data_18000 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18000 _Entry.Title ; Structural Basis for Molecular Interactions Involving MRG Domains: Implications in Chromatin Biology ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-10-16 _Entry.Accession_date 2011-10-16 _Entry.Last_release_date 2012-01-17 _Entry.Original_release_date 2012-01-17 _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 Tao Xie . . Sr. 18000 2 Ishwar Radhakrishnan . . . 18000 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 18000 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'protein-protein complex' . 18000 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18000 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 870 18000 '15N chemical shifts' 204 18000 '1H chemical shifts' 1387 18000 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 . . 2012-01-17 2011-10-16 original author . 18000 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LKM 'BMRB Entry Tracking System' 18000 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18000 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22244764 _Citation.Full_citation . _Citation.Title 'Structural Basis for Molecular Interactions Involving MRG Domains: Implications in Chromatin Biology.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full 'Structure (London, England : 1993)' _Citation.Journal_volume 20 _Citation.Journal_issue 1 _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 151 _Citation.Page_last 160 _Citation.Year 2012 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Tao Xie . . . 18000 1 2 Richard Graveline . . . 18000 1 3 'Ganesan Senthil' Kumar . . . 18000 1 4 Yongbo Zhang . . . 18000 1 5 Arvind Krishnan . . . 18000 1 6 Gregory David . . . 18000 1 7 Ishwar Radhakrishnan . . . 18000 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18000 _Assembly.ID 1 _Assembly.Name MRG _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Pf1 1 $Pf1 A . yes native no no . . . 18000 1 2 MRG15 2 $MRG15 B . yes native no no . . . 18000 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Pf1 _Entity.Sf_category entity _Entity.Sf_framecode Pf1 _Entity.Entry_ID 18000 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Pf1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; DYVQPQLRRPFELLIAAAME RNPTQFQLPNELTCTTALPG SS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'This is the MRG binding domain of PHD factor 1 (Pf1) protein' _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 42 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 4721.391 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 17485 . entity_1 . . . . . 100.00 45 100.00 100.00 6.77e-21 . . . . 18000 1 2 no PDB 2L9S . "Solution Structure Of Pf1 Sid1-Msin3a Pah2 Complex" . . . . . 100.00 45 100.00 100.00 6.77e-21 . . . . 18000 1 3 no PDB 2LKM . "Structural Basis For Molecular Interactions Involving Mrg Domains: Implications In Chromatin Biology" . . . . . 100.00 42 100.00 100.00 8.22e-21 . . . . 18000 1 4 no DBJ BAD18713 . "FLJ00295 protein [Homo sapiens]" . . . . . 100.00 770 100.00 100.00 1.21e-18 . . . . 18000 1 5 no DBJ BAE00370 . "unnamed protein product [Macaca fascicularis]" . . . . . 57.14 529 100.00 100.00 5.99e-06 . . . . 18000 1 6 no DBJ BAE24837 . "unnamed protein product [Mus musculus]" . . . . . 100.00 704 100.00 100.00 1.22e-18 . . . . 18000 1 7 no DBJ BAE33212 . "unnamed protein product [Mus musculus]" . . . . . 100.00 1003 100.00 100.00 1.55e-18 . . . . 18000 1 8 no DBJ BAE41602 . "unnamed protein product [Mus musculus]" . . . . . 100.00 827 100.00 100.00 1.40e-18 . . . . 18000 1 9 no GB AAH01657 . "PHF12 protein, partial [Homo sapiens]" . . . . . 100.00 487 100.00 100.00 4.51e-19 . . . . 18000 1 10 no GB AAH43080 . "PHD finger protein 12 [Mus musculus]" . . . . . 100.00 999 100.00 100.00 1.57e-18 . . . . 18000 1 11 no GB AAI10883 . "PHF12 protein [Homo sapiens]" . . . . . 100.00 849 100.00 100.00 1.41e-18 . . . . 18000 1 12 no GB AAI21044 . "PHD finger protein 12 [Homo sapiens]" . . . . . 100.00 704 100.00 100.00 1.12e-18 . . . . 18000 1 13 no GB AAI21045 . "PHD finger protein 12 [Homo sapiens]" . . . . . 100.00 704 100.00 100.00 1.12e-18 . . . . 18000 1 14 no REF NP_001013135 . "PHD finger protein 12 [Rattus norvegicus]" . . . . . 100.00 1004 100.00 100.00 1.47e-18 . . . . 18000 1 15 no REF NP_001028733 . "PHD finger protein 12 isoform 1 [Homo sapiens]" . . . . . 100.00 1004 100.00 100.00 1.50e-18 . . . . 18000 1 16 no REF NP_001179060 . "PHD finger protein 12 [Bos taurus]" . . . . . 100.00 1004 100.00 100.00 1.62e-18 . . . . 18000 1 17 no REF NP_001253214 . "PHD finger protein 12 [Macaca mulatta]" . . . . . 100.00 1004 100.00 100.00 1.66e-18 . . . . 18000 1 18 no REF NP_001277060 . "PHD finger protein 12 isoform 3 [Homo sapiens]" . . . . . 100.00 849 100.00 100.00 1.41e-18 . . . . 18000 1 19 no SP Q5SPL2 . "RecName: Full=PHD finger protein 12; AltName: Full=PHD factor 1; Short=Pf1" . . . . . 100.00 1003 100.00 100.00 1.55e-18 . . . . 18000 1 20 no SP Q96QT6 . "RecName: Full=PHD finger protein 12; AltName: Full=PHD factor 1; Short=Pf1" . . . . . 100.00 1004 100.00 100.00 1.50e-18 . . . . 18000 1 21 no TPG DAA18992 . "TPA: PHD finger protein 12 [Bos taurus]" . . . . . 100.00 1004 100.00 100.00 1.62e-18 . . . . 18000 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 1 200 ASP . 18000 1 2 201 TYR . 18000 1 3 202 VAL . 18000 1 4 203 GLN . 18000 1 5 204 PRO . 18000 1 6 205 GLN . 18000 1 7 206 LEU . 18000 1 8 207 ARG . 18000 1 9 208 ARG . 18000 1 10 209 PRO . 18000 1 11 210 PHE . 18000 1 12 211 GLU . 18000 1 13 212 LEU . 18000 1 14 213 LEU . 18000 1 15 214 ILE . 18000 1 16 215 ALA . 18000 1 17 216 ALA . 18000 1 18 217 ALA . 18000 1 19 218 MET . 18000 1 20 219 GLU . 18000 1 21 220 ARG . 18000 1 22 221 ASN . 18000 1 23 222 PRO . 18000 1 24 223 THR . 18000 1 25 224 GLN . 18000 1 26 225 PHE . 18000 1 27 226 GLN . 18000 1 28 227 LEU . 18000 1 29 228 PRO . 18000 1 30 229 ASN . 18000 1 31 230 GLU . 18000 1 32 231 LEU . 18000 1 33 232 THR . 18000 1 34 233 CYS . 18000 1 35 234 THR . 18000 1 36 235 THR . 18000 1 37 236 ALA . 18000 1 38 237 LEU . 18000 1 39 238 PRO . 18000 1 40 239 GLY . 18000 1 41 240 SER . 18000 1 42 241 SER . 18000 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 . ASP 1 1 18000 1 . TYR 2 2 18000 1 . VAL 3 3 18000 1 . GLN 4 4 18000 1 . PRO 5 5 18000 1 . GLN 6 6 18000 1 . LEU 7 7 18000 1 . ARG 8 8 18000 1 . ARG 9 9 18000 1 . PRO 10 10 18000 1 . PHE 11 11 18000 1 . GLU 12 12 18000 1 . LEU 13 13 18000 1 . LEU 14 14 18000 1 . ILE 15 15 18000 1 . ALA 16 16 18000 1 . ALA 17 17 18000 1 . ALA 18 18 18000 1 . MET 19 19 18000 1 . GLU 20 20 18000 1 . ARG 21 21 18000 1 . ASN 22 22 18000 1 . PRO 23 23 18000 1 . THR 24 24 18000 1 . GLN 25 25 18000 1 . PHE 26 26 18000 1 . GLN 27 27 18000 1 . LEU 28 28 18000 1 . PRO 29 29 18000 1 . ASN 30 30 18000 1 . GLU 31 31 18000 1 . LEU 32 32 18000 1 . THR 33 33 18000 1 . CYS 34 34 18000 1 . THR 35 35 18000 1 . THR 36 36 18000 1 . ALA 37 37 18000 1 . LEU 38 38 18000 1 . PRO 39 39 18000 1 . GLY 40 40 18000 1 . SER 41 41 18000 1 . SER 42 42 18000 1 stop_ save_ save_MRG15 _Entity.Sf_category entity _Entity.Sf_framecode MRG15 _Entity.Entry_ID 18000 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name MRG15 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SNAEVKVKIPEELKPWLVDD WDLITRQKQLFYLPAKKNVD SILEDYANYRKSRGNTDNKE YAVNEVVAGIKEYFNVMLGT QLLYKFERPQYAEILADHPD APMSQVYGAPHLLRLFVRIG AMLAYTPLDEKSLALLLNYL HDFLKYLAKNSATLFSASDY EVAPPEYHRKAV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 1-3 is from a non-native affinity tag. This is the MRG domain of MRG15' _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 172 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation K201R _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 19870.898 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-30 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2AQL . "Crystal Structure Of The Mrg15 Mrg Domain" . . . . . 100.00 173 97.67 98.84 2.60e-118 . . . . 18000 2 2 no PDB 2F5J . "Crystal Structure Of Mrg Domain From Human Mrg15" . . . . . 100.00 181 97.67 98.84 3.91e-118 . . . . 18000 2 3 no PDB 2LKM . "Structural Basis For Molecular Interactions Involving Mrg Domains: Implications In Chromatin Biology" . . . . . 100.00 172 100.00 100.00 5.64e-121 . . . . 18000 2 4 no DBJ BAB30219 . "unnamed protein product [Mus musculus]" . . . . . 100.00 323 97.67 98.84 7.53e-117 . . . . 18000 2 5 no DBJ BAB58904 . "MRG15 [Mus musculus]" . . . . . 100.00 323 97.67 98.84 7.53e-117 . . . . 18000 2 6 no DBJ BAC37546 . "unnamed protein product [Mus musculus]" . . . . . 100.00 221 97.67 98.84 2.95e-118 . . . . 18000 2 7 no DBJ BAD90270 . "mKIAA4002 protein [Mus musculus]" . . . . . 100.00 218 97.67 98.84 1.60e-117 . . . . 18000 2 8 no DBJ BAE00783 . "unnamed protein product [Macaca fascicularis]" . . . . . 100.00 323 97.09 98.26 3.11e-116 . . . . 18000 2 9 no EMBL CAB70879 . "hypothetical protein [Homo sapiens]" . . . . . 100.58 324 97.11 98.27 3.64e-115 . . . . 18000 2 10 no EMBL CAI29614 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 323 97.67 98.84 7.78e-117 . . . . 18000 2 11 no GB AAD20058 . "Unknown [Homo sapiens]" . . . . . 98.26 243 99.41 100.00 1.41e-118 . . . . 18000 2 12 no GB AAD20970 . "HSPC008 [Homo sapiens]" . . . . . 100.00 323 97.67 98.84 7.53e-117 . . . . 18000 2 13 no GB AAD29872 . "MRG15 protein [Homo sapiens]" . . . . . 100.00 323 97.67 98.84 7.53e-117 . . . . 18000 2 14 no GB AAF29033 . "HSPC061 [Homo sapiens]" . . . . . 100.00 323 97.67 98.84 7.53e-117 . . . . 18000 2 15 no GB AAF80854 . "MSL3-1 protein [Homo sapiens]" . . . . . 100.00 323 97.67 98.84 7.53e-117 . . . . 18000 2 16 no REF NP_001011999 . "mortality factor 4-like protein 1 [Rattus norvegicus]" . . . . . 100.00 323 97.67 98.84 7.21e-117 . . . . 18000 2 17 no REF NP_001030525 . "mortality factor 4-like protein 1 [Bos taurus]" . . . . . 100.00 296 98.26 98.84 1.46e-117 . . . . 18000 2 18 no REF NP_001034236 . "mortality factor 4-like protein 1 isoform a [Mus musculus]" . . . . . 100.00 362 97.67 98.84 1.60e-116 . . . . 18000 2 19 no REF NP_001127679 . "mortality factor 4-like protein 1 [Pongo abelii]" . . . . . 100.00 323 97.67 98.84 7.78e-117 . . . . 18000 2 20 no REF NP_001240678 . "mortality factor 4-like protein 1 [Oryctolagus cuniculus]" . . . . . 100.00 323 97.67 98.84 7.53e-117 . . . . 18000 2 21 no SP P60762 . "RecName: Full=Mortality factor 4-like protein 1; AltName: Full=MORF-related gene 15 protein; AltName: Full=Testis-expressed gen" . . . . . 100.00 362 97.67 98.84 1.60e-116 . . . . 18000 2 22 no SP Q5NVP9 . "RecName: Full=Mortality factor 4-like protein 1 [Pongo abelii]" . . . . . 100.00 323 97.67 98.84 7.78e-117 . . . . 18000 2 23 no SP Q6AYU1 . "RecName: Full=Mortality factor 4-like protein 1; AltName: Full=MORF-related gene 15 protein; AltName: Full=Transcription factor" . . . . . 100.00 323 97.67 98.84 7.21e-117 . . . . 18000 2 24 no SP Q9UBU8 . "RecName: Full=Mortality factor 4-like protein 1; AltName: Full=MORF-related gene 15 protein; AltName: Full=Protein MSL3-1; AltN" . . . . . 100.00 362 97.67 98.84 1.66e-116 . . . . 18000 2 25 no TPG DAA17605 . "TPA: MORF-related gene 15 [Bos taurus]" . . . . . 100.00 296 98.26 98.84 2.13e-117 . . . . 18000 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 152 SER . 18000 2 2 153 ASN . 18000 2 3 154 ALA . 18000 2 4 155 GLU . 18000 2 5 156 VAL . 18000 2 6 157 LYS . 18000 2 7 158 VAL . 18000 2 8 159 LYS . 18000 2 9 160 ILE . 18000 2 10 161 PRO . 18000 2 11 162 GLU . 18000 2 12 163 GLU . 18000 2 13 164 LEU . 18000 2 14 165 LYS . 18000 2 15 166 PRO . 18000 2 16 167 TRP . 18000 2 17 168 LEU . 18000 2 18 169 VAL . 18000 2 19 170 ASP . 18000 2 20 171 ASP . 18000 2 21 172 TRP . 18000 2 22 173 ASP . 18000 2 23 174 LEU . 18000 2 24 175 ILE . 18000 2 25 176 THR . 18000 2 26 177 ARG . 18000 2 27 178 GLN . 18000 2 28 179 LYS . 18000 2 29 180 GLN . 18000 2 30 181 LEU . 18000 2 31 182 PHE . 18000 2 32 183 TYR . 18000 2 33 184 LEU . 18000 2 34 185 PRO . 18000 2 35 186 ALA . 18000 2 36 187 LYS . 18000 2 37 188 LYS . 18000 2 38 189 ASN . 18000 2 39 190 VAL . 18000 2 40 191 ASP . 18000 2 41 192 SER . 18000 2 42 193 ILE . 18000 2 43 194 LEU . 18000 2 44 195 GLU . 18000 2 45 196 ASP . 18000 2 46 197 TYR . 18000 2 47 198 ALA . 18000 2 48 199 ASN . 18000 2 49 200 TYR . 18000 2 50 201 ARG . 18000 2 51 202 LYS . 18000 2 52 203 SER . 18000 2 53 204 ARG . 18000 2 54 205 GLY . 18000 2 55 206 ASN . 18000 2 56 207 THR . 18000 2 57 208 ASP . 18000 2 58 209 ASN . 18000 2 59 210 LYS . 18000 2 60 211 GLU . 18000 2 61 212 TYR . 18000 2 62 213 ALA . 18000 2 63 214 VAL . 18000 2 64 215 ASN . 18000 2 65 216 GLU . 18000 2 66 217 VAL . 18000 2 67 218 VAL . 18000 2 68 219 ALA . 18000 2 69 220 GLY . 18000 2 70 221 ILE . 18000 2 71 222 LYS . 18000 2 72 223 GLU . 18000 2 73 224 TYR . 18000 2 74 225 PHE . 18000 2 75 226 ASN . 18000 2 76 227 VAL . 18000 2 77 228 MET . 18000 2 78 229 LEU . 18000 2 79 230 GLY . 18000 2 80 231 THR . 18000 2 81 232 GLN . 18000 2 82 233 LEU . 18000 2 83 234 LEU . 18000 2 84 235 TYR . 18000 2 85 236 LYS . 18000 2 86 237 PHE . 18000 2 87 238 GLU . 18000 2 88 239 ARG . 18000 2 89 240 PRO . 18000 2 90 241 GLN . 18000 2 91 242 TYR . 18000 2 92 243 ALA . 18000 2 93 244 GLU . 18000 2 94 245 ILE . 18000 2 95 246 LEU . 18000 2 96 247 ALA . 18000 2 97 248 ASP . 18000 2 98 249 HIS . 18000 2 99 250 PRO . 18000 2 100 251 ASP . 18000 2 101 252 ALA . 18000 2 102 253 PRO . 18000 2 103 254 MET . 18000 2 104 255 SER . 18000 2 105 256 GLN . 18000 2 106 257 VAL . 18000 2 107 258 TYR . 18000 2 108 259 GLY . 18000 2 109 260 ALA . 18000 2 110 261 PRO . 18000 2 111 262 HIS . 18000 2 112 263 LEU . 18000 2 113 264 LEU . 18000 2 114 265 ARG . 18000 2 115 266 LEU . 18000 2 116 267 PHE . 18000 2 117 268 VAL . 18000 2 118 269 ARG . 18000 2 119 270 ILE . 18000 2 120 271 GLY . 18000 2 121 272 ALA . 18000 2 122 273 MET . 18000 2 123 274 LEU . 18000 2 124 275 ALA . 18000 2 125 276 TYR . 18000 2 126 277 THR . 18000 2 127 278 PRO . 18000 2 128 279 LEU . 18000 2 129 280 ASP . 18000 2 130 281 GLU . 18000 2 131 282 LYS . 18000 2 132 283 SER . 18000 2 133 284 LEU . 18000 2 134 285 ALA . 18000 2 135 286 LEU . 18000 2 136 287 LEU . 18000 2 137 288 LEU . 18000 2 138 289 ASN . 18000 2 139 290 TYR . 18000 2 140 291 LEU . 18000 2 141 292 HIS . 18000 2 142 293 ASP . 18000 2 143 294 PHE . 18000 2 144 295 LEU . 18000 2 145 296 LYS . 18000 2 146 297 TYR . 18000 2 147 298 LEU . 18000 2 148 299 ALA . 18000 2 149 300 LYS . 18000 2 150 301 ASN . 18000 2 151 302 SER . 18000 2 152 303 ALA . 18000 2 153 304 THR . 18000 2 154 305 LEU . 18000 2 155 306 PHE . 18000 2 156 307 SER . 18000 2 157 308 ALA . 18000 2 158 309 SER . 18000 2 159 310 ASP . 18000 2 160 311 TYR . 18000 2 161 312 GLU . 18000 2 162 313 VAL . 18000 2 163 314 ALA . 18000 2 164 315 PRO . 18000 2 165 316 PRO . 18000 2 166 317 GLU . 18000 2 167 318 TYR . 18000 2 168 319 HIS . 18000 2 169 320 ARG . 18000 2 170 321 LYS . 18000 2 171 322 ALA . 18000 2 172 323 VAL . 18000 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . SER 1 1 18000 2 . ASN 2 2 18000 2 . ALA 3 3 18000 2 . GLU 4 4 18000 2 . VAL 5 5 18000 2 . LYS 6 6 18000 2 . VAL 7 7 18000 2 . LYS 8 8 18000 2 . ILE 9 9 18000 2 . PRO 10 10 18000 2 . GLU 11 11 18000 2 . GLU 12 12 18000 2 . LEU 13 13 18000 2 . LYS 14 14 18000 2 . PRO 15 15 18000 2 . TRP 16 16 18000 2 . LEU 17 17 18000 2 . VAL 18 18 18000 2 . ASP 19 19 18000 2 . ASP 20 20 18000 2 . TRP 21 21 18000 2 . ASP 22 22 18000 2 . LEU 23 23 18000 2 . ILE 24 24 18000 2 . THR 25 25 18000 2 . ARG 26 26 18000 2 . GLN 27 27 18000 2 . LYS 28 28 18000 2 . GLN 29 29 18000 2 . LEU 30 30 18000 2 . PHE 31 31 18000 2 . TYR 32 32 18000 2 . LEU 33 33 18000 2 . PRO 34 34 18000 2 . ALA 35 35 18000 2 . LYS 36 36 18000 2 . LYS 37 37 18000 2 . ASN 38 38 18000 2 . VAL 39 39 18000 2 . ASP 40 40 18000 2 . SER 41 41 18000 2 . ILE 42 42 18000 2 . LEU 43 43 18000 2 . GLU 44 44 18000 2 . ASP 45 45 18000 2 . TYR 46 46 18000 2 . ALA 47 47 18000 2 . ASN 48 48 18000 2 . TYR 49 49 18000 2 . ARG 50 50 18000 2 . LYS 51 51 18000 2 . SER 52 52 18000 2 . ARG 53 53 18000 2 . GLY 54 54 18000 2 . ASN 55 55 18000 2 . THR 56 56 18000 2 . ASP 57 57 18000 2 . ASN 58 58 18000 2 . LYS 59 59 18000 2 . GLU 60 60 18000 2 . TYR 61 61 18000 2 . ALA 62 62 18000 2 . VAL 63 63 18000 2 . ASN 64 64 18000 2 . GLU 65 65 18000 2 . VAL 66 66 18000 2 . VAL 67 67 18000 2 . ALA 68 68 18000 2 . GLY 69 69 18000 2 . ILE 70 70 18000 2 . LYS 71 71 18000 2 . GLU 72 72 18000 2 . TYR 73 73 18000 2 . PHE 74 74 18000 2 . ASN 75 75 18000 2 . VAL 76 76 18000 2 . MET 77 77 18000 2 . LEU 78 78 18000 2 . GLY 79 79 18000 2 . THR 80 80 18000 2 . GLN 81 81 18000 2 . LEU 82 82 18000 2 . LEU 83 83 18000 2 . TYR 84 84 18000 2 . LYS 85 85 18000 2 . PHE 86 86 18000 2 . GLU 87 87 18000 2 . ARG 88 88 18000 2 . PRO 89 89 18000 2 . GLN 90 90 18000 2 . TYR 91 91 18000 2 . ALA 92 92 18000 2 . GLU 93 93 18000 2 . ILE 94 94 18000 2 . LEU 95 95 18000 2 . ALA 96 96 18000 2 . ASP 97 97 18000 2 . HIS 98 98 18000 2 . PRO 99 99 18000 2 . ASP 100 100 18000 2 . ALA 101 101 18000 2 . PRO 102 102 18000 2 . MET 103 103 18000 2 . SER 104 104 18000 2 . GLN 105 105 18000 2 . VAL 106 106 18000 2 . TYR 107 107 18000 2 . GLY 108 108 18000 2 . ALA 109 109 18000 2 . PRO 110 110 18000 2 . HIS 111 111 18000 2 . LEU 112 112 18000 2 . LEU 113 113 18000 2 . ARG 114 114 18000 2 . LEU 115 115 18000 2 . PHE 116 116 18000 2 . VAL 117 117 18000 2 . ARG 118 118 18000 2 . ILE 119 119 18000 2 . GLY 120 120 18000 2 . ALA 121 121 18000 2 . MET 122 122 18000 2 . LEU 123 123 18000 2 . ALA 124 124 18000 2 . TYR 125 125 18000 2 . THR 126 126 18000 2 . PRO 127 127 18000 2 . LEU 128 128 18000 2 . ASP 129 129 18000 2 . GLU 130 130 18000 2 . LYS 131 131 18000 2 . SER 132 132 18000 2 . LEU 133 133 18000 2 . ALA 134 134 18000 2 . LEU 135 135 18000 2 . LEU 136 136 18000 2 . LEU 137 137 18000 2 . ASN 138 138 18000 2 . TYR 139 139 18000 2 . LEU 140 140 18000 2 . HIS 141 141 18000 2 . ASP 142 142 18000 2 . PHE 143 143 18000 2 . LEU 144 144 18000 2 . LYS 145 145 18000 2 . TYR 146 146 18000 2 . LEU 147 147 18000 2 . ALA 148 148 18000 2 . LYS 149 149 18000 2 . ASN 150 150 18000 2 . SER 151 151 18000 2 . ALA 152 152 18000 2 . THR 153 153 18000 2 . LEU 154 154 18000 2 . PHE 155 155 18000 2 . SER 156 156 18000 2 . ALA 157 157 18000 2 . SER 158 158 18000 2 . ASP 159 159 18000 2 . TYR 160 160 18000 2 . GLU 161 161 18000 2 . VAL 162 162 18000 2 . ALA 163 163 18000 2 . PRO 164 164 18000 2 . PRO 165 165 18000 2 . GLU 166 166 18000 2 . TYR 167 167 18000 2 . HIS 168 168 18000 2 . ARG 169 169 18000 2 . LYS 170 170 18000 2 . ALA 171 171 18000 2 . VAL 172 172 18000 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 18000 _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 $Pf1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 18000 1 2 2 $MRG15 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 18000 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 18000 _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 $Pf1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 . . . . . . . . . . . . . . . pMCSG7 . . . . . . 18000 1 2 2 $MRG15 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 . . . . . . . . . . . . . . . pMCSG7 . . . . . . 18000 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18000 _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 Pf1 '[U-100% 13C; U-100% 15N]' . . 1 $Pf1 . . 0.9 . . mM . . . . 18000 1 2 MRG15 'natural abundance' . . 2 $MRG15 . . 0.9 . . mM . . . . 18000 1 3 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 18000 1 4 D2O '[U-100% 2H]' . . . . . . 10 . . % . . . . 18000 1 5 DTT [U-2H] . . . . . . 5 . . mM . . . . 18000 1 6 'sodium azide' 'natural abundance' . . . . . . 0.2 . . % . . . . 18000 1 7 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18000 1 8 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18000 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 18000 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pf1 '[U-100% 13C; U-100% 15N]' . . 1 $Pf1 . . 0.9 . . mM . . . . 18000 2 2 MRG15 'natural abundance' . . 2 $MRG15 . . 0.9 . . mM . . . . 18000 2 3 'potassium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 18000 2 4 D2O '[U-100% 2H]' . . . . . . 100 . . % . . . . 18000 2 5 DTT [U-2H] . . . . . . 5 . . mM . . . . 18000 2 6 'sodium azide' 'natural abundance' . . . . . . 0.2 . . % . . . . 18000 2 7 D2O 'natural abundance' . . . . . . 100 . . % . . . . 18000 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 18000 _Sample.ID 3 _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 Pf1 'natural abundance' . . 1 $Pf1 . . 0.9 . . mM . . . . 18000 3 2 MRG15 '[U-100% 13C; U-100% 15N]' . . 2 $MRG15 . . 0.9 . . mM . . . . 18000 3 3 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 18000 3 4 D2O '[U-100% 2H]' . . . . . . 10 . . % . . . . 18000 3 5 DTT [U-2H] . . . . . . 5 . . mM . . . . 18000 3 6 'sodium azide' 'natural abundance' . . . . . . 0.2 . . % . . . . 18000 3 7 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18000 3 8 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18000 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 18000 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Pf1 'natural abundance' . . 1 $Pf1 . . 0.9 . . mM . . . . 18000 4 2 MRG15 '[U-100% 13C; U-100% 15N]' . . 2 $MRG15 . . 0.9 . . mM . . . . 18000 4 3 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 18000 4 4 D2O '[U-100% 2H]' . . . . . . 100 . . % . . . . 18000 4 5 DTT [U-2H] . . . . . . 5 . . mM . . . . 18000 4 6 'sodium azide' 'natural abundance' . . . . . . 0.2 . . % . . . . 18000 4 7 D2O 'natural abundance' . . . . . . 100 . . % . . . . 18000 4 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 18000 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.8 . pH 18000 1 temperature 298 . K 18000 1 stop_ save_ ############################ # Computer software used # ############################ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 18000 _Software.ID 1 _Software.Name CNS _Software.Version 1.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 18000 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 18000 1 stop_ save_ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 18000 _Software.ID 2 _Software.Name ARIA _Software.Version 1.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Linge, O'Donoghue and Nilges' . . 18000 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 18000 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 18000 _Software.ID 3 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 18000 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18000 3 'data analysis' 18000 3 'peak picking' 18000 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 18000 _NMR_spectrometer.ID 1 _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 18000 _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 . 600 . . . 18000 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 18000 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 4 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 7 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 8 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 9 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 10 '3D HNCACB' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 11 '3D CBCA(CO)NH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 12 '3D HNCA' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 13 '3D HNCO' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 14 '3D 1H-15N NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 15 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 16 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 17 '3D HCACO' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 18 '3D HCCH-COSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 19 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 20 '3D HCCH-COSY' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 1 21 '3D HCCH-TOCSY' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18000 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 18000 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.25145002 . . . . . . . . . 18000 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 na direct 1.0000000000 . . . . . . . . . 18000 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.1013291444 . . . . . . . . . 18000 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 18000 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 18000 1 2 '3D HNCACB' . . . 18000 1 3 '3D CBCA(CO)NH' . . . 18000 1 4 '3D HNCA' . . . 18000 1 5 '3D HNCO' . . . 18000 1 6 '3D 1H-15N NOESY' . . . 18000 1 7 '3D 1H-13C NOESY aliphatic' . . . 18000 1 8 '2D 1H-13C HSQC aromatic' . . . 18000 1 9 '2D 1H-15N HSQC' . . . 18000 1 10 '3D HNCACB' . . . 18000 1 11 '3D CBCA(CO)NH' . . . 18000 1 12 '3D HNCA' . . . 18000 1 13 '3D HNCO' . . . 18000 1 14 '3D 1H-15N NOESY' . . . 18000 1 15 '3D 1H-13C NOESY aliphatic' . . . 18000 1 16 '2D 1H-13C HSQC aromatic' . . . 18000 1 17 '3D HCACO' . . . 18000 1 18 '3D HCCH-COSY' . . . 18000 1 19 '3D HCCH-TOCSY' . . . 18000 1 20 '3D HCCH-COSY' . . . 18000 1 21 '3D HCCH-TOCSY' . . . 18000 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 ASP HA H 1 4.57 0.03 . 1 1 . . A 200 ASP HA . 18000 1 2 . 1 1 1 1 ASP HB2 H 1 2.48 0.03 . 2 1 . . A 200 ASP HB2 . 18000 1 3 . 1 1 1 1 ASP HB3 H 1 2.58 0.03 . 2 1 . . A 200 ASP HB3 . 18000 1 4 . 1 1 1 1 ASP C C 13 173.31 0.20 . 1 1 . . A 200 ASP C . 18000 1 5 . 1 1 1 1 ASP CA C 13 52.32 0.20 . 1 1 . . A 200 ASP CA . 18000 1 6 . 1 1 1 1 ASP CB C 13 39.62 0.20 . 1 1 . . A 200 ASP CB . 18000 1 7 . 1 1 2 2 TYR H H 1 8.23 0.03 . 1 1 . . A 201 TYR H . 18000 1 8 . 1 1 2 2 TYR HA H 1 4.50 0.03 . 1 1 . . A 201 TYR HA . 18000 1 9 . 1 1 2 2 TYR HB2 H 1 2.90 0.03 . 2 1 . . A 201 TYR HB2 . 18000 1 10 . 1 1 2 2 TYR HB3 H 1 2.94 0.03 . 2 1 . . A 201 TYR HB3 . 18000 1 11 . 1 1 2 2 TYR HD2 H 1 7.05 0.03 . 3 1 . . A 201 TYR HD2 . 18000 1 12 . 1 1 2 2 TYR HE2 H 1 6.76 0.03 . 3 1 . . A 201 TYR HE2 . 18000 1 13 . 1 1 2 2 TYR C C 13 173.37 0.20 . 1 1 . . A 201 TYR C . 18000 1 14 . 1 1 2 2 TYR CA C 13 56.03 0.20 . 1 1 . . A 201 TYR CA . 18000 1 15 . 1 1 2 2 TYR CB C 13 37.03 0.20 . 1 1 . . A 201 TYR CB . 18000 1 16 . 1 1 2 2 TYR CD2 C 13 131.37 0.20 . 1 1 . . A 201 TYR CD2 . 18000 1 17 . 1 1 2 2 TYR CE2 C 13 116.25 0.20 . 1 1 . . A 201 TYR CE2 . 18000 1 18 . 1 1 2 2 TYR N N 15 120.78 0.30 . 1 1 . . A 201 TYR N . 18000 1 19 . 1 1 3 3 VAL H H 1 7.95 0.03 . 1 1 . . A 202 VAL H . 18000 1 20 . 1 1 3 3 VAL HA H 1 3.94 0.03 . 1 1 . . A 202 VAL HA . 18000 1 21 . 1 1 3 3 VAL HB H 1 1.89 0.03 . 1 1 . . A 202 VAL HB . 18000 1 22 . 1 1 3 3 VAL HG11 H 1 0.81 0.03 . 2 1 . . A 202 VAL HG11 . 18000 1 23 . 1 1 3 3 VAL HG12 H 1 0.81 0.03 . 2 1 . . A 202 VAL HG12 . 18000 1 24 . 1 1 3 3 VAL HG13 H 1 0.81 0.03 . 2 1 . . A 202 VAL HG13 . 18000 1 25 . 1 1 3 3 VAL HG21 H 1 0.79 0.03 . 2 1 . . A 202 VAL HG21 . 18000 1 26 . 1 1 3 3 VAL HG22 H 1 0.79 0.03 . 2 1 . . A 202 VAL HG22 . 18000 1 27 . 1 1 3 3 VAL HG23 H 1 0.79 0.03 . 2 1 . . A 202 VAL HG23 . 18000 1 28 . 1 1 3 3 VAL C C 13 173.44 0.20 . 1 1 . . A 202 VAL C . 18000 1 29 . 1 1 3 3 VAL CA C 13 60.14 0.20 . 1 1 . . A 202 VAL CA . 18000 1 30 . 1 1 3 3 VAL CB C 13 30.99 0.20 . 1 1 . . A 202 VAL CB . 18000 1 31 . 1 1 3 3 VAL CG1 C 13 18.95 0.20 . 2 1 . . A 202 VAL CG1 . 18000 1 32 . 1 1 3 3 VAL CG2 C 13 19.41 0.20 . 2 1 . . A 202 VAL CG2 . 18000 1 33 . 1 1 3 3 VAL N N 15 123.01 0.30 . 1 1 . . A 202 VAL N . 18000 1 34 . 1 1 4 4 GLN H H 1 8.35 0.03 . 1 1 . . A 203 GLN H . 18000 1 35 . 1 1 4 4 GLN HA H 1 4.47 0.03 . 1 1 . . A 203 GLN HA . 18000 1 36 . 1 1 4 4 GLN HB2 H 1 1.91 0.03 . 2 1 . . A 203 GLN HB2 . 18000 1 37 . 1 1 4 4 GLN HB3 H 1 2.04 0.03 . 2 1 . . A 203 GLN HB3 . 18000 1 38 . 1 1 4 4 GLN HG3 H 1 2.35 0.03 . 2 1 . . A 203 GLN HG3 . 18000 1 39 . 1 1 4 4 GLN HE21 H 1 6.85 0.03 . 2 1 . . A 203 GLN HE21 . 18000 1 40 . 1 1 4 4 GLN HE22 H 1 7.56 0.03 . 2 1 . . A 203 GLN HE22 . 18000 1 41 . 1 1 4 4 GLN C C 13 172.06 0.20 . 1 1 . . A 203 GLN C . 18000 1 42 . 1 1 4 4 GLN CA C 13 52.27 0.20 . 1 1 . . A 203 GLN CA . 18000 1 43 . 1 1 4 4 GLN CB C 13 26.97 0.20 . 1 1 . . A 203 GLN CB . 18000 1 44 . 1 1 4 4 GLN CG C 13 31.71 0.20 . 1 1 . . A 203 GLN CG . 18000 1 45 . 1 1 4 4 GLN N N 15 112.23 0.30 . 1 1 . . A 203 GLN N . 18000 1 46 . 1 1 4 4 GLN NE2 N 15 112.17 0.30 . 1 1 . . A 203 GLN NE2 . 18000 1 47 . 1 1 5 5 PRO HA H 1 4.40 0.03 . 1 1 . . A 204 PRO HA . 18000 1 48 . 1 1 5 5 PRO HB2 H 1 1.86 0.03 . 2 1 . . A 204 PRO HB2 . 18000 1 49 . 1 1 5 5 PRO HB3 H 1 2.27 0.03 . 2 1 . . A 204 PRO HB3 . 18000 1 50 . 1 1 5 5 PRO HG2 H 1 1.97 0.03 . 2 1 . . A 204 PRO HG2 . 18000 1 51 . 1 1 5 5 PRO HG3 H 1 2.04 0.03 . 2 1 . . A 204 PRO HG3 . 18000 1 52 . 1 1 5 5 PRO HD2 H 1 3.67 0.03 . 2 1 . . A 204 PRO HD2 . 18000 1 53 . 1 1 5 5 PRO HD3 H 1 3.81 0.03 . 2 1 . . A 204 PRO HD3 . 18000 1 54 . 1 1 5 5 PRO C C 13 174.83 0.20 . 1 1 . . A 204 PRO C . 18000 1 55 . 1 1 5 5 PRO CA C 13 61.55 0.20 . 1 1 . . A 204 PRO CA . 18000 1 56 . 1 1 5 5 PRO CB C 13 30.32 0.20 . 1 1 . . A 204 PRO CB . 18000 1 57 . 1 1 5 5 PRO CG C 13 25.95 0.20 . 1 1 . . A 204 PRO CG . 18000 1 58 . 1 1 5 5 PRO CD C 13 49.03 0.20 . 1 1 . . A 204 PRO CD . 18000 1 59 . 1 1 6 6 GLN H H 1 8.77 0.03 . 1 1 . . A 205 GLN H . 18000 1 60 . 1 1 6 6 GLN HA H 1 4.40 0.03 . 1 1 . . A 205 GLN HA . 18000 1 61 . 1 1 6 6 GLN HB2 H 1 2.02 0.03 . 2 1 . . A 205 GLN HB2 . 18000 1 62 . 1 1 6 6 GLN HB3 H 1 2.17 0.03 . 2 1 . . A 205 GLN HB3 . 18000 1 63 . 1 1 6 6 GLN HG3 H 1 2.39 0.03 . 2 1 . . A 205 GLN HG3 . 18000 1 64 . 1 1 6 6 GLN HE21 H 1 6.82 0.03 . 2 1 . . A 205 GLN HE21 . 18000 1 65 . 1 1 6 6 GLN HE22 H 1 7.57 0.03 . 2 1 . . A 205 GLN HE22 . 18000 1 66 . 1 1 6 6 GLN C C 13 174.55 0.20 . 1 1 . . A 205 GLN C . 18000 1 67 . 1 1 6 6 GLN CA C 13 54.58 0.20 . 1 1 . . A 205 GLN CA . 18000 1 68 . 1 1 6 6 GLN CB C 13 28.34 0.20 . 1 1 . . A 205 GLN CB . 18000 1 69 . 1 1 6 6 GLN CG C 13 32.29 0.20 . 1 1 . . A 205 GLN CG . 18000 1 70 . 1 1 6 6 GLN N N 15 120.56 0.30 . 1 1 . . A 205 GLN N . 18000 1 71 . 1 1 6 6 GLN NE2 N 15 112.00 0.30 . 1 1 . . A 205 GLN NE2 . 18000 1 72 . 1 1 7 7 LEU H H 1 8.83 0.03 . 1 1 . . A 206 LEU H . 18000 1 73 . 1 1 7 7 LEU HA H 1 4.35 0.03 . 1 1 . . A 206 LEU HA . 18000 1 74 . 1 1 7 7 LEU HB2 H 1 1.36 0.03 . 2 1 . . A 206 LEU HB2 . 18000 1 75 . 1 1 7 7 LEU HB3 H 1 1.55 0.03 . 2 1 . . A 206 LEU HB3 . 18000 1 76 . 1 1 7 7 LEU HG H 1 1.59 0.03 . 1 1 . . A 206 LEU HG . 18000 1 77 . 1 1 7 7 LEU HD11 H 1 0.79 0.03 . 2 1 . . A 206 LEU HD11 . 18000 1 78 . 1 1 7 7 LEU HD12 H 1 0.79 0.03 . 2 1 . . A 206 LEU HD12 . 18000 1 79 . 1 1 7 7 LEU HD13 H 1 0.79 0.03 . 2 1 . . A 206 LEU HD13 . 18000 1 80 . 1 1 7 7 LEU HD21 H 1 0.79 0.03 . 2 1 . . A 206 LEU HD21 . 18000 1 81 . 1 1 7 7 LEU HD22 H 1 0.79 0.03 . 2 1 . . A 206 LEU HD22 . 18000 1 82 . 1 1 7 7 LEU HD23 H 1 0.79 0.03 . 2 1 . . A 206 LEU HD23 . 18000 1 83 . 1 1 7 7 LEU C C 13 174.56 0.20 . 1 1 . . A 206 LEU C . 18000 1 84 . 1 1 7 7 LEU CA C 13 53.08 0.20 . 1 1 . . A 206 LEU CA . 18000 1 85 . 1 1 7 7 LEU CB C 13 40.95 0.20 . 1 1 . . A 206 LEU CB . 18000 1 86 . 1 1 7 7 LEU CG C 13 25.27 0.20 . 1 1 . . A 206 LEU CG . 18000 1 87 . 1 1 7 7 LEU CD1 C 13 21.81 0.20 . 2 1 . . A 206 LEU CD1 . 18000 1 88 . 1 1 7 7 LEU CD2 C 13 24.06 0.20 . 2 1 . . A 206 LEU CD2 . 18000 1 89 . 1 1 7 7 LEU N N 15 120.68 0.30 . 1 1 . . A 206 LEU N . 18000 1 90 . 1 1 8 8 ARG H H 1 7.83 0.03 . 1 1 . . A 207 ARG H . 18000 1 91 . 1 1 8 8 ARG HA H 1 4.28 0.03 . 1 1 . . A 207 ARG HA . 18000 1 92 . 1 1 8 8 ARG HB2 H 1 1.79 0.03 . 2 1 . . A 207 ARG HB2 . 18000 1 93 . 1 1 8 8 ARG HB3 H 1 1.88 0.03 . 2 1 . . A 207 ARG HB3 . 18000 1 94 . 1 1 8 8 ARG HG3 H 1 1.60 0.03 . 2 1 . . A 207 ARG HG3 . 18000 1 95 . 1 1 8 8 ARG HD3 H 1 3.16 0.03 . 2 1 . . A 207 ARG HD3 . 18000 1 96 . 1 1 8 8 ARG C C 13 176.10 0.20 . 1 1 . . A 207 ARG C . 18000 1 97 . 1 1 8 8 ARG CA C 13 56.65 0.20 . 1 1 . . A 207 ARG CA . 18000 1 98 . 1 1 8 8 ARG CB C 13 28.62 0.20 . 1 1 . . A 207 ARG CB . 18000 1 99 . 1 1 8 8 ARG CG C 13 25.07 0.20 . 1 1 . . A 207 ARG CG . 18000 1 100 . 1 1 8 8 ARG CD C 13 41.31 0.20 . 1 1 . . A 207 ARG CD . 18000 1 101 . 1 1 8 8 ARG N N 15 119.85 0.30 . 1 1 . . A 207 ARG N . 18000 1 102 . 1 1 9 9 ARG H H 1 8.38 0.03 . 1 1 . . A 208 ARG H . 18000 1 103 . 1 1 9 9 ARG HA H 1 4.36 0.03 . 1 1 . . A 208 ARG HA . 18000 1 104 . 1 1 9 9 ARG HB2 H 1 1.85 0.03 . 2 1 . . A 208 ARG HB2 . 18000 1 105 . 1 1 9 9 ARG HB3 H 1 1.98 0.03 . 2 1 . . A 208 ARG HB3 . 18000 1 106 . 1 1 9 9 ARG HG3 H 1 1.60 0.03 . 2 1 . . A 208 ARG HG3 . 18000 1 107 . 1 1 9 9 ARG HD2 H 1 3.14 0.03 . 2 1 . . A 208 ARG HD2 . 18000 1 108 . 1 1 9 9 ARG HD3 H 1 3.31 0.03 . 2 1 . . A 208 ARG HD3 . 18000 1 109 . 1 1 9 9 ARG CA C 13 57.42 0.20 . 1 1 . . A 208 ARG CA . 18000 1 110 . 1 1 9 9 ARG CB C 13 25.32 0.20 . 1 1 . . A 208 ARG CB . 18000 1 111 . 1 1 9 9 ARG CG C 13 25.32 0.20 . 1 1 . . A 208 ARG CG . 18000 1 112 . 1 1 9 9 ARG CD C 13 41.20 0.20 . 1 1 . . A 208 ARG CD . 18000 1 113 . 1 1 9 9 ARG N N 15 118.38 0.30 . 1 1 . . A 208 ARG N . 18000 1 114 . 1 1 10 10 PRO HA H 1 3.96 0.03 . 1 1 . . A 209 PRO HA . 18000 1 115 . 1 1 10 10 PRO HB2 H 1 1.37 0.03 . 2 1 . . A 209 PRO HB2 . 18000 1 116 . 1 1 10 10 PRO HB3 H 1 1.86 0.03 . 2 1 . . A 209 PRO HB3 . 18000 1 117 . 1 1 10 10 PRO HG2 H 1 1.85 0.03 . 2 1 . . A 209 PRO HG2 . 18000 1 118 . 1 1 10 10 PRO HG3 H 1 2.05 0.03 . 2 1 . . A 209 PRO HG3 . 18000 1 119 . 1 1 10 10 PRO HD2 H 1 3.56 0.03 . 2 1 . . A 209 PRO HD2 . 18000 1 120 . 1 1 10 10 PRO HD3 H 1 3.66 0.03 . 2 1 . . A 209 PRO HD3 . 18000 1 121 . 1 1 10 10 PRO C C 13 175.69 0.20 . 1 1 . . A 209 PRO C . 18000 1 122 . 1 1 10 10 PRO CA C 13 64.60 0.20 . 1 1 . . A 209 PRO CA . 18000 1 123 . 1 1 10 10 PRO CB C 13 29.40 0.20 . 1 1 . . A 209 PRO CB . 18000 1 124 . 1 1 10 10 PRO CG C 13 25.91 0.20 . 1 1 . . A 209 PRO CG . 18000 1 125 . 1 1 10 10 PRO CD C 13 47.27 0.20 . 1 1 . . A 209 PRO CD . 18000 1 126 . 1 1 11 11 PHE HA H 1 3.96 0.03 . 1 1 . . A 210 PHE HA . 18000 1 127 . 1 1 11 11 PHE HB2 H 1 2.92 0.03 . 2 1 . . A 210 PHE HB2 . 18000 1 128 . 1 1 11 11 PHE HB3 H 1 3.05 0.03 . 2 1 . . A 210 PHE HB3 . 18000 1 129 . 1 1 11 11 PHE HD2 H 1 7.11 0.03 . 3 1 . . A 210 PHE HD2 . 18000 1 130 . 1 1 11 11 PHE HE2 H 1 6.88 0.03 . 3 1 . . A 210 PHE HE2 . 18000 1 131 . 1 1 11 11 PHE C C 13 175.54 0.20 . 1 1 . . A 210 PHE C . 18000 1 132 . 1 1 11 11 PHE CA C 13 61.54 0.20 . 1 1 . . A 210 PHE CA . 18000 1 133 . 1 1 11 11 PHE CB C 13 36.58 0.20 . 1 1 . . A 210 PHE CB . 18000 1 134 . 1 1 11 11 PHE CD2 C 13 130.11 0.20 . 1 1 . . A 210 PHE CD2 . 18000 1 135 . 1 1 12 12 GLU H H 1 8.26 0.03 . 1 1 . . A 211 GLU H . 18000 1 136 . 1 1 12 12 GLU HA H 1 3.90 0.03 . 1 1 . . A 211 GLU HA . 18000 1 137 . 1 1 12 12 GLU HB2 H 1 2.03 0.03 . 2 1 . . A 211 GLU HB2 . 18000 1 138 . 1 1 12 12 GLU HB3 H 1 2.33 0.03 . 2 1 . . A 211 GLU HB3 . 18000 1 139 . 1 1 12 12 GLU HG2 H 1 2.20 0.03 . 2 1 . . A 211 GLU HG2 . 18000 1 140 . 1 1 12 12 GLU HG3 H 1 2.43 0.03 . 2 1 . . A 211 GLU HG3 . 18000 1 141 . 1 1 12 12 GLU C C 13 178.32 0.20 . 1 1 . . A 211 GLU C . 18000 1 142 . 1 1 12 12 GLU CA C 13 58.27 0.20 . 1 1 . . A 211 GLU CA . 18000 1 143 . 1 1 12 12 GLU CB C 13 27.85 0.20 . 1 1 . . A 211 GLU CB . 18000 1 144 . 1 1 12 12 GLU CG C 13 35.04 0.20 . 1 1 . . A 211 GLU CG . 18000 1 145 . 1 1 12 12 GLU N N 15 119.69 0.30 . 1 1 . . A 211 GLU N . 18000 1 146 . 1 1 13 13 LEU H H 1 8.12 0.03 . 1 1 . . A 212 LEU H . 18000 1 147 . 1 1 13 13 LEU HA H 1 4.05 0.03 . 1 1 . . A 212 LEU HA . 18000 1 148 . 1 1 13 13 LEU HB2 H 1 1.27 0.03 . 2 1 . . A 212 LEU HB2 . 18000 1 149 . 1 1 13 13 LEU HB3 H 1 1.82 0.03 . 2 1 . . A 212 LEU HB3 . 18000 1 150 . 1 1 13 13 LEU HG H 1 1.69 0.03 . 1 1 . . A 212 LEU HG . 18000 1 151 . 1 1 13 13 LEU HD11 H 1 0.79 0.03 . 2 1 . . A 212 LEU HD11 . 18000 1 152 . 1 1 13 13 LEU HD12 H 1 0.79 0.03 . 2 1 . . A 212 LEU HD12 . 18000 1 153 . 1 1 13 13 LEU HD13 H 1 0.79 0.03 . 2 1 . . A 212 LEU HD13 . 18000 1 154 . 1 1 13 13 LEU HD21 H 1 0.75 0.03 . 2 1 . . A 212 LEU HD21 . 18000 1 155 . 1 1 13 13 LEU HD22 H 1 0.75 0.03 . 2 1 . . A 212 LEU HD22 . 18000 1 156 . 1 1 13 13 LEU HD23 H 1 0.75 0.03 . 2 1 . . A 212 LEU HD23 . 18000 1 157 . 1 1 13 13 LEU C C 13 178.24 0.20 . 1 1 . . A 212 LEU C . 18000 1 158 . 1 1 13 13 LEU CA C 13 55.88 0.20 . 1 1 . . A 212 LEU CA . 18000 1 159 . 1 1 13 13 LEU CB C 13 39.91 0.20 . 1 1 . . A 212 LEU CB . 18000 1 160 . 1 1 13 13 LEU CG C 13 25.09 0.20 . 1 1 . . A 212 LEU CG . 18000 1 161 . 1 1 13 13 LEU CD1 C 13 20.54 0.20 . 2 1 . . A 212 LEU CD1 . 18000 1 162 . 1 1 13 13 LEU CD2 C 13 24.03 0.20 . 2 1 . . A 212 LEU CD2 . 18000 1 163 . 1 1 13 13 LEU N N 15 119.03 0.30 . 1 1 . . A 212 LEU N . 18000 1 164 . 1 1 14 14 LEU H H 1 7.92 0.03 . 1 1 . . A 213 LEU H . 18000 1 165 . 1 1 14 14 LEU HA H 1 3.89 0.03 . 1 1 . . A 213 LEU HA . 18000 1 166 . 1 1 14 14 LEU HB2 H 1 0.97 0.03 . 2 1 . . A 213 LEU HB2 . 18000 1 167 . 1 1 14 14 LEU HB3 H 1 1.41 0.03 . 2 1 . . A 213 LEU HB3 . 18000 1 168 . 1 1 14 14 LEU HG H 1 1.43 0.03 . 1 1 . . A 213 LEU HG . 18000 1 169 . 1 1 14 14 LEU HD11 H 1 0.50 0.03 . 2 1 . . A 213 LEU HD11 . 18000 1 170 . 1 1 14 14 LEU HD12 H 1 0.50 0.03 . 2 1 . . A 213 LEU HD12 . 18000 1 171 . 1 1 14 14 LEU HD13 H 1 0.50 0.03 . 2 1 . . A 213 LEU HD13 . 18000 1 172 . 1 1 14 14 LEU HD21 H 1 0.14 0.03 . 2 1 . . A 213 LEU HD21 . 18000 1 173 . 1 1 14 14 LEU HD22 H 1 0.14 0.03 . 2 1 . . A 213 LEU HD22 . 18000 1 174 . 1 1 14 14 LEU HD23 H 1 0.14 0.03 . 2 1 . . A 213 LEU HD23 . 18000 1 175 . 1 1 14 14 LEU C C 13 177.44 0.20 . 1 1 . . A 213 LEU C . 18000 1 176 . 1 1 14 14 LEU CA C 13 56.01 0.20 . 1 1 . . A 213 LEU CA . 18000 1 177 . 1 1 14 14 LEU CB C 13 39.62 0.20 . 1 1 . . A 213 LEU CB . 18000 1 178 . 1 1 14 14 LEU CG C 13 24.76 0.20 . 1 1 . . A 213 LEU CG . 18000 1 179 . 1 1 14 14 LEU CD1 C 13 20.96 0.20 . 2 1 . . A 213 LEU CD1 . 18000 1 180 . 1 1 14 14 LEU CD2 C 13 22.91 0.20 . 2 1 . . A 213 LEU CD2 . 18000 1 181 . 1 1 14 14 LEU N N 15 121.81 0.30 . 1 1 . . A 213 LEU N . 18000 1 182 . 1 1 15 15 ILE H H 1 8.68 0.03 . 1 1 . . A 214 ILE H . 18000 1 183 . 1 1 15 15 ILE HA H 1 3.60 0.03 . 1 1 . . A 214 ILE HA . 18000 1 184 . 1 1 15 15 ILE HB H 1 1.87 0.03 . 1 1 . . A 214 ILE HB . 18000 1 185 . 1 1 15 15 ILE HG12 H 1 1.93 0.03 . 2 1 . . A 214 ILE HG12 . 18000 1 186 . 1 1 15 15 ILE HG13 H 1 1.89 0.03 . 2 1 . . A 214 ILE HG13 . 18000 1 187 . 1 1 15 15 ILE HG21 H 1 0.99 0.03 . 1 1 . . A 214 ILE HG21 . 18000 1 188 . 1 1 15 15 ILE HG22 H 1 0.99 0.03 . 1 1 . . A 214 ILE HG22 . 18000 1 189 . 1 1 15 15 ILE HG23 H 1 0.99 0.03 . 1 1 . . A 214 ILE HG23 . 18000 1 190 . 1 1 15 15 ILE HD11 H 1 0.90 0.03 . 1 1 . . A 214 ILE HD11 . 18000 1 191 . 1 1 15 15 ILE HD12 H 1 0.90 0.03 . 1 1 . . A 214 ILE HD12 . 18000 1 192 . 1 1 15 15 ILE HD13 H 1 0.90 0.03 . 1 1 . . A 214 ILE HD13 . 18000 1 193 . 1 1 15 15 ILE C C 13 175.26 0.20 . 1 1 . . A 214 ILE C . 18000 1 194 . 1 1 15 15 ILE CA C 13 64.40 0.20 . 1 1 . . A 214 ILE CA . 18000 1 195 . 1 1 15 15 ILE CB C 13 36.98 0.20 . 1 1 . . A 214 ILE CB . 18000 1 196 . 1 1 15 15 ILE CG1 C 13 30.11 0.20 . 1 1 . . A 214 ILE CG1 . 18000 1 197 . 1 1 15 15 ILE CG2 C 13 15.75 0.20 . 1 1 . . A 214 ILE CG2 . 18000 1 198 . 1 1 15 15 ILE CD1 C 13 12.79 0.20 . 1 1 . . A 214 ILE CD1 . 18000 1 199 . 1 1 15 15 ILE N N 15 121.43 0.30 . 1 1 . . A 214 ILE N . 18000 1 200 . 1 1 16 16 ALA H H 1 7.79 0.03 . 1 1 . . A 215 ALA H . 18000 1 201 . 1 1 16 16 ALA HA H 1 4.09 0.03 . 1 1 . . A 215 ALA HA . 18000 1 202 . 1 1 16 16 ALA HB1 H 1 1.46 0.03 . 1 1 . . A 215 ALA HB1 . 18000 1 203 . 1 1 16 16 ALA HB2 H 1 1.46 0.03 . 1 1 . . A 215 ALA HB2 . 18000 1 204 . 1 1 16 16 ALA HB3 H 1 1.46 0.03 . 1 1 . . A 215 ALA HB3 . 18000 1 205 . 1 1 16 16 ALA C C 13 178.82 0.20 . 1 1 . . A 215 ALA C . 18000 1 206 . 1 1 16 16 ALA CA C 13 53.31 0.20 . 1 1 . . A 215 ALA CA . 18000 1 207 . 1 1 16 16 ALA CB C 13 16.07 0.20 . 1 1 . . A 215 ALA CB . 18000 1 208 . 1 1 16 16 ALA N N 15 120.37 0.30 . 1 1 . . A 215 ALA N . 18000 1 209 . 1 1 17 17 ALA H H 1 7.79 0.03 . 1 1 . . A 216 ALA H . 18000 1 210 . 1 1 17 17 ALA HA H 1 4.16 0.03 . 1 1 . . A 216 ALA HA . 18000 1 211 . 1 1 17 17 ALA HB1 H 1 1.47 0.03 . 1 1 . . A 216 ALA HB1 . 18000 1 212 . 1 1 17 17 ALA HB2 H 1 1.47 0.03 . 1 1 . . A 216 ALA HB2 . 18000 1 213 . 1 1 17 17 ALA HB3 H 1 1.47 0.03 . 1 1 . . A 216 ALA HB3 . 18000 1 214 . 1 1 17 17 ALA C C 13 178.73 0.20 . 1 1 . . A 216 ALA C . 18000 1 215 . 1 1 17 17 ALA CA C 13 52.71 0.20 . 1 1 . . A 216 ALA CA . 18000 1 216 . 1 1 17 17 ALA CB C 13 16.69 0.20 . 1 1 . . A 216 ALA CB . 18000 1 217 . 1 1 17 17 ALA N N 15 118.93 0.30 . 1 1 . . A 216 ALA N . 18000 1 218 . 1 1 18 18 ALA H H 1 8.13 0.03 . 1 1 . . A 217 ALA H . 18000 1 219 . 1 1 18 18 ALA HA H 1 3.92 0.03 . 1 1 . . A 217 ALA HA . 18000 1 220 . 1 1 18 18 ALA HB1 H 1 1.53 0.03 . 1 1 . . A 217 ALA HB1 . 18000 1 221 . 1 1 18 18 ALA HB2 H 1 1.53 0.03 . 1 1 . . A 217 ALA HB2 . 18000 1 222 . 1 1 18 18 ALA HB3 H 1 1.53 0.03 . 1 1 . . A 217 ALA HB3 . 18000 1 223 . 1 1 18 18 ALA C C 13 178.04 0.20 . 1 1 . . A 217 ALA C . 18000 1 224 . 1 1 18 18 ALA CA C 13 52.96 0.20 . 1 1 . . A 217 ALA CA . 18000 1 225 . 1 1 18 18 ALA CB C 13 17.33 0.20 . 1 1 . . A 217 ALA CB . 18000 1 226 . 1 1 18 18 ALA N N 15 120.68 0.30 . 1 1 . . A 217 ALA N . 18000 1 227 . 1 1 19 19 MET H H 1 7.82 0.03 . 1 1 . . A 218 MET H . 18000 1 228 . 1 1 19 19 MET HA H 1 4.21 0.03 . 1 1 . . A 218 MET HA . 18000 1 229 . 1 1 19 19 MET HB2 H 1 2.16 0.03 . 2 1 . . A 218 MET HB2 . 18000 1 230 . 1 1 19 19 MET HB3 H 1 2.22 0.03 . 2 1 . . A 218 MET HB3 . 18000 1 231 . 1 1 19 19 MET HG2 H 1 2.64 0.03 . 2 1 . . A 218 MET HG2 . 18000 1 232 . 1 1 19 19 MET HG3 H 1 2.85 0.03 . 2 1 . . A 218 MET HG3 . 18000 1 233 . 1 1 19 19 MET HE1 H 1 2.07 0.03 . 1 1 . . A 218 MET HE1 . 18000 1 234 . 1 1 19 19 MET HE2 H 1 2.07 0.03 . 1 1 . . A 218 MET HE2 . 18000 1 235 . 1 1 19 19 MET HE3 H 1 2.07 0.03 . 1 1 . . A 218 MET HE3 . 18000 1 236 . 1 1 19 19 MET C C 13 175.22 0.20 . 1 1 . . A 218 MET C . 18000 1 237 . 1 1 19 19 MET CA C 13 55.51 0.20 . 1 1 . . A 218 MET CA . 18000 1 238 . 1 1 19 19 MET CB C 13 30.61 0.20 . 1 1 . . A 218 MET CB . 18000 1 239 . 1 1 19 19 MET CG C 13 30.42 0.20 . 1 1 . . A 218 MET CG . 18000 1 240 . 1 1 19 19 MET CE C 13 14.63 0.20 . 1 1 . . A 218 MET CE . 18000 1 241 . 1 1 19 19 MET N N 15 114.87 0.30 . 1 1 . . A 218 MET N . 18000 1 242 . 1 1 20 20 GLU H H 1 7.27 0.03 . 1 1 . . A 219 GLU H . 18000 1 243 . 1 1 20 20 GLU HA H 1 4.30 0.03 . 1 1 . . A 219 GLU HA . 18000 1 244 . 1 1 20 20 GLU HB2 H 1 1.97 0.03 . 2 1 . . A 219 GLU HB2 . 18000 1 245 . 1 1 20 20 GLU HB3 H 1 2.12 0.03 . 2 1 . . A 219 GLU HB3 . 18000 1 246 . 1 1 20 20 GLU HG2 H 1 2.26 0.03 . 2 1 . . A 219 GLU HG2 . 18000 1 247 . 1 1 20 20 GLU HG3 H 1 2.34 0.03 . 2 1 . . A 219 GLU HG3 . 18000 1 248 . 1 1 20 20 GLU C C 13 174.40 0.20 . 1 1 . . A 219 GLU C . 18000 1 249 . 1 1 20 20 GLU CA C 13 54.34 0.20 . 1 1 . . A 219 GLU CA . 18000 1 250 . 1 1 20 20 GLU CB C 13 28.79 0.20 . 1 1 . . A 219 GLU CB . 18000 1 251 . 1 1 20 20 GLU CG C 13 34.41 0.20 . 1 1 . . A 219 GLU CG . 18000 1 252 . 1 1 20 20 GLU N N 15 115.64 0.30 . 1 1 . . A 219 GLU N . 18000 1 253 . 1 1 21 21 ARG H H 1 7.12 0.03 . 1 1 . . A 220 ARG H . 18000 1 254 . 1 1 21 21 ARG HA H 1 4.25 0.03 . 1 1 . . A 220 ARG HA . 18000 1 255 . 1 1 21 21 ARG HB2 H 1 1.68 0.03 . 2 1 . . A 220 ARG HB2 . 18000 1 256 . 1 1 21 21 ARG HB3 H 1 1.79 0.03 . 2 1 . . A 220 ARG HB3 . 18000 1 257 . 1 1 21 21 ARG HG2 H 1 1.60 0.03 . 2 1 . . A 220 ARG HG2 . 18000 1 258 . 1 1 21 21 ARG HG3 H 1 1.70 0.03 . 2 1 . . A 220 ARG HG3 . 18000 1 259 . 1 1 21 21 ARG HD2 H 1 2.90 0.03 . 2 1 . . A 220 ARG HD2 . 18000 1 260 . 1 1 21 21 ARG HD3 H 1 2.94 0.03 . 2 1 . . A 220 ARG HD3 . 18000 1 261 . 1 1 21 21 ARG C C 13 174.02 0.20 . 1 1 . . A 220 ARG C . 18000 1 262 . 1 1 21 21 ARG CA C 13 53.19 0.20 . 1 1 . . A 220 ARG CA . 18000 1 263 . 1 1 21 21 ARG CB C 13 29.29 0.20 . 1 1 . . A 220 ARG CB . 18000 1 264 . 1 1 21 21 ARG CG C 13 25.11 0.20 . 1 1 . . A 220 ARG CG . 18000 1 265 . 1 1 21 21 ARG CD C 13 41.18 0.20 . 1 1 . . A 220 ARG CD . 18000 1 266 . 1 1 21 21 ARG N N 15 118.63 0.30 . 1 1 . . A 220 ARG N . 18000 1 267 . 1 1 22 22 ASN H H 1 8.55 0.03 . 1 1 . . A 221 ASN H . 18000 1 268 . 1 1 22 22 ASN HA H 1 4.80 0.03 . 1 1 . . A 221 ASN HA . 18000 1 269 . 1 1 22 22 ASN HB2 H 1 2.60 0.03 . 2 1 . . A 221 ASN HB2 . 18000 1 270 . 1 1 22 22 ASN HB3 H 1 2.75 0.03 . 2 1 . . A 221 ASN HB3 . 18000 1 271 . 1 1 22 22 ASN HD21 H 1 6.98 0.03 . 2 1 . . A 221 ASN HD21 . 18000 1 272 . 1 1 22 22 ASN HD22 H 1 7.60 0.03 . 2 1 . . A 221 ASN HD22 . 18000 1 273 . 1 1 22 22 ASN C C 13 171.57 0.20 . 1 1 . . A 221 ASN C . 18000 1 274 . 1 1 22 22 ASN CA C 13 50.02 0.20 . 1 1 . . A 221 ASN CA . 18000 1 275 . 1 1 22 22 ASN CB C 13 35.81 0.20 . 1 1 . . A 221 ASN CB . 18000 1 276 . 1 1 22 22 ASN N N 15 122.19 0.30 . 1 1 . . A 221 ASN N . 18000 1 277 . 1 1 22 22 ASN ND2 N 15 113.24 0.30 . 1 1 . . A 221 ASN ND2 . 18000 1 278 . 1 1 23 23 PRO HA H 1 4.65 0.03 . 1 1 . . A 222 PRO HA . 18000 1 279 . 1 1 23 23 PRO HB2 H 1 1.86 0.03 . 2 1 . . A 222 PRO HB2 . 18000 1 280 . 1 1 23 23 PRO HB3 H 1 2.30 0.03 . 2 1 . . A 222 PRO HB3 . 18000 1 281 . 1 1 23 23 PRO HG2 H 1 1.90 0.03 . 2 1 . . A 222 PRO HG2 . 18000 1 282 . 1 1 23 23 PRO HG3 H 1 2.11 0.03 . 2 1 . . A 222 PRO HG3 . 18000 1 283 . 1 1 23 23 PRO HD2 H 1 3.62 0.03 . 2 1 . . A 222 PRO HD2 . 18000 1 284 . 1 1 23 23 PRO HD3 H 1 3.94 0.03 . 2 1 . . A 222 PRO HD3 . 18000 1 285 . 1 1 23 23 PRO C C 13 174.71 0.20 . 1 1 . . A 222 PRO C . 18000 1 286 . 1 1 23 23 PRO CA C 13 61.85 0.20 . 1 1 . . A 222 PRO CA . 18000 1 287 . 1 1 23 23 PRO CB C 13 30.84 0.20 . 1 1 . . A 222 PRO CB . 18000 1 288 . 1 1 23 23 PRO CG C 13 26.11 0.20 . 1 1 . . A 222 PRO CG . 18000 1 289 . 1 1 23 23 PRO CD C 13 49.25 0.20 . 1 1 . . A 222 PRO CD . 18000 1 290 . 1 1 24 24 THR H H 1 8.48 0.03 . 1 1 . . A 223 THR H . 18000 1 291 . 1 1 24 24 THR HA H 1 4.54 0.03 . 1 1 . . A 223 THR HA . 18000 1 292 . 1 1 24 24 THR HB H 1 4.09 0.03 . 1 1 . . A 223 THR HB . 18000 1 293 . 1 1 24 24 THR HG1 H 1 5.09 0.03 . 1 1 . . A 223 THR HG1 . 18000 1 294 . 1 1 24 24 THR HG21 H 1 1.18 0.03 . 1 1 . . A 223 THR HG21 . 18000 1 295 . 1 1 24 24 THR HG22 H 1 1.18 0.03 . 1 1 . . A 223 THR HG22 . 18000 1 296 . 1 1 24 24 THR HG23 H 1 1.18 0.03 . 1 1 . . A 223 THR HG23 . 18000 1 297 . 1 1 24 24 THR C C 13 171.38 0.20 . 1 1 . . A 223 THR C . 18000 1 298 . 1 1 24 24 THR CA C 13 58.47 0.20 . 1 1 . . A 223 THR CA . 18000 1 299 . 1 1 24 24 THR CB C 13 70.63 0.20 . 1 1 . . A 223 THR CB . 18000 1 300 . 1 1 24 24 THR CG2 C 13 19.62 0.20 . 1 1 . . A 223 THR CG2 . 18000 1 301 . 1 1 24 24 THR N N 15 114.73 0.30 . 1 1 . . A 223 THR N . 18000 1 302 . 1 1 25 25 GLN H H 1 8.63 0.03 . 1 1 . . A 224 GLN H . 18000 1 303 . 1 1 25 25 GLN HA H 1 4.16 0.03 . 1 1 . . A 224 GLN HA . 18000 1 304 . 1 1 25 25 GLN HB3 H 1 2.11 0.03 . 2 1 . . A 224 GLN HB3 . 18000 1 305 . 1 1 25 25 GLN HG2 H 1 2.43 0.03 . 2 1 . . A 224 GLN HG2 . 18000 1 306 . 1 1 25 25 GLN HG3 H 1 2.75 0.03 . 2 1 . . A 224 GLN HG3 . 18000 1 307 . 1 1 25 25 GLN HE21 H 1 7.15 0.03 . 2 1 . . A 224 GLN HE21 . 18000 1 308 . 1 1 25 25 GLN HE22 H 1 7.72 0.03 . 2 1 . . A 224 GLN HE22 . 18000 1 309 . 1 1 25 25 GLN C C 13 173.14 0.20 . 1 1 . . A 224 GLN C . 18000 1 310 . 1 1 25 25 GLN CA C 13 53.91 0.20 . 1 1 . . A 224 GLN CA . 18000 1 311 . 1 1 25 25 GLN CB C 13 26.96 0.20 . 1 1 . . A 224 GLN CB . 18000 1 312 . 1 1 25 25 GLN CG C 13 32.55 0.20 . 1 1 . . A 224 GLN CG . 18000 1 313 . 1 1 25 25 GLN N N 15 122.36 0.30 . 1 1 . . A 224 GLN N . 18000 1 314 . 1 1 25 25 GLN NE2 N 15 111.97 0.30 . 1 1 . . A 224 GLN NE2 . 18000 1 315 . 1 1 26 26 PHE H H 1 7.71 0.03 . 1 1 . . A 225 PHE H . 18000 1 316 . 1 1 26 26 PHE HA H 1 3.99 0.03 . 1 1 . . A 225 PHE HA . 18000 1 317 . 1 1 26 26 PHE HB2 H 1 1.55 0.03 . 2 1 . . A 225 PHE HB2 . 18000 1 318 . 1 1 26 26 PHE HB3 H 1 2.58 0.03 . 2 1 . . A 225 PHE HB3 . 18000 1 319 . 1 1 26 26 PHE HD1 H 1 6.76 0.03 . 3 1 . . A 225 PHE HD1 . 18000 1 320 . 1 1 26 26 PHE HE1 H 1 7.28 0.03 . 3 1 . . A 225 PHE HE1 . 18000 1 321 . 1 1 26 26 PHE HZ H 1 6.89 0.03 . 1 1 . . A 225 PHE HZ . 18000 1 322 . 1 1 26 26 PHE C C 13 171.08 0.20 . 1 1 . . A 225 PHE C . 18000 1 323 . 1 1 26 26 PHE CA C 13 58.42 0.20 . 1 1 . . A 225 PHE CA . 18000 1 324 . 1 1 26 26 PHE CB C 13 36.69 0.20 . 1 1 . . A 225 PHE CB . 18000 1 325 . 1 1 26 26 PHE N N 15 113.57 0.30 . 1 1 . . A 225 PHE N . 18000 1 326 . 1 1 27 27 GLN H H 1 6.21 0.03 . 1 1 . . A 226 GLN H . 18000 1 327 . 1 1 27 27 GLN HA H 1 4.38 0.03 . 1 1 . . A 226 GLN HA . 18000 1 328 . 1 1 27 27 GLN HB2 H 1 1.66 0.03 . 2 1 . . A 226 GLN HB2 . 18000 1 329 . 1 1 27 27 GLN HB3 H 1 1.79 0.03 . 2 1 . . A 226 GLN HB3 . 18000 1 330 . 1 1 27 27 GLN HG2 H 1 2.12 0.03 . 2 1 . . A 226 GLN HG2 . 18000 1 331 . 1 1 27 27 GLN HG3 H 1 2.18 0.03 . 2 1 . . A 226 GLN HG3 . 18000 1 332 . 1 1 27 27 GLN HE21 H 1 6.85 0.03 . 2 1 . . A 226 GLN HE21 . 18000 1 333 . 1 1 27 27 GLN HE22 H 1 7.64 0.03 . 2 1 . . A 226 GLN HE22 . 18000 1 334 . 1 1 27 27 GLN C C 13 171.79 0.20 . 1 1 . . A 226 GLN C . 18000 1 335 . 1 1 27 27 GLN CA C 13 52.20 0.20 . 1 1 . . A 226 GLN CA . 18000 1 336 . 1 1 27 27 GLN CB C 13 30.98 0.20 . 1 1 . . A 226 GLN CB . 18000 1 337 . 1 1 27 27 GLN CG C 13 31.64 0.20 . 1 1 . . A 226 GLN CG . 18000 1 338 . 1 1 27 27 GLN N N 15 121.54 0.30 . 1 1 . . A 226 GLN N . 18000 1 339 . 1 1 27 27 GLN NE2 N 15 112.09 0.30 . 1 1 . . A 226 GLN NE2 . 18000 1 340 . 1 1 28 28 LEU H H 1 8.54 0.03 . 1 1 . . A 227 LEU H . 18000 1 341 . 1 1 28 28 LEU HA H 1 4.15 0.03 . 1 1 . . A 227 LEU HA . 18000 1 342 . 1 1 28 28 LEU HB2 H 1 1.00 0.03 . 2 1 . . A 227 LEU HB2 . 18000 1 343 . 1 1 28 28 LEU HB3 H 1 1.33 0.03 . 2 1 . . A 227 LEU HB3 . 18000 1 344 . 1 1 28 28 LEU HG H 1 1.75 0.03 . 1 1 . . A 227 LEU HG . 18000 1 345 . 1 1 28 28 LEU HD11 H 1 0.89 0.03 . 2 1 . . A 227 LEU HD11 . 18000 1 346 . 1 1 28 28 LEU HD12 H 1 0.89 0.03 . 2 1 . . A 227 LEU HD12 . 18000 1 347 . 1 1 28 28 LEU HD13 H 1 0.89 0.03 . 2 1 . . A 227 LEU HD13 . 18000 1 348 . 1 1 28 28 LEU HD21 H 1 0.59 0.03 . 2 1 . . A 227 LEU HD21 . 18000 1 349 . 1 1 28 28 LEU HD22 H 1 0.59 0.03 . 2 1 . . A 227 LEU HD22 . 18000 1 350 . 1 1 28 28 LEU HD23 H 1 0.59 0.03 . 2 1 . . A 227 LEU HD23 . 18000 1 351 . 1 1 28 28 LEU C C 13 173.22 0.20 . 1 1 . . A 227 LEU C . 18000 1 352 . 1 1 28 28 LEU CA C 13 50.33 0.20 . 1 1 . . A 227 LEU CA . 18000 1 353 . 1 1 28 28 LEU CB C 13 39.69 0.20 . 1 1 . . A 227 LEU CB . 18000 1 354 . 1 1 28 28 LEU CG C 13 24.46 0.20 . 1 1 . . A 227 LEU CG . 18000 1 355 . 1 1 28 28 LEU CD1 C 13 22.64 0.20 . 2 1 . . A 227 LEU CD1 . 18000 1 356 . 1 1 28 28 LEU CD2 C 13 23.43 0.20 . 2 1 . . A 227 LEU CD2 . 18000 1 357 . 1 1 28 28 LEU N N 15 122.76 0.30 . 1 1 . . A 227 LEU N . 18000 1 358 . 1 1 29 29 PRO HA H 1 4.33 0.03 . 1 1 . . A 228 PRO HA . 18000 1 359 . 1 1 29 29 PRO HB2 H 1 1.91 0.03 . 2 1 . . A 228 PRO HB2 . 18000 1 360 . 1 1 29 29 PRO HB3 H 1 2.39 0.03 . 2 1 . . A 228 PRO HB3 . 18000 1 361 . 1 1 29 29 PRO HG2 H 1 1.98 0.03 . 2 1 . . A 228 PRO HG2 . 18000 1 362 . 1 1 29 29 PRO HG3 H 1 2.06 0.03 . 2 1 . . A 228 PRO HG3 . 18000 1 363 . 1 1 29 29 PRO HD2 H 1 3.36 0.03 . 2 1 . . A 228 PRO HD2 . 18000 1 364 . 1 1 29 29 PRO HD3 H 1 3.64 0.03 . 2 1 . . A 228 PRO HD3 . 18000 1 365 . 1 1 29 29 PRO C C 13 175.38 0.20 . 1 1 . . A 228 PRO C . 18000 1 366 . 1 1 29 29 PRO CA C 13 60.84 0.20 . 1 1 . . A 228 PRO CA . 18000 1 367 . 1 1 29 29 PRO CB C 13 30.64 0.20 . 1 1 . . A 228 PRO CB . 18000 1 368 . 1 1 29 29 PRO CG C 13 25.84 0.20 . 1 1 . . A 228 PRO CG . 18000 1 369 . 1 1 29 29 PRO CD C 13 48.69 0.20 . 1 1 . . A 228 PRO CD . 18000 1 370 . 1 1 30 30 ASN H H 1 8.73 0.03 . 1 1 . . A 229 ASN H . 18000 1 371 . 1 1 30 30 ASN HA H 1 4.24 0.03 . 1 1 . . A 229 ASN HA . 18000 1 372 . 1 1 30 30 ASN HB3 H 1 2.65 0.03 . 2 1 . . A 229 ASN HB3 . 18000 1 373 . 1 1 30 30 ASN HD21 H 1 6.89 0.03 . 2 1 . . A 229 ASN HD21 . 18000 1 374 . 1 1 30 30 ASN HD22 H 1 7.61 0.03 . 2 1 . . A 229 ASN HD22 . 18000 1 375 . 1 1 30 30 ASN C C 13 174.87 0.20 . 1 1 . . A 229 ASN C . 18000 1 376 . 1 1 30 30 ASN CA C 13 54.10 0.20 . 1 1 . . A 229 ASN CA . 18000 1 377 . 1 1 30 30 ASN CB C 13 36.54 0.20 . 1 1 . . A 229 ASN CB . 18000 1 378 . 1 1 30 30 ASN N N 15 121.89 0.30 . 1 1 . . A 229 ASN N . 18000 1 379 . 1 1 30 30 ASN ND2 N 15 112.83 0.30 . 1 1 . . A 229 ASN ND2 . 18000 1 380 . 1 1 31 31 GLU H H 1 9.13 0.03 . 1 1 . . A 230 GLU H . 18000 1 381 . 1 1 31 31 GLU HA H 1 4.09 0.03 . 1 1 . . A 230 GLU HA . 18000 1 382 . 1 1 31 31 GLU HB3 H 1 1.96 0.03 . 2 1 . . A 230 GLU HB3 . 18000 1 383 . 1 1 31 31 GLU HG3 H 1 2.18 0.03 . 2 1 . . A 230 GLU HG3 . 18000 1 384 . 1 1 31 31 GLU C C 13 175.19 0.20 . 1 1 . . A 230 GLU C . 18000 1 385 . 1 1 31 31 GLU CA C 13 56.86 0.20 . 1 1 . . A 230 GLU CA . 18000 1 386 . 1 1 31 31 GLU CB C 13 26.78 0.20 . 1 1 . . A 230 GLU CB . 18000 1 387 . 1 1 31 31 GLU CG C 13 34.38 0.20 . 1 1 . . A 230 GLU CG . 18000 1 388 . 1 1 31 31 GLU N N 15 116.44 0.30 . 1 1 . . A 230 GLU N . 18000 1 389 . 1 1 32 32 LEU H H 1 7.53 0.03 . 1 1 . . A 231 LEU H . 18000 1 390 . 1 1 32 32 LEU HA H 1 4.33 0.03 . 1 1 . . A 231 LEU HA . 18000 1 391 . 1 1 32 32 LEU HB2 H 1 1.44 0.03 . 2 1 . . A 231 LEU HB2 . 18000 1 392 . 1 1 32 32 LEU HB3 H 1 1.58 0.03 . 2 1 . . A 231 LEU HB3 . 18000 1 393 . 1 1 32 32 LEU HG H 1 1.55 0.03 . 1 1 . . A 231 LEU HG . 18000 1 394 . 1 1 32 32 LEU HD11 H 1 0.90 0.03 . 2 1 . . A 231 LEU HD11 . 18000 1 395 . 1 1 32 32 LEU HD12 H 1 0.90 0.03 . 2 1 . . A 231 LEU HD12 . 18000 1 396 . 1 1 32 32 LEU HD13 H 1 0.90 0.03 . 2 1 . . A 231 LEU HD13 . 18000 1 397 . 1 1 32 32 LEU HD21 H 1 0.82 0.03 . 2 1 . . A 231 LEU HD21 . 18000 1 398 . 1 1 32 32 LEU HD22 H 1 0.82 0.03 . 2 1 . . A 231 LEU HD22 . 18000 1 399 . 1 1 32 32 LEU HD23 H 1 0.82 0.03 . 2 1 . . A 231 LEU HD23 . 18000 1 400 . 1 1 32 32 LEU C C 13 174.90 0.20 . 1 1 . . A 231 LEU C . 18000 1 401 . 1 1 32 32 LEU CA C 13 53.53 0.20 . 1 1 . . A 231 LEU CA . 18000 1 402 . 1 1 32 32 LEU CB C 13 40.76 0.20 . 1 1 . . A 231 LEU CB . 18000 1 403 . 1 1 32 32 LEU CG C 13 25.95 0.20 . 1 1 . . A 231 LEU CG . 18000 1 404 . 1 1 32 32 LEU CD1 C 13 24.33 0.20 . 2 1 . . A 231 LEU CD1 . 18000 1 405 . 1 1 32 32 LEU CD2 C 13 21.78 0.20 . 2 1 . . A 231 LEU CD2 . 18000 1 406 . 1 1 32 32 LEU N N 15 116.89 0.30 . 1 1 . . A 231 LEU N . 18000 1 407 . 1 1 33 33 THR H H 1 7.21 0.03 . 1 1 . . A 232 THR H . 18000 1 408 . 1 1 33 33 THR HA H 1 3.90 0.03 . 1 1 . . A 232 THR HA . 18000 1 409 . 1 1 33 33 THR HB H 1 3.86 0.03 . 1 1 . . A 232 THR HB . 18000 1 410 . 1 1 33 33 THR HG21 H 1 0.31 0.03 . 1 1 . . A 232 THR HG21 . 18000 1 411 . 1 1 33 33 THR HG22 H 1 0.31 0.03 . 1 1 . . A 232 THR HG22 . 18000 1 412 . 1 1 33 33 THR HG23 H 1 0.31 0.03 . 1 1 . . A 232 THR HG23 . 18000 1 413 . 1 1 33 33 THR C C 13 173.00 0.20 . 1 1 . . A 232 THR C . 18000 1 414 . 1 1 33 33 THR CA C 13 59.89 0.20 . 1 1 . . A 232 THR CA . 18000 1 415 . 1 1 33 33 THR CB C 13 67.39 0.20 . 1 1 . . A 232 THR CB . 18000 1 416 . 1 1 33 33 THR CG2 C 13 19.72 0.20 . 1 1 . . A 232 THR CG2 . 18000 1 417 . 1 1 33 33 THR N N 15 119.95 0.30 . 1 1 . . A 232 THR N . 18000 1 418 . 1 1 34 34 CYS H H 1 7.82 0.03 . 1 1 . . A 233 CYS H . 18000 1 419 . 1 1 34 34 CYS HA H 1 4.46 0.03 . 1 1 . . A 233 CYS HA . 18000 1 420 . 1 1 34 34 CYS HB2 H 1 2.82 0.03 . 2 1 . . A 233 CYS HB2 . 18000 1 421 . 1 1 34 34 CYS HB3 H 1 2.89 0.03 . 2 1 . . A 233 CYS HB3 . 18000 1 422 . 1 1 34 34 CYS C C 13 173.03 0.20 . 1 1 . . A 233 CYS C . 18000 1 423 . 1 1 34 34 CYS CA C 13 57.02 0.20 . 1 1 . . A 233 CYS CA . 18000 1 424 . 1 1 34 34 CYS CB C 13 25.67 0.20 . 1 1 . . A 233 CYS CB . 18000 1 425 . 1 1 34 34 CYS N N 15 119.75 0.30 . 1 1 . . A 233 CYS N . 18000 1 426 . 1 1 35 35 THR H H 1 8.06 0.03 . 1 1 . . A 234 THR H . 18000 1 427 . 1 1 35 35 THR HA H 1 4.35 0.03 . 1 1 . . A 234 THR HA . 18000 1 428 . 1 1 35 35 THR HB H 1 4.25 0.03 . 1 1 . . A 234 THR HB . 18000 1 429 . 1 1 35 35 THR HG21 H 1 1.17 0.03 . 1 1 . . A 234 THR HG21 . 18000 1 430 . 1 1 35 35 THR HG22 H 1 1.17 0.03 . 1 1 . . A 234 THR HG22 . 18000 1 431 . 1 1 35 35 THR HG23 H 1 1.17 0.03 . 1 1 . . A 234 THR HG23 . 18000 1 432 . 1 1 35 35 THR C C 13 172.75 0.20 . 1 1 . . A 234 THR C . 18000 1 433 . 1 1 35 35 THR CA C 13 60.16 0.20 . 1 1 . . A 234 THR CA . 18000 1 434 . 1 1 35 35 THR CB C 13 67.59 0.20 . 1 1 . . A 234 THR CB . 18000 1 435 . 1 1 35 35 THR CG2 C 13 19.77 0.20 . 1 1 . . A 234 THR CG2 . 18000 1 436 . 1 1 35 35 THR N N 15 115.29 0.30 . 1 1 . . A 234 THR N . 18000 1 437 . 1 1 36 36 THR H H 1 7.95 0.03 . 1 1 . . A 235 THR H . 18000 1 438 . 1 1 36 36 THR HA H 1 4.27 0.03 . 1 1 . . A 235 THR HA . 18000 1 439 . 1 1 36 36 THR HB H 1 4.15 0.03 . 1 1 . . A 235 THR HB . 18000 1 440 . 1 1 36 36 THR HG21 H 1 1.15 0.03 . 1 1 . . A 235 THR HG21 . 18000 1 441 . 1 1 36 36 THR HG22 H 1 1.15 0.03 . 1 1 . . A 235 THR HG22 . 18000 1 442 . 1 1 36 36 THR HG23 H 1 1.15 0.03 . 1 1 . . A 235 THR HG23 . 18000 1 443 . 1 1 36 36 THR C C 13 171.93 0.20 . 1 1 . . A 235 THR C . 18000 1 444 . 1 1 36 36 THR CA C 13 59.98 0.20 . 1 1 . . A 235 THR CA . 18000 1 445 . 1 1 36 36 THR CB C 13 67.86 0.20 . 1 1 . . A 235 THR CB . 18000 1 446 . 1 1 36 36 THR CG2 C 13 19.82 0.20 . 1 1 . . A 235 THR CG2 . 18000 1 447 . 1 1 36 36 THR N N 15 115.94 0.30 . 1 1 . . A 235 THR N . 18000 1 448 . 1 1 37 37 ALA H H 1 8.17 0.03 . 1 1 . . A 236 ALA H . 18000 1 449 . 1 1 37 37 ALA HA H 1 4.29 0.03 . 1 1 . . A 236 ALA HA . 18000 1 450 . 1 1 37 37 ALA HB1 H 1 1.30 0.03 . 1 1 . . A 236 ALA HB1 . 18000 1 451 . 1 1 37 37 ALA HB2 H 1 1.30 0.03 . 1 1 . . A 236 ALA HB2 . 18000 1 452 . 1 1 37 37 ALA HB3 H 1 1.30 0.03 . 1 1 . . A 236 ALA HB3 . 18000 1 453 . 1 1 37 37 ALA C C 13 175.22 0.20 . 1 1 . . A 236 ALA C . 18000 1 454 . 1 1 37 37 ALA CA C 13 50.23 0.20 . 1 1 . . A 236 ALA CA . 18000 1 455 . 1 1 37 37 ALA CB C 13 17.36 0.20 . 1 1 . . A 236 ALA CB . 18000 1 456 . 1 1 37 37 ALA N N 15 113.79 0.30 . 1 1 . . A 236 ALA N . 18000 1 457 . 1 1 38 38 LEU H H 1 8.20 0.03 . 1 1 . . A 237 LEU H . 18000 1 458 . 1 1 38 38 LEU HA H 1 4.54 0.03 . 1 1 . . A 237 LEU HA . 18000 1 459 . 1 1 38 38 LEU HB2 H 1 1.50 0.03 . 2 1 . . A 237 LEU HB2 . 18000 1 460 . 1 1 38 38 LEU HB3 H 1 1.54 0.03 . 2 1 . . A 237 LEU HB3 . 18000 1 461 . 1 1 38 38 LEU HG H 1 1.64 0.03 . 1 1 . . A 237 LEU HG . 18000 1 462 . 1 1 38 38 LEU HD11 H 1 0.89 0.03 . 2 1 . . A 237 LEU HD11 . 18000 1 463 . 1 1 38 38 LEU HD12 H 1 0.89 0.03 . 2 1 . . A 237 LEU HD12 . 18000 1 464 . 1 1 38 38 LEU HD13 H 1 0.89 0.03 . 2 1 . . A 237 LEU HD13 . 18000 1 465 . 1 1 38 38 LEU HD21 H 1 0.86 0.03 . 2 1 . . A 237 LEU HD21 . 18000 1 466 . 1 1 38 38 LEU HD22 H 1 0.86 0.03 . 2 1 . . A 237 LEU HD22 . 18000 1 467 . 1 1 38 38 LEU HD23 H 1 0.86 0.03 . 2 1 . . A 237 LEU HD23 . 18000 1 468 . 1 1 38 38 LEU C C 13 173.56 0.20 . 1 1 . . A 237 LEU C . 18000 1 469 . 1 1 38 38 LEU CA C 13 51.11 0.20 . 1 1 . . A 237 LEU CA . 18000 1 470 . 1 1 38 38 LEU CB C 13 39.59 0.20 . 1 1 . . A 237 LEU CB . 18000 1 471 . 1 1 38 38 LEU CG C 13 25.17 0.20 . 1 1 . . A 237 LEU CG . 18000 1 472 . 1 1 38 38 LEU CD1 C 13 23.35 0.20 . 2 1 . . A 237 LEU CD1 . 18000 1 473 . 1 1 38 38 LEU CD2 C 13 21.51 0.20 . 2 1 . . A 237 LEU CD2 . 18000 1 474 . 1 1 38 38 LEU N N 15 122.92 0.30 . 1 1 . . A 237 LEU N . 18000 1 475 . 1 1 39 39 PRO HA H 1 4.37 0.03 . 1 1 . . A 238 PRO HA . 18000 1 476 . 1 1 39 39 PRO HB2 H 1 1.89 0.03 . 2 1 . . A 238 PRO HB2 . 18000 1 477 . 1 1 39 39 PRO HB3 H 1 2.26 0.03 . 2 1 . . A 238 PRO HB3 . 18000 1 478 . 1 1 39 39 PRO HG2 H 1 1.98 0.03 . 2 1 . . A 238 PRO HG2 . 18000 1 479 . 1 1 39 39 PRO HG3 H 1 2.02 0.03 . 2 1 . . A 238 PRO HG3 . 18000 1 480 . 1 1 39 39 PRO HD2 H 1 3.60 0.03 . 2 1 . . A 238 PRO HD2 . 18000 1 481 . 1 1 39 39 PRO HD3 H 1 3.81 0.03 . 2 1 . . A 238 PRO HD3 . 18000 1 482 . 1 1 39 39 PRO C C 13 175.61 0.20 . 1 1 . . A 238 PRO C . 18000 1 483 . 1 1 39 39 PRO CA C 13 61.57 0.20 . 1 1 . . A 238 PRO CA . 18000 1 484 . 1 1 39 39 PRO CB C 13 30.21 0.20 . 1 1 . . A 238 PRO CB . 18000 1 485 . 1 1 39 39 PRO CG C 13 25.74 0.20 . 1 1 . . A 238 PRO CG . 18000 1 486 . 1 1 39 39 PRO CD C 13 48.84 0.20 . 1 1 . . A 238 PRO CD . 18000 1 487 . 1 1 40 40 GLY H H 1 8.48 0.03 . 1 1 . . A 239 GLY H . 18000 1 488 . 1 1 40 40 GLY HA3 H 1 3.95 0.03 . 2 1 . . A 239 GLY HA3 . 18000 1 489 . 1 1 40 40 GLY C C 13 172.31 0.20 . 1 1 . . A 239 GLY C . 18000 1 490 . 1 1 40 40 GLY CA C 13 43.31 0.20 . 1 1 . . A 239 GLY CA . 18000 1 491 . 1 1 40 40 GLY N N 15 122.12 0.30 . 1 1 . . A 239 GLY N . 18000 1 492 . 1 1 41 41 SER H H 1 8.09 0.03 . 1 1 . . A 240 SER H . 18000 1 493 . 1 1 41 41 SER HA H 1 4.48 0.03 . 1 1 . . A 240 SER HA . 18000 1 494 . 1 1 41 41 SER HB2 H 1 3.84 0.03 . 2 1 . . A 240 SER HB2 . 18000 1 495 . 1 1 41 41 SER HB3 H 1 3.88 0.03 . 2 1 . . A 240 SER HB3 . 18000 1 496 . 1 1 41 41 SER C C 13 171.79 0.20 . 1 1 . . A 240 SER C . 18000 1 497 . 1 1 41 41 SER CA C 13 56.44 0.20 . 1 1 . . A 240 SER CA . 18000 1 498 . 1 1 41 41 SER CB C 13 62.24 0.20 . 1 1 . . A 240 SER CB . 18000 1 499 . 1 1 41 41 SER N N 15 115.39 0.30 . 1 1 . . A 240 SER N . 18000 1 500 . 1 1 42 42 SER H H 1 7.98 0.03 . 1 1 . . A 241 SER H . 18000 1 501 . 1 1 42 42 SER HA H 1 4.25 0.03 . 1 1 . . A 241 SER HA . 18000 1 502 . 1 1 42 42 SER HB3 H 1 3.81 0.03 . 2 1 . . A 241 SER HB3 . 18000 1 503 . 1 1 42 42 SER C C 13 176.67 0.20 . 1 1 . . A 241 SER C . 18000 1 504 . 1 1 42 42 SER CA C 13 58.16 0.20 . 1 1 . . A 241 SER CA . 18000 1 505 . 1 1 42 42 SER CB C 13 62.91 0.20 . 1 1 . . A 241 SER CB . 18000 1 506 . 1 1 42 42 SER N N 15 122.65 0.30 . 1 1 . . A 241 SER N . 18000 1 507 . 2 2 2 2 ASN HA H 1 4.70 0.03 . 1 1 . . B 153 ASN HA . 18000 1 508 . 2 2 2 2 ASN HB2 H 1 2.70 0.03 . 2 1 . . B 153 ASN HB2 . 18000 1 509 . 2 2 2 2 ASN HB3 H 1 2.78 0.03 . 2 1 . . B 153 ASN HB3 . 18000 1 510 . 2 2 2 2 ASN C C 13 172.74 0.20 . 1 1 . . B 153 ASN C . 18000 1 511 . 2 2 2 2 ASN CA C 13 51.38 0.20 . 1 1 . . B 153 ASN CA . 18000 1 512 . 2 2 2 2 ASN CB C 13 37.06 0.20 . 1 1 . . B 153 ASN CB . 18000 1 513 . 2 2 3 3 ALA H H 1 8.27 0.03 . 1 1 . . B 154 ALA H . 18000 1 514 . 2 2 3 3 ALA HA H 1 4.23 0.03 . 1 1 . . B 154 ALA HA . 18000 1 515 . 2 2 3 3 ALA HB1 H 1 1.29 0.03 . 1 1 . . B 154 ALA HB1 . 18000 1 516 . 2 2 3 3 ALA HB2 H 1 1.29 0.03 . 1 1 . . B 154 ALA HB2 . 18000 1 517 . 2 2 3 3 ALA HB3 H 1 1.29 0.03 . 1 1 . . B 154 ALA HB3 . 18000 1 518 . 2 2 3 3 ALA C C 13 175.15 0.20 . 1 1 . . B 154 ALA C . 18000 1 519 . 2 2 3 3 ALA CA C 13 50.56 0.20 . 1 1 . . B 154 ALA CA . 18000 1 520 . 2 2 3 3 ALA CB C 13 17.40 0.20 . 1 1 . . B 154 ALA CB . 18000 1 521 . 2 2 3 3 ALA N N 15 123.95 0.30 . 1 1 . . B 154 ALA N . 18000 1 522 . 2 2 4 4 GLU H H 1 8.16 0.03 . 1 1 . . B 155 GLU H . 18000 1 523 . 2 2 4 4 GLU HA H 1 4.12 0.03 . 1 1 . . B 155 GLU HA . 18000 1 524 . 2 2 4 4 GLU HB3 H 1 1.86 0.03 . 2 1 . . B 155 GLU HB3 . 18000 1 525 . 2 2 4 4 GLU HG3 H 1 2.11 0.03 . 2 1 . . B 155 GLU HG3 . 18000 1 526 . 2 2 4 4 GLU C C 13 174.17 0.20 . 1 1 . . B 155 GLU C . 18000 1 527 . 2 2 4 4 GLU CA C 13 54.55 0.20 . 1 1 . . B 155 GLU CA . 18000 1 528 . 2 2 4 4 GLU CB C 13 28.71 0.20 . 1 1 . . B 155 GLU CB . 18000 1 529 . 2 2 4 4 GLU CG C 13 34.35 0.20 . 1 1 . . B 155 GLU CG . 18000 1 530 . 2 2 4 4 GLU N N 15 119.35 0.30 . 1 1 . . B 155 GLU N . 18000 1 531 . 2 2 5 5 VAL H H 1 8.00 0.03 . 1 1 . . B 156 VAL H . 18000 1 532 . 2 2 5 5 VAL HA H 1 3.97 0.03 . 1 1 . . B 156 VAL HA . 18000 1 533 . 2 2 5 5 VAL HB H 1 2.01 0.03 . 1 1 . . B 156 VAL HB . 18000 1 534 . 2 2 5 5 VAL HG11 H 1 0.87 0.03 . 2 1 . . B 156 VAL HG11 . 18000 1 535 . 2 2 5 5 VAL HG12 H 1 0.87 0.03 . 2 1 . . B 156 VAL HG12 . 18000 1 536 . 2 2 5 5 VAL HG13 H 1 0.87 0.03 . 2 1 . . B 156 VAL HG13 . 18000 1 537 . 2 2 5 5 VAL HG21 H 1 0.86 0.03 . 2 1 . . B 156 VAL HG21 . 18000 1 538 . 2 2 5 5 VAL HG22 H 1 0.86 0.03 . 2 1 . . B 156 VAL HG22 . 18000 1 539 . 2 2 5 5 VAL HG23 H 1 0.86 0.03 . 2 1 . . B 156 VAL HG23 . 18000 1 540 . 2 2 5 5 VAL C C 13 173.31 0.20 . 1 1 . . B 156 VAL C . 18000 1 541 . 2 2 5 5 VAL CA C 13 60.44 0.20 . 1 1 . . B 156 VAL CA . 18000 1 542 . 2 2 5 5 VAL CB C 13 30.45 0.20 . 1 1 . . B 156 VAL CB . 18000 1 543 . 2 2 5 5 VAL CG1 C 13 19.28 0.20 . 2 1 . . B 156 VAL CG1 . 18000 1 544 . 2 2 5 5 VAL CG2 C 13 20.02 0.20 . 2 1 . . B 156 VAL CG2 . 18000 1 545 . 2 2 5 5 VAL N N 15 123.31 0.30 . 1 1 . . B 156 VAL N . 18000 1 546 . 2 2 6 6 LYS H H 1 8.32 0.03 . 1 1 . . B 157 LYS H . 18000 1 547 . 2 2 6 6 LYS HA H 1 4.30 0.03 . 1 1 . . B 157 LYS HA . 18000 1 548 . 2 2 6 6 LYS HB2 H 1 1.66 0.03 . 2 1 . . B 157 LYS HB2 . 18000 1 549 . 2 2 6 6 LYS HB3 H 1 1.73 0.03 . 2 1 . . B 157 LYS HB3 . 18000 1 550 . 2 2 6 6 LYS HG3 H 1 1.33 0.03 . 2 1 . . B 157 LYS HG3 . 18000 1 551 . 2 2 6 6 LYS HD3 H 1 1.59 0.03 . 2 1 . . B 157 LYS HD3 . 18000 1 552 . 2 2 6 6 LYS HE2 H 1 2.67 0.03 . 2 1 . . B 157 LYS HE2 . 18000 1 553 . 2 2 6 6 LYS HE3 H 1 2.78 0.03 . 2 1 . . B 157 LYS HE3 . 18000 1 554 . 2 2 6 6 LYS C C 13 173.34 0.20 . 1 1 . . B 157 LYS C . 18000 1 555 . 2 2 6 6 LYS CA C 13 54.12 0.20 . 1 1 . . B 157 LYS CA . 18000 1 556 . 2 2 6 6 LYS CB C 13 31.84 0.20 . 1 1 . . B 157 LYS CB . 18000 1 557 . 2 2 6 6 LYS CG C 13 23.13 0.20 . 1 1 . . B 157 LYS CG . 18000 1 558 . 2 2 6 6 LYS CD C 13 27.23 0.20 . 1 1 . . B 157 LYS CD . 18000 1 559 . 2 2 6 6 LYS CE C 13 39.90 0.20 . 1 1 . . B 157 LYS CE . 18000 1 560 . 2 2 6 6 LYS N N 15 124.96 0.30 . 1 1 . . B 157 LYS N . 18000 1 561 . 2 2 7 7 VAL H H 1 7.90 0.03 . 1 1 . . B 158 VAL H . 18000 1 562 . 2 2 7 7 VAL HA H 1 4.40 0.03 . 1 1 . . B 158 VAL HA . 18000 1 563 . 2 2 7 7 VAL HB H 1 2.03 0.03 . 1 1 . . B 158 VAL HB . 18000 1 564 . 2 2 7 7 VAL HG11 H 1 0.83 0.03 . 2 1 . . B 158 VAL HG11 . 18000 1 565 . 2 2 7 7 VAL HG12 H 1 0.83 0.03 . 2 1 . . B 158 VAL HG12 . 18000 1 566 . 2 2 7 7 VAL HG13 H 1 0.83 0.03 . 2 1 . . B 158 VAL HG13 . 18000 1 567 . 2 2 7 7 VAL HG21 H 1 0.74 0.03 . 2 1 . . B 158 VAL HG21 . 18000 1 568 . 2 2 7 7 VAL HG22 H 1 0.74 0.03 . 2 1 . . B 158 VAL HG22 . 18000 1 569 . 2 2 7 7 VAL HG23 H 1 0.74 0.03 . 2 1 . . B 158 VAL HG23 . 18000 1 570 . 2 2 7 7 VAL C C 13 173.54 0.20 . 1 1 . . B 158 VAL C . 18000 1 571 . 2 2 7 7 VAL CA C 13 59.53 0.20 . 1 1 . . B 158 VAL CA . 18000 1 572 . 2 2 7 7 VAL CB C 13 30.30 0.20 . 1 1 . . B 158 VAL CB . 18000 1 573 . 2 2 7 7 VAL CG1 C 13 19.46 0.20 . 2 1 . . B 158 VAL CG1 . 18000 1 574 . 2 2 7 7 VAL CG2 C 13 19.94 0.20 . 2 1 . . B 158 VAL CG2 . 18000 1 575 . 2 2 7 7 VAL N N 15 122.80 0.30 . 1 1 . . B 158 VAL N . 18000 1 576 . 2 2 8 8 LYS HA H 1 4.25 0.03 . 1 1 . . B 159 LYS HA . 18000 1 577 . 2 2 8 8 LYS HB3 H 1 1.54 0.03 . 2 1 . . B 159 LYS HB3 . 18000 1 578 . 2 2 8 8 LYS HG2 H 1 1.16 0.03 . 2 1 . . B 159 LYS HG2 . 18000 1 579 . 2 2 8 8 LYS HG3 H 1 1.30 0.03 . 2 1 . . B 159 LYS HG3 . 18000 1 580 . 2 2 8 8 LYS HD3 H 1 1.52 0.03 . 2 1 . . B 159 LYS HD3 . 18000 1 581 . 2 2 8 8 LYS HE3 H 1 2.86 0.03 . 2 1 . . B 159 LYS HE3 . 18000 1 582 . 2 2 8 8 LYS C C 13 173.60 0.20 . 1 1 . . B 159 LYS C . 18000 1 583 . 2 2 8 8 LYS CA C 13 53.74 0.20 . 1 1 . . B 159 LYS CA . 18000 1 584 . 2 2 8 8 LYS CB C 13 30.27 0.20 . 1 1 . . B 159 LYS CB . 18000 1 585 . 2 2 8 8 LYS CG C 13 23.15 0.20 . 1 1 . . B 159 LYS CG . 18000 1 586 . 2 2 8 8 LYS CD C 13 27.31 0.20 . 1 1 . . B 159 LYS CD . 18000 1 587 . 2 2 8 8 LYS CE C 13 40.10 0.20 . 1 1 . . B 159 LYS CE . 18000 1 588 . 2 2 9 9 ILE H H 1 8.56 0.03 . 1 1 . . B 160 ILE H . 18000 1 589 . 2 2 9 9 ILE HA H 1 4.20 0.03 . 1 1 . . B 160 ILE HA . 18000 1 590 . 2 2 9 9 ILE HB H 1 1.87 0.03 . 1 1 . . B 160 ILE HB . 18000 1 591 . 2 2 9 9 ILE HG12 H 1 1.47 0.03 . 2 1 . . B 160 ILE HG12 . 18000 1 592 . 2 2 9 9 ILE HG21 H 1 0.85 0.03 . 1 1 . . B 160 ILE HG21 . 18000 1 593 . 2 2 9 9 ILE HG22 H 1 0.85 0.03 . 1 1 . . B 160 ILE HG22 . 18000 1 594 . 2 2 9 9 ILE HG23 H 1 0.85 0.03 . 1 1 . . B 160 ILE HG23 . 18000 1 595 . 2 2 9 9 ILE HD11 H 1 0.71 0.03 . 1 1 . . B 160 ILE HD11 . 18000 1 596 . 2 2 9 9 ILE HD12 H 1 0.71 0.03 . 1 1 . . B 160 ILE HD12 . 18000 1 597 . 2 2 9 9 ILE HD13 H 1 0.71 0.03 . 1 1 . . B 160 ILE HD13 . 18000 1 598 . 2 2 9 9 ILE CA C 13 55.50 0.20 . 1 1 . . B 160 ILE CA . 18000 1 599 . 2 2 9 9 ILE CB C 13 35.45 0.20 . 1 1 . . B 160 ILE CB . 18000 1 600 . 2 2 9 9 ILE CG1 C 13 25.72 0.20 . 1 1 . . B 160 ILE CG1 . 18000 1 601 . 2 2 9 9 ILE CG2 C 13 14.70 0.20 . 1 1 . . B 160 ILE CG2 . 18000 1 602 . 2 2 9 9 ILE CD1 C 13 8.86 0.20 . 1 1 . . B 160 ILE CD1 . 18000 1 603 . 2 2 9 9 ILE N N 15 127.51 0.30 . 1 1 . . B 160 ILE N . 18000 1 604 . 2 2 10 10 PRO HA H 1 4.32 0.03 . 1 1 . . B 161 PRO HA . 18000 1 605 . 2 2 10 10 PRO HB2 H 1 1.58 0.03 . 2 1 . . B 161 PRO HB2 . 18000 1 606 . 2 2 10 10 PRO HB3 H 1 2.55 0.03 . 2 1 . . B 161 PRO HB3 . 18000 1 607 . 2 2 10 10 PRO C C 13 175.25 0.20 . 1 1 . . B 161 PRO C . 18000 1 608 . 2 2 10 10 PRO CA C 13 61.61 0.20 . 1 1 . . B 161 PRO CA . 18000 1 609 . 2 2 10 10 PRO CB C 13 31.07 0.20 . 1 1 . . B 161 PRO CB . 18000 1 610 . 2 2 11 11 GLU H H 1 8.97 0.03 . 1 1 . . B 162 GLU H . 18000 1 611 . 2 2 11 11 GLU HA H 1 3.75 0.03 . 1 1 . . B 162 GLU HA . 18000 1 612 . 2 2 11 11 GLU HB2 H 1 1.95 0.03 . 2 1 . . B 162 GLU HB2 . 18000 1 613 . 2 2 11 11 GLU HB3 H 1 2.05 0.03 . 2 1 . . B 162 GLU HB3 . 18000 1 614 . 2 2 11 11 GLU HG3 H 1 2.40 0.03 . 2 1 . . B 162 GLU HG3 . 18000 1 615 . 2 2 11 11 GLU C C 13 177.27 0.20 . 1 1 . . B 162 GLU C . 18000 1 616 . 2 2 11 11 GLU CA C 13 57.78 0.20 . 1 1 . . B 162 GLU CA . 18000 1 617 . 2 2 11 11 GLU CB C 13 27.57 0.20 . 1 1 . . B 162 GLU CB . 18000 1 618 . 2 2 11 11 GLU CG C 13 34.04 0.20 . 1 1 . . B 162 GLU CG . 18000 1 619 . 2 2 11 11 GLU N N 15 124.59 0.30 . 1 1 . . B 162 GLU N . 18000 1 620 . 2 2 12 12 GLU H H 1 10.14 0.03 . 1 1 . . B 163 GLU H . 18000 1 621 . 2 2 12 12 GLU HA H 1 4.07 0.03 . 1 1 . . B 163 GLU HA . 18000 1 622 . 2 2 12 12 GLU HB2 H 1 1.92 0.03 . 2 1 . . B 163 GLU HB2 . 18000 1 623 . 2 2 12 12 GLU HB3 H 1 2.04 0.03 . 2 1 . . B 163 GLU HB3 . 18000 1 624 . 2 2 12 12 GLU HG3 H 1 2.36 0.03 . 2 1 . . B 163 GLU HG3 . 18000 1 625 . 2 2 12 12 GLU C C 13 175.78 0.20 . 1 1 . . B 163 GLU C . 18000 1 626 . 2 2 12 12 GLU CA C 13 57.55 0.20 . 1 1 . . B 163 GLU CA . 18000 1 627 . 2 2 12 12 GLU CB C 13 27.62 0.20 . 1 1 . . B 163 GLU CB . 18000 1 628 . 2 2 12 12 GLU CG C 13 34.94 0.20 . 1 1 . . B 163 GLU CG . 18000 1 629 . 2 2 12 12 GLU N N 15 116.03 0.30 . 1 1 . . B 163 GLU N . 18000 1 630 . 2 2 13 13 LEU H H 1 7.75 0.03 . 1 1 . . B 164 LEU H . 18000 1 631 . 2 2 13 13 LEU HA H 1 4.47 0.03 . 1 1 . . B 164 LEU HA . 18000 1 632 . 2 2 13 13 LEU HB2 H 1 1.41 0.03 . 2 1 . . B 164 LEU HB2 . 18000 1 633 . 2 2 13 13 LEU HB3 H 1 1.62 0.03 . 2 1 . . B 164 LEU HB3 . 18000 1 634 . 2 2 13 13 LEU HG H 1 1.32 0.03 . 1 1 . . B 164 LEU HG . 18000 1 635 . 2 2 13 13 LEU HD11 H 1 0.76 0.03 . 2 1 . . B 164 LEU HD11 . 18000 1 636 . 2 2 13 13 LEU HD12 H 1 0.76 0.03 . 2 1 . . B 164 LEU HD12 . 18000 1 637 . 2 2 13 13 LEU HD13 H 1 0.76 0.03 . 2 1 . . B 164 LEU HD13 . 18000 1 638 . 2 2 13 13 LEU HD21 H 1 0.52 0.03 . 2 1 . . B 164 LEU HD21 . 18000 1 639 . 2 2 13 13 LEU HD22 H 1 0.52 0.03 . 2 1 . . B 164 LEU HD22 . 18000 1 640 . 2 2 13 13 LEU HD23 H 1 0.52 0.03 . 2 1 . . B 164 LEU HD23 . 18000 1 641 . 2 2 13 13 LEU C C 13 174.81 0.20 . 1 1 . . B 164 LEU C . 18000 1 642 . 2 2 13 13 LEU CA C 13 52.56 0.20 . 1 1 . . B 164 LEU CA . 18000 1 643 . 2 2 13 13 LEU CB C 13 41.10 0.20 . 1 1 . . B 164 LEU CB . 18000 1 644 . 2 2 13 13 LEU CG C 13 25.55 0.20 . 1 1 . . B 164 LEU CG . 18000 1 645 . 2 2 13 13 LEU CD1 C 13 24.23 0.20 . 2 1 . . B 164 LEU CD1 . 18000 1 646 . 2 2 13 13 LEU CD2 C 13 21.38 0.20 . 2 1 . . B 164 LEU CD2 . 18000 1 647 . 2 2 13 13 LEU N N 15 114.62 0.30 . 1 1 . . B 164 LEU N . 18000 1 648 . 2 2 14 14 LYS H H 1 7.33 0.03 . 1 1 . . B 165 LYS H . 18000 1 649 . 2 2 14 14 LYS HA H 1 3.96 0.03 . 1 1 . . B 165 LYS HA . 18000 1 650 . 2 2 14 14 LYS HB2 H 1 1.87 0.03 . 2 1 . . B 165 LYS HB2 . 18000 1 651 . 2 2 14 14 LYS HB3 H 1 1.99 0.03 . 2 1 . . B 165 LYS HB3 . 18000 1 652 . 2 2 14 14 LYS HG2 H 1 1.45 0.03 . 2 1 . . B 165 LYS HG2 . 18000 1 653 . 2 2 14 14 LYS HG3 H 1 1.65 0.03 . 2 1 . . B 165 LYS HG3 . 18000 1 654 . 2 2 14 14 LYS C C 13 176.35 0.20 . 1 1 . . B 165 LYS C . 18000 1 655 . 2 2 14 14 LYS CA C 13 60.70 0.20 . 1 1 . . B 165 LYS CA . 18000 1 656 . 2 2 14 14 LYS CB C 13 28.30 0.20 . 1 1 . . B 165 LYS CB . 18000 1 657 . 2 2 14 14 LYS N N 15 120.04 0.30 . 1 1 . . B 165 LYS N . 18000 1 658 . 2 2 15 15 PRO HD2 H 1 3.51 0.03 . 2 1 . . B 166 PRO HD2 . 18000 1 659 . 2 2 15 15 PRO HD3 H 1 3.77 0.03 . 2 1 . . B 166 PRO HD3 . 18000 1 660 . 2 2 16 16 TRP HA H 1 4.34 0.03 . 1 1 . . B 167 TRP HA . 18000 1 661 . 2 2 16 16 TRP HE3 H 1 7.68 0.03 . 1 1 . . B 167 TRP HE3 . 18000 1 662 . 2 2 16 16 TRP HZ3 H 1 7.02 0.03 . 1 1 . . B 167 TRP HZ3 . 18000 1 663 . 2 2 16 16 TRP CA C 13 57.64 0.20 . 1 1 . . B 167 TRP CA . 18000 1 664 . 2 2 17 17 LEU H H 1 7.40 0.03 . 1 1 . . B 168 LEU H . 18000 1 665 . 2 2 17 17 LEU HA H 1 3.67 0.03 . 1 1 . . B 168 LEU HA . 18000 1 666 . 2 2 17 17 LEU HB2 H 1 1.48 0.03 . 2 1 . . B 168 LEU HB2 . 18000 1 667 . 2 2 17 17 LEU HB3 H 1 2.12 0.03 . 2 1 . . B 168 LEU HB3 . 18000 1 668 . 2 2 17 17 LEU HG H 1 1.78 0.03 . 1 1 . . B 168 LEU HG . 18000 1 669 . 2 2 17 17 LEU HD11 H 1 1.02 0.03 . 2 1 . . B 168 LEU HD11 . 18000 1 670 . 2 2 17 17 LEU HD12 H 1 1.02 0.03 . 2 1 . . B 168 LEU HD12 . 18000 1 671 . 2 2 17 17 LEU HD13 H 1 1.02 0.03 . 2 1 . . B 168 LEU HD13 . 18000 1 672 . 2 2 17 17 LEU HD21 H 1 0.86 0.03 . 2 1 . . B 168 LEU HD21 . 18000 1 673 . 2 2 17 17 LEU HD22 H 1 0.86 0.03 . 2 1 . . B 168 LEU HD22 . 18000 1 674 . 2 2 17 17 LEU HD23 H 1 0.86 0.03 . 2 1 . . B 168 LEU HD23 . 18000 1 675 . 2 2 17 17 LEU C C 13 174.79 0.20 . 1 1 . . B 168 LEU C . 18000 1 676 . 2 2 17 17 LEU CA C 13 64.67 0.20 . 1 1 . . B 168 LEU CA . 18000 1 677 . 2 2 17 17 LEU CB C 13 40.11 0.20 . 1 1 . . B 168 LEU CB . 18000 1 678 . 2 2 17 17 LEU CG C 13 26.25 0.20 . 1 1 . . B 168 LEU CG . 18000 1 679 . 2 2 17 17 LEU CD1 C 13 21.87 0.20 . 2 1 . . B 168 LEU CD1 . 18000 1 680 . 2 2 17 17 LEU CD2 C 13 24.83 0.20 . 2 1 . . B 168 LEU CD2 . 18000 1 681 . 2 2 17 17 LEU N N 15 118.29 0.30 . 1 1 . . B 168 LEU N . 18000 1 682 . 2 2 18 18 VAL HA H 1 3.68 0.03 . 1 1 . . B 169 VAL HA . 18000 1 683 . 2 2 18 18 VAL HB H 1 2.10 0.03 . 1 1 . . B 169 VAL HB . 18000 1 684 . 2 2 18 18 VAL HG11 H 1 1.03 0.03 . 2 1 . . B 169 VAL HG11 . 18000 1 685 . 2 2 18 18 VAL HG12 H 1 1.03 0.03 . 2 1 . . B 169 VAL HG12 . 18000 1 686 . 2 2 18 18 VAL HG13 H 1 1.03 0.03 . 2 1 . . B 169 VAL HG13 . 18000 1 687 . 2 2 18 18 VAL HG21 H 1 0.88 0.03 . 2 1 . . B 169 VAL HG21 . 18000 1 688 . 2 2 18 18 VAL HG22 H 1 0.88 0.03 . 2 1 . . B 169 VAL HG22 . 18000 1 689 . 2 2 18 18 VAL HG23 H 1 0.88 0.03 . 2 1 . . B 169 VAL HG23 . 18000 1 690 . 2 2 18 18 VAL CG1 C 13 19.94 0.20 . 2 1 . . B 169 VAL CG1 . 18000 1 691 . 2 2 18 18 VAL CG2 C 13 21.49 0.20 . 2 1 . . B 169 VAL CG2 . 18000 1 692 . 2 2 19 19 ASP HA H 1 4.28 0.03 . 1 1 . . B 170 ASP HA . 18000 1 693 . 2 2 19 19 ASP C C 13 175.69 0.20 . 1 1 . . B 170 ASP C . 18000 1 694 . 2 2 19 19 ASP CA C 13 56.00 0.20 . 1 1 . . B 170 ASP CA . 18000 1 695 . 2 2 19 19 ASP CB C 13 37.70 0.20 . 1 1 . . B 170 ASP CB . 18000 1 696 . 2 2 20 20 ASP H H 1 7.97 0.03 . 1 1 . . B 171 ASP H . 18000 1 697 . 2 2 20 20 ASP HA H 1 3.98 0.03 . 1 1 . . B 171 ASP HA . 18000 1 698 . 2 2 20 20 ASP HB3 H 1 2.72 0.03 . 2 1 . . B 171 ASP HB3 . 18000 1 699 . 2 2 20 20 ASP C C 13 172.91 0.20 . 1 1 . . B 171 ASP C . 18000 1 700 . 2 2 20 20 ASP CA C 13 55.50 0.20 . 1 1 . . B 171 ASP CA . 18000 1 701 . 2 2 20 20 ASP CB C 13 41.08 0.20 . 1 1 . . B 171 ASP CB . 18000 1 702 . 2 2 20 20 ASP N N 15 119.06 0.30 . 1 1 . . B 171 ASP N . 18000 1 703 . 2 2 21 21 TRP H H 1 7.44 0.03 . 1 1 . . B 172 TRP H . 18000 1 704 . 2 2 21 21 TRP HA H 1 3.96 0.03 . 1 1 . . B 172 TRP HA . 18000 1 705 . 2 2 21 21 TRP HB2 H 1 3.65 0.03 . 2 1 . . B 172 TRP HB2 . 18000 1 706 . 2 2 21 21 TRP HB3 H 1 3.74 0.03 . 2 1 . . B 172 TRP HB3 . 18000 1 707 . 2 2 21 21 TRP HD1 H 1 7.25 0.03 . 1 1 . . B 172 TRP HD1 . 18000 1 708 . 2 2 21 21 TRP HE1 H 1 9.95 0.03 . 1 1 . . B 172 TRP HE1 . 18000 1 709 . 2 2 21 21 TRP HE3 H 1 7.88 0.03 . 1 1 . . B 172 TRP HE3 . 18000 1 710 . 2 2 21 21 TRP HZ2 H 1 7.38 0.03 . 1 1 . . B 172 TRP HZ2 . 18000 1 711 . 2 2 21 21 TRP HZ3 H 1 7.00 0.03 . 1 1 . . B 172 TRP HZ3 . 18000 1 712 . 2 2 21 21 TRP HH2 H 1 7.08 0.03 . 1 1 . . B 172 TRP HH2 . 18000 1 713 . 2 2 21 21 TRP C C 13 177.27 0.20 . 1 1 . . B 172 TRP C . 18000 1 714 . 2 2 21 21 TRP CA C 13 59.18 0.20 . 1 1 . . B 172 TRP CA . 18000 1 715 . 2 2 21 21 TRP CD1 C 13 125.48 0.20 . 1 1 . . B 172 TRP CD1 . 18000 1 716 . 2 2 21 21 TRP N N 15 117.69 0.30 . 1 1 . . B 172 TRP N . 18000 1 717 . 2 2 21 21 TRP NE1 N 15 129.63 0.30 . 1 1 . . B 172 TRP NE1 . 18000 1 718 . 2 2 22 22 ASP H H 1 8.98 0.03 . 1 1 . . B 173 ASP H . 18000 1 719 . 2 2 22 22 ASP HA H 1 3.35 0.03 . 1 1 . . B 173 ASP HA . 18000 1 720 . 2 2 22 22 ASP HB2 H 1 2.67 0.03 . 2 1 . . B 173 ASP HB2 . 18000 1 721 . 2 2 22 22 ASP HB3 H 1 2.75 0.03 . 2 1 . . B 173 ASP HB3 . 18000 1 722 . 2 2 22 22 ASP C C 13 176.42 0.20 . 1 1 . . B 173 ASP C . 18000 1 723 . 2 2 22 22 ASP CA C 13 56.01 0.20 . 1 1 . . B 173 ASP CA . 18000 1 724 . 2 2 22 22 ASP CB C 13 41.55 0.20 . 1 1 . . B 173 ASP CB . 18000 1 725 . 2 2 22 22 ASP N N 15 122.91 0.30 . 1 1 . . B 173 ASP N . 18000 1 726 . 2 2 23 23 LEU H H 1 9.03 0.03 . 1 1 . . B 174 LEU H . 18000 1 727 . 2 2 23 23 LEU HA H 1 3.39 0.03 . 1 1 . . B 174 LEU HA . 18000 1 728 . 2 2 23 23 LEU HB2 H 1 0.65 0.03 . 2 1 . . B 174 LEU HB2 . 18000 1 729 . 2 2 23 23 LEU HB3 H 1 1.73 0.03 . 2 1 . . B 174 LEU HB3 . 18000 1 730 . 2 2 23 23 LEU HG H 1 1.42 0.03 . 1 1 . . B 174 LEU HG . 18000 1 731 . 2 2 23 23 LEU HD11 H 1 0.46 0.03 . 2 1 . . B 174 LEU HD11 . 18000 1 732 . 2 2 23 23 LEU HD12 H 1 0.46 0.03 . 2 1 . . B 174 LEU HD12 . 18000 1 733 . 2 2 23 23 LEU HD13 H 1 0.46 0.03 . 2 1 . . B 174 LEU HD13 . 18000 1 734 . 2 2 23 23 LEU HD21 H 1 -0.09 0.03 . 2 1 . . B 174 LEU HD21 . 18000 1 735 . 2 2 23 23 LEU HD22 H 1 -0.09 0.03 . 2 1 . . B 174 LEU HD22 . 18000 1 736 . 2 2 23 23 LEU HD23 H 1 -0.09 0.03 . 2 1 . . B 174 LEU HD23 . 18000 1 737 . 2 2 23 23 LEU C C 13 175.52 0.20 . 1 1 . . B 174 LEU C . 18000 1 738 . 2 2 23 23 LEU CA C 13 56.67 0.20 . 1 1 . . B 174 LEU CA . 18000 1 739 . 2 2 23 23 LEU CB C 13 40.25 0.20 . 1 1 . . B 174 LEU CB . 18000 1 740 . 2 2 23 23 LEU CG C 13 25.55 0.20 . 1 1 . . B 174 LEU CG . 18000 1 741 . 2 2 23 23 LEU CD1 C 13 21.80 0.20 . 2 1 . . B 174 LEU CD1 . 18000 1 742 . 2 2 23 23 LEU CD2 C 13 21.86 0.20 . 2 1 . . B 174 LEU CD2 . 18000 1 743 . 2 2 23 23 LEU N N 15 121.71 0.30 . 1 1 . . B 174 LEU N . 18000 1 744 . 2 2 24 24 ILE H H 1 7.66 0.03 . 1 1 . . B 175 ILE H . 18000 1 745 . 2 2 24 24 ILE HA H 1 4.61 0.03 . 1 1 . . B 175 ILE HA . 18000 1 746 . 2 2 24 24 ILE HB H 1 1.75 0.03 . 1 1 . . B 175 ILE HB . 18000 1 747 . 2 2 24 24 ILE HG12 H 1 2.22 0.03 . 2 1 . . B 175 ILE HG12 . 18000 1 748 . 2 2 24 24 ILE HG13 H 1 1.63 0.03 . 2 1 . . B 175 ILE HG13 . 18000 1 749 . 2 2 24 24 ILE HG21 H 1 1.12 0.03 . 1 1 . . B 175 ILE HG21 . 18000 1 750 . 2 2 24 24 ILE HG22 H 1 1.12 0.03 . 1 1 . . B 175 ILE HG22 . 18000 1 751 . 2 2 24 24 ILE HG23 H 1 1.12 0.03 . 1 1 . . B 175 ILE HG23 . 18000 1 752 . 2 2 24 24 ILE HD11 H 1 1.33 0.03 . 1 1 . . B 175 ILE HD11 . 18000 1 753 . 2 2 24 24 ILE HD12 H 1 1.33 0.03 . 1 1 . . B 175 ILE HD12 . 18000 1 754 . 2 2 24 24 ILE HD13 H 1 1.33 0.03 . 1 1 . . B 175 ILE HD13 . 18000 1 755 . 2 2 24 24 ILE C C 13 176.22 0.20 . 1 1 . . B 175 ILE C . 18000 1 756 . 2 2 24 24 ILE CA C 13 59.56 0.20 . 1 1 . . B 175 ILE CA . 18000 1 757 . 2 2 24 24 ILE CB C 13 35.97 0.20 . 1 1 . . B 175 ILE CB . 18000 1 758 . 2 2 24 24 ILE CG1 C 13 25.59 0.20 . 1 1 . . B 175 ILE CG1 . 18000 1 759 . 2 2 24 24 ILE CG2 C 13 17.52 0.20 . 1 1 . . B 175 ILE CG2 . 18000 1 760 . 2 2 24 24 ILE CD1 C 13 10.07 0.20 . 1 1 . . B 175 ILE CD1 . 18000 1 761 . 2 2 24 24 ILE N N 15 113.93 0.30 . 1 1 . . B 175 ILE N . 18000 1 762 . 2 2 25 25 THR H H 1 7.89 0.03 . 1 1 . . B 176 THR H . 18000 1 763 . 2 2 25 25 THR HA H 1 3.75 0.03 . 1 1 . . B 176 THR HA . 18000 1 764 . 2 2 25 25 THR HB H 1 3.76 0.03 . 1 1 . . B 176 THR HB . 18000 1 765 . 2 2 25 25 THR HG1 H 1 2.64 0.03 . 1 1 . . B 176 THR HG1 . 18000 1 766 . 2 2 25 25 THR HG21 H 1 0.80 0.03 . 1 1 . . B 176 THR HG21 . 18000 1 767 . 2 2 25 25 THR HG22 H 1 0.80 0.03 . 1 1 . . B 176 THR HG22 . 18000 1 768 . 2 2 25 25 THR HG23 H 1 0.80 0.03 . 1 1 . . B 176 THR HG23 . 18000 1 769 . 2 2 25 25 THR C C 13 174.36 0.20 . 1 1 . . B 176 THR C . 18000 1 770 . 2 2 25 25 THR CA C 13 62.62 0.20 . 1 1 . . B 176 THR CA . 18000 1 771 . 2 2 25 25 THR CB C 13 67.84 0.20 . 1 1 . . B 176 THR CB . 18000 1 772 . 2 2 25 25 THR CG2 C 13 19.16 0.20 . 1 1 . . B 176 THR CG2 . 18000 1 773 . 2 2 25 25 THR N N 15 122.84 0.30 . 1 1 . . B 176 THR N . 18000 1 774 . 2 2 26 26 ARG H H 1 7.37 0.03 . 1 1 . . B 177 ARG H . 18000 1 775 . 2 2 26 26 ARG HA H 1 4.32 0.03 . 1 1 . . B 177 ARG HA . 18000 1 776 . 2 2 26 26 ARG HB2 H 1 1.65 0.03 . 2 1 . . B 177 ARG HB2 . 18000 1 777 . 2 2 26 26 ARG HB3 H 1 1.78 0.03 . 2 1 . . B 177 ARG HB3 . 18000 1 778 . 2 2 26 26 ARG HG3 H 1 1.06 0.03 . 2 1 . . B 177 ARG HG3 . 18000 1 779 . 2 2 26 26 ARG HD2 H 1 2.75 0.03 . 2 1 . . B 177 ARG HD2 . 18000 1 780 . 2 2 26 26 ARG HD3 H 1 2.94 0.03 . 2 1 . . B 177 ARG HD3 . 18000 1 781 . 2 2 26 26 ARG C C 13 175.89 0.20 . 1 1 . . B 177 ARG C . 18000 1 782 . 2 2 26 26 ARG CA C 13 55.96 0.20 . 1 1 . . B 177 ARG CA . 18000 1 783 . 2 2 26 26 ARG CB C 13 28.85 0.20 . 1 1 . . B 177 ARG CB . 18000 1 784 . 2 2 26 26 ARG CG C 13 25.80 0.20 . 1 1 . . B 177 ARG CG . 18000 1 785 . 2 2 26 26 ARG CD C 13 41.21 0.20 . 1 1 . . B 177 ARG CD . 18000 1 786 . 2 2 26 26 ARG N N 15 120.65 0.30 . 1 1 . . B 177 ARG N . 18000 1 787 . 2 2 27 27 GLN H H 1 8.09 0.03 . 1 1 . . B 178 GLN H . 18000 1 788 . 2 2 27 27 GLN HA H 1 4.10 0.03 . 1 1 . . B 178 GLN HA . 18000 1 789 . 2 2 27 27 GLN HB2 H 1 2.08 0.03 . 2 1 . . B 178 GLN HB2 . 18000 1 790 . 2 2 27 27 GLN HB3 H 1 2.28 0.03 . 2 1 . . B 178 GLN HB3 . 18000 1 791 . 2 2 27 27 GLN HG2 H 1 2.00 0.03 . 2 1 . . B 178 GLN HG2 . 18000 1 792 . 2 2 27 27 GLN HG3 H 1 2.14 0.03 . 2 1 . . B 178 GLN HG3 . 18000 1 793 . 2 2 27 27 GLN HE21 H 1 6.59 0.03 . 2 1 . . B 178 GLN HE21 . 18000 1 794 . 2 2 27 27 GLN HE22 H 1 7.76 0.03 . 2 1 . . B 178 GLN HE22 . 18000 1 795 . 2 2 27 27 GLN C C 13 173.33 0.20 . 1 1 . . B 178 GLN C . 18000 1 796 . 2 2 27 27 GLN CA C 13 54.85 0.20 . 1 1 . . B 178 GLN CA . 18000 1 797 . 2 2 27 27 GLN CB C 13 26.75 0.20 . 1 1 . . B 178 GLN CB . 18000 1 798 . 2 2 27 27 GLN CG C 13 32.28 0.20 . 1 1 . . B 178 GLN CG . 18000 1 799 . 2 2 27 27 GLN N N 15 115.23 0.30 . 1 1 . . B 178 GLN N . 18000 1 800 . 2 2 27 27 GLN NE2 N 15 114.10 0.30 . 1 1 . . B 178 GLN NE2 . 18000 1 801 . 2 2 28 28 LYS H H 1 6.68 0.03 . 1 1 . . B 179 LYS H . 18000 1 802 . 2 2 28 28 LYS HA H 1 3.60 0.03 . 1 1 . . B 179 LYS HA . 18000 1 803 . 2 2 28 28 LYS HB2 H 1 1.57 0.03 . 2 1 . . B 179 LYS HB2 . 18000 1 804 . 2 2 28 28 LYS HB3 H 1 2.03 0.03 . 2 1 . . B 179 LYS HB3 . 18000 1 805 . 2 2 28 28 LYS HG2 H 1 0.62 0.03 . 2 1 . . B 179 LYS HG2 . 18000 1 806 . 2 2 28 28 LYS HG3 H 1 0.92 0.03 . 2 1 . . B 179 LYS HG3 . 18000 1 807 . 2 2 28 28 LYS HD2 H 1 0.81 0.03 . 2 1 . . B 179 LYS HD2 . 18000 1 808 . 2 2 28 28 LYS HD3 H 1 1.10 0.03 . 2 1 . . B 179 LYS HD3 . 18000 1 809 . 2 2 28 28 LYS HE3 H 1 2.67 0.03 . 2 1 . . B 179 LYS HE3 . 18000 1 810 . 2 2 28 28 LYS C C 13 173.69 0.20 . 1 1 . . B 179 LYS C . 18000 1 811 . 2 2 28 28 LYS CA C 13 54.37 0.20 . 1 1 . . B 179 LYS CA . 18000 1 812 . 2 2 28 28 LYS CB C 13 25.91 0.20 . 1 1 . . B 179 LYS CB . 18000 1 813 . 2 2 28 28 LYS CG C 13 22.45 0.20 . 1 1 . . B 179 LYS CG . 18000 1 814 . 2 2 28 28 LYS CD C 13 26.02 0.20 . 1 1 . . B 179 LYS CD . 18000 1 815 . 2 2 28 28 LYS CE C 13 40.60 0.20 . 1 1 . . B 179 LYS CE . 18000 1 816 . 2 2 28 28 LYS N N 15 112.39 0.30 . 1 1 . . B 179 LYS N . 18000 1 817 . 2 2 29 29 GLN H H 1 8.52 0.03 . 1 1 . . B 180 GLN H . 18000 1 818 . 2 2 29 29 GLN HA H 1 4.81 0.03 . 1 1 . . B 180 GLN HA . 18000 1 819 . 2 2 29 29 GLN HB3 H 1 1.85 0.03 . 2 1 . . B 180 GLN HB3 . 18000 1 820 . 2 2 29 29 GLN HG3 H 1 2.23 0.03 . 2 1 . . B 180 GLN HG3 . 18000 1 821 . 2 2 29 29 GLN HE21 H 1 6.07 0.03 . 2 1 . . B 180 GLN HE21 . 18000 1 822 . 2 2 29 29 GLN HE22 H 1 6.47 0.03 . 2 1 . . B 180 GLN HE22 . 18000 1 823 . 2 2 29 29 GLN C C 13 170.83 0.20 . 1 1 . . B 180 GLN C . 18000 1 824 . 2 2 29 29 GLN CA C 13 53.07 0.20 . 1 1 . . B 180 GLN CA . 18000 1 825 . 2 2 29 29 GLN CB C 13 27.67 0.20 . 1 1 . . B 180 GLN CB . 18000 1 826 . 2 2 29 29 GLN CG C 13 32.82 0.20 . 1 1 . . B 180 GLN CG . 18000 1 827 . 2 2 29 29 GLN N N 15 118.27 0.30 . 1 1 . . B 180 GLN N . 18000 1 828 . 2 2 29 29 GLN NE2 N 15 106.09 0.30 . 1 1 . . B 180 GLN NE2 . 18000 1 829 . 2 2 30 30 LEU H H 1 8.38 0.03 . 1 1 . . B 181 LEU H . 18000 1 830 . 2 2 30 30 LEU HA H 1 4.96 0.03 . 1 1 . . B 181 LEU HA . 18000 1 831 . 2 2 30 30 LEU HB3 H 1 1.45 0.03 . 2 1 . . B 181 LEU HB3 . 18000 1 832 . 2 2 30 30 LEU HG H 1 1.27 0.03 . 1 1 . . B 181 LEU HG . 18000 1 833 . 2 2 30 30 LEU HD11 H 1 0.84 0.03 . 2 1 . . B 181 LEU HD11 . 18000 1 834 . 2 2 30 30 LEU HD12 H 1 0.84 0.03 . 2 1 . . B 181 LEU HD12 . 18000 1 835 . 2 2 30 30 LEU HD13 H 1 0.84 0.03 . 2 1 . . B 181 LEU HD13 . 18000 1 836 . 2 2 30 30 LEU HD21 H 1 -0.10 0.03 . 2 1 . . B 181 LEU HD21 . 18000 1 837 . 2 2 30 30 LEU HD22 H 1 -0.10 0.03 . 2 1 . . B 181 LEU HD22 . 18000 1 838 . 2 2 30 30 LEU HD23 H 1 -0.10 0.03 . 2 1 . . B 181 LEU HD23 . 18000 1 839 . 2 2 30 30 LEU C C 13 175.59 0.20 . 1 1 . . B 181 LEU C . 18000 1 840 . 2 2 30 30 LEU CA C 13 50.80 0.20 . 1 1 . . B 181 LEU CA . 18000 1 841 . 2 2 30 30 LEU CB C 13 44.91 0.20 . 1 1 . . B 181 LEU CB . 18000 1 842 . 2 2 30 30 LEU CG C 13 25.00 0.20 . 1 1 . . B 181 LEU CG . 18000 1 843 . 2 2 30 30 LEU CD1 C 13 21.38 0.20 . 2 1 . . B 181 LEU CD1 . 18000 1 844 . 2 2 30 30 LEU CD2 C 13 22.93 0.20 . 2 1 . . B 181 LEU CD2 . 18000 1 845 . 2 2 30 30 LEU N N 15 112.75 0.30 . 1 1 . . B 181 LEU N . 18000 1 846 . 2 2 31 31 PHE H H 1 9.85 0.03 . 1 1 . . B 182 PHE H . 18000 1 847 . 2 2 31 31 PHE HA H 1 3.77 0.03 . 1 1 . . B 182 PHE HA . 18000 1 848 . 2 2 31 31 PHE HB2 H 1 2.61 0.03 . 2 1 . . B 182 PHE HB2 . 18000 1 849 . 2 2 31 31 PHE HB3 H 1 3.08 0.03 . 2 1 . . B 182 PHE HB3 . 18000 1 850 . 2 2 31 31 PHE HD2 H 1 7.46 0.03 . 3 1 . . B 182 PHE HD2 . 18000 1 851 . 2 2 31 31 PHE HE2 H 1 7.41 0.03 . 3 1 . . B 182 PHE HE2 . 18000 1 852 . 2 2 31 31 PHE HZ H 1 7.52 0.03 . 1 1 . . B 182 PHE HZ . 18000 1 853 . 2 2 31 31 PHE C C 13 172.88 0.20 . 1 1 . . B 182 PHE C . 18000 1 854 . 2 2 31 31 PHE CA C 13 57.13 0.20 . 1 1 . . B 182 PHE CA . 18000 1 855 . 2 2 31 31 PHE CB C 13 38.38 0.20 . 1 1 . . B 182 PHE CB . 18000 1 856 . 2 2 31 31 PHE N N 15 126.29 0.30 . 1 1 . . B 182 PHE N . 18000 1 857 . 2 2 32 32 TYR H H 1 7.87 0.03 . 1 1 . . B 183 TYR H . 18000 1 858 . 2 2 32 32 TYR HA H 1 3.92 0.03 . 1 1 . . B 183 TYR HA . 18000 1 859 . 2 2 32 32 TYR HB2 H 1 2.42 0.03 . 2 1 . . B 183 TYR HB2 . 18000 1 860 . 2 2 32 32 TYR HB3 H 1 2.60 0.03 . 2 1 . . B 183 TYR HB3 . 18000 1 861 . 2 2 32 32 TYR HD1 H 1 6.89 0.03 . 3 1 . . B 183 TYR HD1 . 18000 1 862 . 2 2 32 32 TYR HE1 H 1 6.69 0.03 . 3 1 . . B 183 TYR HE1 . 18000 1 863 . 2 2 32 32 TYR C C 13 171.29 0.20 . 1 1 . . B 183 TYR C . 18000 1 864 . 2 2 32 32 TYR CA C 13 58.00 0.20 . 1 1 . . B 183 TYR CA . 18000 1 865 . 2 2 32 32 TYR CB C 13 35.54 0.20 . 1 1 . . B 183 TYR CB . 18000 1 866 . 2 2 32 32 TYR CD1 C 13 131.49 0.20 . 1 1 . . B 183 TYR CD1 . 18000 1 867 . 2 2 32 32 TYR CE1 C 13 116.12 0.20 . 1 1 . . B 183 TYR CE1 . 18000 1 868 . 2 2 32 32 TYR N N 15 128.01 0.30 . 1 1 . . B 183 TYR N . 18000 1 869 . 2 2 33 33 LEU H H 1 6.93 0.03 . 1 1 . . B 184 LEU H . 18000 1 870 . 2 2 33 33 LEU HA H 1 4.43 0.03 . 1 1 . . B 184 LEU HA . 18000 1 871 . 2 2 33 33 LEU HB2 H 1 0.62 0.03 . 2 1 . . B 184 LEU HB2 . 18000 1 872 . 2 2 33 33 LEU HB3 H 1 1.27 0.03 . 2 1 . . B 184 LEU HB3 . 18000 1 873 . 2 2 33 33 LEU HG H 1 1.64 0.03 . 1 1 . . B 184 LEU HG . 18000 1 874 . 2 2 33 33 LEU HD11 H 1 0.49 0.03 . 2 1 . . B 184 LEU HD11 . 18000 1 875 . 2 2 33 33 LEU HD12 H 1 0.49 0.03 . 2 1 . . B 184 LEU HD12 . 18000 1 876 . 2 2 33 33 LEU HD13 H 1 0.49 0.03 . 2 1 . . B 184 LEU HD13 . 18000 1 877 . 2 2 33 33 LEU HD21 H 1 0.30 0.03 . 2 1 . . B 184 LEU HD21 . 18000 1 878 . 2 2 33 33 LEU HD22 H 1 0.30 0.03 . 2 1 . . B 184 LEU HD22 . 18000 1 879 . 2 2 33 33 LEU HD23 H 1 0.30 0.03 . 2 1 . . B 184 LEU HD23 . 18000 1 880 . 2 2 33 33 LEU C C 13 173.43 0.20 . 1 1 . . B 184 LEU C . 18000 1 881 . 2 2 33 33 LEU CA C 13 48.89 0.20 . 1 1 . . B 184 LEU CA . 18000 1 882 . 2 2 33 33 LEU CB C 13 43.26 0.20 . 1 1 . . B 184 LEU CB . 18000 1 883 . 2 2 33 33 LEU CG C 13 24.04 0.20 . 1 1 . . B 184 LEU CG . 18000 1 884 . 2 2 33 33 LEU CD1 C 13 22.30 0.20 . 2 1 . . B 184 LEU CD1 . 18000 1 885 . 2 2 33 33 LEU CD2 C 13 25.54 0.20 . 2 1 . . B 184 LEU CD2 . 18000 1 886 . 2 2 33 33 LEU N N 15 125.83 0.30 . 1 1 . . B 184 LEU N . 18000 1 887 . 2 2 34 34 PRO HA H 1 4.11 0.03 . 1 1 . . B 185 PRO HA . 18000 1 888 . 2 2 34 34 PRO HB3 H 1 2.12 0.03 . 2 1 . . B 185 PRO HB3 . 18000 1 889 . 2 2 34 34 PRO HG2 H 1 1.48 0.03 . 2 1 . . B 185 PRO HG2 . 18000 1 890 . 2 2 34 34 PRO HG3 H 1 1.92 0.03 . 2 1 . . B 185 PRO HG3 . 18000 1 891 . 2 2 34 34 PRO HD3 H 1 3.37 0.03 . 2 1 . . B 185 PRO HD3 . 18000 1 892 . 2 2 34 34 PRO C C 13 173.44 0.20 . 1 1 . . B 185 PRO C . 18000 1 893 . 2 2 34 34 PRO CA C 13 60.18 0.20 . 1 1 . . B 185 PRO CA . 18000 1 894 . 2 2 34 34 PRO CB C 13 32.47 0.20 . 1 1 . . B 185 PRO CB . 18000 1 895 . 2 2 34 34 PRO CG C 13 23.88 0.20 . 1 1 . . B 185 PRO CG . 18000 1 896 . 2 2 34 34 PRO CD C 13 48.30 0.20 . 1 1 . . B 185 PRO CD . 18000 1 897 . 2 2 35 35 ALA H H 1 9.22 0.03 . 1 1 . . B 186 ALA H . 18000 1 898 . 2 2 35 35 ALA HA H 1 4.44 0.03 . 1 1 . . B 186 ALA HA . 18000 1 899 . 2 2 35 35 ALA HB1 H 1 1.16 0.03 . 1 1 . . B 186 ALA HB1 . 18000 1 900 . 2 2 35 35 ALA HB2 H 1 1.16 0.03 . 1 1 . . B 186 ALA HB2 . 18000 1 901 . 2 2 35 35 ALA HB3 H 1 1.16 0.03 . 1 1 . . B 186 ALA HB3 . 18000 1 902 . 2 2 35 35 ALA C C 13 176.08 0.20 . 1 1 . . B 186 ALA C . 18000 1 903 . 2 2 35 35 ALA CA C 13 50.22 0.20 . 1 1 . . B 186 ALA CA . 18000 1 904 . 2 2 35 35 ALA CB C 13 17.08 0.20 . 1 1 . . B 186 ALA CB . 18000 1 905 . 2 2 35 35 ALA N N 15 124.76 0.30 . 1 1 . . B 186 ALA N . 18000 1 906 . 2 2 36 36 LYS H H 1 8.59 0.03 . 1 1 . . B 187 LYS H . 18000 1 907 . 2 2 36 36 LYS HA H 1 4.00 0.03 . 1 1 . . B 187 LYS HA . 18000 1 908 . 2 2 36 36 LYS HB2 H 1 1.68 0.03 . 2 1 . . B 187 LYS HB2 . 18000 1 909 . 2 2 36 36 LYS HB3 H 1 1.78 0.03 . 2 1 . . B 187 LYS HB3 . 18000 1 910 . 2 2 36 36 LYS HG2 H 1 1.37 0.03 . 2 1 . . B 187 LYS HG2 . 18000 1 911 . 2 2 36 36 LYS HG3 H 1 1.45 0.03 . 2 1 . . B 187 LYS HG3 . 18000 1 912 . 2 2 36 36 LYS HD3 H 1 1.68 0.03 . 2 1 . . B 187 LYS HD3 . 18000 1 913 . 2 2 36 36 LYS HE3 H 1 2.96 0.03 . 2 1 . . B 187 LYS HE3 . 18000 1 914 . 2 2 36 36 LYS C C 13 175.41 0.20 . 1 1 . . B 187 LYS C . 18000 1 915 . 2 2 36 36 LYS CA C 13 56.82 0.20 . 1 1 . . B 187 LYS CA . 18000 1 916 . 2 2 36 36 LYS CB C 13 30.33 0.20 . 1 1 . . B 187 LYS CB . 18000 1 917 . 2 2 36 36 LYS CG C 13 23.10 0.20 . 1 1 . . B 187 LYS CG . 18000 1 918 . 2 2 36 36 LYS CD C 13 27.23 0.20 . 1 1 . . B 187 LYS CD . 18000 1 919 . 2 2 36 36 LYS CE C 13 40.14 0.20 . 1 1 . . B 187 LYS CE . 18000 1 920 . 2 2 36 36 LYS N N 15 122.71 0.30 . 1 1 . . B 187 LYS N . 18000 1 921 . 2 2 37 37 LYS H H 1 8.12 0.03 . 1 1 . . B 188 LYS H . 18000 1 922 . 2 2 37 37 LYS HA H 1 4.59 0.03 . 1 1 . . B 188 LYS HA . 18000 1 923 . 2 2 37 37 LYS HB2 H 1 1.68 0.03 . 2 1 . . B 188 LYS HB2 . 18000 1 924 . 2 2 37 37 LYS HB3 H 1 1.87 0.03 . 2 1 . . B 188 LYS HB3 . 18000 1 925 . 2 2 37 37 LYS HG2 H 1 1.14 0.03 . 2 1 . . B 188 LYS HG2 . 18000 1 926 . 2 2 37 37 LYS HG3 H 1 1.25 0.03 . 2 1 . . B 188 LYS HG3 . 18000 1 927 . 2 2 37 37 LYS HD2 H 1 1.54 0.03 . 2 1 . . B 188 LYS HD2 . 18000 1 928 . 2 2 37 37 LYS HD3 H 1 1.68 0.03 . 2 1 . . B 188 LYS HD3 . 18000 1 929 . 2 2 37 37 LYS HE2 H 1 2.50 0.03 . 2 1 . . B 188 LYS HE2 . 18000 1 930 . 2 2 37 37 LYS HE3 H 1 2.78 0.03 . 2 1 . . B 188 LYS HE3 . 18000 1 931 . 2 2 37 37 LYS C C 13 172.33 0.20 . 1 1 . . B 188 LYS C . 18000 1 932 . 2 2 37 37 LYS CA C 13 52.12 0.20 . 1 1 . . B 188 LYS CA . 18000 1 933 . 2 2 37 37 LYS CB C 13 31.07 0.20 . 1 1 . . B 188 LYS CB . 18000 1 934 . 2 2 37 37 LYS CG C 13 22.96 0.20 . 1 1 . . B 188 LYS CG . 18000 1 935 . 2 2 37 37 LYS CD C 13 27.48 0.20 . 1 1 . . B 188 LYS CD . 18000 1 936 . 2 2 37 37 LYS CE C 13 40.38 0.20 . 1 1 . . B 188 LYS CE . 18000 1 937 . 2 2 37 37 LYS N N 15 120.82 0.30 . 1 1 . . B 188 LYS N . 18000 1 938 . 2 2 38 38 ASN H H 1 8.40 0.03 . 1 1 . . B 189 ASN H . 18000 1 939 . 2 2 38 38 ASN HA H 1 4.83 0.03 . 1 1 . . B 189 ASN HA . 18000 1 940 . 2 2 38 38 ASN HB2 H 1 2.55 0.03 . 2 1 . . B 189 ASN HB2 . 18000 1 941 . 2 2 38 38 ASN HB3 H 1 3.43 0.03 . 2 1 . . B 189 ASN HB3 . 18000 1 942 . 2 2 38 38 ASN C C 13 172.97 0.20 . 1 1 . . B 189 ASN C . 18000 1 943 . 2 2 38 38 ASN CA C 13 49.78 0.20 . 1 1 . . B 189 ASN CA . 18000 1 944 . 2 2 38 38 ASN CB C 13 37.29 0.20 . 1 1 . . B 189 ASN CB . 18000 1 945 . 2 2 38 38 ASN N N 15 122.33 0.30 . 1 1 . . B 189 ASN N . 18000 1 946 . 2 2 39 39 VAL H H 1 7.85 0.03 . 1 1 . . B 190 VAL H . 18000 1 947 . 2 2 39 39 VAL HA H 1 3.23 0.03 . 1 1 . . B 190 VAL HA . 18000 1 948 . 2 2 39 39 VAL HB H 1 2.15 0.03 . 1 1 . . B 190 VAL HB . 18000 1 949 . 2 2 39 39 VAL HG11 H 1 0.36 0.03 . 2 1 . . B 190 VAL HG11 . 18000 1 950 . 2 2 39 39 VAL HG12 H 1 0.36 0.03 . 2 1 . . B 190 VAL HG12 . 18000 1 951 . 2 2 39 39 VAL HG13 H 1 0.36 0.03 . 2 1 . . B 190 VAL HG13 . 18000 1 952 . 2 2 39 39 VAL HG21 H 1 0.16 0.03 . 2 1 . . B 190 VAL HG21 . 18000 1 953 . 2 2 39 39 VAL HG22 H 1 0.16 0.03 . 2 1 . . B 190 VAL HG22 . 18000 1 954 . 2 2 39 39 VAL HG23 H 1 0.16 0.03 . 2 1 . . B 190 VAL HG23 . 18000 1 955 . 2 2 39 39 VAL C C 13 175.30 0.20 . 1 1 . . B 190 VAL C . 18000 1 956 . 2 2 39 39 VAL CA C 13 66.24 0.20 . 1 1 . . B 190 VAL CA . 18000 1 957 . 2 2 39 39 VAL CB C 13 28.99 0.20 . 1 1 . . B 190 VAL CB . 18000 1 958 . 2 2 39 39 VAL CG1 C 13 19.52 0.20 . 2 1 . . B 190 VAL CG1 . 18000 1 959 . 2 2 39 39 VAL CG2 C 13 22.01 0.20 . 2 1 . . B 190 VAL CG2 . 18000 1 960 . 2 2 39 39 VAL N N 15 120.06 0.30 . 1 1 . . B 190 VAL N . 18000 1 961 . 2 2 40 40 ASP H H 1 7.80 0.03 . 1 1 . . B 191 ASP H . 18000 1 962 . 2 2 40 40 ASP HA H 1 4.04 0.03 . 1 1 . . B 191 ASP HA . 18000 1 963 . 2 2 40 40 ASP HB3 H 1 2.47 0.03 . 2 1 . . B 191 ASP HB3 . 18000 1 964 . 2 2 40 40 ASP C C 13 176.64 0.20 . 1 1 . . B 191 ASP C . 18000 1 965 . 2 2 40 40 ASP CA C 13 56.70 0.20 . 1 1 . . B 191 ASP CA . 18000 1 966 . 2 2 40 40 ASP CB C 13 38.09 0.20 . 1 1 . . B 191 ASP CB . 18000 1 967 . 2 2 40 40 ASP N N 15 118.91 0.30 . 1 1 . . B 191 ASP N . 18000 1 968 . 2 2 41 41 SER H H 1 8.39 0.03 . 1 1 . . B 192 SER H . 18000 1 969 . 2 2 41 41 SER HA H 1 4.22 0.03 . 1 1 . . B 192 SER HA . 18000 1 970 . 2 2 41 41 SER HB3 H 1 4.02 0.03 . 2 1 . . B 192 SER HB3 . 18000 1 971 . 2 2 41 41 SER C C 13 174.49 0.20 . 1 1 . . B 192 SER C . 18000 1 972 . 2 2 41 41 SER CA C 13 59.45 0.20 . 1 1 . . B 192 SER CA . 18000 1 973 . 2 2 41 41 SER CB C 13 61.55 0.20 . 1 1 . . B 192 SER CB . 18000 1 974 . 2 2 41 41 SER N N 15 115.19 0.30 . 1 1 . . B 192 SER N . 18000 1 975 . 2 2 42 42 ILE H H 1 8.05 0.03 . 1 1 . . B 193 ILE H . 18000 1 976 . 2 2 42 42 ILE HA H 1 3.73 0.03 . 1 1 . . B 193 ILE HA . 18000 1 977 . 2 2 42 42 ILE HB H 1 1.81 0.03 . 1 1 . . B 193 ILE HB . 18000 1 978 . 2 2 42 42 ILE HG12 H 1 1.85 0.03 . 2 1 . . B 193 ILE HG12 . 18000 1 979 . 2 2 42 42 ILE HG13 H 1 0.75 0.03 . 2 1 . . B 193 ILE HG13 . 18000 1 980 . 2 2 42 42 ILE HG21 H 1 0.97 0.03 . 1 1 . . B 193 ILE HG21 . 18000 1 981 . 2 2 42 42 ILE HG22 H 1 0.97 0.03 . 1 1 . . B 193 ILE HG22 . 18000 1 982 . 2 2 42 42 ILE HG23 H 1 0.97 0.03 . 1 1 . . B 193 ILE HG23 . 18000 1 983 . 2 2 42 42 ILE HD11 H 1 0.63 0.03 . 1 1 . . B 193 ILE HD11 . 18000 1 984 . 2 2 42 42 ILE HD12 H 1 0.63 0.03 . 1 1 . . B 193 ILE HD12 . 18000 1 985 . 2 2 42 42 ILE HD13 H 1 0.63 0.03 . 1 1 . . B 193 ILE HD13 . 18000 1 986 . 2 2 42 42 ILE C C 13 176.17 0.20 . 1 1 . . B 193 ILE C . 18000 1 987 . 2 2 42 42 ILE CA C 13 63.78 0.20 . 1 1 . . B 193 ILE CA . 18000 1 988 . 2 2 42 42 ILE CB C 13 36.97 0.20 . 1 1 . . B 193 ILE CB . 18000 1 989 . 2 2 42 42 ILE CG2 C 13 15.45 0.20 . 1 1 . . B 193 ILE CG2 . 18000 1 990 . 2 2 42 42 ILE CD1 C 13 12.55 0.20 . 1 1 . . B 193 ILE CD1 . 18000 1 991 . 2 2 42 42 ILE N N 15 122.85 0.30 . 1 1 . . B 193 ILE N . 18000 1 992 . 2 2 43 43 LEU H H 1 8.47 0.03 . 1 1 . . B 194 LEU H . 18000 1 993 . 2 2 43 43 LEU HA H 1 4.05 0.03 . 1 1 . . B 194 LEU HA . 18000 1 994 . 2 2 43 43 LEU HB2 H 1 1.44 0.03 . 2 1 . . B 194 LEU HB2 . 18000 1 995 . 2 2 43 43 LEU HB3 H 1 1.97 0.03 . 2 1 . . B 194 LEU HB3 . 18000 1 996 . 2 2 43 43 LEU HG H 1 1.78 0.03 . 1 1 . . B 194 LEU HG . 18000 1 997 . 2 2 43 43 LEU HD11 H 1 0.75 0.03 . 2 1 . . B 194 LEU HD11 . 18000 1 998 . 2 2 43 43 LEU HD12 H 1 0.75 0.03 . 2 1 . . B 194 LEU HD12 . 18000 1 999 . 2 2 43 43 LEU HD13 H 1 0.75 0.03 . 2 1 . . B 194 LEU HD13 . 18000 1 1000 . 2 2 43 43 LEU HD21 H 1 0.59 0.03 . 2 1 . . B 194 LEU HD21 . 18000 1 1001 . 2 2 43 43 LEU HD22 H 1 0.59 0.03 . 2 1 . . B 194 LEU HD22 . 18000 1 1002 . 2 2 43 43 LEU HD23 H 1 0.59 0.03 . 2 1 . . B 194 LEU HD23 . 18000 1 1003 . 2 2 43 43 LEU C C 13 176.66 0.20 . 1 1 . . B 194 LEU C . 18000 1 1004 . 2 2 43 43 LEU CA C 13 56.25 0.20 . 1 1 . . B 194 LEU CA . 18000 1 1005 . 2 2 43 43 LEU CB C 13 39.27 0.20 . 1 1 . . B 194 LEU CB . 18000 1 1006 . 2 2 43 43 LEU CD1 C 13 24.86 0.20 . 2 1 . . B 194 LEU CD1 . 18000 1 1007 . 2 2 43 43 LEU CD2 C 13 21.44 0.20 . 2 1 . . B 194 LEU CD2 . 18000 1 1008 . 2 2 43 43 LEU N N 15 118.03 0.30 . 1 1 . . B 194 LEU N . 18000 1 1009 . 2 2 44 44 GLU H H 1 7.92 0.03 . 1 1 . . B 195 GLU H . 18000 1 1010 . 2 2 44 44 GLU HA H 1 4.03 0.03 . 1 1 . . B 195 GLU HA . 18000 1 1011 . 2 2 44 44 GLU HB3 H 1 2.10 0.03 . 2 1 . . B 195 GLU HB3 . 18000 1 1012 . 2 2 44 44 GLU HG3 H 1 2.25 0.03 . 2 1 . . B 195 GLU HG3 . 18000 1 1013 . 2 2 44 44 GLU C C 13 176.83 0.20 . 1 1 . . B 195 GLU C . 18000 1 1014 . 2 2 44 44 GLU CA C 13 57.27 0.20 . 1 1 . . B 195 GLU CA . 18000 1 1015 . 2 2 44 44 GLU CB C 13 27.65 0.20 . 1 1 . . B 195 GLU CB . 18000 1 1016 . 2 2 44 44 GLU CG C 13 34.20 0.20 . 1 1 . . B 195 GLU CG . 18000 1 1017 . 2 2 44 44 GLU N N 15 120.03 0.30 . 1 1 . . B 195 GLU N . 18000 1 1018 . 2 2 45 45 ASP H H 1 8.41 0.03 . 1 1 . . B 196 ASP H . 18000 1 1019 . 2 2 45 45 ASP HA H 1 4.36 0.03 . 1 1 . . B 196 ASP HA . 18000 1 1020 . 2 2 45 45 ASP HB2 H 1 2.87 0.03 . 2 1 . . B 196 ASP HB2 . 18000 1 1021 . 2 2 45 45 ASP HB3 H 1 3.17 0.03 . 2 1 . . B 196 ASP HB3 . 18000 1 1022 . 2 2 45 45 ASP C C 13 178.03 0.20 . 1 1 . . B 196 ASP C . 18000 1 1023 . 2 2 45 45 ASP CA C 13 55.26 0.20 . 1 1 . . B 196 ASP CA . 18000 1 1024 . 2 2 45 45 ASP CB C 13 37.71 0.20 . 1 1 . . B 196 ASP CB . 18000 1 1025 . 2 2 45 45 ASP N N 15 120.51 0.30 . 1 1 . . B 196 ASP N . 18000 1 1026 . 2 2 46 46 TYR H H 1 8.39 0.03 . 1 1 . . B 197 TYR H . 18000 1 1027 . 2 2 46 46 TYR HA H 1 3.38 0.03 . 1 1 . . B 197 TYR HA . 18000 1 1028 . 2 2 46 46 TYR HB2 H 1 2.58 0.03 . 2 1 . . B 197 TYR HB2 . 18000 1 1029 . 2 2 46 46 TYR HB3 H 1 2.96 0.03 . 2 1 . . B 197 TYR HB3 . 18000 1 1030 . 2 2 46 46 TYR HD2 H 1 6.44 0.03 . 3 1 . . B 197 TYR HD2 . 18000 1 1031 . 2 2 46 46 TYR C C 13 174.38 0.20 . 1 1 . . B 197 TYR C . 18000 1 1032 . 2 2 46 46 TYR CA C 13 58.91 0.20 . 1 1 . . B 197 TYR CA . 18000 1 1033 . 2 2 46 46 TYR CB C 13 36.26 0.20 . 1 1 . . B 197 TYR CB . 18000 1 1034 . 2 2 46 46 TYR N N 15 122.44 0.30 . 1 1 . . B 197 TYR N . 18000 1 1035 . 2 2 47 47 ALA H H 1 8.44 0.03 . 1 1 . . B 198 ALA H . 18000 1 1036 . 2 2 47 47 ALA HA H 1 3.54 0.03 . 1 1 . . B 198 ALA HA . 18000 1 1037 . 2 2 47 47 ALA HB1 H 1 1.42 0.03 . 1 1 . . B 198 ALA HB1 . 18000 1 1038 . 2 2 47 47 ALA HB2 H 1 1.42 0.03 . 1 1 . . B 198 ALA HB2 . 18000 1 1039 . 2 2 47 47 ALA HB3 H 1 1.42 0.03 . 1 1 . . B 198 ALA HB3 . 18000 1 1040 . 2 2 47 47 ALA C C 13 178.24 0.20 . 1 1 . . B 198 ALA C . 18000 1 1041 . 2 2 47 47 ALA CA C 13 53.55 0.20 . 1 1 . . B 198 ALA CA . 18000 1 1042 . 2 2 47 47 ALA CB C 13 15.86 0.20 . 1 1 . . B 198 ALA CB . 18000 1 1043 . 2 2 47 47 ALA N N 15 122.31 0.30 . 1 1 . . B 198 ALA N . 18000 1 1044 . 2 2 48 48 ASN H H 1 8.34 0.03 . 1 1 . . B 199 ASN H . 18000 1 1045 . 2 2 48 48 ASN HA H 1 4.39 0.03 . 1 1 . . B 199 ASN HA . 18000 1 1046 . 2 2 48 48 ASN HB2 H 1 2.78 0.03 . 2 1 . . B 199 ASN HB2 . 18000 1 1047 . 2 2 48 48 ASN HB3 H 1 2.86 0.03 . 2 1 . . B 199 ASN HB3 . 18000 1 1048 . 2 2 48 48 ASN HD21 H 1 7.12 0.03 . 2 1 . . B 199 ASN HD21 . 18000 1 1049 . 2 2 48 48 ASN HD22 H 1 7.77 0.03 . 2 1 . . B 199 ASN HD22 . 18000 1 1050 . 2 2 48 48 ASN C C 13 176.04 0.20 . 1 1 . . B 199 ASN C . 18000 1 1051 . 2 2 48 48 ASN CA C 13 54.09 0.20 . 1 1 . . B 199 ASN CA . 18000 1 1052 . 2 2 48 48 ASN CB C 13 36.19 0.20 . 1 1 . . B 199 ASN CB . 18000 1 1053 . 2 2 48 48 ASN N N 15 115.86 0.30 . 1 1 . . B 199 ASN N . 18000 1 1054 . 2 2 48 48 ASN ND2 N 15 113.82 0.30 . 1 1 . . B 199 ASN ND2 . 18000 1 1055 . 2 2 49 49 TYR H H 1 8.33 0.03 . 1 1 . . B 200 TYR H . 18000 1 1056 . 2 2 49 49 TYR HA H 1 4.28 0.03 . 1 1 . . B 200 TYR HA . 18000 1 1057 . 2 2 49 49 TYR HB2 H 1 3.10 0.03 . 2 1 . . B 200 TYR HB2 . 18000 1 1058 . 2 2 49 49 TYR HB3 H 1 3.24 0.03 . 2 1 . . B 200 TYR HB3 . 18000 1 1059 . 2 2 49 49 TYR HD2 H 1 7.07 0.03 . 3 1 . . B 200 TYR HD2 . 18000 1 1060 . 2 2 49 49 TYR HE2 H 1 6.96 0.03 . 3 1 . . B 200 TYR HE2 . 18000 1 1061 . 2 2 49 49 TYR C C 13 176.26 0.20 . 1 1 . . B 200 TYR C . 18000 1 1062 . 2 2 49 49 TYR CA C 13 58.68 0.20 . 1 1 . . B 200 TYR CA . 18000 1 1063 . 2 2 49 49 TYR CB C 13 36.04 0.20 . 1 1 . . B 200 TYR CB . 18000 1 1064 . 2 2 49 49 TYR N N 15 124.50 0.30 . 1 1 . . B 200 TYR N . 18000 1 1065 . 2 2 50 50 ARG H H 1 8.37 0.03 . 1 1 . . B 201 ARG H . 18000 1 1066 . 2 2 50 50 ARG HA H 1 3.56 0.03 . 1 1 . . B 201 ARG HA . 18000 1 1067 . 2 2 50 50 ARG HB2 H 1 1.59 0.03 . 2 1 . . B 201 ARG HB2 . 18000 1 1068 . 2 2 50 50 ARG HB3 H 1 1.67 0.03 . 2 1 . . B 201 ARG HB3 . 18000 1 1069 . 2 2 50 50 ARG HG3 H 1 1.24 0.03 . 2 1 . . B 201 ARG HG3 . 18000 1 1070 . 2 2 50 50 ARG HD2 H 1 3.03 0.03 . 2 1 . . B 201 ARG HD2 . 18000 1 1071 . 2 2 50 50 ARG HD3 H 1 3.21 0.03 . 2 1 . . B 201 ARG HD3 . 18000 1 1072 . 2 2 50 50 ARG C C 13 176.85 0.20 . 1 1 . . B 201 ARG C . 18000 1 1073 . 2 2 50 50 ARG CA C 13 55.34 0.20 . 1 1 . . B 201 ARG CA . 18000 1 1074 . 2 2 50 50 ARG CB C 13 27.02 0.20 . 1 1 . . B 201 ARG CB . 18000 1 1075 . 2 2 50 50 ARG CG C 13 24.81 0.20 . 1 1 . . B 201 ARG CG . 18000 1 1076 . 2 2 50 50 ARG CD C 13 39.77 0.20 . 1 1 . . B 201 ARG CD . 18000 1 1077 . 2 2 50 50 ARG N N 15 119.33 0.30 . 1 1 . . B 201 ARG N . 18000 1 1078 . 2 2 51 51 LYS H H 1 7.94 0.03 . 1 1 . . B 202 LYS H . 18000 1 1079 . 2 2 51 51 LYS HA H 1 4.01 0.03 . 1 1 . . B 202 LYS HA . 18000 1 1080 . 2 2 51 51 LYS HB3 H 1 1.85 0.03 . 2 1 . . B 202 LYS HB3 . 18000 1 1081 . 2 2 51 51 LYS HG2 H 1 1.39 0.03 . 2 1 . . B 202 LYS HG2 . 18000 1 1082 . 2 2 51 51 LYS HG3 H 1 1.54 0.03 . 2 1 . . B 202 LYS HG3 . 18000 1 1083 . 2 2 51 51 LYS HD3 H 1 1.62 0.03 . 2 1 . . B 202 LYS HD3 . 18000 1 1084 . 2 2 51 51 LYS HE3 H 1 2.83 0.03 . 2 1 . . B 202 LYS HE3 . 18000 1 1085 . 2 2 51 51 LYS C C 13 176.09 0.20 . 1 1 . . B 202 LYS C . 18000 1 1086 . 2 2 51 51 LYS CA C 13 56.96 0.20 . 1 1 . . B 202 LYS CA . 18000 1 1087 . 2 2 51 51 LYS CB C 13 30.59 0.20 . 1 1 . . B 202 LYS CB . 18000 1 1088 . 2 2 51 51 LYS CG C 13 23.85 0.20 . 1 1 . . B 202 LYS CG . 18000 1 1089 . 2 2 51 51 LYS CE C 13 40.14 0.20 . 1 1 . . B 202 LYS CE . 18000 1 1090 . 2 2 51 51 LYS N N 15 118.54 0.30 . 1 1 . . B 202 LYS N . 18000 1 1091 . 2 2 52 52 SER H H 1 7.70 0.03 . 1 1 . . B 203 SER H . 18000 1 1092 . 2 2 52 52 SER HA H 1 4.32 0.03 . 1 1 . . B 203 SER HA . 18000 1 1093 . 2 2 52 52 SER HB3 H 1 3.93 0.03 . 2 1 . . B 203 SER HB3 . 18000 1 1094 . 2 2 52 52 SER C C 13 172.90 0.20 . 1 1 . . B 203 SER C . 18000 1 1095 . 2 2 52 52 SER CA C 13 57.87 0.20 . 1 1 . . B 203 SER CA . 18000 1 1096 . 2 2 52 52 SER CB C 13 61.70 0.20 . 1 1 . . B 203 SER CB . 18000 1 1097 . 2 2 52 52 SER N N 15 113.88 0.30 . 1 1 . . B 203 SER N . 18000 1 1098 . 2 2 53 53 ARG H H 1 7.45 0.03 . 1 1 . . B 204 ARG H . 18000 1 1099 . 2 2 53 53 ARG HA H 1 4.24 0.03 . 1 1 . . B 204 ARG HA . 18000 1 1100 . 2 2 53 53 ARG HB2 H 1 1.56 0.03 . 2 1 . . B 204 ARG HB2 . 18000 1 1101 . 2 2 53 53 ARG HB3 H 1 1.82 0.03 . 2 1 . . B 204 ARG HB3 . 18000 1 1102 . 2 2 53 53 ARG HG3 H 1 1.43 0.03 . 2 1 . . B 204 ARG HG3 . 18000 1 1103 . 2 2 53 53 ARG HD2 H 1 2.79 0.03 . 2 1 . . B 204 ARG HD2 . 18000 1 1104 . 2 2 53 53 ARG HD3 H 1 2.84 0.03 . 2 1 . . B 204 ARG HD3 . 18000 1 1105 . 2 2 53 53 ARG C C 13 174.81 0.20 . 1 1 . . B 204 ARG C . 18000 1 1106 . 2 2 53 53 ARG CA C 13 54.27 0.20 . 1 1 . . B 204 ARG CA . 18000 1 1107 . 2 2 53 53 ARG CB C 13 28.70 0.20 . 1 1 . . B 204 ARG CB . 18000 1 1108 . 2 2 53 53 ARG CG C 13 24.74 0.20 . 1 1 . . B 204 ARG CG . 18000 1 1109 . 2 2 53 53 ARG CD C 13 41.02 0.20 . 1 1 . . B 204 ARG CD . 18000 1 1110 . 2 2 53 53 ARG N N 15 120.85 0.30 . 1 1 . . B 204 ARG N . 18000 1 1111 . 2 2 54 54 GLY H H 1 7.93 0.03 . 1 1 . . B 205 GLY H . 18000 1 1112 . 2 2 54 54 GLY HA3 H 1 3.91 0.03 . 2 1 . . B 205 GLY HA3 . 18000 1 1113 . 2 2 54 54 GLY C C 13 171.91 0.20 . 1 1 . . B 205 GLY C . 18000 1 1114 . 2 2 54 54 GLY CA C 13 43.57 0.20 . 1 1 . . B 205 GLY CA . 18000 1 1115 . 2 2 54 54 GLY N N 15 107.95 0.30 . 1 1 . . B 205 GLY N . 18000 1 1116 . 2 2 55 55 ASN H H 1 8.33 0.03 . 1 1 . . B 206 ASN H . 18000 1 1117 . 2 2 55 55 ASN HA H 1 4.76 0.03 . 1 1 . . B 206 ASN HA . 18000 1 1118 . 2 2 55 55 ASN HB2 H 1 2.75 0.03 . 2 1 . . B 206 ASN HB2 . 18000 1 1119 . 2 2 55 55 ASN HB3 H 1 2.81 0.03 . 2 1 . . B 206 ASN HB3 . 18000 1 1120 . 2 2 55 55 ASN C C 13 173.81 0.20 . 1 1 . . B 206 ASN C . 18000 1 1121 . 2 2 55 55 ASN CA C 13 51.43 0.20 . 1 1 . . B 206 ASN CA . 18000 1 1122 . 2 2 55 55 ASN CB C 13 37.09 0.20 . 1 1 . . B 206 ASN CB . 18000 1 1123 . 2 2 55 55 ASN N N 15 118.38 0.30 . 1 1 . . B 206 ASN N . 18000 1 1124 . 2 2 56 56 THR HA H 1 4.27 0.03 . 1 1 . . B 207 THR HA . 18000 1 1125 . 2 2 56 56 THR HB H 1 4.26 0.03 . 1 1 . . B 207 THR HB . 18000 1 1126 . 2 2 56 56 THR HG21 H 1 1.16 0.03 . 1 1 . . B 207 THR HG21 . 18000 1 1127 . 2 2 56 56 THR HG22 H 1 1.16 0.03 . 1 1 . . B 207 THR HG22 . 18000 1 1128 . 2 2 56 56 THR HG23 H 1 1.16 0.03 . 1 1 . . B 207 THR HG23 . 18000 1 1129 . 2 2 56 56 THR C C 13 172.56 0.20 . 1 1 . . B 207 THR C . 18000 1 1130 . 2 2 56 56 THR CA C 13 60.42 0.20 . 1 1 . . B 207 THR CA . 18000 1 1131 . 2 2 56 56 THR CB C 13 67.75 0.20 . 1 1 . . B 207 THR CB . 18000 1 1132 . 2 2 56 56 THR CG2 C 13 19.84 0.20 . 1 1 . . B 207 THR CG2 . 18000 1 1133 . 2 2 57 57 ASP H H 1 8.35 0.03 . 1 1 . . B 208 ASP H . 18000 1 1134 . 2 2 57 57 ASP HA H 1 4.55 0.03 . 1 1 . . B 208 ASP HA . 18000 1 1135 . 2 2 57 57 ASP HB3 H 1 2.67 0.03 . 2 1 . . B 208 ASP HB3 . 18000 1 1136 . 2 2 57 57 ASP C C 13 174.17 0.20 . 1 1 . . B 208 ASP C . 18000 1 1137 . 2 2 57 57 ASP CA C 13 52.67 0.20 . 1 1 . . B 208 ASP CA . 18000 1 1138 . 2 2 57 57 ASP CB C 13 39.12 0.20 . 1 1 . . B 208 ASP CB . 18000 1 1139 . 2 2 57 57 ASP N N 15 121.18 0.30 . 1 1 . . B 208 ASP N . 18000 1 1140 . 2 2 58 58 ASN H H 1 8.28 0.03 . 1 1 . . B 209 ASN H . 18000 1 1141 . 2 2 58 58 ASN HA H 1 4.60 0.03 . 1 1 . . B 209 ASN HA . 18000 1 1142 . 2 2 58 58 ASN HB2 H 1 2.77 0.03 . 2 1 . . B 209 ASN HB2 . 18000 1 1143 . 2 2 58 58 ASN HB3 H 1 2.86 0.03 . 2 1 . . B 209 ASN HB3 . 18000 1 1144 . 2 2 58 58 ASN HD21 H 1 6.91 0.03 . 2 1 . . B 209 ASN HD21 . 18000 1 1145 . 2 2 58 58 ASN HD22 H 1 7.56 0.03 . 2 1 . . B 209 ASN HD22 . 18000 1 1146 . 2 2 58 58 ASN C C 13 173.67 0.20 . 1 1 . . B 209 ASN C . 18000 1 1147 . 2 2 58 58 ASN CA C 13 52.11 0.20 . 1 1 . . B 209 ASN CA . 18000 1 1148 . 2 2 58 58 ASN CB C 13 36.73 0.20 . 1 1 . . B 209 ASN CB . 18000 1 1149 . 2 2 58 58 ASN N N 15 117.67 0.30 . 1 1 . . B 209 ASN N . 18000 1 1150 . 2 2 58 58 ASN ND2 N 15 112.43 0.30 . 1 1 . . B 209 ASN ND2 . 18000 1 1151 . 2 2 59 59 LYS H H 1 8.21 0.03 . 1 1 . . B 210 LYS H . 18000 1 1152 . 2 2 59 59 LYS HA H 1 4.27 0.03 . 1 1 . . B 210 LYS HA . 18000 1 1153 . 2 2 59 59 LYS HB3 H 1 1.78 0.03 . 2 1 . . B 210 LYS HB3 . 18000 1 1154 . 2 2 59 59 LYS HG2 H 1 1.37 0.03 . 2 1 . . B 210 LYS HG2 . 18000 1 1155 . 2 2 59 59 LYS HG3 H 1 1.44 0.03 . 2 1 . . B 210 LYS HG3 . 18000 1 1156 . 2 2 59 59 LYS HD3 H 1 1.66 0.03 . 2 1 . . B 210 LYS HD3 . 18000 1 1157 . 2 2 59 59 LYS HE3 H 1 2.96 0.03 . 2 1 . . B 210 LYS HE3 . 18000 1 1158 . 2 2 59 59 LYS C C 13 174.91 0.20 . 1 1 . . B 210 LYS C . 18000 1 1159 . 2 2 59 59 LYS CA C 13 54.90 0.20 . 1 1 . . B 210 LYS CA . 18000 1 1160 . 2 2 59 59 LYS CB C 13 30.67 0.20 . 1 1 . . B 210 LYS CB . 18000 1 1161 . 2 2 59 59 LYS CG C 13 23.11 0.20 . 1 1 . . B 210 LYS CG . 18000 1 1162 . 2 2 59 59 LYS CD C 13 27.26 0.20 . 1 1 . . B 210 LYS CD . 18000 1 1163 . 2 2 59 59 LYS N N 15 120.38 0.30 . 1 1 . . B 210 LYS N . 18000 1 1164 . 2 2 60 60 GLU H H 1 8.38 0.03 . 1 1 . . B 211 GLU H . 18000 1 1165 . 2 2 60 60 GLU HA H 1 4.07 0.03 . 1 1 . . B 211 GLU HA . 18000 1 1166 . 2 2 60 60 GLU HB3 H 1 1.97 0.03 . 2 1 . . B 211 GLU HB3 . 18000 1 1167 . 2 2 60 60 GLU HG3 H 1 2.16 0.03 . 2 1 . . B 211 GLU HG3 . 18000 1 1168 . 2 2 60 60 GLU C C 13 174.81 0.20 . 1 1 . . B 211 GLU C . 18000 1 1169 . 2 2 60 60 GLU CA C 13 55.94 0.20 . 1 1 . . B 211 GLU CA . 18000 1 1170 . 2 2 60 60 GLU CB C 13 27.70 0.20 . 1 1 . . B 211 GLU CB . 18000 1 1171 . 2 2 60 60 GLU CG C 13 34.45 0.20 . 1 1 . . B 211 GLU CG . 18000 1 1172 . 2 2 60 60 GLU N N 15 120.74 0.30 . 1 1 . . B 211 GLU N . 18000 1 1173 . 2 2 61 61 TYR H H 1 7.94 0.03 . 1 1 . . B 212 TYR H . 18000 1 1174 . 2 2 61 61 TYR HA H 1 4.38 0.03 . 1 1 . . B 212 TYR HA . 18000 1 1175 . 2 2 61 61 TYR HB2 H 1 2.96 0.03 . 2 1 . . B 212 TYR HB2 . 18000 1 1176 . 2 2 61 61 TYR HB3 H 1 3.09 0.03 . 2 1 . . B 212 TYR HB3 . 18000 1 1177 . 2 2 61 61 TYR HD2 H 1 7.07 0.03 . 3 1 . . B 212 TYR HD2 . 18000 1 1178 . 2 2 61 61 TYR HE2 H 1 6.77 0.03 . 3 1 . . B 212 TYR HE2 . 18000 1 1179 . 2 2 61 61 TYR C C 13 174.83 0.20 . 1 1 . . B 212 TYR C . 18000 1 1180 . 2 2 61 61 TYR CA C 13 57.42 0.20 . 1 1 . . B 212 TYR CA . 18000 1 1181 . 2 2 61 61 TYR CB C 13 36.53 0.20 . 1 1 . . B 212 TYR CB . 18000 1 1182 . 2 2 61 61 TYR N N 15 119.43 0.30 . 1 1 . . B 212 TYR N . 18000 1 1183 . 2 2 62 62 ALA HA H 1 4.26 0.03 . 1 1 . . B 213 ALA HA . 18000 1 1184 . 2 2 62 62 ALA HB1 H 1 1.30 0.03 . 1 1 . . B 213 ALA HB1 . 18000 1 1185 . 2 2 62 62 ALA HB2 H 1 1.30 0.03 . 1 1 . . B 213 ALA HB2 . 18000 1 1186 . 2 2 62 62 ALA HB3 H 1 1.30 0.03 . 1 1 . . B 213 ALA HB3 . 18000 1 1187 . 2 2 62 62 ALA C C 13 176.63 0.20 . 1 1 . . B 213 ALA C . 18000 1 1188 . 2 2 62 62 ALA CA C 13 51.99 0.20 . 1 1 . . B 213 ALA CA . 18000 1 1189 . 2 2 62 62 ALA CB C 13 16.45 0.20 . 1 1 . . B 213 ALA CB . 18000 1 1190 . 2 2 63 63 VAL HA H 1 3.47 0.03 . 1 1 . . B 214 VAL HA . 18000 1 1191 . 2 2 63 63 VAL HB H 1 2.10 0.03 . 1 1 . . B 214 VAL HB . 18000 1 1192 . 2 2 63 63 VAL HG11 H 1 1.01 0.03 . 2 1 . . B 214 VAL HG11 . 18000 1 1193 . 2 2 63 63 VAL HG12 H 1 1.01 0.03 . 2 1 . . B 214 VAL HG12 . 18000 1 1194 . 2 2 63 63 VAL HG13 H 1 1.01 0.03 . 2 1 . . B 214 VAL HG13 . 18000 1 1195 . 2 2 63 63 VAL HG21 H 1 0.90 0.03 . 2 1 . . B 214 VAL HG21 . 18000 1 1196 . 2 2 63 63 VAL HG22 H 1 0.90 0.03 . 2 1 . . B 214 VAL HG22 . 18000 1 1197 . 2 2 63 63 VAL HG23 H 1 0.90 0.03 . 2 1 . . B 214 VAL HG23 . 18000 1 1198 . 2 2 63 63 VAL C C 13 174.98 0.20 . 1 1 . . B 214 VAL C . 18000 1 1199 . 2 2 63 63 VAL CA C 13 64.19 0.20 . 1 1 . . B 214 VAL CA . 18000 1 1200 . 2 2 63 63 VAL CB C 13 29.82 0.20 . 1 1 . . B 214 VAL CB . 18000 1 1201 . 2 2 63 63 VAL CG1 C 13 21.84 0.20 . 2 1 . . B 214 VAL CG1 . 18000 1 1202 . 2 2 63 63 VAL CG2 C 13 19.26 0.20 . 2 1 . . B 214 VAL CG2 . 18000 1 1203 . 2 2 64 64 ASN H H 1 8.19 0.03 . 1 1 . . B 215 ASN H . 18000 1 1204 . 2 2 64 64 ASN HA H 1 4.30 0.03 . 1 1 . . B 215 ASN HA . 18000 1 1205 . 2 2 64 64 ASN HB2 H 1 2.70 0.03 . 2 1 . . B 215 ASN HB2 . 18000 1 1206 . 2 2 64 64 ASN HB3 H 1 2.81 0.03 . 2 1 . . B 215 ASN HB3 . 18000 1 1207 . 2 2 64 64 ASN HD21 H 1 6.97 0.03 . 2 1 . . B 215 ASN HD21 . 18000 1 1208 . 2 2 64 64 ASN HD22 H 1 7.57 0.03 . 2 1 . . B 215 ASN HD22 . 18000 1 1209 . 2 2 64 64 ASN C C 13 176.32 0.20 . 1 1 . . B 215 ASN C . 18000 1 1210 . 2 2 64 64 ASN CA C 13 54.19 0.20 . 1 1 . . B 215 ASN CA . 18000 1 1211 . 2 2 64 64 ASN CB C 13 35.36 0.20 . 1 1 . . B 215 ASN CB . 18000 1 1212 . 2 2 64 64 ASN N N 15 117.46 0.30 . 1 1 . . B 215 ASN N . 18000 1 1213 . 2 2 64 64 ASN ND2 N 15 112.09 0.30 . 1 1 . . B 215 ASN ND2 . 18000 1 1214 . 2 2 65 65 GLU H H 1 7.73 0.03 . 1 1 . . B 216 GLU H . 18000 1 1215 . 2 2 65 65 GLU HA H 1 4.00 0.03 . 1 1 . . B 216 GLU HA . 18000 1 1216 . 2 2 65 65 GLU HB2 H 1 1.90 0.03 . 2 1 . . B 216 GLU HB2 . 18000 1 1217 . 2 2 65 65 GLU HB3 H 1 2.16 0.03 . 2 1 . . B 216 GLU HB3 . 18000 1 1218 . 2 2 65 65 GLU C C 13 177.24 0.20 . 1 1 . . B 216 GLU C . 18000 1 1219 . 2 2 65 65 GLU CA C 13 57.18 0.20 . 1 1 . . B 216 GLU CA . 18000 1 1220 . 2 2 65 65 GLU CB C 13 28.40 0.20 . 1 1 . . B 216 GLU CB . 18000 1 1221 . 2 2 65 65 GLU CG C 13 34.78 0.20 . 1 1 . . B 216 GLU CG . 18000 1 1222 . 2 2 65 65 GLU N N 15 119.43 0.30 . 1 1 . . B 216 GLU N . 18000 1 1223 . 2 2 66 66 VAL H H 1 7.82 0.03 . 1 1 . . B 217 VAL H . 18000 1 1224 . 2 2 66 66 VAL HA H 1 3.53 0.03 . 1 1 . . B 217 VAL HA . 18000 1 1225 . 2 2 66 66 VAL HB H 1 2.09 0.03 . 1 1 . . B 217 VAL HB . 18000 1 1226 . 2 2 66 66 VAL HG11 H 1 0.93 0.03 . 2 1 . . B 217 VAL HG11 . 18000 1 1227 . 2 2 66 66 VAL HG12 H 1 0.93 0.03 . 2 1 . . B 217 VAL HG12 . 18000 1 1228 . 2 2 66 66 VAL HG13 H 1 0.93 0.03 . 2 1 . . B 217 VAL HG13 . 18000 1 1229 . 2 2 66 66 VAL HG21 H 1 0.72 0.03 . 2 1 . . B 217 VAL HG21 . 18000 1 1230 . 2 2 66 66 VAL HG22 H 1 0.72 0.03 . 2 1 . . B 217 VAL HG22 . 18000 1 1231 . 2 2 66 66 VAL HG23 H 1 0.72 0.03 . 2 1 . . B 217 VAL HG23 . 18000 1 1232 . 2 2 66 66 VAL C C 13 174.99 0.20 . 1 1 . . B 217 VAL C . 18000 1 1233 . 2 2 66 66 VAL CA C 13 64.31 0.20 . 1 1 . . B 217 VAL CA . 18000 1 1234 . 2 2 66 66 VAL CB C 13 29.64 0.20 . 1 1 . . B 217 VAL CB . 18000 1 1235 . 2 2 66 66 VAL CG1 C 13 19.07 0.20 . 2 1 . . B 217 VAL CG1 . 18000 1 1236 . 2 2 66 66 VAL CG2 C 13 21.58 0.20 . 2 1 . . B 217 VAL CG2 . 18000 1 1237 . 2 2 66 66 VAL N N 15 120.69 0.30 . 1 1 . . B 217 VAL N . 18000 1 1238 . 2 2 67 67 VAL H H 1 8.26 0.03 . 1 1 . . B 218 VAL H . 18000 1 1239 . 2 2 67 67 VAL HA H 1 3.50 0.03 . 1 1 . . B 218 VAL HA . 18000 1 1240 . 2 2 67 67 VAL HB H 1 2.11 0.03 . 1 1 . . B 218 VAL HB . 18000 1 1241 . 2 2 67 67 VAL HG11 H 1 1.10 0.03 . 2 1 . . B 218 VAL HG11 . 18000 1 1242 . 2 2 67 67 VAL HG12 H 1 1.10 0.03 . 2 1 . . B 218 VAL HG12 . 18000 1 1243 . 2 2 67 67 VAL HG13 H 1 1.10 0.03 . 2 1 . . B 218 VAL HG13 . 18000 1 1244 . 2 2 67 67 VAL HG21 H 1 0.98 0.03 . 2 1 . . B 218 VAL HG21 . 18000 1 1245 . 2 2 67 67 VAL HG22 H 1 0.98 0.03 . 2 1 . . B 218 VAL HG22 . 18000 1 1246 . 2 2 67 67 VAL HG23 H 1 0.98 0.03 . 2 1 . . B 218 VAL HG23 . 18000 1 1247 . 2 2 67 67 VAL C C 13 175.20 0.20 . 1 1 . . B 218 VAL C . 18000 1 1248 . 2 2 67 67 VAL CA C 13 64.96 0.20 . 1 1 . . B 218 VAL CA . 18000 1 1249 . 2 2 67 67 VAL CB C 13 29.71 0.20 . 1 1 . . B 218 VAL CB . 18000 1 1250 . 2 2 67 67 VAL CG1 C 13 20.04 0.20 . 2 1 . . B 218 VAL CG1 . 18000 1 1251 . 2 2 67 67 VAL CG2 C 13 20.19 0.20 . 2 1 . . B 218 VAL CG2 . 18000 1 1252 . 2 2 67 67 VAL N N 15 117.01 0.30 . 1 1 . . B 218 VAL N . 18000 1 1253 . 2 2 68 68 ALA H H 1 7.49 0.03 . 1 1 . . B 219 ALA H . 18000 1 1254 . 2 2 68 68 ALA HA H 1 3.93 0.03 . 1 1 . . B 219 ALA HA . 18000 1 1255 . 2 2 68 68 ALA HB1 H 1 1.32 0.03 . 1 1 . . B 219 ALA HB1 . 18000 1 1256 . 2 2 68 68 ALA HB2 H 1 1.32 0.03 . 1 1 . . B 219 ALA HB2 . 18000 1 1257 . 2 2 68 68 ALA HB3 H 1 1.32 0.03 . 1 1 . . B 219 ALA HB3 . 18000 1 1258 . 2 2 68 68 ALA C C 13 178.31 0.20 . 1 1 . . B 219 ALA C . 18000 1 1259 . 2 2 68 68 ALA CA C 13 53.04 0.20 . 1 1 . . B 219 ALA CA . 18000 1 1260 . 2 2 68 68 ALA CB C 13 16.28 0.20 . 1 1 . . B 219 ALA CB . 18000 1 1261 . 2 2 68 68 ALA N N 15 120.36 0.30 . 1 1 . . B 219 ALA N . 18000 1 1262 . 2 2 69 69 GLY H H 1 7.64 0.03 . 1 1 . . B 220 GLY H . 18000 1 1263 . 2 2 69 69 GLY HA2 H 1 1.98 0.03 . 2 1 . . B 220 GLY HA2 . 18000 1 1264 . 2 2 69 69 GLY HA3 H 1 3.21 0.03 . 2 1 . . B 220 GLY HA3 . 18000 1 1265 . 2 2 69 69 GLY C C 13 172.88 0.20 . 1 1 . . B 220 GLY C . 18000 1 1266 . 2 2 69 69 GLY CA C 13 44.13 0.20 . 1 1 . . B 220 GLY CA . 18000 1 1267 . 2 2 69 69 GLY N N 15 106.25 0.30 . 1 1 . . B 220 GLY N . 18000 1 1268 . 2 2 70 70 ILE H H 1 8.13 0.03 . 1 1 . . B 221 ILE H . 18000 1 1269 . 2 2 70 70 ILE HA H 1 3.29 0.03 . 1 1 . . B 221 ILE HA . 18000 1 1270 . 2 2 70 70 ILE HB H 1 1.56 0.03 . 1 1 . . B 221 ILE HB . 18000 1 1271 . 2 2 70 70 ILE HG12 H 1 1.79 0.03 . 2 1 . . B 221 ILE HG12 . 18000 1 1272 . 2 2 70 70 ILE HG13 H 1 0.69 0.03 . 2 1 . . B 221 ILE HG13 . 18000 1 1273 . 2 2 70 70 ILE HG21 H 1 0.59 0.03 . 1 1 . . B 221 ILE HG21 . 18000 1 1274 . 2 2 70 70 ILE HG22 H 1 0.59 0.03 . 1 1 . . B 221 ILE HG22 . 18000 1 1275 . 2 2 70 70 ILE HG23 H 1 0.59 0.03 . 1 1 . . B 221 ILE HG23 . 18000 1 1276 . 2 2 70 70 ILE HD11 H 1 0.37 0.03 . 1 1 . . B 221 ILE HD11 . 18000 1 1277 . 2 2 70 70 ILE HD12 H 1 0.37 0.03 . 1 1 . . B 221 ILE HD12 . 18000 1 1278 . 2 2 70 70 ILE HD13 H 1 0.37 0.03 . 1 1 . . B 221 ILE HD13 . 18000 1 1279 . 2 2 70 70 ILE C C 13 175.10 0.20 . 1 1 . . B 221 ILE C . 18000 1 1280 . 2 2 70 70 ILE CA C 13 64.07 0.20 . 1 1 . . B 221 ILE CA . 18000 1 1281 . 2 2 70 70 ILE CB C 13 35.26 0.20 . 1 1 . . B 221 ILE CB . 18000 1 1282 . 2 2 70 70 ILE CG1 C 13 27.96 0.20 . 1 1 . . B 221 ILE CG1 . 18000 1 1283 . 2 2 70 70 ILE CG2 C 13 16.09 0.20 . 1 1 . . B 221 ILE CG2 . 18000 1 1284 . 2 2 70 70 ILE CD1 C 13 10.97 0.20 . 1 1 . . B 221 ILE CD1 . 18000 1 1285 . 2 2 70 70 ILE N N 15 119.94 0.30 . 1 1 . . B 221 ILE N . 18000 1 1286 . 2 2 71 71 LYS H H 1 7.75 0.03 . 1 1 . . B 222 LYS H . 18000 1 1287 . 2 2 71 71 LYS HA H 1 3.43 0.03 . 1 1 . . B 222 LYS HA . 18000 1 1288 . 2 2 71 71 LYS HB3 H 1 1.77 0.03 . 2 1 . . B 222 LYS HB3 . 18000 1 1289 . 2 2 71 71 LYS HG3 H 1 1.31 0.03 . 2 1 . . B 222 LYS HG3 . 18000 1 1290 . 2 2 71 71 LYS HE3 H 1 2.80 0.03 . 2 1 . . B 222 LYS HE3 . 18000 1 1291 . 2 2 71 71 LYS C C 13 175.28 0.20 . 1 1 . . B 222 LYS C . 18000 1 1292 . 2 2 71 71 LYS CA C 13 59.27 0.20 . 1 1 . . B 222 LYS CA . 18000 1 1293 . 2 2 71 71 LYS CB C 13 30.67 0.20 . 1 1 . . B 222 LYS CB . 18000 1 1294 . 2 2 71 71 LYS CE C 13 39.79 0.20 . 1 1 . . B 222 LYS CE . 18000 1 1295 . 2 2 71 71 LYS N N 15 118.80 0.30 . 1 1 . . B 222 LYS N . 18000 1 1296 . 2 2 72 72 GLU H H 1 7.83 0.03 . 1 1 . . B 223 GLU H . 18000 1 1297 . 2 2 72 72 GLU HA H 1 4.15 0.03 . 1 1 . . B 223 GLU HA . 18000 1 1298 . 2 2 72 72 GLU HB3 H 1 1.99 0.03 . 2 1 . . B 223 GLU HB3 . 18000 1 1299 . 2 2 72 72 GLU HG2 H 1 2.32 0.03 . 2 1 . . B 223 GLU HG2 . 18000 1 1300 . 2 2 72 72 GLU HG3 H 1 2.42 0.03 . 2 1 . . B 223 GLU HG3 . 18000 1 1301 . 2 2 72 72 GLU C C 13 177.33 0.20 . 1 1 . . B 223 GLU C . 18000 1 1302 . 2 2 72 72 GLU CA C 13 57.18 0.20 . 1 1 . . B 223 GLU CA . 18000 1 1303 . 2 2 72 72 GLU CB C 13 27.67 0.20 . 1 1 . . B 223 GLU CB . 18000 1 1304 . 2 2 72 72 GLU CG C 13 34.40 0.20 . 1 1 . . B 223 GLU CG . 18000 1 1305 . 2 2 72 72 GLU N N 15 116.15 0.30 . 1 1 . . B 223 GLU N . 18000 1 1306 . 2 2 73 73 TYR H H 1 8.63 0.03 . 1 1 . . B 224 TYR H . 18000 1 1307 . 2 2 73 73 TYR HA H 1 4.48 0.03 . 1 1 . . B 224 TYR HA . 18000 1 1308 . 2 2 73 73 TYR HB2 H 1 2.99 0.03 . 2 1 . . B 224 TYR HB2 . 18000 1 1309 . 2 2 73 73 TYR HB3 H 1 3.22 0.03 . 2 1 . . B 224 TYR HB3 . 18000 1 1310 . 2 2 73 73 TYR HD2 H 1 6.82 0.03 . 3 1 . . B 224 TYR HD2 . 18000 1 1311 . 2 2 73 73 TYR HE2 H 1 6.50 0.03 . 3 1 . . B 224 TYR HE2 . 18000 1 1312 . 2 2 73 73 TYR C C 13 175.68 0.20 . 1 1 . . B 224 TYR C . 18000 1 1313 . 2 2 73 73 TYR CA C 13 57.52 0.20 . 1 1 . . B 224 TYR CA . 18000 1 1314 . 2 2 73 73 TYR CB C 13 36.94 0.20 . 1 1 . . B 224 TYR CB . 18000 1 1315 . 2 2 73 73 TYR CE2 C 13 116.64 0.20 . 1 1 . . B 224 TYR CE2 . 18000 1 1316 . 2 2 73 73 TYR N N 15 119.76 0.30 . 1 1 . . B 224 TYR N . 18000 1 1317 . 2 2 74 74 PHE H H 1 9.22 0.03 . 1 1 . . B 225 PHE H . 18000 1 1318 . 2 2 74 74 PHE HA H 1 3.41 0.03 . 1 1 . . B 225 PHE HA . 18000 1 1319 . 2 2 74 74 PHE HB2 H 1 2.90 0.03 . 2 1 . . B 225 PHE HB2 . 18000 1 1320 . 2 2 74 74 PHE HB3 H 1 3.23 0.03 . 2 1 . . B 225 PHE HB3 . 18000 1 1321 . 2 2 74 74 PHE HD2 H 1 6.93 0.03 . 3 1 . . B 225 PHE HD2 . 18000 1 1322 . 2 2 74 74 PHE HE2 H 1 6.88 0.03 . 3 1 . . B 225 PHE HE2 . 18000 1 1323 . 2 2 74 74 PHE HZ H 1 6.80 0.03 . 1 1 . . B 225 PHE HZ . 18000 1 1324 . 2 2 74 74 PHE C C 13 173.93 0.20 . 1 1 . . B 225 PHE C . 18000 1 1325 . 2 2 74 74 PHE CA C 13 61.60 0.20 . 1 1 . . B 225 PHE CA . 18000 1 1326 . 2 2 74 74 PHE CB C 13 36.59 0.20 . 1 1 . . B 225 PHE CB . 18000 1 1327 . 2 2 74 74 PHE N N 15 120.09 0.30 . 1 1 . . B 225 PHE N . 18000 1 1328 . 2 2 75 75 ASN H H 1 8.21 0.03 . 1 1 . . B 226 ASN H . 18000 1 1329 . 2 2 75 75 ASN HA H 1 4.47 0.03 . 1 1 . . B 226 ASN HA . 18000 1 1330 . 2 2 75 75 ASN HB2 H 1 2.92 0.03 . 2 1 . . B 226 ASN HB2 . 18000 1 1331 . 2 2 75 75 ASN HB3 H 1 2.98 0.03 . 2 1 . . B 226 ASN HB3 . 18000 1 1332 . 2 2 75 75 ASN HD21 H 1 6.68 0.03 . 2 1 . . B 226 ASN HD21 . 18000 1 1333 . 2 2 75 75 ASN HD22 H 1 7.34 0.03 . 2 1 . . B 226 ASN HD22 . 18000 1 1334 . 2 2 75 75 ASN C C 13 176.63 0.20 . 1 1 . . B 226 ASN C . 18000 1 1335 . 2 2 75 75 ASN CA C 13 54.16 0.20 . 1 1 . . B 226 ASN CA . 18000 1 1336 . 2 2 75 75 ASN CB C 13 35.80 0.20 . 1 1 . . B 226 ASN CB . 18000 1 1337 . 2 2 75 75 ASN N N 15 115.01 0.30 . 1 1 . . B 226 ASN N . 18000 1 1338 . 2 2 75 75 ASN ND2 N 15 109.24 0.30 . 1 1 . . B 226 ASN ND2 . 18000 1 1339 . 2 2 76 76 VAL H H 1 7.43 0.03 . 1 1 . . B 227 VAL H . 18000 1 1340 . 2 2 76 76 VAL HA H 1 4.30 0.03 . 1 1 . . B 227 VAL HA . 18000 1 1341 . 2 2 76 76 VAL HB H 1 2.18 0.03 . 1 1 . . B 227 VAL HB . 18000 1 1342 . 2 2 76 76 VAL HG11 H 1 1.13 0.03 . 2 1 . . B 227 VAL HG11 . 18000 1 1343 . 2 2 76 76 VAL HG12 H 1 1.13 0.03 . 2 1 . . B 227 VAL HG12 . 18000 1 1344 . 2 2 76 76 VAL HG13 H 1 1.13 0.03 . 2 1 . . B 227 VAL HG13 . 18000 1 1345 . 2 2 76 76 VAL HG21 H 1 1.00 0.03 . 2 1 . . B 227 VAL HG21 . 18000 1 1346 . 2 2 76 76 VAL HG22 H 1 1.00 0.03 . 2 1 . . B 227 VAL HG22 . 18000 1 1347 . 2 2 76 76 VAL HG23 H 1 1.00 0.03 . 2 1 . . B 227 VAL HG23 . 18000 1 1348 . 2 2 76 76 VAL C C 13 174.96 0.20 . 1 1 . . B 227 VAL C . 18000 1 1349 . 2 2 76 76 VAL CA C 13 61.32 0.20 . 1 1 . . B 227 VAL CA . 18000 1 1350 . 2 2 76 76 VAL CB C 13 30.67 0.20 . 1 1 . . B 227 VAL CB . 18000 1 1351 . 2 2 76 76 VAL CG1 C 13 19.84 0.20 . 2 1 . . B 227 VAL CG1 . 18000 1 1352 . 2 2 76 76 VAL CG2 C 13 20.03 0.20 . 2 1 . . B 227 VAL CG2 . 18000 1 1353 . 2 2 76 76 VAL N N 15 115.12 0.30 . 1 1 . . B 227 VAL N . 18000 1 1354 . 2 2 77 77 MET H H 1 7.74 0.03 . 1 1 . . B 228 MET H . 18000 1 1355 . 2 2 77 77 MET HA H 1 4.00 0.03 . 1 1 . . B 228 MET HA . 18000 1 1356 . 2 2 77 77 MET HB3 H 1 1.55 0.03 . 2 1 . . B 228 MET HB3 . 18000 1 1357 . 2 2 77 77 MET HG3 H 1 2.50 0.03 . 2 1 . . B 228 MET HG3 . 18000 1 1358 . 2 2 77 77 MET HE1 H 1 1.58 0.03 . 1 1 . . B 228 MET HE1 . 18000 1 1359 . 2 2 77 77 MET HE2 H 1 1.58 0.03 . 1 1 . . B 228 MET HE2 . 18000 1 1360 . 2 2 77 77 MET HE3 H 1 1.58 0.03 . 1 1 . . B 228 MET HE3 . 18000 1 1361 . 2 2 77 77 MET C C 13 176.27 0.20 . 1 1 . . B 228 MET C . 18000 1 1362 . 2 2 77 77 MET CA C 13 54.03 0.20 . 1 1 . . B 228 MET CA . 18000 1 1363 . 2 2 77 77 MET CB C 13 31.51 0.20 . 1 1 . . B 228 MET CB . 18000 1 1364 . 2 2 77 77 MET CE C 13 15.26 0.20 . 1 1 . . B 228 MET CE . 18000 1 1365 . 2 2 77 77 MET N N 15 119.85 0.30 . 1 1 . . B 228 MET N . 18000 1 1366 . 2 2 78 78 LEU H H 1 7.89 0.03 . 1 1 . . B 229 LEU H . 18000 1 1367 . 2 2 78 78 LEU HA H 1 3.15 0.03 . 1 1 . . B 229 LEU HA . 18000 1 1368 . 2 2 78 78 LEU HB2 H 1 0.46 0.03 . 2 1 . . B 229 LEU HB2 . 18000 1 1369 . 2 2 78 78 LEU HB3 H 1 1.07 0.03 . 2 1 . . B 229 LEU HB3 . 18000 1 1370 . 2 2 78 78 LEU HG H 1 0.74 0.03 . 1 1 . . B 229 LEU HG . 18000 1 1371 . 2 2 78 78 LEU HD11 H 1 0.00 0.03 . 2 1 . . B 229 LEU HD11 . 18000 1 1372 . 2 2 78 78 LEU HD12 H 1 0.00 0.03 . 2 1 . . B 229 LEU HD12 . 18000 1 1373 . 2 2 78 78 LEU HD13 H 1 0.00 0.03 . 2 1 . . B 229 LEU HD13 . 18000 1 1374 . 2 2 78 78 LEU HD21 H 1 -0.04 0.03 . 2 1 . . B 229 LEU HD21 . 18000 1 1375 . 2 2 78 78 LEU HD22 H 1 -0.04 0.03 . 2 1 . . B 229 LEU HD22 . 18000 1 1376 . 2 2 78 78 LEU HD23 H 1 -0.04 0.03 . 2 1 . . B 229 LEU HD23 . 18000 1 1377 . 2 2 78 78 LEU C C 13 176.07 0.20 . 1 1 . . B 229 LEU C . 18000 1 1378 . 2 2 78 78 LEU CA C 13 55.86 0.20 . 1 1 . . B 229 LEU CA . 18000 1 1379 . 2 2 78 78 LEU CB C 13 36.34 0.20 . 1 1 . . B 229 LEU CB . 18000 1 1380 . 2 2 78 78 LEU CD1 C 13 21.47 0.20 . 2 1 . . B 229 LEU CD1 . 18000 1 1381 . 2 2 78 78 LEU CD2 C 13 19.85 0.20 . 2 1 . . B 229 LEU CD2 . 18000 1 1382 . 2 2 78 78 LEU N N 15 122.18 0.30 . 1 1 . . B 229 LEU N . 18000 1 1383 . 2 2 79 79 GLY H H 1 8.35 0.03 . 1 1 . . B 230 GLY H . 18000 1 1384 . 2 2 79 79 GLY HA2 H 1 2.86 0.03 . 2 1 . . B 230 GLY HA2 . 18000 1 1385 . 2 2 79 79 GLY HA3 H 1 3.32 0.03 . 2 1 . . B 230 GLY HA3 . 18000 1 1386 . 2 2 79 79 GLY C C 13 173.07 0.20 . 1 1 . . B 230 GLY C . 18000 1 1387 . 2 2 79 79 GLY CA C 13 43.15 0.20 . 1 1 . . B 230 GLY CA . 18000 1 1388 . 2 2 79 79 GLY N N 15 118.39 0.30 . 1 1 . . B 230 GLY N . 18000 1 1389 . 2 2 80 80 THR H H 1 7.04 0.03 . 1 1 . . B 231 THR H . 18000 1 1390 . 2 2 80 80 THR HA H 1 4.28 0.03 . 1 1 . . B 231 THR HA . 18000 1 1391 . 2 2 80 80 THR HB H 1 4.12 0.03 . 1 1 . . B 231 THR HB . 18000 1 1392 . 2 2 80 80 THR HG1 H 1 4.62 0.03 . 1 1 . . B 231 THR HG1 . 18000 1 1393 . 2 2 80 80 THR HG21 H 1 1.21 0.03 . 1 1 . . B 231 THR HG21 . 18000 1 1394 . 2 2 80 80 THR HG22 H 1 1.21 0.03 . 1 1 . . B 231 THR HG22 . 18000 1 1395 . 2 2 80 80 THR HG23 H 1 1.21 0.03 . 1 1 . . B 231 THR HG23 . 18000 1 1396 . 2 2 80 80 THR C C 13 173.26 0.20 . 1 1 . . B 231 THR C . 18000 1 1397 . 2 2 80 80 THR CA C 13 60.03 0.20 . 1 1 . . B 231 THR CA . 18000 1 1398 . 2 2 80 80 THR CB C 13 68.54 0.20 . 1 1 . . B 231 THR CB . 18000 1 1399 . 2 2 80 80 THR CG2 C 13 20.64 0.20 . 1 1 . . B 231 THR CG2 . 18000 1 1400 . 2 2 80 80 THR N N 15 124.79 0.30 . 1 1 . . B 231 THR N . 18000 1 1401 . 2 2 81 81 GLN H H 1 8.11 0.03 . 1 1 . . B 232 GLN H . 18000 1 1402 . 2 2 81 81 GLN HA H 1 5.09 0.03 . 1 1 . . B 232 GLN HA . 18000 1 1403 . 2 2 81 81 GLN HB3 H 1 1.57 0.03 . 2 1 . . B 232 GLN HB3 . 18000 1 1404 . 2 2 81 81 GLN HG3 H 1 2.27 0.03 . 2 1 . . B 232 GLN HG3 . 18000 1 1405 . 2 2 81 81 GLN HE21 H 1 6.45 0.03 . 2 1 . . B 232 GLN HE21 . 18000 1 1406 . 2 2 81 81 GLN HE22 H 1 7.71 0.03 . 2 1 . . B 232 GLN HE22 . 18000 1 1407 . 2 2 81 81 GLN C C 13 175.79 0.20 . 1 1 . . B 232 GLN C . 18000 1 1408 . 2 2 81 81 GLN CA C 13 53.65 0.20 . 1 1 . . B 232 GLN CA . 18000 1 1409 . 2 2 81 81 GLN CB C 13 30.52 0.20 . 1 1 . . B 232 GLN CB . 18000 1 1410 . 2 2 81 81 GLN CG C 13 31.05 0.20 . 1 1 . . B 232 GLN CG . 18000 1 1411 . 2 2 81 81 GLN N N 15 114.74 0.30 . 1 1 . . B 232 GLN N . 18000 1 1412 . 2 2 81 81 GLN NE2 N 15 112.17 0.30 . 1 1 . . B 232 GLN NE2 . 18000 1 1413 . 2 2 82 82 LEU H H 1 6.98 0.03 . 1 1 . . B 233 LEU H . 18000 1 1414 . 2 2 82 82 LEU HA H 1 4.46 0.03 . 1 1 . . B 233 LEU HA . 18000 1 1415 . 2 2 82 82 LEU HB3 H 1 1.30 0.03 . 2 1 . . B 233 LEU HB3 . 18000 1 1416 . 2 2 82 82 LEU HD11 H 1 0.50 0.03 . 2 1 . . B 233 LEU HD11 . 18000 1 1417 . 2 2 82 82 LEU HD12 H 1 0.50 0.03 . 2 1 . . B 233 LEU HD12 . 18000 1 1418 . 2 2 82 82 LEU HD13 H 1 0.50 0.03 . 2 1 . . B 233 LEU HD13 . 18000 1 1419 . 2 2 82 82 LEU HD21 H 1 0.45 0.03 . 2 1 . . B 233 LEU HD21 . 18000 1 1420 . 2 2 82 82 LEU HD22 H 1 0.45 0.03 . 2 1 . . B 233 LEU HD22 . 18000 1 1421 . 2 2 82 82 LEU HD23 H 1 0.45 0.03 . 2 1 . . B 233 LEU HD23 . 18000 1 1422 . 2 2 82 82 LEU C C 13 172.61 0.20 . 1 1 . . B 233 LEU C . 18000 1 1423 . 2 2 82 82 LEU CA C 13 52.46 0.20 . 1 1 . . B 233 LEU CA . 18000 1 1424 . 2 2 82 82 LEU CB C 13 39.14 0.20 . 1 1 . . B 233 LEU CB . 18000 1 1425 . 2 2 82 82 LEU CD1 C 13 23.49 0.20 . 2 1 . . B 233 LEU CD1 . 18000 1 1426 . 2 2 82 82 LEU CD2 C 13 20.40 0.20 . 2 1 . . B 233 LEU CD2 . 18000 1 1427 . 2 2 82 82 LEU N N 15 112.48 0.30 . 1 1 . . B 233 LEU N . 18000 1 1428 . 2 2 83 83 LEU H H 1 7.56 0.03 . 1 1 . . B 234 LEU H . 18000 1 1429 . 2 2 83 83 LEU HA H 1 4.51 0.03 . 1 1 . . B 234 LEU HA . 18000 1 1430 . 2 2 83 83 LEU HB3 H 1 1.51 0.03 . 2 1 . . B 234 LEU HB3 . 18000 1 1431 . 2 2 83 83 LEU HG H 1 1.67 0.03 . 1 1 . . B 234 LEU HG . 18000 1 1432 . 2 2 83 83 LEU HD11 H 1 0.59 0.03 . 2 1 . . B 234 LEU HD11 . 18000 1 1433 . 2 2 83 83 LEU HD12 H 1 0.59 0.03 . 2 1 . . B 234 LEU HD12 . 18000 1 1434 . 2 2 83 83 LEU HD13 H 1 0.59 0.03 . 2 1 . . B 234 LEU HD13 . 18000 1 1435 . 2 2 83 83 LEU HD21 H 1 0.31 0.03 . 2 1 . . B 234 LEU HD21 . 18000 1 1436 . 2 2 83 83 LEU HD22 H 1 0.31 0.03 . 2 1 . . B 234 LEU HD22 . 18000 1 1437 . 2 2 83 83 LEU HD23 H 1 0.31 0.03 . 2 1 . . B 234 LEU HD23 . 18000 1 1438 . 2 2 83 83 LEU C C 13 178.33 0.20 . 1 1 . . B 234 LEU C . 18000 1 1439 . 2 2 83 83 LEU CA C 13 51.90 0.20 . 1 1 . . B 234 LEU CA . 18000 1 1440 . 2 2 83 83 LEU CB C 13 40.95 0.20 . 1 1 . . B 234 LEU CB . 18000 1 1441 . 2 2 83 83 LEU CG C 13 22.98 0.20 . 1 1 . . B 234 LEU CG . 18000 1 1442 . 2 2 83 83 LEU CD1 C 13 20.87 0.20 . 2 1 . . B 234 LEU CD1 . 18000 1 1443 . 2 2 83 83 LEU CD2 C 13 24.87 0.20 . 2 1 . . B 234 LEU CD2 . 18000 1 1444 . 2 2 83 83 LEU N N 15 115.86 0.30 . 1 1 . . B 234 LEU N . 18000 1 1445 . 2 2 84 84 TYR H H 1 9.75 0.03 . 1 1 . . B 235 TYR H . 18000 1 1446 . 2 2 84 84 TYR HA H 1 4.79 0.03 . 1 1 . . B 235 TYR HA . 18000 1 1447 . 2 2 84 84 TYR HB2 H 1 3.02 0.03 . 2 1 . . B 235 TYR HB2 . 18000 1 1448 . 2 2 84 84 TYR HB3 H 1 3.53 0.03 . 2 1 . . B 235 TYR HB3 . 18000 1 1449 . 2 2 84 84 TYR HD2 H 1 7.41 0.03 . 3 1 . . B 235 TYR HD2 . 18000 1 1450 . 2 2 84 84 TYR HE2 H 1 6.83 0.03 . 3 1 . . B 235 TYR HE2 . 18000 1 1451 . 2 2 84 84 TYR C C 13 176.26 0.20 . 1 1 . . B 235 TYR C . 18000 1 1452 . 2 2 84 84 TYR CA C 13 57.75 0.20 . 1 1 . . B 235 TYR CA . 18000 1 1453 . 2 2 84 84 TYR CB C 13 37.10 0.20 . 1 1 . . B 235 TYR CB . 18000 1 1454 . 2 2 84 84 TYR CD2 C 13 132.38 0.20 . 1 1 . . B 235 TYR CD2 . 18000 1 1455 . 2 2 84 84 TYR N N 15 125.85 0.30 . 1 1 . . B 235 TYR N . 18000 1 1456 . 2 2 85 85 LYS H H 1 9.34 0.03 . 1 1 . . B 236 LYS H . 18000 1 1457 . 2 2 85 85 LYS HA H 1 3.93 0.03 . 1 1 . . B 236 LYS HA . 18000 1 1458 . 2 2 85 85 LYS HB2 H 1 1.95 0.03 . 2 1 . . B 236 LYS HB2 . 18000 1 1459 . 2 2 85 85 LYS HB3 H 1 2.04 0.03 . 2 1 . . B 236 LYS HB3 . 18000 1 1460 . 2 2 85 85 LYS HG3 H 1 1.50 0.03 . 2 1 . . B 236 LYS HG3 . 18000 1 1461 . 2 2 85 85 LYS HD3 H 1 1.78 0.03 . 2 1 . . B 236 LYS HD3 . 18000 1 1462 . 2 2 85 85 LYS HE3 H 1 3.03 0.03 . 2 1 . . B 236 LYS HE3 . 18000 1 1463 . 2 2 85 85 LYS C C 13 178.28 0.20 . 1 1 . . B 236 LYS C . 18000 1 1464 . 2 2 85 85 LYS CA C 13 59.21 0.20 . 1 1 . . B 236 LYS CA . 18000 1 1465 . 2 2 85 85 LYS CB C 13 30.43 0.20 . 1 1 . . B 236 LYS CB . 18000 1 1466 . 2 2 85 85 LYS CG C 13 23.81 0.20 . 1 1 . . B 236 LYS CG . 18000 1 1467 . 2 2 85 85 LYS CD C 13 27.80 0.20 . 1 1 . . B 236 LYS CD . 18000 1 1468 . 2 2 85 85 LYS CE C 13 40.18 0.20 . 1 1 . . B 236 LYS CE . 18000 1 1469 . 2 2 85 85 LYS N N 15 123.88 0.30 . 1 1 . . B 236 LYS N . 18000 1 1470 . 2 2 86 86 PHE H H 1 9.12 0.03 . 1 1 . . B 237 PHE H . 18000 1 1471 . 2 2 86 86 PHE HA H 1 4.46 0.03 . 1 1 . . B 237 PHE HA . 18000 1 1472 . 2 2 86 86 PHE HB2 H 1 2.58 0.03 . 2 1 . . B 237 PHE HB2 . 18000 1 1473 . 2 2 86 86 PHE HB3 H 1 3.50 0.03 . 2 1 . . B 237 PHE HB3 . 18000 1 1474 . 2 2 86 86 PHE HD2 H 1 7.32 0.03 . 3 1 . . B 237 PHE HD2 . 18000 1 1475 . 2 2 86 86 PHE HE2 H 1 7.04 0.03 . 3 1 . . B 237 PHE HE2 . 18000 1 1476 . 2 2 86 86 PHE HZ H 1 6.79 0.03 . 1 1 . . B 237 PHE HZ . 18000 1 1477 . 2 2 86 86 PHE C C 13 173.93 0.20 . 1 1 . . B 237 PHE C . 18000 1 1478 . 2 2 86 86 PHE CA C 13 58.51 0.20 . 1 1 . . B 237 PHE CA . 18000 1 1479 . 2 2 86 86 PHE CB C 13 38.37 0.20 . 1 1 . . B 237 PHE CB . 18000 1 1480 . 2 2 86 86 PHE N N 15 117.15 0.30 . 1 1 . . B 237 PHE N . 18000 1 1481 . 2 2 87 87 GLU H H 1 7.88 0.03 . 1 1 . . B 238 GLU H . 18000 1 1482 . 2 2 87 87 GLU HA H 1 4.16 0.03 . 1 1 . . B 238 GLU HA . 18000 1 1483 . 2 2 87 87 GLU HB3 H 1 2.67 0.03 . 2 1 . . B 238 GLU HB3 . 18000 1 1484 . 2 2 87 87 GLU HG3 H 1 2.97 0.03 . 2 1 . . B 238 GLU HG3 . 18000 1 1485 . 2 2 87 87 GLU C C 13 175.65 0.20 . 1 1 . . B 238 GLU C . 18000 1 1486 . 2 2 87 87 GLU CA C 13 55.07 0.20 . 1 1 . . B 238 GLU CA . 18000 1 1487 . 2 2 87 87 GLU CB C 13 31.54 0.20 . 1 1 . . B 238 GLU CB . 18000 1 1488 . 2 2 87 87 GLU N N 15 112.13 0.30 . 1 1 . . B 238 GLU N . 18000 1 1489 . 2 2 88 88 ARG H H 1 7.98 0.03 . 1 1 . . B 239 ARG H . 18000 1 1490 . 2 2 88 88 ARG HA H 1 4.25 0.03 . 1 1 . . B 239 ARG HA . 18000 1 1491 . 2 2 88 88 ARG HB2 H 1 2.05 0.03 . 2 1 . . B 239 ARG HB2 . 18000 1 1492 . 2 2 88 88 ARG HB3 H 1 2.26 0.03 . 2 1 . . B 239 ARG HB3 . 18000 1 1493 . 2 2 88 88 ARG HG2 H 1 1.64 0.03 . 2 1 . . B 239 ARG HG2 . 18000 1 1494 . 2 2 88 88 ARG HG3 H 1 2.04 0.03 . 2 1 . . B 239 ARG HG3 . 18000 1 1495 . 2 2 88 88 ARG HD2 H 1 3.19 0.03 . 2 1 . . B 239 ARG HD2 . 18000 1 1496 . 2 2 88 88 ARG HD3 H 1 3.26 0.03 . 2 1 . . B 239 ARG HD3 . 18000 1 1497 . 2 2 88 88 ARG C C 13 174.49 0.20 . 1 1 . . B 239 ARG C . 18000 1 1498 . 2 2 88 88 ARG CA C 13 60.41 0.20 . 1 1 . . B 239 ARG CA . 18000 1 1499 . 2 2 88 88 ARG CB C 13 25.00 0.20 . 1 1 . . B 239 ARG CB . 18000 1 1500 . 2 2 88 88 ARG CG C 13 26.69 0.20 . 1 1 . . B 239 ARG CG . 18000 1 1501 . 2 2 88 88 ARG CD C 13 41.45 0.20 . 1 1 . . B 239 ARG CD . 18000 1 1502 . 2 2 88 88 ARG N N 15 120.33 0.30 . 1 1 . . B 239 ARG N . 18000 1 1503 . 2 2 89 89 PRO HA H 1 4.36 0.03 . 1 1 . . B 240 PRO HA . 18000 1 1504 . 2 2 89 89 PRO HD2 H 1 3.62 0.03 . 2 1 . . B 240 PRO HD2 . 18000 1 1505 . 2 2 89 89 PRO HD3 H 1 3.73 0.03 . 2 1 . . B 240 PRO HD3 . 18000 1 1506 . 2 2 89 89 PRO C C 13 176.33 0.20 . 1 1 . . B 240 PRO C . 18000 1 1507 . 2 2 89 89 PRO CA C 13 64.40 0.20 . 1 1 . . B 240 PRO CA . 18000 1 1508 . 2 2 90 90 GLN H H 1 7.82 0.03 . 1 1 . . B 241 GLN H . 18000 1 1509 . 2 2 90 90 GLN HA H 1 4.21 0.03 . 1 1 . . B 241 GLN HA . 18000 1 1510 . 2 2 90 90 GLN HB3 H 1 2.19 0.03 . 2 1 . . B 241 GLN HB3 . 18000 1 1511 . 2 2 90 90 GLN HG3 H 1 2.49 0.03 . 2 1 . . B 241 GLN HG3 . 18000 1 1512 . 2 2 90 90 GLN C C 13 175.27 0.20 . 1 1 . . B 241 GLN C . 18000 1 1513 . 2 2 90 90 GLN CA C 13 56.87 0.20 . 1 1 . . B 241 GLN CA . 18000 1 1514 . 2 2 90 90 GLN CB C 13 26.48 0.20 . 1 1 . . B 241 GLN CB . 18000 1 1515 . 2 2 90 90 GLN N N 15 119.90 0.30 . 1 1 . . B 241 GLN N . 18000 1 1516 . 2 2 91 91 TYR H H 1 7.85 0.03 . 1 1 . . B 242 TYR H . 18000 1 1517 . 2 2 91 91 TYR HA H 1 4.45 0.03 . 1 1 . . B 242 TYR HA . 18000 1 1518 . 2 2 91 91 TYR HB2 H 1 3.07 0.03 . 2 1 . . B 242 TYR HB2 . 18000 1 1519 . 2 2 91 91 TYR HB3 H 1 3.23 0.03 . 2 1 . . B 242 TYR HB3 . 18000 1 1520 . 2 2 91 91 TYR HD2 H 1 7.16 0.03 . 3 1 . . B 242 TYR HD2 . 18000 1 1521 . 2 2 91 91 TYR HE2 H 1 6.82 0.03 . 3 1 . . B 242 TYR HE2 . 18000 1 1522 . 2 2 91 91 TYR C C 13 174.10 0.20 . 1 1 . . B 242 TYR C . 18000 1 1523 . 2 2 91 91 TYR CA C 13 58.17 0.20 . 1 1 . . B 242 TYR CA . 18000 1 1524 . 2 2 91 91 TYR CB C 13 37.28 0.20 . 1 1 . . B 242 TYR CB . 18000 1 1525 . 2 2 91 91 TYR N N 15 121.12 0.30 . 1 1 . . B 242 TYR N . 18000 1 1526 . 2 2 92 92 ALA H H 1 8.14 0.03 . 1 1 . . B 243 ALA H . 18000 1 1527 . 2 2 92 92 ALA HA H 1 3.68 0.03 . 1 1 . . B 243 ALA HA . 18000 1 1528 . 2 2 92 92 ALA HB1 H 1 1.45 0.03 . 1 1 . . B 243 ALA HB1 . 18000 1 1529 . 2 2 92 92 ALA HB2 H 1 1.45 0.03 . 1 1 . . B 243 ALA HB2 . 18000 1 1530 . 2 2 92 92 ALA HB3 H 1 1.45 0.03 . 1 1 . . B 243 ALA HB3 . 18000 1 1531 . 2 2 92 92 ALA C C 13 179.11 0.20 . 1 1 . . B 243 ALA C . 18000 1 1532 . 2 2 92 92 ALA CA C 13 53.15 0.20 . 1 1 . . B 243 ALA CA . 18000 1 1533 . 2 2 92 92 ALA CB C 13 16.01 0.20 . 1 1 . . B 243 ALA CB . 18000 1 1534 . 2 2 92 92 ALA N N 15 119.57 0.30 . 1 1 . . B 243 ALA N . 18000 1 1535 . 2 2 93 93 GLU H H 1 7.87 0.03 . 1 1 . . B 244 GLU H . 18000 1 1536 . 2 2 93 93 GLU HA H 1 3.97 0.03 . 1 1 . . B 244 GLU HA . 18000 1 1537 . 2 2 93 93 GLU HB2 H 1 2.10 0.03 . 2 1 . . B 244 GLU HB2 . 18000 1 1538 . 2 2 93 93 GLU HB3 H 1 2.17 0.03 . 2 1 . . B 244 GLU HB3 . 18000 1 1539 . 2 2 93 93 GLU HG3 H 1 2.42 0.03 . 2 1 . . B 244 GLU HG3 . 18000 1 1540 . 2 2 93 93 GLU C C 13 176.59 0.20 . 1 1 . . B 244 GLU C . 18000 1 1541 . 2 2 93 93 GLU CA C 13 57.35 0.20 . 1 1 . . B 244 GLU CA . 18000 1 1542 . 2 2 93 93 GLU CB C 13 27.52 0.20 . 1 1 . . B 244 GLU CB . 18000 1 1543 . 2 2 93 93 GLU CG C 13 34.57 0.20 . 1 1 . . B 244 GLU CG . 18000 1 1544 . 2 2 93 93 GLU N N 15 118.29 0.30 . 1 1 . . B 244 GLU N . 18000 1 1545 . 2 2 94 94 ILE H H 1 8.05 0.03 . 1 1 . . B 245 ILE H . 18000 1 1546 . 2 2 94 94 ILE HA H 1 3.96 0.03 . 1 1 . . B 245 ILE HA . 18000 1 1547 . 2 2 94 94 ILE HB H 1 2.31 0.03 . 1 1 . . B 245 ILE HB . 18000 1 1548 . 2 2 94 94 ILE HG12 H 1 1.55 0.03 . 2 1 . . B 245 ILE HG12 . 18000 1 1549 . 2 2 94 94 ILE HG13 H 1 1.41 0.03 . 2 1 . . B 245 ILE HG13 . 18000 1 1550 . 2 2 94 94 ILE HG21 H 1 0.96 0.03 . 1 1 . . B 245 ILE HG21 . 18000 1 1551 . 2 2 94 94 ILE HG22 H 1 0.96 0.03 . 1 1 . . B 245 ILE HG22 . 18000 1 1552 . 2 2 94 94 ILE HG23 H 1 0.96 0.03 . 1 1 . . B 245 ILE HG23 . 18000 1 1553 . 2 2 94 94 ILE HD11 H 1 0.66 0.03 . 1 1 . . B 245 ILE HD11 . 18000 1 1554 . 2 2 94 94 ILE HD12 H 1 0.66 0.03 . 1 1 . . B 245 ILE HD12 . 18000 1 1555 . 2 2 94 94 ILE HD13 H 1 0.66 0.03 . 1 1 . . B 245 ILE HD13 . 18000 1 1556 . 2 2 94 94 ILE C C 13 176.41 0.20 . 1 1 . . B 245 ILE C . 18000 1 1557 . 2 2 94 94 ILE CA C 13 60.70 0.20 . 1 1 . . B 245 ILE CA . 18000 1 1558 . 2 2 94 94 ILE CB C 13 34.41 0.20 . 1 1 . . B 245 ILE CB . 18000 1 1559 . 2 2 94 94 ILE CG1 C 13 26.21 0.20 . 1 1 . . B 245 ILE CG1 . 18000 1 1560 . 2 2 94 94 ILE CG2 C 13 17.06 0.20 . 1 1 . . B 245 ILE CG2 . 18000 1 1561 . 2 2 94 94 ILE CD1 C 13 9.69 0.20 . 1 1 . . B 245 ILE CD1 . 18000 1 1562 . 2 2 94 94 ILE N N 15 121.40 0.30 . 1 1 . . B 245 ILE N . 18000 1 1563 . 2 2 95 95 LEU H H 1 8.00 0.03 . 1 1 . . B 246 LEU H . 18000 1 1564 . 2 2 95 95 LEU HA H 1 3.80 0.03 . 1 1 . . B 246 LEU HA . 18000 1 1565 . 2 2 95 95 LEU HB2 H 1 1.26 0.03 . 2 1 . . B 246 LEU HB2 . 18000 1 1566 . 2 2 95 95 LEU HB3 H 1 1.38 0.03 . 2 1 . . B 246 LEU HB3 . 18000 1 1567 . 2 2 95 95 LEU HG H 1 1.27 0.03 . 1 1 . . B 246 LEU HG . 18000 1 1568 . 2 2 95 95 LEU HD11 H 1 0.70 0.03 . 2 1 . . B 246 LEU HD11 . 18000 1 1569 . 2 2 95 95 LEU HD12 H 1 0.70 0.03 . 2 1 . . B 246 LEU HD12 . 18000 1 1570 . 2 2 95 95 LEU HD13 H 1 0.70 0.03 . 2 1 . . B 246 LEU HD13 . 18000 1 1571 . 2 2 95 95 LEU HD21 H 1 0.57 0.03 . 2 1 . . B 246 LEU HD21 . 18000 1 1572 . 2 2 95 95 LEU HD22 H 1 0.57 0.03 . 2 1 . . B 246 LEU HD22 . 18000 1 1573 . 2 2 95 95 LEU HD23 H 1 0.57 0.03 . 2 1 . . B 246 LEU HD23 . 18000 1 1574 . 2 2 95 95 LEU C C 13 177.41 0.20 . 1 1 . . B 246 LEU C . 18000 1 1575 . 2 2 95 95 LEU CA C 13 55.41 0.20 . 1 1 . . B 246 LEU CA . 18000 1 1576 . 2 2 95 95 LEU CB C 13 40.21 0.20 . 1 1 . . B 246 LEU CB . 18000 1 1577 . 2 2 95 95 LEU CG C 13 24.79 0.20 . 1 1 . . B 246 LEU CG . 18000 1 1578 . 2 2 95 95 LEU CD1 C 13 21.50 0.20 . 2 1 . . B 246 LEU CD1 . 18000 1 1579 . 2 2 95 95 LEU CD2 C 13 22.94 0.20 . 2 1 . . B 246 LEU CD2 . 18000 1 1580 . 2 2 95 95 LEU N N 15 119.77 0.30 . 1 1 . . B 246 LEU N . 18000 1 1581 . 2 2 96 96 ALA H H 1 7.25 0.03 . 1 1 . . B 247 ALA H . 18000 1 1582 . 2 2 96 96 ALA HA H 1 4.00 0.03 . 1 1 . . B 247 ALA HA . 18000 1 1583 . 2 2 96 96 ALA HB1 H 1 1.38 0.03 . 1 1 . . B 247 ALA HB1 . 18000 1 1584 . 2 2 96 96 ALA HB2 H 1 1.38 0.03 . 1 1 . . B 247 ALA HB2 . 18000 1 1585 . 2 2 96 96 ALA HB3 H 1 1.38 0.03 . 1 1 . . B 247 ALA HB3 . 18000 1 1586 . 2 2 96 96 ALA C C 13 177.54 0.20 . 1 1 . . B 247 ALA C . 18000 1 1587 . 2 2 96 96 ALA CA C 13 52.23 0.20 . 1 1 . . B 247 ALA CA . 18000 1 1588 . 2 2 96 96 ALA CB C 13 16.54 0.20 . 1 1 . . B 247 ALA CB . 18000 1 1589 . 2 2 96 96 ALA N N 15 118.30 0.30 . 1 1 . . B 247 ALA N . 18000 1 1590 . 2 2 97 97 ASP H H 1 7.83 0.03 . 1 1 . . B 248 ASP H . 18000 1 1591 . 2 2 97 97 ASP HA H 1 4.41 0.03 . 1 1 . . B 248 ASP HA . 18000 1 1592 . 2 2 97 97 ASP HB2 H 1 2.13 0.03 . 2 1 . . B 248 ASP HB2 . 18000 1 1593 . 2 2 97 97 ASP HB3 H 1 2.51 0.03 . 2 1 . . B 248 ASP HB3 . 18000 1 1594 . 2 2 97 97 ASP C C 13 174.47 0.20 . 1 1 . . B 248 ASP C . 18000 1 1595 . 2 2 97 97 ASP CA C 13 53.54 0.20 . 1 1 . . B 248 ASP CA . 18000 1 1596 . 2 2 97 97 ASP CB C 13 39.70 0.20 . 1 1 . . B 248 ASP CB . 18000 1 1597 . 2 2 97 97 ASP N N 15 116.19 0.30 . 1 1 . . B 248 ASP N . 18000 1 1598 . 2 2 98 98 HIS H H 1 8.04 0.03 . 1 1 . . B 249 HIS H . 18000 1 1599 . 2 2 98 98 HIS HA H 1 4.91 0.03 . 1 1 . . B 249 HIS HA . 18000 1 1600 . 2 2 98 98 HIS HB2 H 1 2.94 0.03 . 2 1 . . B 249 HIS HB2 . 18000 1 1601 . 2 2 98 98 HIS HB3 H 1 3.06 0.03 . 2 1 . . B 249 HIS HB3 . 18000 1 1602 . 2 2 98 98 HIS HD2 H 1 7.02 0.03 . 1 1 . . B 249 HIS HD2 . 18000 1 1603 . 2 2 98 98 HIS HE1 H 1 8.05 0.03 . 1 1 . . B 249 HIS HE1 . 18000 1 1604 . 2 2 98 98 HIS C C 13 170.56 0.20 . 1 1 . . B 249 HIS C . 18000 1 1605 . 2 2 98 98 HIS CA C 13 51.53 0.20 . 1 1 . . B 249 HIS CA . 18000 1 1606 . 2 2 98 98 HIS CB C 13 27.13 0.20 . 1 1 . . B 249 HIS CB . 18000 1 1607 . 2 2 98 98 HIS CE1 C 13 135.41 0.20 . 1 1 . . B 249 HIS CE1 . 18000 1 1608 . 2 2 98 98 HIS N N 15 117.46 0.30 . 1 1 . . B 249 HIS N . 18000 1 1609 . 2 2 99 99 PRO HA H 1 4.42 0.03 . 1 1 . . B 250 PRO HA . 18000 1 1610 . 2 2 99 99 PRO HB2 H 1 1.88 0.03 . 2 1 . . B 250 PRO HB2 . 18000 1 1611 . 2 2 99 99 PRO HB3 H 1 2.26 0.03 . 2 1 . . B 250 PRO HB3 . 18000 1 1612 . 2 2 99 99 PRO HG3 H 1 1.84 0.03 . 2 1 . . B 250 PRO HG3 . 18000 1 1613 . 2 2 99 99 PRO HD2 H 1 3.24 0.03 . 2 1 . . B 250 PRO HD2 . 18000 1 1614 . 2 2 99 99 PRO HD3 H 1 3.44 0.03 . 2 1 . . B 250 PRO HD3 . 18000 1 1615 . 2 2 99 99 PRO C C 13 175.66 0.20 . 1 1 . . B 250 PRO C . 18000 1 1616 . 2 2 99 99 PRO CA C 13 62.99 0.20 . 1 1 . . B 250 PRO CA . 18000 1 1617 . 2 2 99 99 PRO CB C 13 30.04 0.20 . 1 1 . . B 250 PRO CB . 18000 1 1618 . 2 2 99 99 PRO CG C 13 25.52 0.20 . 1 1 . . B 250 PRO CG . 18000 1 1619 . 2 2 99 99 PRO CD C 13 48.52 0.20 . 1 1 . . B 250 PRO CD . 18000 1 1620 . 2 2 100 100 ASP H H 1 8.46 0.03 . 1 1 . . B 251 ASP H . 18000 1 1621 . 2 2 100 100 ASP HA H 1 4.60 0.03 . 1 1 . . B 251 ASP HA . 18000 1 1622 . 2 2 100 100 ASP HB2 H 1 2.62 0.03 . 2 1 . . B 251 ASP HB2 . 18000 1 1623 . 2 2 100 100 ASP HB3 H 1 2.75 0.03 . 2 1 . . B 251 ASP HB3 . 18000 1 1624 . 2 2 100 100 ASP C C 13 173.60 0.20 . 1 1 . . B 251 ASP C . 18000 1 1625 . 2 2 100 100 ASP CA C 13 51.97 0.20 . 1 1 . . B 251 ASP CA . 18000 1 1626 . 2 2 100 100 ASP CB C 13 39.10 0.20 . 1 1 . . B 251 ASP CB . 18000 1 1627 . 2 2 100 100 ASP N N 15 115.72 0.30 . 1 1 . . B 251 ASP N . 18000 1 1628 . 2 2 101 101 ALA H H 1 7.39 0.03 . 1 1 . . B 252 ALA H . 18000 1 1629 . 2 2 101 101 ALA HA H 1 4.62 0.03 . 1 1 . . B 252 ALA HA . 18000 1 1630 . 2 2 101 101 ALA HB1 H 1 1.23 0.03 . 1 1 . . B 252 ALA HB1 . 18000 1 1631 . 2 2 101 101 ALA HB2 H 1 1.23 0.03 . 1 1 . . B 252 ALA HB2 . 18000 1 1632 . 2 2 101 101 ALA HB3 H 1 1.23 0.03 . 1 1 . . B 252 ALA HB3 . 18000 1 1633 . 2 2 101 101 ALA C C 13 173.08 0.20 . 1 1 . . B 252 ALA C . 18000 1 1634 . 2 2 101 101 ALA CA C 13 48.24 0.20 . 1 1 . . B 252 ALA CA . 18000 1 1635 . 2 2 101 101 ALA CB C 13 17.39 0.20 . 1 1 . . B 252 ALA CB . 18000 1 1636 . 2 2 101 101 ALA N N 15 124.83 0.30 . 1 1 . . B 252 ALA N . 18000 1 1637 . 2 2 102 102 PRO HA H 1 4.61 0.03 . 1 1 . . B 253 PRO HA . 18000 1 1638 . 2 2 102 102 PRO HB2 H 1 2.08 0.03 . 2 1 . . B 253 PRO HB2 . 18000 1 1639 . 2 2 102 102 PRO HB3 H 1 2.37 0.03 . 2 1 . . B 253 PRO HB3 . 18000 1 1640 . 2 2 102 102 PRO HG3 H 1 2.05 0.03 . 2 1 . . B 253 PRO HG3 . 18000 1 1641 . 2 2 102 102 PRO HD2 H 1 3.56 0.03 . 2 1 . . B 253 PRO HD2 . 18000 1 1642 . 2 2 102 102 PRO HD3 H 1 3.94 0.03 . 2 1 . . B 253 PRO HD3 . 18000 1 1643 . 2 2 102 102 PRO C C 13 176.64 0.20 . 1 1 . . B 253 PRO C . 18000 1 1644 . 2 2 102 102 PRO CA C 13 59.81 0.20 . 1 1 . . B 253 PRO CA . 18000 1 1645 . 2 2 102 102 PRO CB C 13 30.19 0.20 . 1 1 . . B 253 PRO CB . 18000 1 1646 . 2 2 102 102 PRO CG C 13 26.00 0.20 . 1 1 . . B 253 PRO CG . 18000 1 1647 . 2 2 102 102 PRO CD C 13 48.76 0.20 . 1 1 . . B 253 PRO CD . 18000 1 1648 . 2 2 103 103 MET H H 1 8.89 0.03 . 1 1 . . B 254 MET H . 18000 1 1649 . 2 2 103 103 MET HA H 1 4.88 0.03 . 1 1 . . B 254 MET HA . 18000 1 1650 . 2 2 103 103 MET HB2 H 1 2.08 0.03 . 2 1 . . B 254 MET HB2 . 18000 1 1651 . 2 2 103 103 MET HB3 H 1 2.38 0.03 . 2 1 . . B 254 MET HB3 . 18000 1 1652 . 2 2 103 103 MET HG2 H 1 2.85 0.03 . 2 1 . . B 254 MET HG2 . 18000 1 1653 . 2 2 103 103 MET HG3 H 1 3.10 0.03 . 2 1 . . B 254 MET HG3 . 18000 1 1654 . 2 2 103 103 MET HE1 H 1 2.18 0.03 . 1 1 . . B 254 MET HE1 . 18000 1 1655 . 2 2 103 103 MET HE2 H 1 2.18 0.03 . 1 1 . . B 254 MET HE2 . 18000 1 1656 . 2 2 103 103 MET HE3 H 1 2.18 0.03 . 1 1 . . B 254 MET HE3 . 18000 1 1657 . 2 2 103 103 MET C C 13 178.19 0.20 . 1 1 . . B 254 MET C . 18000 1 1658 . 2 2 103 103 MET CA C 13 55.62 0.20 . 1 1 . . B 254 MET CA . 18000 1 1659 . 2 2 103 103 MET CB C 13 31.82 0.20 . 1 1 . . B 254 MET CB . 18000 1 1660 . 2 2 103 103 MET CE C 13 19.22 0.20 . 1 1 . . B 254 MET CE . 18000 1 1661 . 2 2 103 103 MET N N 15 122.33 0.30 . 1 1 . . B 254 MET N . 18000 1 1662 . 2 2 104 104 SER H H 1 9.97 0.03 . 1 1 . . B 255 SER H . 18000 1 1663 . 2 2 104 104 SER HA H 1 4.29 0.03 . 1 1 . . B 255 SER HA . 18000 1 1664 . 2 2 104 104 SER HB2 H 1 3.83 0.03 . 2 1 . . B 255 SER HB2 . 18000 1 1665 . 2 2 104 104 SER HB3 H 1 3.93 0.03 . 2 1 . . B 255 SER HB3 . 18000 1 1666 . 2 2 104 104 SER C C 13 172.32 0.20 . 1 1 . . B 255 SER C . 18000 1 1667 . 2 2 104 104 SER CA C 13 59.67 0.20 . 1 1 . . B 255 SER CA . 18000 1 1668 . 2 2 104 104 SER CB C 13 59.01 0.20 . 1 1 . . B 255 SER CB . 18000 1 1669 . 2 2 104 104 SER N N 15 117.84 0.30 . 1 1 . . B 255 SER N . 18000 1 1670 . 2 2 105 105 GLN H H 1 7.82 0.03 . 1 1 . . B 256 GLN H . 18000 1 1671 . 2 2 105 105 GLN HA H 1 4.54 0.03 . 1 1 . . B 256 GLN HA . 18000 1 1672 . 2 2 105 105 GLN HB2 H 1 2.10 0.03 . 2 1 . . B 256 GLN HB2 . 18000 1 1673 . 2 2 105 105 GLN HB3 H 1 2.28 0.03 . 2 1 . . B 256 GLN HB3 . 18000 1 1674 . 2 2 105 105 GLN HG3 H 1 2.40 0.03 . 2 1 . . B 256 GLN HG3 . 18000 1 1675 . 2 2 105 105 GLN HE21 H 1 6.81 0.03 . 2 1 . . B 256 GLN HE21 . 18000 1 1676 . 2 2 105 105 GLN HE22 H 1 7.87 0.03 . 2 1 . . B 256 GLN HE22 . 18000 1 1677 . 2 2 105 105 GLN C C 13 174.54 0.20 . 1 1 . . B 256 GLN C . 18000 1 1678 . 2 2 105 105 GLN CA C 13 53.79 0.20 . 1 1 . . B 256 GLN CA . 18000 1 1679 . 2 2 105 105 GLN CB C 13 28.24 0.20 . 1 1 . . B 256 GLN CB . 18000 1 1680 . 2 2 105 105 GLN CG C 13 32.96 0.20 . 1 1 . . B 256 GLN CG . 18000 1 1681 . 2 2 105 105 GLN N N 15 119.13 0.30 . 1 1 . . B 256 GLN N . 18000 1 1682 . 2 2 105 105 GLN NE2 N 15 111.90 0.30 . 1 1 . . B 256 GLN NE2 . 18000 1 1683 . 2 2 106 106 VAL H H 1 7.75 0.03 . 1 1 . . B 257 VAL H . 18000 1 1684 . 2 2 106 106 VAL HA H 1 3.92 0.03 . 1 1 . . B 257 VAL HA . 18000 1 1685 . 2 2 106 106 VAL HB H 1 2.26 0.03 . 1 1 . . B 257 VAL HB . 18000 1 1686 . 2 2 106 106 VAL HG11 H 1 0.82 0.03 . 2 1 . . B 257 VAL HG11 . 18000 1 1687 . 2 2 106 106 VAL HG12 H 1 0.82 0.03 . 2 1 . . B 257 VAL HG12 . 18000 1 1688 . 2 2 106 106 VAL HG13 H 1 0.82 0.03 . 2 1 . . B 257 VAL HG13 . 18000 1 1689 . 2 2 106 106 VAL HG21 H 1 0.63 0.03 . 2 1 . . B 257 VAL HG21 . 18000 1 1690 . 2 2 106 106 VAL HG22 H 1 0.63 0.03 . 2 1 . . B 257 VAL HG22 . 18000 1 1691 . 2 2 106 106 VAL HG23 H 1 0.63 0.03 . 2 1 . . B 257 VAL HG23 . 18000 1 1692 . 2 2 106 106 VAL C C 13 172.38 0.20 . 1 1 . . B 257 VAL C . 18000 1 1693 . 2 2 106 106 VAL CA C 13 62.92 0.20 . 1 1 . . B 257 VAL CA . 18000 1 1694 . 2 2 106 106 VAL CB C 13 32.86 0.20 . 1 1 . . B 257 VAL CB . 18000 1 1695 . 2 2 106 106 VAL CG1 C 13 19.39 0.20 . 2 1 . . B 257 VAL CG1 . 18000 1 1696 . 2 2 106 106 VAL CG2 C 13 21.03 0.20 . 2 1 . . B 257 VAL CG2 . 18000 1 1697 . 2 2 106 106 VAL N N 15 119.46 0.30 . 1 1 . . B 257 VAL N . 18000 1 1698 . 2 2 107 107 TYR H H 1 8.40 0.03 . 1 1 . . B 258 TYR H . 18000 1 1699 . 2 2 107 107 TYR HA H 1 4.12 0.03 . 1 1 . . B 258 TYR HA . 18000 1 1700 . 2 2 107 107 TYR HB2 H 1 2.84 0.03 . 2 1 . . B 258 TYR HB2 . 18000 1 1701 . 2 2 107 107 TYR HB3 H 1 2.91 0.03 . 2 1 . . B 258 TYR HB3 . 18000 1 1702 . 2 2 107 107 TYR HD1 H 1 6.41 0.03 . 3 1 . . B 258 TYR HD1 . 18000 1 1703 . 2 2 107 107 TYR HE1 H 1 6.58 0.03 . 3 1 . . B 258 TYR HE1 . 18000 1 1704 . 2 2 107 107 TYR C C 13 172.43 0.20 . 1 1 . . B 258 TYR C . 18000 1 1705 . 2 2 107 107 TYR CA C 13 57.99 0.20 . 1 1 . . B 258 TYR CA . 18000 1 1706 . 2 2 107 107 TYR CB C 13 38.98 0.20 . 1 1 . . B 258 TYR CB . 18000 1 1707 . 2 2 107 107 TYR N N 15 117.71 0.30 . 1 1 . . B 258 TYR N . 18000 1 1708 . 2 2 108 108 GLY H H 1 8.63 0.03 . 1 1 . . B 259 GLY H . 18000 1 1709 . 2 2 108 108 GLY HA2 H 1 3.58 0.03 . 2 1 . . B 259 GLY HA2 . 18000 1 1710 . 2 2 108 108 GLY HA3 H 1 4.36 0.03 . 2 1 . . B 259 GLY HA3 . 18000 1 1711 . 2 2 108 108 GLY C C 13 171.97 0.20 . 1 1 . . B 259 GLY C . 18000 1 1712 . 2 2 108 108 GLY CA C 13 42.65 0.20 . 1 1 . . B 259 GLY CA . 18000 1 1713 . 2 2 108 108 GLY N N 15 106.28 0.30 . 1 1 . . B 259 GLY N . 18000 1 1714 . 2 2 109 109 ALA H H 1 9.15 0.03 . 1 1 . . B 260 ALA H . 18000 1 1715 . 2 2 109 109 ALA HA H 1 3.78 0.03 . 1 1 . . B 260 ALA HA . 18000 1 1716 . 2 2 109 109 ALA HB1 H 1 0.92 0.03 . 1 1 . . B 260 ALA HB1 . 18000 1 1717 . 2 2 109 109 ALA HB2 H 1 0.92 0.03 . 1 1 . . B 260 ALA HB2 . 18000 1 1718 . 2 2 109 109 ALA HB3 H 1 0.92 0.03 . 1 1 . . B 260 ALA HB3 . 18000 1 1719 . 2 2 109 109 ALA C C 13 173.79 0.20 . 1 1 . . B 260 ALA C . 18000 1 1720 . 2 2 109 109 ALA CA C 13 54.80 0.20 . 1 1 . . B 260 ALA CA . 18000 1 1721 . 2 2 109 109 ALA CB C 13 14.83 0.20 . 1 1 . . B 260 ALA CB . 18000 1 1722 . 2 2 109 109 ALA N N 15 121.49 0.30 . 1 1 . . B 260 ALA N . 18000 1 1723 . 2 2 110 110 PRO HA H 1 4.43 0.03 . 1 1 . . B 261 PRO HA . 18000 1 1724 . 2 2 110 110 PRO HB3 H 1 1.57 0.03 . 2 1 . . B 261 PRO HB3 . 18000 1 1725 . 2 2 110 110 PRO HD2 H 1 3.47 0.03 . 2 1 . . B 261 PRO HD2 . 18000 1 1726 . 2 2 110 110 PRO HD3 H 1 3.65 0.03 . 2 1 . . B 261 PRO HD3 . 18000 1 1727 . 2 2 110 110 PRO C C 13 177.44 0.20 . 1 1 . . B 261 PRO C . 18000 1 1728 . 2 2 110 110 PRO CA C 13 65.62 0.20 . 1 1 . . B 261 PRO CA . 18000 1 1729 . 2 2 111 111 HIS H H 1 6.99 0.03 . 1 1 . . B 262 HIS H . 18000 1 1730 . 2 2 111 111 HIS HA H 1 3.64 0.03 . 1 1 . . B 262 HIS HA . 18000 1 1731 . 2 2 111 111 HIS HB3 H 1 2.85 0.03 . 2 1 . . B 262 HIS HB3 . 18000 1 1732 . 2 2 111 111 HIS HD2 H 1 6.61 0.03 . 1 1 . . B 262 HIS HD2 . 18000 1 1733 . 2 2 111 111 HIS HE1 H 1 7.49 0.03 . 1 1 . . B 262 HIS HE1 . 18000 1 1734 . 2 2 111 111 HIS C C 13 174.59 0.20 . 1 1 . . B 262 HIS C . 18000 1 1735 . 2 2 111 111 HIS CA C 13 61.47 0.20 . 1 1 . . B 262 HIS CA . 18000 1 1736 . 2 2 111 111 HIS CB C 13 28.73 0.20 . 1 1 . . B 262 HIS CB . 18000 1 1737 . 2 2 111 111 HIS N N 15 114.91 0.30 . 1 1 . . B 262 HIS N . 18000 1 1738 . 2 2 112 112 LEU H H 1 7.80 0.03 . 1 1 . . B 263 LEU H . 18000 1 1739 . 2 2 112 112 LEU HA H 1 4.06 0.03 . 1 1 . . B 263 LEU HA . 18000 1 1740 . 2 2 112 112 LEU HB2 H 1 1.16 0.03 . 2 1 . . B 263 LEU HB2 . 18000 1 1741 . 2 2 112 112 LEU HB3 H 1 2.23 0.03 . 2 1 . . B 263 LEU HB3 . 18000 1 1742 . 2 2 112 112 LEU HG H 1 1.77 0.03 . 1 1 . . B 263 LEU HG . 18000 1 1743 . 2 2 112 112 LEU HD11 H 1 1.07 0.03 . 2 1 . . B 263 LEU HD11 . 18000 1 1744 . 2 2 112 112 LEU HD12 H 1 1.07 0.03 . 2 1 . . B 263 LEU HD12 . 18000 1 1745 . 2 2 112 112 LEU HD13 H 1 1.07 0.03 . 2 1 . . B 263 LEU HD13 . 18000 1 1746 . 2 2 112 112 LEU HD21 H 1 0.81 0.03 . 2 1 . . B 263 LEU HD21 . 18000 1 1747 . 2 2 112 112 LEU HD22 H 1 0.81 0.03 . 2 1 . . B 263 LEU HD22 . 18000 1 1748 . 2 2 112 112 LEU HD23 H 1 0.81 0.03 . 2 1 . . B 263 LEU HD23 . 18000 1 1749 . 2 2 112 112 LEU C C 13 176.04 0.20 . 1 1 . . B 263 LEU C . 18000 1 1750 . 2 2 112 112 LEU CA C 13 55.91 0.20 . 1 1 . . B 263 LEU CA . 18000 1 1751 . 2 2 112 112 LEU CB C 13 39.55 0.20 . 1 1 . . B 263 LEU CB . 18000 1 1752 . 2 2 112 112 LEU CD1 C 13 25.34 0.20 . 2 1 . . B 263 LEU CD1 . 18000 1 1753 . 2 2 112 112 LEU CD2 C 13 20.32 0.20 . 2 1 . . B 263 LEU CD2 . 18000 1 1754 . 2 2 112 112 LEU N N 15 120.05 0.30 . 1 1 . . B 263 LEU N . 18000 1 1755 . 2 2 113 113 LEU H H 1 8.43 0.03 . 1 1 . . B 264 LEU H . 18000 1 1756 . 2 2 113 113 LEU HA H 1 4.35 0.03 . 1 1 . . B 264 LEU HA . 18000 1 1757 . 2 2 113 113 LEU HD11 H 1 0.89 0.03 . 2 1 . . B 264 LEU HD11 . 18000 1 1758 . 2 2 113 113 LEU HD12 H 1 0.89 0.03 . 2 1 . . B 264 LEU HD12 . 18000 1 1759 . 2 2 113 113 LEU HD13 H 1 0.89 0.03 . 2 1 . . B 264 LEU HD13 . 18000 1 1760 . 2 2 113 113 LEU C C 13 177.30 0.20 . 1 1 . . B 264 LEU C . 18000 1 1761 . 2 2 113 113 LEU CA C 13 56.25 0.20 . 1 1 . . B 264 LEU CA . 18000 1 1762 . 2 2 113 113 LEU CB C 13 39.42 0.20 . 1 1 . . B 264 LEU CB . 18000 1 1763 . 2 2 113 113 LEU CD1 C 13 22.25 0.20 . 2 1 . . B 264 LEU CD1 . 18000 1 1764 . 2 2 113 113 LEU N N 15 117.75 0.30 . 1 1 . . B 264 LEU N . 18000 1 1765 . 2 2 114 114 ARG H H 1 7.66 0.03 . 1 1 . . B 265 ARG H . 18000 1 1766 . 2 2 114 114 ARG HA H 1 3.68 0.03 . 1 1 . . B 265 ARG HA . 18000 1 1767 . 2 2 114 114 ARG HB3 H 1 2.03 0.03 . 2 1 . . B 265 ARG HB3 . 18000 1 1768 . 2 2 114 114 ARG C C 13 176.48 0.20 . 1 1 . . B 265 ARG C . 18000 1 1769 . 2 2 114 114 ARG CA C 13 58.33 0.20 . 1 1 . . B 265 ARG CA . 18000 1 1770 . 2 2 114 114 ARG CB C 13 28.85 0.20 . 1 1 . . B 265 ARG CB . 18000 1 1771 . 2 2 114 114 ARG N N 15 115.50 0.30 . 1 1 . . B 265 ARG N . 18000 1 1772 . 2 2 115 115 LEU H H 1 7.41 0.03 . 1 1 . . B 266 LEU H . 18000 1 1773 . 2 2 115 115 LEU HA H 1 3.74 0.03 . 1 1 . . B 266 LEU HA . 18000 1 1774 . 2 2 115 115 LEU HB2 H 1 1.42 0.03 . 2 1 . . B 266 LEU HB2 . 18000 1 1775 . 2 2 115 115 LEU HB3 H 1 2.38 0.03 . 2 1 . . B 266 LEU HB3 . 18000 1 1776 . 2 2 115 115 LEU HG H 1 1.17 0.03 . 1 1 . . B 266 LEU HG . 18000 1 1777 . 2 2 115 115 LEU HD11 H 1 0.63 0.03 . 2 1 . . B 266 LEU HD11 . 18000 1 1778 . 2 2 115 115 LEU HD12 H 1 0.63 0.03 . 2 1 . . B 266 LEU HD12 . 18000 1 1779 . 2 2 115 115 LEU HD13 H 1 0.63 0.03 . 2 1 . . B 266 LEU HD13 . 18000 1 1780 . 2 2 115 115 LEU HD21 H 1 0.55 0.03 . 2 1 . . B 266 LEU HD21 . 18000 1 1781 . 2 2 115 115 LEU HD22 H 1 0.55 0.03 . 2 1 . . B 266 LEU HD22 . 18000 1 1782 . 2 2 115 115 LEU HD23 H 1 0.55 0.03 . 2 1 . . B 266 LEU HD23 . 18000 1 1783 . 2 2 115 115 LEU C C 13 176.26 0.20 . 1 1 . . B 266 LEU C . 18000 1 1784 . 2 2 115 115 LEU CA C 13 56.58 0.20 . 1 1 . . B 266 LEU CA . 18000 1 1785 . 2 2 115 115 LEU CB C 13 40.25 0.20 . 1 1 . . B 266 LEU CB . 18000 1 1786 . 2 2 115 115 LEU CD1 C 13 24.11 0.20 . 2 1 . . B 266 LEU CD1 . 18000 1 1787 . 2 2 115 115 LEU CD2 C 13 23.83 0.20 . 2 1 . . B 266 LEU CD2 . 18000 1 1788 . 2 2 115 115 LEU N N 15 117.56 0.30 . 1 1 . . B 266 LEU N . 18000 1 1789 . 2 2 116 116 PHE H H 1 7.75 0.03 . 1 1 . . B 267 PHE H . 18000 1 1790 . 2 2 116 116 PHE HA H 1 4.03 0.03 . 1 1 . . B 267 PHE HA . 18000 1 1791 . 2 2 116 116 PHE HB2 H 1 3.10 0.03 . 2 1 . . B 267 PHE HB2 . 18000 1 1792 . 2 2 116 116 PHE HB3 H 1 3.22 0.03 . 2 1 . . B 267 PHE HB3 . 18000 1 1793 . 2 2 116 116 PHE HD1 H 1 7.51 0.03 . 3 1 . . B 267 PHE HD1 . 18000 1 1794 . 2 2 116 116 PHE HE1 H 1 7.25 0.03 . 3 1 . . B 267 PHE HE1 . 18000 1 1795 . 2 2 116 116 PHE HZ H 1 7.00 0.03 . 1 1 . . B 267 PHE HZ . 18000 1 1796 . 2 2 116 116 PHE C C 13 174.35 0.20 . 1 1 . . B 267 PHE C . 18000 1 1797 . 2 2 116 116 PHE CA C 13 59.47 0.20 . 1 1 . . B 267 PHE CA . 18000 1 1798 . 2 2 116 116 PHE CB C 13 36.97 0.20 . 1 1 . . B 267 PHE CB . 18000 1 1799 . 2 2 116 116 PHE CD1 C 13 130.23 0.20 . 1 1 . . B 267 PHE CD1 . 18000 1 1800 . 2 2 116 116 PHE N N 15 114.31 0.30 . 1 1 . . B 267 PHE N . 18000 1 1801 . 2 2 117 117 VAL H H 1 7.67 0.03 . 1 1 . . B 268 VAL H . 18000 1 1802 . 2 2 117 117 VAL HA H 1 3.97 0.03 . 1 1 . . B 268 VAL HA . 18000 1 1803 . 2 2 117 117 VAL HB H 1 2.72 0.03 . 1 1 . . B 268 VAL HB . 18000 1 1804 . 2 2 117 117 VAL HG11 H 1 1.20 0.03 . 2 1 . . B 268 VAL HG11 . 18000 1 1805 . 2 2 117 117 VAL HG12 H 1 1.20 0.03 . 2 1 . . B 268 VAL HG12 . 18000 1 1806 . 2 2 117 117 VAL HG13 H 1 1.20 0.03 . 2 1 . . B 268 VAL HG13 . 18000 1 1807 . 2 2 117 117 VAL HG21 H 1 1.07 0.03 . 2 1 . . B 268 VAL HG21 . 18000 1 1808 . 2 2 117 117 VAL HG22 H 1 1.07 0.03 . 2 1 . . B 268 VAL HG22 . 18000 1 1809 . 2 2 117 117 VAL HG23 H 1 1.07 0.03 . 2 1 . . B 268 VAL HG23 . 18000 1 1810 . 2 2 117 117 VAL C C 13 175.32 0.20 . 1 1 . . B 268 VAL C . 18000 1 1811 . 2 2 117 117 VAL CA C 13 62.84 0.20 . 1 1 . . B 268 VAL CA . 18000 1 1812 . 2 2 117 117 VAL CB C 13 30.14 0.20 . 1 1 . . B 268 VAL CB . 18000 1 1813 . 2 2 117 117 VAL CG1 C 13 22.02 0.20 . 2 1 . . B 268 VAL CG1 . 18000 1 1814 . 2 2 117 117 VAL CG2 C 13 20.00 0.20 . 2 1 . . B 268 VAL CG2 . 18000 1 1815 . 2 2 117 117 VAL N N 15 118.54 0.30 . 1 1 . . B 268 VAL N . 18000 1 1816 . 2 2 118 118 ARG H H 1 7.33 0.03 . 1 1 . . B 269 ARG H . 18000 1 1817 . 2 2 118 118 ARG HA H 1 4.47 0.03 . 1 1 . . B 269 ARG HA . 18000 1 1818 . 2 2 118 118 ARG HB3 H 1 1.69 0.03 . 2 1 . . B 269 ARG HB3 . 18000 1 1819 . 2 2 118 118 ARG HG3 H 1 1.84 0.03 . 2 1 . . B 269 ARG HG3 . 18000 1 1820 . 2 2 118 118 ARG HD2 H 1 3.26 0.03 . 2 1 . . B 269 ARG HD2 . 18000 1 1821 . 2 2 118 118 ARG HD3 H 1 3.38 0.03 . 2 1 . . B 269 ARG HD3 . 18000 1 1822 . 2 2 118 118 ARG C C 13 176.04 0.20 . 1 1 . . B 269 ARG C . 18000 1 1823 . 2 2 118 118 ARG CA C 13 53.44 0.20 . 1 1 . . B 269 ARG CA . 18000 1 1824 . 2 2 118 118 ARG CB C 13 28.94 0.20 . 1 1 . . B 269 ARG CB . 18000 1 1825 . 2 2 118 118 ARG CD C 13 40.07 0.20 . 1 1 . . B 269 ARG CD . 18000 1 1826 . 2 2 118 118 ARG N N 15 116.12 0.30 . 1 1 . . B 269 ARG N . 18000 1 1827 . 2 2 119 119 ILE H H 1 8.05 0.03 . 1 1 . . B 270 ILE H . 18000 1 1828 . 2 2 119 119 ILE HA H 1 3.93 0.03 . 1 1 . . B 270 ILE HA . 18000 1 1829 . 2 2 119 119 ILE HB H 1 1.82 0.03 . 1 1 . . B 270 ILE HB . 18000 1 1830 . 2 2 119 119 ILE HG12 H 1 1.80 0.03 . 2 1 . . B 270 ILE HG12 . 18000 1 1831 . 2 2 119 119 ILE HG13 H 1 1.02 0.03 . 2 1 . . B 270 ILE HG13 . 18000 1 1832 . 2 2 119 119 ILE HG21 H 1 0.95 0.03 . 1 1 . . B 270 ILE HG21 . 18000 1 1833 . 2 2 119 119 ILE HG22 H 1 0.95 0.03 . 1 1 . . B 270 ILE HG22 . 18000 1 1834 . 2 2 119 119 ILE HG23 H 1 0.95 0.03 . 1 1 . . B 270 ILE HG23 . 18000 1 1835 . 2 2 119 119 ILE HD11 H 1 0.57 0.03 . 1 1 . . B 270 ILE HD11 . 18000 1 1836 . 2 2 119 119 ILE HD12 H 1 0.57 0.03 . 1 1 . . B 270 ILE HD12 . 18000 1 1837 . 2 2 119 119 ILE HD13 H 1 0.57 0.03 . 1 1 . . B 270 ILE HD13 . 18000 1 1838 . 2 2 119 119 ILE C C 13 174.00 0.20 . 1 1 . . B 270 ILE C . 18000 1 1839 . 2 2 119 119 ILE CA C 13 63.88 0.20 . 1 1 . . B 270 ILE CA . 18000 1 1840 . 2 2 119 119 ILE CB C 13 36.10 0.20 . 1 1 . . B 270 ILE CB . 18000 1 1841 . 2 2 119 119 ILE CG1 C 13 27.31 0.20 . 1 1 . . B 270 ILE CG1 . 18000 1 1842 . 2 2 119 119 ILE CG2 C 13 15.45 0.20 . 1 1 . . B 270 ILE CG2 . 18000 1 1843 . 2 2 119 119 ILE CD1 C 13 11.94 0.20 . 1 1 . . B 270 ILE CD1 . 18000 1 1844 . 2 2 119 119 ILE N N 15 118.37 0.30 . 1 1 . . B 270 ILE N . 18000 1 1845 . 2 2 120 120 GLY H H 1 8.25 0.03 . 1 1 . . B 271 GLY H . 18000 1 1846 . 2 2 120 120 GLY HA2 H 1 3.57 0.03 . 2 1 . . B 271 GLY HA2 . 18000 1 1847 . 2 2 120 120 GLY HA3 H 1 4.12 0.03 . 2 1 . . B 271 GLY HA3 . 18000 1 1848 . 2 2 120 120 GLY C C 13 174.06 0.20 . 1 1 . . B 271 GLY C . 18000 1 1849 . 2 2 120 120 GLY CA C 13 45.84 0.20 . 1 1 . . B 271 GLY CA . 18000 1 1850 . 2 2 120 120 GLY N N 15 108.90 0.30 . 1 1 . . B 271 GLY N . 18000 1 1851 . 2 2 121 121 ALA H H 1 7.77 0.03 . 1 1 . . B 272 ALA H . 18000 1 1852 . 2 2 121 121 ALA HA H 1 4.18 0.03 . 1 1 . . B 272 ALA HA . 18000 1 1853 . 2 2 121 121 ALA HB1 H 1 1.49 0.03 . 1 1 . . B 272 ALA HB1 . 18000 1 1854 . 2 2 121 121 ALA HB2 H 1 1.49 0.03 . 1 1 . . B 272 ALA HB2 . 18000 1 1855 . 2 2 121 121 ALA HB3 H 1 1.49 0.03 . 1 1 . . B 272 ALA HB3 . 18000 1 1856 . 2 2 121 121 ALA C C 13 178.10 0.20 . 1 1 . . B 272 ALA C . 18000 1 1857 . 2 2 121 121 ALA CA C 13 52.48 0.20 . 1 1 . . B 272 ALA CA . 18000 1 1858 . 2 2 121 121 ALA CB C 13 16.85 0.20 . 1 1 . . B 272 ALA CB . 18000 1 1859 . 2 2 121 121 ALA N N 15 123.09 0.30 . 1 1 . . B 272 ALA N . 18000 1 1860 . 2 2 122 122 MET H H 1 7.54 0.03 . 1 1 . . B 273 MET H . 18000 1 1861 . 2 2 122 122 MET HA H 1 4.24 0.03 . 1 1 . . B 273 MET HA . 18000 1 1862 . 2 2 122 122 MET HB2 H 1 1.97 0.03 . 2 1 . . B 273 MET HB2 . 18000 1 1863 . 2 2 122 122 MET HB3 H 1 2.13 0.03 . 2 1 . . B 273 MET HB3 . 18000 1 1864 . 2 2 122 122 MET HG2 H 1 2.60 0.03 . 2 1 . . B 273 MET HG2 . 18000 1 1865 . 2 2 122 122 MET HG3 H 1 2.76 0.03 . 2 1 . . B 273 MET HG3 . 18000 1 1866 . 2 2 122 122 MET HE1 H 1 2.05 0.03 . 1 1 . . B 273 MET HE1 . 18000 1 1867 . 2 2 122 122 MET HE2 H 1 2.05 0.03 . 1 1 . . B 273 MET HE2 . 18000 1 1868 . 2 2 122 122 MET HE3 H 1 2.05 0.03 . 1 1 . . B 273 MET HE3 . 18000 1 1869 . 2 2 122 122 MET C C 13 177.77 0.20 . 1 1 . . B 273 MET C . 18000 1 1870 . 2 2 122 122 MET CA C 13 55.43 0.20 . 1 1 . . B 273 MET CA . 18000 1 1871 . 2 2 122 122 MET CB C 13 30.11 0.20 . 1 1 . . B 273 MET CB . 18000 1 1872 . 2 2 122 122 MET CG C 13 30.91 0.20 . 1 1 . . B 273 MET CG . 18000 1 1873 . 2 2 122 122 MET CE C 13 15.27 0.20 . 1 1 . . B 273 MET CE . 18000 1 1874 . 2 2 122 122 MET N N 15 114.76 0.30 . 1 1 . . B 273 MET N . 18000 1 1875 . 2 2 123 123 LEU H H 1 8.30 0.03 . 1 1 . . B 274 LEU H . 18000 1 1876 . 2 2 123 123 LEU HA H 1 3.95 0.03 . 1 1 . . B 274 LEU HA . 18000 1 1877 . 2 2 123 123 LEU HB3 H 1 1.86 0.03 . 2 1 . . B 274 LEU HB3 . 18000 1 1878 . 2 2 123 123 LEU HG H 1 1.70 0.03 . 1 1 . . B 274 LEU HG . 18000 1 1879 . 2 2 123 123 LEU HD11 H 1 0.60 0.03 . 2 1 . . B 274 LEU HD11 . 18000 1 1880 . 2 2 123 123 LEU HD12 H 1 0.60 0.03 . 2 1 . . B 274 LEU HD12 . 18000 1 1881 . 2 2 123 123 LEU HD13 H 1 0.60 0.03 . 2 1 . . B 274 LEU HD13 . 18000 1 1882 . 2 2 123 123 LEU HD21 H 1 0.60 0.03 . 2 1 . . B 274 LEU HD21 . 18000 1 1883 . 2 2 123 123 LEU HD22 H 1 0.60 0.03 . 2 1 . . B 274 LEU HD22 . 18000 1 1884 . 2 2 123 123 LEU HD23 H 1 0.60 0.03 . 2 1 . . B 274 LEU HD23 . 18000 1 1885 . 2 2 123 123 LEU C C 13 175.99 0.20 . 1 1 . . B 274 LEU C . 18000 1 1886 . 2 2 123 123 LEU CA C 13 55.28 0.20 . 1 1 . . B 274 LEU CA . 18000 1 1887 . 2 2 123 123 LEU CB C 13 39.95 0.20 . 1 1 . . B 274 LEU CB . 18000 1 1888 . 2 2 123 123 LEU CG C 13 24.95 0.20 . 1 1 . . B 274 LEU CG . 18000 1 1889 . 2 2 123 123 LEU CD1 C 13 21.73 0.20 . 2 1 . . B 274 LEU CD1 . 18000 1 1890 . 2 2 123 123 LEU CD2 C 13 23.84 0.20 . 2 1 . . B 274 LEU CD2 . 18000 1 1891 . 2 2 123 123 LEU N N 15 121.03 0.30 . 1 1 . . B 274 LEU N . 18000 1 1892 . 2 2 124 124 ALA H H 1 7.18 0.03 . 1 1 . . B 275 ALA H . 18000 1 1893 . 2 2 124 124 ALA HA H 1 4.01 0.03 . 1 1 . . B 275 ALA HA . 18000 1 1894 . 2 2 124 124 ALA HB1 H 1 1.22 0.03 . 1 1 . . B 275 ALA HB1 . 18000 1 1895 . 2 2 124 124 ALA HB2 H 1 1.22 0.03 . 1 1 . . B 275 ALA HB2 . 18000 1 1896 . 2 2 124 124 ALA HB3 H 1 1.22 0.03 . 1 1 . . B 275 ALA HB3 . 18000 1 1897 . 2 2 124 124 ALA C C 13 176.19 0.20 . 1 1 . . B 275 ALA C . 18000 1 1898 . 2 2 124 124 ALA CA C 13 52.13 0.20 . 1 1 . . B 275 ALA CA . 18000 1 1899 . 2 2 124 124 ALA CB C 13 16.72 0.20 . 1 1 . . B 275 ALA CB . 18000 1 1900 . 2 2 124 124 ALA N N 15 118.51 0.30 . 1 1 . . B 275 ALA N . 18000 1 1901 . 2 2 125 125 TYR H H 1 7.15 0.03 . 1 1 . . B 276 TYR H . 18000 1 1902 . 2 2 125 125 TYR HA H 1 4.60 0.03 . 1 1 . . B 276 TYR HA . 18000 1 1903 . 2 2 125 125 TYR HB2 H 1 2.94 0.03 . 2 1 . . B 276 TYR HB2 . 18000 1 1904 . 2 2 125 125 TYR HB3 H 1 3.23 0.03 . 2 1 . . B 276 TYR HB3 . 18000 1 1905 . 2 2 125 125 TYR HD1 H 1 7.15 0.03 . 3 1 . . B 276 TYR HD1 . 18000 1 1906 . 2 2 125 125 TYR HE1 H 1 6.76 0.03 . 3 1 . . B 276 TYR HE1 . 18000 1 1907 . 2 2 125 125 TYR C C 13 173.62 0.20 . 1 1 . . B 276 TYR C . 18000 1 1908 . 2 2 125 125 TYR CA C 13 55.55 0.20 . 1 1 . . B 276 TYR CA . 18000 1 1909 . 2 2 125 125 TYR CB C 13 36.91 0.20 . 1 1 . . B 276 TYR CB . 18000 1 1910 . 2 2 125 125 TYR CD1 C 13 131.50 0.20 . 1 1 . . B 276 TYR CD1 . 18000 1 1911 . 2 2 125 125 TYR CE1 C 13 116.27 0.20 . 1 1 . . B 276 TYR CE1 . 18000 1 1912 . 2 2 125 125 TYR N N 15 113.22 0.30 . 1 1 . . B 276 TYR N . 18000 1 1913 . 2 2 126 126 THR H H 1 7.32 0.03 . 1 1 . . B 277 THR H . 18000 1 1914 . 2 2 126 126 THR HA H 1 4.58 0.03 . 1 1 . . B 277 THR HA . 18000 1 1915 . 2 2 126 126 THR HB H 1 3.84 0.03 . 1 1 . . B 277 THR HB . 18000 1 1916 . 2 2 126 126 THR HG21 H 1 0.97 0.03 . 1 1 . . B 277 THR HG21 . 18000 1 1917 . 2 2 126 126 THR HG22 H 1 0.97 0.03 . 1 1 . . B 277 THR HG22 . 18000 1 1918 . 2 2 126 126 THR HG23 H 1 0.97 0.03 . 1 1 . . B 277 THR HG23 . 18000 1 1919 . 2 2 126 126 THR C C 13 170.44 0.20 . 1 1 . . B 277 THR C . 18000 1 1920 . 2 2 126 126 THR CA C 13 57.42 0.20 . 1 1 . . B 277 THR CA . 18000 1 1921 . 2 2 126 126 THR CB C 13 68.40 0.20 . 1 1 . . B 277 THR CB . 18000 1 1922 . 2 2 126 126 THR CG2 C 13 19.60 0.20 . 1 1 . . B 277 THR CG2 . 18000 1 1923 . 2 2 126 126 THR N N 15 116.06 0.30 . 1 1 . . B 277 THR N . 18000 1 1924 . 2 2 127 127 PRO HA H 1 4.51 0.03 . 1 1 . . B 278 PRO HA . 18000 1 1925 . 2 2 127 127 PRO HB3 H 1 2.00 0.03 . 2 1 . . B 278 PRO HB3 . 18000 1 1926 . 2 2 127 127 PRO HG3 H 1 1.97 0.03 . 2 1 . . B 278 PRO HG3 . 18000 1 1927 . 2 2 127 127 PRO HD2 H 1 3.62 0.03 . 2 1 . . B 278 PRO HD2 . 18000 1 1928 . 2 2 127 127 PRO HD3 H 1 3.70 0.03 . 2 1 . . B 278 PRO HD3 . 18000 1 1929 . 2 2 127 127 PRO C C 13 173.85 0.20 . 1 1 . . B 278 PRO C . 18000 1 1930 . 2 2 127 127 PRO CA C 13 60.98 0.20 . 1 1 . . B 278 PRO CA . 18000 1 1931 . 2 2 127 127 PRO CB C 13 28.47 0.20 . 1 1 . . B 278 PRO CB . 18000 1 1932 . 2 2 127 127 PRO CG C 13 25.67 0.20 . 1 1 . . B 278 PRO CG . 18000 1 1933 . 2 2 127 127 PRO CD C 13 49.03 0.20 . 1 1 . . B 278 PRO CD . 18000 1 1934 . 2 2 128 128 LEU H H 1 7.87 0.03 . 1 1 . . B 279 LEU H . 18000 1 1935 . 2 2 128 128 LEU HA H 1 4.43 0.03 . 1 1 . . B 279 LEU HA . 18000 1 1936 . 2 2 128 128 LEU HB2 H 1 1.32 0.03 . 2 1 . . B 279 LEU HB2 . 18000 1 1937 . 2 2 128 128 LEU HB3 H 1 1.53 0.03 . 2 1 . . B 279 LEU HB3 . 18000 1 1938 . 2 2 128 128 LEU HG H 1 1.61 0.03 . 1 1 . . B 279 LEU HG . 18000 1 1939 . 2 2 128 128 LEU HD11 H 1 0.72 0.03 . 2 1 . . B 279 LEU HD11 . 18000 1 1940 . 2 2 128 128 LEU HD12 H 1 0.72 0.03 . 2 1 . . B 279 LEU HD12 . 18000 1 1941 . 2 2 128 128 LEU HD13 H 1 0.72 0.03 . 2 1 . . B 279 LEU HD13 . 18000 1 1942 . 2 2 128 128 LEU HD21 H 1 0.66 0.03 . 2 1 . . B 279 LEU HD21 . 18000 1 1943 . 2 2 128 128 LEU HD22 H 1 0.66 0.03 . 2 1 . . B 279 LEU HD22 . 18000 1 1944 . 2 2 128 128 LEU HD23 H 1 0.66 0.03 . 2 1 . . B 279 LEU HD23 . 18000 1 1945 . 2 2 128 128 LEU C C 13 174.40 0.20 . 1 1 . . B 279 LEU C . 18000 1 1946 . 2 2 128 128 LEU CA C 13 51.94 0.20 . 1 1 . . B 279 LEU CA . 18000 1 1947 . 2 2 128 128 LEU CB C 13 43.30 0.20 . 1 1 . . B 279 LEU CB . 18000 1 1948 . 2 2 128 128 LEU CG C 13 25.04 0.20 . 1 1 . . B 279 LEU CG . 18000 1 1949 . 2 2 128 128 LEU CD1 C 13 22.42 0.20 . 2 1 . . B 279 LEU CD1 . 18000 1 1950 . 2 2 128 128 LEU CD2 C 13 24.35 0.20 . 2 1 . . B 279 LEU CD2 . 18000 1 1951 . 2 2 128 128 LEU N N 15 123.72 0.30 . 1 1 . . B 279 LEU N . 18000 1 1952 . 2 2 129 129 ASP H H 1 8.12 0.03 . 1 1 . . B 280 ASP H . 18000 1 1953 . 2 2 129 129 ASP HA H 1 4.54 0.03 . 1 1 . . B 280 ASP HA . 18000 1 1954 . 2 2 129 129 ASP HB2 H 1 2.67 0.03 . 2 1 . . B 280 ASP HB2 . 18000 1 1955 . 2 2 129 129 ASP HB3 H 1 2.92 0.03 . 2 1 . . B 280 ASP HB3 . 18000 1 1956 . 2 2 129 129 ASP C C 13 173.62 0.20 . 1 1 . . B 280 ASP C . 18000 1 1957 . 2 2 129 129 ASP CA C 13 51.52 0.20 . 1 1 . . B 280 ASP CA . 18000 1 1958 . 2 2 129 129 ASP CB C 13 39.82 0.20 . 1 1 . . B 280 ASP CB . 18000 1 1959 . 2 2 129 129 ASP N N 15 119.94 0.30 . 1 1 . . B 280 ASP N . 18000 1 1960 . 2 2 130 130 GLU H H 1 8.80 0.03 . 1 1 . . B 281 GLU H . 18000 1 1961 . 2 2 130 130 GLU HA H 1 3.89 0.03 . 1 1 . . B 281 GLU HA . 18000 1 1962 . 2 2 130 130 GLU HB3 H 1 2.05 0.03 . 2 1 . . B 281 GLU HB3 . 18000 1 1963 . 2 2 130 130 GLU HG2 H 1 2.29 0.03 . 2 1 . . B 281 GLU HG2 . 18000 1 1964 . 2 2 130 130 GLU HG3 H 1 2.34 0.03 . 2 1 . . B 281 GLU HG3 . 18000 1 1965 . 2 2 130 130 GLU C C 13 177.06 0.20 . 1 1 . . B 281 GLU C . 18000 1 1966 . 2 2 130 130 GLU CA C 13 58.34 0.20 . 1 1 . . B 281 GLU CA . 18000 1 1967 . 2 2 130 130 GLU CB C 13 27.91 0.20 . 1 1 . . B 281 GLU CB . 18000 1 1968 . 2 2 130 130 GLU CG C 13 34.46 0.20 . 1 1 . . B 281 GLU CG . 18000 1 1969 . 2 2 130 130 GLU N N 15 120.07 0.30 . 1 1 . . B 281 GLU N . 18000 1 1970 . 2 2 131 131 LYS H H 1 8.29 0.03 . 1 1 . . B 282 LYS H . 18000 1 1971 . 2 2 131 131 LYS HA H 1 4.13 0.03 . 1 1 . . B 282 LYS HA . 18000 1 1972 . 2 2 131 131 LYS HB2 H 1 1.81 0.03 . 2 1 . . B 282 LYS HB2 . 18000 1 1973 . 2 2 131 131 LYS HB3 H 1 1.94 0.03 . 2 1 . . B 282 LYS HB3 . 18000 1 1974 . 2 2 131 131 LYS HG2 H 1 1.43 0.03 . 2 1 . . B 282 LYS HG2 . 18000 1 1975 . 2 2 131 131 LYS HG3 H 1 1.55 0.03 . 2 1 . . B 282 LYS HG3 . 18000 1 1976 . 2 2 131 131 LYS HD3 H 1 1.69 0.03 . 2 1 . . B 282 LYS HD3 . 18000 1 1977 . 2 2 131 131 LYS HE3 H 1 2.97 0.03 . 2 1 . . B 282 LYS HE3 . 18000 1 1978 . 2 2 131 131 LYS C C 13 177.79 0.20 . 1 1 . . B 282 LYS C . 18000 1 1979 . 2 2 131 131 LYS CA C 13 57.56 0.20 . 1 1 . . B 282 LYS CA . 18000 1 1980 . 2 2 131 131 LYS CB C 13 30.12 0.20 . 1 1 . . B 282 LYS CB . 18000 1 1981 . 2 2 131 131 LYS CG C 13 23.65 0.20 . 1 1 . . B 282 LYS CG . 18000 1 1982 . 2 2 131 131 LYS CD C 13 27.25 0.20 . 1 1 . . B 282 LYS CD . 18000 1 1983 . 2 2 131 131 LYS N N 15 119.51 0.30 . 1 1 . . B 282 LYS N . 18000 1 1984 . 2 2 132 132 SER H H 1 8.31 0.03 . 1 1 . . B 283 SER H . 18000 1 1985 . 2 2 132 132 SER HA H 1 4.10 0.03 . 1 1 . . B 283 SER HA . 18000 1 1986 . 2 2 132 132 SER HB2 H 1 3.64 0.03 . 2 1 . . B 283 SER HB2 . 18000 1 1987 . 2 2 132 132 SER HB3 H 1 3.86 0.03 . 2 1 . . B 283 SER HB3 . 18000 1 1988 . 2 2 132 132 SER C C 13 173.64 0.20 . 1 1 . . B 283 SER C . 18000 1 1989 . 2 2 132 132 SER CA C 13 60.57 0.20 . 1 1 . . B 283 SER CA . 18000 1 1990 . 2 2 132 132 SER CB C 13 60.80 0.20 . 1 1 . . B 283 SER CB . 18000 1 1991 . 2 2 132 132 SER N N 15 118.20 0.30 . 1 1 . . B 283 SER N . 18000 1 1992 . 2 2 133 133 LEU H H 1 8.30 0.03 . 1 1 . . B 284 LEU H . 18000 1 1993 . 2 2 133 133 LEU HA H 1 3.88 0.03 . 1 1 . . B 284 LEU HA . 18000 1 1994 . 2 2 133 133 LEU HB2 H 1 1.38 0.03 . 2 1 . . B 284 LEU HB2 . 18000 1 1995 . 2 2 133 133 LEU HB3 H 1 1.74 0.03 . 2 1 . . B 284 LEU HB3 . 18000 1 1996 . 2 2 133 133 LEU HG H 1 1.53 0.03 . 1 1 . . B 284 LEU HG . 18000 1 1997 . 2 2 133 133 LEU HD11 H 1 0.86 0.03 . 2 1 . . B 284 LEU HD11 . 18000 1 1998 . 2 2 133 133 LEU HD12 H 1 0.86 0.03 . 2 1 . . B 284 LEU HD12 . 18000 1 1999 . 2 2 133 133 LEU HD13 H 1 0.86 0.03 . 2 1 . . B 284 LEU HD13 . 18000 1 2000 . 2 2 133 133 LEU HD21 H 1 0.84 0.03 . 2 1 . . B 284 LEU HD21 . 18000 1 2001 . 2 2 133 133 LEU HD22 H 1 0.84 0.03 . 2 1 . . B 284 LEU HD22 . 18000 1 2002 . 2 2 133 133 LEU HD23 H 1 0.84 0.03 . 2 1 . . B 284 LEU HD23 . 18000 1 2003 . 2 2 133 133 LEU C C 13 175.41 0.20 . 1 1 . . B 284 LEU C . 18000 1 2004 . 2 2 133 133 LEU CA C 13 56.12 0.20 . 1 1 . . B 284 LEU CA . 18000 1 2005 . 2 2 133 133 LEU CB C 13 39.67 0.20 . 1 1 . . B 284 LEU CB . 18000 1 2006 . 2 2 133 133 LEU CG C 13 25.29 0.20 . 1 1 . . B 284 LEU CG . 18000 1 2007 . 2 2 133 133 LEU CD1 C 13 23.98 0.20 . 2 1 . . B 284 LEU CD1 . 18000 1 2008 . 2 2 133 133 LEU CD2 C 13 22.07 0.20 . 2 1 . . B 284 LEU CD2 . 18000 1 2009 . 2 2 133 133 LEU N N 15 121.41 0.30 . 1 1 . . B 284 LEU N . 18000 1 2010 . 2 2 134 134 ALA H H 1 7.79 0.03 . 1 1 . . B 285 ALA H . 18000 1 2011 . 2 2 134 134 ALA HA H 1 4.00 0.03 . 1 1 . . B 285 ALA HA . 18000 1 2012 . 2 2 134 134 ALA HB1 H 1 1.48 0.03 . 1 1 . . B 285 ALA HB1 . 18000 1 2013 . 2 2 134 134 ALA HB2 H 1 1.48 0.03 . 1 1 . . B 285 ALA HB2 . 18000 1 2014 . 2 2 134 134 ALA HB3 H 1 1.48 0.03 . 1 1 . . B 285 ALA HB3 . 18000 1 2015 . 2 2 134 134 ALA C C 13 178.60 0.20 . 1 1 . . B 285 ALA C . 18000 1 2016 . 2 2 134 134 ALA CA C 13 53.44 0.20 . 1 1 . . B 285 ALA CA . 18000 1 2017 . 2 2 134 134 ALA CB C 13 16.13 0.20 . 1 1 . . B 285 ALA CB . 18000 1 2018 . 2 2 134 134 ALA N N 15 119.19 0.30 . 1 1 . . B 285 ALA N . 18000 1 2019 . 2 2 135 135 LEU H H 1 7.63 0.03 . 1 1 . . B 286 LEU H . 18000 1 2020 . 2 2 135 135 LEU HA H 1 4.15 0.03 . 1 1 . . B 286 LEU HA . 18000 1 2021 . 2 2 135 135 LEU HB2 H 1 1.72 0.03 . 2 1 . . B 286 LEU HB2 . 18000 1 2022 . 2 2 135 135 LEU HB3 H 1 1.80 0.03 . 2 1 . . B 286 LEU HB3 . 18000 1 2023 . 2 2 135 135 LEU HG H 1 1.72 0.03 . 1 1 . . B 286 LEU HG . 18000 1 2024 . 2 2 135 135 LEU HD11 H 1 1.03 0.03 . 2 1 . . B 286 LEU HD11 . 18000 1 2025 . 2 2 135 135 LEU HD12 H 1 1.03 0.03 . 2 1 . . B 286 LEU HD12 . 18000 1 2026 . 2 2 135 135 LEU HD13 H 1 1.03 0.03 . 2 1 . . B 286 LEU HD13 . 18000 1 2027 . 2 2 135 135 LEU HD21 H 1 0.94 0.03 . 2 1 . . B 286 LEU HD21 . 18000 1 2028 . 2 2 135 135 LEU HD22 H 1 0.94 0.03 . 2 1 . . B 286 LEU HD22 . 18000 1 2029 . 2 2 135 135 LEU HD23 H 1 0.94 0.03 . 2 1 . . B 286 LEU HD23 . 18000 1 2030 . 2 2 135 135 LEU C C 13 176.50 0.20 . 1 1 . . B 286 LEU C . 18000 1 2031 . 2 2 135 135 LEU CA C 13 55.99 0.20 . 1 1 . . B 286 LEU CA . 18000 1 2032 . 2 2 135 135 LEU CB C 13 40.63 0.20 . 1 1 . . B 286 LEU CB . 18000 1 2033 . 2 2 135 135 LEU CG C 13 25.32 0.20 . 1 1 . . B 286 LEU CG . 18000 1 2034 . 2 2 135 135 LEU CD1 C 13 22.49 0.20 . 2 1 . . B 286 LEU CD1 . 18000 1 2035 . 2 2 135 135 LEU CD2 C 13 23.62 0.20 . 2 1 . . B 286 LEU CD2 . 18000 1 2036 . 2 2 135 135 LEU N N 15 118.77 0.30 . 1 1 . . B 286 LEU N . 18000 1 2037 . 2 2 136 136 LEU H H 1 8.25 0.03 . 1 1 . . B 287 LEU H . 18000 1 2038 . 2 2 136 136 LEU HA H 1 4.00 0.03 . 1 1 . . B 287 LEU HA . 18000 1 2039 . 2 2 136 136 LEU HB2 H 1 1.37 0.03 . 2 1 . . B 287 LEU HB2 . 18000 1 2040 . 2 2 136 136 LEU HB3 H 1 1.94 0.03 . 2 1 . . B 287 LEU HB3 . 18000 1 2041 . 2 2 136 136 LEU HG H 1 1.27 0.03 . 1 1 . . B 287 LEU HG . 18000 1 2042 . 2 2 136 136 LEU HD11 H 1 0.48 0.03 . 2 1 . . B 287 LEU HD11 . 18000 1 2043 . 2 2 136 136 LEU HD12 H 1 0.48 0.03 . 2 1 . . B 287 LEU HD12 . 18000 1 2044 . 2 2 136 136 LEU HD13 H 1 0.48 0.03 . 2 1 . . B 287 LEU HD13 . 18000 1 2045 . 2 2 136 136 LEU HD21 H 1 0.44 0.03 . 2 1 . . B 287 LEU HD21 . 18000 1 2046 . 2 2 136 136 LEU HD22 H 1 0.44 0.03 . 2 1 . . B 287 LEU HD22 . 18000 1 2047 . 2 2 136 136 LEU HD23 H 1 0.44 0.03 . 2 1 . . B 287 LEU HD23 . 18000 1 2048 . 2 2 136 136 LEU C C 13 177.11 0.20 . 1 1 . . B 287 LEU C . 18000 1 2049 . 2 2 136 136 LEU CA C 13 56.66 0.20 . 1 1 . . B 287 LEU CA . 18000 1 2050 . 2 2 136 136 LEU CB C 13 39.93 0.20 . 1 1 . . B 287 LEU CB . 18000 1 2051 . 2 2 136 136 LEU CG C 13 25.15 0.20 . 1 1 . . B 287 LEU CG . 18000 1 2052 . 2 2 136 136 LEU CD1 C 13 21.98 0.20 . 2 1 . . B 287 LEU CD1 . 18000 1 2053 . 2 2 136 136 LEU CD2 C 13 24.64 0.20 . 2 1 . . B 287 LEU CD2 . 18000 1 2054 . 2 2 136 136 LEU N N 15 118.83 0.30 . 1 1 . . B 287 LEU N . 18000 1 2055 . 2 2 137 137 LEU H H 1 8.84 0.03 . 1 1 . . B 288 LEU H . 18000 1 2056 . 2 2 137 137 LEU HA H 1 3.72 0.03 . 1 1 . . B 288 LEU HA . 18000 1 2057 . 2 2 137 137 LEU HB2 H 1 1.44 0.03 . 2 1 . . B 288 LEU HB2 . 18000 1 2058 . 2 2 137 137 LEU HB3 H 1 1.92 0.03 . 2 1 . . B 288 LEU HB3 . 18000 1 2059 . 2 2 137 137 LEU HG H 1 1.75 0.03 . 1 1 . . B 288 LEU HG . 18000 1 2060 . 2 2 137 137 LEU HD11 H 1 0.82 0.03 . 2 1 . . B 288 LEU HD11 . 18000 1 2061 . 2 2 137 137 LEU HD12 H 1 0.82 0.03 . 2 1 . . B 288 LEU HD12 . 18000 1 2062 . 2 2 137 137 LEU HD13 H 1 0.82 0.03 . 2 1 . . B 288 LEU HD13 . 18000 1 2063 . 2 2 137 137 LEU HD21 H 1 0.65 0.03 . 2 1 . . B 288 LEU HD21 . 18000 1 2064 . 2 2 137 137 LEU HD22 H 1 0.65 0.03 . 2 1 . . B 288 LEU HD22 . 18000 1 2065 . 2 2 137 137 LEU HD23 H 1 0.65 0.03 . 2 1 . . B 288 LEU HD23 . 18000 1 2066 . 2 2 137 137 LEU C C 13 176.94 0.20 . 1 1 . . B 288 LEU C . 18000 1 2067 . 2 2 137 137 LEU CA C 13 56.60 0.20 . 1 1 . . B 288 LEU CA . 18000 1 2068 . 2 2 137 137 LEU CB C 13 39.10 0.20 . 1 1 . . B 288 LEU CB . 18000 1 2069 . 2 2 137 137 LEU CG C 13 25.49 0.20 . 1 1 . . B 288 LEU CG . 18000 1 2070 . 2 2 137 137 LEU CD1 C 13 23.85 0.20 . 2 1 . . B 288 LEU CD1 . 18000 1 2071 . 2 2 137 137 LEU CD2 C 13 21.30 0.20 . 2 1 . . B 288 LEU CD2 . 18000 1 2072 . 2 2 137 137 LEU N N 15 117.25 0.30 . 1 1 . . B 288 LEU N . 18000 1 2073 . 2 2 138 138 ASN H H 1 7.97 0.03 . 1 1 . . B 289 ASN H . 18000 1 2074 . 2 2 138 138 ASN HA H 1 4.53 0.03 . 1 1 . . B 289 ASN HA . 18000 1 2075 . 2 2 138 138 ASN HB2 H 1 2.94 0.03 . 2 1 . . B 289 ASN HB2 . 18000 1 2076 . 2 2 138 138 ASN HB3 H 1 3.00 0.03 . 2 1 . . B 289 ASN HB3 . 18000 1 2077 . 2 2 138 138 ASN HD21 H 1 6.85 0.03 . 2 1 . . B 289 ASN HD21 . 18000 1 2078 . 2 2 138 138 ASN HD22 H 1 7.08 0.03 . 2 1 . . B 289 ASN HD22 . 18000 1 2079 . 2 2 138 138 ASN C C 13 176.88 0.20 . 1 1 . . B 289 ASN C . 18000 1 2080 . 2 2 138 138 ASN CA C 13 55.04 0.20 . 1 1 . . B 289 ASN CA . 18000 1 2081 . 2 2 138 138 ASN CB C 13 36.51 0.20 . 1 1 . . B 289 ASN CB . 18000 1 2082 . 2 2 138 138 ASN N N 15 118.06 0.30 . 1 1 . . B 289 ASN N . 18000 1 2083 . 2 2 138 138 ASN ND2 N 15 111.31 0.30 . 1 1 . . B 289 ASN ND2 . 18000 1 2084 . 2 2 139 139 TYR H H 1 8.01 0.03 . 1 1 . . B 290 TYR H . 18000 1 2085 . 2 2 139 139 TYR HA H 1 4.41 0.03 . 1 1 . . B 290 TYR HA . 18000 1 2086 . 2 2 139 139 TYR HB3 H 1 3.11 0.03 . 2 1 . . B 290 TYR HB3 . 18000 1 2087 . 2 2 139 139 TYR HD1 H 1 7.36 0.03 . 3 1 . . B 290 TYR HD1 . 18000 1 2088 . 2 2 139 139 TYR HE1 H 1 6.64 0.03 . 3 1 . . B 290 TYR HE1 . 18000 1 2089 . 2 2 139 139 TYR C C 13 177.03 0.20 . 1 1 . . B 290 TYR C . 18000 1 2090 . 2 2 139 139 TYR CA C 13 60.96 0.20 . 1 1 . . B 290 TYR CA . 18000 1 2091 . 2 2 139 139 TYR CB C 13 37.20 0.20 . 1 1 . . B 290 TYR CB . 18000 1 2092 . 2 2 139 139 TYR N N 15 118.38 0.30 . 1 1 . . B 290 TYR N . 18000 1 2093 . 2 2 140 140 LEU H H 1 9.10 0.03 . 1 1 . . B 291 LEU H . 18000 1 2094 . 2 2 140 140 LEU HA H 1 4.19 0.03 . 1 1 . . B 291 LEU HA . 18000 1 2095 . 2 2 140 140 LEU HB2 H 1 1.36 0.03 . 2 1 . . B 291 LEU HB2 . 18000 1 2096 . 2 2 140 140 LEU HB3 H 1 1.92 0.03 . 2 1 . . B 291 LEU HB3 . 18000 1 2097 . 2 2 140 140 LEU HG H 1 2.24 0.03 . 1 1 . . B 291 LEU HG . 18000 1 2098 . 2 2 140 140 LEU HD11 H 1 0.94 0.03 . 2 1 . . B 291 LEU HD11 . 18000 1 2099 . 2 2 140 140 LEU HD12 H 1 0.94 0.03 . 2 1 . . B 291 LEU HD12 . 18000 1 2100 . 2 2 140 140 LEU HD13 H 1 0.94 0.03 . 2 1 . . B 291 LEU HD13 . 18000 1 2101 . 2 2 140 140 LEU HD21 H 1 0.77 0.03 . 2 1 . . B 291 LEU HD21 . 18000 1 2102 . 2 2 140 140 LEU HD22 H 1 0.77 0.03 . 2 1 . . B 291 LEU HD22 . 18000 1 2103 . 2 2 140 140 LEU HD23 H 1 0.77 0.03 . 2 1 . . B 291 LEU HD23 . 18000 1 2104 . 2 2 140 140 LEU C C 13 177.31 0.20 . 1 1 . . B 291 LEU C . 18000 1 2105 . 2 2 140 140 LEU CA C 13 56.64 0.20 . 1 1 . . B 291 LEU CA . 18000 1 2106 . 2 2 140 140 LEU CB C 13 38.85 0.20 . 1 1 . . B 291 LEU CB . 18000 1 2107 . 2 2 140 140 LEU CG C 13 24.28 0.20 . 1 1 . . B 291 LEU CG . 18000 1 2108 . 2 2 140 140 LEU CD1 C 13 19.66 0.20 . 2 1 . . B 291 LEU CD1 . 18000 1 2109 . 2 2 140 140 LEU CD2 C 13 24.72 0.20 . 2 1 . . B 291 LEU CD2 . 18000 1 2110 . 2 2 140 140 LEU N N 15 118.59 0.30 . 1 1 . . B 291 LEU N . 18000 1 2111 . 2 2 141 141 HIS H H 1 8.81 0.03 . 1 1 . . B 292 HIS H . 18000 1 2112 . 2 2 141 141 HIS HA H 1 4.42 0.03 . 1 1 . . B 292 HIS HA . 18000 1 2113 . 2 2 141 141 HIS HB3 H 1 3.27 0.03 . 2 1 . . B 292 HIS HB3 . 18000 1 2114 . 2 2 141 141 HIS HD2 H 1 7.03 0.03 . 1 1 . . B 292 HIS HD2 . 18000 1 2115 . 2 2 141 141 HIS HE1 H 1 7.75 0.03 . 1 1 . . B 292 HIS HE1 . 18000 1 2116 . 2 2 141 141 HIS C C 13 176.12 0.20 . 1 1 . . B 292 HIS C . 18000 1 2117 . 2 2 141 141 HIS CA C 13 58.86 0.20 . 1 1 . . B 292 HIS CA . 18000 1 2118 . 2 2 141 141 HIS CB C 13 26.47 0.20 . 1 1 . . B 292 HIS CB . 18000 1 2119 . 2 2 141 141 HIS CE1 C 13 135.01 0.20 . 1 1 . . B 292 HIS CE1 . 18000 1 2120 . 2 2 141 141 HIS N N 15 116.72 0.30 . 1 1 . . B 292 HIS N . 18000 1 2121 . 2 2 142 142 ASP H H 1 8.16 0.03 . 1 1 . . B 293 ASP H . 18000 1 2122 . 2 2 142 142 ASP HA H 1 4.50 0.03 . 1 1 . . B 293 ASP HA . 18000 1 2123 . 2 2 142 142 ASP HB2 H 1 2.90 0.03 . 2 1 . . B 293 ASP HB2 . 18000 1 2124 . 2 2 142 142 ASP HB3 H 1 3.06 0.03 . 2 1 . . B 293 ASP HB3 . 18000 1 2125 . 2 2 142 142 ASP C C 13 176.44 0.20 . 1 1 . . B 293 ASP C . 18000 1 2126 . 2 2 142 142 ASP CA C 13 56.56 0.20 . 1 1 . . B 293 ASP CA . 18000 1 2127 . 2 2 142 142 ASP CB C 13 40.52 0.20 . 1 1 . . B 293 ASP CB . 18000 1 2128 . 2 2 142 142 ASP N N 15 121.84 0.30 . 1 1 . . B 293 ASP N . 18000 1 2129 . 2 2 143 143 PHE H H 1 8.48 0.03 . 1 1 . . B 294 PHE H . 18000 1 2130 . 2 2 143 143 PHE HA H 1 3.93 0.03 . 1 1 . . B 294 PHE HA . 18000 1 2131 . 2 2 143 143 PHE HB2 H 1 2.74 0.03 . 2 1 . . B 294 PHE HB2 . 18000 1 2132 . 2 2 143 143 PHE HB3 H 1 2.93 0.03 . 2 1 . . B 294 PHE HB3 . 18000 1 2133 . 2 2 143 143 PHE HD2 H 1 6.12 0.03 . 3 1 . . B 294 PHE HD2 . 18000 1 2134 . 2 2 143 143 PHE HE2 H 1 6.89 0.03 . 3 1 . . B 294 PHE HE2 . 18000 1 2135 . 2 2 143 143 PHE HZ H 1 6.97 0.03 . 1 1 . . B 294 PHE HZ . 18000 1 2136 . 2 2 143 143 PHE C C 13 175.76 0.20 . 1 1 . . B 294 PHE C . 18000 1 2137 . 2 2 143 143 PHE CA C 13 58.82 0.20 . 1 1 . . B 294 PHE CA . 18000 1 2138 . 2 2 143 143 PHE CB C 13 36.56 0.20 . 1 1 . . B 294 PHE CB . 18000 1 2139 . 2 2 143 143 PHE CD2 C 13 129.83 0.20 . 1 1 . . B 294 PHE CD2 . 18000 1 2140 . 2 2 143 143 PHE CE2 C 13 127.63 0.20 . 1 1 . . B 294 PHE CE2 . 18000 1 2141 . 2 2 143 143 PHE N N 15 121.37 0.30 . 1 1 . . B 294 PHE N . 18000 1 2142 . 2 2 144 144 LEU H H 1 8.30 0.03 . 1 1 . . B 295 LEU H . 18000 1 2143 . 2 2 144 144 LEU HA H 1 3.42 0.03 . 1 1 . . B 295 LEU HA . 18000 1 2144 . 2 2 144 144 LEU HB3 H 1 1.98 0.03 . 2 1 . . B 295 LEU HB3 . 18000 1 2145 . 2 2 144 144 LEU HG H 1 1.10 0.03 . 1 1 . . B 295 LEU HG . 18000 1 2146 . 2 2 144 144 LEU HD11 H 1 0.79 0.03 . 2 1 . . B 295 LEU HD11 . 18000 1 2147 . 2 2 144 144 LEU HD12 H 1 0.79 0.03 . 2 1 . . B 295 LEU HD12 . 18000 1 2148 . 2 2 144 144 LEU HD13 H 1 0.79 0.03 . 2 1 . . B 295 LEU HD13 . 18000 1 2149 . 2 2 144 144 LEU HD21 H 1 0.28 0.03 . 2 1 . . B 295 LEU HD21 . 18000 1 2150 . 2 2 144 144 LEU HD22 H 1 0.28 0.03 . 2 1 . . B 295 LEU HD22 . 18000 1 2151 . 2 2 144 144 LEU HD23 H 1 0.28 0.03 . 2 1 . . B 295 LEU HD23 . 18000 1 2152 . 2 2 144 144 LEU C C 13 176.43 0.20 . 1 1 . . B 295 LEU C . 18000 1 2153 . 2 2 144 144 LEU CA C 13 56.40 0.20 . 1 1 . . B 295 LEU CA . 18000 1 2154 . 2 2 144 144 LEU CB C 13 39.78 0.20 . 1 1 . . B 295 LEU CB . 18000 1 2155 . 2 2 144 144 LEU CG C 13 25.64 0.20 . 1 1 . . B 295 LEU CG . 18000 1 2156 . 2 2 144 144 LEU CD1 C 13 24.36 0.20 . 2 1 . . B 295 LEU CD1 . 18000 1 2157 . 2 2 144 144 LEU CD2 C 13 21.47 0.20 . 2 1 . . B 295 LEU CD2 . 18000 1 2158 . 2 2 144 144 LEU N N 15 119.12 0.30 . 1 1 . . B 295 LEU N . 18000 1 2159 . 2 2 145 145 LYS H H 1 8.11 0.03 . 1 1 . . B 296 LYS H . 18000 1 2160 . 2 2 145 145 LYS HA H 1 3.90 0.03 . 1 1 . . B 296 LYS HA . 18000 1 2161 . 2 2 145 145 LYS HB3 H 1 2.02 0.03 . 2 1 . . B 296 LYS HB3 . 18000 1 2162 . 2 2 145 145 LYS HG2 H 1 1.41 0.03 . 2 1 . . B 296 LYS HG2 . 18000 1 2163 . 2 2 145 145 LYS HG3 H 1 1.61 0.03 . 2 1 . . B 296 LYS HG3 . 18000 1 2164 . 2 2 145 145 LYS HD3 H 1 1.74 0.03 . 2 1 . . B 296 LYS HD3 . 18000 1 2165 . 2 2 145 145 LYS HE3 H 1 2.97 0.03 . 2 1 . . B 296 LYS HE3 . 18000 1 2166 . 2 2 145 145 LYS C C 13 176.84 0.20 . 1 1 . . B 296 LYS C . 18000 1 2167 . 2 2 145 145 LYS CA C 13 57.98 0.20 . 1 1 . . B 296 LYS CA . 18000 1 2168 . 2 2 145 145 LYS CB C 13 30.17 0.20 . 1 1 . . B 296 LYS CB . 18000 1 2169 . 2 2 145 145 LYS CG C 13 23.58 0.20 . 1 1 . . B 296 LYS CG . 18000 1 2170 . 2 2 145 145 LYS CD C 13 27.74 0.20 . 1 1 . . B 296 LYS CD . 18000 1 2171 . 2 2 145 145 LYS N N 15 119.68 0.30 . 1 1 . . B 296 LYS N . 18000 1 2172 . 2 2 146 146 TYR H H 1 7.69 0.03 . 1 1 . . B 297 TYR H . 18000 1 2173 . 2 2 146 146 TYR HA H 1 3.85 0.03 . 1 1 . . B 297 TYR HA . 18000 1 2174 . 2 2 146 146 TYR HB2 H 1 3.04 0.03 . 2 1 . . B 297 TYR HB2 . 18000 1 2175 . 2 2 146 146 TYR HB3 H 1 3.23 0.03 . 2 1 . . B 297 TYR HB3 . 18000 1 2176 . 2 2 146 146 TYR HD2 H 1 6.22 0.03 . 3 1 . . B 297 TYR HD2 . 18000 1 2177 . 2 2 146 146 TYR HE2 H 1 6.44 0.03 . 3 1 . . B 297 TYR HE2 . 18000 1 2178 . 2 2 146 146 TYR C C 13 176.15 0.20 . 1 1 . . B 297 TYR C . 18000 1 2179 . 2 2 146 146 TYR CA C 13 60.06 0.20 . 1 1 . . B 297 TYR CA . 18000 1 2180 . 2 2 146 146 TYR CB C 13 35.86 0.20 . 1 1 . . B 297 TYR CB . 18000 1 2181 . 2 2 146 146 TYR N N 15 122.18 0.30 . 1 1 . . B 297 TYR N . 18000 1 2182 . 2 2 147 147 LEU H H 1 8.03 0.03 . 1 1 . . B 298 LEU H . 18000 1 2183 . 2 2 147 147 LEU HA H 1 3.44 0.03 . 1 1 . . B 298 LEU HA . 18000 1 2184 . 2 2 147 147 LEU HB2 H 1 1.17 0.03 . 2 1 . . B 298 LEU HB2 . 18000 1 2185 . 2 2 147 147 LEU HB3 H 1 1.85 0.03 . 2 1 . . B 298 LEU HB3 . 18000 1 2186 . 2 2 147 147 LEU HG H 1 1.25 0.03 . 1 1 . . B 298 LEU HG . 18000 1 2187 . 2 2 147 147 LEU HD11 H 1 0.58 0.03 . 2 1 . . B 298 LEU HD11 . 18000 1 2188 . 2 2 147 147 LEU HD12 H 1 0.58 0.03 . 2 1 . . B 298 LEU HD12 . 18000 1 2189 . 2 2 147 147 LEU HD13 H 1 0.58 0.03 . 2 1 . . B 298 LEU HD13 . 18000 1 2190 . 2 2 147 147 LEU HD21 H 1 0.59 0.03 . 2 1 . . B 298 LEU HD21 . 18000 1 2191 . 2 2 147 147 LEU HD22 H 1 0.59 0.03 . 2 1 . . B 298 LEU HD22 . 18000 1 2192 . 2 2 147 147 LEU HD23 H 1 0.59 0.03 . 2 1 . . B 298 LEU HD23 . 18000 1 2193 . 2 2 147 147 LEU C C 13 176.29 0.20 . 1 1 . . B 298 LEU C . 18000 1 2194 . 2 2 147 147 LEU CA C 13 55.85 0.20 . 1 1 . . B 298 LEU CA . 18000 1 2195 . 2 2 147 147 LEU CB C 13 39.77 0.20 . 1 1 . . B 298 LEU CB . 18000 1 2196 . 2 2 147 147 LEU CG C 13 23.91 0.20 . 1 1 . . B 298 LEU CG . 18000 1 2197 . 2 2 147 147 LEU CD1 C 13 24.18 0.20 . 2 1 . . B 298 LEU CD1 . 18000 1 2198 . 2 2 147 147 LEU CD2 C 13 21.17 0.20 . 2 1 . . B 298 LEU CD2 . 18000 1 2199 . 2 2 147 147 LEU N N 15 120.35 0.30 . 1 1 . . B 298 LEU N . 18000 1 2200 . 2 2 148 148 ALA H H 1 8.20 0.03 . 1 1 . . B 299 ALA H . 18000 1 2201 . 2 2 148 148 ALA HA H 1 3.76 0.03 . 1 1 . . B 299 ALA HA . 18000 1 2202 . 2 2 148 148 ALA HB1 H 1 1.40 0.03 . 1 1 . . B 299 ALA HB1 . 18000 1 2203 . 2 2 148 148 ALA HB2 H 1 1.40 0.03 . 1 1 . . B 299 ALA HB2 . 18000 1 2204 . 2 2 148 148 ALA HB3 H 1 1.40 0.03 . 1 1 . . B 299 ALA HB3 . 18000 1 2205 . 2 2 148 148 ALA C C 13 178.67 0.20 . 1 1 . . B 299 ALA C . 18000 1 2206 . 2 2 148 148 ALA CA C 13 53.48 0.20 . 1 1 . . B 299 ALA CA . 18000 1 2207 . 2 2 148 148 ALA CB C 13 16.50 0.20 . 1 1 . . B 299 ALA CB . 18000 1 2208 . 2 2 148 148 ALA N N 15 118.59 0.30 . 1 1 . . B 299 ALA N . 18000 1 2209 . 2 2 149 149 LYS H H 1 8.17 0.03 . 1 1 . . B 300 LYS H . 18000 1 2210 . 2 2 149 149 LYS HA H 1 3.99 0.03 . 1 1 . . B 300 LYS HA . 18000 1 2211 . 2 2 149 149 LYS HB2 H 1 1.67 0.03 . 2 1 . . B 300 LYS HB2 . 18000 1 2212 . 2 2 149 149 LYS HB3 H 1 1.78 0.03 . 2 1 . . B 300 LYS HB3 . 18000 1 2213 . 2 2 149 149 LYS C C 13 175.76 0.20 . 1 1 . . B 300 LYS C . 18000 1 2214 . 2 2 149 149 LYS CA C 13 56.51 0.20 . 1 1 . . B 300 LYS CA . 18000 1 2215 . 2 2 149 149 LYS CB C 13 30.22 0.20 . 1 1 . . B 300 LYS CB . 18000 1 2216 . 2 2 149 149 LYS CG C 13 22.74 0.20 . 1 1 . . B 300 LYS CG . 18000 1 2217 . 2 2 149 149 LYS CD C 13 27.13 0.20 . 1 1 . . B 300 LYS CD . 18000 1 2218 . 2 2 149 149 LYS N N 15 119.09 0.30 . 1 1 . . B 300 LYS N . 18000 1 2219 . 2 2 150 150 ASN H H 1 7.08 0.03 . 1 1 . . B 301 ASN H . 18000 1 2220 . 2 2 150 150 ASN HA H 1 4.78 0.03 . 1 1 . . B 301 ASN HA . 18000 1 2221 . 2 2 150 150 ASN HB2 H 1 1.78 0.03 . 2 1 . . B 301 ASN HB2 . 18000 1 2222 . 2 2 150 150 ASN HB3 H 1 2.64 0.03 . 2 1 . . B 301 ASN HB3 . 18000 1 2223 . 2 2 150 150 ASN HD21 H 1 5.99 0.03 . 2 1 . . B 301 ASN HD21 . 18000 1 2224 . 2 2 150 150 ASN HD22 H 1 6.32 0.03 . 2 1 . . B 301 ASN HD22 . 18000 1 2225 . 2 2 150 150 ASN C C 13 173.29 0.20 . 1 1 . . B 301 ASN C . 18000 1 2226 . 2 2 150 150 ASN CA C 13 51.21 0.20 . 1 1 . . B 301 ASN CA . 18000 1 2227 . 2 2 150 150 ASN CB C 13 37.27 0.20 . 1 1 . . B 301 ASN CB . 18000 1 2228 . 2 2 150 150 ASN N N 15 115.00 0.30 . 1 1 . . B 301 ASN N . 18000 1 2229 . 2 2 150 150 ASN ND2 N 15 115.90 0.30 . 1 1 . . B 301 ASN ND2 . 18000 1 2230 . 2 2 151 151 SER H H 1 7.37 0.03 . 1 1 . . B 302 SER H . 18000 1 2231 . 2 2 151 151 SER HA H 1 3.97 0.03 . 1 1 . . B 302 SER HA . 18000 1 2232 . 2 2 151 151 SER HB3 H 1 4.20 0.03 . 2 1 . . B 302 SER HB3 . 18000 1 2233 . 2 2 151 151 SER C C 13 173.73 0.20 . 1 1 . . B 302 SER C . 18000 1 2234 . 2 2 151 151 SER CA C 13 60.34 0.20 . 1 1 . . B 302 SER CA . 18000 1 2235 . 2 2 151 151 SER CB C 13 61.17 0.20 . 1 1 . . B 302 SER CB . 18000 1 2236 . 2 2 151 151 SER N N 15 117.03 0.30 . 1 1 . . B 302 SER N . 18000 1 2237 . 2 2 152 152 ALA H H 1 8.47 0.03 . 1 1 . . B 303 ALA H . 18000 1 2238 . 2 2 152 152 ALA HA H 1 4.32 0.03 . 1 1 . . B 303 ALA HA . 18000 1 2239 . 2 2 152 152 ALA HB1 H 1 1.45 0.03 . 1 1 . . B 303 ALA HB1 . 18000 1 2240 . 2 2 152 152 ALA HB2 H 1 1.45 0.03 . 1 1 . . B 303 ALA HB2 . 18000 1 2241 . 2 2 152 152 ALA HB3 H 1 1.45 0.03 . 1 1 . . B 303 ALA HB3 . 18000 1 2242 . 2 2 152 152 ALA C C 13 177.65 0.20 . 1 1 . . B 303 ALA C . 18000 1 2243 . 2 2 152 152 ALA CA C 13 52.49 0.20 . 1 1 . . B 303 ALA CA . 18000 1 2244 . 2 2 152 152 ALA CB C 13 16.67 0.20 . 1 1 . . B 303 ALA CB . 18000 1 2245 . 2 2 152 152 ALA N N 15 120.95 0.30 . 1 1 . . B 303 ALA N . 18000 1 2246 . 2 2 153 153 THR H H 1 7.34 0.03 . 1 1 . . B 304 THR H . 18000 1 2247 . 2 2 153 153 THR HA H 1 4.25 0.03 . 1 1 . . B 304 THR HA . 18000 1 2248 . 2 2 153 153 THR HB H 1 4.11 0.03 . 1 1 . . B 304 THR HB . 18000 1 2249 . 2 2 153 153 THR HG21 H 1 1.11 0.03 . 1 1 . . B 304 THR HG21 . 18000 1 2250 . 2 2 153 153 THR HG22 H 1 1.11 0.03 . 1 1 . . B 304 THR HG22 . 18000 1 2251 . 2 2 153 153 THR HG23 H 1 1.11 0.03 . 1 1 . . B 304 THR HG23 . 18000 1 2252 . 2 2 153 153 THR C C 13 173.42 0.20 . 1 1 . . B 304 THR C . 18000 1 2253 . 2 2 153 153 THR CA C 13 60.49 0.20 . 1 1 . . B 304 THR CA . 18000 1 2254 . 2 2 153 153 THR CB C 13 67.47 0.20 . 1 1 . . B 304 THR CB . 18000 1 2255 . 2 2 153 153 THR CG2 C 13 20.10 0.20 . 1 1 . . B 304 THR CG2 . 18000 1 2256 . 2 2 153 153 THR N N 15 124.33 0.30 . 1 1 . . B 304 THR N . 18000 1 2257 . 2 2 154 154 LEU H H 1 7.25 0.03 . 1 1 . . B 305 LEU H . 18000 1 2258 . 2 2 154 154 LEU HA H 1 4.07 0.03 . 1 1 . . B 305 LEU HA . 18000 1 2259 . 2 2 154 154 LEU HB2 H 1 0.15 0.03 . 2 1 . . B 305 LEU HB2 . 18000 1 2260 . 2 2 154 154 LEU HB3 H 1 0.97 0.03 . 2 1 . . B 305 LEU HB3 . 18000 1 2261 . 2 2 154 154 LEU HG H 1 1.48 0.03 . 1 1 . . B 305 LEU HG . 18000 1 2262 . 2 2 154 154 LEU HD11 H 1 0.63 0.03 . 2 1 . . B 305 LEU HD11 . 18000 1 2263 . 2 2 154 154 LEU HD12 H 1 0.63 0.03 . 2 1 . . B 305 LEU HD12 . 18000 1 2264 . 2 2 154 154 LEU HD13 H 1 0.63 0.03 . 2 1 . . B 305 LEU HD13 . 18000 1 2265 . 2 2 154 154 LEU HD21 H 1 0.52 0.03 . 2 1 . . B 305 LEU HD21 . 18000 1 2266 . 2 2 154 154 LEU HD22 H 1 0.52 0.03 . 2 1 . . B 305 LEU HD22 . 18000 1 2267 . 2 2 154 154 LEU HD23 H 1 0.52 0.03 . 2 1 . . B 305 LEU HD23 . 18000 1 2268 . 2 2 154 154 LEU C C 13 174.21 0.20 . 1 1 . . B 305 LEU C . 18000 1 2269 . 2 2 154 154 LEU CA C 13 53.77 0.20 . 1 1 . . B 305 LEU CA . 18000 1 2270 . 2 2 154 154 LEU CB C 13 42.62 0.20 . 1 1 . . B 305 LEU CB . 18000 1 2271 . 2 2 154 154 LEU CG C 13 24.66 0.20 . 1 1 . . B 305 LEU CG . 18000 1 2272 . 2 2 154 154 LEU CD1 C 13 20.66 0.20 . 2 1 . . B 305 LEU CD1 . 18000 1 2273 . 2 2 154 154 LEU CD2 C 13 24.97 0.20 . 2 1 . . B 305 LEU CD2 . 18000 1 2274 . 2 2 154 154 LEU N N 15 119.39 0.30 . 1 1 . . B 305 LEU N . 18000 1 2275 . 2 2 155 155 PHE H H 1 7.49 0.03 . 1 1 . . B 306 PHE H . 18000 1 2276 . 2 2 155 155 PHE HB2 H 1 1.08 0.03 . 2 1 . . B 306 PHE HB2 . 18000 1 2277 . 2 2 155 155 PHE HB3 H 1 1.83 0.03 . 2 1 . . B 306 PHE HB3 . 18000 1 2278 . 2 2 155 155 PHE HE1 H 1 6.87 0.03 . 3 1 . . B 306 PHE HE1 . 18000 1 2279 . 2 2 155 155 PHE HZ H 1 6.77 0.03 . 1 1 . . B 306 PHE HZ . 18000 1 2280 . 2 2 155 155 PHE CA C 13 54.25 0.20 . 1 1 . . B 306 PHE CA . 18000 1 2281 . 2 2 155 155 PHE CB C 13 36.10 0.20 . 1 1 . . B 306 PHE CB . 18000 1 2282 . 2 2 155 155 PHE N N 15 117.84 0.30 . 1 1 . . B 306 PHE N . 18000 1 2283 . 2 2 156 156 SER HA H 1 4.60 0.03 . 1 1 . . B 307 SER HA . 18000 1 2284 . 2 2 156 156 SER HB2 H 1 3.51 0.03 . 2 1 . . B 307 SER HB2 . 18000 1 2285 . 2 2 156 156 SER HB3 H 1 3.73 0.03 . 2 1 . . B 307 SER HB3 . 18000 1 2286 . 2 2 156 156 SER C C 13 173.50 0.20 . 1 1 . . B 307 SER C . 18000 1 2287 . 2 2 156 156 SER CA C 13 55.06 0.20 . 1 1 . . B 307 SER CA . 18000 1 2288 . 2 2 156 156 SER CB C 13 63.00 0.20 . 1 1 . . B 307 SER CB . 18000 1 2289 . 2 2 157 157 ALA H H 1 9.52 0.03 . 1 1 . . B 308 ALA H . 18000 1 2290 . 2 2 157 157 ALA HA H 1 4.42 0.03 . 1 1 . . B 308 ALA HA . 18000 1 2291 . 2 2 157 157 ALA HB1 H 1 1.55 0.03 . 1 1 . . B 308 ALA HB1 . 18000 1 2292 . 2 2 157 157 ALA HB2 H 1 1.55 0.03 . 1 1 . . B 308 ALA HB2 . 18000 1 2293 . 2 2 157 157 ALA HB3 H 1 1.55 0.03 . 1 1 . . B 308 ALA HB3 . 18000 1 2294 . 2 2 157 157 ALA C C 13 177.31 0.20 . 1 1 . . B 308 ALA C . 18000 1 2295 . 2 2 157 157 ALA CA C 13 52.85 0.20 . 1 1 . . B 308 ALA CA . 18000 1 2296 . 2 2 157 157 ALA CB C 13 16.42 0.20 . 1 1 . . B 308 ALA CB . 18000 1 2297 . 2 2 157 157 ALA N N 15 113.10 0.30 . 1 1 . . B 308 ALA N . 18000 1 2298 . 2 2 158 158 SER H H 1 8.49 0.03 . 1 1 . . B 309 SER H . 18000 1 2299 . 2 2 158 158 SER HA H 1 4.46 0.03 . 1 1 . . B 309 SER HA . 18000 1 2300 . 2 2 158 158 SER HB3 H 1 3.93 0.03 . 2 1 . . B 309 SER HB3 . 18000 1 2301 . 2 2 158 158 SER C C 13 172.73 0.20 . 1 1 . . B 309 SER C . 18000 1 2302 . 2 2 158 158 SER CA C 13 58.60 0.20 . 1 1 . . B 309 SER CA . 18000 1 2303 . 2 2 158 158 SER CB C 13 60.94 0.20 . 1 1 . . B 309 SER CB . 18000 1 2304 . 2 2 158 158 SER N N 15 112.75 0.30 . 1 1 . . B 309 SER N . 18000 1 2305 . 2 2 159 159 ASP H H 1 7.55 0.03 . 1 1 . . B 310 ASP H . 18000 1 2306 . 2 2 159 159 ASP HA H 1 4.55 0.03 . 1 1 . . B 310 ASP HA . 18000 1 2307 . 2 2 159 159 ASP HB2 H 1 2.53 0.03 . 2 1 . . B 310 ASP HB2 . 18000 1 2308 . 2 2 159 159 ASP HB3 H 1 2.75 0.03 . 2 1 . . B 310 ASP HB3 . 18000 1 2309 . 2 2 159 159 ASP C C 13 169.94 0.20 . 1 1 . . B 310 ASP C . 18000 1 2310 . 2 2 159 159 ASP CA C 13 53.57 0.20 . 1 1 . . B 310 ASP CA . 18000 1 2311 . 2 2 159 159 ASP CB C 13 40.22 0.20 . 1 1 . . B 310 ASP CB . 18000 1 2312 . 2 2 159 159 ASP N N 15 120.20 0.30 . 1 1 . . B 310 ASP N . 18000 1 2313 . 2 2 160 160 TYR H H 1 7.64 0.03 . 1 1 . . B 311 TYR H . 18000 1 2314 . 2 2 160 160 TYR HA H 1 5.15 0.03 . 1 1 . . B 311 TYR HA . 18000 1 2315 . 2 2 160 160 TYR HB2 H 1 2.73 0.03 . 2 1 . . B 311 TYR HB2 . 18000 1 2316 . 2 2 160 160 TYR HB3 H 1 3.07 0.03 . 2 1 . . B 311 TYR HB3 . 18000 1 2317 . 2 2 160 160 TYR HD2 H 1 7.12 0.03 . 3 1 . . B 311 TYR HD2 . 18000 1 2318 . 2 2 160 160 TYR HE2 H 1 7.18 0.03 . 3 1 . . B 311 TYR HE2 . 18000 1 2319 . 2 2 160 160 TYR C C 13 172.90 0.20 . 1 1 . . B 311 TYR C . 18000 1 2320 . 2 2 160 160 TYR CA C 13 54.74 0.20 . 1 1 . . B 311 TYR CA . 18000 1 2321 . 2 2 160 160 TYR CB C 13 38.49 0.20 . 1 1 . . B 311 TYR CB . 18000 1 2322 . 2 2 160 160 TYR N N 15 118.77 0.30 . 1 1 . . B 311 TYR N . 18000 1 2323 . 2 2 161 161 GLU H H 1 8.96 0.03 . 1 1 . . B 312 GLU H . 18000 1 2324 . 2 2 161 161 GLU HA H 1 4.71 0.03 . 1 1 . . B 312 GLU HA . 18000 1 2325 . 2 2 161 161 GLU HB2 H 1 1.88 0.03 . 2 1 . . B 312 GLU HB2 . 18000 1 2326 . 2 2 161 161 GLU HB3 H 1 1.96 0.03 . 2 1 . . B 312 GLU HB3 . 18000 1 2327 . 2 2 161 161 GLU HG3 H 1 2.22 0.03 . 2 1 . . B 312 GLU HG3 . 18000 1 2328 . 2 2 161 161 GLU C C 13 174.00 0.20 . 1 1 . . B 312 GLU C . 18000 1 2329 . 2 2 161 161 GLU CA C 13 52.50 0.20 . 1 1 . . B 312 GLU CA . 18000 1 2330 . 2 2 161 161 GLU CB C 13 32.15 0.20 . 1 1 . . B 312 GLU CB . 18000 1 2331 . 2 2 161 161 GLU CG C 13 34.30 0.20 . 1 1 . . B 312 GLU CG . 18000 1 2332 . 2 2 161 161 GLU N N 15 117.72 0.30 . 1 1 . . B 312 GLU N . 18000 1 2333 . 2 2 162 162 VAL H H 1 8.50 0.03 . 1 1 . . B 313 VAL H . 18000 1 2334 . 2 2 162 162 VAL HA H 1 3.80 0.03 . 1 1 . . B 313 VAL HA . 18000 1 2335 . 2 2 162 162 VAL HB H 1 2.03 0.03 . 1 1 . . B 313 VAL HB . 18000 1 2336 . 2 2 162 162 VAL HG11 H 1 1.07 0.03 . 2 1 . . B 313 VAL HG11 . 18000 1 2337 . 2 2 162 162 VAL HG12 H 1 1.07 0.03 . 2 1 . . B 313 VAL HG12 . 18000 1 2338 . 2 2 162 162 VAL HG13 H 1 1.07 0.03 . 2 1 . . B 313 VAL HG13 . 18000 1 2339 . 2 2 162 162 VAL HG21 H 1 1.02 0.03 . 2 1 . . B 313 VAL HG21 . 18000 1 2340 . 2 2 162 162 VAL HG22 H 1 1.02 0.03 . 2 1 . . B 313 VAL HG22 . 18000 1 2341 . 2 2 162 162 VAL HG23 H 1 1.02 0.03 . 2 1 . . B 313 VAL HG23 . 18000 1 2342 . 2 2 162 162 VAL C C 13 174.01 0.20 . 1 1 . . B 313 VAL C . 18000 1 2343 . 2 2 162 162 VAL CA C 13 62.16 0.20 . 1 1 . . B 313 VAL CA . 18000 1 2344 . 2 2 162 162 VAL CB C 13 30.64 0.20 . 1 1 . . B 313 VAL CB . 18000 1 2345 . 2 2 162 162 VAL CG1 C 13 19.84 0.20 . 2 1 . . B 313 VAL CG1 . 18000 1 2346 . 2 2 162 162 VAL CG2 C 13 19.30 0.20 . 2 1 . . B 313 VAL CG2 . 18000 1 2347 . 2 2 162 162 VAL N N 15 122.27 0.30 . 1 1 . . B 313 VAL N . 18000 1 2348 . 2 2 163 163 ALA H H 1 8.40 0.03 . 1 1 . . B 314 ALA H . 18000 1 2349 . 2 2 163 163 ALA HA H 1 4.51 0.03 . 1 1 . . B 314 ALA HA . 18000 1 2350 . 2 2 163 163 ALA HB1 H 1 1.29 0.03 . 1 1 . . B 314 ALA HB1 . 18000 1 2351 . 2 2 163 163 ALA HB2 H 1 1.29 0.03 . 1 1 . . B 314 ALA HB2 . 18000 1 2352 . 2 2 163 163 ALA HB3 H 1 1.29 0.03 . 1 1 . . B 314 ALA HB3 . 18000 1 2353 . 2 2 163 163 ALA C C 13 173.35 0.20 . 1 1 . . B 314 ALA C . 18000 1 2354 . 2 2 163 163 ALA CA C 13 48.62 0.20 . 1 1 . . B 314 ALA CA . 18000 1 2355 . 2 2 163 163 ALA CB C 13 16.11 0.20 . 1 1 . . B 314 ALA CB . 18000 1 2356 . 2 2 163 163 ALA N N 15 112.61 0.30 . 1 1 . . B 314 ALA N . 18000 1 2357 . 2 2 164 164 PRO HA H 1 4.87 0.03 . 1 1 . . B 315 PRO HA . 18000 1 2358 . 2 2 164 164 PRO HB2 H 1 2.30 0.03 . 2 1 . . B 315 PRO HB2 . 18000 1 2359 . 2 2 164 164 PRO HB3 H 1 2.48 0.03 . 2 1 . . B 315 PRO HB3 . 18000 1 2360 . 2 2 164 164 PRO HG2 H 1 2.05 0.03 . 2 1 . . B 315 PRO HG2 . 18000 1 2361 . 2 2 164 164 PRO HG3 H 1 2.22 0.03 . 2 1 . . B 315 PRO HG3 . 18000 1 2362 . 2 2 164 164 PRO HD2 H 1 3.44 0.03 . 2 1 . . B 315 PRO HD2 . 18000 1 2363 . 2 2 164 164 PRO HD3 H 1 3.91 0.03 . 2 1 . . B 315 PRO HD3 . 18000 1 2364 . 2 2 164 164 PRO C C 13 173.47 0.20 . 1 1 . . B 315 PRO C . 18000 1 2365 . 2 2 164 164 PRO CA C 13 60.20 0.20 . 1 1 . . B 315 PRO CA . 18000 1 2366 . 2 2 164 164 PRO CB C 13 29.28 0.20 . 1 1 . . B 315 PRO CB . 18000 1 2367 . 2 2 164 164 PRO CG C 13 26.08 0.20 . 1 1 . . B 315 PRO CG . 18000 1 2368 . 2 2 164 164 PRO CD C 13 48.69 0.20 . 1 1 . . B 315 PRO CD . 18000 1 2369 . 2 2 165 165 PRO HA H 1 4.25 0.03 . 1 1 . . B 316 PRO HA . 18000 1 2370 . 2 2 165 165 PRO HB2 H 1 1.94 0.03 . 2 1 . . B 316 PRO HB2 . 18000 1 2371 . 2 2 165 165 PRO HB3 H 1 2.40 0.03 . 2 1 . . B 316 PRO HB3 . 18000 1 2372 . 2 2 165 165 PRO HG2 H 1 2.07 0.03 . 2 1 . . B 316 PRO HG2 . 18000 1 2373 . 2 2 165 165 PRO HG3 H 1 2.21 0.03 . 2 1 . . B 316 PRO HG3 . 18000 1 2374 . 2 2 165 165 PRO HD2 H 1 3.83 0.03 . 2 1 . . B 316 PRO HD2 . 18000 1 2375 . 2 2 165 165 PRO HD3 H 1 3.94 0.03 . 2 1 . . B 316 PRO HD3 . 18000 1 2376 . 2 2 165 165 PRO C C 13 177.39 0.20 . 1 1 . . B 316 PRO C . 18000 1 2377 . 2 2 165 165 PRO CA C 13 64.11 0.20 . 1 1 . . B 316 PRO CA . 18000 1 2378 . 2 2 165 165 PRO CB C 13 30.22 0.20 . 1 1 . . B 316 PRO CB . 18000 1 2379 . 2 2 165 165 PRO CG C 13 26.04 0.20 . 1 1 . . B 316 PRO CG . 18000 1 2380 . 2 2 165 165 PRO CD C 13 48.68 0.20 . 1 1 . . B 316 PRO CD . 18000 1 2381 . 2 2 166 166 GLU H H 1 9.42 0.03 . 1 1 . . B 317 GLU H . 18000 1 2382 . 2 2 166 166 GLU HA H 1 4.05 0.03 . 1 1 . . B 317 GLU HA . 18000 1 2383 . 2 2 166 166 GLU HB3 H 1 2.04 0.03 . 2 1 . . B 317 GLU HB3 . 18000 1 2384 . 2 2 166 166 GLU HG3 H 1 2.33 0.03 . 2 1 . . B 317 GLU HG3 . 18000 1 2385 . 2 2 166 166 GLU C C 13 176.10 0.20 . 1 1 . . B 317 GLU C . 18000 1 2386 . 2 2 166 166 GLU CA C 13 57.27 0.20 . 1 1 . . B 317 GLU CA . 18000 1 2387 . 2 2 166 166 GLU CB C 13 26.69 0.20 . 1 1 . . B 317 GLU CB . 18000 1 2388 . 2 2 166 166 GLU CG C 13 34.23 0.20 . 1 1 . . B 317 GLU CG . 18000 1 2389 . 2 2 166 166 GLU N N 15 115.72 0.30 . 1 1 . . B 317 GLU N . 18000 1 2390 . 2 2 167 167 TYR H H 1 8.05 0.03 . 1 1 . . B 318 TYR H . 18000 1 2391 . 2 2 167 167 TYR HA H 1 3.89 0.03 . 1 1 . . B 318 TYR HA . 18000 1 2392 . 2 2 167 167 TYR HB3 H 1 3.04 0.03 . 2 1 . . B 318 TYR HB3 . 18000 1 2393 . 2 2 167 167 TYR HD1 H 1 6.60 0.03 . 3 1 . . B 318 TYR HD1 . 18000 1 2394 . 2 2 167 167 TYR HE1 H 1 5.86 0.03 . 3 1 . . B 318 TYR HE1 . 18000 1 2395 . 2 2 167 167 TYR C C 13 175.57 0.20 . 1 1 . . B 318 TYR C . 18000 1 2396 . 2 2 167 167 TYR CA C 13 59.60 0.20 . 1 1 . . B 318 TYR CA . 18000 1 2397 . 2 2 167 167 TYR CB C 13 37.51 0.20 . 1 1 . . B 318 TYR CB . 18000 1 2398 . 2 2 167 167 TYR N N 15 121.69 0.30 . 1 1 . . B 318 TYR N . 18000 1 2399 . 2 2 168 168 HIS H H 1 7.63 0.03 . 1 1 . . B 319 HIS H . 18000 1 2400 . 2 2 168 168 HIS HA H 1 4.20 0.03 . 1 1 . . B 319 HIS HA . 18000 1 2401 . 2 2 168 168 HIS HB3 H 1 3.28 0.03 . 2 1 . . B 319 HIS HB3 . 18000 1 2402 . 2 2 168 168 HIS HD2 H 1 7.25 0.03 . 1 1 . . B 319 HIS HD2 . 18000 1 2403 . 2 2 168 168 HIS HE1 H 1 7.75 0.03 . 1 1 . . B 319 HIS HE1 . 18000 1 2404 . 2 2 168 168 HIS C C 13 175.63 0.20 . 1 1 . . B 319 HIS C . 18000 1 2405 . 2 2 168 168 HIS CA C 13 57.76 0.20 . 1 1 . . B 319 HIS CA . 18000 1 2406 . 2 2 168 168 HIS CB C 13 29.28 0.20 . 1 1 . . B 319 HIS CB . 18000 1 2407 . 2 2 168 168 HIS CD2 C 13 116.55 0.20 . 1 1 . . B 319 HIS CD2 . 18000 1 2408 . 2 2 168 168 HIS CE1 C 13 136.50 0.20 . 1 1 . . B 319 HIS CE1 . 18000 1 2409 . 2 2 168 168 HIS N N 15 115.70 0.30 . 1 1 . . B 319 HIS N . 18000 1 2410 . 2 2 169 169 ARG H H 1 7.48 0.03 . 1 1 . . B 320 ARG H . 18000 1 2411 . 2 2 169 169 ARG HA H 1 4.17 0.03 . 1 1 . . B 320 ARG HA . 18000 1 2412 . 2 2 169 169 ARG HB2 H 1 1.81 0.03 . 2 1 . . B 320 ARG HB2 . 18000 1 2413 . 2 2 169 169 ARG HB3 H 1 1.90 0.03 . 2 1 . . B 320 ARG HB3 . 18000 1 2414 . 2 2 169 169 ARG HG3 H 1 1.65 0.03 . 2 1 . . B 320 ARG HG3 . 18000 1 2415 . 2 2 169 169 ARG HD3 H 1 3.19 0.03 . 2 1 . . B 320 ARG HD3 . 18000 1 2416 . 2 2 169 169 ARG C C 13 175.21 0.20 . 1 1 . . B 320 ARG C . 18000 1 2417 . 2 2 169 169 ARG CA C 13 55.86 0.20 . 1 1 . . B 320 ARG CA . 18000 1 2418 . 2 2 169 169 ARG CB C 13 28.44 0.20 . 1 1 . . B 320 ARG CB . 18000 1 2419 . 2 2 169 169 ARG CG C 13 25.71 0.20 . 1 1 . . B 320 ARG CG . 18000 1 2420 . 2 2 169 169 ARG CD C 13 41.54 0.20 . 1 1 . . B 320 ARG CD . 18000 1 2421 . 2 2 169 169 ARG N N 15 115.65 0.30 . 1 1 . . B 320 ARG N . 18000 1 2422 . 2 2 170 170 LYS H H 1 7.33 0.03 . 1 1 . . B 321 LYS H . 18000 1 2423 . 2 2 170 170 LYS HA H 1 4.18 0.03 . 1 1 . . B 321 LYS HA . 18000 1 2424 . 2 2 170 170 LYS HB2 H 1 1.52 0.03 . 2 1 . . B 321 LYS HB2 . 18000 1 2425 . 2 2 170 170 LYS HB3 H 1 1.62 0.03 . 2 1 . . B 321 LYS HB3 . 18000 1 2426 . 2 2 170 170 LYS HG2 H 1 1.34 0.03 . 2 1 . . B 321 LYS HG2 . 18000 1 2427 . 2 2 170 170 LYS HG3 H 1 1.57 0.03 . 2 1 . . B 321 LYS HG3 . 18000 1 2428 . 2 2 170 170 LYS HD3 H 1 1.43 0.03 . 2 1 . . B 321 LYS HD3 . 18000 1 2429 . 2 2 170 170 LYS HE2 H 1 2.75 0.03 . 2 1 . . B 321 LYS HE2 . 18000 1 2430 . 2 2 170 170 LYS HE3 H 1 2.81 0.03 . 2 1 . . B 321 LYS HE3 . 18000 1 2431 . 2 2 170 170 LYS C C 13 174.39 0.20 . 1 1 . . B 321 LYS C . 18000 1 2432 . 2 2 170 170 LYS CA C 13 54.97 0.20 . 1 1 . . B 321 LYS CA . 18000 1 2433 . 2 2 170 170 LYS CB C 13 31.27 0.20 . 1 1 . . B 321 LYS CB . 18000 1 2434 . 2 2 170 170 LYS CG C 13 23.22 0.20 . 1 1 . . B 321 LYS CG . 18000 1 2435 . 2 2 170 170 LYS CD C 13 27.79 0.20 . 1 1 . . B 321 LYS CD . 18000 1 2436 . 2 2 170 170 LYS CE C 13 39.99 0.20 . 1 1 . . B 321 LYS CE . 18000 1 2437 . 2 2 170 170 LYS N N 15 116.98 0.30 . 1 1 . . B 321 LYS N . 18000 1 2438 . 2 2 171 171 ALA H H 1 7.51 0.03 . 1 1 . . B 322 ALA H . 18000 1 2439 . 2 2 171 171 ALA HA H 1 4.29 0.03 . 1 1 . . B 322 ALA HA . 18000 1 2440 . 2 2 171 171 ALA HB1 H 1 1.26 0.03 . 1 1 . . B 322 ALA HB1 . 18000 1 2441 . 2 2 171 171 ALA HB2 H 1 1.26 0.03 . 1 1 . . B 322 ALA HB2 . 18000 1 2442 . 2 2 171 171 ALA HB3 H 1 1.26 0.03 . 1 1 . . B 322 ALA HB3 . 18000 1 2443 . 2 2 171 171 ALA C C 13 174.21 0.20 . 1 1 . . B 322 ALA C . 18000 1 2444 . 2 2 171 171 ALA CA C 13 50.19 0.20 . 1 1 . . B 322 ALA CA . 18000 1 2445 . 2 2 171 171 ALA CB C 13 17.85 0.20 . 1 1 . . B 322 ALA CB . 18000 1 2446 . 2 2 171 171 ALA N N 15 123.17 0.30 . 1 1 . . B 322 ALA N . 18000 1 2447 . 2 2 172 172 VAL H H 1 7.30 0.03 . 1 1 . . B 323 VAL H . 18000 1 2448 . 2 2 172 172 VAL HA H 1 4.01 0.03 . 1 1 . . B 323 VAL HA . 18000 1 2449 . 2 2 172 172 VAL HB H 1 2.12 0.03 . 1 1 . . B 323 VAL HB . 18000 1 2450 . 2 2 172 172 VAL HG11 H 1 0.91 0.03 . 2 1 . . B 323 VAL HG11 . 18000 1 2451 . 2 2 172 172 VAL HG12 H 1 0.91 0.03 . 2 1 . . B 323 VAL HG12 . 18000 1 2452 . 2 2 172 172 VAL HG13 H 1 0.91 0.03 . 2 1 . . B 323 VAL HG13 . 18000 1 2453 . 2 2 172 172 VAL HG21 H 1 0.89 0.03 . 2 1 . . B 323 VAL HG21 . 18000 1 2454 . 2 2 172 172 VAL HG22 H 1 0.89 0.03 . 2 1 . . B 323 VAL HG22 . 18000 1 2455 . 2 2 172 172 VAL HG23 H 1 0.89 0.03 . 2 1 . . B 323 VAL HG23 . 18000 1 2456 . 2 2 172 172 VAL C C 13 169.20 0.20 . 1 1 . . B 323 VAL C . 18000 1 2457 . 2 2 172 172 VAL CA C 13 61.86 0.20 . 1 1 . . B 323 VAL CA . 18000 1 2458 . 2 2 172 172 VAL CB C 13 31.27 0.20 . 1 1 . . B 323 VAL CB . 18000 1 2459 . 2 2 172 172 VAL CG1 C 13 19.97 0.20 . 2 1 . . B 323 VAL CG1 . 18000 1 2460 . 2 2 172 172 VAL CG2 C 13 18.28 0.20 . 2 1 . . B 323 VAL CG2 . 18000 1 2461 . 2 2 172 172 VAL N N 15 121.96 0.30 . 1 1 . . B 323 VAL N . 18000 1 stop_ save_