 218 ARG HB3 H 1 1.772 0.020 . 2 . . . . 218 ARG HB3 . 17416 1 2656 . 1 1 218 218 ARG C C 13 175.548 0.400 . 1 . . . . 218 ARG C . 17416 1 2657 . 1 1 218 218 ARG CA C 13 58.250 0.400 . 1 . . . . 218 ARG CA . 17416 1 2658 . 1 1 218 218 ARG N N 15 121.847 0.400 . 1 . . . . 218 ARG N . 17416 1 2659 . 1 1 219 219 TYR H H 1 6.993 0.020 . 1 . . . . 219 TYR H . 17416 1 2660 . 1 1 219 219 TYR HA H 1 4.707 0.020 . 1 . . . . 219 TYR HA . 17416 1 2661 . 1 1 219 219 TYR HB2 H 1 1.924 0.020 . 2 . . . . 219 TYR HB2 . 17416 1 2662 . 1 1 219 219 TYR HB3 H 1 3.204 0.020 . 2 . . . . 219 TYR HB3 . 17416 1 2663 . 1 1 219 219 TYR HD1 H 1 6.737 0.020 . 1 . . . . 219 TYR HD1 . 17416 1 2664 . 1 1 219 219 TYR HD2 H 1 6.737 0.020 . 1 . . . . 219 TYR HD2 . 17416 1 2665 . 1 1 219 219 TYR HE1 H 1 6.460 0.020 . 1 . . . . 219 TYR HE1 . 17416 1 2666 . 1 1 219 219 TYR HE2 H 1 6.460 0.020 . 1 . . . . 219 TYR HE2 . 17416 1 2667 . 1 1 219 219 TYR CA C 13 54.702 0.400 . 1 . . . . 219 TYR CA . 17416 1 2668 . 1 1 219 219 TYR CB C 13 43.086 0.400 . 1 . . . . 219 TYR CB . 17416 1 2669 . 1 1 219 219 TYR N N 15 109.979 0.400 . 1 . . . . 219 TYR N . 17416 1 2670 . 1 1 220 220 GLU HA H 1 4.103 0.020 . 1 . . . . 220 GLU HA . 17416 1 2671 . 1 1 220 220 GLU HB2 H 1 2.334 0.020 . 2 . . . . 220 GLU HB2 . 17416 1 2672 . 1 1 220 220 GLU HB3 H 1 2.334 0.020 . 2 . . . . 220 GLU HB3 . 17416 1 2673 . 1 1 220 220 GLU C C 13 175.061 0.400 . 1 . . . . 220 GLU C . 17416 1 2674 . 1 1 220 220 GLU CA C 13 59.283 0.400 . 1 . . . . 220 GLU CA . 17416 1 2675 . 1 1 221 221 ASN H H 1 7.596 0.020 . 1 . . . . 221 ASN H . 17416 1 2676 . 1 1 221 221 ASN HA H 1 5.235 0.020 . 1 . . . . 221 ASN HA . 17416 1 2677 . 1 1 221 221 ASN HB2 H 1 2.872 0.020 . 2 . . . . 221 ASN HB2 . 17416 1 2678 . 1 1 221 221 ASN HB3 H 1 3.098 0.020 . 2 . . . . 221 ASN HB3 . 17416 1 2679 . 1 1 221 221 ASN C C 13 176.139 0.400 . 1 . . . . 221 ASN C . 17416 1 2680 . 1 1 221 221 ASN CA C 13 49.339 0.400 . 1 . . . . 221 ASN CA . 17416 1 2681 . 1 1 221 221 ASN CB C 13 36.289 0.400 . 1 . . . . 221 ASN CB . 17416 1 2682 . 1 1 221 221 ASN N N 15 110.662 0.400 . 1 . . . . 221 ASN N . 17416 1 2683 . 1 1 222 222 GLU H H 1 7.392 0.020 . 1 . . . . 222 GLU H . 17416 1 2684 . 1 1 222 222 GLU HA H 1 3.707 0.020 . 1 . . . . 222 GLU HA . 17416 1 2685 . 1 1 222 222 GLU HB2 H 1 2.004 0.020 . 2 . . . . 222 GLU HB2 . 17416 1 2686 . 1 1 222 222 GLU HB3 H 1 2.559 0.020 . 2 . . . . 222 GLU HB3 . 17416 1 2687 . 1 1 222 222 GLU HG2 H 1 2.235 0.020 . 2 . . . . 222 GLU HG2 . 17416 1 2688 . 1 1 222 222 GLU HG3 H 1 2.493 0.020 . 2 . . . . 222 GLU HG3 . 17416 1 2689 . 1 1 222 222 GLU CA C 13 62.390 0.400 . 1 . . . . 222 GLU CA . 17416 1 2690 . 1 1 222 222 GLU CB C 13 28.210 0.400 . 1 . . . . 222 GLU CB . 17416 1 2691 . 1 1 222 222 GLU CG C 13 36.289 0.400 . 1 . . . . 222 GLU CG . 17416 1 2692 . 1 1 222 222 GLU N N 15 118.084 0.400 . 1 . . . . 222 GLU N . 17416 1 2693 . 1 1 223 223 PRO HA H 1 3.748 0.020 . 1 . . . . 223 PRO HA . 17416 1 2694 . 1 1 223 223 PRO HB2 H 1 -0.081 0.020 . 2 . . . . 223 PRO HB2 . 17416 1 2695 . 1 1 223 223 PRO HB3 H 1 0.795 0.020 . 2 . . . . 223 PRO HB3 . 17416 1 2696 . 1 1 223 223 PRO HG2 H 1 0.811 0.020 . 2 . . . . 223 PRO HG2 . 17416 1 2697 . 1 1 223 223 PRO HG3 H 1 1.280 0.020 . 2 . . . . 223 PRO HG3 . 17416 1 2698 . 1 1 223 223 PRO HD2 H 1 3.313 0.020 . 2 . . . . 223 PRO HD2 . 17416 1 2699 . 1 1 223 223 PRO HD3 H 1 3.364 0.020 . 2 . . . . 223 PRO HD3 . 17416 1 2700 . 1 1 223 223 PRO C C 13 178.372 0.400 . 1 . . . . 223 PRO C . 17416 1 2701 . 1 1 223 223 PRO CA C 13 67.033 0.400 . 1 . . . . 223 PRO CA . 17416 1 2702 . 1 1 223 223 PRO CB C 13 29.763 0.400 . 1 . . . . 223 PRO CB . 17416 1 2703 . 1 1 223 223 PRO CG C 13 28.210 0.400 . 1 . . . . 223 PRO CG . 17416 1 2704 . 1 1 223 223 PRO CD C 13 49.029 0.400 . 1 . . . . 223 PRO CD . 17416 1 2705 . 1 1 224 224 VAL H H 1 6.714 0.020 . 1 . . . . 224 VAL H . 17416 1 2706 . 1 1 224 224 VAL HA H 1 3.937 0.020 . 1 . . . . 224 VAL HA . 17416 1 2707 . 1 1 224 224 VAL HB H 1 2.450 0.020 . 1 . . . . 224 VAL HB . 17416 1 2708 . 1 1 224 224 VAL HG11 H 1 1.396 0.020 . 2 . . . . 224 VAL HG1 . 17416 1 2709 . 1 1 224 224 VAL HG12 H 1 1.396 0.020 . 2 . . . . 224 VAL HG1 . 17416 1 2710 . 1 1 224 224 VAL HG13 H 1 1.396 0.020 . 2 . . . . 224 VAL HG1 . 17416 1 2711 . 1 1 224 224 VAL HG21 H 1 1.245 0.020 . 2 . . . . 224 VAL HG2 . 17416 1 2712 . 1 1 224 224 VAL HG22 H 1 1.245 0.020 . 2 . . . . 224 VAL HG2 . 17416 1 2713 . 1 1 224 224 VAL HG23 H 1 1.245 0.020 . 2 . . . . 224 VAL HG2 . 17416 1 2714 . 1 1 224 224 VAL C C 13 178.177 0.400 . 1 . . . . 224 VAL C . 17416 1 2715 . 1 1 224 224 VAL CA C 13 65.524 0.400 . 1 . . . . 224 VAL CA . 17416 1 2716 . 1 1 224 224 VAL CB C 13 31.343 0.400 . 1 . . . . 224 VAL CB . 17416 1 2717 . 1 1 224 224 VAL CG1 C 13 23.901 0.400 . 1 . . . . 224 VAL CG1 . 17416 1 2718 . 1 1 224 224 VAL CG2 C 13 22.283 0.400 . 1 . . . . 224 VAL CG2 . 17416 1 2719 . 1 1 224 224 VAL N N 15 107.940 0.400 . 1 . . . . 224 VAL N . 17416 1 2720 . 1 1 225 225 ARG H H 1 7.255 0.020 . 1 . . . . 225 ARG H . 17416 1 2721 . 1 1 225 225 ARG HA H 1 3.662 0.020 . 1 . . . . 225 ARG HA . 17416 1 2722 . 1 1 225 225 ARG HB2 H 1 1.086 0.020 . 2 . . . . 225 ARG HB2 . 17416 1 2723 . 1 1 225 225 ARG HB3 H 1 1.627 0.020 . 2 . . . . 225 ARG HB3 . 17416 1 2724 . 1 1 225 225 ARG HG2 H 1 -0.198 0.020 . 2 . . . . 225 ARG HG2 . 17416 1 2725 . 1 1 225 225 ARG HG3 H 1 0.807 0.020 . 2 . . . . 225 ARG HG3 . 17416 1 2726 . 1 1 225 225 ARG HD2 H 1 1.616 0.020 . 2 . . . . 225 ARG HD2 . 17416 1 2727 . 1 1 225 225 ARG HD3 H 1 2.177 0.020 . 2 . . . . 225 ARG HD3 . 17416 1 2728 . 1 1 225 225 ARG C C 13 178.178 0.400 . 1 . . . . 225 ARG C . 17416 1 2729 . 1 1 225 225 ARG CA C 13 59.901 0.400 . 1 . . . . 225 ARG CA . 17416 1 2730 . 1 1 225 225 ARG CB C 13 30.074 0.400 . 1 . . . . 225 ARG CB . 17416 1 2731 . 1 1 225 225 ARG CG C 13 26.967 0.400 . 1 . . . . 225 ARG CG . 17416 1 2732 . 1 1 225 225 ARG CD C 13 43.125 0.400 . 1 . . . . 225 ARG CD . 17416 1 2733 . 1 1 225 225 ARG N N 15 119.858 0.400 . 1 . . . . 225 ARG N . 17416 1 2734 . 1 1 226 226 HIS H H 1 8.179 0.020 . 1 . . . . 226 HIS H . 17416 1 2735 . 1 1 226 226 HIS HA H 1 3.827 0.020 . 1 . . . . 226 HIS HA . 17416 1 2736 . 1 1 226 226 HIS HB2 H 1 2.869 0.020 . 2 . . . . 226 HIS HB2 . 17416 1 2737 . 1 1 226 226 HIS HB3 H 1 3.442 0.020 . 2 . . . . 226 HIS HB3 . 17416 1 2738 . 1 1 226 226 HIS HE1 H 1 7.423 0.020 . 1 . . . . 226 HIS HE1 . 17416 1 2739 . 1 1 226 226 HIS C C 13 176.619 0.400 . 1 . . . . 226 HIS C . 17416 1 2740 . 1 1 226 226 HIS CA C 13 60.235 0.400 . 1 . . . . 226 HIS CA . 17416 1 2741 . 1 1 226 226 HIS CB C 13 28.217 0.400 . 1 . . . . 226 HIS CB . 17416 1 2742 . 1 1 226 226 HIS N N 15 117.412 0.400 . 1 . . . . 226 HIS N . 17416 1 2743 . 1 1 227 227 LYS H H 1 7.865 0.020 . 1 . . . . 227 LYS H . 17416 1 2744 . 1 1 227 227 LYS HA H 1 3.847 0.020 . 1 . . . . 227 LYS HA . 17416 1 2745 . 1 1 227 227 LYS HB2 H 1 1.387 0.020 . 2 . . . . 227 LYS HB2 . 17416 1 2746 . 1 1 227 227 LYS HB3 H 1 1.387 0.020 . 2 . . . . 227 LYS HB3 . 17416 1 2747 . 1 1 227 227 LYS HG2 H 1 1.135 0.020 . 2 . . . . 227 LYS HG2 . 17416 1 2748 . 1 1 227 227 LYS HG3 H 1 1.135 0.020 . 2 . . . . 227 LYS HG3 . 17416 1 2749 . 1 1 227 227 LYS HD2 H 1 1.754 0.020 . 2 . . . . 227 LYS HD2 . 17416 1 2750 . 1 1 227 227 LYS HD3 H 1 1.955 0.020 . 2 . . . . 227 LYS HD3 . 17416 1 2751 . 1 1 227 227 LYS HE2 H 1 2.838 0.020 . 2 . . . . 227 LYS HE2 . 17416 1 2752 . 1 1 227 227 LYS HE3 H 1 3.331 0.020 . 2 . . . . 227 LYS HE3 . 17416 1 2753 . 1 1 227 227 LYS C C 13 180.416 0.400 . 1 . . . . 227 LYS C . 17416 1 2754 . 1 1 227 227 LYS CA C 13 58.032 0.400 . 1 . . . . 227 LYS CA . 17416 1 2755 . 1 1 227 227 LYS CG C 13 31.317 0.400 . 1 . . . . 227 LYS CG . 17416 1 2756 . 1 1 227 227 LYS CD C 13 28.210 0.400 . 1 . . . . 227 LYS CD . 17416 1 2757 . 1 1 227 227 LYS CE C 13 44.368 0.400 . 1 . . . . 227 LYS CE . 17416 1 2758 . 1 1 227 227 LYS N N 15 117.678 0.400 . 1 . . . . 227 LYS N . 17416 1 2759 . 1 1 228 228 VAL H H 1 7.684 0.020 . 1 . . . . 228 VAL H . 17416 1 2760 . 1 1 228 228 VAL HA H 1 3.458 0.020 . 1 . . . . 228 VAL HA . 17416 1 2761 . 1 1 228 228 VAL HB H 1 2.501 0.020 . 1 . . . . 228 VAL HB . 17416 1 2762 . 1 1 228 228 VAL HG11 H 1 1.029 0.020 . 2 . . . . 228 VAL HG1 . 17416 1 2763 . 1 1 228 228 VAL HG12 H 1 1.029 0.020 . 2 . . . . 228 VAL HG1 . 17416 1 2764 . 1 1 228 228 VAL HG13 H 1 1.029 0.020 . 2 . . . . 228 VAL HG1 . 17416 1 2765 . 1 1 228 228 VAL HG21 H 1 1.480 0.020 . 2 . . . . 228 VAL HG2 . 17416 1 2766 . 1 1 228 228 VAL HG22 H 1 1.480 0.020 . 2 . . . . 228 VAL HG2 . 17416 1 2767 . 1 1 228 228 VAL HG23 H 1 1.480 0.020 . 2 . . . . 228 VAL HG2 . 17416 1 2768 . 1 1 228 228 VAL C C 13 175.940 0.400 . 1 . . . . 228 VAL C . 17416 1 2769 . 1 1 228 228 VAL CA C 13 67.699 0.400 . 1 . . . . 228 VAL CA . 17416 1 2770 . 1 1 228 228 VAL CB C 13 31.337 0.400 . 1 . . . . 228 VAL CB . 17416 1 2771 . 1 1 228 228 VAL CG1 C 13 22.888 0.400 . 1 . . . . 228 VAL CG1 . 17416 1 2772 . 1 1 228 228 VAL CG2 C 13 26.037 0.400 . 1 . . . . 228 VAL CG2 . 17416 1 2773 . 1 1 228 228 VAL N N 15 121.444 0.400 . 1 . . . . 228 VAL N . 17416 1 2774 . 1 1 229 229 PHE H H 1 7.622 0.020 . 1 . . . . 229 PHE H . 17416 1 2775 . 1 1 229 229 PHE HA H 1 3.722 0.020 . 1 . . . . 229 PHE HA . 17416 1 2776 . 1 1 229 229 PHE HB2 H 1 2.822 0.020 . 2 . . . . 229 PHE HB2 . 17416 1 2777 . 1 1 229 229 PHE HB3 H 1 3.305 0.020 . 2 . . . . 229 PHE HB3 . 17416 1 2778 . 1 1 229 229 PHE HD1 H 1 6.724 0.020 . 1 . . . . 229 PHE HD1 . 17416 1 2779 . 1 1 229 229 PHE HD2 H 1 6.724 0.020 . 1 . . . . 229 PHE HD2 . 17416 1 2780 . 1 1 229 229 PHE HE1 H 1 7.039 0.020 . 1 . . . . 229 PHE HE1 . 17416 1 2781 . 1 1 229 229 PHE HE2 H 1 7.039 0.020 . 1 . . . . 229 PHE HE2 . 17416 1 2782 . 1 1 229 229 PHE HZ H 1 7.452 0.020 . 1 . . . . 229 PHE HZ . 17416 1 2783 . 1 1 229 229 PHE C C 13 177.590 0.400 . 1 . . . . 229 PHE C . 17416 1 2784 . 1 1 229 229 PHE CA C 13 62.059 0.400 . 1 . . . . 229 PHE CA . 17416 1 2785 . 1 1 229 229 PHE CB C 13 38.773 0.400 . 1 . . . . 229 PHE CB . 17416 1 2786 . 1 1 229 229 PHE N N 15 120.904 0.400 . 1 . . . . 229 PHE N . 17416 1 2787 . 1 1 230 230 ASP H H 1 8.863 0.020 . 1 . . . . 230 ASP H . 17416 1 2788 . 1 1 230 230 ASP HA H 1 4.069 0.020 . 1 . . . . 230 ASP HA . 17416 1 2789 . 1 1 230 230 ASP HB2 H 1 2.246 0.020 . 2 . . . . 230 ASP HB2 . 17416 1 2790 . 1 1 230 230 ASP HB3 H 1 2.756 0.020 . 2 . . . . 230 ASP HB3 . 17416 1 2791 . 1 1 230 230 ASP C C 13 176.911 0.400 . 1 . . . . 230 ASP C . 17416 1 2792 . 1 1 230 230 ASP CA C 13 57.464 0.400 . 1 . . . . 230 ASP CA . 17416 1 2793 . 1 1 230 230 ASP CB C 13 41.260 0.400 . 1 . . . . 230 ASP CB . 17416 1 2794 . 1 1 230 230 ASP N N 15 120.507 0.400 . 1 . . . . 230 ASP N . 17416 1 2795 . 1 1 231 231 LEU H H 1 7.311 0.020 . 1 . . . . 231 LEU H . 17416 1 2796 . 1 1 231 231 LEU HA H 1 4.083 0.020 . 1 . . . . 231 LEU HA . 17416 1 2797 . 1 1 231 231 LEU HB2 H 1 1.693 0.020 . 2 . . . . 231 LEU HB2 . 17416 1 2798 . 1 1 231 231 LEU HB3 H 1 1.947 0.020 . 2 . . . . 231 LEU HB3 . 17416 1 2799 . 1 1 231 231 LEU HG H 1 1.377 0.020 . 1 . . . . 231 LEU HG . 17416 1 2800 . 1 1 231 231 LEU HD11 H 1 0.863 0.020 . 2 . . . . 231 LEU HD1 . 17416 1 2801 . 1 1 231 231 LEU HD12 H 1 0.863 0.020 . 2 . . . . 231 LEU HD1 . 17416 1 2802 . 1 1 231 231 LEU HD13 H 1 0.863 0.020 . 2 . . . . 231 LEU HD1 . 17416 1 2803 . 1 1 231 231 LEU HD21 H 1 0.822 0.020 . 2 . . . . 231 LEU HD2 . 17416 1 2804 . 1 1 231 231 LEU HD22 H 1 0.822 0.020 . 2 . . . . 231 LEU HD2 . 17416 1 2805 . 1 1 231 231 LEU HD23 H 1 0.822 0.020 . 2 . . . . 231 LEU HD2 . 17416 1 2806 . 1 1 231 231 LEU C C 13 177.592 0.400 . 1 . . . . 231 LEU C . 17416 1 2807 . 1 1 231 231 LEU CA C 13 58.339 0.400 . 1 . . . . 231 LEU CA . 17416 1 2808 . 1 1 231 231 LEU CB C 13 40.639 0.400 . 1 . . . . 231 LEU CB . 17416 1 2809 . 1 1 231 231 LEU CG C 13 27.658 0.400 . 1 . . . . 231 LEU CG . 17416 1 2810 . 1 1 231 231 LEU CD1 C 13 22.620 0.400 . 1 . . . . 231 LEU CD1 . 17416 1 2811 . 1 1 231 231 LEU CD2 C 13 26.008 0.400 . 1 . . . . 231 LEU CD2 . 17416 1 2812 . 1 1 231 231 LEU N N 15 120.777 0.400 . 1 . . . . 231 LEU N . 17416 1 2813 . 1 1 232 232 ILE H H 1 7.836 0.020 . 1 . . . . 232 ILE H . 17416 1 2814 . 1 1 232 232 ILE HA H 1 3.334 0.020 . 1 . . . . 232 ILE HA . 17416 1 2815 . 1 1 232 232 ILE HB H 1 1.527 0.020 . 1 . . . . 232 ILE HB . 17416 1 2816 . 1 1 232 232 ILE HG12 H 1 0.528 0.020 . 2 . . . . 232 ILE HG12 . 17416 1 2817 . 1 1 232 232 ILE HG13 H 1 1.651 0.020 . 2 . . . . 232 ILE HG13 . 17416 1 2818 . 1 1 232 232 ILE HG21 H 1 0.555 0.020 . 1 . . . . 232 ILE HG2 . 17416 1 2819 . 1 1 232 232 ILE HG22 H 1 0.555 0.020 . 1 . . . . 232 ILE HG2 . 17416 1 2820 . 1 1 232 232 ILE HG23 H 1 0.555 0.020 . 1 . . . . 232 ILE HG2 . 17416 1 2821 . 1 1 232 232 ILE HD11 H 1 0.177 0.020 . 1 . . . . 232 ILE HD1 . 17416 1 2822 . 1 1 232 232 ILE HD12 H 1 0.177 0.020 . 1 . . . . 232 ILE HD1 . 17416 1 2823 . 1 1 232 232 ILE HD13 H 1 0.177 0.020 . 1 . . . . 232 ILE HD1 . 17416 1 2824 . 1 1 232 232 ILE C C 13 178.371 0.400 . 1 . . . . 232 ILE C . 17416 1 2825 . 1 1 232 232 ILE CA C 13 66.131 0.400 . 1 . . . . 232 ILE CA . 17416 1 2826 . 1 1 232 232 ILE CB C 13 38.202 0.400 . 1 . . . . 232 ILE CB . 17416 1 2827 . 1 1 232 232 ILE CG1 C 13 31.636 0.400 . 1 . . . . 232 ILE CG1 . 17416 1 2828 . 1 1 232 232 ILE CG2 C 13 17.060 0.400 . 1 . . . . 232 ILE CG2 . 17416 1 2829 . 1 1 232 232 ILE CD1 C 13 15.142 0.400 . 1 . . . . 232 ILE CD1 . 17416 1 2830 . 1 1 232 232 ILE N N 15 119.024 0.400 . 1 . . . . 232 ILE N . 17416 1 2831 . 1 1 233 233 GLY H H 1 7.430 0.020 . 1 . . . . 233 GLY H . 17416 1 2832 . 1 1 233 233 GLY HA2 H 1 3.470 0.020 . 2 . . . . 233 GLY HA2 . 17416 1 2833 . 1 1 233 233 GLY HA3 H 1 4.256 0.020 . 2 . . . . 233 GLY HA3 . 17416 1 2834 . 1 1 233 233 GLY C C 13 175.057 0.400 . 1 . . . . 233 GLY C . 17416 1 2835 . 1 1 233 233 GLY CA C 13 47.715 0.400 . 1 . . . . 233 GLY CA . 17416 1 2836 . 1 1 233 233 GLY N N 15 109.452 0.400 . 1 . . . . 233 GLY N . 17416 1 2837 . 1 1 234 234 ASP H H 1 8.185 0.020 . 1 . . . . 234 ASP H . 17416 1 2838 . 1 1 234 234 ASP HA H 1 4.463 0.020 . 1 . . . . 234 ASP HA . 17416 1 2839 . 1 1 234 234 ASP HB2 H 1 2.534 0.020 . 2 . . . . 234 ASP HB2 . 17416 1 2840 . 1 1 234 234 ASP HB3 H 1 2.306 0.020 . 2 . . . . 234 ASP HB3 . 17416 1 2841 . 1 1 234 234 ASP C C 13 178.957 0.400 . 1 . . . . 234 ASP C . 17416 1 2842 . 1 1 234 234 ASP CA C 13 57.442 0.400 . 1 . . . . 234 ASP CA . 17416 1 2843 . 1 1 234 234 ASP CB C 13 40.405 0.400 . 1 . . . . 234 ASP CB . 17416 1 2844 . 1 1 234 234 ASP N N 15 122.924 0.400 . 1 . . . . 234 ASP N . 17416 1 2845 . 1 1 235 235 LEU H H 1 8.756 0.020 . 1 . . . . 235 LEU H . 17416 1 2846 . 1 1 235 235 LEU HA H 1 3.823 0.020 . 1 . . . . 235 LEU HA . 17416 1 2847 . 1 1 235 235 LEU HB2 H 1 1.201 0.020 . 2 . . . . 235 LEU HB2 . 17416 1 2848 . 1 1 235 235 LEU HB3 H 1 1.847 0.020 . 2 . . . . 235 LEU HB3 . 17416 1 2849 . 1 1 235 235 LEU HG H 1 1.592 0.020 . 1 . . . . 235 LEU HG . 17416 1 2850 . 1 1 235 235 LEU HD11 H 1 -0.153 0.020 . 2 . . . . 235 LEU HD1 . 17416 1 2851 . 1 1 235 235 LEU HD12 H 1 -0.153 0.020 . 2 . . . . 235 LEU HD1 . 17416 1 2852 . 1 1 235 235 LEU HD13 H 1 -0.153 0.020 . 2 . . . . 235 LEU HD1 . 17416 1 2853 . 1 1 235 235 LEU HD21 H 1 0.303 0.020 . 2 . . . . 235 LEU HD2 . 17416 1 2854 . 1 1 235 235 LEU HD22 H 1 0.303 0.020 . 2 . . . . 235 LEU HD2 . 17416 1 2855 . 1 1 235 235 LEU HD23 H 1 0.303 0.020 . 2 . . . . 235 LEU HD2 . 17416 1 2856 . 1 1 235 235 LEU C C 13 178.274 0.400 . 1 . . . . 235 LEU C . 17416 1 2857 . 1 1 235 235 LEU CA C 13 56.777 0.400 . 1 . . . . 235 LEU CA . 17416 1 2858 . 1 1 235 235 LEU CB C 13 43.435 0.400 . 1 . . . . 235 LEU CB . 17416 1 2859 . 1 1 235 235 LEU CG C 13 25.986 0.400 . 1 . . . . 235 LEU CG . 17416 1 2860 . 1 1 235 235 LEU CD1 C 13 24.185 0.400 . 1 . . . . 235 LEU CD1 . 17416 1 2861 . 1 1 235 235 LEU CD2 C 13 21.987 0.400 . 1 . . . . 235 LEU CD2 . 17416 1 2862 . 1 1 235 235 LEU N N 15 116.442 0.400 . 1 . . . . 235 LEU N . 17416 1 2863 . 1 1 236 236 TYR H H 1 7.430 0.020 . 1 . . . . 236 TYR H . 17416 1 2864 . 1 1 236 236 TYR HA H 1 4.568 0.020 . 1 . . . . 236 TYR HA . 17416 1 2865 . 1 1 236 236 TYR HB2 H 1 2.742 0.020 . 2 . . . . 236 TYR HB2 . 17416 1 2866 . 1 1 236 236 TYR HB3 H 1 2.985 0.020 . 2 . . . . 236 TYR HB3 . 17416 1 2867 . 1 1 236 236 TYR HD1 H 1 6.867 0.020 . 1 . . . . 236 TYR HD1 . 17416 1 2868 . 1 1 236 236 TYR HD2 H 1 6.867 0.020 . 1 . . . . 236 TYR HD2 . 17416 1 2869 . 1 1 236 236 TYR HE1 H 1 6.171 0.020 . 1 . . . . 236 TYR HE1 . 17416 1 2870 . 1 1 236 236 TYR HE2 H 1 6.171 0.020 . 1 . . . . 236 TYR HE2 . 17416 1 2871 . 1 1 236 236 TYR C C 13 178.076 0.400 . 1 . . . . 236 TYR C . 17416 1 2872 . 1 1 236 236 TYR CA C 13 53.351 0.400 . 1 . . . . 236 TYR CA . 17416 1 2873 . 1 1 236 236 TYR CB C 13 36.978 0.400 . 1 . . . . 236 TYR CB . 17416 1 2874 . 1 1 236 236 TYR N N 15 116.600 0.400 . 1 . . . . 236 TYR N . 17416 1 2875 . 1 1 237 237 LEU H H 1 7.650 0.020 . 1 . . . . 237 LEU H . 17416 1 2876 . 1 1 237 237 LEU HA H 1 4.382 0.020 . 1 . . . . 237 LEU HA . 17416 1 2877 . 1 1 237 237 LEU HB2 H 1 1.168 0.020 . 2 . . . . 237 LEU HB2 . 17416 1 2878 . 1 1 237 237 LEU HB3 H 1 2.151 0.020 . 2 . . . . 237 LEU HB3 . 17416 1 2879 . 1 1 237 237 LEU HG H 1 1.767 0.020 . 1 . . . . 237 LEU HG . 17416 1 2880 . 1 1 237 237 LEU HD11 H 1 0.906 0.020 . 2 . . . . 237 LEU HD1 . 17416 1 2881 . 1 1 237 237 LEU HD12 H 1 0.906 0.020 . 2 . . . . 237 LEU HD1 . 17416 1 2882 . 1 1 237 237 LEU HD13 H 1 0.906 0.020 . 2 . . . . 237 LEU HD1 . 17416 1 2883 . 1 1 237 237 LEU HD21 H 1 0.447 0.020 . 2 . . . . 237 LEU HD2 . 17416 1 2884 . 1 1 237 237 LEU HD22 H 1 0.447 0.020 . 2 . . . . 237 LEU HD2 . 17416 1 2885 . 1 1 237 237 LEU HD23 H 1 0.447 0.020 . 2 . . . . 237 LEU HD2 . 17416 1 2886 . 1 1 237 237 LEU C C 13 178.081 0.400 . 1 . . . . 237 LEU C . 17416 1 2887 . 1 1 237 237 LEU CA C 13 55.573 0.400 . 1 . . . . 237 LEU CA . 17416 1 2888 . 1 1 237 237 LEU CB C 13 40.950 0.400 . 1 . . . . 237 LEU CB . 17416 1 2889 . 1 1 237 237 LEU CG C 13 26.755 0.400 . 1 . . . . 237 LEU CG . 17416 1 2890 . 1 1 237 237 LEU CD1 C 13 26.722 0.400 . 1 . . . . 237 LEU CD1 . 17416 1 2891 . 1 1 237 237 LEU CD2 C 13 21.984 0.400 . 1 . . . . 237 LEU CD2 . 17416 1 2892 . 1 1 237 237 LEU N N 15 117.798 0.400 . 1 . . . . 237 LEU N . 17416 1 2893 . 1 1 238 238 LEU H H 1 7.941 0.020 . 1 . . . . 238 LEU H . 17416 1 2894 . 1 1 238 238 LEU HA H 1 4.141 0.020 . 1 . . . . 238 LEU HA . 17416 1 2895 . 1 1 238 238 LEU HB2 H 1 1.828 0.020 . 2 . . . . 238 LEU HB2 . 17416 1 2896 . 1 1 238 238 LEU HB3 H 1 1.117 0.020 . 2 . . . . 238 LEU HB3 . 17416 1 2897 . 1 1 238 238 LEU HG H 1 1.557 0.020 . 1 . . . . 238 LEU HG . 17416 1 2898 . 1 1 238 238 LEU HD11 H 1 0.468 0.020 . 2 . . . . 238 LEU HD1 . 17416 1 2899 . 1 1 238 238 LEU HD12 H 1 0.468 0.020 . 2 . . . . 238 LEU HD1 . 17416 1 2900 . 1 1 238 238 LEU HD13 H 1 0.468 0.020 . 2 . . . . 238 LEU HD1 . 17416 1 2901 . 1 1 238 238 LEU HD21 H 1 0.427 0.020 . 2 . . . . 238 LEU HD2 . 17416 1 2902 . 1 1 238 238 LEU HD22 H 1 0.427 0.020 . 2 . . . . 238 LEU HD2 . 17416 1 2903 . 1 1 238 238 LEU HD23 H 1 0.427 0.020 . 2 . . . . 238 LEU HD2 . 17416 1 2904 . 1 1 238 238 LEU C C 13 179.345 0.400 . 1 . . . . 238 LEU C . 17416 1 2905 . 1 1 238 238 LEU CA C 13 57.325 0.400 . 1 . . . . 238 LEU CA . 17416 1 2906 . 1 1 238 238 LEU CB C 13 41.887 0.400 . 1 . . . . 238 LEU CB . 17416 1 2907 . 1 1 238 238 LEU CG C 13 27.640 0.400 . 1 . . . . 238 LEU CG . 17416 1 2908 . 1 1 238 238 LEU CD1 C 13 24.497 0.400 . 1 . . . . 238 LEU CD1 . 17416 1 2909 . 1 1 238 238 LEU CD2 C 13 23.507 0.400 . 1 . . . . 238 LEU CD2 . 17416 1 2910 . 1 1 238 238 LEU N N 15 119.793 0.400 . 1 . . . . 238 LEU N . 17416 1 2911 . 1 1 239 239 GLY H H 1 8.229 0.020 . 1 . . . . 239 GLY H . 17416 1 2912 . 1 1 239 239 GLY HA2 H 1 3.770 0.020 . 2 . . . . 239 GLY HA2 . 17416 1 2913 . 1 1 239 239 GLY HA3 H 1 4.215 0.020 . 2 . . . . 239 GLY HA3 . 17416 1 2914 . 1 1 239 239 GLY C C 13 172.529 0.400 . 1 . . . . 239 GLY C . 17416 1 2915 . 1 1 239 239 GLY CA C 13 45.062 0.400 . 1 . . . . 239 GLY CA . 17416 1 2916 . 1 1 239 239 GLY N N 15 105.521 0.400 . 1 . . . . 239 GLY N . 17416 1 2917 . 1 1 240 240 SER H H 1 7.418 0.020 . 1 . . . . 240 SER H . 17416 1 2918 . 1 1 240 240 SER HA H 1 5.019 0.020 . 1 . . . . 240 SER HA . 17416 1 2919 . 1 1 240 240 SER HB2 H 1 3.684 0.020 . 2 . . . . 240 SER HB2 . 17416 1 2920 . 1 1 240 240 SER HB3 H 1 4.167 0.020 . 2 . . . . 240 SER HB3 . 17416 1 2921 . 1 1 240 240 SER CA C 13 55.852 0.400 . 1 . . . . 240 SER CA . 17416 1 2922 . 1 1 240 240 SER CB C 13 66.122 0.400 . 1 . . . . 240 SER CB . 17416 1 2923 . 1 1 240 240 SER N N 15 113.490 0.400 . 1 . . . . 240 SER N . 17416 1 2924 . 1 1 241 241 PRO HA H 1 4.659 0.020 . 1 . . . . 241 PRO HA . 17416 1 2925 . 1 1 241 241 PRO HB2 H 1 2.298 0.020 . 2 . . . . 241 PRO HB2 . 17416 1 2926 . 1 1 241 241 PRO HB3 H 1 2.633 0.020 . 2 . . . . 241 PRO HB3 . 17416 1 2927 . 1 1 241 241 PRO HG2 H 1 1.881 0.020 . 2 . . . . 241 PRO HG2 . 17416 1 2928 . 1 1 241 241 PRO HG3 H 1 1.974 0.020 . 2 . . . . 241 PRO HG3 . 17416 1 2929 . 1 1 241 241 PRO HD2 H 1 3.397 0.020 . 2 . . . . 241 PRO HD2 . 17416 1 2930 . 1 1 241 241 PRO HD3 H 1 4.023 0.020 . 2 . . . . 241 PRO HD3 . 17416 1 2931 . 1 1 241 241 PRO C C 13 175.061 0.400 . 1 . . . . 241 PRO C . 17416 1 2932 . 1 1 241 241 PRO CA C 13 63.000 0.400 . 1 . . . . 241 PRO CA . 17416 1 2933 . 1 1 241 241 PRO CB C 13 31.006 0.400 . 1 . . . . 241 PRO CB . 17416 1 2934 . 1 1 241 241 PRO CG C 13 27.899 0.400 . 1 . . . . 241 PRO CG . 17416 1 2935 . 1 1 241 241 PRO CD C 13 50.264 0.400 . 1 . . . . 241 PRO CD . 17416 1 2936 . 1 1 242 242 VAL H H 1 10.360 0.020 . 1 . . . . 242 VAL H . 17416 1 2937 . 1 1 242 242 VAL HA H 1 5.295 0.020 . 1 . . . . 242 VAL HA . 17416 1 2938 . 1 1 242 242 VAL HB H 1 2.170 0.020 . 1 . . . . 242 VAL HB . 17416 1 2939 . 1 1 242 242 VAL HG11 H 1 1.232 0.020 . 2 . . . . 242 VAL HG1 . 17416 1 2940 . 1 1 242 242 VAL HG12 H 1 1.232 0.020 . 2 . . . . 242 VAL HG1 . 17416 1 2941 . 1 1 242 242 VAL HG13 H 1 1.232 0.020 . 2 . . . . 242 VAL HG1 . 17416 1 2942 . 1 1 242 242 VAL HG21 H 1 1.310 0.020 . 2 . . . . 242 VAL HG2 . 17416 1 2943 . 1 1 242 242 VAL HG22 H 1 1.310 0.020 . 2 . . . . 242 VAL HG2 . 17416 1 2944 . 1 1 242 242 VAL HG23 H 1 1.310 0.020 . 2 . . . . 242 VAL HG2 . 17416 1 2945 . 1 1 242 242 VAL C C 13 176.035 0.400 . 1 . . . . 242 VAL C . 17416 1 2946 . 1 1 242 242 VAL CA C 13 61.798 0.400 . 1 . . . . 242 VAL CA . 17416 1 2947 . 1 1 242 242 VAL CB C 13 35.650 0.400 . 1 . . . . 242 VAL CB . 17416 1 2948 . 1 1 242 242 VAL CG1 C 13 22.288 0.400 . 1 . . . . 242 VAL CG1 . 17416 1 2949 . 1 1 242 242 VAL CG2 C 13 24.163 0.400 . 1 . . . . 242 VAL CG2 . 17416 1 2950 . 1 1 242 242 VAL N N 15 127.292 0.400 . 1 . . . . 242 VAL N . 17416 1 2951 . 1 1 243 243 LYS H H 1 8.963 0.020 . 1 . . . . 243 LYS H . 17416 1 2952 . 1 1 243 243 LYS HA H 1 4.559 0.020 . 1 . . . . 243 LYS HA . 17416 1 2953 . 1 1 243 243 LYS HB2 H 1 1.892 0.020 . 2 . . . . 243 LYS HB2 . 17416 1 2954 . 1 1 243 243 LYS HB3 H 1 1.892 0.020 . 2 . . . . 243 LYS HB3 . 17416 1 2955 . 1 1 243 243 LYS HG2 H 1 1.105 0.020 . 2 . . . . 243 LYS HG2 . 17416 1 2956 . 1 1 243 243 LYS HG3 H 1 1.105 0.020 . 2 . . . . 243 LYS HG3 . 17416 1 2957 . 1 1 243 243 LYS HD2 H 1 1.247 0.020 . 2 . . . . 243 LYS HD2 . 17416 1 2958 . 1 1 243 243 LYS HD3 H 1 1.664 0.020 . 2 . . . . 243 LYS HD3 . 17416 1 2959 . 1 1 243 243 LYS HE2 H 1 1.702 0.020 . 2 . . . . 243 LYS HE2 . 17416 1 2960 . 1 1 243 243 LYS HE3 H 1 2.439 0.020 . 2 . . . . 243 LYS HE3 . 17416 1 2961 . 1 1 243 243 LYS C C 13 175.453 0.400 . 1 . . . . 243 LYS C . 17416 1 2962 . 1 1 243 243 LYS CA C 13 53.707 0.400 . 1 . . . . 243 LYS CA . 17416 1 2963 . 1 1 243 243 LYS CD C 13 28.210 0.400 . 1 . . . . 243 LYS CD . 17416 1 2964 . 1 1 243 243 LYS CE C 13 40.950 0.400 . 1 . . . . 243 LYS CE . 17416 1 2965 . 1 1 243 243 LYS N N 15 121.584 0.400 . 1 . . . . 243 LYS N . 17416 1 2966 . 1 1 244 244 GLY H H 1 7.257 0.020 . 1 . . . . 244 GLY H . 17416 1 2967 . 1 1 244 244 GLY HA2 H 1 3.749 0.020 . 2 . . . . 244 GLY HA2 . 17416 1 2968 . 1 1 244 244 GLY HA3 H 1 4.054 0.020 . 2 . . . . 244 GLY HA3 . 17416 1 2969 . 1 1 244 244 GLY C C 13 168.513 0.400 . 1 . . . . 244 GLY C . 17416 1 2970 . 1 1 244 244 GLY CA C 13 45.010 0.400 . 1 . . . . 244 GLY CA . 17416 1 2971 . 1 1 244 244 GLY N N 15 109.193 0.400 . 1 . . . . 244 GLY N . 17416 1 2972 . 1 1 245 245 LYS H H 1 8.544 0.020 . 1 . . . . 245 LYS H . 17416 1 2973 . 1 1 245 245 LYS HA H 1 5.567 0.020 . 1 . . . . 245 LYS HA . 17416 1 2974 . 1 1 245 245 LYS HB2 H 1 1.532 0.020 . 2 . . . . 245 LYS HB2 . 17416 1 2975 . 1 1 245 245 LYS HB3 H 1 1.532 0.020 . 2 . . . . 245 LYS HB3 . 17416 1 2976 . 1 1 245 245 LYS HG2 H 1 1.198 0.020 . 2 . . . . 245 LYS HG2 . 17416 1 2977 . 1 1 245 245 LYS HG3 H 1 1.262 0.020 . 2 . . . . 245 LYS HG3 . 17416 1 2978 . 1 1 245 245 LYS HD2 H 1 1.551 0.020 . 2 . . . . 245 LYS HD2 . 17416 1 2979 . 1 1 245 245 LYS HD3 H 1 1.551 0.020 . 2 . . . . 245 LYS HD3 . 17416 1 2980 . 1 1 245 245 LYS HE2 H 1 2.881 0.020 . 2 . . . . 245 LYS HE2 . 17416 1 2981 . 1 1 245 245 LYS HE3 H 1 2.881 0.020 . 2 . . . . 245 LYS HE3 . 17416 1 2982 . 1 1 245 245 LYS C C 13 175.743 0.400 . 1 . . . . 245 LYS C . 17416 1 2983 . 1 1 245 245 LYS CA C 13 54.221 0.400 . 1 . . . . 245 LYS CA . 17416 1 2984 . 1 1 245 245 LYS CB C 13 34.456 0.400 . 1 . . . . 245 LYS CB . 17416 1 2985 . 1 1 245 245 LYS CG C 13 24.785 0.400 . 1 . . . . 245 LYS CG . 17416 1 2986 . 1 1 245 245 LYS CD C 13 29.653 0.400 . 1 . . . . 245 LYS CD . 17416 1 2987 . 1 1 245 245 LYS CE C 13 41.337 0.400 . 1 . . . . 245 LYS CE . 17416 1 2988 . 1 1 245 245 LYS N N 15 120.519 0.400 . 1 . . . . 245 LYS N . 17416 1 2989 . 1 1 246 246 PHE H H 1 9.451 0.020 . 1 . . . . 246 PHE H . 17416 1 2990 . 1 1 246 246 PHE HA H 1 5.697 0.020 . 1 . . . . 246 PHE HA . 17416 1 2991 . 1 1 246 246 PHE HB2 H 1 3.142 0.020 . 2 . . . . 246 PHE HB2 . 17416 1 2992 . 1 1 246 246 PHE HB3 H 1 2.891 0.020 . 2 . . . . 246 PHE HB3 . 17416 1 2993 . 1 1 246 246 PHE HD1 H 1 7.259 0.020 . 1 . . . . 246 PHE HD1 . 17416 1 2994 . 1 1 246 246 PHE HD2 H 1 7.259 0.020 . 1 . . . . 246 PHE HD2 . 17416 1 2995 . 1 1 246 246 PHE HE1 H 1 6.996 0.020 . 1 . . . . 246 PHE HE1 . 17416 1 2996 . 1 1 246 246 PHE HE2 H 1 6.996 0.020 . 1 . . . . 246 PHE HE2 . 17416 1 2997 . 1 1 246 246 PHE HZ H 1 6.888 0.020 . 1 . . . . 246 PHE HZ . 17416 1 2998 . 1 1 246 246 PHE C C 13 175.253 0.400 . 1 . . . . 246 PHE C . 17416 1 2999 . 1 1 246 246 PHE CA C 13 56.518 0.400 . 1 . . . . 246 PHE CA . 17416 1 3000 . 1 1 246 246 PHE CB C 13 43.401 0.400 . 1 . . . . 246 PHE CB . 17416 1 3001 . 1 1 246 246 PHE N N 15 123.749 0.400 . 1 . . . . 246 PHE N . 17416 1 3002 . 1 1 247 247 TYR H H 1 9.266 0.020 . 1 . . . . 247 TYR H . 17416 1 3003 . 1 1 247 247 TYR HA H 1 5.376 0.020 . 1 . . . . 247 TYR HA . 17416 1 3004 . 1 1 247 247 TYR HB2 H 1 3.189 0.020 . 2 . . . . 247 TYR HB2 . 17416 1 3005 . 1 1 247 247 TYR HB3 H 1 2.759 0.020 . 2 . . . . 247 TYR HB3 . 17416 1 3006 . 1 1 247 247 TYR HD1 H 1 6.841 0.020 . 1 . . . . 247 TYR HD1 . 17416 1 3007 . 1 1 247 247 TYR HD2 H 1 6.841 0.020 . 1 . . . . 247 TYR HD2 . 17416 1 3008 . 1 1 247 247 TYR HE1 H 1 6.677 0.020 . 1 . . . . 247 TYR HE1 . 17416 1 3009 . 1 1 247 247 TYR HE2 H 1 6.677 0.020 . 1 . . . . 247 TYR HE2 . 17416 1 3010 . 1 1 247 247 TYR C C 13 172.725 0.400 . 1 . . . . 247 TYR C . 17416 1 3011 . 1 1 247 247 TYR CA C 13 56.700 0.400 . 1 . . . . 247 TYR CA . 17416 1 3012 . 1 1 247 247 TYR CB C 13 41.001 0.400 . 1 . . . . 247 TYR CB . 17416 1 3013 . 1 1 247 247 TYR N N 15 125.762 0.400 . 1 . . . . 247 TYR N . 17416 1 3014 . 1 1 248 248 SER H H 1 8.399 0.020 . 1 . . . . 248 SER H . 17416 1 3015 . 1 1 248 248 SER HA H 1 5.167 0.020 . 1 . . . . 248 SER HA . 17416 1 3016 . 1 1 248 248 SER HB2 H 1 3.597 0.020 . 2 . . . . 248 SER HB2 . 17416 1 3017 . 1 1 248 248 SER HB3 H 1 3.790 0.020 . 2 . . . . 248 SER HB3 . 17416 1 3018 . 1 1 248 248 SER HG H 1 5.315 0.020 . 1 . . . . 248 SER HG . 17416 1 3019 . 1 1 248 248 SER C C 13 171.359 0.400 . 1 . . . . 248 SER C . 17416 1 3020 . 1 1 248 248 SER CA C 13 54.633 0.400 . 1 . . . . 248 SER CA . 17416 1 3021 . 1 1 248 248 SER CB C 13 65.188 0.400 . 1 . . . . 248 SER CB . 17416 1 3022 . 1 1 248 248 SER N N 15 121.735 0.400 . 1 . . . . 248 SER N . 17416 1 3023 . 1 1 249 249 PHE H H 1 9.309 0.020 . 1 . . . . 249 PHE H . 17416 1 3024 . 1 1 249 249 PHE HA H 1 5.101 0.020 . 1 . . . . 249 PHE HA . 17416 1 3025 . 1 1 249 249 PHE HB2 H 1 3.143 0.020 . 2 . . . . 249 PHE HB2 . 17416 1 3026 . 1 1 249 249 PHE HB3 H 1 3.053 0.020 . 2 . . . . 249 PHE HB3 . 17416 1 3027 . 1 1 249 249 PHE HD1 H 1 7.200 0.020 . 1 . . . . 249 PHE HD1 . 17416 1 3028 . 1 1 249 249 PHE HD2 H 1 7.200 0.020 . 1 . . . . 249 PHE HD2 . 17416 1 3029 . 1 1 249 249 PHE HE1 H 1 7.206 0.020 . 1 . . . . 249 PHE HE1 . 17416 1 3030 . 1 1 249 249 PHE HE2 H 1 7.206 0.020 . 1 . . . . 249 PHE HE2 . 17416 1 3031 . 1 1 249 249 PHE HZ H 1 8.017 0.020 . 1 . . . . 249 PHE HZ . 17416 1 3032 . 1 1 249 249 PHE C C 13 174.672 0.400 . 1 . . . . 249 PHE C . 17416 1 3033 . 1 1 249 249 PHE CA C 13 55.253 0.400 . 1 . . . . 249 PHE CA . 17416 1 3034 . 1 1 249 249 PHE CB C 13 39.684 0.400 . 1 . . . . 249 PHE CB . 17416 1 3035 . 1 1 249 249 PHE N N 15 127.943 0.400 . 1 . . . . 249 PHE N . 17416 1 3036 . 1 1 250 250 ARG H H 1 7.837 0.020 . 1 . . . . 250 ARG H . 17416 1 3037 . 1 1 250 250 ARG HA H 1 3.699 0.020 . 1 . . . . 250 ARG HA . 17416 1 3038 . 1 1 250 250 ARG HB2 H 1 1.696 0.020 . 2 . . . . 250 ARG HB2 . 17416 1 3039 . 1 1 250 250 ARG HB3 H 1 1.963 0.020 . 2 . . . . 250 ARG HB3 . 17416 1 3040 . 1 1 250 250 ARG HG2 H 1 -0.021 0.020 . 2 . . . . 250 ARG HG2 . 17416 1 3041 . 1 1 250 250 ARG HG3 H 1 1.100 0.020 . 2 . . . . 250 ARG HG3 . 17416 1 3042 . 1 1 250 250 ARG HD2 H 1 2.716 0.020 . 2 . . . . 250 ARG HD2 . 17416 1 3043 . 1 1 250 250 ARG HD3 H 1 2.916 0.020 . 2 . . . . 250 ARG HD3 . 17416 1 3044 . 1 1 250 250 ARG C C 13 176.229 0.400 . 1 . . . . 250 ARG C . 17416 1 3045 . 1 1 250 250 ARG CA C 13 57.767 0.400 . 1 . . . . 250 ARG CA . 17416 1 3046 . 1 1 250 250 ARG CB C 13 27.899 0.400 . 1 . . . . 250 ARG CB . 17416 1 3047 . 1 1 250 250 ARG CG C 13 26.967 0.400 . 1 . . . . 250 ARG CG . 17416 1 3048 . 1 1 250 250 ARG CD C 13 44.094 0.400 . 1 . . . . 250 ARG CD . 17416 1 3049 . 1 1 250 250 ARG N N 15 113.507 0.400 . 1 . . . . 250 ARG N . 17416 1 3050 . 1 1 251 251 GLY H H 1 6.926 0.020 . 1 . . . . 251 GLY H . 17416 1 3051 . 1 1 251 251 GLY HA2 H 1 3.810 0.020 . 2 . . . . 251 GLY HA2 . 17416 1 3052 . 1 1 251 251 GLY HA3 H 1 4.041 0.020 . 2 . . . . 251 GLY HA3 . 17416 1 3053 . 1 1 251 251 GLY C C 13 173.984 0.400 . 1 . . . . 251 GLY C . 17416 1 3054 . 1 1 251 251 GLY CA C 13 46.544 0.400 . 1 . . . . 251 GLY CA . 17416 1 3055 . 1 1 251 251 GLY N N 15 101.350 0.400 . 1 . . . . 251 GLY N . 17416 1 3056 . 1 1 252 252 GLY H H 1 6.961 0.020 . 1 . . . . 252 GLY H . 17416 1 3057 . 1 1 252 252 GLY HA2 H 1 4.218 0.020 . 2 . . . . 252 GLY HA2 . 17416 1 3058 . 1 1 252 252 GLY HA3 H 1 4.069 0.020 . 2 . . . . 252 GLY HA3 . 17416 1 3059 . 1 1 252 252 GLY CA C 13 43.911 0.400 . 1 . . . . 252 GLY CA . 17416 1 3060 . 1 1 252 252 GLY N N 15 108.617 0.400 . 1 . . . . 252 GLY N . 17416 1 3061 . 1 1 253 253 HIS HA H 1 4.389 0.020 . 1 . . . . 253 HIS HA . 17416 1 3062 . 1 1 253 253 HIS HB2 H 1 3.172 0.020 . 2 . . . . 253 HIS HB2 . 17416 1 3063 . 1 1 253 253 HIS HB3 H 1 3.429 0.020 . 2 . . . . 253 HIS HB3 . 17416 1 3064 . 1 1 253 253 HIS HD2 H 1 7.181 0.020 . 1 . . . . 253 HIS HD2 . 17416 1 3065 . 1 1 253 253 HIS HE1 H 1 7.523 0.020 . 1 . . . . 253 HIS HE1 . 17416 1 3066 . 1 1 253 253 HIS CA C 13 59.593 0.400 . 1 . . . . 253 HIS CA . 17416 1 3067 . 1 1 253 253 HIS CB C 13 27.899 0.400 . 1 . . . . 253 HIS CB . 17416 1 3068 . 1 1 254 254 SER HA H 1 4.143 0.020 . 1 . . . . 254 SER HA . 17416 1 3069 . 1 1 254 254 SER HB2 H 1 3.702 0.020 . 2 . . . . 254 SER HB2 . 17416 1 3070 . 1 1 254 254 SER HB3 H 1 3.702 0.020 . 2 . . . . 254 SER HB3 . 17416 1 3071 . 1 1 254 254 SER C C 13 176.620 0.400 . 1 . . . . 254 SER C . 17416 1 3072 . 1 1 254 254 SER CA C 13 61.743 0.400 . 1 . . . . 254 SER CA . 17416 1 3073 . 1 1 254 254 SER CB C 13 62.140 0.400 . 1 . . . . 254 SER CB . 17416 1 3074 . 1 1 255 255 LEU H H 1 7.825 0.020 . 1 . . . . 255 LEU H . 17416 1 3075 . 1 1 255 255 LEU HA H 1 4.118 0.020 . 1 . . . . 255 LEU HA . 17416 1 3076 . 1 1 255 255 LEU HB2 H 1 1.568 0.020 . 2 . . . . 255 LEU HB2 . 17416 1 3077 . 1 1 255 255 LEU HB3 H 1 1.731 0.020 . 2 . . . . 255 LEU HB3 . 17416 1 3078 . 1 1 255 255 LEU HG H 1 1.719 0.020 . 1 . . . . 255 LEU HG . 17416 1 3079 . 1 1 255 255 LEU HD11 H 1 0.852 0.020 . 2 . . . . 255 LEU HD1 . 17416 1 3080 . 1 1 255 255 LEU HD12 H 1 0.852 0.020 . 2 . . . . 255 LEU HD1 . 17416 1 3081 . 1 1 255 255 LEU HD13 H 1 0.852 0.020 . 2 . . . . 255 LEU HD1 . 17416 1 3082 . 1 1 255 255 LEU HD21 H 1 0.790 0.020 . 2 . . . . 255 LEU HD2 . 17416 1 3083 . 1 1 255 255 LEU HD22 H 1 0.790 0.020 . 2 . . . . 255 LEU HD2 . 17416 1 3084 . 1 1 255 255 LEU HD23 H 1 0.790 0.020 . 2 . . . . 255 LEU HD2 . 17416 1 3085 . 1 1 255 255 LEU C C 13 177.496 0.400 . 1 . . . . 255 LEU C . 17416 1 3086 . 1 1 255 255 LEU CA C 13 57.021 0.400 . 1 . . . . 255 LEU CA . 17416 1 3087 . 1 1 255 255 LEU CB C 13 42.192 0.400 . 1 . . . . 255 LEU CB . 17416 1 3088 . 1 1 255 255 LEU CG C 13 26.587 0.400 . 1 . . . . 255 LEU CG . 17416 1 3089 . 1 1 255 255 LEU CD1 C 13 24.229 0.400 . 1 . . . . 255 LEU CD1 . 17416 1 3090 . 1 1 255 255 LEU CD2 C 13 27.614 0.400 . 1 . . . . 255 LEU CD2 . 17416 1 3091 . 1 1 255 255 LEU N N 15 125.094 0.400 . 1 . . . . 255 LEU N . 17416 1 3092 . 1 1 256 256 ASN H H 1 8.551 0.020 . 1 . . . . 256 ASN H . 17416 1 3093 . 1 1 256 256 ASN HA H 1 4.118 0.020 . 1 . . . . 256 ASN HA . 17416 1 3094 . 1 1 256 256 ASN HB2 H 1 3.308 0.020 . 2 . . . . 256 ASN HB2 . 17416 1 3095 . 1 1 256 256 ASN HB3 H 1 2.392 0.020 . 2 . . . . 256 ASN HB3 . 17416 1 3096 . 1 1 256 256 ASN C C 13 177.788 0.400 . 1 . . . . 256 ASN C . 17416 1 3097 . 1 1 256 256 ASN CA C 13 55.586 0.400 . 1 . . . . 256 ASN CA . 17416 1 3098 . 1 1 256 256 ASN CB C 13 37.892 0.400 . 1 . . . . 256 ASN CB . 17416 1 3099 . 1 1 256 256 ASN N N 15 119.163 0.400 . 1 . . . . 256 ASN N . 17416 1 3100 . 1 1 257 257 VAL H H 1 8.441 0.020 . 1 . . . . 257 VAL H . 17416 1 3101 . 1 1 257 257 VAL HA H 1 3.548 0.020 . 1 . . . . 257 VAL HA . 17416 1 3102 . 1 1 257 257 VAL HB H 1 2.135 0.020 . 1 . . . . 257 VAL HB . 17416 1 3103 . 1 1 257 257 VAL HG11 H 1 0.943 0.020 . 2 . . . . 257 VAL HG1 . 17416 1 3104 . 1 1 257 257 VAL HG12 H 1 0.943 0.020 . 2 . . . . 257 VAL HG1 . 17416 1 3105 . 1 1 257 257 VAL HG13 H 1 0.943 0.020 . 2 . . . . 257 VAL HG1 . 17416 1 3106 . 1 1 257 257 VAL HG21 H 1 1.024 0.020 . 2 . . . . 257 VAL HG2 . 17416 1 3107 . 1 1 257 257 VAL HG22 H 1 1.024 0.020 . 2 . . . . 257 VAL HG2 . 17416 1 3108 . 1 1 257 257 VAL HG23 H 1 1.024 0.020 . 2 . . . . 257 VAL HG2 . 17416 1 3109 . 1 1 257 257 VAL C C 13 177.106 0.400 . 1 . . . . 257 VAL C . 17416 1 3110 . 1 1 257 257 VAL CA C 13 66.427 0.400 . 1 . . . . 257 VAL CA . 17416 1 3111 . 1 1 257 257 VAL CB C 13 31.292 0.400 . 1 . . . . 257 VAL CB . 17416 1 3112 . 1 1 257 257 VAL CG1 C 13 21.984 0.400 . 1 . . . . 257 VAL CG1 . 17416 1 3113 . 1 1 257 257 VAL CG2 C 13 24.494 0.400 . 1 . . . . 257 VAL CG2 . 17416 1 3114 . 1 1 257 257 VAL N N 15 117.797 0.400 . 1 . . . . 257 VAL N . 17416 1 3115 . 1 1 258 258 LYS H H 1 8.003 0.020 . 1 . . . . 258 LYS H . 17416 1 3116 . 1 1 258 258 LYS HA H 1 3.941 0.020 . 1 . . . . 258 LYS HA . 17416 1 3117 . 1 1 258 258 LYS HB2 H 1 2.030 0.020 . 2 . . . . 258 LYS HB2 . 17416 1 3118 . 1 1 258 258 LYS HB3 H 1 2.030 0.020 . 2 . . . . 258 LYS HB3 . 17416 1 3119 . 1 1 258 258 LYS HG2 H 1 1.373 0.020 . 2 . . . . 258 LYS HG2 . 17416 1 3120 . 1 1 258 258 LYS HG3 H 1 1.606 0.020 . 2 . . . . 258 LYS HG3 . 17416 1 3121 . 1 1 258 258 LYS HD2 H 1 1.634 0.020 . 2 . . . . 258 LYS HD2 . 17416 1 3122 . 1 1 258 258 LYS HD3 H 1 1.634 0.020 . 2 . . . . 258 LYS HD3 . 17416 1 3123 . 1 1 258 258 LYS HE2 H 1 2.947 0.020 . 2 . . . . 258 LYS HE2 . 17416 1 3124 . 1 1 258 258 LYS HE3 H 1 2.947 0.020 . 2 . . . . 258 LYS HE3 . 17416 1 3125 . 1 1 258 258 LYS C C 13 179.055 0.400 . 1 . . . . 258 LYS C . 17416 1 3126 . 1 1 258 258 LYS CA C 13 60.470 0.400 . 1 . . . . 258 LYS CA . 17416 1 3127 . 1 1 258 258 LYS CB C 13 32.227 0.400 . 1 . . . . 258 LYS CB . 17416 1 3128 . 1 1 258 258 LYS CG C 13 25.688 0.400 . 1 . . . . 258 LYS CG . 17416 1 3129 . 1 1 258 258 LYS CD C 13 29.385 0.400 . 1 . . . . 258 LYS CD . 17416 1 3130 . 1 1 258 258 LYS CE C 13 41.907 0.400 . 1 . . . . 258 LYS CE . 17416 1 3131 . 1 1 258 258 LYS N N 15 123.334 0.400 . 1 . . . . 258 LYS N . 17416 1 3132 . 1 1 259 259 LEU H H 1 8.255 0.020 . 1 . . . . 259 LEU H . 17416 1 3133 . 1 1 259 259 LEU HA H 1 3.985 0.020 . 1 . . . . 259 LEU HA . 17416 1 3134 . 1 1 259 259 LEU HB2 H 1 1.598 0.020 . 2 . . . . 259 LEU HB2 . 17416 1 3135 . 1 1 259 259 LEU HB3 H 1 2.357 0.020 . 2 . . . . 259 LEU HB3 . 17416 1 3136 . 1 1 259 259 LEU HG H 1 1.634 0.020 . 1 . . . . 259 LEU HG . 17416 1 3137 . 1 1 259 259 LEU HD11 H 1 0.977 0.020 . 2 . . . . 259 LEU HD1 . 17416 1 3138 . 1 1 259 259 LEU HD12 H 1 0.977 0.020 . 2 . . . . 259 LEU HD1 . 17416 1 3139 . 1 1 259 259 LEU HD13 H 1 0.977 0.020 . 2 . . . . 259 LEU HD1 . 17416 1 3140 . 1 1 259 259 LEU HD21 H 1 1.125 0.020 . 2 . . . . 259 LEU HD2 . 17416 1 3141 . 1 1 259 259 LEU HD22 H 1 1.125 0.020 . 2 . . . . 259 LEU HD2 . 17416 1 3142 . 1 1 259 259 LEU HD23 H 1 1.125 0.020 . 2 . . . . 259 LEU HD2 . 17416 1 3143 . 1 1 259 259 LEU C C 13 178.081 0.400 . 1 . . . . 259 LEU C . 17416 1 3144 . 1 1 259 259 LEU CA C 13 58.380 0.400 . 1 . . . . 259 LEU CA . 17416 1 3145 . 1 1 259 259 LEU CB C 13 40.017 0.400 . 1 . . . . 259 LEU CB . 17416 1 3146 . 1 1 259 259 LEU CG C 13 26.730 0.400 . 1 . . . . 259 LEU CG . 17416 1 3147 . 1 1 259 259 LEU CD1 C 13 23.586 0.400 . 1 . . . . 259 LEU CD1 . 17416 1 3148 . 1 1 259 259 LEU CD2 C 13 26.313 0.400 . 1 . . . . 259 LEU CD2 . 17416 1 3149 . 1 1 259 259 LEU N N 15 119.159 0.400 . 1 . . . . 259 LEU N . 17416 1 3150 . 1 1 260 260 VAL H H 1 7.991 0.020 . 1 . . . . 260 VAL H . 17416 1 3151 . 1 1 260 260 VAL HA H 1 3.264 0.020 . 1 . . . . 260 VAL HA . 17416 1 3152 . 1 1 260 260 VAL HB H 1 2.298 0.020 . 1 . . . . 260 VAL HB . 17416 1 3153 . 1 1 260 260 VAL HG11 H 1 0.674 0.020 . 2 . . . . 260 VAL HG1 . 17416 1 3154 . 1 1 260 260 VAL HG12 H 1 0.674 0.020 . 2 . . . . 260 VAL HG1 . 17416 1 3155 . 1 1 260 260 VAL HG13 H 1 0.674 0.020 . 2 . . . . 260 VAL HG1 . 17416 1 3156 . 1 1 260 260 VAL HG21 H 1 1.078 0.020 . 2 . . . . 260 VAL HG2 . 17416 1 3157 . 1 1 260 260 VAL HG22 H 1 1.078 0.020 . 2 . . . . 260 VAL HG2 . 17416 1 3158 . 1 1 260 260 VAL HG23 H 1 1.078 0.020 . 2 . . . . 260 VAL HG2 . 17416 1 3159 . 1 1 260 260 VAL C C 13 176.716 0.400 . 1 . . . . 260 VAL C . 17416 1 3160 . 1 1 260 260 VAL CA C 13 67.370 0.400 . 1 . . . . 260 VAL CA . 17416 1 3161 . 1 1 260 260 VAL CB C 13 31.332 0.400 . 1 . . . . 260 VAL CB . 17416 1 3162 . 1 1 260 260 VAL CG1 C 13 21.075 0.400 . 1 . . . . 260 VAL CG1 . 17416 1 3163 . 1 1 260 260 VAL CG2 C 13 23.593 0.400 . 1 . . . . 260 VAL CG2 . 17416 1 3164 . 1 1 260 260 VAL N N 15 119.841 0.400 . 1 . . . . 260 VAL N . 17416 1 3165 . 1 1 261 261 LYS H H 1 8.411 0.020 . 1 . . . . 261 LYS H . 17416 1 3166 . 1 1 261 261 LYS HA H 1 3.221 0.020 . 1 . . . . 261 LYS HA . 17416 1 3167 . 1 1 261 261 LYS HB2 H 1 1.665 0.020 . 2 . . . . 261 LYS HB2 . 17416 1 3168 . 1 1 261 261 LYS HB3 H 1 1.845 0.020 . 2 . . . . 261 LYS HB3 . 17416 1 3169 . 1 1 261 261 LYS HG2 H 1 1.453 0.020 . 2 . . . . 261 LYS HG2 . 17416 1 3170 . 1 1 261 261 LYS HG3 H 1 1.453 0.020 . 2 . . . . 261 LYS HG3 . 17416 1 3171 . 1 1 261 261 LYS HD2 H 1 1.369 0.020 . 2 . . . . 261 LYS HD2 . 17416 1 3172 . 1 1 261 261 LYS HD3 H 1 1.482 0.020 . 2 . . . . 261 LYS HD3 . 17416 1 3173 . 1 1 261 261 LYS HE2 H 1 2.762 0.020 . 2 . . . . 261 LYS HE2 . 17416 1 3174 . 1 1 261 261 LYS HE3 H 1 3.048 0.020 . 2 . . . . 261 LYS HE3 . 17416 1 3175 . 1 1 261 261 LYS C C 13 177.204 0.400 . 1 . . . . 261 LYS C . 17416 1 3176 . 1 1 261 261 LYS CA C 13 60.178 0.400 . 1 . . . . 261 LYS CA . 17416 1 3177 . 1 1 261 261 LYS CB C 13 32.249 0.400 . 1 . . . . 261 LYS CB . 17416 1 3178 . 1 1 261 261 LYS CD C 13 26.967 0.400 . 1 . . . . 261 LYS CD . 17416 1 3179 . 1 1 261 261 LYS CE C 13 41.899 0.400 . 1 . . . . 261 LYS CE . 17416 1 3180 . 1 1 261 261 LYS N N 15 117.401 0.400 . 1 . . . . 261 LYS N . 17416 1 3181 . 1 1 262 262 GLU H H 1 8.001 0.020 . 1 . . . . 262 GLU H . 17416 1 3182 . 1 1 262 262 GLU HA H 1 4.120 0.020 . 1 . . . . 262 GLU HA . 17416 1 3183 . 1 1 262 262 GLU HB2 H 1 2.109 0.020 . 2 . . . . 262 GLU HB2 . 17416 1 3184 . 1 1 262 262 GLU HB3 H 1 2.109 0.020 . 2 . . . . 262 GLU HB3 . 17416 1 3185 . 1 1 262 262 GLU HG2 H 1 2.239 0.020 . 2 . . . . 262 GLU HG2 . 17416 1 3186 . 1 1 262 262 GLU HG3 H 1 2.447 0.020 . 2 . . . . 262 GLU HG3 . 17416 1 3187 . 1 1 262 262 GLU C C 13 179.836 0.400 . 1 . . . . 262 GLU C . 17416 1 3188 . 1 1 262 262 GLU CA C 13 58.980 0.400 . 1 . . . . 262 GLU CA . 17416 1 3189 . 1 1 262 262 GLU CB C 13 29.400 0.400 . 1 . . . . 262 GLU CB . 17416 1 3190 . 1 1 262 262 GLU CG C 13 35.655 0.400 . 1 . . . . 262 GLU CG . 17416 1 3191 . 1 1 262 262 GLU N N 15 119.589 0.400 . 1 . . . . 262 GLU N . 17416 1 3192 . 1 1 263 263 LEU H H 1 8.755 0.020 . 1 . . . . 263 LEU H . 17416 1 3193 . 1 1 263 263 LEU HA H 1 4.089 0.020 . 1 . . . . 263 LEU HA . 17416 1 3194 . 1 1 263 263 LEU HB2 H 1 2.068 0.020 . 2 . . . . 263 LEU HB2 . 17416 1 3195 . 1 1 263 263 LEU HB3 H 1 1.539 0.020 . 2 . . . . 263 LEU HB3 . 17416 1 3196 . 1 1 263 263 LEU HG H 1 1.894 0.020 . 1 . . . . 263 LEU HG . 17416 1 3197 . 1 1 263 263 LEU HD11 H 1 0.938 0.020 . 2 . . . . 263 LEU HD1 . 17416 1 3198 . 1 1 263 263 LEU HD12 H 1 0.938 0.020 . 2 . . . . 263 LEU HD1 . 17416 1 3199 . 1 1 263 263 LEU HD13 H 1 0.938 0.020 . 2 . . . . 263 LEU HD1 . 17416 1 3200 . 1 1 263 263 LEU HD21 H 1 1.144 0.020 . 2 . . . . 263 LEU HD2 . 17416 1 3201 . 1 1 263 263 LEU HD22 H 1 1.144 0.020 . 2 . . . . 263 LEU HD2 . 17416 1 3202 . 1 1 263 263 LEU HD23 H 1 1.144 0.020 . 2 . . . . 263 LEU HD2 . 17416 1 3203 . 1 1 263 263 LEU C C 13 179.447 0.400 . 1 . . . . 263 LEU C . 17416 1 3204 . 1 1 263 263 LEU CA C 13 57.809 0.400 . 1 . . . . 263 LEU CA . 17416 1 3205 . 1 1 263 263 LEU CB C 13 41.888 0.400 . 1 . . . . 263 LEU CB . 17416 1 3206 . 1 1 263 263 LEU CG C 13 27.325 0.400 . 1 . . . . 263 LEU CG . 17416 1 3207 . 1 1 263 263 LEU CD1 C 13 26.001 0.400 . 1 . . . . 263 LEU CD1 . 17416 1 3208 . 1 1 263 263 LEU CD2 C 13 24.504 0.400 . 1 . . . . 263 LEU CD2 . 17416 1 3209 . 1 1 263 263 LEU N N 15 121.060 0.400 . 1 . . . . 263 LEU N . 17416 1 3210 . 1 1 264 264 ALA H H 1 8.380 0.020 . 1 . . . . 264 ALA H . 17416 1 3211 . 1 1 264 264 ALA HA H 1 4.149 0.020 . 1 . . . . 264 ALA HA . 17416 1 3212 . 1 1 264 264 ALA HB1 H 1 1.328 0.020 . 1 . . . . 264 ALA HB . 17416 1 3213 . 1 1 264 264 ALA HB2 H 1 1.328 0.020 . 1 . . . . 264 ALA HB . 17416 1 3214 . 1 1 264 264 ALA HB3 H 1 1.328 0.020 . 1 . . . . 264 ALA HB . 17416 1 3215 . 1 1 264 264 ALA C C 13 179.834 0.400 . 1 . . . . 264 ALA C . 17416 1 3216 . 1 1 264 264 ALA CA C 13 54.345 0.400 . 1 . . . . 264 ALA CA . 17416 1 3217 . 1 1 264 264 ALA CB C 13 18.263 0.400 . 1 . . . . 264 ALA CB . 17416 1 3218 . 1 1 264 264 ALA N N 15 120.100 0.400 . 1 . . . . 264 ALA N . 17416 1 3219 . 1 1 265 265 LYS H H 1 7.530 0.020 . 1 . . . . 265 LYS H . 17416 1 3220 . 1 1 265 265 LYS HA H 1 4.141 0.020 . 1 . . . . 265 LYS HA . 17416 1 3221 . 1 1 265 265 LYS HB2 H 1 1.984 0.020 . 2 . . . . 265 LYS HB2 . 17416 1 3222 . 1 1 265 265 LYS HB3 H 1 1.984 0.020 . 2 . . . . 265 LYS HB3 . 17416 1 3223 . 1 1 265 265 LYS HG2 H 1 1.510 0.020 . 2 . . . . 265 LYS HG2 . 17416 1 3224 . 1 1 265 265 LYS HG3 H 1 1.688 0.020 . 2 . . . . 265 LYS HG3 . 17416 1 3225 . 1 1 265 265 LYS HD2 H 1 1.753 0.020 . 2 . . . . 265 LYS HD2 . 17416 1 3226 . 1 1 265 265 LYS HD3 H 1 1.753 0.020 . 2 . . . . 265 LYS HD3 . 17416 1 3227 . 1 1 265 265 LYS HE2 H 1 2.960 0.020 . 2 . . . . 265 LYS HE2 . 17416 1 3228 . 1 1 265 265 LYS HE3 H 1 2.960 0.020 . 2 . . . . 265 LYS HE3 . 17416 1 3229 . 1 1 265 265 LYS C C 13 178.376 0.400 . 1 . . . . 265 LYS C . 17416 1 3230 . 1 1 265 265 LYS CA C 13 58.717 0.400 . 1 . . . . 265 LYS CA . 17416 1 3231 . 1 1 265 265 LYS CB C 13 32.788 0.400 . 1 . . . . 265 LYS CB . 17416 1 3232 . 1 1 265 265 LYS CG C 13 24.809 0.400 . 1 . . . . 265 LYS CG . 17416 1 3233 . 1 1 265 265 LYS CD C 13 29.368 0.400 . 1 . . . . 265 LYS CD . 17416 1 3234 . 1 1 265 265 LYS CE C 13 41.650 0.400 . 1 . . . . 265 LYS CE . 17416 1 3235 . 1 1 265 265 LYS N N 15 117.235 0.400 . 1 . . . . 265 LYS N . 17416 1 3236 . 1 1 266 266 LYS H H 1 7.797 0.020 . 1 . . . . 266 LYS H . 17416 1 3237 . 1 1 266 266 LYS HA H 1 4.277 0.020 . 1 . . . . 266 LYS HA . 17416 1 3238 . 1 1 266 266 LYS HB2 H 1 2.033 0.020 . 2 . . . . 266 LYS HB2 . 17416 1 3239 . 1 1 266 266 LYS HB3 H 1 2.087 0.020 . 2 . . . . 266 LYS HB3 . 17416 1 3240 . 1 1 266 266 LYS HG2 H 1 1.606 0.020 . 2 . . . . 266 LYS HG2 . 17416 1 3241 . 1 1 266 266 LYS HG3 H 1 1.606 0.020 . 2 . . . . 266 LYS HG3 . 17416 1 3242 . 1 1 266 266 LYS HD2 H 1 1.746 0.020 . 2 . . . . 266 LYS HD2 . 17416 1 3243 . 1 1 266 266 LYS HD3 H 1 1.746 0.020 . 2 . . . . 266 LYS HD3 . 17416 1 3244 . 1 1 266 266 LYS HE2 H 1 3.003 0.020 . 2 . . . . 266 LYS HE2 . 17416 1 3245 . 1 1 266 266 LYS HE3 H 1 3.003 0.020 . 2 . . . . 266 LYS HE3 . 17416 1 3246 . 1 1 266 266 LYS C C 13 178.080 0.400 . 1 . . . . 266 LYS C . 17416 1 3247 . 1 1 266 266 LYS CA C 13 56.824 0.400 . 1 . . . . 266 LYS CA . 17416 1 3248 . 1 1 266 266 LYS CB C 13 32.503 0.400 . 1 . . . . 266 LYS CB . 17416 1 3249 . 1 1 266 266 LYS CG C 13 24.809 0.400 . 1 . . . . 266 LYS CG . 17416 1 3250 . 1 1 266 266 LYS CD C 13 28.806 0.400 . 1 . . . . 266 LYS CD . 17416 1 3251 . 1 1 266 266 LYS CE C 13 41.622 0.400 . 1 . . . . 266 LYS CE . 17416 1 3252 . 1 1 266 266 LYS N N 15 117.966 0.400 . 1 . . . . 266 LYS N . 17416 1 3253 . 1 1 267 267 GLN H H 1 7.798 0.020 . 1 . . . . 267 GLN H . 17416 1 3254 . 1 1 267 267 GLN HA H 1 4.378 0.020 . 1 . . . . 267 GLN HA . 17416 1 3255 . 1 1 267 267 GLN HB2 H 1 2.137 0.020 . 2 . . . . 267 GLN HB2 . 17416 1 3256 . 1 1 267 267 GLN HB3 H 1 2.275 0.020 . 2 . . . . 267 GLN HB3 . 17416 1 3257 . 1 1 267 267 GLN HG2 H 1 2.412 0.020 . 2 . . . . 267 GLN HG2 . 17416 1 3258 . 1 1 267 267 GLN HG3 H 1 2.483 0.020 . 2 . . . . 267 GLN HG3 . 17416 1 3259 . 1 1 267 267 GLN HE21 H 1 6.935 0.020 . 2 . . . . 267 GLN HE21 . 17416 1 3260 . 1 1 267 267 GLN HE22 H 1 7.330 0.020 . 2 . . . . 267 GLN HE22 . 17416 1 3261 . 1 1 267 267 GLN C C 13 175.937 0.400 . 1 . . . . 267 GLN C . 17416 1 3262 . 1 1 267 267 GLN CA C 13 56.451 0.400 . 1 . . . . 267 GLN CA . 17416 1 3263 . 1 1 267 267 GLN CB C 13 29.170 0.400 . 1 . . . . 267 GLN CB . 17416 1 3264 . 1 1 267 267 GLN CG C 13 34.498 0.400 . 1 . . . . 267 GLN CG . 17416 1 3265 . 1 1 267 267 GLN N N 15 118.634 0.400 . 1 . . . . 267 GLN N . 17416 1 3266 . 1 1 267 267 GLN NE2 N 15 112.012 0.400 . 1 . . . . 267 GLN NE2 . 17416 1 3267 . 1 1 268 268 LYS H H 1 8.124 0.020 . 1 . . . . 268 LYS H . 17416 1 3268 . 1 1 268 268 LYS HA H 1 4.315 0.020 . 1 . . . . 268 LYS HA . 17416 1 3269 . 1 1 268 268 LYS HB2 H 1 1.840 0.020 . 2 . . . . 268 LYS HB2 . 17416 1 3270 . 1 1 268 268 LYS HB3 H 1 1.840 0.020 . 2 . . . . 268 LYS HB3 . 17416 1 3271 . 1 1 268 268 LYS HG2 H 1 1.498 0.020 . 2 . . . . 268 LYS HG2 . 17416 1 3272 . 1 1 268 268 LYS HG3 H 1 1.498 0.020 . 2 . . . . 268 LYS HG3 . 17416 1 3273 . 1 1 268 268 LYS HD2 H 1 1.680 0.020 . 2 . . . . 268 LYS HD2 . 17416 1 3274 . 1 1 268 268 LYS HD3 H 1 1.680 0.020 . 2 . . . . 268 LYS HD3 . 17416 1 3275 . 1 1 268 268 LYS HE2 H 1 2.960 0.020 . 2 . . . . 268 LYS HE2 . 17416 1 3276 . 1 1 268 268 LYS HE3 H 1 2.960 0.020 . 2 . . . . 268 LYS HE3 . 17416 1 3277 . 1 1 268 268 LYS C C 13 176.812 0.400 . 1 . . . . 268 LYS C . 17416 1 3278 . 1 1 268 268 LYS CA C 13 56.808 0.400 . 1 . . . . 268 LYS CA . 17416 1 3279 . 1 1 268 268 LYS CB C 13 32.500 0.400 . 1 . . . . 268 LYS CB . 17416 1 3280 . 1 1 268 268 LYS CG C 13 24.500 0.400 . 1 . . . . 268 LYS CG . 17416 1 3281 . 1 1 268 268 LYS CD C 13 29.370 0.400 . 1 . . . . 268 LYS CD . 17416 1 3282 . 1 1 268 268 LYS CE C 13 41.900 0.400 . 1 . . . . 268 LYS CE . 17416 1 3283 . 1 1 268 268 LYS N N 15 121.334 0.400 . 1 . . . . 268 LYS N . 17416 1 3284 . 1 1 269 269 LEU H H 1 8.183 0.020 . 1 . . . . 269 LEU H . 17416 1 3285 . 1 1 269 269 LEU HA H 1 4.476 0.020 . 1 . . . . 269 LEU HA . 17416 1 3286 . 1 1 269 269 LEU HB2 H 1 1.687 0.020 . 2 . . . . 269 LEU HB2 . 17416 1 3287 . 1 1 269 269 LEU HB3 H 1 1.734 0.020 . 2 . . . . 269 LEU HB3 . 17416 1 3288 . 1 1 269 269 LEU HG H 1 1.709 0.020 . 1 . . . . 269 LEU HG . 17416 1 3289 . 1 1 269 269 LEU HD11 H 1 0.994 0.020 . 2 . . . . 269 LEU HD1 . 17416 1 3290 . 1 1 269 269 LEU HD12 H 1 0.994 0.020 . 2 . . . . 269 LEU HD1 . 17416 1 3291 . 1 1 269 269 LEU HD13 H 1 0.994 0.020 . 2 . . . . 269 LEU HD1 . 17416 1 3292 . 1 1 269 269 LEU HD21 H 1 0.931 0.020 . 2 . . . . 269 LEU HD2 . 17416 1 3293 . 1 1 269 269 LEU HD22 H 1 0.931 0.020 . 2 . . . . 269 LEU HD2 . 17416 1 3294 . 1 1 269 269 LEU HD23 H 1 0.931 0.020 . 2 . . . . 269 LEU HD2 . 17416 1 3295 . 1 1 269 269 LEU C C 13 177.787 0.400 . 1 . . . . 269 LEU C . 17416 1 3296 . 1 1 269 269 LEU CA C 13 55.288 0.400 . 1 . . . . 269 LEU CA . 17416 1 3297 . 1 1 269 269 LEU CB C 13 42.477 0.400 . 1 . . . . 269 LEU CB . 17416 1 3298 . 1 1 269 269 LEU CG C 13 27.089 0.400 . 1 . . . . 269 LEU CG . 17416 1 3299 . 1 1 269 269 LEU CD1 C 13 24.809 0.400 . 1 . . . . 269 LEU CD1 . 17416 1 3300 . 1 1 269 269 LEU CD2 C 13 23.384 0.400 . 1 . . . . 269 LEU CD2 . 17416 1 3301 . 1 1 269 269 LEU N N 15 122.216 0.400 . 1 . . . . 269 LEU N . 17416 1 3302 . 1 1 270 270 THR H H 1 8.048 0.020 . 1 . . . . 270 THR H . 17416 1 3303 . 1 1 270 270 THR HA H 1 4.382 0.020 . 1 . . . . 270 THR HA . 17416 1 3304 . 1 1 270 270 THR HB H 1 4.272 0.020 . 1 . . . . 270 THR HB . 17416 1 3305 . 1 1 270 270 THR HG21 H 1 1.231 0.020 . 1 . . . . 270 THR HG2 . 17416 1 3306 . 1 1 270 270 THR HG22 H 1 1.231 0.020 . 1 . . . . 270 THR HG2 . 17416 1 3307 . 1 1 270 270 THR HG23 H 1 1.231 0.020 . 1 . . . . 270 THR HG2 . 17416 1 3308 . 1 1 270 270 THR C C 13 172.918 0.400 . 1 . . . . 270 THR C . 17416 1 3309 . 1 1 270 270 THR CA C 13 61.506 0.400 . 1 . . . . 270 THR CA . 17416 1 3310 . 1 1 270 270 THR CB C 13 69.634 0.400 . 1 . . . . 270 THR CB . 17416 1 3311 . 1 1 270 270 THR CG2 C 13 21.374 0.400 . 1 . . . . 270 THR CG2 . 17416 1 3312 . 1 1 270 270 THR N N 15 114.411 0.400 . 1 . . . . 270 THR N . 17416 1 3313 . 1 1 271 271 ARG H H 1 8.122 0.020 . 1 . . . . 271 ARG H . 17416 1 3314 . 1 1 271 271 ARG HA H 1 4.394 0.020 . 1 . . . . 271 ARG HA . 17416 1 3315 . 1 1 271 271 ARG C C 13 175.889 0.400 . 1 . . . . 271 ARG C . 17416 1 3316 . 1 1 271 271 ARG CA C 13 55.670 0.400 . 1 . . . . 271 ARG CA . 17416 1 3317 . 1 1 271 271 ARG N N 15 122.410 0.400 . 1 . . . . 271 ARG N . 17416 1 3318 . 1 1 272 272 ASP H H 1 8.240 0.020 . 1 . . . . 272 ASP H . 17416 1 3319 . 1 1 272 272 ASP HA H 1 4.593 0.020 . 1 . . . . 272 ASP HA . 17416 1 3320 . 1 1 272 272 ASP C C 13 175.544 0.400 . 1 . . . . 272 ASP C . 17416 1 3321 . 1 1 272 272 ASP CA C 13 54.481 0.400 . 1 . . . . 272 ASP CA . 17416 1 3322 . 1 1 272 272 ASP N N 15 121.443 0.400 . 1 . . . . 272 ASP N . 17416 1 3323 . 1 1 273 273 LEU H H 1 7.939 0.020 . 1 . . . . 273 LEU H . 17416 1 3324 . 1 1 273 273 LEU HA H 1 4.658 0.020 . 1 . . . . 273 LEU HA . 17416 1 3325 . 1 1 273 273 LEU HB2 H 1 1.632 0.020 . 2 . . . . 273 LEU HB2 . 17416 1 3326 . 1 1 273 273 LEU HB3 H 1 1.632 0.020 . 2 . . . . 273 LEU HB3 . 17416 1 3327 . 1 1 273 273 LEU HG H 1 1.717 0.020 . 1 . . . . 273 LEU HG . 17416 1 3328 . 1 1 273 273 LEU HD11 H 1 0.963 0.020 . 2 . . . . 273 LEU HD1 . 17416 1 3329 . 1 1 273 273 LEU HD12 H 1 0.963 0.020 . 2 . . . . 273 LEU HD1 . 17416 1 3330 . 1 1 273 273 LEU HD13 H 1 0.963 0.020 . 2 . . . . 273 LEU HD1 . 17416 1 3331 . 1 1 273 273 LEU HD21 H 1 0.962 0.020 . 2 . . . . 273 LEU HD2 . 17416 1 3332 . 1 1 273 273 LEU HD22 H 1 0.962 0.020 . 2 . . . . 273 LEU HD2 . 17416 1 3333 . 1 1 273 273 LEU HD23 H 1 0.962 0.020 . 2 . . . . 273 LEU HD2 . 17416 1 3334 . 1 1 273 273 LEU CA C 13 53.014 0.400 . 1 . . . . 273 LEU CA . 17416 1 3335 . 1 1 273 273 LEU CB C 13 41.622 0.400 . 1 . . . . 273 LEU CB . 17416 1 3336 . 1 1 273 273 LEU CG C 13 27.089 0.400 . 1 . . . . 273 LEU CG . 17416 1 3337 . 1 1 273 273 LEU CD1 C 13 23.099 0.400 . 1 . . . . 273 LEU CD1 . 17416 1 3338 . 1 1 273 273 LEU CD2 C 13 25.094 0.400 . 1 . . . . 273 LEU CD2 . 17416 1 3339 . 1 1 273 273 LEU N N 15 123.471 0.400 . 1 . . . . 273 LEU N . 17416 1 3340 . 1 1 274 274 PRO HA H 1 4.247 0.020 . 1 . . . . 274 PRO HA . 17416 1 3341 . 1 1 274 274 PRO HB2 H 1 1.906 0.020 . 2 . . . . 274 PRO HB2 . 17416 1 3342 . 1 1 274 274 PRO HB3 H 1 2.226 0.020 . 2 . . . . 274 PRO HB3 . 17416 1 3343 . 1 1 274 274 PRO HG2 H 1 2.000 0.020 . 2 . . . . 274 PRO HG2 . 17416 1 3344 . 1 1 274 274 PRO HG3 H 1 2.000 0.020 . 2 . . . . 274 PRO HG3 . 17416 1 3345 . 1 1 274 274 PRO HD2 H 1 3.643 0.020 . 2 . . . . 274 PRO HD2 . 17416 1 3346 . 1 1 274 274 PRO HD3 H 1 3.779 0.020 . 2 . . . . 274 PRO HD3 . 17416 1 3347 . 1 1 274 274 PRO CA C 13 64.704 0.400 . 1 . . . . 274 PRO CA . 17416 1 3348 . 1 1 274 274 PRO CB C 13 31.933 0.400 . 1 . . . . 274 PRO CB . 17416 1 3349 . 1 1 274 274 PRO CG C 13 27.089 0.400 . 1 . . . . 274 PRO CG . 17416 1 3350 . 1 1 274 274 PRO CD C 13 50.171 0.400 . 1 . . . . 274 PRO CD . 17416 1 3351 . 2 2 1 1 C90 HA11 H 1 3.509 0.002 . 1 . . . . 1 C90 HA11 . 17416 1 3352 . 2 2 1 1 C90 HA12 H 1 3.509 0.002 . 1 . . . . 1 C90 HA12 . 17416 1 3353 . 2 2 1 1 C90 HA21 H 1 3.509 0.002 . 1 . . . . 1 C90 HA21 . 17416 1 3354 . 2 2 1 1 C90 HA22 H 1 3.509 0.002 . 1 . . . . 1 C90 HA22 . 17416 1 3355 . 2 2 1 1 C90 CA1 C 13 68.760 0.400 . 1 . . . . 1 C90 CD . 17416 1 3356 . 2 2 1 1 C90 CA2 C 13 68.760 0.400 . 1 . . . . 1 C90 CD . 17416 1 3357 . 2 2 1 1 C90 HB11 H 1 2.330 0.002 . 1 . . . . 1 C90 HB11 . 17416 1 3358 . 2 2 1 1 C90 HB12 H 1 2.330 0.002 . 1 . . . . 1 C90 HB12 . 17416 1 3359 . 2 2 1 1 C90 HB21 H 1 2.330 0.002 . 1 . . . . 1 C90 HB21 . 17416 1 3360 . 2 2 1 1 C90 HB22 H 1 2.330 0.002 . 1 . . . . 1 C90 HB22 . 17416 1 3361 . 2 2 1 1 C90 CB1 C 13 55.180 0.400 . 1 . . . . 1 C90 CB1 . 17416 1 3362 . 2 2 1 1 C90 CB2 C 13 55.180 0.400 . 1 . . . . 1 C90 CB2 . 17416 1 3363 . 2 2 1 1 C90 H51 H 1 3.771 0.002 . 1 . . . . 1 C90 H51 . 17416 1 3364 . 2 2 1 1 C90 H52 H 1 3.285 0.002 . 1 . . . . 1 C90 H52 . 17416 1 3365 . 2 2 1 1 C90 HC1 H 1 6.952 0.003 . 1 . . . . 1 C90 HC1 . 17416 1 3366 . 2 2 1 1 C90 HC2 H 1 6.952 0.003 . 1 . . . . 1 C90 HC2 . 17416 1 3367 . 2 2 1 1 C90 HD1 H 1 7.202 0.000 . 1 . . . . 1 C90 HD1 . 17416 1 3368 . 2 2 1 1 C90 HD2 H 1 7.202 0.000 . 1 . . . . 1 C90 HD2 . 17416 1 3369 . 2 2 1 1 C90 HE1 H 1 7.430 0.002 . 1 . . . . 1 C90 HE1 . 17416 1 3370 . 2 2 1 1 C90 HE2 H 1 7.430 0.002 . 1 . . . . 1 C90 HE2 . 17416 1 3371 . 2 2 1 1 C90 HF1 H 1 8.055 0.003 . 1 . . . . 1 C90 HF1 . 17416 1 3372 . 2 2 1 1 C90 HF H 1 8.055 0.003 . 1 . . . . 1 C90 HF . 17416 1 3373 . 2 2 1 1 C90 H17 H 1 7.833 0.000 . 1 . . . . 1 C90 H17 . 17416 1 3374 . 2 2 1 1 C90 N17 N 15 111.655 0.400 . 1 . . . . 1 C90 C21 . 17416 1 3375 . 2 2 1 1 C90 H18 H 1 5.225 0.003 . 1 . . . . 1 C90 H18 . 17416 1 3376 . 2 2 1 1 C90 C18 C 13 58.630 0.400 . 1 . . . . 1 C90 C18 . 17416 1 3377 . 2 2 1 1 C90 H19 H 1 4.101 0.002 . 1 . . . . 1 C90 H19 . 17416 1 3378 . 2 2 1 1 C90 C19 C 13 69.970 0.400 . 1 . . . . 1 C90 C19 . 17416 1 3379 . 2 2 1 1 C90 H211 H 1 0.995 0.001 . 1 . . . . 1 C90 H211 . 17416 1 3380 . 2 2 1 1 C90 H212 H 1 0.995 0.001 . 1 . . . . 1 C90 H212 . 17416 1 3381 . 2 2 1 1 C90 H213 H 1 0.995 0.001 . 1 . . . . 1 C90 H213 . 17416 1 3382 . 2 2 1 1 C90 C21 C 13 20.580 0.400 . 1 . . . . 1 C90 C21 . 17416 1 stop_ save_