data_11010 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11010 _Entry.Title ; Rac1/PRK1 Complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-10-25 _Entry.Accession_date 2007-10-25 _Entry.Last_release_date 2008-06-27 _Entry.Original_release_date 2008-06-27 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.100 _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 Rakhee Modha . . . 11010 2 Louise Campbell . J. . 11010 3 Daniel Nietlispach . . . 11010 4 Heeran Buhecha . R. . 11010 5 Darerca Owen . . . 11010 6 Helen Mott . R. . 11010 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID effector . 11010 'G protein' . 11010 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 11010 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 970 11010 '15N chemical shifts' 248 11010 '1H chemical shifts' 1666 11010 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 . . 2008-06-27 2007-10-25 original author . 11010 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2RMK 'BMRB Entry Tracking System' 11010 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 11010 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 18006505 _Citation.Full_citation . _Citation.Title 'The Rac1 polybasic region is required for interaction with its effector PRK1' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 283 _Citation.Journal_issue 3 _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 1492 _Citation.Page_last 1500 _Citation.Year 2008 _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 Rakhee Modha . . . 11010 1 2 Louise Campbell . J. . 11010 1 3 Daniel Nietlispach . . . 11010 1 4 Heeran Buhecha . R. . 11010 1 5 Darerca Owen . . . 11010 1 6 Helen Mott . R. . 11010 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'G protein' 11010 1 Rac1 11010 1 signalling 11010 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11010 _Assembly.ID 1 _Assembly.Name 'Rac1/HR1b complex' _Assembly.BMRB_code . _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _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 Rac1 1 $Rac1 A . yes native no no . . . 11010 1 2 'PRK1 HR1b' 2 $PRK1_HR1b B . yes native no no . . . 11010 1 3 'PHOSPHOMETHYLPHOSPHONIC ACID GUANYLATE ESTER' 3 $GCP C . yes native no no . . . 11010 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 1mh1 . . 'X-ray crystallography' . 'Rac1.GMPPNP truncated' . 11010 1 yes PDB 1urf . . NMR . 'PRK1 HR1b domain' . 11010 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Rac1 _Entity.Sf_category entity _Entity.Sf_framecode Rac1 _Entity.Entry_ID 11010 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Rac1 _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 ; MQAIKCVVVGDGAVGKTCLL ISYTTNAFPGEYIPTVFDNY SANVMVDGKPVNLGLWDTAG LEDYDRLRPLSYPQTDVFLI CFSLVSPASFENVRAKWYPE VRHHCPNTPIILVGTKLDLR DDKDTIEKLKEKKLTPITYP QGLAMAKEIGAVKYLECSAL TQRGLKTVFDEAIRAVLCPP PVKKRKRKCLLL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 192 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 21477.398 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 yes SP P63000 . Rac1_human . . . . . . . . . . . . . . 11010 1 2 no PDB 1E96 . "Structure Of The RacP67PHOX COMPLEX" . . . . . 99.48 192 100.00 100.00 1.96e-136 . . . . 11010 1 3 no PDB 1FOE . "Crystal Structure Of Rac1 In Complex With The Guanine Nucleotide Exchange Region Of Tiam1" . . . . . 92.19 177 99.44 99.44 3.98e-125 . . . . 11010 1 4 no PDB 1G4U . "Crystal Structure Of The Salmonella Tyrosine Phosphatase And Gtpase Activating Protein Sptp Bound To Rac1" . . . . . 95.83 184 98.91 98.91 1.34e-129 . . . . 11010 1 5 no PDB 1HE1 . "Crystal Structure Of The Complex Between The Gap Domain Of The Pseudomonas Aeruginosa Exos Toxin And Human Rac" . . . . . 91.15 176 99.43 99.43 1.94e-123 . . . . 11010 1 6 no PDB 1HH4 . "Rac1-Rhogdi Complex Involved In Nadph Oxidase Activation" . . . . . 99.48 192 98.95 98.95 2.03e-134 . . . . 11010 1 7 no PDB 1I4D . "Crystal Structure Analysis Of Rac1-Gdp Complexed With Arfaptin (P21)" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 8 no PDB 1I4L . "Crystal Structure Analysis Of Rac1-Gdp In Complex With Arfaptin (P41)" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 9 no PDB 1I4T . "Crystal Structure Analysis Of Rac1-Gmppnp In Complex With Arfaptin" . . . . . 100.00 192 100.00 100.00 1.75e-137 . . . . 11010 1 10 no PDB 1MH1 . "Small G-Protein" . . . . . 95.31 186 98.91 98.91 1.80e-128 . . . . 11010 1 11 no PDB 2FJU . "Activated Rac1 Bound To Its Effector Phospholipase C Beta 2" . . . . . 92.19 178 99.44 99.44 2.63e-125 . . . . 11010 1 12 no PDB 2H7V . "Co-crystal Structure Of Ypka-rac1" . . . . . 95.83 188 98.91 98.91 1.46e-129 . . . . 11010 1 13 no PDB 2NZ8 . "N-Terminal Dhph Cassette Of Trio In Complex With Nucleotide- Free Rac1" . . . . . 92.19 177 99.44 99.44 3.98e-125 . . . . 11010 1 14 no PDB 2P2L . "Rac1-gdp-zinc Complex" . . . . . 95.83 188 98.91 98.91 1.46e-129 . . . . 11010 1 15 no PDB 2RMK . "Rac1PRK1 COMPLEX" . . . . . 100.00 192 100.00 100.00 1.75e-137 . . . . 11010 1 16 no PDB 2VRW . "Critical Structural Role For The Ph And C1 Domains Of The Vav1 Exchange Factor" . . . . . 95.83 184 99.46 99.46 1.21e-130 . . . . 11010 1 17 no PDB 2WKP . "Structure Of A Photoactivatable Rac1 Containing Lov2 Wildtype" . . . . . 93.23 332 97.77 98.88 2.49e-124 . . . . 11010 1 18 no PDB 2WKQ . "Structure Of A Photoactivatable Rac1 Containing The Lov2 C450a Mutant" . . . . . 93.23 332 97.77 98.88 1.49e-124 . . . . 11010 1 19 no PDB 2WKR . "Structure Of A Photoactivatable Rac1 Containing The Lov2 C450m Mutant" . . . . . 93.23 332 97.77 98.88 1.63e-124 . . . . 11010 1 20 no PDB 2YIN . "Structure Of The Complex Between Dock2 And Rac1" . . . . . 92.19 196 99.44 99.44 1.11e-125 . . . . 11010 1 21 no PDB 3B13 . "Crystal Structure Of The Dhr-2 Domain Of Dock2 In Complex With Rac1 (T17n Mutant)" . . . . . 92.19 184 98.87 98.87 9.25e-125 . . . . 11010 1 22 no PDB 3BJI . "Structural Basis Of Promiscuous Guanine Nucleotide Exchange By The T-Cell Essential Vav1" . . . . . 92.19 177 99.44 99.44 3.98e-125 . . . . 11010 1 23 no PDB 3RYT . "The Plexin A1 Intracellular Region In Complex With Rac1" . . . . . 92.19 180 100.00 100.00 9.76e-126 . . . . 11010 1 24 no PDB 3SBD . "Crystal Structure Of Rac1 P29s Mutant" . . . . . 91.67 187 98.86 98.86 2.58e-123 . . . . 11010 1 25 no PDB 3SBE . "Crystal Structure Of Rac1 P29s Mutant" . . . . . 91.67 187 98.86 98.86 2.58e-123 . . . . 11010 1 26 no PDB 3SU8 . "Crystal Structure Of A Truncated Intracellular Domain Of Plexin-B1 In Complex With Rac1" . . . . . 92.19 184 99.44 99.44 2.26e-125 . . . . 11010 1 27 no PDB 3SUA . "Crystal Structure Of The Intracellular Domain Of Plexin-B1 In Complex With Rac1" . . . . . 92.19 184 99.44 99.44 2.26e-125 . . . . 11010 1 28 no PDB 3TH5 . "Crystal Structure Of Wild-Type Rac1" . . . . . 91.67 204 99.43 99.43 1.46e-124 . . . . 11010 1 29 no PDB 4GZL . "Crystal Structure Of Rac1 Q61l Mutant" . . . . . 91.67 204 100.00 100.00 1.89e-125 . . . . 11010 1 30 no PDB 4GZM . "Crystal Structure Of Rac1 F28l Mutant" . . . . . 91.67 204 98.86 98.86 1.24e-123 . . . . 11010 1 31 no PDB 4YON . "P-rex1:rac1 Complex" . . . . . 92.19 179 98.87 98.87 7.55e-124 . . . . 11010 1 32 no DBJ BAB25667 . "unnamed protein product [Mus musculus]" . . . . . 100.00 192 98.96 99.48 3.78e-136 . . . . 11010 1 33 no DBJ BAB26027 . "unnamed protein product [Mus musculus]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 34 no DBJ BAB69451 . "unnamed protein product [Mus musculus]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 35 no DBJ BAC16311 . "Raichu-1011X [synthetic construct]" . . . . . 91.67 763 99.43 99.43 9.59e-119 . . . . 11010 1 36 no DBJ BAC28767 . "unnamed protein product [Mus musculus]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 37 no EMBL CAA39801 . "rac2 [Canis lupus familiaris]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 38 no EMBL CAA40545 . "ras-related C3 botulinium toxin substrate [Mus musculus]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 39 no EMBL CAB53579 . "Rac1 protein [Homo sapiens]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 40 no EMBL CAJ83626 . "ras-related C3 botulinum toxin substrate 1 (rho family, small GTP binding protein Rac1) [Xenopus (Silurana) tropicalis]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 41 no EMBL CDQ72552 . "unnamed protein product [Oncorhynchus mykiss]" . . . . . 100.00 192 98.44 98.44 1.20e-134 . . . . 11010 1 42 no GB AAA36537 . "ras-related C3 botulinum toxin substrate [Homo sapiens]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 43 no GB AAA36544 . "ras-like protein [Homo sapiens]" . . . . . 99.48 191 99.48 99.48 3.94e-136 . . . . 11010 1 44 no GB AAB22206 . "rac1 p21=small GTP-binding protein [human, HL60, Peptide, 192 aa]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 45 no GB AAC18960 . "GTPase cRac1A [Gallus gallus]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 46 no GB AAD50299 . "rac GTPase [Xenopus laevis]" . . . . . 100.00 192 98.96 99.48 2.34e-136 . . . . 11010 1 47 no REF NP_001003274 . "ras-related C3 botulinum toxin substrate 1 precursor [Canis lupus familiaris]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 48 no REF NP_001004840 . "ras-related C3 botulinum toxin substrate 1 [Xenopus (Silurana) tropicalis]" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 49 no REF NP_001034907 . "uncharacterized protein LOC562838 [Danio rerio]" . . . . . 100.00 192 97.92 97.92 7.36e-134 . . . . 11010 1 50 no REF NP_001084224 . "ras-related C3 botulinum toxin substrate 3 (rho family, small GTP binding protein Rac3) [Xenopus laevis]" . . . . . 100.00 192 98.96 99.48 2.34e-136 . . . . 11010 1 51 no REF NP_001089332 . "ras-related C3 botulinum toxin substrate 1 (rho family, small GTP binding protein Rac1) [Xenopus laevis]" . . . . . 100.00 192 98.44 98.96 2.62e-135 . . . . 11010 1 52 no SP P62998 . "RecName: Full=Ras-related C3 botulinum toxin substrate 1; AltName: Full=p21-Rac1; Flags: Precursor" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 53 no SP P62999 . "RecName: Full=Ras-related C3 botulinum toxin substrate 1; AltName: Full=Rac2; AltName: Full=p21-Rac1; Flags: Precursor" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 54 no SP P63000 . "RecName: Full=Ras-related C3 botulinum toxin substrate 1; AltName: Full=Cell migration-inducing gene 5 protein; AltName: Full=R" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 55 no SP P63001 . "RecName: Full=Ras-related C3 botulinum toxin substrate 1; AltName: Full=p21-Rac1; Flags: Precursor" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 56 no SP Q6RUV5 . "RecName: Full=Ras-related C3 botulinum toxin substrate 1; AltName: Full=p21-Rac1; Flags: Precursor" . . . . . 100.00 192 99.48 99.48 9.85e-137 . . . . 11010 1 57 no TPG DAA15019 . "TPA: ras-related C3 botulinum toxin substrate 1 precursor [Bos taurus]" . . . . . 94.27 181 99.45 99.45 1.02e-128 . . . . 11010 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Ras-like protein' 11010 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 11010 1 2 . GLN . 11010 1 3 . ALA . 11010 1 4 . ILE . 11010 1 5 . LYS . 11010 1 6 . CYS . 11010 1 7 . VAL . 11010 1 8 . VAL . 11010 1 9 . VAL . 11010 1 10 . GLY . 11010 1 11 . ASP . 11010 1 12 . GLY . 11010 1 13 . ALA . 11010 1 14 . VAL . 11010 1 15 . GLY . 11010 1 16 . LYS . 11010 1 17 . THR . 11010 1 18 . CYS . 11010 1 19 . LEU . 11010 1 20 . LEU . 11010 1 21 . ILE . 11010 1 22 . SER . 11010 1 23 . TYR . 11010 1 24 . THR . 11010 1 25 . THR . 11010 1 26 . ASN . 11010 1 27 . ALA . 11010 1 28 . PHE . 11010 1 29 . PRO . 11010 1 30 . GLY . 11010 1 31 . GLU . 11010 1 32 . TYR . 11010 1 33 . ILE . 11010 1 34 . PRO . 11010 1 35 . THR . 11010 1 36 . VAL . 11010 1 37 . PHE . 11010 1 38 . ASP . 11010 1 39 . ASN . 11010 1 40 . TYR . 11010 1 41 . SER . 11010 1 42 . ALA . 11010 1 43 . ASN . 11010 1 44 . VAL . 11010 1 45 . MET . 11010 1 46 . VAL . 11010 1 47 . ASP . 11010 1 48 . GLY . 11010 1 49 . LYS . 11010 1 50 . PRO . 11010 1 51 . VAL . 11010 1 52 . ASN . 11010 1 53 . LEU . 11010 1 54 . GLY . 11010 1 55 . LEU . 11010 1 56 . TRP . 11010 1 57 . ASP . 11010 1 58 . THR . 11010 1 59 . ALA . 11010 1 60 . GLY . 11010 1 61 . LEU . 11010 1 62 . GLU . 11010 1 63 . ASP . 11010 1 64 . TYR . 11010 1 65 . ASP . 11010 1 66 . ARG . 11010 1 67 . LEU . 11010 1 68 . ARG . 11010 1 69 . PRO . 11010 1 70 . LEU . 11010 1 71 . SER . 11010 1 72 . TYR . 11010 1 73 . PRO . 11010 1 74 . GLN . 11010 1 75 . THR . 11010 1 76 . ASP . 11010 1 77 . VAL . 11010 1 78 . PHE . 11010 1 79 . LEU . 11010 1 80 . ILE . 11010 1 81 . CYS . 11010 1 82 . PHE . 11010 1 83 . SER . 11010 1 84 . LEU . 11010 1 85 . VAL . 11010 1 86 . SER . 11010 1 87 . PRO . 11010 1 88 . ALA . 11010 1 89 . SER . 11010 1 90 . PHE . 11010 1 91 . GLU . 11010 1 92 . ASN . 11010 1 93 . VAL . 11010 1 94 . ARG . 11010 1 95 . ALA . 11010 1 96 . LYS . 11010 1 97 . TRP . 11010 1 98 . TYR . 11010 1 99 . PRO . 11010 1 100 . GLU . 11010 1 101 . VAL . 11010 1 102 . ARG . 11010 1 103 . HIS . 11010 1 104 . HIS . 11010 1 105 . CYS . 11010 1 106 . PRO . 11010 1 107 . ASN . 11010 1 108 . THR . 11010 1 109 . PRO . 11010 1 110 . ILE . 11010 1 111 . ILE . 11010 1 112 . LEU . 11010 1 113 . VAL . 11010 1 114 . GLY . 11010 1 115 . THR . 11010 1 116 . LYS . 11010 1 117 . LEU . 11010 1 118 . ASP . 11010 1 119 . LEU . 11010 1 120 . ARG . 11010 1 121 . ASP . 11010 1 122 . ASP . 11010 1 123 . LYS . 11010 1 124 . ASP . 11010 1 125 . THR . 11010 1 126 . ILE . 11010 1 127 . GLU . 11010 1 128 . LYS . 11010 1 129 . LEU . 11010 1 130 . LYS . 11010 1 131 . GLU . 11010 1 132 . LYS . 11010 1 133 . LYS . 11010 1 134 . LEU . 11010 1 135 . THR . 11010 1 136 . PRO . 11010 1 137 . ILE . 11010 1 138 . THR . 11010 1 139 . TYR . 11010 1 140 . PRO . 11010 1 141 . GLN . 11010 1 142 . GLY . 11010 1 143 . LEU . 11010 1 144 . ALA . 11010 1 145 . MET . 11010 1 146 . ALA . 11010 1 147 . LYS . 11010 1 148 . GLU . 11010 1 149 . ILE . 11010 1 150 . GLY . 11010 1 151 . ALA . 11010 1 152 . VAL . 11010 1 153 . LYS . 11010 1 154 . TYR . 11010 1 155 . LEU . 11010 1 156 . GLU . 11010 1 157 . CYS . 11010 1 158 . SER . 11010 1 159 . ALA . 11010 1 160 . LEU . 11010 1 161 . THR . 11010 1 162 . GLN . 11010 1 163 . ARG . 11010 1 164 . GLY . 11010 1 165 . LEU . 11010 1 166 . LYS . 11010 1 167 . THR . 11010 1 168 . VAL . 11010 1 169 . PHE . 11010 1 170 . ASP . 11010 1 171 . GLU . 11010 1 172 . ALA . 11010 1 173 . ILE . 11010 1 174 . ARG . 11010 1 175 . ALA . 11010 1 176 . VAL . 11010 1 177 . LEU . 11010 1 178 . CYS . 11010 1 179 . PRO . 11010 1 180 . PRO . 11010 1 181 . PRO . 11010 1 182 . VAL . 11010 1 183 . LYS . 11010 1 184 . LYS . 11010 1 185 . ARG . 11010 1 186 . LYS . 11010 1 187 . ARG . 11010 1 188 . LYS . 11010 1 189 . CYS . 11010 1 190 . LEU . 11010 1 191 . LEU . 11010 1 192 . LEU . 11010 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 11010 1 . GLN 2 2 11010 1 . ALA 3 3 11010 1 . ILE 4 4 11010 1 . LYS 5 5 11010 1 . CYS 6 6 11010 1 . VAL 7 7 11010 1 . VAL 8 8 11010 1 . VAL 9 9 11010 1 . GLY 10 10 11010 1 . ASP 11 11 11010 1 . GLY 12 12 11010 1 . ALA 13 13 11010 1 . VAL 14 14 11010 1 . GLY 15 15 11010 1 . LYS 16 16 11010 1 . THR 17 17 11010 1 . CYS 18 18 11010 1 . LEU 19 19 11010 1 . LEU 20 20 11010 1 . ILE 21 21 11010 1 . SER 22 22 11010 1 . TYR 23 23 11010 1 . THR 24 24 11010 1 . THR 25 25 11010 1 . ASN 26 26 11010 1 . ALA 27 27 11010 1 . PHE 28 28 11010 1 . PRO 29 29 11010 1 . GLY 30 30 11010 1 . GLU 31 31 11010 1 . TYR 32 32 11010 1 . ILE 33 33 11010 1 . PRO 34 34 11010 1 . THR 35 35 11010 1 . VAL 36 36 11010 1 . PHE 37 37 11010 1 . ASP 38 38 11010 1 . ASN 39 39 11010 1 . TYR 40 40 11010 1 . SER 41 41 11010 1 . ALA 42 42 11010 1 . ASN 43 43 11010 1 . VAL 44 44 11010 1 . MET 45 45 11010 1 . VAL 46 46 11010 1 . ASP 47 47 11010 1 . GLY 48 48 11010 1 . LYS 49 49 11010 1 . PRO 50 50 11010 1 . VAL 51 51 11010 1 . ASN 52 52 11010 1 . LEU 53 53 11010 1 . GLY 54 54 11010 1 . LEU 55 55 11010 1 . TRP 56 56 11010 1 . ASP 57 57 11010 1 . THR 58 58 11010 1 . ALA 59 59 11010 1 . GLY 60 60 11010 1 . LEU 61 61 11010 1 . GLU 62 62 11010 1 . ASP 63 63 11010 1 . TYR 64 64 11010 1 . ASP 65 65 11010 1 . ARG 66 66 11010 1 . LEU 67 67 11010 1 . ARG 68 68 11010 1 . PRO 69 69 11010 1 . LEU 70 70 11010 1 . SER 71 71 11010 1 . TYR 72 72 11010 1 . PRO 73 73 11010 1 . GLN 74 74 11010 1 . THR 75 75 11010 1 . ASP 76 76 11010 1 . VAL 77 77 11010 1 . PHE 78 78 11010 1 . LEU 79 79 11010 1 . ILE 80 80 11010 1 . CYS 81 81 11010 1 . PHE 82 82 11010 1 . SER 83 83 11010 1 . LEU 84 84 11010 1 . VAL 85 85 11010 1 . SER 86 86 11010 1 . PRO 87 87 11010 1 . ALA 88 88 11010 1 . SER 89 89 11010 1 . PHE 90 90 11010 1 . GLU 91 91 11010 1 . ASN 92 92 11010 1 . VAL 93 93 11010 1 . ARG 94 94 11010 1 . ALA 95 95 11010 1 . LYS 96 96 11010 1 . TRP 97 97 11010 1 . TYR 98 98 11010 1 . PRO 99 99 11010 1 . GLU 100 100 11010 1 . VAL 101 101 11010 1 . ARG 102 102 11010 1 . HIS 103 103 11010 1 . HIS 104 104 11010 1 . CYS 105 105 11010 1 . PRO 106 106 11010 1 . ASN 107 107 11010 1 . THR 108 108 11010 1 . PRO 109 109 11010 1 . ILE 110 110 11010 1 . ILE 111 111 11010 1 . LEU 112 112 11010 1 . VAL 113 113 11010 1 . GLY 114 114 11010 1 . THR 115 115 11010 1 . LYS 116 116 11010 1 . LEU 117 117 11010 1 . ASP 118 118 11010 1 . LEU 119 119 11010 1 . ARG 120 120 11010 1 . ASP 121 121 11010 1 . ASP 122 122 11010 1 . LYS 123 123 11010 1 . ASP 124 124 11010 1 . THR 125 125 11010 1 . ILE 126 126 11010 1 . GLU 127 127 11010 1 . LYS 128 128 11010 1 . LEU 129 129 11010 1 . LYS 130 130 11010 1 . GLU 131 131 11010 1 . LYS 132 132 11010 1 . LYS 133 133 11010 1 . LEU 134 134 11010 1 . THR 135 135 11010 1 . PRO 136 136 11010 1 . ILE 137 137 11010 1 . THR 138 138 11010 1 . TYR 139 139 11010 1 . PRO 140 140 11010 1 . GLN 141 141 11010 1 . GLY 142 142 11010 1 . LEU 143 143 11010 1 . ALA 144 144 11010 1 . MET 145 145 11010 1 . ALA 146 146 11010 1 . LYS 147 147 11010 1 . GLU 148 148 11010 1 . ILE 149 149 11010 1 . GLY 150 150 11010 1 . ALA 151 151 11010 1 . VAL 152 152 11010 1 . LYS 153 153 11010 1 . TYR 154 154 11010 1 . LEU 155 155 11010 1 . GLU 156 156 11010 1 . CYS 157 157 11010 1 . SER 158 158 11010 1 . ALA 159 159 11010 1 . LEU 160 160 11010 1 . THR 161 161 11010 1 . GLN 162 162 11010 1 . ARG 163 163 11010 1 . GLY 164 164 11010 1 . LEU 165 165 11010 1 . LYS 166 166 11010 1 . THR 167 167 11010 1 . VAL 168 168 11010 1 . PHE 169 169 11010 1 . ASP 170 170 11010 1 . GLU 171 171 11010 1 . ALA 172 172 11010 1 . ILE 173 173 11010 1 . ARG 174 174 11010 1 . ALA 175 175 11010 1 . VAL 176 176 11010 1 . LEU 177 177 11010 1 . CYS 178 178 11010 1 . PRO 179 179 11010 1 . PRO 180 180 11010 1 . PRO 181 181 11010 1 . VAL 182 182 11010 1 . LYS 183 183 11010 1 . LYS 184 184 11010 1 . ARG 185 185 11010 1 . LYS 186 186 11010 1 . ARG 187 187 11010 1 . LYS 188 188 11010 1 . CYS 189 189 11010 1 . LEU 190 190 11010 1 . LEU 191 191 11010 1 . LEU 192 192 11010 1 stop_ save_ save_PRK1_HR1b _Entity.Sf_category entity _Entity.Sf_framecode PRK1_HR1b _Entity.Entry_ID 11010 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name PRK1_HR1b _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 ; GIPATNLSRVAGLEKQLAIE LKVKQGAENMIQTYSNGSTK DRKLLLTAQQMLQDSKTKID IIRMQLRRALQADQLENQAA P ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 119-121 represent a non-native affinity tag' _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 81 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'HR1b domain' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 9019.512 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . . SWS Q16512 . PKN1_HUMAN . . . . . . . . . . . . . . 11010 2 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'protein kinase' 11010 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 1119 GLY . 11010 2 2 1120 ILE . 11010 2 3 1121 PRO . 11010 2 4 1122 ALA . 11010 2 5 1123 THR . 11010 2 6 1124 ASN . 11010 2 7 1125 LEU . 11010 2 8 1126 SER . 11010 2 9 1127 ARG . 11010 2 10 1128 VAL . 11010 2 11 1129 ALA . 11010 2 12 1130 GLY . 11010 2 13 1131 LEU . 11010 2 14 1132 GLU . 11010 2 15 1133 LYS . 11010 2 16 1134 GLN . 11010 2 17 1135 LEU . 11010 2 18 1136 ALA . 11010 2 19 1137 ILE . 11010 2 20 1138 GLU . 11010 2 21 1139 LEU . 11010 2 22 1140 LYS . 11010 2 23 1141 VAL . 11010 2 24 1142 LYS . 11010 2 25 1143 GLN . 11010 2 26 1144 GLY . 11010 2 27 1145 ALA . 11010 2 28 1146 GLU . 11010 2 29 1147 ASN . 11010 2 30 1148 MET . 11010 2 31 1149 ILE . 11010 2 32 1150 GLN . 11010 2 33 1151 THR . 11010 2 34 1152 TYR . 11010 2 35 1153 SER . 11010 2 36 1154 ASN . 11010 2 37 1155 GLY . 11010 2 38 1156 SER . 11010 2 39 1157 THR . 11010 2 40 1158 LYS . 11010 2 41 1159 ASP . 11010 2 42 1160 ARG . 11010 2 43 1161 LYS . 11010 2 44 1162 LEU . 11010 2 45 1163 LEU . 11010 2 46 1164 LEU . 11010 2 47 1165 THR . 11010 2 48 1166 ALA . 11010 2 49 1167 GLN . 11010 2 50 1168 GLN . 11010 2 51 1169 MET . 11010 2 52 1170 LEU . 11010 2 53 1171 GLN . 11010 2 54 1172 ASP . 11010 2 55 1173 SER . 11010 2 56 1174 LYS . 11010 2 57 1175 THR . 11010 2 58 1176 LYS . 11010 2 59 1177 ILE . 11010 2 60 1178 ASP . 11010 2 61 1179 ILE . 11010 2 62 1180 ILE . 11010 2 63 1181 ARG . 11010 2 64 1182 MET . 11010 2 65 1183 GLN . 11010 2 66 1184 LEU . 11010 2 67 1185 ARG . 11010 2 68 1186 ARG . 11010 2 69 1187 ALA . 11010 2 70 1188 LEU . 11010 2 71 1189 GLN . 11010 2 72 1190 ALA . 11010 2 73 1191 ASP . 11010 2 74 1192 GLN . 11010 2 75 1193 LEU . 11010 2 76 1194 GLU . 11010 2 77 1195 ASN . 11010 2 78 1196 GLN . 11010 2 79 1197 ALA . 11010 2 80 1198 ALA . 11010 2 81 1199 PRO . 11010 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 11010 2 . ILE 2 2 11010 2 . PRO 3 3 11010 2 . ALA 4 4 11010 2 . THR 5 5 11010 2 . ASN 6 6 11010 2 . LEU 7 7 11010 2 . SER 8 8 11010 2 . ARG 9 9 11010 2 . VAL 10 10 11010 2 . ALA 11 11 11010 2 . GLY 12 12 11010 2 . LEU 13 13 11010 2 . GLU 14 14 11010 2 . LYS 15 15 11010 2 . GLN 16 16 11010 2 . LEU 17 17 11010 2 . ALA 18 18 11010 2 . ILE 19 19 11010 2 . GLU 20 20 11010 2 . LEU 21 21 11010 2 . LYS 22 22 11010 2 . VAL 23 23 11010 2 . LYS 24 24 11010 2 . GLN 25 25 11010 2 . GLY 26 26 11010 2 . ALA 27 27 11010 2 . GLU 28 28 11010 2 . ASN 29 29 11010 2 . MET 30 30 11010 2 . ILE 31 31 11010 2 . GLN 32 32 11010 2 . THR 33 33 11010 2 . TYR 34 34 11010 2 . SER 35 35 11010 2 . ASN 36 36 11010 2 . GLY 37 37 11010 2 . SER 38 38 11010 2 . THR 39 39 11010 2 . LYS 40 40 11010 2 . ASP 41 41 11010 2 . ARG 42 42 11010 2 . LYS 43 43 11010 2 . LEU 44 44 11010 2 . LEU 45 45 11010 2 . LEU 46 46 11010 2 . THR 47 47 11010 2 . ALA 48 48 11010 2 . GLN 49 49 11010 2 . GLN 50 50 11010 2 . MET 51 51 11010 2 . LEU 52 52 11010 2 . GLN 53 53 11010 2 . ASP 54 54 11010 2 . SER 55 55 11010 2 . LYS 56 56 11010 2 . THR 57 57 11010 2 . LYS 58 58 11010 2 . ILE 59 59 11010 2 . ASP 60 60 11010 2 . ILE 61 61 11010 2 . ILE 62 62 11010 2 . ARG 63 63 11010 2 . MET 64 64 11010 2 . GLN 65 65 11010 2 . LEU 66 66 11010 2 . ARG 67 67 11010 2 . ARG 68 68 11010 2 . ALA 69 69 11010 2 . LEU 70 70 11010 2 . GLN 71 71 11010 2 . ALA 72 72 11010 2 . ASP 73 73 11010 2 . GLN 74 74 11010 2 . LEU 75 75 11010 2 . GLU 76 76 11010 2 . ASN 77 77 11010 2 . GLN 78 78 11010 2 . ALA 79 79 11010 2 . ALA 80 80 11010 2 . PRO 81 81 11010 2 stop_ save_ save_GCP _Entity.Sf_category entity _Entity.Sf_framecode GCP _Entity.Entry_ID 11010 _Entity.ID 3 _Entity.BMRB_code . _Entity.Name GCP _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID GCP _Entity.Nonpolymer_comp_label $chem_comp_GCP _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 3 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GCP . 11010 3 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 11010 _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 $Rac1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11010 1 2 2 $PRK1_HR1b . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11010 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 11010 _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 $Rac1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . . . . . . . pGEX-2T . . . . . . 11010 1 2 2 $PRK1_HR1b . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . . . . . . . pGEX-3X . . . . . . 11010 1 3 3 $GCP . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 11010 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_GCP _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_GCP _Chem_comp.Entry_ID 11010 _Chem_comp.ID GCP _Chem_comp.Provenance . _Chem_comp.Name 'PHOSPHOMETHYLPHOSPHONIC ACID GUANYLATE ESTER' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code GCP _Chem_comp.Ambiguous_flag . _Chem_comp.Initial_date . _Chem_comp.Modified_date . _Chem_comp.Release_status . _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code . _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic . _Chem_comp.Formula 'C11 H18 N5 O13 P3' _Chem_comp.Formula_weight 521.208 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag . _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag . _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site . _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Wed Dec 20 02:58:09 2006 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID c1nc2c(=O)[nH]c(nc2n1C3C(C(C(O3)COP(=O)(O)OP(=O)(CP(=O)(O)O)O)O)O)N SMILES OpenEye/OEToolkits 1.4.2 11010 GCP c1nc2c(=O)[nH]c(nc2n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO[P@](=O)(O)O[P@@](=O)(CP(=O)(O)O)O)O)O)N SMILES_CANONICAL OpenEye/OEToolkits 1.4.2 11010 GCP InChI=1/C11H18N5O13P3/c12-11-14-8-5(9(19)15-11)13-2-16(8)10-7(18)6(17)4(28-10)1-27-32(25,26)29-31(23,24)3-30(20,21)22/h2,4,6-7,10,17-18H,1,3H2,(H,23,24)(H,25,26)(H2,20,21,22)(H3,12,14,15,19)/t4-,6-,7-,10-/m1/s1 INCHI InChi 1 11010 GCP NC1=Nc2[n](cnc2C(=O)N1)C3OC(COP(O)(=O)OP(O)(=O)CP(O)(O)=O)C(O)C3O SMILES_CANONICAL CACTVS 2.87 11010 GCP NC1=Nc2[n](cnc2C(=O)N1)[C@@H]3O[C@H](CO[P@@](O)(=O)O[P@@](O)(=O)CP(O)(O)=O)[C@@H](O)[C@H]3O SMILES CACTVS 2.87 11010 GCP stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID '[[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]methylphosphonic acid' 'SYSTEMATIC NAME' OpenEye/Lexichem 1.4 11010 GCP stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID C1' . C1' . . C . R . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP C2 . C2 . . C . N . 0 . . . . yes no . . . . . . . . . . . . . . . 11010 GCP C2' . C2' . . C . R . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP C3' . C3' . . C . S . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP C3B . C3B . . C . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP C4 . C4 . . C . N . 0 . . . . yes no . . . . . . . . . . . . . . . 11010 GCP C4' . C4' . . C . R . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP C5 . C5 . . C . N . 0 . . . . yes no . . . . . . . . . . . . . . . 11010 GCP C5' . C5' . . C . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP C6 . C6 . . C . N . 0 . . . . yes no . . . . . . . . . . . . . . . 11010 GCP C8 . C8 . . C . N . 0 . . . . yes no . . . . . . . . . . . . . . . 11010 GCP H1' . H1' . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP H2' . H2' . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP H3' . H3' . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP H3B1 . H3B1 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP H3B2 . H3B2 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP H4' . H4' . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP H5'1 . H5'1 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP H5'2 . H5'2 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP H8 . H8 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP HN1 . HN1 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP HN21 . HN21 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP HN22 . HN22 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP HO2' . HO2' . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP HO3' . HO3' . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP HOA2 . HOA2 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP HOB2 . HOB2 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP HOG2 . HOG2 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP HOG3 . HOG3 . . H . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP N1 . N1 . . N . N . 0 . . . . yes no . . . . . . . . . . . . . . . 11010 GCP N2 . N2 . . N . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP N3 . N3 . . N . N . 0 . . . . yes no . . . . . . . . . . . . . . . 11010 GCP N7 . N7 . . N . N . 0 . . . . yes no . . . . . . . . . . . . . . . 11010 GCP N9 . N9 . . N . N . 0 . . . . yes no . . . . . . . . . . . . . . . 11010 GCP O1A . O1A . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O1B . O1B . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O1G . O1G . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O2' . O2' . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O2A . O2A . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O2B . O2B . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O2G . O2G . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O3' . O3' . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O3A . O3A . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O3G . O3G . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O4' . O4' . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O5' . O5' . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP O6 . O6 . . O . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP PA . PA . . P . S . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP PB . PB . . P . R . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP PG . PG . . P . N . 0 . . . . no no . . . . . . . . . . . . . . . 11010 GCP stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . DOUB PG O1G . . . . 11010 GCP 2 . SING PG O2G . . . . 11010 GCP 3 . SING PG O3G . . . . 11010 GCP 4 . SING PG C3B . . . . 11010 GCP 5 . SING O2G HOG2 . . . . 11010 GCP 6 . SING O3G HOG3 . . . . 11010 GCP 7 . SING C3B PB . . . . 11010 GCP 8 . SING C3B H3B1 . . . . 11010 GCP 9 . SING C3B H3B2 . . . . 11010 GCP 10 . DOUB PB O1B . . . . 11010 GCP 11 . SING PB O2B . . . . 11010 GCP 12 . SING PB O3A . . . . 11010 GCP 13 . SING O2B HOB2 . . . . 11010 GCP 14 . SING O3A PA . . . . 11010 GCP 15 . DOUB PA O1A . . . . 11010 GCP 16 . SING PA O2A . . . . 11010 GCP 17 . SING PA O5' . . . . 11010 GCP 18 . SING O2A HOA2 . . . . 11010 GCP 19 . SING O5' C5' . . . . 11010 GCP 20 . SING C5' C4' . . . . 11010 GCP 21 . SING C5' H5'2 . . . . 11010 GCP 22 . SING C5' H5'1 . . . . 11010 GCP 23 . SING C4' O4' . . . . 11010 GCP 24 . SING C4' C3' . . . . 11010 GCP 25 . SING C4' H4' . . . . 11010 GCP 26 . SING O4' C1' . . . . 11010 GCP 27 . SING C3' O3' . . . . 11010 GCP 28 . SING C3' C2' . . . . 11010 GCP 29 . SING C3' H3' . . . . 11010 GCP 30 . SING O3' HO3' . . . . 11010 GCP 31 . SING C2' O2' . . . . 11010 GCP 32 . SING C2' C1' . . . . 11010 GCP 33 . SING C2' H2' . . . . 11010 GCP 34 . SING O2' HO2' . . . . 11010 GCP 35 . SING C1' N9 . . . . 11010 GCP 36 . SING C1' H1' . . . . 11010 GCP 37 . SING N9 C8 . . . . 11010 GCP 38 . SING N9 C4 . . . . 11010 GCP 39 . DOUB C8 N7 . . . . 11010 GCP 40 . SING C8 H8 . . . . 11010 GCP 41 . SING N7 C5 . . . . 11010 GCP 42 . SING C5 C6 . . . . 11010 GCP 43 . DOUB C5 C4 . . . . 11010 GCP 44 . DOUB C6 O6 . . . . 11010 GCP 45 . SING C6 N1 . . . . 11010 GCP 46 . SING N1 C2 . . . . 11010 GCP 47 . SING N1 HN1 . . . . 11010 GCP 48 . SING C2 N2 . . . . 11010 GCP 49 . DOUB C2 N3 . . . . 11010 GCP 50 . SING N2 HN21 . . . . 11010 GCP 51 . SING N2 HN22 . . . . 11010 GCP 52 . SING N3 C4 . . . . 11010 GCP stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Deuterated_Rac _Sample.Sf_category sample _Sample.Sf_framecode Deuterated_Rac _Sample.Entry_ID 11010 _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 Rac1 '[U-13C; U-15N; U-2H]' . . 1 $Rac1 . . 0.6 . . mM . . . . 11010 1 2 'PRK1 HR1b' 'natural abundance' . . 2 $PRK1_HR1b . . 0.6 . . mM . . . . 11010 1 3 'PHOSPHOMETHYLPHOSPHONIC ACID GUANYLATE ESTER' 'natural abundance' . . 3 $GCP . . 0.7 . . mM . . . . 11010 1 4 Tris-HCl 'natural abundance' . . . . . . 10 . . mM . . . . 11010 1 5 NaCl 'natural abundance' . . . . . . 200 . . mM . . . . 11010 1 6 MgCl2 'natural abundance' . . . . . . 5 . . mM . . . . 11010 1 7 dithiothreitol 'natural abundance' . . . . . . 10 . . mM . . . . 11010 1 8 NaN3 'natural abundance' . . . . . . 0.05 . . % . . . . 11010 1 9 H2O 'natural abundance' . . . . . . 90 . . % . . . . 11010 1 10 D2O . . . . . . . 10 . . % . . . . 11010 1 stop_ save_ save_13C_15N_Rac1 _Sample.Sf_category sample _Sample.Sf_framecode 13C_15N_Rac1 _Sample.Entry_ID 11010 _Sample.ID 2 _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 Rac1 '[U-100% 13C; U-100% 15N]' . . 1 $Rac1 . . 0.6 . . mM . . . . 11010 2 2 'PRK1 HR1b' 'natural abundance' . . 2 $PRK1_HR1b . . 0.6 . . mM . . . . 11010 2 3 'PHOSPHOMETHYLPHOSPHONIC ACID GUANYLATE ESTER' 'natural abundance' . . 3 $GCP . . 0.7 . . mM . . . . 11010 2 4 Tris-HCl 'natural abundance' . . . . . . 10 . . mM . . . . 11010 2 5 NaCl 'natural abundance' . . . . . . 200 . . mM . . . . 11010 2 6 MgCl2 'natural abundance' . . . . . . 5 . . mM . . . . 11010 2 7 dithiothreitol 'natural abundance' . . . . . . 10 . . mM . . . . 11010 2 8 NaN3 'natural abundance' . . . . . . 0.05 . . % . . . . 11010 2 9 H2O 'natural abundance' . . . . . . 90 . . % . . . . 11010 2 10 D2O . . . . . . . 10 . . % . . . . 11010 2 stop_ save_ save_15N_Rac _Sample.Sf_category sample _Sample.Sf_framecode 15N_Rac _Sample.Entry_ID 11010 _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 Rac1 '[U-100% 15N]' . . 1 $Rac1 . . 0.6 . . mM . . . . 11010 3 2 'PRK1 HR1b' 'natural abundance' . . 2 $PRK1_HR1b . . 0.6 . . mM . . . . 11010 3 3 'PHOSPHOMETHYLPHOSPHONIC ACID GUANYLATE ESTER' 'natural abundance' . . 3 $GCP . . 0.7 . . mM . . . . 11010 3 4 Tris-HCl 'natural abundance' . . . . . . 10 . . mM . . . . 11010 3 5 NaCl 'natural abundance' . . . . . . 200 . . mM . . . . 11010 3 6 MgCl2 'natural abundance' . . . . . . 5 . . mM . . . . 11010 3 7 dithiothreitol 'natural abundance' . . . . . . 10 . . mM . . . . 11010 3 8 NaN3 'natural abundance' . . . . . . 0.05 . . % . . . . 11010 3 9 H2O 'natural abundance' . . . . . . 90 . . % . . . . 11010 3 10 D2O . . . . . . . 10 . . % . . . . 11010 3 stop_ save_ save_13C_15N_HR1b _Sample.Sf_category sample _Sample.Sf_framecode 13C_15N_HR1b _Sample.Entry_ID 11010 _Sample.ID 4 _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 Rac1 'natural abundance' . . 1 $Rac1 . . 0.6 . . mM . . . . 11010 4 2 'PRK1 HR1b' '[U-100% 13C; U-100% 15N]' . . 2 $PRK1_HR1b . . 0.6 . . mM . . . . 11010 4 3 'PHOSPHOMETHYLPHOSPHONIC ACID GUANYLATE ESTER' 'natural abundance' . . 3 $GCP . . 0.7 . . mM . . . . 11010 4 4 Tris-HCl 'natural abundance' . . . . . . 10 . . mM . . . . 11010 4 5 NaCl 'natural abundance' . . . . . . 200 . . mM . . . . 11010 4 6 MgCl2 'natural abundance' . . . . . . 5 . . mM . . . . 11010 4 7 dithiothreitol 'natural abundance' . . . . . . 10 . . mM . . . . 11010 4 8 NaN3 'natural abundance' . . . . . . 0.05 . . % . . . . 11010 4 9 H2O 'natural abundance' . . . . . . 90 . . % . . . . 11010 4 10 D2O . . . . . . . 10 . . % . . . . 11010 4 stop_ save_ save_15N_HR1b _Sample.Sf_category sample _Sample.Sf_framecode 15N_HR1b _Sample.Entry_ID 11010 _Sample.ID 5 _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 Rac1 'natural abundance' . . 1 $Rac1 . . 0.6 . . mM . . . . 11010 5 2 'PRK1 HR1b' '[U-100% 15N]' . . 2 $PRK1_HR1b . . 0.6 . . mM . . . . 11010 5 3 'PHOSPHOMETHYLPHOSPHONIC ACID GUANYLATE ESTER' 'natural abundance' . . 3 $GCP . . 0.7 . . mM . . . . 11010 5 4 Tris-HCl 'natural abundance' . . . . . . 10 . . mM . . . . 11010 5 5 NaCl 'natural abundance' . . . . . . 200 . . mM . . . . 11010 5 6 MgCl2 'natural abundance' . . . . . . 5 . . mM . . . . 11010 5 7 dithiothreitol 'natural abundance' . . . . . . 10 . . mM . . . . 11010 5 8 NaN3 'natural abundance' . . . . . . 0.05 . . % . . . . 11010 5 9 H2O 'natural abundance' . . . . . . 90 . . % . . . . 11010 5 10 D2O . . . . . . . 10 . . % . . . . 11010 5 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 11010 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 225 . mM 11010 1 pH 7.4 . pH 11010 1 pressure 1 . atm 11010 1 temperature 298 . K 11010 1 stop_ save_ ############################ # Computer software used # ############################ save_AZARA _Software.Sf_category software _Software.Sf_framecode AZARA _Software.Entry_ID 11010 _Software.ID 1 _Software.Name AZARA _Software.Version 2.7 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Boucher . . 11010 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11010 1 stop_ save_ save_ANSIG _Software.Sf_category software _Software.Sf_framecode ANSIG _Software.Entry_ID 11010 _Software.ID 2 _Software.Name ANSIG _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Kraulis . . 11010 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 11010 2 stop_ save_ save_ARIA _Software.Sf_category software _Software.Sf_framecode ARIA _Software.Entry_ID 11010 _Software.ID 3 _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' . . 11010 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11010 3 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 11010 _Software.ID 4 _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' . . 11010 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 11010 4 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 11010 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 11010 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 11010 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 600 . . . 11010 1 2 spectrometer_2 Bruker DRX . 800 . . . 11010 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 11010 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $13C_15N_Rac1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11010 1 2 '3D 1H-13C NOESY' no . . . . . . . . . . 4 $13C_15N_HR1b isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 11010 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 11010 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 11010 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 11010 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 11010 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 11010 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-13C NOESY' 2 $13C_15N_Rac1 isotropic 11010 1 2 '3D 1H-13C NOESY' 4 $13C_15N_HR1b isotropic 11010 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET H H 1 7.675 0.0 . 1 . . . . 1 MET HN . 11010 1 2 . 1 1 1 1 MET HA H 1 4.319 0.0 . 1 . . . . 1 MET HA . 11010 1 3 . 1 1 1 1 MET HB2 H 1 1.866 0.0 . 2 . . . . 1 MET HB# . 11010 1 4 . 1 1 1 1 MET HE1 H 1 1.873 0.0 . 1 . . . . 1 MET HE# . 11010 1 5 . 1 1 1 1 MET HE2 H 1 1.873 0.0 . 1 . . . . 1 MET HE# . 11010 1 6 . 1 1 1 1 MET HE3 H 1 1.873 0.0 . 1 . . . . 1 MET HE# . 11010 1 7 . 1 1 1 1 MET HG2 H 1 2.31 0.0 . 1 . . . . 1 MET HG1 . 11010 1 8 . 1 1 1 1 MET HG3 H 1 2.368 0.0 . 1 . . . . 1 MET HG2 . 11010 1 9 . 1 1 1 1 MET C C 13 175.483 0.0 . 1 . . . . 1 MET CO . 11010 1 10 . 1 1 1 1 MET CA C 13 55.739 0.0 . 1 . . . . 1 MET CA . 11010 1 11 . 1 1 1 1 MET CB C 13 34.043 0.0 . 1 . . . . 1 MET CB . 11010 1 12 . 1 1 1 1 MET CE C 13 17.154 0.0 . 1 . . . . 1 MET CE . 11010 1 13 . 1 1 1 1 MET CG C 13 31.786 0.0 . 1 . . . . 1 MET CG . 11010 1 14 . 1 1 1 1 MET N N 15 119.319 0.0 . 1 . . . . 1 MET N . 11010 1 15 . 1 1 2 2 GLN H H 1 8.202 0.0 . 1 . . . . 2 GLN HN . 11010 1 16 . 1 1 2 2 GLN HA H 1 4.315 0.0 . 1 . . . . 2 GLN HA . 11010 1 17 . 1 1 2 2 GLN HB2 H 1 1.88 0.0 . 1 . . . . 2 GLN HB1 . 11010 1 18 . 1 1 2 2 GLN HB3 H 1 2.007 0.0 . 1 . . . . 2 GLN HB2 . 11010 1 19 . 1 1 2 2 GLN HE21 H 1 6.726 0.0 . 1 . . . . 2 GLN HE21 . 11010 1 20 . 1 1 2 2 GLN HE22 H 1 7.554 0.0 . 1 . . . . 2 GLN HE22 . 11010 1 21 . 1 1 2 2 GLN HG2 H 1 2.209 0.0 . 1 . . . . 2 GLN HG1 . 11010 1 22 . 1 1 2 2 GLN HG3 H 1 2.26 0.0 . 1 . . . . 2 GLN HG2 . 11010 1 23 . 1 1 2 2 GLN C C 13 174.301 0.0 . 1 . . . . 2 GLN CO . 11010 1 24 . 1 1 2 2 GLN CA C 13 55.762 0.0 . 1 . . . . 2 GLN CA . 11010 1 25 . 1 1 2 2 GLN CB C 13 30.023 0.0 . 1 . . . . 2 GLN CB . 11010 1 26 . 1 1 2 2 GLN CG C 13 33.727 0.0 . 1 . . . . 2 GLN CG . 11010 1 27 . 1 1 2 2 GLN N N 15 123.135 0.0 . 1 . . . . 2 GLN N . 11010 1 28 . 1 1 2 2 GLN NE2 N 15 110.952 0.0 . 1 . . . . 2 GLN NE2 . 11010 1 29 . 1 1 3 3 ALA H H 1 8.594 0.0 . 1 . . . . 3 ALA HN . 11010 1 30 . 1 1 3 3 ALA HA H 1 5.138 0.0 . 1 . . . . 3 ALA HA . 11010 1 31 . 1 1 3 3 ALA HB1 H 1 1.359 0.0 . 1 . . . . 3 ALA HB# . 11010 1 32 . 1 1 3 3 ALA HB2 H 1 1.359 0.0 . 1 . . . . 3 ALA HB# . 11010 1 33 . 1 1 3 3 ALA HB3 H 1 1.359 0.0 . 1 . . . . 3 ALA HB# . 11010 1 34 . 1 1 3 3 ALA C C 13 177.228 0.0 . 1 . . . . 3 ALA CO . 11010 1 35 . 1 1 3 3 ALA CA C 13 51.333 0.0 . 1 . . . . 3 ALA CA . 11010 1 36 . 1 1 3 3 ALA CB C 13 20.2022 0.0 . 1 . . . . 3 ALA CB . 11010 1 37 . 1 1 3 3 ALA N N 15 128.1 0.0 . 1 . . . . 3 ALA N . 11010 1 38 . 1 1 4 4 ILE H H 1 8.387 0.0 . 1 . . . . 4 ILE HN . 11010 1 39 . 1 1 4 4 ILE HA H 1 4.37 0.0 . 1 . . . . 4 ILE HA . 11010 1 40 . 1 1 4 4 ILE HB H 1 1.565 0.0 . 1 . . . . 4 ILE HB . 11010 1 41 . 1 1 4 4 ILE HD11 H 1 0.736 0.0 . 1 . . . . 4 ILE HD1# . 11010 1 42 . 1 1 4 4 ILE HD12 H 1 0.736 0.0 . 1 . . . . 4 ILE HD1# . 11010 1 43 . 1 1 4 4 ILE HD13 H 1 0.736 0.0 . 1 . . . . 4 ILE HD1# . 11010 1 44 . 1 1 4 4 ILE HG12 H 1 1.053 0.0 . 1 . . . . 4 ILE HG11 . 11010 1 45 . 1 1 4 4 ILE HG13 H 1 1.424 0.0 . 1 . . . . 4 ILE HG12 . 11010 1 46 . 1 1 4 4 ILE HG21 H 1 0.6680471 0.0 . 1 . . . . 4 ILE HG2# . 11010 1 47 . 1 1 4 4 ILE HG22 H 1 0.6680471 0.0 . 1 . . . . 4 ILE HG2# . 11010 1 48 . 1 1 4 4 ILE HG23 H 1 0.6680471 0.0 . 1 . . . . 4 ILE HG2# . 11010 1 49 . 1 1 4 4 ILE C C 13 173.856 0.0 . 1 . . . . 4 ILE CO . 11010 1 50 . 1 1 4 4 ILE CA C 13 60.151 0.0 . 1 . . . . 4 ILE CA . 11010 1 51 . 1 1 4 4 ILE CB C 13 41.808 0.0 . 1 . . . . 4 ILE CB . 11010 1 52 . 1 1 4 4 ILE CD1 C 13 14.406 0.0 . 1 . . . . 4 ILE CD1 . 11010 1 53 . 1 1 4 4 ILE CG1 C 13 28.04 0.0 . 1 . . . . 4 ILE CG1 . 11010 1 54 . 1 1 4 4 ILE CG2 C 13 17.56553 0.0 . 1 . . . . 4 ILE CG2 . 11010 1 55 . 1 1 4 4 ILE N N 15 122.001 0.0 . 1 . . . . 4 ILE N . 11010 1 56 . 1 1 5 5 LYS H H 1 10.484 0.0 . 1 . . . . 5 LYS HN . 11010 1 57 . 1 1 5 5 LYS HA H 1 5.25002 0.0 . 1 . . . . 5 LYS HA . 11010 1 58 . 1 1 5 5 LYS HB2 H 1 1.48 0.0 . 2 . . . . 5 LYS HB# . 11010 1 59 . 1 1 5 5 LYS HD2 H 1 1.586 0.0 . 2 . . . . 5 LYS HD# . 11010 1 60 . 1 1 5 5 LYS HG2 H 1 0.6296959 0.0 . 1 . . . . 5 LYS HG1 . 11010 1 61 . 1 1 5 5 LYS HG3 H 1 0.857682 0.0 . 1 . . . . 5 LYS HG2 . 11010 1 62 . 1 1 5 5 LYS C C 13 174.464 0.0 . 1 . . . . 5 LYS CO . 11010 1 63 . 1 1 5 5 LYS CA C 13 55.799 0.0 . 1 . . . . 5 LYS CA . 11010 1 64 . 1 1 5 5 LYS CB C 13 33.164 0.0 . 1 . . . . 5 LYS CB . 11010 1 65 . 1 1 5 5 LYS N N 15 131.036 0.0 . 1 . . . . 5 LYS N . 11010 1 66 . 1 1 6 6 CYS H H 1 9.321 0.0 . 1 . . . . 6 CYS HN . 11010 1 67 . 1 1 6 6 CYS HA H 1 5.515 0.0 . 1 . . . . 6 CYS HA . 11010 1 68 . 1 1 6 6 CYS HB2 H 1 2.264 0.0 . 1 . . . . 6 CYS HB1 . 11010 1 69 . 1 1 6 6 CYS HB3 H 1 2.915 0.0 . 1 . . . . 6 CYS HB2 . 11010 1 70 . 1 1 6 6 CYS HG H 1 1.024 0.0 . 1 . . . . 6 CYS HG . 11010 1 71 . 1 1 6 6 CYS C C 13 172.549 0.0 . 1 . . . . 6 CYS CO . 11010 1 72 . 1 1 6 6 CYS CA C 13 55.853 0.0 . 1 . . . . 6 CYS CA . 11010 1 73 . 1 1 6 6 CYS CB C 13 28.584 0.0 . 1 . . . . 6 CYS CB . 11010 1 74 . 1 1 6 6 CYS N N 15 130.888 0.0 . 1 . . . . 6 CYS N . 11010 1 75 . 1 1 7 7 VAL H H 1 7.503 0.0 . 1 . . . . 7 VAL HN . 11010 1 76 . 1 1 7 7 VAL HA H 1 4.86 0.0 . 1 . . . . 7 VAL HA . 11010 1 77 . 1 1 7 7 VAL HB H 1 1.398 0.0 . 1 . . . . 7 VAL HB . 11010 1 78 . 1 1 7 7 VAL HG11 H 1 0.62 0.0 . 1 . . . . 7 VAL HG1# . 11010 1 79 . 1 1 7 7 VAL HG12 H 1 0.62 0.0 . 1 . . . . 7 VAL HG1# . 11010 1 80 . 1 1 7 7 VAL HG13 H 1 0.62 0.0 . 1 . . . . 7 VAL HG1# . 11010 1 81 . 1 1 7 7 VAL HG21 H 1 0.9996024 0.0 . 1 . . . . 7 VAL HG2# . 11010 1 82 . 1 1 7 7 VAL HG22 H 1 0.9996024 0.0 . 1 . . . . 7 VAL HG2# . 11010 1 83 . 1 1 7 7 VAL HG23 H 1 0.9996024 0.0 . 1 . . . . 7 VAL HG2# . 11010 1 84 . 1 1 7 7 VAL C C 13 173.932 0.0 . 1 . . . . 7 VAL CO . 11010 1 85 . 1 1 7 7 VAL CA C 13 60.989 0.0 . 1 . . . . 7 VAL CA . 11010 1 86 . 1 1 7 7 VAL CB C 13 33.576 0.0 . 1 . . . . 7 VAL CB . 11010 1 87 . 1 1 7 7 VAL CG1 C 13 23.713 0.0 . 1 . . . . 7 VAL CG1 . 11010 1 88 . 1 1 7 7 VAL CG2 C 13 22.28395 0.0 . 1 . . . . 7 VAL CG2 . 11010 1 89 . 1 1 7 7 VAL N N 15 128.782 0.0 . 1 . . . . 7 VAL N . 11010 1 90 . 1 1 8 8 VAL H H 1 8.18 0.0 . 1 . . . . 8 VAL HN . 11010 1 91 . 1 1 8 8 VAL HA H 1 4.979 0.0 . 1 . . . . 8 VAL HA . 11010 1 92 . 1 1 8 8 VAL HB H 1 2.092 0.0 . 1 . . . . 8 VAL HB . 11010 1 93 . 1 1 8 8 VAL HG11 H 1 0.846 0.0 . 1 . . . . 8 VAL HG1# . 11010 1 94 . 1 1 8 8 VAL HG12 H 1 0.846 0.0 . 1 . . . . 8 VAL HG1# . 11010 1 95 . 1 1 8 8 VAL HG13 H 1 0.846 0.0 . 1 . . . . 8 VAL HG1# . 11010 1 96 . 1 1 8 8 VAL HG21 H 1 0.9537642 0.0 . 1 . . . . 8 VAL HG2# . 11010 1 97 . 1 1 8 8 VAL HG22 H 1 0.9537642 0.0 . 1 . . . . 8 VAL HG2# . 11010 1 98 . 1 1 8 8 VAL HG23 H 1 0.9537642 0.0 . 1 . . . . 8 VAL HG2# . 11010 1 99 . 1 1 8 8 VAL C C 13 174.418 0.0 . 1 . . . . 8 VAL CO . 11010 1 100 . 1 1 8 8 VAL CA C 13 60.816 0.0 . 1 . . . . 8 VAL CA . 11010 1 101 . 1 1 8 8 VAL CB C 13 33.58 0.0 . 1 . . . . 8 VAL CB . 11010 1 102 . 1 1 8 8 VAL CG1 C 13 22.672 0.0 . 1 . . . . 8 VAL CG1 . 11010 1 103 . 1 1 8 8 VAL CG2 C 13 22.335 0.0 . 1 . . . . 8 VAL CG2 . 11010 1 104 . 1 1 8 8 VAL N N 15 125.609 0.0 . 1 . . . . 8 VAL N . 11010 1 105 . 1 1 9 9 VAL H H 1 8.658 0.0 . 1 . . . . 9 VAL HN . 11010 1 106 . 1 1 9 9 VAL HA H 1 4.331 0.0 . 1 . . . . 9 VAL HA . 11010 1 107 . 1 1 9 9 VAL HB H 1 1.793 0.0 . 1 . . . . 9 VAL HB . 11010 1 108 . 1 1 9 9 VAL HG11 H 1 0.639 0.0 . 1 . . . . 9 VAL HG1# . 11010 1 109 . 1 1 9 9 VAL HG12 H 1 0.639 0.0 . 1 . . . . 9 VAL HG1# . 11010 1 110 . 1 1 9 9 VAL HG13 H 1 0.639 0.0 . 1 . . . . 9 VAL HG1# . 11010 1 111 . 1 1 9 9 VAL HG21 H 1 1.069 0.0 . 1 . . . . 9 VAL HG2# . 11010 1 112 . 1 1 9 9 VAL HG22 H 1 1.069 0.0 . 1 . . . . 9 VAL HG2# . 11010 1 113 . 1 1 9 9 VAL HG23 H 1 1.069 0.0 . 1 . . . . 9 VAL HG2# . 11010 1 114 . 1 1 9 9 VAL C C 13 173.726 0.0 . 1 . . . . 9 VAL CO . 11010 1 115 . 1 1 9 9 VAL CA C 13 58.464 0.0 . 1 . . . . 9 VAL CA . 11010 1 116 . 1 1 9 9 VAL CB C 13 35.227 0.0 . 1 . . . . 9 VAL CB . 11010 1 117 . 1 1 9 9 VAL CG1 C 13 20.613 0.0 . 1 . . . . 9 VAL CG1 . 11010 1 118 . 1 1 9 9 VAL CG2 C 13 21.511 0.0 . 1 . . . . 9 VAL CG2 . 11010 1 119 . 1 1 9 9 VAL N N 15 116.586 0.0 . 1 . . . . 9 VAL N . 11010 1 120 . 1 1 10 10 GLY H H 1 6.766 0.0 . 1 . . . . 10 GLY HN . 11010 1 121 . 1 1 10 10 GLY C C 13 172.344 0.0 . 1 . . . . 10 GLY CO . 11010 1 122 . 1 1 10 10 GLY CA C 13 43.474 0.0 . 1 . . . . 10 GLY CA . 11010 1 123 . 1 1 10 10 GLY N N 15 106.764 0.0 . 1 . . . . 10 GLY N . 11010 1 124 . 1 1 11 11 ASP H H 1 8.136 0.0 . 1 . . . . 11 ASP HN . 11010 1 125 . 1 1 11 11 ASP HB2 H 1 2.798 0.0 . 2 . . . . 11 ASP HB# . 11010 1 126 . 1 1 11 11 ASP C C 13 177.509 0.0 . 1 . . . . 11 ASP CO . 11010 1 127 . 1 1 11 11 ASP CA C 13 56.02 0.0 . 1 . . . . 11 ASP CA . 11010 1 128 . 1 1 11 11 ASP CB C 13 42.8807 0.0 . 1 . . . . 11 ASP CB . 11010 1 129 . 1 1 11 11 ASP N N 15 117.193 0.0 . 1 . . . . 11 ASP N . 11010 1 130 . 1 1 12 12 GLY H H 1 8.478 0.0 . 1 . . . . 12 GLY HN . 11010 1 131 . 1 1 12 12 GLY HA2 H 1 3.639 0.0 . 1 . . . . 12 GLY HA1 . 11010 1 132 . 1 1 12 12 GLY HA3 H 1 4.365 0.0 . 1 . . . . 12 GLY HA2 . 11010 1 133 . 1 1 12 12 GLY CA C 13 46.833 0.0 . 1 . . . . 12 GLY CA . 11010 1 134 . 1 1 12 12 GLY N N 15 102.739 0.0 . 1 . . . . 12 GLY N . 11010 1 135 . 1 1 13 13 ALA HA H 1 3.933 0.0 . 1 . . . . 13 ALA HA . 11010 1 136 . 1 1 13 13 ALA HB1 H 1 1.513 0.0 . 1 . . . . 13 ALA HB# . 11010 1 137 . 1 1 13 13 ALA HB2 H 1 1.513 0.0 . 1 . . . . 13 ALA HB# . 11010 1 138 . 1 1 13 13 ALA HB3 H 1 1.513 0.0 . 1 . . . . 13 ALA HB# . 11010 1 139 . 1 1 13 13 ALA CA C 13 54.316 0.0 . 1 . . . . 13 ALA CA . 11010 1 140 . 1 1 13 13 ALA CB C 13 18.087 0.0 . 1 . . . . 13 ALA CB . 11010 1 141 . 1 1 14 14 VAL H H 1 7.23878 0.0 . 1 . . . . 14 VAL HN . 11010 1 142 . 1 1 15 15 GLY H H 1 8.333 0.0 . 1 . . . . 15 GLY HN . 11010 1 143 . 1 1 15 15 GLY CA C 13 44.74 0.0 . 1 . . . . 15 GLY CA . 11010 1 144 . 1 1 15 15 GLY N N 15 107.656 0.0 . 1 . . . . 15 GLY N . 11010 1 145 . 1 1 16 16 LYS H H 1 9.386 0.0 . 1 . . . . 16 LYS HN . 11010 1 146 . 1 1 16 16 LYS C C 13 176.668 0.0 . 1 . . . . 16 LYS CO . 11010 1 147 . 1 1 16 16 LYS CA C 13 60.656 0.0 . 1 . . . . 16 LYS CA . 11010 1 148 . 1 1 16 16 LYS CB C 13 29.901 0.0 . 1 . . . . 16 LYS CB . 11010 1 149 . 1 1 17 17 THR H H 1 9.128 0.0 . 1 . . . . 17 THR HN . 11010 1 150 . 1 1 17 17 THR HA H 1 3.886015 0.0 . 1 . . . . 17 THR HA . 11010 1 151 . 1 1 17 17 THR HB H 1 4.224 0.0 . 1 . . . . 17 THR HB . 11010 1 152 . 1 1 17 17 THR HG21 H 1 1.093 0.0 . 1 . . . . 17 THR HG2# . 11010 1 153 . 1 1 17 17 THR HG22 H 1 1.093 0.0 . 1 . . . . 17 THR HG2# . 11010 1 154 . 1 1 17 17 THR HG23 H 1 1.093 0.0 . 1 . . . . 17 THR HG2# . 11010 1 155 . 1 1 17 17 THR C C 13 177.675 0.0 . 1 . . . . 17 THR CO . 11010 1 156 . 1 1 17 17 THR CA C 13 67.077 0.0 . 1 . . . . 17 THR CA . 11010 1 157 . 1 1 17 17 THR CB C 13 67.793 0.0 . 1 . . . . 17 THR CB . 11010 1 158 . 1 1 17 17 THR CG2 C 13 22.438 0.0 . 1 . . . . 17 THR CG2 . 11010 1 159 . 1 1 17 17 THR N N 15 118.569 0.0 . 1 . . . . 17 THR N . 11010 1 160 . 1 1 18 18 CYS H H 1 9.424 0.0 . 1 . . . . 18 CYS HN . 11010 1 161 . 1 1 18 18 CYS C C 13 177.028 0.0 . 1 . . . . 18 CYS CO . 11010 1 162 . 1 1 18 18 CYS CA C 13 65.768 0.0 . 1 . . . . 18 CYS CA . 11010 1 163 . 1 1 18 18 CYS CB C 13 27.871 0.0 . 1 . . . . 18 CYS CB . 11010 1 164 . 1 1 18 18 CYS N N 15 119.075 0.0 . 1 . . . . 18 CYS N . 11010 1 165 . 1 1 19 19 LEU H H 1 7.933 0.0 . 1 . . . . 19 LEU HN . 11010 1 166 . 1 1 19 19 LEU HA H 1 3.859 0.0 . 1 . . . . 19 LEU HA . 11010 1 167 . 1 1 19 19 LEU HB2 H 1 1.715 0.0 . 1 . . . . 19 LEU HB1 . 11010 1 168 . 1 1 19 19 LEU HB3 H 1 2.187 0.0 . 1 . . . . 19 LEU HB2 . 11010 1 169 . 1 1 19 19 LEU HD11 H 1 0.647 0.0 . 1 . . . . 19 LEU HD1# . 11010 1 170 . 1 1 19 19 LEU HD12 H 1 0.647 0.0 . 1 . . . . 19 LEU HD1# . 11010 1 171 . 1 1 19 19 LEU HD13 H 1 0.647 0.0 . 1 . . . . 19 LEU HD1# . 11010 1 172 . 1 1 19 19 LEU HD21 H 1 0.692 0.0 . 1 . . . . 19 LEU HD2# . 11010 1 173 . 1 1 19 19 LEU HD22 H 1 0.692 0.0 . 1 . . . . 19 LEU HD2# . 11010 1 174 . 1 1 19 19 LEU HD23 H 1 0.692 0.0 . 1 . . . . 19 LEU HD2# . 11010 1 175 . 1 1 19 19 LEU HG H 1 1.72 0.0 . 1 . . . . 19 LEU HG . 11010 1 176 . 1 1 19 19 LEU C C 13 177.428 0.0 . 1 . . . . 19 LEU CO . 11010 1 177 . 1 1 19 19 LEU CA C 13 59.562 0.0 . 1 . . . . 19 LEU CA . 11010 1 178 . 1 1 19 19 LEU CB C 13 42.203 0.0 . 1 . . . . 19 LEU CB . 11010 1 179 . 1 1 19 19 LEU CD1 C 13 26.57626 0.0 . 1 . . . . 19 LEU CD1 . 11010 1 180 . 1 1 19 19 LEU CD2 C 13 27.132 0.0 . 1 . . . . 19 LEU CD2 . 11010 1 181 . 1 1 19 19 LEU CG C 13 26.541 0.0 . 1 . . . . 19 LEU CG . 11010 1 182 . 1 1 19 19 LEU N N 15 121.124 0.0 . 1 . . . . 19 LEU N . 11010 1 183 . 1 1 20 20 LEU H H 1 7.293 0.0 . 1 . . . . 20 LEU HN . 11010 1 184 . 1 1 20 20 LEU HA H 1 3.703 0.0 . 1 . . . . 20 LEU HA . 11010 1 185 . 1 1 20 20 LEU HB2 H 1 1.572 0.0 . 2 . . . . 20 LEU HB# . 11010 1 186 . 1 1 20 20 LEU HD11 H 1 0.786 0.0 . 2 . . . . 20 LEU HD# . 11010 1 187 . 1 1 20 20 LEU HD12 H 1 0.786 0.0 . 2 . . . . 20 LEU HD# . 11010 1 188 . 1 1 20 20 LEU HD13 H 1 0.786 0.0 . 2 . . . . 20 LEU HD# . 11010 1 189 . 1 1 20 20 LEU HG H 1 1.977 0.0 . 1 . . . . 20 LEU HG . 11010 1 190 . 1 1 20 20 LEU C C 13 180.74 0.0 . 1 . . . . 20 LEU CO . 11010 1 191 . 1 1 20 20 LEU CA C 13 57.71 0.0 . 1 . . . . 20 LEU CA . 11010 1 192 . 1 1 20 20 LEU CB C 13 41.646 0.0 . 1 . . . . 20 LEU CB . 11010 1 193 . 1 1 20 20 LEU CD1 C 13 24.824 0.0 . 2 . . . . 20 LEU CD# . 11010 1 194 . 1 1 20 20 LEU CG C 13 26.32 0.0 . 1 . . . . 20 LEU CG . 11010 1 195 . 1 1 20 20 LEU N N 15 116.51 0.0 . 1 . . . . 20 LEU N . 11010 1 196 . 1 1 21 21 ILE H H 1 8.771 0.0 . 1 . . . . 21 ILE HN . 11010 1 197 . 1 1 21 21 ILE HD11 H 1 0.4752095 0.0 . 1 . . . . 21 ILE HD1# . 11010 1 198 . 1 1 21 21 ILE HD12 H 1 0.4752095 0.0 . 1 . . . . 21 ILE HD1# . 11010 1 199 . 1 1 21 21 ILE HD13 H 1 0.4752095 0.0 . 1 . . . . 21 ILE HD1# . 11010 1 200 . 1 1 21 21 ILE HG21 H 1 0.71 0.0 . 1 . . . . 21 ILE HG2# . 11010 1 201 . 1 1 21 21 ILE HG22 H 1 0.71 0.0 . 1 . . . . 21 ILE HG2# . 11010 1 202 . 1 1 21 21 ILE HG23 H 1 0.71 0.0 . 1 . . . . 21 ILE HG2# . 11010 1 203 . 1 1 21 21 ILE C C 13 179.669 0.0 . 1 . . . . 21 ILE CO . 11010 1 204 . 1 1 21 21 ILE CA C 13 65.014 0.0 . 1 . . . . 21 ILE CA . 11010 1 205 . 1 1 21 21 ILE CD1 C 13 13.38975 0.0 . 1 . . . . 21 ILE CD1 . 11010 1 206 . 1 1 21 21 ILE CG2 C 13 17.517 0.0 . 1 . . . . 21 ILE CG2 . 11010 1 207 . 1 1 21 21 ILE N N 15 121.158 0.0 . 1 . . . . 21 ILE N . 11010 1 208 . 1 1 22 22 SER H H 1 8.86 0.0 . 1 . . . . 22 SER HN . 11010 1 209 . 1 1 22 22 SER HA H 1 4.2 0.0 . 1 . . . . 22 SER HA . 11010 1 210 . 1 1 22 22 SER HB2 H 1 3.956 0.0 . 2 . . . . 22 SER HB# . 11010 1 211 . 1 1 22 22 SER HG H 1 5.089 0.0 . 1 . . . . 22 SER HG . 11010 1 212 . 1 1 22 22 SER C C 13 177.38 0.0 . 1 . . . . 22 SER CO . 11010 1 213 . 1 1 22 22 SER CA C 13 61.579 0.0 . 1 . . . . 22 SER CA . 11010 1 214 . 1 1 22 22 SER CB C 13 63.932 0.0 . 1 . . . . 22 SER CB . 11010 1 215 . 1 1 22 22 SER N N 15 118.94 0.0 . 1 . . . . 22 SER N . 11010 1 216 . 1 1 23 23 TYR H H 1 7.766 0.0 . 1 . . . . 23 TYR HN . 11010 1 217 . 1 1 23 23 TYR HA H 1 4.121 0.0 . 1 . . . . 23 TYR HA . 11010 1 218 . 1 1 23 23 TYR HB2 H 1 2.902021 0.0 . 2 . . . . 23 TYR HB# . 11010 1 219 . 1 1 23 23 TYR HD1 H 1 6.232 0.0 . 3 . . . . 23 TYR HD# . 11010 1 220 . 1 1 23 23 TYR HE1 H 1 6.235 0.0 . 3 . . . . 23 TYR HE# . 11010 1 221 . 1 1 23 23 TYR C C 13 177.15 0.0 . 1 . . . . 23 TYR CO . 11010 1 222 . 1 1 23 23 TYR CA C 13 60.735 0.0 . 1 . . . . 23 TYR CA . 11010 1 223 . 1 1 23 23 TYR CB C 13 39.38 0.0 . 1 . . . . 23 TYR CB . 11010 1 224 . 1 1 23 23 TYR CD1 C 13 132.266 0.0 . 3 . . . . 23 TYR CD# . 11010 1 225 . 1 1 23 23 TYR CE1 C 13 118.253 0.0 . 3 . . . . 23 TYR CE# . 11010 1 226 . 1 1 23 23 TYR N N 15 116.749 0.0 . 1 . . . . 23 TYR N . 11010 1 227 . 1 1 24 24 THR H H 1 7.643 0.0 . 1 . . . . 24 THR HN . 11010 1 228 . 1 1 24 24 THR HA H 1 3.564 0.0 . 1 . . . . 24 THR HA . 11010 1 229 . 1 1 24 24 THR HB H 1 4.046236 0.0 . 1 . . . . 24 THR HB . 11010 1 230 . 1 1 24 24 THR HG1 H 1 4.188 0.0 . 1 . . . . 24 THR HG1 . 11010 1 231 . 1 1 24 24 THR HG21 H 1 0.999 0.0 . 1 . . . . 24 THR HG2# . 11010 1 232 . 1 1 24 24 THR HG22 H 1 0.999 0.0 . 1 . . . . 24 THR HG2# . 11010 1 233 . 1 1 24 24 THR HG23 H 1 0.999 0.0 . 1 . . . . 24 THR HG2# . 11010 1 234 . 1 1 24 24 THR C C 13 176.794 0.0 . 1 . . . . 24 THR CO . 11010 1 235 . 1 1 24 24 THR CA C 13 64.257 0.0 . 1 . . . . 24 THR CA . 11010 1 236 . 1 1 24 24 THR CB C 13 69.954 0.0 . 1 . . . . 24 THR CB . 11010 1 237 . 1 1 24 24 THR CG2 C 13 23.308 0.0 . 1 . . . . 24 THR CG2 . 11010 1 238 . 1 1 24 24 THR N N 15 104.957 0.0 . 1 . . . . 24 THR N . 11010 1 239 . 1 1 25 25 THR H H 1 8.1 0.0 . 1 . . . . 25 THR HN . 11010 1 240 . 1 1 25 25 THR HA H 1 4.497418 0.0 . 1 . . . . 25 THR HA . 11010 1 241 . 1 1 25 25 THR HB H 1 4.21 0.0 . 1 . . . . 25 THR HB . 11010 1 242 . 1 1 25 25 THR HG1 H 1 4.218 0.0 . 1 . . . . 25 THR HG1 . 11010 1 243 . 1 1 25 25 THR HG21 H 1 1.154 0.0 . 1 . . . . 25 THR HG2# . 11010 1 244 . 1 1 25 25 THR HG22 H 1 1.154 0.0 . 1 . . . . 25 THR HG2# . 11010 1 245 . 1 1 25 25 THR HG23 H 1 1.154 0.0 . 1 . . . . 25 THR HG2# . 11010 1 246 . 1 1 25 25 THR C C 13 175.245 0.0 . 1 . . . . 25 THR CO . 11010 1 247 . 1 1 25 25 THR CA C 13 62.11 0.0 . 1 . . . . 25 THR CA . 11010 1 248 . 1 1 25 25 THR CB C 13 72.062 0.0 . 1 . . . . 25 THR CB . 11010 1 249 . 1 1 25 25 THR CG2 C 13 21.067 0.0 . 1 . . . . 25 THR CG2 . 11010 1 250 . 1 1 25 25 THR N N 15 109.652 0.0 . 1 . . . . 25 THR N . 11010 1 251 . 1 1 26 26 ASN H H 1 7.531 0.0 . 1 . . . . 26 ASN HN . 11010 1 252 . 1 1 26 26 ASN HA H 1 4.431 0.0 . 1 . . . . 26 ASN HA . 11010 1 253 . 1 1 26 26 ASN HB2 H 1 2.789 0.0 . 1 . . . . 26 ASN HB1 . 11010 1 254 . 1 1 26 26 ASN HB3 H 1 3.041 0.0 . 1 . . . . 26 ASN HB2 . 11010 1 255 . 1 1 26 26 ASN HD21 H 1 6.71 0.0 . 1 . . . . 26 ASN HD21 . 11010 1 256 . 1 1 26 26 ASN HD22 H 1 7.368 0.0 . 1 . . . . 26 ASN HD22 . 11010 1 257 . 1 1 26 26 ASN C C 13 173.085 0.0 . 1 . . . . 26 ASN CO . 11010 1 258 . 1 1 26 26 ASN CA C 13 55.048 0.0 . 1 . . . . 26 ASN CA . 11010 1 259 . 1 1 26 26 ASN CB C 13 38.02 0.0 . 1 . . . . 26 ASN CB . 11010 1 260 . 1 1 26 26 ASN N N 15 116.05 0.0 . 1 . . . . 26 ASN N . 11010 1 261 . 1 1 26 26 ASN ND2 N 15 112.28 0.0 . 1 . . . . 26 ASN ND2 . 11010 1 262 . 1 1 27 27 ALA H H 1 7.607 0.0 . 1 . . . . 27 ALA HN . 11010 1 263 . 1 1 27 27 ALA HA H 1 4.426 0.0 . 1 . . . . 27 ALA HA . 11010 1 264 . 1 1 27 27 ALA C C 13 174.313 0.0 . 1 . . . . 27 ALA CO . 11010 1 265 . 1 1 27 27 ALA CA C 13 51.364 0.0 . 1 . . . . 27 ALA CA . 11010 1 266 . 1 1 27 27 ALA CB C 13 21.397 0.0 . 1 . . . . 27 ALA CB . 11010 1 267 . 1 1 27 27 ALA N N 15 120.359 0.0 . 1 . . . . 27 ALA N . 11010 1 268 . 1 1 28 28 PHE H H 1 8.33 0.0 . 1 . . . . 28 PHE HN . 11010 1 269 . 1 1 28 28 PHE HA H 1 4.724 0.0 . 1 . . . . 28 PHE HA . 11010 1 270 . 1 1 28 28 PHE HB2 H 1 2.764 0.0 . 1 . . . . 28 PHE HB1 . 11010 1 271 . 1 1 28 28 PHE HB3 H 1 3.012 0.0 . 1 . . . . 28 PHE HB2 . 11010 1 272 . 1 1 28 28 PHE HD1 H 1 6.811 0.0 . 3 . . . . 28 PHE HD# . 11010 1 273 . 1 1 28 28 PHE HE1 H 1 6.615 0.0 . 3 . . . . 28 PHE HE# . 11010 1 274 . 1 1 28 28 PHE C C 13 175.236 0.0 . 1 . . . . 28 PHE CO . 11010 1 275 . 1 1 28 28 PHE CA C 13 55.197 0.0 . 1 . . . . 28 PHE CA . 11010 1 276 . 1 1 28 28 PHE CB C 13 40.315 0.0 . 1 . . . . 28 PHE CB . 11010 1 277 . 1 1 28 28 PHE CD1 C 13 131.74 0.0 . 3 . . . . 28 PHE CD# . 11010 1 278 . 1 1 28 28 PHE CE1 C 13 130.544 0.0 . 3 . . . . 28 PHE CE# . 11010 1 279 . 1 1 28 28 PHE N N 15 122.723 0.0 . 1 . . . . 28 PHE N . 11010 1 280 . 1 1 29 29 PRO HD2 H 1 3.242 0.0 . 2 . . . . 29 PRO HD# . 11010 1 281 . 1 1 29 29 PRO HG2 H 1 2.336 0.0 . 2 . . . . 29 PRO HG# . 11010 1 282 . 1 1 29 29 PRO CA C 13 63.816 0.0 . 1 . . . . 29 PRO CA . 11010 1 283 . 1 1 29 29 PRO CB C 13 32.111 0.0 . 1 . . . . 29 PRO CB . 11010 1 284 . 1 1 29 29 PRO CD C 13 51.102 0.0 . 1 . . . . 29 PRO CD . 11010 1 285 . 1 1 29 29 PRO CG C 13 27.204 0.0 . 1 . . . . 29 PRO CG . 11010 1 286 . 1 1 30 30 GLY H H 1 8.345 0.0 . 1 . . . . 30 GLY HN . 11010 1 287 . 1 1 30 30 GLY CA C 13 45.28657 0.0 . 1 . . . . 30 GLY CA . 11010 1 288 . 1 1 30 30 GLY N N 15 108.5593 0.0 . 1 . . . . 30 GLY N . 11010 1 289 . 1 1 31 31 GLU H H 1 8.156 0.0 . 1 . . . . 31 GLU HN . 11010 1 290 . 1 1 31 31 GLU HA H 1 4.250878 0.0 . 1 . . . . 31 GLU HA . 11010 1 291 . 1 1 31 31 GLU HB2 H 1 1.866472 0.0 . 2 . . . . 31 GLU HB# . 11010 1 292 . 1 1 31 31 GLU HG2 H 1 2.032 0.0 . 2 . . . . 31 GLU HG# . 11010 1 293 . 1 1 31 31 GLU CG C 13 36.071 0.0 . 1 . . . . 31 GLU CG . 11010 1 294 . 1 1 31 31 GLU N N 15 121.295 0.0 . 1 . . . . 31 GLU N . 11010 1 295 . 1 1 32 32 TYR HB2 H 1 2.786 0.0 . 1 . . . . 32 TYR HB1 . 11010 1 296 . 1 1 32 32 TYR HB3 H 1 2.9 0.0 . 1 . . . . 32 TYR HB2 . 11010 1 297 . 1 1 32 32 TYR HD1 H 1 6.966 0.0 . 3 . . . . 32 TYR HD# . 11010 1 298 . 1 1 32 32 TYR HE1 H 1 6.701 0.0 . 3 . . . . 32 TYR HE# . 11010 1 299 . 1 1 32 32 TYR CD1 C 13 133.069 0.0 . 3 . . . . 32 TYR CD# . 11010 1 300 . 1 1 32 32 TYR CE1 C 13 118.062 0.0 . 3 . . . . 32 TYR CE# . 11010 1 301 . 1 1 33 33 ILE HA H 1 4.182 0.0 . 1 . . . . 33 ILE HA . 11010 1 302 . 1 1 33 33 ILE HB H 1 1.551999 0.0 . 1 . . . . 33 ILE HB . 11010 1 303 . 1 1 33 33 ILE HD11 H 1 0.637 0.0 . 1 . . . . 33 ILE HD1# . 11010 1 304 . 1 1 33 33 ILE HD12 H 1 0.637 0.0 . 1 . . . . 33 ILE HD1# . 11010 1 305 . 1 1 33 33 ILE HD13 H 1 0.637 0.0 . 1 . . . . 33 ILE HD1# . 11010 1 306 . 1 1 33 33 ILE HG12 H 1 0.71 0.0 . 1 . . . . 33 ILE HG11 . 11010 1 307 . 1 1 33 33 ILE HG13 H 1 1.263 0.0 . 1 . . . . 33 ILE HG12 . 11010 1 308 . 1 1 33 33 ILE HG21 H 1 0.745 0.0 . 1 . . . . 33 ILE HG2# . 11010 1 309 . 1 1 33 33 ILE HG22 H 1 0.745 0.0 . 1 . . . . 33 ILE HG2# . 11010 1 310 . 1 1 33 33 ILE HG23 H 1 0.745 0.0 . 1 . . . . 33 ILE HG2# . 11010 1 311 . 1 1 33 33 ILE CA C 13 57.773 0.0 . 1 . . . . 33 ILE CA . 11010 1 312 . 1 1 33 33 ILE CB C 13 39.55 0.0 . 1 . . . . 33 ILE CB . 11010 1 313 . 1 1 33 33 ILE CD1 C 13 13.445 0.0 . 1 . . . . 33 ILE CD1 . 11010 1 314 . 1 1 33 33 ILE CG1 C 13 27.306 0.0 . 1 . . . . 33 ILE CG1 . 11010 1 315 . 1 1 33 33 ILE CG2 C 13 17.604 0.0 . 1 . . . . 33 ILE CG2 . 11010 1 316 . 1 1 34 34 PRO HD2 H 1 3.484 0.0 . 1 . . . . 34 PRO HD1 . 11010 1 317 . 1 1 34 34 PRO CD C 13 50.312 0.0 . 1 . . . . 34 PRO CD . 11010 1 318 . 1 1 36 36 VAL HB H 1 1.731 0.0 . 1 . . . . 36 VAL HB . 11010 1 319 . 1 1 36 36 VAL HG11 H 1 0.6256085 0.0 . 1 . . . . 36 VAL HG1# . 11010 1 320 . 1 1 36 36 VAL HG12 H 1 0.6256085 0.0 . 1 . . . . 36 VAL HG1# . 11010 1 321 . 1 1 36 36 VAL HG13 H 1 0.6256085 0.0 . 1 . . . . 36 VAL HG1# . 11010 1 322 . 1 1 36 36 VAL HG21 H 1 0.6239656 0.0 . 1 . . . . 36 VAL HG2# . 11010 1 323 . 1 1 36 36 VAL HG22 H 1 0.6239656 0.0 . 1 . . . . 36 VAL HG2# . 11010 1 324 . 1 1 36 36 VAL HG23 H 1 0.6239656 0.0 . 1 . . . . 36 VAL HG2# . 11010 1 325 . 1 1 36 36 VAL CB C 13 33.50074 0.0 . 1 . . . . 36 VAL CB . 11010 1 326 . 1 1 36 36 VAL CG1 C 13 20.22027 0.0 . 1 . . . . 36 VAL CG1 . 11010 1 327 . 1 1 36 36 VAL CG2 C 13 21.44504 0.0 . 1 . . . . 36 VAL CG2 . 11010 1 328 . 1 1 37 37 PHE HD1 H 1 7.13627 0.0 . 3 . . . . 37 PHE HD# . 11010 1 329 . 1 1 37 37 PHE CD1 C 13 131.136 0.0 . 3 . . . . 37 PHE CD# . 11010 1 330 . 1 1 40 40 TYR HD1 H 1 6.827 0.0 . 3 . . . . 40 TYR HD# . 11010 1 331 . 1 1 40 40 TYR HE1 H 1 6.536 0.0 . 3 . . . . 40 TYR HE# . 11010 1 332 . 1 1 40 40 TYR CD1 C 13 133.087 0.0 . 3 . . . . 40 TYR CD# . 11010 1 333 . 1 1 40 40 TYR CE1 C 13 117.741 0.0 . 3 . . . . 40 TYR CE# . 11010 1 334 . 1 1 41 41 SER HA H 1 5.433 0.0 . 1 . . . . 41 SER HA . 11010 1 335 . 1 1 41 41 SER HB2 H 1 3.568 0.0 . 1 . . . . 41 SER HB1 . 11010 1 336 . 1 1 41 41 SER HB3 H 1 3.651 0.0 . 1 . . . . 41 SER HB2 . 11010 1 337 . 1 1 41 41 SER C C 13 172.583 0.0 . 1 . . . . 41 SER CO . 11010 1 338 . 1 1 41 41 SER CA C 13 57.291 0.0 . 1 . . . . 41 SER CA . 11010 1 339 . 1 1 41 41 SER CB C 13 65.602 0.0 . 1 . . . . 41 SER CB . 11010 1 340 . 1 1 42 42 ALA H H 1 8.794 0.0 . 1 . . . . 42 ALA HN . 11010 1 341 . 1 1 42 42 ALA HA H 1 4.483 0.0 . 1 . . . . 42 ALA HA . 11010 1 342 . 1 1 42 42 ALA HB1 H 1 1.131 0.0 . 1 . . . . 42 ALA HB# . 11010 1 343 . 1 1 42 42 ALA HB2 H 1 1.131 0.0 . 1 . . . . 42 ALA HB# . 11010 1 344 . 1 1 42 42 ALA HB3 H 1 1.131 0.0 . 1 . . . . 42 ALA HB# . 11010 1 345 . 1 1 42 42 ALA C C 13 174.746 0.0 . 1 . . . . 42 ALA CO . 11010 1 346 . 1 1 42 42 ALA CA C 13 51.056 0.0 . 1 . . . . 42 ALA CA . 11010 1 347 . 1 1 42 42 ALA CB C 13 22.419 0.0 . 1 . . . . 42 ALA CB . 11010 1 348 . 1 1 42 42 ALA N N 15 124.332 0.0 . 1 . . . . 42 ALA N . 11010 1 349 . 1 1 43 43 ASN H H 1 8.497 0.0 . 1 . . . . 43 ASN HN . 11010 1 350 . 1 1 43 43 ASN HA H 1 5.496 0.0 . 1 . . . . 43 ASN HA . 11010 1 351 . 1 1 43 43 ASN HB2 H 1 2.267 0.0 . 1 . . . . 43 ASN HB1 . 11010 1 352 . 1 1 43 43 ASN HB3 H 1 2.48 0.0 . 1 . . . . 43 ASN HB2 . 11010 1 353 . 1 1 43 43 ASN HD21 H 1 6.443 0.0 . 1 . . . . 43 ASN HD21 . 11010 1 354 . 1 1 43 43 ASN HD22 H 1 7.174 0.0 . 1 . . . . 43 ASN HD22 . 11010 1 355 . 1 1 43 43 ASN C C 13 174.531 0.0 . 1 . . . . 43 ASN CO . 11010 1 356 . 1 1 43 43 ASN CA C 13 52.589 0.0 . 1 . . . . 43 ASN CA . 11010 1 357 . 1 1 43 43 ASN CB C 13 38.855 0.0 . 1 . . . . 43 ASN CB . 11010 1 358 . 1 1 43 43 ASN N N 15 121.005 0.0 . 1 . . . . 43 ASN N . 11010 1 359 . 1 1 43 43 ASN ND2 N 15 110.58 0.0 . 1 . . . . 43 ASN ND2 . 11010 1 360 . 1 1 44 44 VAL H H 1 8.935 0.0 . 1 . . . . 44 VAL HN . 11010 1 361 . 1 1 44 44 VAL HA H 1 4.406 0.0 . 1 . . . . 44 VAL HA . 11010 1 362 . 1 1 44 44 VAL HB H 1 1.884 0.0 . 1 . . . . 44 VAL HB . 11010 1 363 . 1 1 44 44 VAL HG11 H 1 0.766 0.0 . 1 . . . . 44 VAL HG1# . 11010 1 364 . 1 1 44 44 VAL HG12 H 1 0.766 0.0 . 1 . . . . 44 VAL HG1# . 11010 1 365 . 1 1 44 44 VAL HG13 H 1 0.766 0.0 . 1 . . . . 44 VAL HG1# . 11010 1 366 . 1 1 44 44 VAL HG21 H 1 0.802 0.0 . 1 . . . . 44 VAL HG2# . 11010 1 367 . 1 1 44 44 VAL HG22 H 1 0.802 0.0 . 1 . . . . 44 VAL HG2# . 11010 1 368 . 1 1 44 44 VAL HG23 H 1 0.802 0.0 . 1 . . . . 44 VAL HG2# . 11010 1 369 . 1 1 44 44 VAL C C 13 173.924 0.0 . 1 . . . . 44 VAL CO . 11010 1 370 . 1 1 44 44 VAL CA C 13 60.307 0.0 . 1 . . . . 44 VAL CA . 11010 1 371 . 1 1 44 44 VAL CB C 13 35.835 0.0 . 1 . . . . 44 VAL CB . 11010 1 372 . 1 1 44 44 VAL CG1 C 13 20.333 0.0 . 1 . . . . 44 VAL CG1 . 11010 1 373 . 1 1 44 44 VAL CG2 C 13 21.44 0.0 . 1 . . . . 44 VAL CG2 . 11010 1 374 . 1 1 44 44 VAL N N 15 122.258 0.0 . 1 . . . . 44 VAL N . 11010 1 375 . 1 1 45 45 MET H H 1 8.38 0.0 . 1 . . . . 45 MET HN . 11010 1 376 . 1 1 45 45 MET HA H 1 5.074 0.0 . 1 . . . . 45 MET HA . 11010 1 377 . 1 1 45 45 MET HB2 H 1 1.75 0.0 . 1 . . . . 45 MET HB1 . 11010 1 378 . 1 1 45 45 MET HB3 H 1 1.823 0.0 . 1 . . . . 45 MET HB2 . 11010 1 379 . 1 1 45 45 MET HE1 H 1 1.748 0.0 . 1 . . . . 45 MET HE# . 11010 1 380 . 1 1 45 45 MET HE2 H 1 1.748 0.0 . 1 . . . . 45 MET HE# . 11010 1 381 . 1 1 45 45 MET HE3 H 1 1.748 0.0 . 1 . . . . 45 MET HE# . 11010 1 382 . 1 1 45 45 MET HG2 H 1 2.221791 0.0 . 1 . . . . 45 MET HG1 . 11010 1 383 . 1 1 45 45 MET HG3 H 1 2.274 0.0 . 1 . . . . 45 MET HG2 . 11010 1 384 . 1 1 45 45 MET C C 13 176.144 0.0 . 1 . . . . 45 MET CO . 11010 1 385 . 1 1 45 45 MET CA C 13 53.724 0.0 . 1 . . . . 45 MET CA . 11010 1 386 . 1 1 45 45 MET CB C 13 33.189 0.0 . 1 . . . . 45 MET CB . 11010 1 387 . 1 1 45 45 MET CE C 13 16.497 0.0 . 1 . . . . 45 MET CE . 11010 1 388 . 1 1 45 45 MET CG C 13 31.786 0.0 . 1 . . . . 45 MET CG . 11010 1 389 . 1 1 45 45 MET N N 15 122.977 0.0 . 1 . . . . 45 MET N . 11010 1 390 . 1 1 46 46 VAL H H 1 8.679 0.0 . 1 . . . . 46 VAL HN . 11010 1 391 . 1 1 46 46 VAL HA H 1 4.101 0.0 . 1 . . . . 46 VAL HA . 11010 1 392 . 1 1 46 46 VAL HB H 1 1.745 0.0 . 1 . . . . 46 VAL HB . 11010 1 393 . 1 1 46 46 VAL HG11 H 1 0.713 0.0 . 1 . . . . 46 VAL HG1# . 11010 1 394 . 1 1 46 46 VAL HG12 H 1 0.713 0.0 . 1 . . . . 46 VAL HG1# . 11010 1 395 . 1 1 46 46 VAL HG13 H 1 0.713 0.0 . 1 . . . . 46 VAL HG1# . 11010 1 396 . 1 1 46 46 VAL HG21 H 1 0.821 0.0 . 1 . . . . 46 VAL HG2# . 11010 1 397 . 1 1 46 46 VAL HG22 H 1 0.821 0.0 . 1 . . . . 46 VAL HG2# . 11010 1 398 . 1 1 46 46 VAL HG23 H 1 0.821 0.0 . 1 . . . . 46 VAL HG2# . 11010 1 399 . 1 1 46 46 VAL C C 13 175.118 0.0 . 1 . . . . 46 VAL CO . 11010 1 400 . 1 1 46 46 VAL CA C 13 61.501 0.0 . 1 . . . . 46 VAL CA . 11010 1 401 . 1 1 46 46 VAL CB C 13 34.39738 0.0 . 1 . . . . 46 VAL CB . 11010 1 402 . 1 1 46 46 VAL CG1 C 13 20.836 0.0 . 1 . . . . 46 VAL CG1 . 11010 1 403 . 1 1 46 46 VAL CG2 C 13 17.49 0.0 . 1 . . . . 46 VAL CG2 . 11010 1 404 . 1 1 46 46 VAL N N 15 125.627 0.0 . 1 . . . . 46 VAL N . 11010 1 405 . 1 1 47 47 ASP H H 1 9.196 0.0 . 1 . . . . 47 ASP HN . 11010 1 406 . 1 1 47 47 ASP HA H 1 4.13 0.0 . 1 . . . . 47 ASP HA . 11010 1 407 . 1 1 47 47 ASP HB2 H 1 2.577258 0.0 . 1 . . . . 47 ASP HB1 . 11010 1 408 . 1 1 47 47 ASP HB3 H 1 2.778593 0.0 . 1 . . . . 47 ASP HB2 . 11010 1 409 . 1 1 47 47 ASP C C 13 176.181 0.0 . 1 . . . . 47 ASP CO . 11010 1 410 . 1 1 47 47 ASP CA C 13 55.3066 0.0 . 1 . . . . 47 ASP CA . 11010 1 411 . 1 1 47 47 ASP CB C 13 39.181 0.0 . 1 . . . . 47 ASP CB . 11010 1 412 . 1 1 47 47 ASP N N 15 127 0.0 . 1 . . . . 47 ASP N . 11010 1 413 . 1 1 48 48 GLY H H 1 8.425 0.0 . 1 . . . . 48 GLY HN . 11010 1 414 . 1 1 48 48 GLY HA2 H 1 3.494 0.0 . 1 . . . . 48 GLY HA1 . 11010 1 415 . 1 1 48 48 GLY HA3 H 1 4.055 0.0 . 1 . . . . 48 GLY HA2 . 11010 1 416 . 1 1 48 48 GLY C C 13 173.625 0.0 . 1 . . . . 48 GLY CO . 11010 1 417 . 1 1 48 48 GLY CA C 13 45.324 0.0 . 1 . . . . 48 GLY CA . 11010 1 418 . 1 1 48 48 GLY N N 15 101.975 0.0 . 1 . . . . 48 GLY N . 11010 1 419 . 1 1 49 49 LYS H H 1 7.936 0.0 . 1 . . . . 49 LYS HN . 11010 1 420 . 1 1 49 49 LYS HA H 1 4.805 0.0 . 1 . . . . 49 LYS HA . 11010 1 421 . 1 1 49 49 LYS HB2 H 1 1.718 0.0 . 1 . . . . 49 LYS HB1 . 11010 1 422 . 1 1 49 49 LYS HB3 H 1 1.767 0.0 . 1 . . . . 49 LYS HB2 . 11010 1 423 . 1 1 49 49 LYS HD2 H 1 1.566 0.0 . 1 . . . . 49 LYS HD1 . 11010 1 424 . 1 1 49 49 LYS HD3 H 1 1.615 0.0 . 1 . . . . 49 LYS HD2 . 11010 1 425 . 1 1 49 49 LYS HE2 H 1 2.956 0.0 . 2 . . . . 49 LYS HE# . 11010 1 426 . 1 1 49 49 LYS HG2 H 1 1.313 0.0 . 2 . . . . 49 LYS HG# . 11010 1 427 . 1 1 49 49 LYS C C 13 173.54 0.0 . 1 . . . . 49 LYS CO . 11010 1 428 . 1 1 49 49 LYS CA C 13 52.616 0.0 . 1 . . . . 49 LYS CA . 11010 1 429 . 1 1 49 49 LYS CB C 13 33.31556 0.0 . 1 . . . . 49 LYS CB . 11010 1 430 . 1 1 49 49 LYS CD C 13 29.089 0.0 . 1 . . . . 49 LYS CD . 11010 1 431 . 1 1 49 49 LYS CE C 13 42.254 0.0 . 1 . . . . 49 LYS CE . 11010 1 432 . 1 1 49 49 LYS CG C 13 24.48 0.0 . 1 . . . . 49 LYS CG . 11010 1 433 . 1 1 49 49 LYS N N 15 121.892 0.0 . 1 . . . . 49 LYS N . 11010 1 434 . 1 1 50 50 PRO HA H 1 4.801 0.0 . 1 . . . . 50 PRO HA . 11010 1 435 . 1 1 50 50 PRO HB2 H 1 1.80801 0.0 . 2 . . . . 50 PRO HB# . 11010 1 436 . 1 1 50 50 PRO HD2 H 1 3.599427 0.0 . 1 . . . . 50 PRO HD1 . 11010 1 437 . 1 1 50 50 PRO HD3 H 1 3.651547 0.0 . 1 . . . . 50 PRO HD2 . 11010 1 438 . 1 1 50 50 PRO C C 13 176.712 0.0 . 1 . . . . 50 PRO CO . 11010 1 439 . 1 1 50 50 PRO CA C 13 62.383 0.0 . 1 . . . . 50 PRO CA . 11010 1 440 . 1 1 50 50 PRO CB C 13 32.09829 0.0 . 1 . . . . 50 PRO CB . 11010 1 441 . 1 1 50 50 PRO CD C 13 50.25133 0.0 . 1 . . . . 50 PRO CD . 11010 1 442 . 1 1 51 51 VAL H H 1 9.083 0.0 . 1 . . . . 51 VAL HN . 11010 1 443 . 1 1 51 51 VAL HA H 1 4.487 0.0 . 1 . . . . 51 VAL HA . 11010 1 444 . 1 1 51 51 VAL HB H 1 1.941 0.0 . 1 . . . . 51 VAL HB . 11010 1 445 . 1 1 51 51 VAL HG11 H 1 0.755 0.0 . 1 . . . . 51 VAL HG1# . 11010 1 446 . 1 1 51 51 VAL HG12 H 1 0.755 0.0 . 1 . . . . 51 VAL HG1# . 11010 1 447 . 1 1 51 51 VAL HG13 H 1 0.755 0.0 . 1 . . . . 51 VAL HG1# . 11010 1 448 . 1 1 51 51 VAL HG21 H 1 0.799 0.0 . 1 . . . . 51 VAL HG2# . 11010 1 449 . 1 1 51 51 VAL HG22 H 1 0.799 0.0 . 1 . . . . 51 VAL HG2# . 11010 1 450 . 1 1 51 51 VAL HG23 H 1 0.799 0.0 . 1 . . . . 51 VAL HG2# . 11010 1 451 . 1 1 51 51 VAL C C 13 174.227 0.0 . 1 . . . . 51 VAL CO . 11010 1 452 . 1 1 51 51 VAL CA C 13 60.721 0.0 . 1 . . . . 51 VAL CA . 11010 1 453 . 1 1 51 51 VAL CB C 13 35.849 0.0 . 1 . . . . 51 VAL CB . 11010 1 454 . 1 1 51 51 VAL CG1 C 13 21.4 0.0 . 1 . . . . 51 VAL CG1 . 11010 1 455 . 1 1 51 51 VAL CG2 C 13 21.349 0.0 . 1 . . . . 51 VAL CG2 . 11010 1 456 . 1 1 51 51 VAL N N 15 122.914 0.0 . 1 . . . . 51 VAL N . 11010 1 457 . 1 1 52 52 ASN H H 1 8.573 0.0 . 1 . . . . 52 ASN HN . 11010 1 458 . 1 1 52 52 ASN HA H 1 5.127 0.0 . 1 . . . . 52 ASN HA . 11010 1 459 . 1 1 52 52 ASN HB2 H 1 2.618 0.0 . 1 . . . . 52 ASN HB1 . 11010 1 460 . 1 1 52 52 ASN HB3 H 1 2.681026 0.0 . 1 . . . . 52 ASN HB2 . 11010 1 461 . 1 1 52 52 ASN HD21 H 1 6.575 0.0 . 1 . . . . 52 ASN HD21 . 11010 1 462 . 1 1 52 52 ASN HD22 H 1 7.345 0.0 . 1 . . . . 52 ASN HD22 . 11010 1 463 . 1 1 52 52 ASN C C 13 173.355 0.0 . 1 . . . . 52 ASN CO . 11010 1 464 . 1 1 52 52 ASN CA C 13 52.422 0.0 . 1 . . . . 52 ASN CA . 11010 1 465 . 1 1 52 52 ASN CB C 13 39.542 0.0 . 1 . . . . 52 ASN CB . 11010 1 466 . 1 1 52 52 ASN CG C 13 176.507 0.0 . 1 . . . . 52 ASN CG . 11010 1 467 . 1 1 52 52 ASN N N 15 123.85 0.0 . 1 . . . . 52 ASN N . 11010 1 468 . 1 1 52 52 ASN ND2 N 15 109.8431 0.0 . 1 . . . . 52 ASN ND2 . 11010 1 469 . 1 1 53 53 LEU H H 1 9.137 0.0 . 1 . . . . 53 LEU HN . 11010 1 470 . 1 1 53 53 LEU HA H 1 4.701 0.0 . 1 . . . . 53 LEU HA . 11010 1 471 . 1 1 53 53 LEU HB2 H 1 1.136 0.0 . 1 . . . . 53 LEU HB1 . 11010 1 472 . 1 1 53 53 LEU HB3 H 1 2.09 0.0 . 1 . . . . 53 LEU HB2 . 11010 1 473 . 1 1 53 53 LEU HD11 H 1 0.762 0.0 . 1 . . . . 53 LEU HD1# . 11010 1 474 . 1 1 53 53 LEU HD12 H 1 0.762 0.0 . 1 . . . . 53 LEU HD1# . 11010 1 475 . 1 1 53 53 LEU HD13 H 1 0.762 0.0 . 1 . . . . 53 LEU HD1# . 11010 1 476 . 1 1 53 53 LEU HD21 H 1 0.8963309 0.0 . 1 . . . . 53 LEU HD2# . 11010 1 477 . 1 1 53 53 LEU HD22 H 1 0.8963309 0.0 . 1 . . . . 53 LEU HD2# . 11010 1 478 . 1 1 53 53 LEU HD23 H 1 0.8963309 0.0 . 1 . . . . 53 LEU HD2# . 11010 1 479 . 1 1 53 53 LEU HG H 1 1.383 0.0 . 1 . . . . 53 LEU HG . 11010 1 480 . 1 1 53 53 LEU C C 13 174.169 0.0 . 1 . . . . 53 LEU CO . 11010 1 481 . 1 1 53 53 LEU CA C 13 54.09009 0.0 . 1 . . . . 53 LEU CA . 11010 1 482 . 1 1 53 53 LEU CB C 13 44.077 0.0 . 1 . . . . 53 LEU CB . 11010 1 483 . 1 1 53 53 LEU CD1 C 13 23.536 0.0 . 1 . . . . 53 LEU CD1 . 11010 1 484 . 1 1 53 53 LEU CD2 C 13 26.80015 0.0 . 1 . . . . 53 LEU CD2 . 11010 1 485 . 1 1 53 53 LEU CG C 13 27.174 0.0 . 1 . . . . 53 LEU CG . 11010 1 486 . 1 1 53 53 LEU N N 15 128.902 0.0 . 1 . . . . 53 LEU N . 11010 1 487 . 1 1 54 54 GLY H H 1 9.47 0.0 . 1 . . . . 54 GLY HN . 11010 1 488 . 1 1 54 54 GLY HA2 H 1 3.67 0.0 . 2 . . . . 54 GLY HA# . 11010 1 489 . 1 1 54 54 GLY C C 13 172.592 0.0 . 1 . . . . 54 GLY CO . 11010 1 490 . 1 1 54 54 GLY CA C 13 45.379 0.0 . 1 . . . . 54 GLY CA . 11010 1 491 . 1 1 54 54 GLY N N 15 116.315 0.0 . 1 . . . . 54 GLY N . 11010 1 492 . 1 1 55 55 LEU H H 1 8.769 0.0 . 1 . . . . 55 LEU HN . 11010 1 493 . 1 1 55 55 LEU HA H 1 5.215 0.0 . 1 . . . . 55 LEU HA . 11010 1 494 . 1 1 55 55 LEU HB2 H 1 1.321 0.0 . 2 . . . . 55 LEU HB# . 11010 1 495 . 1 1 55 55 LEU HD11 H 1 0.579 0.0 . 1 . . . . 55 LEU HD1# . 11010 1 496 . 1 1 55 55 LEU HD12 H 1 0.579 0.0 . 1 . . . . 55 LEU HD1# . 11010 1 497 . 1 1 55 55 LEU HD13 H 1 0.579 0.0 . 1 . . . . 55 LEU HD1# . 11010 1 498 . 1 1 55 55 LEU HD21 H 1 0.808 0.0 . 1 . . . . 55 LEU HD2# . 11010 1 499 . 1 1 55 55 LEU HD22 H 1 0.808 0.0 . 1 . . . . 55 LEU HD2# . 11010 1 500 . 1 1 55 55 LEU HD23 H 1 0.808 0.0 . 1 . . . . 55 LEU HD2# . 11010 1 501 . 1 1 55 55 LEU HG H 1 1.497 0.0 . 1 . . . . 55 LEU HG . 11010 1 502 . 1 1 55 55 LEU C C 13 175.264 0.0 . 1 . . . . 55 LEU CO . 11010 1 503 . 1 1 55 55 LEU CA C 13 53.72 0.0 . 1 . . . . 55 LEU CA . 11010 1 504 . 1 1 55 55 LEU CB C 13 44.436 0.0 . 1 . . . . 55 LEU CB . 11010 1 505 . 1 1 55 55 LEU CD1 C 13 25.43 0.0 . 1 . . . . 55 LEU CD1 . 11010 1 506 . 1 1 55 55 LEU CD2 C 13 24.83 0.0 . 1 . . . . 55 LEU CD2 . 11010 1 507 . 1 1 55 55 LEU CG C 13 26.592 0.0 . 1 . . . . 55 LEU CG . 11010 1 508 . 1 1 55 55 LEU N N 15 125.576 0.0 . 1 . . . . 55 LEU N . 11010 1 509 . 1 1 56 56 TRP H H 1 9.309 0.0 . 1 . . . . 56 TRP HN . 11010 1 510 . 1 1 56 56 TRP HA H 1 5.585951 0.0 . 1 . . . . 56 TRP HA . 11010 1 511 . 1 1 56 56 TRP HB2 H 1 3.282 0.0 . 2 . . . . 56 TRP HB# . 11010 1 512 . 1 1 56 56 TRP HD1 H 1 7.193 0.0 . 1 . . . . 56 TRP HD1 . 11010 1 513 . 1 1 56 56 TRP HE1 H 1 10.479 0.0 . 1 . . . . 56 TRP HE1 . 11010 1 514 . 1 1 56 56 TRP HH2 H 1 7.015 0.0 . 1 . . . . 56 TRP HH2 . 11010 1 515 . 1 1 56 56 TRP HZ2 H 1 7.338 0.0 . 1 . . . . 56 TRP HZ2 . 11010 1 516 . 1 1 56 56 TRP CA C 13 57.107 0.0 . 1 . . . . 56 TRP CA . 11010 1 517 . 1 1 56 56 TRP CD1 C 13 126.151 0.0 . 1 . . . . 56 TRP CD1 . 11010 1 518 . 1 1 56 56 TRP CH2 C 13 124.154 0.0 . 1 . . . . 56 TRP CH2 . 11010 1 519 . 1 1 56 56 TRP CZ2 C 13 114.399 0.0 . 1 . . . . 56 TRP CZ2 . 11010 1 520 . 1 1 56 56 TRP N N 15 126.59 0.0 . 1 . . . . 56 TRP N . 11010 1 521 . 1 1 56 56 TRP NE1 N 15 129.5261 0.0 . 1 . . . . 56 TRP NE1 . 11010 1 522 . 1 1 57 57 ASP HB2 H 1 2.377402 0.0 . 2 . . . . 57 ASP HB# . 11010 1 523 . 1 1 58 58 THR H H 1 6.266 0.0 . 1 . . . . 58 THR HN . 11010 1 524 . 1 1 59 59 ALA HA H 1 4.246 0.0 . 1 . . . . 59 ALA HA . 11010 1 525 . 1 1 59 59 ALA HB1 H 1 1.285 0.0 . 1 . . . . 59 ALA HB# . 11010 1 526 . 1 1 59 59 ALA HB2 H 1 1.285 0.0 . 1 . . . . 59 ALA HB# . 11010 1 527 . 1 1 59 59 ALA HB3 H 1 1.285 0.0 . 1 . . . . 59 ALA HB# . 11010 1 528 . 1 1 59 59 ALA CA C 13 52.391 0.0 . 1 . . . . 59 ALA CA . 11010 1 529 . 1 1 59 59 ALA CB C 13 19.329 0.0 . 1 . . . . 59 ALA CB . 11010 1 530 . 1 1 60 60 GLY H H 1 8.296 0.0 . 1 . . . . 60 GLY HN . 11010 1 531 . 1 1 60 60 GLY N N 15 107.959 0.0 . 1 . . . . 60 GLY N . 11010 1 532 . 1 1 61 61 LEU H H 1 8.024 0.0 . 1 . . . . 61 LEU HN . 11010 1 533 . 1 1 61 61 LEU HA H 1 4.435 0.0 . 1 . . . . 61 LEU HA . 11010 1 534 . 1 1 61 61 LEU HB2 H 1 1.808 0.0 . 1 . . . . 61 LEU HB1 . 11010 1 535 . 1 1 61 61 LEU HB3 H 1 1.985 0.0 . 1 . . . . 61 LEU HB2 . 11010 1 536 . 1 1 61 61 LEU HD11 H 1 0.997 0.0 . 1 . . . . 61 LEU HD1# . 11010 1 537 . 1 1 61 61 LEU HD12 H 1 0.997 0.0 . 1 . . . . 61 LEU HD1# . 11010 1 538 . 1 1 61 61 LEU HD13 H 1 0.997 0.0 . 1 . . . . 61 LEU HD1# . 11010 1 539 . 1 1 61 61 LEU HD21 H 1 1.059 0.0 . 1 . . . . 61 LEU HD2# . 11010 1 540 . 1 1 61 61 LEU HD22 H 1 1.059 0.0 . 1 . . . . 61 LEU HD2# . 11010 1 541 . 1 1 61 61 LEU HD23 H 1 1.059 0.0 . 1 . . . . 61 LEU HD2# . 11010 1 542 . 1 1 61 61 LEU HG H 1 1.929 0.0 . 1 . . . . 61 LEU HG . 11010 1 543 . 1 1 61 61 LEU C C 13 179.247 0.0 . 1 . . . . 61 LEU CO . 11010 1 544 . 1 1 61 61 LEU CA C 13 55.619 0.0 . 1 . . . . 61 LEU CA . 11010 1 545 . 1 1 61 61 LEU CB C 13 42.804 0.0 . 1 . . . . 61 LEU CB . 11010 1 546 . 1 1 61 61 LEU CD1 C 13 23.441 0.0 . 1 . . . . 61 LEU CD1 . 11010 1 547 . 1 1 61 61 LEU CD2 C 13 25.16 0.0 . 1 . . . . 61 LEU CD2 . 11010 1 548 . 1 1 61 61 LEU CG C 13 27.794 0.0 . 1 . . . . 61 LEU CG . 11010 1 549 . 1 1 62 62 GLU H H 1 8.968 0.0 . 1 . . . . 62 GLU HN . 11010 1 550 . 1 1 62 62 GLU HA H 1 4.151 0.0 . 1 . . . . 62 GLU HA . 11010 1 551 . 1 1 62 62 GLU HB2 H 1 1.987 0.0 . 1 . . . . 62 GLU HB1 . 11010 1 552 . 1 1 62 62 GLU HB3 H 1 2.046 0.0 . 1 . . . . 62 GLU HB2 . 11010 1 553 . 1 1 62 62 GLU HG2 H 1 2.262 0.0 . 2 . . . . 62 GLU HG# . 11010 1 554 . 1 1 62 62 GLU C C 13 178.302 0.0 . 1 . . . . 62 GLU CO . 11010 1 555 . 1 1 62 62 GLU CA C 13 58.102 0.0 . 1 . . . . 62 GLU CA . 11010 1 556 . 1 1 62 62 GLU CB C 13 29.271 0.0 . 1 . . . . 62 GLU CB . 11010 1 557 . 1 1 62 62 GLU CG C 13 36.071 0.0 . 1 . . . . 62 GLU CG . 11010 1 558 . 1 1 62 62 GLU N N 15 121.277 0.0 . 1 . . . . 62 GLU N . 11010 1 559 . 1 1 63 63 ASP H H 1 8.282 0.0 . 1 . . . . 63 ASP HN . 11010 1 560 . 1 1 63 63 ASP HB2 H 1 1.731668 0.0 . 1 . . . . 63 ASP HB1 . 11010 1 561 . 1 1 63 63 ASP C C 13 176.947 0.0 . 1 . . . . 63 ASP CO . 11010 1 562 . 1 1 63 63 ASP CA C 13 55.91 0.0 . 1 . . . . 63 ASP CA . 11010 1 563 . 1 1 63 63 ASP CB C 13 40.198 0.0 . 1 . . . . 63 ASP CB . 11010 1 564 . 1 1 63 63 ASP N N 15 117.44 0.0 . 1 . . . . 63 ASP N . 11010 1 565 . 1 1 64 64 TYR H H 1 7.721 0.0 . 1 . . . . 64 TYR HN . 11010 1 566 . 1 1 64 64 TYR HA H 1 4.198 0.0 . 1 . . . . 64 TYR HA . 11010 1 567 . 1 1 64 64 TYR HD1 H 1 7.019 0.0 . 3 . . . . 64 TYR HD# . 11010 1 568 . 1 1 64 64 TYR HE1 H 1 6.781 0.0 . 3 . . . . 64 TYR HE# . 11010 1 569 . 1 1 64 64 TYR CD1 C 13 133.081 0.0 . 3 . . . . 64 TYR CD# . 11010 1 570 . 1 1 64 64 TYR CE1 C 13 118.221 0.0 . 3 . . . . 64 TYR CE# . 11010 1 571 . 1 1 65 65 ASP H H 1 8.041817 0.0 . 1 . . . . 65 ASP HN . 11010 1 572 . 1 1 66 66 ARG HA H 1 4.083 0.0 . 1 . . . . 66 ARG HA . 11010 1 573 . 1 1 66 66 ARG HD2 H 1 3.118 0.0 . 2 . . . . 66 ARG HD# . 11010 1 574 . 1 1 66 66 ARG CA C 13 58.098 0.0 . 1 . . . . 66 ARG CA . 11010 1 575 . 1 1 66 66 ARG CD C 13 43.375 0.0 . 1 . . . . 66 ARG CD . 11010 1 576 . 1 1 67 67 LEU H H 1 7.327152 0.0 . 1 . . . . 67 LEU HN . 11010 1 577 . 1 1 67 67 LEU HA H 1 4.322 0.0 . 1 . . . . 67 LEU HA . 11010 1 578 . 1 1 67 67 LEU HB2 H 1 1.61 0.0 . 2 . . . . 67 LEU HB# . 11010 1 579 . 1 1 67 67 LEU HD11 H 1 0.8106109 0.0 . 1 . . . . 67 LEU HD1# . 11010 1 580 . 1 1 67 67 LEU HD12 H 1 0.8106109 0.0 . 1 . . . . 67 LEU HD1# . 11010 1 581 . 1 1 67 67 LEU HD13 H 1 0.8106109 0.0 . 1 . . . . 67 LEU HD1# . 11010 1 582 . 1 1 67 67 LEU HD21 H 1 0.8842775 0.0 . 1 . . . . 67 LEU HD2# . 11010 1 583 . 1 1 67 67 LEU HD22 H 1 0.8842775 0.0 . 1 . . . . 67 LEU HD2# . 11010 1 584 . 1 1 67 67 LEU HD23 H 1 0.8842775 0.0 . 1 . . . . 67 LEU HD2# . 11010 1 585 . 1 1 67 67 LEU CA C 13 55.318 0.0 . 1 . . . . 67 LEU CA . 11010 1 586 . 1 1 67 67 LEU CB C 13 43.752 0.0 . 1 . . . . 67 LEU CB . 11010 1 587 . 1 1 67 67 LEU CD1 C 13 24.159 0.0 . 1 . . . . 67 LEU CD1 . 11010 1 588 . 1 1 67 67 LEU CD2 C 13 25.29 0.0 . 1 . . . . 67 LEU CD2 . 11010 1 589 . 1 1 69 69 PRO C C 13 178.499 0.0 . 1 . . . . 69 PRO CO . 11010 1 590 . 1 1 69 69 PRO CA C 13 63.744 0.0 . 1 . . . . 69 PRO CA . 11010 1 591 . 1 1 69 69 PRO CB C 13 30.212 0.0 . 1 . . . . 69 PRO CB . 11010 1 592 . 1 1 70 70 LEU H H 1 7.444 0.0 . 1 . . . . 70 LEU HN . 11010 1 593 . 1 1 70 70 LEU HA H 1 3.943 0.0 . 1 . . . . 70 LEU HA . 11010 1 594 . 1 1 70 70 LEU HB2 H 1 1.496 0.0 . 1 . . . . 70 LEU HB1 . 11010 1 595 . 1 1 70 70 LEU HB3 H 1 1.765 0.0 . 1 . . . . 70 LEU HB2 . 11010 1 596 . 1 1 70 70 LEU HD11 H 1 0.7806277 0.0 . 1 . . . . 70 LEU HD1# . 11010 1 597 . 1 1 70 70 LEU HD12 H 1 0.7806277 0.0 . 1 . . . . 70 LEU HD1# . 11010 1 598 . 1 1 70 70 LEU HD13 H 1 0.7806277 0.0 . 1 . . . . 70 LEU HD1# . 11010 1 599 . 1 1 70 70 LEU HD21 H 1 0.895 0.0 . 1 . . . . 70 LEU HD2# . 11010 1 600 . 1 1 70 70 LEU HD22 H 1 0.895 0.0 . 1 . . . . 70 LEU HD2# . 11010 1 601 . 1 1 70 70 LEU HD23 H 1 0.895 0.0 . 1 . . . . 70 LEU HD2# . 11010 1 602 . 1 1 70 70 LEU HG H 1 1.685 0.0 . 1 . . . . 70 LEU HG . 11010 1 603 . 1 1 70 70 LEU C C 13 179.072 0.0 . 1 . . . . 70 LEU CO . 11010 1 604 . 1 1 70 70 LEU CA C 13 57.265 0.0 . 1 . . . . 70 LEU CA . 11010 1 605 . 1 1 70 70 LEU CB C 13 40.665 0.0 . 1 . . . . 70 LEU CB . 11010 1 606 . 1 1 70 70 LEU CD1 C 13 22.941 0.0 . 1 . . . . 70 LEU CD1 . 11010 1 607 . 1 1 70 70 LEU CD2 C 13 25.425 0.0 . 1 . . . . 70 LEU CD2 . 11010 1 608 . 1 1 70 70 LEU CG C 13 27.784 0.0 . 1 . . . . 70 LEU CG . 11010 1 609 . 1 1 70 70 LEU N N 15 118.12 0.0 . 1 . . . . 70 LEU N . 11010 1 610 . 1 1 71 71 SER H H 1 7.864 0.0 . 1 . . . . 71 SER HN . 11010 1 611 . 1 1 71 71 SER HA H 1 4.252 0.0 . 1 . . . . 71 SER HA . 11010 1 612 . 1 1 71 71 SER HB2 H 1 3.836 0.0 . 1 . . . . 71 SER HB1 . 11010 1 613 . 1 1 71 71 SER HB3 H 1 3.929 0.0 . 1 . . . . 71 SER HB2 . 11010 1 614 . 1 1 71 71 SER C C 13 174.408 0.0 . 1 . . . . 71 SER CO . 11010 1 615 . 1 1 71 71 SER CA C 13 60.483 0.0 . 1 . . . . 71 SER CA . 11010 1 616 . 1 1 71 71 SER CB C 13 64.065 0.0 . 1 . . . . 71 SER CB . 11010 1 617 . 1 1 71 71 SER N N 15 111.643 0.0 . 1 . . . . 71 SER N . 11010 1 618 . 1 1 72 72 TYR H H 1 7.105 0.0 . 1 . . . . 72 TYR HN . 11010 1 619 . 1 1 72 72 TYR HB2 H 1 3.154 0.0 . 1 . . . . 72 TYR HB1 . 11010 1 620 . 1 1 72 72 TYR HB3 H 1 3.433 0.0 . 1 . . . . 72 TYR HB2 . 11010 1 621 . 1 1 72 72 TYR HD1 H 1 6.803 0.0 . 3 . . . . 72 TYR HD# . 11010 1 622 . 1 1 72 72 TYR HE1 H 1 6.568 0.0 . 3 . . . . 72 TYR HE# . 11010 1 623 . 1 1 72 72 TYR C C 13 174.452 0.0 . 1 . . . . 72 TYR CO . 11010 1 624 . 1 1 72 72 TYR CA C 13 56.376 0.0 . 1 . . . . 72 TYR CA . 11010 1 625 . 1 1 72 72 TYR CB C 13 35.54 0.0 . 1 . . . . 72 TYR CB . 11010 1 626 . 1 1 72 72 TYR CD1 C 13 131.511 0.0 . 3 . . . . 72 TYR CD# . 11010 1 627 . 1 1 72 72 TYR CE1 C 13 117.533 0.0 . 3 . . . . 72 TYR CE# . 11010 1 628 . 1 1 72 72 TYR N N 15 119.588 0.0 . 1 . . . . 72 TYR N . 11010 1 629 . 1 1 73 73 PRO CA C 13 65.97876 0.0 . 1 . . . . 73 PRO CA . 11010 1 630 . 1 1 74 74 GLN H H 1 8.899 0.0 . 1 . . . . 74 GLN HN . 11010 1 631 . 1 1 74 74 GLN HA H 1 3.695 0.0 . 1 . . . . 74 GLN HA . 11010 1 632 . 1 1 74 74 GLN HB2 H 1 2.125 0.0 . 2 . . . . 74 GLN HB# . 11010 1 633 . 1 1 74 74 GLN HE21 H 1 6.757 0.0 . 1 . . . . 74 GLN HE21 . 11010 1 634 . 1 1 74 74 GLN HE22 H 1 7.469709 0.0 . 1 . . . . 74 GLN HE22 . 11010 1 635 . 1 1 74 74 GLN HG2 H 1 2.099 0.0 . 1 . . . . 74 GLN HG1 . 11010 1 636 . 1 1 74 74 GLN HG3 H 1 2.192 0.0 . 1 . . . . 74 GLN HG2 . 11010 1 637 . 1 1 74 74 GLN C C 13 175.112 0.0 . 1 . . . . 74 GLN CO . 11010 1 638 . 1 1 74 74 GLN CA C 13 57.206 0.0 . 1 . . . . 74 GLN CA . 11010 1 639 . 1 1 74 74 GLN CB C 13 25.786 0.0 . 1 . . . . 74 GLN CB . 11010 1 640 . 1 1 74 74 GLN CG C 13 34.902 0.0 . 1 . . . . 74 GLN CG . 11010 1 641 . 1 1 74 74 GLN N N 15 114.436 0.0 . 1 . . . . 74 GLN N . 11010 1 642 . 1 1 74 74 GLN NE2 N 15 111.688 0.0 . 1 . . . . 74 GLN NE2 . 11010 1 643 . 1 1 75 75 THR H H 1 7.338 0.0 . 1 . . . . 75 THR HN . 11010 1 644 . 1 1 75 75 THR HA H 1 3.008 0.0 . 1 . . . . 75 THR HA . 11010 1 645 . 1 1 75 75 THR HB H 1 3.485 0.0 . 1 . . . . 75 THR HB . 11010 1 646 . 1 1 75 75 THR HG1 H 1 5.518 0.0 . 1 . . . . 75 THR HG1 . 11010 1 647 . 1 1 75 75 THR HG21 H 1 -0.033 0.0 . 1 . . . . 75 THR HG2# . 11010 1 648 . 1 1 75 75 THR HG22 H 1 -0.033 0.0 . 1 . . . . 75 THR HG2# . 11010 1 649 . 1 1 75 75 THR HG23 H 1 -0.033 0.0 . 1 . . . . 75 THR HG2# . 11010 1 650 . 1 1 75 75 THR C C 13 173.974 0.0 . 1 . . . . 75 THR CO . 11010 1 651 . 1 1 75 75 THR CA C 13 66.977 0.0 . 1 . . . . 75 THR CA . 11010 1 652 . 1 1 75 75 THR CB C 13 67.865 0.0 . 1 . . . . 75 THR CB . 11010 1 653 . 1 1 75 75 THR CG2 C 13 23.223 0.0 . 1 . . . . 75 THR CG2 . 11010 1 654 . 1 1 75 75 THR N N 15 116.621 0.0 . 1 . . . . 75 THR N . 11010 1 655 . 1 1 76 76 ASP H H 1 8.705 0.0 . 1 . . . . 76 ASP HN . 11010 1 656 . 1 1 76 76 ASP HA H 1 4.695 0.0 . 1 . . . . 76 ASP HA . 11010 1 657 . 1 1 76 76 ASP HB2 H 1 2.656729 0.0 . 2 . . . . 76 ASP HB# . 11010 1 658 . 1 1 76 76 ASP C C 13 174.739 0.0 . 1 . . . . 76 ASP CO . 11010 1 659 . 1 1 76 76 ASP CA C 13 56.514 0.0 . 1 . . . . 76 ASP CA . 11010 1 660 . 1 1 76 76 ASP CB C 13 44.104 0.0 . 1 . . . . 76 ASP CB . 11010 1 661 . 1 1 76 76 ASP N N 15 123.589 0.0 . 1 . . . . 76 ASP N . 11010 1 662 . 1 1 77 77 VAL H H 1 7.377 0.0 . 1 . . . . 77 VAL HN . 11010 1 663 . 1 1 77 77 VAL HA H 1 4.441 0.0 . 1 . . . . 77 VAL HA . 11010 1 664 . 1 1 77 77 VAL HB H 1 2.049 0.0 . 1 . . . . 77 VAL HB . 11010 1 665 . 1 1 77 77 VAL HG11 H 1 0.569 0.0 . 1 . . . . 77 VAL HG1# . 11010 1 666 . 1 1 77 77 VAL HG12 H 1 0.569 0.0 . 1 . . . . 77 VAL HG1# . 11010 1 667 . 1 1 77 77 VAL HG13 H 1 0.569 0.0 . 1 . . . . 77 VAL HG1# . 11010 1 668 . 1 1 77 77 VAL HG21 H 1 0.774 0.0 . 1 . . . . 77 VAL HG2# . 11010 1 669 . 1 1 77 77 VAL HG22 H 1 0.774 0.0 . 1 . . . . 77 VAL HG2# . 11010 1 670 . 1 1 77 77 VAL HG23 H 1 0.774 0.0 . 1 . . . . 77 VAL HG2# . 11010 1 671 . 1 1 77 77 VAL C C 13 171.238 0.0 . 1 . . . . 77 VAL CO . 11010 1 672 . 1 1 77 77 VAL CA C 13 60.351 0.0 . 1 . . . . 77 VAL CA . 11010 1 673 . 1 1 77 77 VAL CB C 13 32.647 0.0 . 1 . . . . 77 VAL CB . 11010 1 674 . 1 1 77 77 VAL CG1 C 13 17.39 0.0 . 1 . . . . 77 VAL CG1 . 11010 1 675 . 1 1 77 77 VAL CG2 C 13 20.167 0.0 . 1 . . . . 77 VAL CG2 . 11010 1 676 . 1 1 77 77 VAL N N 15 116.053 0.0 . 1 . . . . 77 VAL N . 11010 1 677 . 1 1 78 78 PHE H H 1 8.491 0.0 . 1 . . . . 78 PHE HN . 11010 1 678 . 1 1 78 78 PHE HA H 1 5.313 0.0 . 1 . . . . 78 PHE HA . 11010 1 679 . 1 1 78 78 PHE HB2 H 1 2.629 0.0 . 1 . . . . 78 PHE HB1 . 11010 1 680 . 1 1 78 78 PHE HB3 H 1 2.711 0.0 . 1 . . . . 78 PHE HB2 . 11010 1 681 . 1 1 78 78 PHE HD1 H 1 6.829 0.0 . 3 . . . . 78 PHE HD# . 11010 1 682 . 1 1 78 78 PHE CA C 13 57.178 0.0 . 1 . . . . 78 PHE CA . 11010 1 683 . 1 1 78 78 PHE CB C 13 43.313 0.0 . 1 . . . . 78 PHE CB . 11010 1 684 . 1 1 78 78 PHE CD1 C 13 132.033 0.0 . 3 . . . . 78 PHE CD# . 11010 1 685 . 1 1 78 78 PHE N N 15 122.723 0.0 . 1 . . . . 78 PHE N . 11010 1 686 . 1 1 79 79 LEU H H 1 8.836 0.0 . 1 . . . . 79 LEU HN . 11010 1 687 . 1 1 79 79 LEU HA H 1 5.119 0.0 . 1 . . . . 79 LEU HA . 11010 1 688 . 1 1 79 79 LEU HB2 H 1 0.931 0.0 . 1 . . . . 79 LEU HB1 . 11010 1 689 . 1 1 79 79 LEU HB3 H 1 1.681 0.0 . 1 . . . . 79 LEU HB2 . 11010 1 690 . 1 1 79 79 LEU HD11 H 1 0.219 0.0 . 1 . . . . 79 LEU HD1# . 11010 1 691 . 1 1 79 79 LEU HD12 H 1 0.219 0.0 . 1 . . . . 79 LEU HD1# . 11010 1 692 . 1 1 79 79 LEU HD13 H 1 0.219 0.0 . 1 . . . . 79 LEU HD1# . 11010 1 693 . 1 1 79 79 LEU HD21 H 1 0.282 0.0 . 1 . . . . 79 LEU HD2# . 11010 1 694 . 1 1 79 79 LEU HD22 H 1 0.282 0.0 . 1 . . . . 79 LEU HD2# . 11010 1 695 . 1 1 79 79 LEU HD23 H 1 0.282 0.0 . 1 . . . . 79 LEU HD2# . 11010 1 696 . 1 1 79 79 LEU HG H 1 1.187 0.0 . 1 . . . . 79 LEU HG . 11010 1 697 . 1 1 79 79 LEU CA C 13 53.169 0.0 . 1 . . . . 79 LEU CA . 11010 1 698 . 1 1 79 79 LEU CB C 13 41.595 0.0 . 1 . . . . 79 LEU CB . 11010 1 699 . 1 1 79 79 LEU CD1 C 13 25.482 0.0 . 1 . . . . 79 LEU CD1 . 11010 1 700 . 1 1 79 79 LEU CD2 C 13 23.396 0.0 . 1 . . . . 79 LEU CD2 . 11010 1 701 . 1 1 79 79 LEU CG C 13 27.03 0.0 . 1 . . . . 79 LEU CG . 11010 1 702 . 1 1 79 79 LEU N N 15 118.907 0.0 . 1 . . . . 79 LEU N . 11010 1 703 . 1 1 80 80 ILE H H 1 8.516 0.0 . 1 . . . . 80 ILE HN . 11010 1 704 . 1 1 80 80 ILE HA H 1 4.418 0.0 . 1 . . . . 80 ILE HA . 11010 1 705 . 1 1 80 80 ILE HB H 1 1.573 0.0 . 1 . . . . 80 ILE HB . 11010 1 706 . 1 1 80 80 ILE HD11 H 1 0.7591192 0.0 . 1 . . . . 80 ILE HD1# . 11010 1 707 . 1 1 80 80 ILE HD12 H 1 0.7591192 0.0 . 1 . . . . 80 ILE HD1# . 11010 1 708 . 1 1 80 80 ILE HD13 H 1 0.7591192 0.0 . 1 . . . . 80 ILE HD1# . 11010 1 709 . 1 1 80 80 ILE HG21 H 1 0.799 0.0 . 1 . . . . 80 ILE HG2# . 11010 1 710 . 1 1 80 80 ILE HG22 H 1 0.799 0.0 . 1 . . . . 80 ILE HG2# . 11010 1 711 . 1 1 80 80 ILE HG23 H 1 0.799 0.0 . 1 . . . . 80 ILE HG2# . 11010 1 712 . 1 1 80 80 ILE CA C 13 61.109 0.0 . 1 . . . . 80 ILE CA . 11010 1 713 . 1 1 80 80 ILE CB C 13 38.251 0.0 . 1 . . . . 80 ILE CB . 11010 1 714 . 1 1 80 80 ILE CD1 C 13 13.63905 0.0 . 1 . . . . 80 ILE CD1 . 11010 1 715 . 1 1 80 80 ILE CG2 C 13 18.756 0.0 . 1 . . . . 80 ILE CG2 . 11010 1 716 . 1 1 80 80 ILE N N 15 121.667 0.0 . 1 . . . . 80 ILE N . 11010 1 717 . 1 1 81 81 CYS H H 1 8.861 0.0 . 1 . . . . 81 CYS HN . 11010 1 718 . 1 1 81 81 CYS HA H 1 5.767 0.0 . 1 . . . . 81 CYS HA . 11010 1 719 . 1 1 81 81 CYS HB2 H 1 2.134 0.0 . 1 . . . . 81 CYS HB1 . 11010 1 720 . 1 1 81 81 CYS HB3 H 1 2.373 0.0 . 1 . . . . 81 CYS HB2 . 11010 1 721 . 1 1 81 81 CYS HG H 1 1.375 0.0 . 1 . . . . 81 CYS HG . 11010 1 722 . 1 1 81 81 CYS CA C 13 56.841 0.0 . 1 . . . . 81 CYS CA . 11010 1 723 . 1 1 81 81 CYS CB C 13 30.742 0.0 . 1 . . . . 81 CYS CB . 11010 1 724 . 1 1 81 81 CYS N N 15 123.471 0.0 . 1 . . . . 81 CYS N . 11010 1 725 . 1 1 82 82 PHE H H 1 8.875 0.0 . 1 . . . . 82 PHE HN . 11010 1 726 . 1 1 82 82 PHE HA H 1 4.632 0.0 . 1 . . . . 82 PHE HA . 11010 1 727 . 1 1 82 82 PHE HB2 H 1 2.836 0.0 . 1 . . . . 82 PHE HB1 . 11010 1 728 . 1 1 82 82 PHE HB3 H 1 3.072 0.0 . 1 . . . . 82 PHE HB2 . 11010 1 729 . 1 1 82 82 PHE HD1 H 1 6.787 0.0 . 3 . . . . 82 PHE HD# . 11010 1 730 . 1 1 82 82 PHE HE1 H 1 7.112 0.0 . 3 . . . . 82 PHE HE# . 11010 1 731 . 1 1 82 82 PHE C C 13 171.069 0.0 . 1 . . . . 82 PHE CO . 11010 1 732 . 1 1 82 82 PHE CA C 13 56.272 0.0 . 1 . . . . 82 PHE CA . 11010 1 733 . 1 1 82 82 PHE CB C 13 40.769 0.0 . 1 . . . . 82 PHE CB . 11010 1 734 . 1 1 82 82 PHE CD1 C 13 131.946 0.0 . 3 . . . . 82 PHE CD# . 11010 1 735 . 1 1 82 82 PHE CE1 C 13 132.538 0.0 . 3 . . . . 82 PHE CE# . 11010 1 736 . 1 1 82 82 PHE N N 15 118.383 0.0 . 1 . . . . 82 PHE N . 11010 1 737 . 1 1 83 83 SER H H 1 8.303 0.0 . 1 . . . . 83 SER HN . 11010 1 738 . 1 1 83 83 SER HA H 1 5.134 0.0 . 1 . . . . 83 SER HA . 11010 1 739 . 1 1 83 83 SER HB2 H 1 3.93 0.0 . 2 . . . . 83 SER HB# . 11010 1 740 . 1 1 83 83 SER C C 13 177.128 0.0 . 1 . . . . 83 SER CO . 11010 1 741 . 1 1 83 83 SER CA C 13 54.474 0.0 . 1 . . . . 83 SER CA . 11010 1 742 . 1 1 83 83 SER CB C 13 63.961 0.0 . 1 . . . . 83 SER CB . 11010 1 743 . 1 1 83 83 SER N N 15 113.641 0.0 . 1 . . . . 83 SER N . 11010 1 744 . 1 1 84 84 LEU H H 1 8.883 0.0 . 1 . . . . 84 LEU HN . 11010 1 745 . 1 1 84 84 LEU HA H 1 4.014 0.0 . 1 . . . . 84 LEU HA . 11010 1 746 . 1 1 84 84 LEU HB2 H 1 1.477 0.0 . 2 . . . . 84 LEU HB# . 11010 1 747 . 1 1 84 84 LEU HD11 H 1 0.512 0.0 . 1 . . . . 84 LEU HD1# . 11010 1 748 . 1 1 84 84 LEU HD12 H 1 0.512 0.0 . 1 . . . . 84 LEU HD1# . 11010 1 749 . 1 1 84 84 LEU HD13 H 1 0.512 0.0 . 1 . . . . 84 LEU HD1# . 11010 1 750 . 1 1 84 84 LEU HD21 H 1 1.012852 0.0 . 1 . . . . 84 LEU HD2# . 11010 1 751 . 1 1 84 84 LEU HD22 H 1 1.012852 0.0 . 1 . . . . 84 LEU HD2# . 11010 1 752 . 1 1 84 84 LEU HD23 H 1 1.012852 0.0 . 1 . . . . 84 LEU HD2# . 11010 1 753 . 1 1 84 84 LEU HG H 1 1.456 0.0 . 1 . . . . 84 LEU HG . 11010 1 754 . 1 1 84 84 LEU C C 13 176.708 0.0 . 1 . . . . 84 LEU CO . 11010 1 755 . 1 1 84 84 LEU CA C 13 57.604 0.0 . 1 . . . . 84 LEU CA . 11010 1 756 . 1 1 84 84 LEU CB C 13 42.753 0.0 . 1 . . . . 84 LEU CB . 11010 1 757 . 1 1 84 84 LEU CD1 C 13 26.005 0.0 . 1 . . . . 84 LEU CD1 . 11010 1 758 . 1 1 84 84 LEU CD2 C 13 23.416 0.0 . 1 . . . . 84 LEU CD2 . 11010 1 759 . 1 1 84 84 LEU CG C 13 27.201 0.0 . 1 . . . . 84 LEU CG . 11010 1 760 . 1 1 84 84 LEU N N 15 127.934 0.0 . 1 . . . . 84 LEU N . 11010 1 761 . 1 1 85 85 VAL H H 1 7.394 0.0 . 1 . . . . 85 VAL HN . 11010 1 762 . 1 1 85 85 VAL HA H 1 4.364 0.0 . 1 . . . . 85 VAL HA . 11010 1 763 . 1 1 85 85 VAL HB H 1 2.395 0.0 . 1 . . . . 85 VAL HB . 11010 1 764 . 1 1 85 85 VAL HG11 H 1 0.5675426 0.0 . 1 . . . . 85 VAL HG1# . 11010 1 765 . 1 1 85 85 VAL HG12 H 1 0.5675426 0.0 . 1 . . . . 85 VAL HG1# . 11010 1 766 . 1 1 85 85 VAL HG13 H 1 0.5675426 0.0 . 1 . . . . 85 VAL HG1# . 11010 1 767 . 1 1 85 85 VAL HG21 H 1 0.612 0.0 . 1 . . . . 85 VAL HG2# . 11010 1 768 . 1 1 85 85 VAL HG22 H 1 0.612 0.0 . 1 . . . . 85 VAL HG2# . 11010 1 769 . 1 1 85 85 VAL HG23 H 1 0.612 0.0 . 1 . . . . 85 VAL HG2# . 11010 1 770 . 1 1 85 85 VAL C C 13 173.828 0.0 . 1 . . . . 85 VAL CO . 11010 1 771 . 1 1 85 85 VAL CA C 13 59.329 0.0 . 1 . . . . 85 VAL CA . 11010 1 772 . 1 1 85 85 VAL CB C 13 30.201 0.0 . 1 . . . . 85 VAL CB . 11010 1 773 . 1 1 85 85 VAL CG1 C 13 21.223 0.0 . 1 . . . . 85 VAL CG1 . 11010 1 774 . 1 1 85 85 VAL CG2 C 13 18.196 0.0 . 1 . . . . 85 VAL CG2 . 11010 1 775 . 1 1 85 85 VAL N N 15 103.055 0.0 . 1 . . . . 85 VAL N . 11010 1 776 . 1 1 86 86 SER H H 1 7.712 0.0 . 1 . . . . 86 SER HN . 11010 1 777 . 1 1 86 86 SER HA H 1 5.086 0.0 . 1 . . . . 86 SER HA . 11010 1 778 . 1 1 86 86 SER HB2 H 1 3.775 0.0 . 1 . . . . 86 SER HB1 . 11010 1 779 . 1 1 86 86 SER HB3 H 1 3.984 0.0 . 1 . . . . 86 SER HB2 . 11010 1 780 . 1 1 86 86 SER HG H 1 6.12 0.0 . 1 . . . . 86 SER HG . 11010 1 781 . 1 1 86 86 SER C C 13 172.911 0.0 . 1 . . . . 86 SER CO . 11010 1 782 . 1 1 86 86 SER CA C 13 53.955 0.0 . 1 . . . . 86 SER CA . 11010 1 783 . 1 1 86 86 SER CB C 13 63.008 0.0 . 1 . . . . 86 SER CB . 11010 1 784 . 1 1 86 86 SER N N 15 111.821 0.0 . 1 . . . . 86 SER N . 11010 1 785 . 1 1 87 87 PRO HA H 1 4.258 0.0 . 1 . . . . 87 PRO HA . 11010 1 786 . 1 1 87 87 PRO HB2 H 1 2.596 0.0 . 2 . . . . 87 PRO HB# . 11010 1 787 . 1 1 87 87 PRO HD2 H 1 3.465 0.0 . 1 . . . . 87 PRO HD1 . 11010 1 788 . 1 1 87 87 PRO HD3 H 1 3.949383 0.0 . 1 . . . . 87 PRO HD2 . 11010 1 789 . 1 1 87 87 PRO HG2 H 1 2.042 0.0 . 1 . . . . 87 PRO HG1 . 11010 1 790 . 1 1 87 87 PRO HG3 H 1 2.182273 0.0 . 1 . . . . 87 PRO HG2 . 11010 1 791 . 1 1 87 87 PRO CA C 13 65.6063 0.0 . 1 . . . . 87 PRO CA . 11010 1 792 . 1 1 87 87 PRO CD C 13 50.40145 0.0 . 1 . . . . 87 PRO CD . 11010 1 793 . 1 1 87 87 PRO CG C 13 28.51436 0.0 . 1 . . . . 87 PRO CG . 11010 1 794 . 1 1 88 88 ALA HA H 1 4.171 0.0 . 1 . . . . 88 ALA HA . 11010 1 795 . 1 1 88 88 ALA HB1 H 1 1.371 0.0 . 1 . . . . 88 ALA HB# . 11010 1 796 . 1 1 88 88 ALA HB2 H 1 1.371 0.0 . 1 . . . . 88 ALA HB# . 11010 1 797 . 1 1 88 88 ALA HB3 H 1 1.371 0.0 . 1 . . . . 88 ALA HB# . 11010 1 798 . 1 1 88 88 ALA C C 13 180.118 0.0 . 1 . . . . 88 ALA CO . 11010 1 799 . 1 1 88 88 ALA CA C 13 55.548 0.0 . 1 . . . . 88 ALA CA . 11010 1 800 . 1 1 88 88 ALA CB C 13 18.357 0.0 . 1 . . . . 88 ALA CB . 11010 1 801 . 1 1 89 89 SER H H 1 7.994 0.0 . 1 . . . . 89 SER HN . 11010 1 802 . 1 1 89 89 SER HA H 1 4.982 0.0 . 1 . . . . 89 SER HA . 11010 1 803 . 1 1 89 89 SER HB2 H 1 4.338 0.0 . 2 . . . . 89 SER HB# . 11010 1 804 . 1 1 89 89 SER HG H 1 6.111 0.0 . 1 . . . . 89 SER HG . 11010 1 805 . 1 1 89 89 SER C C 13 176.379 0.0 . 1 . . . . 89 SER CO . 11010 1 806 . 1 1 89 89 SER CA C 13 61.272 0.0 . 1 . . . . 89 SER CA . 11010 1 807 . 1 1 89 89 SER CB C 13 64 0.0 . 1 . . . . 89 SER CB . 11010 1 808 . 1 1 89 89 SER N N 15 115.412 0.0 . 1 . . . . 89 SER N . 11010 1 809 . 1 1 90 90 PHE H H 1 7.433 0.0 . 1 . . . . 90 PHE HN . 11010 1 810 . 1 1 90 90 PHE HA H 1 4.312 0.0 . 1 . . . . 90 PHE HA . 11010 1 811 . 1 1 90 90 PHE HB2 H 1 2.768864 0.0 . 1 . . . . 90 PHE HB1 . 11010 1 812 . 1 1 90 90 PHE HB3 H 1 3.262 0.0 . 1 . . . . 90 PHE HB2 . 11010 1 813 . 1 1 90 90 PHE HD1 H 1 6.249 0.0 . 3 . . . . 90 PHE HD# . 11010 1 814 . 1 1 90 90 PHE HE1 H 1 6.676 0.0 . 3 . . . . 90 PHE HE# . 11010 1 815 . 1 1 90 90 PHE HZ H 1 6.919 0.0 . 1 . . . . 90 PHE HZ . 11010 1 816 . 1 1 90 90 PHE C C 13 177.359 0.0 . 1 . . . . 90 PHE CO . 11010 1 817 . 1 1 90 90 PHE CA C 13 59.184 0.0 . 1 . . . . 90 PHE CA . 11010 1 818 . 1 1 90 90 PHE CB C 13 39.60029 0.0 . 1 . . . . 90 PHE CB . 11010 1 819 . 1 1 90 90 PHE CD1 C 13 132.41 0.0 . 3 . . . . 90 PHE CD# . 11010 1 820 . 1 1 90 90 PHE CE1 C 13 130.555 0.0 . 3 . . . . 90 PHE CE# . 11010 1 821 . 1 1 90 90 PHE N N 15 125.031 0.0 . 1 . . . . 90 PHE N . 11010 1 822 . 1 1 91 91 GLU H H 1 8.169 0.0 . 1 . . . . 91 GLU HN . 11010 1 823 . 1 1 91 91 GLU HA H 1 3.708 0.0 . 1 . . . . 91 GLU HA . 11010 1 824 . 1 1 91 91 GLU HB2 H 1 1.946 0.0 . 1 . . . . 91 GLU HB1 . 11010 1 825 . 1 1 91 91 GLU HB3 H 1 2.02 0.0 . 1 . . . . 91 GLU HB2 . 11010 1 826 . 1 1 91 91 GLU HG2 H 1 2.279 0.0 . 2 . . . . 91 GLU HG# . 11010 1 827 . 1 1 91 91 GLU C C 13 180.144 0.0 . 1 . . . . 91 GLU CO . 11010 1 828 . 1 1 91 91 GLU CA C 13 58.961 0.0 . 1 . . . . 91 GLU CA . 11010 1 829 . 1 1 91 91 GLU CB C 13 28.885 0.0 . 1 . . . . 91 GLU CB . 11010 1 830 . 1 1 91 91 GLU CG C 13 35.583 0.0 . 1 . . . . 91 GLU CG . 11010 1 831 . 1 1 91 91 GLU N N 15 118.926 0.0 . 1 . . . . 91 GLU N . 11010 1 832 . 1 1 92 92 ASN H H 1 7.881 0.0 . 1 . . . . 92 ASN HN . 11010 1 833 . 1 1 92 92 ASN HA H 1 4.809 0.0 . 1 . . . . 92 ASN HA . 11010 1 834 . 1 1 92 92 ASN HB2 H 1 2.813 0.0 . 1 . . . . 92 ASN HB1 . 11010 1 835 . 1 1 92 92 ASN HB3 H 1 3.237 0.0 . 1 . . . . 92 ASN HB2 . 11010 1 836 . 1 1 92 92 ASN HD21 H 1 6.633 0.0 . 1 . . . . 92 ASN HD21 . 11010 1 837 . 1 1 92 92 ASN HD22 H 1 10.265 0.0 . 1 . . . . 92 ASN HD22 . 11010 1 838 . 1 1 92 92 ASN C C 13 178.567 0.0 . 1 . . . . 92 ASN CO . 11010 1 839 . 1 1 92 92 ASN CA C 13 54.473 0.0 . 1 . . . . 92 ASN CA . 11010 1 840 . 1 1 92 92 ASN CB C 13 38.155 0.0 . 1 . . . . 92 ASN CB . 11010 1 841 . 1 1 92 92 ASN N N 15 114.244 0.0 . 1 . . . . 92 ASN N . 11010 1 842 . 1 1 92 92 ASN ND2 N 15 116.194 0.0 . 1 . . . . 92 ASN ND2 . 11010 1 843 . 1 1 93 93 VAL H H 1 8.057 0.0 . 1 . . . . 93 VAL HN . 11010 1 844 . 1 1 93 93 VAL HA H 1 3.668 0.0 . 1 . . . . 93 VAL HA . 11010 1 845 . 1 1 93 93 VAL HB H 1 2.338 0.0 . 1 . . . . 93 VAL HB . 11010 1 846 . 1 1 93 93 VAL HG11 H 1 0.799 0.0 . 1 . . . . 93 VAL HG1# . 11010 1 847 . 1 1 93 93 VAL HG12 H 1 0.799 0.0 . 1 . . . . 93 VAL HG1# . 11010 1 848 . 1 1 93 93 VAL HG13 H 1 0.799 0.0 . 1 . . . . 93 VAL HG1# . 11010 1 849 . 1 1 93 93 VAL HG21 H 1 1.222 0.0 . 1 . . . . 93 VAL HG2# . 11010 1 850 . 1 1 93 93 VAL HG22 H 1 1.222 0.0 . 1 . . . . 93 VAL HG2# . 11010 1 851 . 1 1 93 93 VAL HG23 H 1 1.222 0.0 . 1 . . . . 93 VAL HG2# . 11010 1 852 . 1 1 93 93 VAL C C 13 175.292 0.0 . 1 . . . . 93 VAL CO . 11010 1 853 . 1 1 93 93 VAL CA C 13 68.8 0.0 . 1 . . . . 93 VAL CA . 11010 1 854 . 1 1 93 93 VAL CB C 13 31.048 0.0 . 1 . . . . 93 VAL CB . 11010 1 855 . 1 1 93 93 VAL CG1 C 13 21.695 0.0 . 1 . . . . 93 VAL CG1 . 11010 1 856 . 1 1 93 93 VAL CG2 C 13 22.938 0.0 . 1 . . . . 93 VAL CG2 . 11010 1 857 . 1 1 93 93 VAL N N 15 124.573 0.0 . 1 . . . . 93 VAL N . 11010 1 858 . 1 1 94 94 ARG H H 1 6.346 0.0 . 1 . . . . 94 ARG HN . 11010 1 859 . 1 1 94 94 ARG HA H 1 4.006 0.0 . 1 . . . . 94 ARG HA . 11010 1 860 . 1 1 94 94 ARG HB2 H 1 1.661 0.0 . 1 . . . . 94 ARG HB1 . 11010 1 861 . 1 1 94 94 ARG HB3 H 1 2.291 0.0 . 1 . . . . 94 ARG HB2 . 11010 1 862 . 1 1 94 94 ARG HD2 H 1 2.940138 0.0 . 1 . . . . 94 ARG HD1 . 11010 1 863 . 1 1 94 94 ARG HD3 H 1 3.108 0.0 . 1 . . . . 94 ARG HD2 . 11010 1 864 . 1 1 94 94 ARG HG2 H 1 1.36 0.0 . 2 . . . . 94 ARG HG# . 11010 1 865 . 1 1 94 94 ARG C C 13 177.068 0.0 . 1 . . . . 94 ARG CO . 11010 1 866 . 1 1 94 94 ARG CA C 13 57.972 0.0 . 1 . . . . 94 ARG CA . 11010 1 867 . 1 1 94 94 ARG CB C 13 30.879 0.0 . 1 . . . . 94 ARG CB . 11010 1 868 . 1 1 94 94 ARG CD C 13 43.528 0.0 . 1 . . . . 94 ARG CD . 11010 1 869 . 1 1 94 94 ARG CG C 13 26.92 0.0 . 1 . . . . 94 ARG CG . 11010 1 870 . 1 1 94 94 ARG N N 15 114.636 0.0 . 1 . . . . 94 ARG N . 11010 1 871 . 1 1 95 95 ALA H H 1 7.808 0.0 . 1 . . . . 95 ALA HN . 11010 1 872 . 1 1 95 95 ALA HA H 1 4.065382 0.0 . 1 . . . . 95 ALA HA . 11010 1 873 . 1 1 95 95 ALA HB1 H 1 1.368 0.0 . 1 . . . . 95 ALA HB# . 11010 1 874 . 1 1 95 95 ALA HB2 H 1 1.368 0.0 . 1 . . . . 95 ALA HB# . 11010 1 875 . 1 1 95 95 ALA HB3 H 1 1.368 0.0 . 1 . . . . 95 ALA HB# . 11010 1 876 . 1 1 95 95 ALA C C 13 177.492 0.0 . 1 . . . . 95 ALA CO . 11010 1 877 . 1 1 95 95 ALA CA C 13 54.113 0.0 . 1 . . . . 95 ALA CA . 11010 1 878 . 1 1 95 95 ALA CB C 13 19.689 0.0 . 1 . . . . 95 ALA CB . 11010 1 879 . 1 1 95 95 ALA N N 15 116.97 0.0 . 1 . . . . 95 ALA N . 11010 1 880 . 1 1 96 96 LYS H H 1 7.978 0.0 . 1 . . . . 96 LYS HN . 11010 1 881 . 1 1 96 96 LYS HA H 1 4.22 0.0 . 1 . . . . 96 LYS HA . 11010 1 882 . 1 1 96 96 LYS HB2 H 1 0.948 0.0 . 1 . . . . 96 LYS HB1 . 11010 1 883 . 1 1 96 96 LYS HB3 H 1 1.172155 0.0 . 1 . . . . 96 LYS HB2 . 11010 1 884 . 1 1 96 96 LYS HD2 H 1 0.629 0.0 . 1 . . . . 96 LYS HD1 . 11010 1 885 . 1 1 96 96 LYS HD3 H 1 0.851 0.0 . 1 . . . . 96 LYS HD2 . 11010 1 886 . 1 1 96 96 LYS HE2 H 1 2.136 0.0 . 2 . . . . 96 LYS HE# . 11010 1 887 . 1 1 96 96 LYS HG2 H 1 -0.278 0.0 . 1 . . . . 96 LYS HG1 . 11010 1 888 . 1 1 96 96 LYS HG3 H 1 0.505 0.0 . 1 . . . . 96 LYS HG2 . 11010 1 889 . 1 1 96 96 LYS C C 13 177.408 0.0 . 1 . . . . 96 LYS CO . 11010 1 890 . 1 1 96 96 LYS CA C 13 57.473 0.0 . 1 . . . . 96 LYS CA . 11010 1 891 . 1 1 96 96 LYS CB C 13 35.521 0.0 . 1 . . . . 96 LYS CB . 11010 1 892 . 1 1 96 96 LYS CD C 13 29.325 0.0 . 1 . . . . 96 LYS CD . 11010 1 893 . 1 1 96 96 LYS CE C 13 41.645 0.0 . 1 . . . . 96 LYS CE . 11010 1 894 . 1 1 96 96 LYS CG C 13 24.814 0.0 . 1 . . . . 96 LYS CG . 11010 1 895 . 1 1 96 96 LYS N N 15 114.682 0.0 . 1 . . . . 96 LYS N . 11010 1 896 . 1 1 97 97 TRP H H 1 7.829 0.0 . 1 . . . . 97 TRP HN . 11010 1 897 . 1 1 97 97 TRP HA H 1 4.336 0.0 . 1 . . . . 97 TRP HA . 11010 1 898 . 1 1 97 97 TRP HB2 H 1 3.042 0.0 . 1 . . . . 97 TRP HB2 . 11010 1 899 . 1 1 97 97 TRP HD1 H 1 6.704 0.0 . 1 . . . . 97 TRP HD1 . 11010 1 900 . 1 1 97 97 TRP HE1 H 1 11.589 0.0 . 1 . . . . 97 TRP HE1 . 11010 1 901 . 1 1 97 97 TRP HZ2 H 1 7.581 0.0 . 1 . . . . 97 TRP HZ2 . 11010 1 902 . 1 1 97 97 TRP CA C 13 60.645 0.0 . 1 . . . . 97 TRP CA . 11010 1 903 . 1 1 97 97 TRP CB C 13 31.209 0.0 . 1 . . . . 97 TRP CB . 11010 1 904 . 1 1 97 97 TRP CD1 C 13 126.227 0.0 . 1 . . . . 97 TRP CD1 . 11010 1 905 . 1 1 97 97 TRP CZ2 C 13 116.245 0.0 . 1 . . . . 97 TRP CZ2 . 11010 1 906 . 1 1 97 97 TRP N N 15 120.662 0.0 . 1 . . . . 97 TRP N . 11010 1 907 . 1 1 97 97 TRP NE1 N 15 133.265 0.0 . 1 . . . . 97 TRP NE1 . 11010 1 908 . 1 1 98 98 TYR H H 1 9.008 0.0 . 1 . . . . 98 TYR HN . 11010 1 909 . 1 1 98 98 TYR HA H 1 4.308 0.0 . 1 . . . . 98 TYR HA . 11010 1 910 . 1 1 98 98 TYR HB2 H 1 2.832 0.0 . 1 . . . . 98 TYR HB1 . 11010 1 911 . 1 1 98 98 TYR HB3 H 1 3.268 0.0 . 1 . . . . 98 TYR HB2 . 11010 1 912 . 1 1 98 98 TYR HD1 H 1 6.866 0.0 . 3 . . . . 98 TYR HD# . 11010 1 913 . 1 1 98 98 TYR HE1 H 1 6.714 0.0 . 3 . . . . 98 TYR HE# . 11010 1 914 . 1 1 98 98 TYR CA C 13 61.766 0.0 . 1 . . . . 98 TYR CA . 11010 1 915 . 1 1 98 98 TYR CB C 13 36.434 0.0 . 1 . . . . 98 TYR CB . 11010 1 916 . 1 1 98 98 TYR CD1 C 13 132.581 0.0 . 3 . . . . 98 TYR CD# . 11010 1 917 . 1 1 98 98 TYR CE1 C 13 119.446 0.0 . 3 . . . . 98 TYR CE# . 11010 1 918 . 1 1 98 98 TYR N N 15 117.171 0.0 . 1 . . . . 98 TYR N . 11010 1 919 . 1 1 99 99 PRO HA H 1 3.756 0.0 . 1 . . . . 99 PRO HA . 11010 1 920 . 1 1 99 99 PRO HB2 H 1 1.503 0.0 . 1 . . . . 99 PRO HB1 . 11010 1 921 . 1 1 99 99 PRO HB3 H 1 1.989 0.0 . 1 . . . . 99 PRO HB2 . 11010 1 922 . 1 1 99 99 PRO HD2 H 1 3.588 0.0 . 1 . . . . 99 PRO HD1 . 11010 1 923 . 1 1 99 99 PRO HG2 H 1 1.712801 0.0 . 1 . . . . 99 PRO HG1 . 11010 1 924 . 1 1 99 99 PRO HG3 H 1 1.777713 0.0 . 1 . . . . 99 PRO HG2 . 11010 1 925 . 1 1 99 99 PRO C C 13 178.964 0.0 . 1 . . . . 99 PRO CO . 11010 1 926 . 1 1 99 99 PRO CA C 13 65.675 0.0 . 1 . . . . 99 PRO CA . 11010 1 927 . 1 1 99 99 PRO CB C 13 30.203 0.0 . 1 . . . . 99 PRO CB . 11010 1 928 . 1 1 99 99 PRO CG C 13 27.97709 0.0 . 1 . . . . 99 PRO CG . 11010 1 929 . 1 1 100 100 GLU H H 1 7.498 0.0 . 1 . . . . 100 GLU HN . 11010 1 930 . 1 1 100 100 GLU HA H 1 4.08 0.0 . 1 . . . . 100 GLU HA . 11010 1 931 . 1 1 100 100 GLU HB2 H 1 2.07 0.0 . 1 . . . . 100 GLU HB1 . 11010 1 932 . 1 1 100 100 GLU HB3 H 1 2.338 0.0 . 1 . . . . 100 GLU HB2 . 11010 1 933 . 1 1 100 100 GLU HG2 H 1 2.426 0.0 . 2 . . . . 100 GLU HG# . 11010 1 934 . 1 1 100 100 GLU C C 13 178.275 0.0 . 1 . . . . 100 GLU CO . 11010 1 935 . 1 1 100 100 GLU CA C 13 60.651 0.0 . 1 . . . . 100 GLU CA . 11010 1 936 . 1 1 100 100 GLU CB C 13 30.17 0.0 . 1 . . . . 100 GLU CB . 11010 1 937 . 1 1 100 100 GLU CG C 13 36.461 0.0 . 1 . . . . 100 GLU CG . 11010 1 938 . 1 1 100 100 GLU N N 15 117.66 0.0 . 1 . . . . 100 GLU N . 11010 1 939 . 1 1 101 101 VAL H H 1 8.308 0.0 . 1 . . . . 101 VAL HN . 11010 1 940 . 1 1 101 101 VAL HA H 1 2.996 0.0 . 1 . . . . 101 VAL HA . 11010 1 941 . 1 1 101 101 VAL HB H 1 1.392 0.0 . 1 . . . . 101 VAL HB . 11010 1 942 . 1 1 101 101 VAL HG11 H 1 -0.257 0.0 . 1 . . . . 101 VAL HG1# . 11010 1 943 . 1 1 101 101 VAL HG12 H 1 -0.257 0.0 . 1 . . . . 101 VAL HG1# . 11010 1 944 . 1 1 101 101 VAL HG13 H 1 -0.257 0.0 . 1 . . . . 101 VAL HG1# . 11010 1 945 . 1 1 101 101 VAL HG21 H 1 0.373 0.0 . 1 . . . . 101 VAL HG2# . 11010 1 946 . 1 1 101 101 VAL HG22 H 1 0.373 0.0 . 1 . . . . 101 VAL HG2# . 11010 1 947 . 1 1 101 101 VAL HG23 H 1 0.373 0.0 . 1 . . . . 101 VAL HG2# . 11010 1 948 . 1 1 101 101 VAL C C 13 178.302 0.0 . 1 . . . . 101 VAL CO . 11010 1 949 . 1 1 101 101 VAL CA C 13 66.53 0.0 . 1 . . . . 101 VAL CA . 11010 1 950 . 1 1 101 101 VAL CB C 13 30.7 0.0 . 1 . . . . 101 VAL CB . 11010 1 951 . 1 1 101 101 VAL CG1 C 13 20.399 0.0 . 1 . . . . 101 VAL CG1 . 11010 1 952 . 1 1 101 101 VAL CG2 C 13 21.898 0.0 . 1 . . . . 101 VAL CG2 . 11010 1 953 . 1 1 101 101 VAL N N 15 116.441 0.0 . 1 . . . . 101 VAL N . 11010 1 954 . 1 1 102 102 ARG H H 1 7.93 0.0 . 1 . . . . 102 ARG HN . 11010 1 955 . 1 1 102 102 ARG HA H 1 3.663 0.0 . 1 . . . . 102 ARG HA . 11010 1 956 . 1 1 102 102 ARG HB2 H 1 1.424 0.0 . 2 . . . . 102 ARG HB# . 11010 1 957 . 1 1 102 102 ARG HG2 H 1 0.796 0.0 . 1 . . . . 102 ARG HG1 . 11010 1 958 . 1 1 102 102 ARG HG3 H 1 1.198428 0.0 . 1 . . . . 102 ARG HG2 . 11010 1 959 . 1 1 102 102 ARG C C 13 177.731 0.0 . 1 . . . . 102 ARG CO . 11010 1 960 . 1 1 102 102 ARG CA C 13 57.239 0.0 . 1 . . . . 102 ARG CA . 11010 1 961 . 1 1 102 102 ARG CB C 13 28.774 0.0 . 1 . . . . 102 ARG CB . 11010 1 962 . 1 1 102 102 ARG N N 15 116.059 0.0 . 1 . . . . 102 ARG N . 11010 1 963 . 1 1 103 103 HIS H H 1 7.664 0.0 . 1 . . . . 103 HIS HN . 11010 1 964 . 1 1 103 103 HIS HA H 1 3.965 0.0 . 1 . . . . 103 HIS HA . 11010 1 965 . 1 1 103 103 HIS HB2 H 1 3.006 0.0 . 2 . . . . 103 HIS HB# . 11010 1 966 . 1 1 103 103 HIS HD2 H 1 5.461 0.0 . 1 . . . . 103 HIS HD2 . 11010 1 967 . 1 1 103 103 HIS C C 13 176.45 0.0 . 1 . . . . 103 HIS CO . 11010 1 968 . 1 1 103 103 HIS CA C 13 59.08 0.0 . 1 . . . . 103 HIS CA . 11010 1 969 . 1 1 103 103 HIS CB C 13 30.035 0.0 . 1 . . . . 103 HIS CB . 11010 1 970 . 1 1 103 103 HIS N N 15 117.596 0.0 . 1 . . . . 103 HIS N . 11010 1 971 . 1 1 104 104 HIS H H 1 6.89 0.0 . 1 . . . . 104 HIS HN . 11010 1 972 . 1 1 104 104 HIS HA H 1 4.189 0.0 . 1 . . . . 104 HIS HA . 11010 1 973 . 1 1 104 104 HIS HB2 H 1 2.97 0.0 . 1 . . . . 104 HIS HB1 . 11010 1 974 . 1 1 104 104 HIS HB3 H 1 3.41 0.0 . 1 . . . . 104 HIS HB2 . 11010 1 975 . 1 1 104 104 HIS C C 13 176.907 0.0 . 1 . . . . 104 HIS CO . 11010 1 976 . 1 1 104 104 HIS CA C 13 58.955 0.0 . 1 . . . . 104 HIS CA . 11010 1 977 . 1 1 104 104 HIS CB C 13 34.121 0.0 . 1 . . . . 104 HIS CB . 11010 1 978 . 1 1 104 104 HIS N N 15 113.428 0.0 . 1 . . . . 104 HIS N . 11010 1 979 . 1 1 105 105 CYS H H 1 8.756 0.0 . 1 . . . . 105 CYS HN . 11010 1 980 . 1 1 105 105 CYS HA H 1 4.894 0.0 . 1 . . . . 105 CYS HA . 11010 1 981 . 1 1 105 105 CYS HB2 H 1 2.729 0.0 . 1 . . . . 105 CYS HB1 . 11010 1 982 . 1 1 105 105 CYS HB3 H 1 3.481 0.0 . 1 . . . . 105 CYS HB2 . 11010 1 983 . 1 1 105 105 CYS C C 13 172.757 0.0 . 1 . . . . 105 CYS CO . 11010 1 984 . 1 1 105 105 CYS CA C 13 56.595 0.0 . 1 . . . . 105 CYS CA . 11010 1 985 . 1 1 105 105 CYS CB C 13 28.977 0.0 . 1 . . . . 105 CYS CB . 11010 1 986 . 1 1 105 105 CYS N N 15 117.65 0.0 . 1 . . . . 105 CYS N . 11010 1 987 . 1 1 106 106 PRO HD2 H 1 3.231 0.0 . 1 . . . . 106 PRO HD1 . 11010 1 988 . 1 1 106 106 PRO CA C 13 65.10617 0.0 . 1 . . . . 106 PRO CA . 11010 1 989 . 1 1 107 107 ASN H H 1 8.649243 0.0 . 1 . . . . 107 ASN HN . 11010 1 990 . 1 1 107 107 ASN HA H 1 4.895 0.0 . 1 . . . . 107 ASN HA . 11010 1 991 . 1 1 107 107 ASN HB2 H 1 2.591 0.0 . 1 . . . . 107 ASN HB1 . 11010 1 992 . 1 1 107 107 ASN HB3 H 1 2.901 0.0 . 1 . . . . 107 ASN HB2 . 11010 1 993 . 1 1 107 107 ASN HD21 H 1 6.929 0.0 . 1 . . . . 107 ASN HD21 . 11010 1 994 . 1 1 107 107 ASN HD22 H 1 7.586 0.0 . 1 . . . . 107 ASN HD22 . 11010 1 995 . 1 1 107 107 ASN CA C 13 52.971 0.0 . 1 . . . . 107 ASN CA . 11010 1 996 . 1 1 107 107 ASN CB C 13 40.185 0.0 . 1 . . . . 107 ASN CB . 11010 1 997 . 1 1 107 107 ASN N N 15 111.951 0.0 . 1 . . . . 107 ASN N . 11010 1 998 . 1 1 107 107 ASN ND2 N 15 113.543 0.0 . 1 . . . . 107 ASN ND2 . 11010 1 999 . 1 1 108 108 THR H H 1 6.983 0.0 . 1 . . . . 108 THR HN . 11010 1 1000 . 1 1 108 108 THR HA H 1 4.479 0.0 . 1 . . . . 108 THR HA . 11010 1 1001 . 1 1 108 108 THR HB H 1 4.227 0.0 . 1 . . . . 108 THR HB . 11010 1 1002 . 1 1 108 108 THR HG21 H 1 1.259 0.0 . 1 . . . . 108 THR HG2# . 11010 1 1003 . 1 1 108 108 THR HG22 H 1 1.259 0.0 . 1 . . . . 108 THR HG2# . 11010 1 1004 . 1 1 108 108 THR HG23 H 1 1.259 0.0 . 1 . . . . 108 THR HG2# . 11010 1 1005 . 1 1 108 108 THR CA C 13 62.297 0.0 . 1 . . . . 108 THR CA . 11010 1 1006 . 1 1 108 108 THR CB C 13 70.79377 0.0 . 1 . . . . 108 THR CB . 11010 1 1007 . 1 1 108 108 THR CG2 C 13 22.372 0.0 . 1 . . . . 108 THR CG2 . 11010 1 1008 . 1 1 108 108 THR N N 15 119.596 0.0 . 1 . . . . 108 THR N . 11010 1 1009 . 1 1 109 109 PRO HA H 1 4.439 0.0 . 1 . . . . 109 PRO HA . 11010 1 1010 . 1 1 109 109 PRO HB2 H 1 1.733 0.0 . 1 . . . . 109 PRO HB1 . 11010 1 1011 . 1 1 109 109 PRO HB3 H 1 2.331 0.0 . 1 . . . . 109 PRO HB2 . 11010 1 1012 . 1 1 109 109 PRO HD2 H 1 3.848 0.0 . 1 . . . . 109 PRO HD1 . 11010 1 1013 . 1 1 109 109 PRO HD3 H 1 4.179 0.0 . 1 . . . . 109 PRO HD2 . 11010 1 1014 . 1 1 109 109 PRO HG2 H 1 1.997854 0.0 . 2 . . . . 109 PRO HG# . 11010 1 1015 . 1 1 109 109 PRO CA C 13 63.53 0.0 . 1 . . . . 109 PRO CA . 11010 1 1016 . 1 1 109 109 PRO CB C 13 32.991 0.0 . 1 . . . . 109 PRO CB . 11010 1 1017 . 1 1 109 109 PRO CD C 13 51.676 0.0 . 1 . . . . 109 PRO CD . 11010 1 1018 . 1 1 109 109 PRO CG C 13 27.53638 0.0 . 1 . . . . 109 PRO CG . 11010 1 1019 . 1 1 110 110 ILE H H 1 8.561 0.0 . 1 . . . . 110 ILE HN . 11010 1 1020 . 1 1 110 110 ILE HA H 1 4.838 0.0 . 1 . . . . 110 ILE HA . 11010 1 1021 . 1 1 110 110 ILE HB H 1 1.406 0.0 . 1 . . . . 110 ILE HB . 11010 1 1022 . 1 1 110 110 ILE HD11 H 1 0.831 0.0 . 1 . . . . 110 ILE HD1# . 11010 1 1023 . 1 1 110 110 ILE HD12 H 1 0.831 0.0 . 1 . . . . 110 ILE HD1# . 11010 1 1024 . 1 1 110 110 ILE HD13 H 1 0.831 0.0 . 1 . . . . 110 ILE HD1# . 11010 1 1025 . 1 1 110 110 ILE HG12 H 1 1.411 0.0 . 1 . . . . 110 ILE HG11 . 11010 1 1026 . 1 1 110 110 ILE HG13 H 1 1.859 0.0 . 1 . . . . 110 ILE HG12 . 11010 1 1027 . 1 1 110 110 ILE HG21 H 1 0.752 0.0 . 1 . . . . 110 ILE HG2# . 11010 1 1028 . 1 1 110 110 ILE HG22 H 1 0.752 0.0 . 1 . . . . 110 ILE HG2# . 11010 1 1029 . 1 1 110 110 ILE HG23 H 1 0.752 0.0 . 1 . . . . 110 ILE HG2# . 11010 1 1030 . 1 1 110 110 ILE CA C 13 59.747 0.0 . 1 . . . . 110 ILE CA . 11010 1 1031 . 1 1 110 110 ILE CB C 13 43.573 0.0 . 1 . . . . 110 ILE CB . 11010 1 1032 . 1 1 110 110 ILE CD1 C 13 14.306 0.0 . 1 . . . . 110 ILE CD1 . 11010 1 1033 . 1 1 110 110 ILE CG1 C 13 27.819 0.0 . 1 . . . . 110 ILE CG1 . 11010 1 1034 . 1 1 110 110 ILE CG2 C 13 17.399 0.0 . 1 . . . . 110 ILE CG2 . 11010 1 1035 . 1 1 110 110 ILE N N 15 118.905 0.0 . 1 . . . . 110 ILE N . 11010 1 1036 . 1 1 111 111 ILE H H 1 8.983 0.0 . 1 . . . . 111 ILE HN . 11010 1 1037 . 1 1 111 111 ILE HA H 1 4.275 0.0 . 1 . . . . 111 ILE HA . 11010 1 1038 . 1 1 111 111 ILE HB H 1 1.773 0.0 . 1 . . . . 111 ILE HB . 11010 1 1039 . 1 1 111 111 ILE HD11 H 1 0.487 0.0 . 1 . . . . 111 ILE HD1# . 11010 1 1040 . 1 1 111 111 ILE HD12 H 1 0.487 0.0 . 1 . . . . 111 ILE HD1# . 11010 1 1041 . 1 1 111 111 ILE HD13 H 1 0.487 0.0 . 1 . . . . 111 ILE HD1# . 11010 1 1042 . 1 1 111 111 ILE HG12 H 1 1.026127 0.0 . 1 . . . . 111 ILE HG11 . 11010 1 1043 . 1 1 111 111 ILE HG13 H 1 1.072459 0.0 . 1 . . . . 111 ILE HG12 . 11010 1 1044 . 1 1 111 111 ILE HG21 H 1 0.489 0.0 . 1 . . . . 111 ILE HG2# . 11010 1 1045 . 1 1 111 111 ILE HG22 H 1 0.489 0.0 . 1 . . . . 111 ILE HG2# . 11010 1 1046 . 1 1 111 111 ILE HG23 H 1 0.489 0.0 . 1 . . . . 111 ILE HG2# . 11010 1 1047 . 1 1 111 111 ILE CA C 13 59.249 0.0 . 1 . . . . 111 ILE CA . 11010 1 1048 . 1 1 111 111 ILE CB C 13 38.63 0.0 . 1 . . . . 111 ILE CB . 11010 1 1049 . 1 1 111 111 ILE CD1 C 13 11.556 0.0 . 1 . . . . 111 ILE CD1 . 11010 1 1050 . 1 1 111 111 ILE CG1 C 13 27.803 0.0 . 1 . . . . 111 ILE CG1 . 11010 1 1051 . 1 1 111 111 ILE CG2 C 13 16.853 0.0 . 1 . . . . 111 ILE CG2 . 11010 1 1052 . 1 1 111 111 ILE N N 15 126.51 0.0 . 1 . . . . 111 ILE N . 11010 1 1053 . 1 1 112 112 LEU H H 1 8.297 0.0 . 1 . . . . 112 LEU HN . 11010 1 1054 . 1 1 112 112 LEU HA H 1 5.153417 0.0 . 1 . . . . 112 LEU HA . 11010 1 1055 . 1 1 112 112 LEU HB2 H 1 1.58 0.0 . 1 . . . . 112 LEU HB1 . 11010 1 1056 . 1 1 112 112 LEU HB3 H 1 2.014 0.0 . 1 . . . . 112 LEU HB2 . 11010 1 1057 . 1 1 112 112 LEU HD11 H 1 0.767 0.0 . 1 . . . . 112 LEU HD1# . 11010 1 1058 . 1 1 112 112 LEU HD12 H 1 0.767 0.0 . 1 . . . . 112 LEU HD1# . 11010 1 1059 . 1 1 112 112 LEU HD13 H 1 0.767 0.0 . 1 . . . . 112 LEU HD1# . 11010 1 1060 . 1 1 112 112 LEU HD21 H 1 1.228537 0.0 . 1 . . . . 112 LEU HD2# . 11010 1 1061 . 1 1 112 112 LEU HD22 H 1 1.228537 0.0 . 1 . . . . 112 LEU HD2# . 11010 1 1062 . 1 1 112 112 LEU HD23 H 1 1.228537 0.0 . 1 . . . . 112 LEU HD2# . 11010 1 1063 . 1 1 112 112 LEU HG H 1 1.93 0.0 . 1 . . . . 112 LEU HG . 11010 1 1064 . 1 1 112 112 LEU CA C 13 53.49932 0.0 . 1 . . . . 112 LEU CA . 11010 1 1065 . 1 1 112 112 LEU CD1 C 13 27.082 0.0 . 1 . . . . 112 LEU CD1 . 11010 1 1066 . 1 1 112 112 LEU CD2 C 13 25.483 0.0 . 1 . . . . 112 LEU CD2 . 11010 1 1067 . 1 1 112 112 LEU CG C 13 27.821 0.0 . 1 . . . . 112 LEU CG . 11010 1 1068 . 1 1 112 112 LEU N N 15 108.107 0.0 . 1 . . . . 112 LEU N . 11010 1 1069 . 1 1 113 113 VAL H H 1 9.225 0.0 . 1 . . . . 113 VAL HN . 11010 1 1070 . 1 1 113 113 VAL HA H 1 4.849 0.0 . 1 . . . . 113 VAL HA . 11010 1 1071 . 1 1 113 113 VAL HB H 1 1.98 0.0 . 1 . . . . 113 VAL HB . 11010 1 1072 . 1 1 113 113 VAL HG11 H 1 0.35392 0.0 . 1 . . . . 113 VAL HG1# . 11010 1 1073 . 1 1 113 113 VAL HG12 H 1 0.35392 0.0 . 1 . . . . 113 VAL HG1# . 11010 1 1074 . 1 1 113 113 VAL HG13 H 1 0.35392 0.0 . 1 . . . . 113 VAL HG1# . 11010 1 1075 . 1 1 113 113 VAL HG21 H 1 0.49 0.0 . 1 . . . . 113 VAL HG2# . 11010 1 1076 . 1 1 113 113 VAL HG22 H 1 0.49 0.0 . 1 . . . . 113 VAL HG2# . 11010 1 1077 . 1 1 113 113 VAL HG23 H 1 0.49 0.0 . 1 . . . . 113 VAL HG2# . 11010 1 1078 . 1 1 113 113 VAL C C 13 174.483 0.0 . 1 . . . . 113 VAL CO . 11010 1 1079 . 1 1 113 113 VAL CA C 13 60.198 0.0 . 1 . . . . 113 VAL CA . 11010 1 1080 . 1 1 113 113 VAL CB C 13 34.995 0.0 . 1 . . . . 113 VAL CB . 11010 1 1081 . 1 1 113 113 VAL CG1 C 13 21.909 0.0 . 1 . . . . 113 VAL CG1 . 11010 1 1082 . 1 1 113 113 VAL CG2 C 13 23.193 0.0 . 1 . . . . 113 VAL CG2 . 11010 1 1083 . 1 1 113 113 VAL N N 15 127.84 0.0 . 1 . . . . 113 VAL N . 11010 1 1084 . 1 1 114 114 GLY H H 1 8.775 0.0 . 1 . . . . 114 GLY HN . 11010 1 1085 . 1 1 114 114 GLY HA2 H 1 2.609 0.0 . 1 . . . . 114 GLY HA1 . 11010 1 1086 . 1 1 114 114 GLY HA3 H 1 3.58 0.0 . 1 . . . . 114 GLY HA2 . 11010 1 1087 . 1 1 114 114 GLY C C 13 173.082 0.0 . 1 . . . . 114 GLY CO . 11010 1 1088 . 1 1 114 114 GLY CA C 13 44.501 0.0 . 1 . . . . 114 GLY CA . 11010 1 1089 . 1 1 114 114 GLY N N 15 113.462 0.0 . 1 . . . . 114 GLY N . 11010 1 1090 . 1 1 115 115 THR H H 1 9.204 0.0 . 1 . . . . 115 THR HN . 11010 1 1091 . 1 1 115 115 THR HA H 1 5.181 0.0 . 1 . . . . 115 THR HA . 11010 1 1092 . 1 1 115 115 THR HG1 H 1 5.149 0.0 . 1 . . . . 115 THR HG1 . 11010 1 1093 . 1 1 115 115 THR HG21 H 1 0.5869563 0.0 . 1 . . . . 115 THR HG2# . 11010 1 1094 . 1 1 115 115 THR HG22 H 1 0.5869563 0.0 . 1 . . . . 115 THR HG2# . 11010 1 1095 . 1 1 115 115 THR HG23 H 1 0.5869563 0.0 . 1 . . . . 115 THR HG2# . 11010 1 1096 . 1 1 115 115 THR C C 13 175.279 0.0 . 1 . . . . 115 THR CO . 11010 1 1097 . 1 1 115 115 THR CA C 13 59.971 0.0 . 1 . . . . 115 THR CA . 11010 1 1098 . 1 1 115 115 THR CB C 13 70.289 0.0 . 1 . . . . 115 THR CB . 11010 1 1099 . 1 1 115 115 THR CG2 C 13 22.71 0.0 . 1 . . . . 115 THR CG2 . 11010 1 1100 . 1 1 115 115 THR N N 15 116.219 0.0 . 1 . . . . 115 THR N . 11010 1 1101 . 1 1 116 116 LYS H H 1 9.061 0.0 . 1 . . . . 116 LYS HN . 11010 1 1102 . 1 1 116 116 LYS C C 13 178.25 0.0 . 1 . . . . 116 LYS CO . 11010 1 1103 . 1 1 116 116 LYS CA C 13 57.166 0.0 . 1 . . . . 116 LYS CA . 11010 1 1104 . 1 1 116 116 LYS CB C 13 29.261 0.0 . 1 . . . . 116 LYS CB . 11010 1 1105 . 1 1 116 116 LYS N N 15 107.992 0.0 . 1 . . . . 116 LYS N . 11010 1 1106 . 1 1 117 117 LEU H H 1 8.277 0.0 . 1 . . . . 117 LEU HN . 11010 1 1107 . 1 1 117 117 LEU HA H 1 3.759 0.0 . 1 . . . . 117 LEU HA . 11010 1 1108 . 1 1 117 117 LEU HB2 H 1 1.076 0.0 . 2 . . . . 117 LEU HB# . 11010 1 1109 . 1 1 117 117 LEU HD11 H 1 0.476 0.0 . 1 . . . . 117 LEU HD1# . 11010 1 1110 . 1 1 117 117 LEU HD12 H 1 0.476 0.0 . 1 . . . . 117 LEU HD1# . 11010 1 1111 . 1 1 117 117 LEU HD13 H 1 0.476 0.0 . 1 . . . . 117 LEU HD1# . 11010 1 1112 . 1 1 117 117 LEU HD21 H 1 0.704 0.0 . 1 . . . . 117 LEU HD2# . 11010 1 1113 . 1 1 117 117 LEU HD22 H 1 0.704 0.0 . 1 . . . . 117 LEU HD2# . 11010 1 1114 . 1 1 117 117 LEU HD23 H 1 0.704 0.0 . 1 . . . . 117 LEU HD2# . 11010 1 1115 . 1 1 117 117 LEU HG H 1 1.387 0.0 . 1 . . . . 117 LEU HG . 11010 1 1116 . 1 1 117 117 LEU C C 13 177.647 0.0 . 1 . . . . 117 LEU CO . 11010 1 1117 . 1 1 117 117 LEU CA C 13 58.01932 0.0 . 1 . . . . 117 LEU CA . 11010 1 1118 . 1 1 117 117 LEU CB C 13 42.835 0.0 . 1 . . . . 117 LEU CB . 11010 1 1119 . 1 1 117 117 LEU CD1 C 13 26.23 0.0 . 1 . . . . 117 LEU CD1 . 11010 1 1120 . 1 1 117 117 LEU CD2 C 13 23.285 0.0 . 1 . . . . 117 LEU CD2 . 11010 1 1121 . 1 1 117 117 LEU CG C 13 26.622 0.0 . 1 . . . . 117 LEU CG . 11010 1 1122 . 1 1 117 117 LEU N N 15 115.673 0.0 . 1 . . . . 117 LEU N . 11010 1 1123 . 1 1 118 118 ASP H H 1 8.461 0.0 . 1 . . . . 118 ASP HN . 11010 1 1124 . 1 1 118 118 ASP HA H 1 4.277 0.0 . 1 . . . . 118 ASP HA . 11010 1 1125 . 1 1 118 118 ASP HB2 H 1 2.531 0.0 . 2 . . . . 118 ASP HB# . 11010 1 1126 . 1 1 118 118 ASP C C 13 176.064 0.0 . 1 . . . . 118 ASP CO . 11010 1 1127 . 1 1 118 118 ASP CA C 13 55.456 0.0 . 1 . . . . 118 ASP CA . 11010 1 1128 . 1 1 118 118 ASP CB C 13 40.672 0.0 . 1 . . . . 118 ASP CB . 11010 1 1129 . 1 1 118 118 ASP N N 15 112.055 0.0 . 1 . . . . 118 ASP N . 11010 1 1130 . 1 1 119 119 LEU H H 1 7.83 0.0 . 1 . . . . 119 LEU HN . 11010 1 1131 . 1 1 119 119 LEU HA H 1 4.452 0.0 . 1 . . . . 119 LEU HA . 11010 1 1132 . 1 1 119 119 LEU HB2 H 1 1.806 0.0 . 2 . . . . 119 LEU HB# . 11010 1 1133 . 1 1 119 119 LEU HD11 H 1 0.652 0.0 . 1 . . . . 119 LEU HD1# . 11010 1 1134 . 1 1 119 119 LEU HD12 H 1 0.652 0.0 . 1 . . . . 119 LEU HD1# . 11010 1 1135 . 1 1 119 119 LEU HD13 H 1 0.652 0.0 . 1 . . . . 119 LEU HD1# . 11010 1 1136 . 1 1 119 119 LEU HD21 H 1 0.856 0.0 . 1 . . . . 119 LEU HD2# . 11010 1 1137 . 1 1 119 119 LEU HD22 H 1 0.856 0.0 . 1 . . . . 119 LEU HD2# . 11010 1 1138 . 1 1 119 119 LEU HD23 H 1 0.856 0.0 . 1 . . . . 119 LEU HD2# . 11010 1 1139 . 1 1 119 119 LEU C C 13 178.187 0.0 . 1 . . . . 119 LEU CO . 11010 1 1140 . 1 1 119 119 LEU CA C 13 54.618 0.0 . 1 . . . . 119 LEU CA . 11010 1 1141 . 1 1 119 119 LEU CB C 13 42.76 0.0 . 1 . . . . 119 LEU CB . 11010 1 1142 . 1 1 119 119 LEU CD1 C 13 21.044 0.0 . 1 . . . . 119 LEU CD1 . 11010 1 1143 . 1 1 119 119 LEU CD2 C 13 26.426 0.0 . 1 . . . . 119 LEU CD2 . 11010 1 1144 . 1 1 119 119 LEU N N 15 116.513 0.0 . 1 . . . . 119 LEU N . 11010 1 1145 . 1 1 120 120 ARG H H 1 7.142 0.0 . 1 . . . . 120 ARG HN . 11010 1 1146 . 1 1 120 120 ARG HA H 1 3.508 0.0 . 1 . . . . 120 ARG HA . 11010 1 1147 . 1 1 120 120 ARG HB2 H 1 1.571 0.0 . 1 . . . . 120 ARG HB1 . 11010 1 1148 . 1 1 120 120 ARG HB3 H 1 1.941 0.0 . 1 . . . . 120 ARG HB2 . 11010 1 1149 . 1 1 120 120 ARG HE H 1 6.934 0.0 . 1 . . . . 120 ARG HE . 11010 1 1150 . 1 1 120 120 ARG HG2 H 1 1.357 0.0 . 2 . . . . 120 ARG HG# . 11010 1 1151 . 1 1 120 120 ARG C C 13 174.411 0.0 . 1 . . . . 120 ARG CO . 11010 1 1152 . 1 1 120 120 ARG CA C 13 60.664 0.0 . 1 . . . . 120 ARG CA . 11010 1 1153 . 1 1 120 120 ARG CB C 13 30.324 0.0 . 1 . . . . 120 ARG CB . 11010 1 1154 . 1 1 120 120 ARG N N 15 118.415 0.0 . 1 . . . . 120 ARG N . 11010 1 1155 . 1 1 121 121 ASP H H 1 7.303 0.0 . 1 . . . . 121 ASP HN . 11010 1 1156 . 1 1 121 121 ASP HA H 1 4.765 0.0 . 1 . . . . 121 ASP HA . 11010 1 1157 . 1 1 121 121 ASP HB2 H 1 2.419 0.0 . 1 . . . . 121 ASP HB1 . 11010 1 1158 . 1 1 121 121 ASP HB3 H 1 2.715 0.0 . 1 . . . . 121 ASP HB2 . 11010 1 1159 . 1 1 121 121 ASP C C 13 175.601 0.0 . 1 . . . . 121 ASP CO . 11010 1 1160 . 1 1 121 121 ASP CA C 13 52.612 0.0 . 1 . . . . 121 ASP CA . 11010 1 1161 . 1 1 121 121 ASP CB C 13 41.184 0.0 . 1 . . . . 121 ASP CB . 11010 1 1162 . 1 1 121 121 ASP N N 15 111.59 0.0 . 1 . . . . 121 ASP N . 11010 1 1163 . 1 1 122 122 ASP H H 1 7.155 0.0 . 1 . . . . 122 ASP HN . 11010 1 1164 . 1 1 122 122 ASP HA H 1 4.537 0.0 . 1 . . . . 122 ASP HA . 11010 1 1165 . 1 1 122 122 ASP HB2 H 1 2.663049 0.0 . 1 . . . . 122 ASP HB1 . 11010 1 1166 . 1 1 122 122 ASP HB3 H 1 3.011 0.0 . 1 . . . . 122 ASP HB2 . 11010 1 1167 . 1 1 122 122 ASP C C 13 175.085 0.0 . 1 . . . . 122 ASP CO . 11010 1 1168 . 1 1 122 122 ASP CA C 13 54.004 0.0 . 1 . . . . 122 ASP CA . 11010 1 1169 . 1 1 122 122 ASP CB C 13 43.917 0.0 . 1 . . . . 122 ASP CB . 11010 1 1170 . 1 1 122 122 ASP N N 15 121.554 0.0 . 1 . . . . 122 ASP N . 11010 1 1171 . 1 1 123 123 LYS H H 1 8.773 0.0 . 1 . . . . 123 LYS HN . 11010 1 1172 . 1 1 123 123 LYS HA H 1 3.817 0.0 . 1 . . . . 123 LYS HA . 11010 1 1173 . 1 1 123 123 LYS HB2 H 1 1.75 0.0 . 1 . . . . 123 LYS HB1 . 11010 1 1174 . 1 1 123 123 LYS HB3 H 1 1.844 0.0 . 1 . . . . 123 LYS HB2 . 11010 1 1175 . 1 1 123 123 LYS HD2 H 1 1.644 0.0 . 2 . . . . 123 LYS HD# . 11010 1 1176 . 1 1 123 123 LYS HE2 H 1 2.932 0.0 . 2 . . . . 123 LYS HE# . 11010 1 1177 . 1 1 123 123 LYS HG2 H 1 1.333 0.0 . 1 . . . . 123 LYS HG1 . 11010 1 1178 . 1 1 123 123 LYS HG3 H 1 1.453 0.0 . 1 . . . . 123 LYS HG2 . 11010 1 1179 . 1 1 123 123 LYS C C 13 178.249 0.0 . 1 . . . . 123 LYS CO . 11010 1 1180 . 1 1 123 123 LYS CA C 13 60.515 0.0 . 1 . . . . 123 LYS CA . 11010 1 1181 . 1 1 123 123 LYS CB C 13 32.323 0.0 . 1 . . . . 123 LYS CB . 11010 1 1182 . 1 1 123 123 LYS CD C 13 29.286 0.0 . 1 . . . . 123 LYS CD . 11010 1 1183 . 1 1 123 123 LYS CE C 13 42.106 0.0 . 1 . . . . 123 LYS CE . 11010 1 1184 . 1 1 123 123 LYS CG C 13 24.799 0.0 . 1 . . . . 123 LYS CG . 11010 1 1185 . 1 1 123 123 LYS N N 15 129.024 0.0 . 1 . . . . 123 LYS N . 11010 1 1186 . 1 1 124 124 ASP H H 1 8.432 0.0 . 1 . . . . 124 ASP HN . 11010 1 1187 . 1 1 124 124 ASP HA H 1 4.3 0.0 . 1 . . . . 124 ASP HA . 11010 1 1188 . 1 1 124 124 ASP HB2 H 1 2.562 0.0 . 1 . . . . 124 ASP HB1 . 11010 1 1189 . 1 1 124 124 ASP HB3 H 1 2.680527 0.0 . 1 . . . . 124 ASP HB2 . 11010 1 1190 . 1 1 124 124 ASP C C 13 178.71 0.0 . 1 . . . . 124 ASP CO . 11010 1 1191 . 1 1 124 124 ASP CA C 13 57.863 0.0 . 1 . . . . 124 ASP CA . 11010 1 1192 . 1 1 124 124 ASP CB C 13 40.493 0.0 . 1 . . . . 124 ASP CB . 11010 1 1193 . 1 1 124 124 ASP N N 15 117.87 0.0 . 1 . . . . 124 ASP N . 11010 1 1194 . 1 1 125 125 THR H H 1 7.992 0.0 . 1 . . . . 125 THR HN . 11010 1 1195 . 1 1 125 125 THR HA H 1 3.785 0.0 . 1 . . . . 125 THR HA . 11010 1 1196 . 1 1 125 125 THR HB H 1 4.567689 0.0 . 1 . . . . 125 THR HB . 11010 1 1197 . 1 1 125 125 THR HG1 H 1 6.881 0.0 . 1 . . . . 125 THR HG1 . 11010 1 1198 . 1 1 125 125 THR HG21 H 1 1.162 0.0 . 1 . . . . 125 THR HG2# . 11010 1 1199 . 1 1 125 125 THR HG22 H 1 1.162 0.0 . 1 . . . . 125 THR HG2# . 11010 1 1200 . 1 1 125 125 THR HG23 H 1 1.162 0.0 . 1 . . . . 125 THR HG2# . 11010 1 1201 . 1 1 125 125 THR C C 13 176.568 0.0 . 1 . . . . 125 THR CO . 11010 1 1202 . 1 1 125 125 THR CA C 13 67.901 0.0 . 1 . . . . 125 THR CA . 11010 1 1203 . 1 1 125 125 THR CB C 13 68.27511 0.0 . 1 . . . . 125 THR CB . 11010 1 1204 . 1 1 125 125 THR CG2 C 13 21.322 0.0 . 1 . . . . 125 THR CG2 . 11010 1 1205 . 1 1 125 125 THR N N 15 118.375 0.0 . 1 . . . . 125 THR N . 11010 1 1206 . 1 1 126 126 ILE H H 1 8.465 0.0 . 1 . . . . 126 ILE HN . 11010 1 1207 . 1 1 126 126 ILE HA H 1 3.452 0.0 . 1 . . . . 126 ILE HA . 11010 1 1208 . 1 1 126 126 ILE HB H 1 1.896 0.0 . 1 . . . . 126 ILE HB . 11010 1 1209 . 1 1 126 126 ILE HD11 H 1 0.733 0.0 . 1 . . . . 126 ILE HD1# . 11010 1 1210 . 1 1 126 126 ILE HD12 H 1 0.733 0.0 . 1 . . . . 126 ILE HD1# . 11010 1 1211 . 1 1 126 126 ILE HD13 H 1 0.733 0.0 . 1 . . . . 126 ILE HD1# . 11010 1 1212 . 1 1 126 126 ILE HG12 H 1 0.947 0.0 . 1 . . . . 126 ILE HG11 . 11010 1 1213 . 1 1 126 126 ILE HG13 H 1 1.621 0.0 . 1 . . . . 126 ILE HG12 . 11010 1 1214 . 1 1 126 126 ILE HG21 H 1 0.856 0.0 . 1 . . . . 126 ILE HG2# . 11010 1 1215 . 1 1 126 126 ILE HG22 H 1 0.856 0.0 . 1 . . . . 126 ILE HG2# . 11010 1 1216 . 1 1 126 126 ILE HG23 H 1 0.856 0.0 . 1 . . . . 126 ILE HG2# . 11010 1 1217 . 1 1 126 126 ILE C C 13 179.465 0.0 . 1 . . . . 126 ILE CO . 11010 1 1218 . 1 1 126 126 ILE CA C 13 65.869 0.0 . 1 . . . . 126 ILE CA . 11010 1 1219 . 1 1 126 126 ILE CB C 13 38.015 0.0 . 1 . . . . 126 ILE CB . 11010 1 1220 . 1 1 126 126 ILE CD1 C 13 13.504 0.0 . 1 . . . . 126 ILE CD1 . 11010 1 1221 . 1 1 126 126 ILE CG1 C 13 29.726 0.0 . 1 . . . . 126 ILE CG1 . 11010 1 1222 . 1 1 126 126 ILE CG2 C 13 17.567 0.0 . 1 . . . . 126 ILE CG2 . 11010 1 1223 . 1 1 126 126 ILE N N 15 121.688 0.0 . 1 . . . . 126 ILE N . 11010 1 1224 . 1 1 127 127 GLU H H 1 8.35 0.0 . 1 . . . . 127 GLU HN . 11010 1 1225 . 1 1 127 127 GLU HA H 1 3.981 0.0 . 1 . . . . 127 GLU HA . 11010 1 1226 . 1 1 127 127 GLU HB2 H 1 1.618 0.0 . 1 . . . . 127 GLU HB1 . 11010 1 1227 . 1 1 127 127 GLU HB3 H 1 2.106 0.0 . 1 . . . . 127 GLU HB2 . 11010 1 1228 . 1 1 127 127 GLU HG2 H 1 2.29 0.0 . 1 . . . . 127 GLU HG1 . 11010 1 1229 . 1 1 127 127 GLU HG3 H 1 2.355 0.0 . 1 . . . . 127 GLU HG2 . 11010 1 1230 . 1 1 127 127 GLU C C 13 179.227 0.0 . 1 . . . . 127 GLU CO . 11010 1 1231 . 1 1 127 127 GLU CA C 13 59.52534 0.0 . 1 . . . . 127 GLU CA . 11010 1 1232 . 1 1 127 127 GLU CB C 13 29.259 0.0 . 1 . . . . 127 GLU CB . 11010 1 1233 . 1 1 127 127 GLU CG C 13 36.424 0.0 . 1 . . . . 127 GLU CG . 11010 1 1234 . 1 1 127 127 GLU N N 15 119.95 0.0 . 1 . . . . 127 GLU N . 11010 1 1235 . 1 1 128 128 LYS H H 1 7.995 0.0 . 1 . . . . 128 LYS HN . 11010 1 1236 . 1 1 128 128 LYS HA H 1 4.069679 0.0 . 1 . . . . 128 LYS HA . 11010 1 1237 . 1 1 128 128 LYS HB2 H 1 1.865 0.0 . 1 . . . . 128 LYS HB1 . 11010 1 1238 . 1 1 128 128 LYS HB3 H 1 1.982 0.0 . 1 . . . . 128 LYS HB2 . 11010 1 1239 . 1 1 128 128 LYS HE2 H 1 2.939942 0.0 . 2 . . . . 128 LYS HE# . 11010 1 1240 . 1 1 128 128 LYS HG2 H 1 1.467 0.0 . 1 . . . . 128 LYS HG1 . 11010 1 1241 . 1 1 128 128 LYS HG3 H 1 1.595 0.0 . 1 . . . . 128 LYS HG2 . 11010 1 1242 . 1 1 128 128 LYS C C 13 180.62 0.0 . 1 . . . . 128 LYS CO . 11010 1 1243 . 1 1 128 128 LYS CA C 13 59.171 0.0 . 1 . . . . 128 LYS CA . 11010 1 1244 . 1 1 128 128 LYS CB C 13 32.026 0.0 . 1 . . . . 128 LYS CB . 11010 1 1245 . 1 1 128 128 LYS CG C 13 25.487 0.0 . 1 . . . . 128 LYS CG . 11010 1 1246 . 1 1 128 128 LYS N N 15 120.431 0.0 . 1 . . . . 128 LYS N . 11010 1 1247 . 1 1 129 129 LEU H H 1 8.149 0.0 . 1 . . . . 129 LEU HN . 11010 1 1248 . 1 1 129 129 LEU HA H 1 4.005 0.0 . 1 . . . . 129 LEU HA . 11010 1 1249 . 1 1 129 129 LEU HB2 H 1 1.07 0.0 . 1 . . . . 129 LEU HB1 . 11010 1 1250 . 1 1 129 129 LEU HB3 H 1 1.814 0.0 . 1 . . . . 129 LEU HB2 . 11010 1 1251 . 1 1 129 129 LEU HD11 H 1 0.615 0.0 . 1 . . . . 129 LEU HD1# . 11010 1 1252 . 1 1 129 129 LEU HD12 H 1 0.615 0.0 . 1 . . . . 129 LEU HD1# . 11010 1 1253 . 1 1 129 129 LEU HD13 H 1 0.615 0.0 . 1 . . . . 129 LEU HD1# . 11010 1 1254 . 1 1 129 129 LEU HD21 H 1 0.752 0.0 . 1 . . . . 129 LEU HD2# . 11010 1 1255 . 1 1 129 129 LEU HD22 H 1 0.752 0.0 . 1 . . . . 129 LEU HD2# . 11010 1 1256 . 1 1 129 129 LEU HD23 H 1 0.752 0.0 . 1 . . . . 129 LEU HD2# . 11010 1 1257 . 1 1 129 129 LEU HG H 1 1.754 0.0 . 1 . . . . 129 LEU HG . 11010 1 1258 . 1 1 129 129 LEU C C 13 179.81 0.0 . 1 . . . . 129 LEU CO . 11010 1 1259 . 1 1 129 129 LEU CA C 13 58.051 0.0 . 1 . . . . 129 LEU CA . 11010 1 1260 . 1 1 129 129 LEU CB C 13 41.536 0.0 . 1 . . . . 129 LEU CB . 11010 1 1261 . 1 1 129 129 LEU CD1 C 13 25.462 0.0 . 1 . . . . 129 LEU CD1 . 11010 1 1262 . 1 1 129 129 LEU CD2 C 13 22.992 0.0 . 1 . . . . 129 LEU CD2 . 11010 1 1263 . 1 1 129 129 LEU CG C 13 27.427 0.0 . 1 . . . . 129 LEU CG . 11010 1 1264 . 1 1 129 129 LEU N N 15 119.569 0.0 . 1 . . . . 129 LEU N . 11010 1 1265 . 1 1 130 130 LYS H H 1 8.314 0.0 . 1 . . . . 130 LYS HN . 11010 1 1266 . 1 1 130 130 LYS HA H 1 4.099 0.0 . 1 . . . . 130 LYS HA . 11010 1 1267 . 1 1 130 130 LYS HB2 H 1 2.017 0.0 . 2 . . . . 130 LYS HB# . 11010 1 1268 . 1 1 130 130 LYS HD2 H 1 1.644 0.0 . 2 . . . . 130 LYS HD# . 11010 1 1269 . 1 1 130 130 LYS HE2 H 1 2.854 0.0 . 2 . . . . 130 LYS HE# . 11010 1 1270 . 1 1 130 130 LYS HG2 H 1 1.423 0.0 . 1 . . . . 130 LYS HG1 . 11010 1 1271 . 1 1 130 130 LYS HG3 H 1 1.588 0.0 . 1 . . . . 130 LYS HG2 . 11010 1 1272 . 1 1 130 130 LYS C C 13 180.955 0.0 . 1 . . . . 130 LYS CO . 11010 1 1273 . 1 1 130 130 LYS CA C 13 59.775 0.0 . 1 . . . . 130 LYS CA . 11010 1 1274 . 1 1 130 130 LYS CB C 13 32.253 0.0 . 1 . . . . 130 LYS CB . 11010 1 1275 . 1 1 130 130 LYS CD C 13 29.545 0.0 . 1 . . . . 130 LYS CD . 11010 1 1276 . 1 1 130 130 LYS CE C 13 42.011 0.0 . 1 . . . . 130 LYS CE . 11010 1 1277 . 1 1 130 130 LYS CG C 13 25.355 0.0 . 1 . . . . 130 LYS CG . 11010 1 1278 . 1 1 130 130 LYS N N 15 120.982 0.0 . 1 . . . . 130 LYS N . 11010 1 1279 . 1 1 131 131 GLU H H 1 7.73 0.0 . 1 . . . . 131 GLU HN . 11010 1 1280 . 1 1 131 131 GLU HA H 1 4.041 0.0 . 1 . . . . 131 GLU HA . 11010 1 1281 . 1 1 131 131 GLU HB2 H 1 2.107677 0.0 . 1 . . . . 131 GLU HB1 . 11010 1 1282 . 1 1 131 131 GLU HB3 H 1 2.174 0.0 . 1 . . . . 131 GLU HB2 . 11010 1 1283 . 1 1 131 131 GLU HG2 H 1 2.3 0.0 . 1 . . . . 131 GLU HG1 . 11010 1 1284 . 1 1 131 131 GLU HG3 H 1 2.541 0.0 . 1 . . . . 131 GLU HG2 . 11010 1 1285 . 1 1 131 131 GLU C C 13 177.778 0.0 . 1 . . . . 131 GLU CO . 11010 1 1286 . 1 1 131 131 GLU CA C 13 59.272 0.0 . 1 . . . . 131 GLU CA . 11010 1 1287 . 1 1 131 131 GLU CB C 13 29.599 0.0 . 1 . . . . 131 GLU CB . 11010 1 1288 . 1 1 131 131 GLU CG C 13 36.431 0.0 . 1 . . . . 131 GLU CG . 11010 1 1289 . 1 1 131 131 GLU N N 15 120.199 0.0 . 1 . . . . 131 GLU N . 11010 1 1290 . 1 1 132 132 LYS H H 1 7.239 0.0 . 1 . . . . 132 LYS HN . 11010 1 1291 . 1 1 132 132 LYS HA H 1 4.384 0.0 . 1 . . . . 132 LYS HA . 11010 1 1292 . 1 1 132 132 LYS HB2 H 1 2.132 0.0 . 2 . . . . 132 LYS HB# . 11010 1 1293 . 1 1 132 132 LYS HD2 H 1 1.619 0.0 . 2 . . . . 132 LYS HD# . 11010 1 1294 . 1 1 132 132 LYS HE2 H 1 2.948 0.0 . 2 . . . . 132 LYS HE# . 11010 1 1295 . 1 1 132 132 LYS HG2 H 1 1.407 0.0 . 1 . . . . 132 LYS HG1 . 11010 1 1296 . 1 1 132 132 LYS HG3 H 1 1.531 0.0 . 1 . . . . 132 LYS HG2 . 11010 1 1297 . 1 1 132 132 LYS C C 13 174.749 0.0 . 1 . . . . 132 LYS CO . 11010 1 1298 . 1 1 132 132 LYS CA C 13 55.164 0.0 . 1 . . . . 132 LYS CA . 11010 1 1299 . 1 1 132 132 LYS CB C 13 32.85 0.0 . 1 . . . . 132 LYS CB . 11010 1 1300 . 1 1 132 132 LYS CD C 13 29.267 0.0 . 1 . . . . 132 LYS CD . 11010 1 1301 . 1 1 132 132 LYS CE C 13 42.319 0.0 . 1 . . . . 132 LYS CE . 11010 1 1302 . 1 1 132 132 LYS CG C 13 25.116 0.0 . 1 . . . . 132 LYS CG . 11010 1 1303 . 1 1 132 132 LYS N N 15 116.441 0.0 . 1 . . . . 132 LYS N . 11010 1 1304 . 1 1 133 133 LYS H H 1 8.05 0.0 . 1 . . . . 133 LYS HN . 11010 1 1305 . 1 1 133 133 LYS HA H 1 3.856 0.0 . 1 . . . . 133 LYS HA . 11010 1 1306 . 1 1 133 133 LYS HB2 H 1 1.9 0.0 . 1 . . . . 133 LYS HB1 . 11010 1 1307 . 1 1 133 133 LYS HB3 H 1 2.103 0.0 . 1 . . . . 133 LYS HB2 . 11010 1 1308 . 1 1 133 133 LYS HD2 H 1 1.596 0.0 . 1 . . . . 133 LYS HD1 . 11010 1 1309 . 1 1 133 133 LYS HD3 H 1 1.64 0.0 . 1 . . . . 133 LYS HD2 . 11010 1 1310 . 1 1 133 133 LYS HE2 H 1 2.953 0.0 . 2 . . . . 133 LYS HE# . 11010 1 1311 . 1 1 133 133 LYS HG2 H 1 1.319 0.0 . 2 . . . . 133 LYS HG# . 11010 1 1312 . 1 1 133 133 LYS C C 13 175.363 0.0 . 1 . . . . 133 LYS CO . 11010 1 1313 . 1 1 133 133 LYS CA C 13 57.257 0.0 . 1 . . . . 133 LYS CA . 11010 1 1314 . 1 1 133 133 LYS CB C 13 28.72 0.0 . 1 . . . . 133 LYS CB . 11010 1 1315 . 1 1 133 133 LYS CD C 13 28.985 0.0 . 1 . . . . 133 LYS CD . 11010 1 1316 . 1 1 133 133 LYS CE C 13 42.186 0.0 . 1 . . . . 133 LYS CE . 11010 1 1317 . 1 1 133 133 LYS CG C 13 25.297 0.0 . 1 . . . . 133 LYS CG . 11010 1 1318 . 1 1 133 133 LYS N N 15 113.916 0.0 . 1 . . . . 133 LYS N . 11010 1 1319 . 1 1 134 134 LEU H H 1 7.909 0.0 . 1 . . . . 134 LEU HN . 11010 1 1320 . 1 1 134 134 LEU HA H 1 4.837 0.0 . 1 . . . . 134 LEU HA . 11010 1 1321 . 1 1 134 134 LEU HB2 H 1 1.205 0.0 . 1 . . . . 134 LEU HB1 . 11010 1 1322 . 1 1 134 134 LEU HB3 H 1 1.628 0.0 . 1 . . . . 134 LEU HB2 . 11010 1 1323 . 1 1 134 134 LEU HD11 H 1 0.849 0.0 . 1 . . . . 134 LEU HD1# . 11010 1 1324 . 1 1 134 134 LEU HD12 H 1 0.849 0.0 . 1 . . . . 134 LEU HD1# . 11010 1 1325 . 1 1 134 134 LEU HD13 H 1 0.849 0.0 . 1 . . . . 134 LEU HD1# . 11010 1 1326 . 1 1 134 134 LEU HD21 H 1 0.856 0.0 . 1 . . . . 134 LEU HD2# . 11010 1 1327 . 1 1 134 134 LEU HD22 H 1 0.856 0.0 . 1 . . . . 134 LEU HD2# . 11010 1 1328 . 1 1 134 134 LEU HD23 H 1 0.856 0.0 . 1 . . . . 134 LEU HD2# . 11010 1 1329 . 1 1 134 134 LEU C C 13 176.374 0.0 . 1 . . . . 134 LEU CO . 11010 1 1330 . 1 1 134 134 LEU CA C 13 52.993 0.0 . 1 . . . . 134 LEU CA . 11010 1 1331 . 1 1 134 134 LEU CB C 13 46.636 0.0 . 1 . . . . 134 LEU CB . 11010 1 1332 . 1 1 134 134 LEU CD1 C 13 25.984 0.0 . 1 . . . . 134 LEU CD1 . 11010 1 1333 . 1 1 134 134 LEU CD2 C 13 22.381 0.0 . 1 . . . . 134 LEU CD2 . 11010 1 1334 . 1 1 134 134 LEU N N 15 117.672 0.0 . 1 . . . . 134 LEU N . 11010 1 1335 . 1 1 135 135 THR H H 1 7.773 0.0 . 1 . . . . 135 THR HN . 11010 1 1336 . 1 1 135 135 THR HA H 1 4.746 0.0 . 1 . . . . 135 THR HA . 11010 1 1337 . 1 1 135 135 THR HB H 1 4.101 0.0 . 1 . . . . 135 THR HB . 11010 1 1338 . 1 1 135 135 THR HG21 H 1 1.094 0.0 . 1 . . . . 135 THR HG2# . 11010 1 1339 . 1 1 135 135 THR HG22 H 1 1.094 0.0 . 1 . . . . 135 THR HG2# . 11010 1 1340 . 1 1 135 135 THR HG23 H 1 1.094 0.0 . 1 . . . . 135 THR HG2# . 11010 1 1341 . 1 1 135 135 THR C C 13 171.292 0.0 . 1 . . . . 135 THR CO . 11010 1 1342 . 1 1 135 135 THR CA C 13 58.929 0.0 . 1 . . . . 135 THR CA . 11010 1 1343 . 1 1 135 135 THR CB C 13 70.644 0.0 . 1 . . . . 135 THR CB . 11010 1 1344 . 1 1 135 135 THR CG2 C 13 21.419 0.0 . 1 . . . . 135 THR CG2 . 11010 1 1345 . 1 1 135 135 THR N N 15 112.601 0.0 . 1 . . . . 135 THR N . 11010 1 1346 . 1 1 136 136 PRO HA H 1 4.271 0.0 . 1 . . . . 136 PRO HA . 11010 1 1347 . 1 1 136 136 PRO HB2 H 1 1.613097 0.0 . 1 . . . . 136 PRO HB1 . 11010 1 1348 . 1 1 136 136 PRO HB3 H 1 2.097 0.0 . 1 . . . . 136 PRO HB2 . 11010 1 1349 . 1 1 136 136 PRO HD2 H 1 3.716 0.0 . 2 . . . . 136 PRO HD# . 11010 1 1350 . 1 1 136 136 PRO HG2 H 1 2.178 0.0 . 2 . . . . 136 PRO HG# . 11010 1 1351 . 1 1 136 136 PRO C C 13 175.277 0.0 . 1 . . . . 136 PRO CO . 11010 1 1352 . 1 1 136 136 PRO CA C 13 62.62 0.0 . 1 . . . . 136 PRO CA . 11010 1 1353 . 1 1 136 136 PRO CB C 13 33.078 0.0 . 1 . . . . 136 PRO CB . 11010 1 1354 . 1 1 136 136 PRO CD C 13 50.75878 0.0 . 1 . . . . 136 PRO CD . 11010 1 1355 . 1 1 136 136 PRO CG C 13 27.745 0.0 . 1 . . . . 136 PRO CG . 11010 1 1356 . 1 1 137 137 ILE H H 1 8.69 0.0 . 1 . . . . 137 ILE HN . 11010 1 1357 . 1 1 137 137 ILE HA H 1 3.892 0.0 . 1 . . . . 137 ILE HA . 11010 1 1358 . 1 1 137 137 ILE HB H 1 1.929 0.0 . 1 . . . . 137 ILE HB . 11010 1 1359 . 1 1 137 137 ILE HD11 H 1 0.364 0.0 . 1 . . . . 137 ILE HD1# . 11010 1 1360 . 1 1 137 137 ILE HD12 H 1 0.364 0.0 . 1 . . . . 137 ILE HD1# . 11010 1 1361 . 1 1 137 137 ILE HD13 H 1 0.364 0.0 . 1 . . . . 137 ILE HD1# . 11010 1 1362 . 1 1 137 137 ILE HG12 H 1 0.709 0.0 . 1 . . . . 137 ILE HG11 . 11010 1 1363 . 1 1 137 137 ILE HG13 H 1 1.176 0.0 . 1 . . . . 137 ILE HG12 . 11010 1 1364 . 1 1 137 137 ILE HG21 H 1 0.154 0.0 . 1 . . . . 137 ILE HG2# . 11010 1 1365 . 1 1 137 137 ILE HG22 H 1 0.154 0.0 . 1 . . . . 137 ILE HG2# . 11010 1 1366 . 1 1 137 137 ILE HG23 H 1 0.154 0.0 . 1 . . . . 137 ILE HG2# . 11010 1 1367 . 1 1 137 137 ILE C C 13 175.822 0.0 . 1 . . . . 137 ILE CO . 11010 1 1368 . 1 1 137 137 ILE CA C 13 59.64627 0.0 . 1 . . . . 137 ILE CA . 11010 1 1369 . 1 1 137 137 ILE CB C 13 36.412 0.0 . 1 . . . . 137 ILE CB . 11010 1 1370 . 1 1 137 137 ILE CD1 C 13 10.519 0.0 . 1 . . . . 137 ILE CD1 . 11010 1 1371 . 1 1 137 137 ILE CG1 C 13 27.108 0.0 . 1 . . . . 137 ILE CG1 . 11010 1 1372 . 1 1 137 137 ILE CG2 C 13 17.126 0.0 . 1 . . . . 137 ILE CG2 . 11010 1 1373 . 1 1 137 137 ILE N N 15 122.52 0.0 . 1 . . . . 137 ILE N . 11010 1 1374 . 1 1 138 138 THR H H 1 7.832 0.0 . 1 . . . . 138 THR HN . 11010 1 1375 . 1 1 138 138 THR HA H 1 4.295 0.0 . 1 . . . . 138 THR HA . 11010 1 1376 . 1 1 138 138 THR HB H 1 4.474 0.0 . 1 . . . . 138 THR HB . 11010 1 1377 . 1 1 138 138 THR HG1 H 1 5.301 0.0 . 1 . . . . 138 THR HG1 . 11010 1 1378 . 1 1 138 138 THR HG21 H 1 1.165 0.0 . 1 . . . . 138 THR HG2# . 11010 1 1379 . 1 1 138 138 THR HG22 H 1 1.165 0.0 . 1 . . . . 138 THR HG2# . 11010 1 1380 . 1 1 138 138 THR HG23 H 1 1.165 0.0 . 1 . . . . 138 THR HG2# . 11010 1 1381 . 1 1 138 138 THR C C 13 174.342 0.0 . 1 . . . . 138 THR CO . 11010 1 1382 . 1 1 138 138 THR CA C 13 60.42 0.0 . 1 . . . . 138 THR CA . 11010 1 1383 . 1 1 138 138 THR CB C 13 71.143 0.0 . 1 . . . . 138 THR CB . 11010 1 1384 . 1 1 138 138 THR CG2 C 13 22.089 0.0 . 1 . . . . 138 THR CG2 . 11010 1 1385 . 1 1 138 138 THR N N 15 116.215 0.0 . 1 . . . . 138 THR N . 11010 1 1386 . 1 1 139 139 TYR H H 1 9.046 0.0 . 1 . . . . 139 TYR HN . 11010 1 1387 . 1 1 139 139 TYR HA H 1 4.279 0.0 . 1 . . . . 139 TYR HA . 11010 1 1388 . 1 1 139 139 TYR HB2 H 1 3.105 0.0 . 1 . . . . 139 TYR HB1 . 11010 1 1389 . 1 1 139 139 TYR HB3 H 1 3.300934 0.0 . 1 . . . . 139 TYR HB2 . 11010 1 1390 . 1 1 139 139 TYR HD1 H 1 7.093 0.0 . 3 . . . . 139 TYR HD# . 11010 1 1391 . 1 1 139 139 TYR HE1 H 1 6.754 0.0 . 3 . . . . 139 TYR HE# . 11010 1 1392 . 1 1 139 139 TYR C C 13 174.511 0.0 . 1 . . . . 139 TYR CO . 11010 1 1393 . 1 1 139 139 TYR CA C 13 62.784 0.0 . 1 . . . . 139 TYR CA . 11010 1 1394 . 1 1 139 139 TYR CB C 13 35.899 0.0 . 1 . . . . 139 TYR CB . 11010 1 1395 . 1 1 139 139 TYR CD1 C 13 133.556 0.0 . 3 . . . . 139 TYR CD# . 11010 1 1396 . 1 1 139 139 TYR CE1 C 13 118.085 0.0 . 3 . . . . 139 TYR CE# . 11010 1 1397 . 1 1 139 139 TYR N N 15 120.907 0.0 . 1 . . . . 139 TYR N . 11010 1 1398 . 1 1 140 140 PRO HA H 1 4.01 0.0 . 1 . . . . 140 PRO HA . 11010 1 1399 . 1 1 140 140 PRO HB2 H 1 1.677 0.0 . 1 . . . . 140 PRO HB1 . 11010 1 1400 . 1 1 140 140 PRO HB3 H 1 2.279729 0.0 . 1 . . . . 140 PRO HB2 . 11010 1 1401 . 1 1 140 140 PRO HD2 H 1 3.091 0.0 . 1 . . . . 140 PRO HD1 . 11010 1 1402 . 1 1 140 140 PRO HD3 H 1 3.992 0.0 . 1 . . . . 140 PRO HD2 . 11010 1 1403 . 1 1 140 140 PRO HG2 H 1 2.021 0.0 . 2 . . . . 140 PRO HG# . 11010 1 1404 . 1 1 140 140 PRO C C 13 180.351 0.0 . 1 . . . . 140 PRO CO . 11010 1 1405 . 1 1 140 140 PRO CA C 13 65.975 0.0 . 1 . . . . 140 PRO CA . 11010 1 1406 . 1 1 140 140 PRO CB C 13 31.135 0.0 . 1 . . . . 140 PRO CB . 11010 1 1407 . 1 1 140 140 PRO CD C 13 49.608 0.0 . 1 . . . . 140 PRO CD . 11010 1 1408 . 1 1 140 140 PRO CG C 13 28.62914 0.0 . 1 . . . . 140 PRO CG . 11010 1 1409 . 1 1 141 141 GLN H H 1 7.171 0.0 . 1 . . . . 141 GLN HN . 11010 1 1410 . 1 1 141 141 GLN HA H 1 3.909 0.0 . 1 . . . . 141 GLN HA . 11010 1 1411 . 1 1 141 141 GLN HB2 H 1 1.685 0.0 . 1 . . . . 141 GLN HB1 . 11010 1 1412 . 1 1 141 141 GLN HB3 H 1 2.069541 0.0 . 1 . . . . 141 GLN HB2 . 11010 1 1413 . 1 1 141 141 GLN HE21 H 1 6.533 0.0 . 1 . . . . 141 GLN HE21 . 11010 1 1414 . 1 1 141 141 GLN HE22 H 1 7.398 0.0 . 1 . . . . 141 GLN HE22 . 11010 1 1415 . 1 1 141 141 GLN HG2 H 1 2.168 0.0 . 2 . . . . 141 GLN HG# . 11010 1 1416 . 1 1 141 141 GLN C C 13 179.487 0.0 . 1 . . . . 141 GLN CO . 11010 1 1417 . 1 1 141 141 GLN CA C 13 59.014 0.0 . 1 . . . . 141 GLN CA . 11010 1 1418 . 1 1 141 141 GLN CB C 13 28.807 0.0 . 1 . . . . 141 GLN CB . 11010 1 1419 . 1 1 141 141 GLN CG C 13 34.692 0.0 . 1 . . . . 141 GLN CG . 11010 1 1420 . 1 1 141 141 GLN N N 15 116.948 0.0 . 1 . . . . 141 GLN N . 11010 1 1421 . 1 1 141 141 GLN NE2 N 15 109.882 0.0 . 1 . . . . 141 GLN NE2 . 11010 1 1422 . 1 1 142 142 GLY H H 1 8.078 0.0 . 1 . . . . 142 GLY HN . 11010 1 1423 . 1 1 142 142 GLY HA2 H 1 2.996 0.0 . 1 . . . . 142 GLY HA1 . 11010 1 1424 . 1 1 142 142 GLY C C 13 174.89 0.0 . 1 . . . . 142 GLY CO . 11010 1 1425 . 1 1 142 142 GLY CA C 13 46.651 0.0 . 1 . . . . 142 GLY CA . 11010 1 1426 . 1 1 142 142 GLY N N 15 110.309 0.0 . 1 . . . . 142 GLY N . 11010 1 1427 . 1 1 143 143 LEU H H 1 7.803 0.0 . 1 . . . . 143 LEU HN . 11010 1 1428 . 1 1 143 143 LEU HA H 1 3.42 0.0 . 1 . . . . 143 LEU HA . 11010 1 1429 . 1 1 143 143 LEU HB2 H 1 1.16 0.0 . 1 . . . . 143 LEU HB1 . 11010 1 1430 . 1 1 143 143 LEU HB3 H 1 1.34 0.0 . 1 . . . . 143 LEU HB2 . 11010 1 1431 . 1 1 143 143 LEU HD11 H 1 0.868 0.0 . 2 . . . . 143 LEU HD# . 11010 1 1432 . 1 1 143 143 LEU HD12 H 1 0.868 0.0 . 2 . . . . 143 LEU HD# . 11010 1 1433 . 1 1 143 143 LEU HD13 H 1 0.868 0.0 . 2 . . . . 143 LEU HD# . 11010 1 1434 . 1 1 143 143 LEU HG H 1 1.248 0.0 . 1 . . . . 143 LEU HG . 11010 1 1435 . 1 1 143 143 LEU C C 13 179.459 0.0 . 1 . . . . 143 LEU CO . 11010 1 1436 . 1 1 143 143 LEU CA C 13 57.283 0.0 . 1 . . . . 143 LEU CA . 11010 1 1437 . 1 1 143 143 LEU CB C 13 42.383 0.0 . 1 . . . . 143 LEU CB . 11010 1 1438 . 1 1 143 143 LEU CD1 C 13 24.693 0.0 . 2 . . . . 143 LEU CD# . 11010 1 1439 . 1 1 143 143 LEU CG C 13 26.177 0.0 . 1 . . . . 143 LEU CG . 11010 1 1440 . 1 1 143 143 LEU N N 15 120.736 0.0 . 1 . . . . 143 LEU N . 11010 1 1441 . 1 1 144 144 ALA H H 1 7.514 0.0 . 1 . . . . 144 ALA HN . 11010 1 1442 . 1 1 144 144 ALA HA H 1 3.956 0.0 . 1 . . . . 144 ALA HA . 11010 1 1443 . 1 1 144 144 ALA HB1 H 1 1.382 0.0 . 1 . . . . 144 ALA HB# . 11010 1 1444 . 1 1 144 144 ALA HB2 H 1 1.382 0.0 . 1 . . . . 144 ALA HB# . 11010 1 1445 . 1 1 144 144 ALA HB3 H 1 1.382 0.0 . 1 . . . . 144 ALA HB# . 11010 1 1446 . 1 1 144 144 ALA C C 13 180.977 0.0 . 1 . . . . 144 ALA CO . 11010 1 1447 . 1 1 144 144 ALA CA C 13 54.874 0.0 . 1 . . . . 144 ALA CA . 11010 1 1448 . 1 1 144 144 ALA CB C 13 17.86242 0.0 . 1 . . . . 144 ALA CB . 11010 1 1449 . 1 1 144 144 ALA N N 15 119.898 0.0 . 1 . . . . 144 ALA N . 11010 1 1450 . 1 1 145 145 MET H H 1 7.701 0.0 . 1 . . . . 145 MET HN . 11010 1 1451 . 1 1 145 145 MET HA H 1 4.113 0.0 . 1 . . . . 145 MET HA . 11010 1 1452 . 1 1 145 145 MET HB2 H 1 1.86981 0.0 . 2 . . . . 145 MET HB# . 11010 1 1453 . 1 1 145 145 MET C C 13 177.25 0.0 . 1 . . . . 145 MET CO . 11010 1 1454 . 1 1 145 145 MET CA C 13 56.964 0.0 . 1 . . . . 145 MET CA . 11010 1 1455 . 1 1 145 145 MET CB C 13 31.86311 0.0 . 1 . . . . 145 MET CB . 11010 1 1456 . 1 1 145 145 MET CE C 13 16.022 0.0 . 1 . . . . 145 MET CE . 11010 1 1457 . 1 1 145 145 MET N N 15 120.534 0.0 . 1 . . . . 145 MET N . 11010 1 1458 . 1 1 146 146 ALA H H 1 8.121 0.0 . 1 . . . . 146 ALA HN . 11010 1 1459 . 1 1 146 146 ALA HA H 1 3.6 0.0 . 1 . . . . 146 ALA HA . 11010 1 1460 . 1 1 146 146 ALA HB1 H 1 1.381 0.0 . 1 . . . . 146 ALA HB# . 11010 1 1461 . 1 1 146 146 ALA HB2 H 1 1.381 0.0 . 1 . . . . 146 ALA HB# . 11010 1 1462 . 1 1 146 146 ALA HB3 H 1 1.381 0.0 . 1 . . . . 146 ALA HB# . 11010 1 1463 . 1 1 146 146 ALA C C 13 178.926 0.0 . 1 . . . . 146 ALA CO . 11010 1 1464 . 1 1 146 146 ALA CA C 13 54.95 0.0 . 1 . . . . 146 ALA CA . 11010 1 1465 . 1 1 146 146 ALA CB C 13 18.717 0.0 . 1 . . . . 146 ALA CB . 11010 1 1466 . 1 1 146 146 ALA N N 15 120.537 0.0 . 1 . . . . 146 ALA N . 11010 1 1467 . 1 1 147 147 LYS H H 1 7.765 0.0 . 1 . . . . 147 LYS HN . 11010 1 1468 . 1 1 147 147 LYS HA H 1 3.972 0.0 . 1 . . . . 147 LYS HA . 11010 1 1469 . 1 1 147 147 LYS HB2 H 1 1.803 0.0 . 2 . . . . 147 LYS HB# . 11010 1 1470 . 1 1 147 147 LYS HD2 H 1 1.584 0.0 . 2 . . . . 147 LYS HD# . 11010 1 1471 . 1 1 147 147 LYS HE2 H 1 2.85 0.0 . 2 . . . . 147 LYS HE# . 11010 1 1472 . 1 1 147 147 LYS HG2 H 1 1.307 0.0 . 1 . . . . 147 LYS HG1 . 11010 1 1473 . 1 1 147 147 LYS HG3 H 1 1.421386 0.0 . 1 . . . . 147 LYS HG2 . 11010 1 1474 . 1 1 147 147 LYS C C 13 179.72 0.0 . 1 . . . . 147 LYS CO . 11010 1 1475 . 1 1 147 147 LYS CA C 13 58.826 0.0 . 1 . . . . 147 LYS CA . 11010 1 1476 . 1 1 147 147 LYS CB C 13 32.171 0.0 . 1 . . . . 147 LYS CB . 11010 1 1477 . 1 1 147 147 LYS CD C 13 29.222 0.0 . 1 . . . . 147 LYS CD . 11010 1 1478 . 1 1 147 147 LYS CE C 13 42.097 0.0 . 1 . . . . 147 LYS CE . 11010 1 1479 . 1 1 147 147 LYS CG C 13 25.124 0.0 . 1 . . . . 147 LYS CG . 11010 1 1480 . 1 1 147 147 LYS N N 15 116.734 0.0 . 1 . . . . 147 LYS N . 11010 1 1481 . 1 1 148 148 GLU H H 1 7.826 0.0 . 1 . . . . 148 GLU HN . 11010 1 1482 . 1 1 148 148 GLU HA H 1 3.818 0.0 . 1 . . . . 148 GLU HA . 11010 1 1483 . 1 1 148 148 GLU HB2 H 1 2.014 0.0 . 2 . . . . 148 GLU HB# . 11010 1 1484 . 1 1 148 148 GLU HG2 H 1 1.873 0.0 . 1 . . . . 148 GLU HG1 . 11010 1 1485 . 1 1 148 148 GLU HG3 H 1 2.121 0.0 . 1 . . . . 148 GLU HG2 . 11010 1 1486 . 1 1 148 148 GLU C C 13 178.563 0.0 . 1 . . . . 148 GLU CO . 11010 1 1487 . 1 1 148 148 GLU CA C 13 59.624 0.0 . 1 . . . . 148 GLU CA . 11010 1 1488 . 1 1 148 148 GLU CB C 13 29.38632 0.0 . 1 . . . . 148 GLU CB . 11010 1 1489 . 1 1 148 148 GLU CG C 13 35.792 0.0 . 1 . . . . 148 GLU CG . 11010 1 1490 . 1 1 148 148 GLU N N 15 121.159 0.0 . 1 . . . . 148 GLU N . 11010 1 1491 . 1 1 149 149 ILE H H 1 7.487 0.0 . 1 . . . . 149 ILE HN . 11010 1 1492 . 1 1 149 149 ILE HA H 1 3.579 0.0 . 1 . . . . 149 ILE HA . 11010 1 1493 . 1 1 149 149 ILE HB H 1 0.875 0.0 . 1 . . . . 149 ILE HB . 11010 1 1494 . 1 1 149 149 ILE HD11 H 1 0.482 0.0 . 1 . . . . 149 ILE HD1# . 11010 1 1495 . 1 1 149 149 ILE HD12 H 1 0.482 0.0 . 1 . . . . 149 ILE HD1# . 11010 1 1496 . 1 1 149 149 ILE HD13 H 1 0.482 0.0 . 1 . . . . 149 ILE HD1# . 11010 1 1497 . 1 1 149 149 ILE HG12 H 1 0.952 0.0 . 1 . . . . 149 ILE HG11 . 11010 1 1498 . 1 1 149 149 ILE HG13 H 1 1.223 0.0 . 1 . . . . 149 ILE HG12 . 11010 1 1499 . 1 1 149 149 ILE HG21 H 1 0.224 0.0 . 1 . . . . 149 ILE HG2# . 11010 1 1500 . 1 1 149 149 ILE HG22 H 1 0.224 0.0 . 1 . . . . 149 ILE HG2# . 11010 1 1501 . 1 1 149 149 ILE HG23 H 1 0.224 0.0 . 1 . . . . 149 ILE HG2# . 11010 1 1502 . 1 1 149 149 ILE C C 13 174.307 0.0 . 1 . . . . 149 ILE CO . 11010 1 1503 . 1 1 149 149 ILE CA C 13 60.686 0.0 . 1 . . . . 149 ILE CA . 11010 1 1504 . 1 1 149 149 ILE CB C 13 37.034 0.0 . 1 . . . . 149 ILE CB . 11010 1 1505 . 1 1 149 149 ILE CD1 C 13 14.985 0.0 . 1 . . . . 149 ILE CD1 . 11010 1 1506 . 1 1 149 149 ILE CG1 C 13 24.813 0.0 . 1 . . . . 149 ILE CG1 . 11010 1 1507 . 1 1 149 149 ILE CG2 C 13 16.372 0.0 . 1 . . . . 149 ILE CG2 . 11010 1 1508 . 1 1 149 149 ILE N N 15 108.473 0.0 . 1 . . . . 149 ILE N . 11010 1 1509 . 1 1 150 150 GLY H H 1 7.328 0.0 . 1 . . . . 150 GLY HN . 11010 1 1510 . 1 1 150 150 GLY HA2 H 1 3.677 0.0 . 1 . . . . 150 GLY HA1 . 11010 1 1511 . 1 1 150 150 GLY HA3 H 1 3.773 0.0 . 1 . . . . 150 GLY HA2 . 11010 1 1512 . 1 1 150 150 GLY C C 13 176.24 0.0 . 1 . . . . 150 GLY CO . 11010 1 1513 . 1 1 150 150 GLY CA C 13 46.608 0.0 . 1 . . . . 150 GLY CA . 11010 1 1514 . 1 1 150 150 GLY N N 15 108.347 0.0 . 1 . . . . 150 GLY N . 11010 1 1515 . 1 1 151 151 ALA H H 1 8.528 0.0 . 1 . . . . 151 ALA HN . 11010 1 1516 . 1 1 151 151 ALA HA H 1 4.263 0.0 . 1 . . . . 151 ALA HA . 11010 1 1517 . 1 1 151 151 ALA HB1 H 1 1.193 0.0 . 1 . . . . 151 ALA HB# . 11010 1 1518 . 1 1 151 151 ALA HB2 H 1 1.193 0.0 . 1 . . . . 151 ALA HB# . 11010 1 1519 . 1 1 151 151 ALA HB3 H 1 1.193 0.0 . 1 . . . . 151 ALA HB# . 11010 1 1520 . 1 1 151 151 ALA C C 13 177.744 0.0 . 1 . . . . 151 ALA CO . 11010 1 1521 . 1 1 151 151 ALA CA C 13 52.072 0.0 . 1 . . . . 151 ALA CA . 11010 1 1522 . 1 1 151 151 ALA CB C 13 19.288 0.0 . 1 . . . . 151 ALA CB . 11010 1 1523 . 1 1 151 151 ALA N N 15 122.087 0.0 . 1 . . . . 151 ALA N . 11010 1 1524 . 1 1 152 152 VAL H H 1 9.032 0.0 . 1 . . . . 152 VAL HN . 11010 1 1525 . 1 1 152 152 VAL HA H 1 3.838 0.0 . 1 . . . . 152 VAL HA . 11010 1 1526 . 1 1 152 152 VAL HB H 1 2.015 0.0 . 1 . . . . 152 VAL HB . 11010 1 1527 . 1 1 152 152 VAL HG11 H 1 0.9932001 0.0 . 1 . . . . 152 VAL HG1# . 11010 1 1528 . 1 1 152 152 VAL HG12 H 1 0.9932001 0.0 . 1 . . . . 152 VAL HG1# . 11010 1 1529 . 1 1 152 152 VAL HG13 H 1 0.9932001 0.0 . 1 . . . . 152 VAL HG1# . 11010 1 1530 . 1 1 152 152 VAL HG21 H 1 0.999 0.0 . 1 . . . . 152 VAL HG2# . 11010 1 1531 . 1 1 152 152 VAL HG22 H 1 0.999 0.0 . 1 . . . . 152 VAL HG2# . 11010 1 1532 . 1 1 152 152 VAL HG23 H 1 0.999 0.0 . 1 . . . . 152 VAL HG2# . 11010 1 1533 . 1 1 152 152 VAL C C 13 176.426 0.0 . 1 . . . . 152 VAL CO . 11010 1 1534 . 1 1 152 152 VAL CA C 13 64.216 0.0 . 1 . . . . 152 VAL CA . 11010 1 1535 . 1 1 152 152 VAL CB C 13 32.373 0.0 . 1 . . . . 152 VAL CB . 11010 1 1536 . 1 1 152 152 VAL CG1 C 13 21.44449 0.0 . 1 . . . . 152 VAL CG1 . 11010 1 1537 . 1 1 152 152 VAL CG2 C 13 21.9528 0.0 . 1 . . . . 152 VAL CG2 . 11010 1 1538 . 1 1 152 152 VAL N N 15 118.474 0.0 . 1 . . . . 152 VAL N . 11010 1 1539 . 1 1 153 153 LYS H H 1 7.05 0.0 . 1 . . . . 153 LYS HN . 11010 1 1540 . 1 1 153 153 LYS HA H 1 4.430797 0.0 . 1 . . . . 153 LYS HA . 11010 1 1541 . 1 1 153 153 LYS HB2 H 1 1.539 0.0 . 2 . . . . 153 LYS HB# . 11010 1 1542 . 1 1 153 153 LYS HD2 H 1 1.618 0.0 . 1 . . . . 153 LYS HD1 . 11010 1 1543 . 1 1 153 153 LYS HD3 H 1 1.711 0.0 . 1 . . . . 153 LYS HD2 . 11010 1 1544 . 1 1 153 153 LYS HE2 H 1 2.798 0.0 . 1 . . . . 153 LYS HE1 . 11010 1 1545 . 1 1 153 153 LYS HE3 H 1 2.857 0.0 . 1 . . . . 153 LYS HE2 . 11010 1 1546 . 1 1 153 153 LYS HG2 H 1 1.274 0.0 . 1 . . . . 153 LYS HG1 . 11010 1 1547 . 1 1 153 153 LYS HG3 H 1 1.333584 0.0 . 1 . . . . 153 LYS HG2 . 11010 1 1548 . 1 1 153 153 LYS C C 13 173.112 0.0 . 1 . . . . 153 LYS CO . 11010 1 1549 . 1 1 153 153 LYS CA C 13 54.346 0.0 . 1 . . . . 153 LYS CA . 11010 1 1550 . 1 1 153 153 LYS CB C 13 37.675 0.0 . 1 . . . . 153 LYS CB . 11010 1 1551 . 1 1 153 153 LYS CD C 13 28.58 0.0 . 1 . . . . 153 LYS CD . 11010 1 1552 . 1 1 153 153 LYS CE C 13 41.96893 0.0 . 1 . . . . 153 LYS CE . 11010 1 1553 . 1 1 153 153 LYS CG C 13 25.52 0.0 . 1 . . . . 153 LYS CG . 11010 1 1554 . 1 1 153 153 LYS N N 15 113.786 0.0 . 1 . . . . 153 LYS N . 11010 1 1555 . 1 1 154 154 TYR H H 1 8.046 0.0 . 1 . . . . 154 TYR HN . 11010 1 1556 . 1 1 154 154 TYR HA H 1 5.665 0.0 . 1 . . . . 154 TYR HA . 11010 1 1557 . 1 1 154 154 TYR HB2 H 1 2.456 0.0 . 1 . . . . 154 TYR HB1 . 11010 1 1558 . 1 1 154 154 TYR HB3 H 1 2.706711 0.0 . 1 . . . . 154 TYR HB2 . 11010 1 1559 . 1 1 154 154 TYR HD1 H 1 6.111 0.0 . 3 . . . . 154 TYR HD# . 11010 1 1560 . 1 1 154 154 TYR HE1 H 1 6.552 0.0 . 3 . . . . 154 TYR HE# . 11010 1 1561 . 1 1 154 154 TYR HH H 1 10.808 0.0 . 1 . . . . 154 TYR HH . 11010 1 1562 . 1 1 154 154 TYR C C 13 173.228 0.0 . 1 . . . . 154 TYR CO . 11010 1 1563 . 1 1 154 154 TYR CA C 13 55.475 0.0 . 1 . . . . 154 TYR CA . 11010 1 1564 . 1 1 154 154 TYR CB C 13 41.088 0.0 . 1 . . . . 154 TYR CB . 11010 1 1565 . 1 1 154 154 TYR CD1 C 13 132.767 0.0 . 3 . . . . 154 TYR CD# . 11010 1 1566 . 1 1 154 154 TYR CE1 C 13 117.7648 0.0 . 3 . . . . 154 TYR CE# . 11010 1 1567 . 1 1 154 154 TYR N N 15 122.163 0.0 . 1 . . . . 154 TYR N . 11010 1 1568 . 1 1 155 155 LEU H H 1 8.29 0.0 . 1 . . . . 155 LEU HN . 11010 1 1569 . 1 1 155 155 LEU HA H 1 4.326 0.0 . 1 . . . . 155 LEU HA . 11010 1 1570 . 1 1 155 155 LEU HB2 H 1 1.019 0.0 . 1 . . . . 155 LEU HB1 . 11010 1 1571 . 1 1 155 155 LEU HB3 H 1 1.581 0.0 . 1 . . . . 155 LEU HB2 . 11010 1 1572 . 1 1 155 155 LEU HD11 H 1 0.557 0.0 . 1 . . . . 155 LEU HD1# . 11010 1 1573 . 1 1 155 155 LEU HD12 H 1 0.557 0.0 . 1 . . . . 155 LEU HD1# . 11010 1 1574 . 1 1 155 155 LEU HD13 H 1 0.557 0.0 . 1 . . . . 155 LEU HD1# . 11010 1 1575 . 1 1 155 155 LEU HD21 H 1 0.778 0.0 . 1 . . . . 155 LEU HD2# . 11010 1 1576 . 1 1 155 155 LEU HD22 H 1 0.778 0.0 . 1 . . . . 155 LEU HD2# . 11010 1 1577 . 1 1 155 155 LEU HD23 H 1 0.778 0.0 . 1 . . . . 155 LEU HD2# . 11010 1 1578 . 1 1 155 155 LEU HG H 1 1.176 0.0 . 1 . . . . 155 LEU HG . 11010 1 1579 . 1 1 155 155 LEU C C 13 173.321 0.0 . 1 . . . . 155 LEU CO . 11010 1 1580 . 1 1 155 155 LEU CA C 13 52.765 0.0 . 1 . . . . 155 LEU CA . 11010 1 1581 . 1 1 155 155 LEU CB C 13 46.85 0.0 . 1 . . . . 155 LEU CB . 11010 1 1582 . 1 1 155 155 LEU CD1 C 13 28.002 0.0 . 1 . . . . 155 LEU CD1 . 11010 1 1583 . 1 1 155 155 LEU CD2 C 13 23.69 0.0 . 1 . . . . 155 LEU CD2 . 11010 1 1584 . 1 1 155 155 LEU CG C 13 27.18049 0.0 . 1 . . . . 155 LEU CG . 11010 1 1585 . 1 1 155 155 LEU N N 15 127.825 0.0 . 1 . . . . 155 LEU N . 11010 1 1586 . 1 1 156 156 GLU H H 1 7.931 0.0 . 1 . . . . 156 GLU HN . 11010 1 1587 . 1 1 156 156 GLU HA H 1 5.131 0.0 . 1 . . . . 156 GLU HA . 11010 1 1588 . 1 1 156 156 GLU HB2 H 1 1.771 0.0 . 2 . . . . 156 GLU HB# . 11010 1 1589 . 1 1 156 156 GLU HG2 H 1 1.963 0.0 . 1 . . . . 156 GLU HG1 . 11010 1 1590 . 1 1 156 156 GLU HG3 H 1 2.172005 0.0 . 1 . . . . 156 GLU HG2 . 11010 1 1591 . 1 1 156 156 GLU C C 13 177.594 0.0 . 1 . . . . 156 GLU CO . 11010 1 1592 . 1 1 156 156 GLU CA C 13 53.701 0.0 . 1 . . . . 156 GLU CA . 11010 1 1593 . 1 1 156 156 GLU CB C 13 32.968 0.0 . 1 . . . . 156 GLU CB . 11010 1 1594 . 1 1 156 156 GLU N N 15 115.061 0.0 . 1 . . . . 156 GLU N . 11010 1 1595 . 1 1 157 157 CYS H H 1 9.016 0.0 . 1 . . . . 157 CYS HN . 11010 1 1596 . 1 1 157 157 CYS HA H 1 5.167 0.0 . 1 . . . . 157 CYS HA . 11010 1 1597 . 1 1 157 157 CYS HB2 H 1 2.318682 0.0 . 1 . . . . 157 CYS HB1 . 11010 1 1598 . 1 1 157 157 CYS HB3 H 1 2.548 0.0 . 1 . . . . 157 CYS HB2 . 11010 1 1599 . 1 1 157 157 CYS HG H 1 1.126 0.0 . 1 . . . . 157 CYS HG . 11010 1 1600 . 1 1 157 157 CYS C C 13 171.617 0.0 . 1 . . . . 157 CYS CO . 11010 1 1601 . 1 1 157 157 CYS CA C 13 56.11078 0.0 . 1 . . . . 157 CYS CA . 11010 1 1602 . 1 1 157 157 CYS CB C 13 31.914 0.0 . 1 . . . . 157 CYS CB . 11010 1 1603 . 1 1 157 157 CYS N N 15 114.672 0.0 . 1 . . . . 157 CYS N . 11010 1 1604 . 1 1 158 158 SER H H 1 8.36 0.0 . 1 . . . . 158 SER HN . 11010 1 1605 . 1 1 158 158 SER HA H 1 5.183 0.0 . 1 . . . . 158 SER HA . 11010 1 1606 . 1 1 158 158 SER HB2 H 1 3.821 0.0 . 1 . . . . 158 SER HB1 . 11010 1 1607 . 1 1 158 158 SER HB3 H 1 4.002 0.0 . 1 . . . . 158 SER HB2 . 11010 1 1608 . 1 1 158 158 SER HG H 1 6.987 0.0 . 1 . . . . 158 SER HG . 11010 1 1609 . 1 1 158 158 SER C C 13 176.101 0.0 . 1 . . . . 158 SER CO . 11010 1 1610 . 1 1 158 158 SER CA C 13 55.838 0.0 . 1 . . . . 158 SER CA . 11010 1 1611 . 1 1 158 158 SER CB C 13 65.571 0.0 . 1 . . . . 158 SER CB . 11010 1 1612 . 1 1 158 158 SER N N 15 110.669 0.0 . 1 . . . . 158 SER N . 11010 1 1613 . 1 1 159 159 ALA H H 1 9.308 0.0 . 1 . . . . 159 ALA HN . 11010 1 1614 . 1 1 159 159 ALA HA H 1 4.145 0.0 . 1 . . . . 159 ALA HA . 11010 1 1615 . 1 1 159 159 ALA HB1 H 1 1.706 0.0 . 1 . . . . 159 ALA HB# . 11010 1 1616 . 1 1 159 159 ALA HB2 H 1 1.706 0.0 . 1 . . . . 159 ALA HB# . 11010 1 1617 . 1 1 159 159 ALA HB3 H 1 1.706 0.0 . 1 . . . . 159 ALA HB# . 11010 1 1618 . 1 1 159 159 ALA C C 13 177.377 0.0 . 1 . . . . 159 ALA CO . 11010 1 1619 . 1 1 159 159 ALA CA C 13 54.64233 0.0 . 1 . . . . 159 ALA CA . 11010 1 1620 . 1 1 159 159 ALA CB C 13 19.769 0.0 . 1 . . . . 159 ALA CB . 11010 1 1621 . 1 1 159 159 ALA N N 15 132.36 0.0 . 1 . . . . 159 ALA N . 11010 1 1622 . 1 1 160 160 LEU H H 1 7.371 0.0 . 1 . . . . 160 LEU HN . 11010 1 1623 . 1 1 160 160 LEU HA H 1 3.222 0.0 . 1 . . . . 160 LEU HA . 11010 1 1624 . 1 1 160 160 LEU HB2 H 1 0.146 0.0 . 1 . . . . 160 LEU HB1 . 11010 1 1625 . 1 1 160 160 LEU HB3 H 1 1.088 0.0 . 1 . . . . 160 LEU HB2 . 11010 1 1626 . 1 1 160 160 LEU HD11 H 1 -0.084 0.0 . 1 . . . . 160 LEU HD1# . 11010 1 1627 . 1 1 160 160 LEU HD12 H 1 -0.084 0.0 . 1 . . . . 160 LEU HD1# . 11010 1 1628 . 1 1 160 160 LEU HD13 H 1 -0.084 0.0 . 1 . . . . 160 LEU HD1# . 11010 1 1629 . 1 1 160 160 LEU HD21 H 1 0.434 0.0 . 1 . . . . 160 LEU HD2# . 11010 1 1630 . 1 1 160 160 LEU HD22 H 1 0.434 0.0 . 1 . . . . 160 LEU HD2# . 11010 1 1631 . 1 1 160 160 LEU HD23 H 1 0.434 0.0 . 1 . . . . 160 LEU HD2# . 11010 1 1632 . 1 1 160 160 LEU HG H 1 0.79 0.0 . 1 . . . . 160 LEU HG . 11010 1 1633 . 1 1 160 160 LEU C C 13 177.944 0.0 . 1 . . . . 160 LEU CO . 11010 1 1634 . 1 1 160 160 LEU CA C 13 57.8 0.0 . 1 . . . . 160 LEU CA . 11010 1 1635 . 1 1 160 160 LEU CB C 13 43.158 0.0 . 1 . . . . 160 LEU CB . 11010 1 1636 . 1 1 160 160 LEU CD1 C 13 22.995 0.0 . 1 . . . . 160 LEU CD1 . 11010 1 1637 . 1 1 160 160 LEU CD2 C 13 25.679 0.0 . 1 . . . . 160 LEU CD2 . 11010 1 1638 . 1 1 160 160 LEU CG C 13 26.656 0.0 . 1 . . . . 160 LEU CG . 11010 1 1639 . 1 1 160 160 LEU N N 15 118.807 0.0 . 1 . . . . 160 LEU N . 11010 1 1640 . 1 1 161 161 THR H H 1 8.055 0.0 . 1 . . . . 161 THR HN . 11010 1 1641 . 1 1 161 161 THR HA H 1 4.206 0.0 . 1 . . . . 161 THR HA . 11010 1 1642 . 1 1 161 161 THR HB H 1 4.359 0.0 . 1 . . . . 161 THR HB . 11010 1 1643 . 1 1 161 161 THR HG1 H 1 5.269 0.0 . 1 . . . . 161 THR HG1 . 11010 1 1644 . 1 1 161 161 THR HG21 H 1 1.068 0.0 . 1 . . . . 161 THR HG2# . 11010 1 1645 . 1 1 161 161 THR HG22 H 1 1.068 0.0 . 1 . . . . 161 THR HG2# . 11010 1 1646 . 1 1 161 161 THR HG23 H 1 1.068 0.0 . 1 . . . . 161 THR HG2# . 11010 1 1647 . 1 1 161 161 THR C C 13 176.15 0.0 . 1 . . . . 161 THR CO . 11010 1 1648 . 1 1 161 161 THR CA C 13 61.31 0.0 . 1 . . . . 161 THR CA . 11010 1 1649 . 1 1 161 161 THR CB C 13 69.848 0.0 . 1 . . . . 161 THR CB . 11010 1 1650 . 1 1 161 161 THR CG2 C 13 21.74 0.0 . 1 . . . . 161 THR CG2 . 11010 1 1651 . 1 1 161 161 THR N N 15 106.133 0.0 . 1 . . . . 161 THR N . 11010 1 1652 . 1 1 162 162 GLN H H 1 7.335 0.0 . 1 . . . . 162 GLN HN . 11010 1 1653 . 1 1 162 162 GLN HA H 1 3.881786 0.0 . 1 . . . . 162 GLN HA . 11010 1 1654 . 1 1 162 162 GLN HB2 H 1 2.197 0.0 . 1 . . . . 162 GLN HB1 . 11010 1 1655 . 1 1 162 162 GLN HB3 H 1 2.574 0.0 . 1 . . . . 162 GLN HB2 . 11010 1 1656 . 1 1 162 162 GLN HE21 H 1 6.57 0.0 . 1 . . . . 162 GLN HE21 . 11010 1 1657 . 1 1 162 162 GLN HE22 H 1 7.198 0.0 . 1 . . . . 162 GLN HE22 . 11010 1 1658 . 1 1 162 162 GLN HG2 H 1 2.03 0.0 . 1 . . . . 162 GLN HG1 . 11010 1 1659 . 1 1 162 162 GLN HG3 H 1 2.1 0.0 . 1 . . . . 162 GLN HG2 . 11010 1 1660 . 1 1 162 162 GLN C C 13 175.401 0.0 . 1 . . . . 162 GLN CO . 11010 1 1661 . 1 1 162 162 GLN CA C 13 59.22 0.0 . 1 . . . . 162 GLN CA . 11010 1 1662 . 1 1 162 162 GLN CB C 13 25.973 0.0 . 1 . . . . 162 GLN CB . 11010 1 1663 . 1 1 162 162 GLN CG C 13 34.609 0.0 . 1 . . . . 162 GLN CG . 11010 1 1664 . 1 1 162 162 GLN N N 15 112.791 0.0 . 1 . . . . 162 GLN N . 11010 1 1665 . 1 1 162 162 GLN NE2 N 15 111.485 0.0 . 1 . . . . 162 GLN NE2 . 11010 1 1666 . 1 1 163 163 ARG H H 1 7.849 0.0 . 1 . . . . 163 ARG HN . 11010 1 1667 . 1 1 163 163 ARG HA H 1 4.163 0.0 . 1 . . . . 163 ARG HA . 11010 1 1668 . 1 1 163 163 ARG HB2 H 1 1.567561 0.0 . 1 . . . . 163 ARG HB1 . 11010 1 1669 . 1 1 163 163 ARG HB3 H 1 1.665 0.0 . 1 . . . . 163 ARG HB2 . 11010 1 1670 . 1 1 163 163 ARG HD2 H 1 3.055 0.0 . 1 . . . . 163 ARG HD1 . 11010 1 1671 . 1 1 163 163 ARG HD3 H 1 3.125 0.0 . 1 . . . . 163 ARG HD2 . 11010 1 1672 . 1 1 163 163 ARG HE H 1 6.712 0.0 . 1 . . . . 163 ARG HE . 11010 1 1673 . 1 1 163 163 ARG HG2 H 1 1.459 0.0 . 1 . . . . 163 ARG HG1 . 11010 1 1674 . 1 1 163 163 ARG HG3 H 1 1.556 0.0 . 1 . . . . 163 ARG HG2 . 11010 1 1675 . 1 1 163 163 ARG C C 13 177.298 0.0 . 1 . . . . 163 ARG CO . 11010 1 1676 . 1 1 163 163 ARG CA C 13 58.08 0.0 . 1 . . . . 163 ARG CA . 11010 1 1677 . 1 1 163 163 ARG CB C 13 30.166 0.0 . 1 . . . . 163 ARG CB . 11010 1 1678 . 1 1 163 163 ARG CD C 13 43.411 0.0 . 1 . . . . 163 ARG CD . 11010 1 1679 . 1 1 163 163 ARG CG C 13 26.904 0.0 . 1 . . . . 163 ARG CG . 11010 1 1680 . 1 1 163 163 ARG N N 15 123.74 0.0 . 1 . . . . 163 ARG N . 11010 1 1681 . 1 1 164 164 GLY H H 1 9.061 0.0 . 1 . . . . 164 GLY HN . 11010 1 1682 . 1 1 164 164 GLY HA2 H 1 3.847 0.0 . 1 . . . . 164 GLY HA1 . 11010 1 1683 . 1 1 164 164 GLY HA3 H 1 4.14 0.0 . 1 . . . . 164 GLY HA2 . 11010 1 1684 . 1 1 164 164 GLY C C 13 175.226 0.0 . 1 . . . . 164 GLY CO . 11010 1 1685 . 1 1 164 164 GLY CA C 13 46.163 0.0 . 1 . . . . 164 GLY CA . 11010 1 1686 . 1 1 164 164 GLY N N 15 114.837 0.0 . 1 . . . . 164 GLY N . 11010 1 1687 . 1 1 165 165 LEU H H 1 7.468 0.0 . 1 . . . . 165 LEU HN . 11010 1 1688 . 1 1 165 165 LEU HA H 1 3.721 0.0 . 1 . . . . 165 LEU HA . 11010 1 1689 . 1 1 165 165 LEU HB2 H 1 1.168 0.0 . 1 . . . . 165 LEU HB1 . 11010 1 1690 . 1 1 165 165 LEU HB3 H 1 1.919 0.0 . 1 . . . . 165 LEU HB2 . 11010 1 1691 . 1 1 165 165 LEU HD11 H 1 0.991 0.0 . 1 . . . . 165 LEU HD1# . 11010 1 1692 . 1 1 165 165 LEU HD12 H 1 0.991 0.0 . 1 . . . . 165 LEU HD1# . 11010 1 1693 . 1 1 165 165 LEU HD13 H 1 0.991 0.0 . 1 . . . . 165 LEU HD1# . 11010 1 1694 . 1 1 165 165 LEU HD21 H 1 1.040603 0.0 . 1 . . . . 165 LEU HD2# . 11010 1 1695 . 1 1 165 165 LEU HD22 H 1 1.040603 0.0 . 1 . . . . 165 LEU HD2# . 11010 1 1696 . 1 1 165 165 LEU HD23 H 1 1.040603 0.0 . 1 . . . . 165 LEU HD2# . 11010 1 1697 . 1 1 165 165 LEU HG H 1 1.635 0.0 . 1 . . . . 165 LEU HG . 11010 1 1698 . 1 1 165 165 LEU C C 13 177.109 0.0 . 1 . . . . 165 LEU CO . 11010 1 1699 . 1 1 165 165 LEU CA C 13 58.572 0.0 . 1 . . . . 165 LEU CA . 11010 1 1700 . 1 1 165 165 LEU CB C 13 43.621 0.0 . 1 . . . . 165 LEU CB . 11010 1 1701 . 1 1 165 165 LEU CD1 C 13 26.23062 0.0 . 1 . . . . 165 LEU CD1 . 11010 1 1702 . 1 1 165 165 LEU CD2 C 13 25.35892 0.0 . 1 . . . . 165 LEU CD2 . 11010 1 1703 . 1 1 165 165 LEU CG C 13 27.27831 0.0 . 1 . . . . 165 LEU CG . 11010 1 1704 . 1 1 165 165 LEU N N 15 121.07 0.0 . 1 . . . . 165 LEU N . 11010 1 1705 . 1 1 166 166 LYS H H 1 8.529 0.0 . 1 . . . . 166 LYS HN . 11010 1 1706 . 1 1 166 166 LYS HA H 1 4.06 0.0 . 1 . . . . 166 LYS HA . 11010 1 1707 . 1 1 166 166 LYS HB2 H 1 1.944 0.0 . 1 . . . . 166 LYS HB1 . 11010 1 1708 . 1 1 166 166 LYS HB3 H 1 1.987 0.0 . 1 . . . . 166 LYS HB2 . 11010 1 1709 . 1 1 166 166 LYS HD2 H 1 1.675 0.0 . 1 . . . . 166 LYS HD1 . 11010 1 1710 . 1 1 166 166 LYS HD3 H 1 1.771 0.0 . 1 . . . . 166 LYS HD2 . 11010 1 1711 . 1 1 166 166 LYS HE2 H 1 3.059 0.0 . 2 . . . . 166 LYS HE# . 11010 1 1712 . 1 1 166 166 LYS HG2 H 1 1.535 0.0 . 1 . . . . 166 LYS HG1 . 11010 1 1713 . 1 1 166 166 LYS HG3 H 1 1.686 0.0 . 1 . . . . 166 LYS HG2 . 11010 1 1714 . 1 1 166 166 LYS C C 13 179.31 0.0 . 1 . . . . 166 LYS CO . 11010 1 1715 . 1 1 166 166 LYS CA C 13 60.406 0.0 . 1 . . . . 166 LYS CA . 11010 1 1716 . 1 1 166 166 LYS CB C 13 32.332 0.0 . 1 . . . . 166 LYS CB . 11010 1 1717 . 1 1 166 166 LYS CD C 13 29.551 0.0 . 1 . . . . 166 LYS CD . 11010 1 1718 . 1 1 166 166 LYS CE C 13 42.217 0.0 . 1 . . . . 166 LYS CE . 11010 1 1719 . 1 1 166 166 LYS CG C 13 25.519 0.0 . 1 . . . . 166 LYS CG . 11010 1 1720 . 1 1 166 166 LYS N N 15 116.783 0.0 . 1 . . . . 166 LYS N . 11010 1 1721 . 1 1 167 167 THR H H 1 7.713 0.0 . 1 . . . . 167 THR HN . 11010 1 1722 . 1 1 167 167 THR HA H 1 3.816 0.0 . 1 . . . . 167 THR HA . 11010 1 1723 . 1 1 167 167 THR HB H 1 3.813 0.0 . 1 . . . . 167 THR HB . 11010 1 1724 . 1 1 167 167 THR HG21 H 1 1.229 0.0 . 1 . . . . 167 THR HG2# . 11010 1 1725 . 1 1 167 167 THR HG22 H 1 1.229 0.0 . 1 . . . . 167 THR HG2# . 11010 1 1726 . 1 1 167 167 THR HG23 H 1 1.229 0.0 . 1 . . . . 167 THR HG2# . 11010 1 1727 . 1 1 167 167 THR C C 13 174.737 0.0 . 1 . . . . 167 THR CO . 11010 1 1728 . 1 1 167 167 THR CA C 13 66.309 0.0 . 1 . . . . 167 THR CA . 11010 1 1729 . 1 1 167 167 THR CB C 13 69.115 0.0 . 1 . . . . 167 THR CB . 11010 1 1730 . 1 1 167 167 THR CG2 C 13 23.145 0.0 . 1 . . . . 167 THR CG2 . 11010 1 1731 . 1 1 167 167 THR N N 15 113.431 0.0 . 1 . . . . 167 THR N . 11010 1 1732 . 1 1 168 168 VAL H H 1 7.049 0.0 . 1 . . . . 168 VAL HN . 11010 1 1733 . 1 1 168 168 VAL HA H 1 3.06 0.0 . 1 . . . . 168 VAL HA . 11010 1 1734 . 1 1 168 168 VAL HB H 1 1.676 0.0 . 1 . . . . 168 VAL HB . 11010 1 1735 . 1 1 168 168 VAL HG11 H 1 -0.259 0.0 . 1 . . . . 168 VAL HG1# . 11010 1 1736 . 1 1 168 168 VAL HG12 H 1 -0.259 0.0 . 1 . . . . 168 VAL HG1# . 11010 1 1737 . 1 1 168 168 VAL HG13 H 1 -0.259 0.0 . 1 . . . . 168 VAL HG1# . 11010 1 1738 . 1 1 168 168 VAL HG21 H 1 0.711 0.0 . 1 . . . . 168 VAL HG2# . 11010 1 1739 . 1 1 168 168 VAL HG22 H 1 0.711 0.0 . 1 . . . . 168 VAL HG2# . 11010 1 1740 . 1 1 168 168 VAL HG23 H 1 0.711 0.0 . 1 . . . . 168 VAL HG2# . 11010 1 1741 . 1 1 168 168 VAL C C 13 175.885 0.0 . 1 . . . . 168 VAL CO . 11010 1 1742 . 1 1 168 168 VAL CA C 13 66.697 0.0 . 1 . . . . 168 VAL CA . 11010 1 1743 . 1 1 168 168 VAL CB C 13 31.254 0.0 . 1 . . . . 168 VAL CB . 11010 1 1744 . 1 1 168 168 VAL CG1 C 13 21.716 0.0 . 1 . . . . 168 VAL CG1 . 11010 1 1745 . 1 1 168 168 VAL CG2 C 13 22.33368 0.0 . 1 . . . . 168 VAL CG2 . 11010 1 1746 . 1 1 168 168 VAL N N 15 119.101 0.0 . 1 . . . . 168 VAL N . 11010 1 1747 . 1 1 169 169 PHE H H 1 6.251 0.0 . 1 . . . . 169 PHE HN . 11010 1 1748 . 1 1 169 169 PHE HA H 1 3.71956 0.0 . 1 . . . . 169 PHE HA . 11010 1 1749 . 1 1 169 169 PHE HB2 H 1 2.233 0.0 . 1 . . . . 169 PHE HB1 . 11010 1 1750 . 1 1 169 169 PHE HB3 H 1 2.572 0.0 . 1 . . . . 169 PHE HB2 . 11010 1 1751 . 1 1 169 169 PHE HD1 H 1 6.421 0.0 . 3 . . . . 169 PHE HD# . 11010 1 1752 . 1 1 169 169 PHE HE1 H 1 6.584 0.0 . 3 . . . . 169 PHE HE# . 11010 1 1753 . 1 1 169 169 PHE HZ H 1 6.491 0.0 . 1 . . . . 169 PHE HZ . 11010 1 1754 . 1 1 169 169 PHE C C 13 177.4 0.0 . 1 . . . . 169 PHE CO . 11010 1 1755 . 1 1 169 169 PHE CA C 13 61.81 0.0 . 1 . . . . 169 PHE CA . 11010 1 1756 . 1 1 169 169 PHE CB C 13 38.774 0.0 . 1 . . . . 169 PHE CB . 11010 1 1757 . 1 1 169 169 PHE CD1 C 13 130.742 0.0 . 3 . . . . 169 PHE CD# . 11010 1 1758 . 1 1 169 169 PHE CE1 C 13 130.142 0.0 . 3 . . . . 169 PHE CE# . 11010 1 1759 . 1 1 169 169 PHE CZ C 13 127.097 0.0 . 1 . . . . 169 PHE CZ . 11010 1 1760 . 1 1 169 169 PHE N N 15 114.407 0.0 . 1 . . . . 169 PHE N . 11010 1 1761 . 1 1 170 170 ASP H H 1 8.148 0.0 . 1 . . . . 170 ASP HN . 11010 1 1762 . 1 1 170 170 ASP HA H 1 4.24 0.0 . 1 . . . . 170 ASP HA . 11010 1 1763 . 1 1 170 170 ASP HB2 H 1 2.478 0.0 . 1 . . . . 170 ASP HB1 . 11010 1 1764 . 1 1 170 170 ASP HB3 H 1 2.618 0.0 . 1 . . . . 170 ASP HB2 . 11010 1 1765 . 1 1 170 170 ASP C C 13 179.242 0.0 . 1 . . . . 170 ASP CO . 11010 1 1766 . 1 1 170 170 ASP CA C 13 57.8 0.0 . 1 . . . . 170 ASP CA . 11010 1 1767 . 1 1 170 170 ASP CB C 13 40.508 0.0 . 1 . . . . 170 ASP CB . 11010 1 1768 . 1 1 170 170 ASP N N 15 120.029 0.0 . 1 . . . . 170 ASP N . 11010 1 1769 . 1 1 171 171 GLU H H 1 8.254 0.0 . 1 . . . . 171 GLU HN . 11010 1 1770 . 1 1 171 171 GLU HB2 H 1 1.722 0.0 . 1 . . . . 171 GLU HB1 . 11010 1 1771 . 1 1 171 171 GLU HB3 H 1 1.993 0.0 . 1 . . . . 171 GLU HB2 . 11010 1 1772 . 1 1 171 171 GLU HG2 H 1 2.054717 0.0 . 1 . . . . 171 GLU HG1 . 11010 1 1773 . 1 1 171 171 GLU HG3 H 1 2.430673 0.0 . 1 . . . . 171 GLU HG2 . 11010 1 1774 . 1 1 171 171 GLU C C 13 179.613 0.0 . 1 . . . . 171 GLU CO . 11010 1 1775 . 1 1 171 171 GLU CA C 13 58.094 0.0 . 1 . . . . 171 GLU CA . 11010 1 1776 . 1 1 171 171 GLU CB C 13 28.046 0.0 . 1 . . . . 171 GLU CB . 11010 1 1777 . 1 1 171 171 GLU N N 15 115.752 0.0 . 1 . . . . 171 GLU N . 11010 1 1778 . 1 1 172 172 ALA H H 1 7.926 0.0 . 1 . . . . 172 ALA HN . 11010 1 1779 . 1 1 172 172 ALA HA H 1 3.738 0.0 . 1 . . . . 172 ALA HA . 11010 1 1780 . 1 1 172 172 ALA HB1 H 1 1.227 0.0 . 1 . . . . 172 ALA HB# . 11010 1 1781 . 1 1 172 172 ALA HB2 H 1 1.227 0.0 . 1 . . . . 172 ALA HB# . 11010 1 1782 . 1 1 172 172 ALA HB3 H 1 1.227 0.0 . 1 . . . . 172 ALA HB# . 11010 1 1783 . 1 1 172 172 ALA C C 13 177.715 0.0 . 1 . . . . 172 ALA CO . 11010 1 1784 . 1 1 172 172 ALA CA C 13 55.642 0.0 . 1 . . . . 172 ALA CA . 11010 1 1785 . 1 1 172 172 ALA CB C 13 17.198 0.0 . 1 . . . . 172 ALA CB . 11010 1 1786 . 1 1 172 172 ALA N N 15 123.857 0.0 . 1 . . . . 172 ALA N . 11010 1 1787 . 1 1 173 173 ILE H H 1 7.587 0.0 . 1 . . . . 173 ILE HN . 11010 1 1788 . 1 1 173 173 ILE HA H 1 3.41 0.0 . 1 . . . . 173 ILE HA . 11010 1 1789 . 1 1 173 173 ILE HB H 1 1.956 0.0 . 1 . . . . 173 ILE HB . 11010 1 1790 . 1 1 173 173 ILE HD11 H 1 0.809 0.0 . 1 . . . . 173 ILE HD1# . 11010 1 1791 . 1 1 173 173 ILE HD12 H 1 0.809 0.0 . 1 . . . . 173 ILE HD1# . 11010 1 1792 . 1 1 173 173 ILE HD13 H 1 0.809 0.0 . 1 . . . . 173 ILE HD1# . 11010 1 1793 . 1 1 173 173 ILE HG12 H 1 0.745 0.0 . 1 . . . . 173 ILE HG11 . 11010 1 1794 . 1 1 173 173 ILE HG13 H 1 1.893 0.0 . 1 . . . . 173 ILE HG12 . 11010 1 1795 . 1 1 173 173 ILE HG21 H 1 0.756 0.0 . 1 . . . . 173 ILE HG2# . 11010 1 1796 . 1 1 173 173 ILE HG22 H 1 0.756 0.0 . 1 . . . . 173 ILE HG2# . 11010 1 1797 . 1 1 173 173 ILE HG23 H 1 0.756 0.0 . 1 . . . . 173 ILE HG2# . 11010 1 1798 . 1 1 173 173 ILE C C 13 179.292 0.0 . 1 . . . . 173 ILE CO . 11010 1 1799 . 1 1 173 173 ILE CA C 13 65.587 0.0 . 1 . . . . 173 ILE CA . 11010 1 1800 . 1 1 173 173 ILE CB C 13 37.997 0.0 . 1 . . . . 173 ILE CB . 11010 1 1801 . 1 1 173 173 ILE CD1 C 13 14.844 0.0 . 1 . . . . 173 ILE CD1 . 11010 1 1802 . 1 1 173 173 ILE CG1 C 13 30.253 0.0 . 1 . . . . 173 ILE CG1 . 11010 1 1803 . 1 1 173 173 ILE CG2 C 13 18.33 0.0 . 1 . . . . 173 ILE CG2 . 11010 1 1804 . 1 1 173 173 ILE N N 15 114.127 0.0 . 1 . . . . 173 ILE N . 11010 1 1805 . 1 1 174 174 ARG H H 1 8.423 0.0 . 1 . . . . 174 ARG HN . 11010 1 1806 . 1 1 174 174 ARG HA H 1 3.682 0.0 . 1 . . . . 174 ARG HA . 11010 1 1807 . 1 1 174 174 ARG HB2 H 1 1.709 0.0 . 2 . . . . 174 ARG HB# . 11010 1 1808 . 1 1 174 174 ARG HD2 H 1 3.077 0.0 . 2 . . . . 174 ARG HD# . 11010 1 1809 . 1 1 174 174 ARG HG2 H 1 1.462 0.0 . 2 . . . . 174 ARG HG# . 11010 1 1810 . 1 1 174 174 ARG C C 13 177.688 0.0 . 1 . . . . 174 ARG CO . 11010 1 1811 . 1 1 174 174 ARG CA C 13 60.649 0.0 . 1 . . . . 174 ARG CA . 11010 1 1812 . 1 1 174 174 ARG CB C 13 29.802 0.0 . 1 . . . . 174 ARG CB . 11010 1 1813 . 1 1 174 174 ARG CD C 13 43.358 0.0 . 1 . . . . 174 ARG CD . 11010 1 1814 . 1 1 174 174 ARG CG C 13 27.122 0.0 . 1 . . . . 174 ARG CG . 11010 1 1815 . 1 1 174 174 ARG N N 15 119.832 0.0 . 1 . . . . 174 ARG N . 11010 1 1816 . 1 1 175 175 ALA H H 1 7.776 0.0 . 1 . . . . 175 ALA HN . 11010 1 1817 . 1 1 175 175 ALA HA H 1 3.993 0.0 . 1 . . . . 175 ALA HA . 11010 1 1818 . 1 1 175 175 ALA HB1 H 1 1.371 0.0 . 1 . . . . 175 ALA HB# . 11010 1 1819 . 1 1 175 175 ALA HB2 H 1 1.371 0.0 . 1 . . . . 175 ALA HB# . 11010 1 1820 . 1 1 175 175 ALA HB3 H 1 1.371 0.0 . 1 . . . . 175 ALA HB# . 11010 1 1821 . 1 1 175 175 ALA C C 13 177.589 0.0 . 1 . . . . 175 ALA CO . 11010 1 1822 . 1 1 175 175 ALA CA C 13 54.18 0.0 . 1 . . . . 175 ALA CA . 11010 1 1823 . 1 1 175 175 ALA CB C 13 17.95134 0.0 . 1 . . . . 175 ALA CB . 11010 1 1824 . 1 1 175 175 ALA N N 15 118.163 0.0 . 1 . . . . 175 ALA N . 11010 1 1825 . 1 1 176 176 VAL H H 1 7.196 0.0 . 1 . . . . 176 VAL HN . 11010 1 1826 . 1 1 176 176 VAL HA H 1 3.794 0.0 . 1 . . . . 176 VAL HA . 11010 1 1827 . 1 1 176 176 VAL HB H 1 2.103 0.0 . 1 . . . . 176 VAL HB . 11010 1 1828 . 1 1 176 176 VAL HG11 H 1 0.876 0.0 . 2 . . . . 176 VAL HG# . 11010 1 1829 . 1 1 176 176 VAL HG12 H 1 0.876 0.0 . 2 . . . . 176 VAL HG# . 11010 1 1830 . 1 1 176 176 VAL HG13 H 1 0.876 0.0 . 2 . . . . 176 VAL HG# . 11010 1 1831 . 1 1 176 176 VAL C C 13 177.378 0.0 . 1 . . . . 176 VAL CO . 11010 1 1832 . 1 1 176 176 VAL CA C 13 64.011 0.0 . 1 . . . . 176 VAL CA . 11010 1 1833 . 1 1 176 176 VAL CB C 13 33.184 0.0 . 1 . . . . 176 VAL CB . 11010 1 1834 . 1 1 176 176 VAL CG1 C 13 21.892 0.0 . 2 . . . . 176 VAL CG# . 11010 1 1835 . 1 1 176 176 VAL N N 15 114.779 0.0 . 1 . . . . 176 VAL N . 11010 1 1836 . 1 1 177 177 LEU H H 1 8.106 0.0 . 1 . . . . 177 LEU HN . 11010 1 1837 . 1 1 177 177 LEU HA H 1 4.136 0.0 . 1 . . . . 177 LEU HA . 11010 1 1838 . 1 1 177 177 LEU HB2 H 1 1.56 0.0 . 2 . . . . 177 LEU HB# . 11010 1 1839 . 1 1 177 177 LEU HD11 H 1 0.671 0.0 . 1 . . . . 177 LEU HD1# . 11010 1 1840 . 1 1 177 177 LEU HD12 H 1 0.671 0.0 . 1 . . . . 177 LEU HD1# . 11010 1 1841 . 1 1 177 177 LEU HD13 H 1 0.671 0.0 . 1 . . . . 177 LEU HD1# . 11010 1 1842 . 1 1 177 177 LEU HD21 H 1 0.664 0.0 . 1 . . . . 177 LEU HD2# . 11010 1 1843 . 1 1 177 177 LEU HD22 H 1 0.664 0.0 . 1 . . . . 177 LEU HD2# . 11010 1 1844 . 1 1 177 177 LEU HD23 H 1 0.664 0.0 . 1 . . . . 177 LEU HD2# . 11010 1 1845 . 1 1 177 177 LEU HG H 1 1.66 0.0 . 1 . . . . 177 LEU HG . 11010 1 1846 . 1 1 177 177 LEU C C 13 177.892 0.0 . 1 . . . . 177 LEU CO . 11010 1 1847 . 1 1 177 177 LEU CA C 13 56.381 0.0 . 1 . . . . 177 LEU CA . 11010 1 1848 . 1 1 177 177 LEU CB C 13 42.68979 0.0 . 1 . . . . 177 LEU CB . 11010 1 1849 . 1 1 177 177 LEU CD1 C 13 22.396 0.0 . 1 . . . . 177 LEU CD1 . 11010 1 1850 . 1 1 177 177 LEU CD2 C 13 25.81861 0.0 . 1 . . . . 177 LEU CD2 . 11010 1 1851 . 1 1 177 177 LEU CG C 13 26.496 0.0 . 1 . . . . 177 LEU CG . 11010 1 1852 . 1 1 177 177 LEU N N 15 117.115 0.0 . 1 . . . . 177 LEU N . 11010 1 1853 . 1 1 178 178 CYS H H 1 8.174 0.0 . 1 . . . . 178 CYS HN . 11010 1 1854 . 1 1 178 178 CYS HA H 1 4.693 0.0 . 1 . . . . 178 CYS HA . 11010 1 1855 . 1 1 178 178 CYS HB2 H 1 2.767 0.0 . 1 . . . . 178 CYS HB1 . 11010 1 1856 . 1 1 178 178 CYS HB3 H 1 2.881 0.0 . 1 . . . . 178 CYS HB2 . 11010 1 1857 . 1 1 178 178 CYS C C 13 171.421 0.0 . 1 . . . . 178 CYS CO . 11010 1 1858 . 1 1 178 178 CYS CA C 13 56.097 0.0 . 1 . . . . 178 CYS CA . 11010 1 1859 . 1 1 178 178 CYS CB C 13 27.478 0.0 . 1 . . . . 178 CYS CB . 11010 1 1860 . 1 1 178 178 CYS N N 15 117.58 0.0 . 1 . . . . 178 CYS N . 11010 1 1861 . 1 1 179 179 PRO HA H 1 4.646 0.0 . 1 . . . . 179 PRO HA . 11010 1 1862 . 1 1 179 179 PRO HB2 H 1 1.86 0.0 . 1 . . . . 179 PRO HB1 . 11010 1 1863 . 1 1 179 179 PRO HB3 H 1 2.282 0.0 . 1 . . . . 179 PRO HB2 . 11010 1 1864 . 1 1 179 179 PRO HD2 H 1 3.45516 0.0 . 2 . . . . 179 PRO HD# . 11010 1 1865 . 1 1 179 179 PRO HG2 H 1 1.929 0.0 . 2 . . . . 179 PRO HG# . 11010 1 1866 . 1 1 179 179 PRO CA C 13 61.722 0.0 . 1 . . . . 179 PRO CA . 11010 1 1867 . 1 1 179 179 PRO CB C 13 30.672 0.0 . 1 . . . . 179 PRO CB . 11010 1 1868 . 1 1 179 179 PRO CD C 13 50.372 0.0 . 1 . . . . 179 PRO CD . 11010 1 1869 . 1 1 179 179 PRO CG C 13 27.198 0.0 . 1 . . . . 179 PRO CG . 11010 1 1870 . 1 1 180 180 PRO HA H 1 4.667 0.0 . 1 . . . . 180 PRO HA . 11010 1 1871 . 1 1 180 180 PRO HB2 H 1 1.839 0.0 . 1 . . . . 180 PRO HB1 . 11010 1 1872 . 1 1 180 180 PRO HB3 H 1 2.294 0.0 . 1 . . . . 180 PRO HB2 . 11010 1 1873 . 1 1 180 180 PRO HD2 H 1 3.603834 0.0 . 1 . . . . 180 PRO HD1 . 11010 1 1874 . 1 1 180 180 PRO HD3 H 1 3.835 0.0 . 1 . . . . 180 PRO HD2 . 11010 1 1875 . 1 1 180 180 PRO HG2 H 1 1.994 0.0 . 2 . . . . 180 PRO HG# . 11010 1 1876 . 1 1 180 180 PRO CA C 13 61.249 0.0 . 1 . . . . 180 PRO CA . 11010 1 1877 . 1 1 180 180 PRO CB C 13 30.702 0.0 . 1 . . . . 180 PRO CB . 11010 1 1878 . 1 1 180 180 PRO CD C 13 50.372 0.0 . 1 . . . . 180 PRO CD . 11010 1 1879 . 1 1 180 180 PRO CG C 13 27.252 0.0 . 1 . . . . 180 PRO CG . 11010 1 1880 . 1 1 181 181 PRO HA H 1 4.39 0.0 . 1 . . . . 181 PRO HA . 11010 1 1881 . 1 1 181 181 PRO HB2 H 1 1.792616 0.0 . 1 . . . . 181 PRO HB1 . 11010 1 1882 . 1 1 181 181 PRO HB3 H 1 2.20036 0.0 . 1 . . . . 181 PRO HB2 . 11010 1 1883 . 1 1 181 181 PRO HD2 H 1 3.565 0.0 . 1 . . . . 181 PRO HD1 . 11010 1 1884 . 1 1 181 181 PRO HD3 H 1 3.752 0.0 . 1 . . . . 181 PRO HD2 . 11010 1 1885 . 1 1 181 181 PRO HG2 H 1 1.951 0.0 . 2 . . . . 181 PRO HG# . 11010 1 1886 . 1 1 181 181 PRO CA C 13 62.793 0.0 . 1 . . . . 181 PRO CA . 11010 1 1887 . 1 1 181 181 PRO CB C 13 31.88597 0.0 . 1 . . . . 181 PRO CB . 11010 1 1888 . 1 1 181 181 PRO CD C 13 50.411 0.0 . 1 . . . . 181 PRO CD . 11010 1 1889 . 1 1 181 181 PRO CG C 13 27.281 0.0 . 1 . . . . 181 PRO CG . 11010 1 1890 . 1 1 182 182 VAL H H 1 8.116 0.0 . 1 . . . . 182 VAL HN . 11010 1 1891 . 1 1 182 182 VAL HA H 1 3.955 0.0 . 1 . . . . 182 VAL HA . 11010 1 1892 . 1 1 182 182 VAL HB H 1 1.961267 0.0 . 1 . . . . 182 VAL HB . 11010 1 1893 . 1 1 182 182 VAL HG11 H 1 0.8503013 0.0 . 1 . . . . 182 VAL HG1# . 11010 1 1894 . 1 1 182 182 VAL HG12 H 1 0.8503013 0.0 . 1 . . . . 182 VAL HG1# . 11010 1 1895 . 1 1 182 182 VAL HG13 H 1 0.8503013 0.0 . 1 . . . . 182 VAL HG1# . 11010 1 1896 . 1 1 182 182 VAL HG21 H 1 0.888033 0.0 . 1 . . . . 182 VAL HG2# . 11010 1 1897 . 1 1 182 182 VAL HG22 H 1 0.888033 0.0 . 1 . . . . 182 VAL HG2# . 11010 1 1898 . 1 1 182 182 VAL HG23 H 1 0.888033 0.0 . 1 . . . . 182 VAL HG2# . 11010 1 1899 . 1 1 182 182 VAL CA C 13 62.406 0.0 . 1 . . . . 182 VAL CA . 11010 1 1900 . 1 1 182 182 VAL CB C 13 32.78797 0.0 . 1 . . . . 182 VAL CB . 11010 1 1901 . 1 1 182 182 VAL CG1 C 13 21.267 0.0 . 1 . . . . 182 VAL CG1 . 11010 1 1902 . 1 1 182 182 VAL CG2 C 13 20.837 0.0 . 1 . . . . 182 VAL CG2 . 11010 1 1903 . 1 1 182 182 VAL N N 15 120.299 0.0 . 1 . . . . 182 VAL N . 11010 1 1904 . 1 1 183 183 LYS H H 1 8.302 0.0 . 1 . . . . 183 LYS HN . 11010 1 1905 . 1 1 183 183 LYS HA H 1 4.214 0.0 . 1 . . . . 183 LYS HA . 11010 1 1906 . 1 1 183 183 LYS HB2 H 1 1.659 0.0 . 1 . . . . 183 LYS HB1 . 11010 1 1907 . 1 1 183 183 LYS HB3 H 1 1.725 0.0 . 1 . . . . 183 LYS HB2 . 11010 1 1908 . 1 1 183 183 LYS HD2 H 1 1.598 0.0 . 2 . . . . 183 LYS HD# . 11010 1 1909 . 1 1 183 183 LYS HE2 H 1 2.916 0.0 . 2 . . . . 183 LYS HE# . 11010 1 1910 . 1 1 183 183 LYS HG2 H 1 1.318 0.0 . 1 . . . . 183 LYS HG1 . 11010 1 1911 . 1 1 183 183 LYS HG3 H 1 1.372 0.0 . 1 . . . . 183 LYS HG2 . 11010 1 1912 . 1 1 183 183 LYS CA C 13 56.193 0.0 . 1 . . . . 183 LYS CA . 11010 1 1913 . 1 1 183 183 LYS CB C 13 32.954 0.0 . 1 . . . . 183 LYS CB . 11010 1 1914 . 1 1 183 183 LYS CD C 13 29.074 0.0 . 1 . . . . 183 LYS CD . 11010 1 1915 . 1 1 183 183 LYS CE C 13 42.145 0.0 . 1 . . . . 183 LYS CE . 11010 1 1916 . 1 1 183 183 LYS CG C 13 24.829 0.0 . 1 . . . . 183 LYS CG . 11010 1 1917 . 1 1 183 183 LYS N N 15 124.848 0.0 . 1 . . . . 183 LYS N . 11010 1 1918 . 1 1 184 184 LYS H H 1 8.229 0.0 . 1 . . . . 184 LYS HN . 11010 1 1919 . 1 1 184 184 LYS HA H 1 4.215 0.0 . 1 . . . . 184 LYS HA . 11010 1 1920 . 1 1 184 184 LYS HB2 H 1 1.655449 0.0 . 1 . . . . 184 LYS HB1 . 11010 1 1921 . 1 1 184 184 LYS HB3 H 1 1.727653 0.0 . 1 . . . . 184 LYS HB2 . 11010 1 1922 . 1 1 184 184 LYS HD2 H 1 1.597903 0.0 . 2 . . . . 184 LYS HD# . 11010 1 1923 . 1 1 184 184 LYS HE2 H 1 2.912776 0.0 . 2 . . . . 184 LYS HE# . 11010 1 1924 . 1 1 184 184 LYS HG2 H 1 1.317804 0.0 . 1 . . . . 184 LYS HG1 . 11010 1 1925 . 1 1 184 184 LYS HG3 H 1 1.373255 0.0 . 1 . . . . 184 LYS HG2 . 11010 1 1926 . 1 1 184 184 LYS CA C 13 56.566 0.0 . 1 . . . . 184 LYS CA . 11010 1 1927 . 1 1 184 184 LYS CB C 13 33.13635 0.0 . 1 . . . . 184 LYS CB . 11010 1 1928 . 1 1 184 184 LYS CD C 13 29.06064 0.0 . 1 . . . . 184 LYS CD . 11010 1 1929 . 1 1 184 184 LYS CE C 13 42.14215 0.0 . 1 . . . . 184 LYS CE . 11010 1 1930 . 1 1 184 184 LYS CG C 13 24.80302 0.0 . 1 . . . . 184 LYS CG . 11010 1 1931 . 1 1 184 184 LYS N N 15 122.453 0.0 . 1 . . . . 184 LYS N . 11010 1 1932 . 1 1 185 185 ARG H H 1 7.944 0.0 . 1 . . . . 185 ARG HN . 11010 1 1933 . 1 1 185 185 ARG HA H 1 4.074 0.0 . 1 . . . . 185 ARG HA . 11010 1 1934 . 1 1 185 185 ARG HB2 H 1 1.622601 0.0 . 1 . . . . 185 ARG HB1 . 11010 1 1935 . 1 1 185 185 ARG HB3 H 1 1.74 0.0 . 1 . . . . 185 ARG HB2 . 11010 1 1936 . 1 1 185 185 ARG HD2 H 1 3.105 0.0 . 2 . . . . 185 ARG HD# . 11010 1 1937 . 1 1 185 185 ARG HG2 H 1 1.501 0.0 . 2 . . . . 185 ARG HG# . 11010 1 1938 . 1 1 185 185 ARG CA C 13 57.467 0.0 . 1 . . . . 185 ARG CA . 11010 1 1939 . 1 1 185 185 ARG CB C 13 31.5134 0.0 . 1 . . . . 185 ARG CB . 11010 1 1940 . 1 1 185 185 ARG CD C 13 43.437 0.0 . 1 . . . . 185 ARG CD . 11010 1 1941 . 1 1 185 185 ARG CG C 13 27.245 0.0 . 1 . . . . 185 ARG CG . 11010 1 1942 . 1 1 185 185 ARG N N 15 127.408 0.0 . 1 . . . . 185 ARG N . 11010 1 1943 . 1 1 187 187 ARG HA H 1 4.24889 0.0 . 1 . . . . 187 ARG HA . 11010 1 1944 . 1 1 187 187 ARG HB2 H 1 1.679036 0.0 . 1 . . . . 187 ARG HB1 . 11010 1 1945 . 1 1 187 187 ARG HB3 H 1 1.751154 0.0 . 1 . . . . 187 ARG HB2 . 11010 1 1946 . 1 1 187 187 ARG HD2 H 1 3.146 0.0 . 2 . . . . 187 ARG HD# . 11010 1 1947 . 1 1 187 187 ARG HG2 H 1 1.565152 0.0 . 2 . . . . 187 ARG HG# . 11010 1 1948 . 1 1 187 187 ARG CA C 13 56.064 0.0 . 1 . . . . 187 ARG CA . 11010 1 1949 . 1 1 187 187 ARG CB C 13 31.15816 0.0 . 1 . . . . 187 ARG CB . 11010 1 1950 . 1 1 187 187 ARG CD C 13 43.201 0.0 . 1 . . . . 187 ARG CD . 11010 1 1951 . 1 1 187 187 ARG CG C 13 27.29458 0.0 . 1 . . . . 187 ARG CG . 11010 1 1952 . 1 1 188 188 LYS H H 1 7.894 0.0 . 1 . . . . 188 LYS HN . 11010 1 1953 . 1 1 188 188 LYS HA H 1 4.057 0.0 . 1 . . . . 188 LYS HA . 11010 1 1954 . 1 1 188 188 LYS HB2 H 1 1.622 0.0 . 1 . . . . 188 LYS HB1 . 11010 1 1955 . 1 1 188 188 LYS HB3 H 1 1.711 0.0 . 1 . . . . 188 LYS HB2 . 11010 1 1956 . 1 1 188 188 LYS HD2 H 1 1.583 0.0 . 2 . . . . 188 LYS HD# . 11010 1 1957 . 1 1 188 188 LYS HE2 H 1 2.908 0.0 . 2 . . . . 188 LYS HE# . 11010 1 1958 . 1 1 188 188 LYS HG2 H 1 1.307 0.0 . 2 . . . . 188 LYS HG# . 11010 1 1959 . 1 1 188 188 LYS CA C 13 57.772 0.0 . 1 . . . . 188 LYS CA . 11010 1 1960 . 1 1 188 188 LYS CB C 13 33.664 0.0 . 1 . . . . 188 LYS CB . 11010 1 1961 . 1 1 188 188 LYS CD C 13 29.029 0.0 . 1 . . . . 188 LYS CD . 11010 1 1962 . 1 1 188 188 LYS CE C 13 42.167 0.0 . 1 . . . . 188 LYS CE . 11010 1 1963 . 1 1 188 188 LYS CG C 13 24.835 0.0 . 1 . . . . 188 LYS CG . 11010 1 1964 . 1 1 188 188 LYS N N 15 127.232 0.0 . 1 . . . . 188 LYS N . 11010 1 1965 . 1 1 191 191 LEU H H 1 8.194 0.0 . 1 . . . . 191 LEU HN . 11010 1 1966 . 1 1 191 191 LEU HA H 1 4.263 0.0 . 1 . . . . 191 LEU HA . 11010 1 1967 . 1 1 191 191 LEU HB2 H 1 1.489 0.0 . 2 . . . . 191 LEU HB# . 11010 1 1968 . 1 1 191 191 LEU HD11 H 1 0.804 0.0 . 2 . . . . 191 LEU HD# . 11010 1 1969 . 1 1 191 191 LEU HD12 H 1 0.804 0.0 . 2 . . . . 191 LEU HD# . 11010 1 1970 . 1 1 191 191 LEU HD13 H 1 0.804 0.0 . 2 . . . . 191 LEU HD# . 11010 1 1971 . 1 1 191 191 LEU CA C 13 55.07 0.0 . 1 . . . . 191 LEU CA . 11010 1 1972 . 1 1 191 191 LEU CB C 13 42.491 0.0 . 1 . . . . 191 LEU CB . 11010 1 1973 . 1 1 191 191 LEU CD1 C 13 24.922 0.0 . 2 . . . . 191 LEU CD# . 11010 1 1974 . 1 1 191 191 LEU N N 15 123.324 0.0 . 1 . . . . 191 LEU N . 11010 1 1975 . 1 1 192 192 LEU H H 1 7.619 0.0 . 1 . . . . 192 LEU HN . 11010 1 1976 . 1 1 192 192 LEU HA H 1 4.118 0.0 . 1 . . . . 192 LEU HA . 11010 1 1977 . 1 1 192 192 LEU HB2 H 1 1.482 0.0 . 2 . . . . 192 LEU HB# . 11010 1 1978 . 1 1 192 192 LEU HD11 H 1 0.773 0.0 . 1 . . . . 192 LEU HD1# . 11010 1 1979 . 1 1 192 192 LEU HD12 H 1 0.773 0.0 . 1 . . . . 192 LEU HD1# . 11010 1 1980 . 1 1 192 192 LEU HD13 H 1 0.773 0.0 . 1 . . . . 192 LEU HD1# . 11010 1 1981 . 1 1 192 192 LEU HD21 H 1 0.814 0.0 . 1 . . . . 192 LEU HD2# . 11010 1 1982 . 1 1 192 192 LEU HD22 H 1 0.814 0.0 . 1 . . . . 192 LEU HD2# . 11010 1 1983 . 1 1 192 192 LEU HD23 H 1 0.814 0.0 . 1 . . . . 192 LEU HD2# . 11010 1 1984 . 1 1 192 192 LEU HG H 1 1.472 0.0 . 1 . . . . 192 LEU HG . 11010 1 1985 . 1 1 192 192 LEU CA C 13 56.499 0.0 . 1 . . . . 192 LEU CA . 11010 1 1986 . 1 1 192 192 LEU CB C 13 43.487 0.0 . 1 . . . . 192 LEU CB . 11010 1 1987 . 1 1 192 192 LEU CD1 C 13 23.546 0.0 . 1 . . . . 192 LEU CD1 . 11010 1 1988 . 1 1 192 192 LEU CD2 C 13 25.198 0.0 . 1 . . . . 192 LEU CD2 . 11010 1 1989 . 1 1 192 192 LEU CG C 13 26.967 0.0 . 1 . . . . 192 LEU CG . 11010 1 1990 . 1 1 192 192 LEU N N 15 128.298 0.0 . 1 . . . . 192 LEU N . 11010 1 1991 . 2 2 2 2 ILE HA H 1 4.421 0.0 . 1 . . . . 1120 ILE HA . 11010 1 1992 . 2 2 2 2 ILE HB H 1 1.765 0.0 . 1 . . . . 1120 ILE HB . 11010 1 1993 . 2 2 2 2 ILE HD11 H 1 0.782 0.0 . 1 . . . . 1120 ILE HD1# . 11010 1 1994 . 2 2 2 2 ILE HD12 H 1 0.782 0.0 . 1 . . . . 1120 ILE HD1# . 11010 1 1995 . 2 2 2 2 ILE HD13 H 1 0.782 0.0 . 1 . . . . 1120 ILE HD1# . 11010 1 1996 . 2 2 2 2 ILE HG12 H 1 1.116 0.0 . 1 . . . . 1120 ILE HG11 . 11010 1 1997 . 2 2 2 2 ILE HG13 H 1 1.448738 0.0 . 1 . . . . 1120 ILE HG12 . 11010 1 1998 . 2 2 2 2 ILE HG21 H 1 0.906 0.0 . 1 . . . . 1120 ILE HG2# . 11010 1 1999 . 2 2 2 2 ILE HG22 H 1 0.906 0.0 . 1 . . . . 1120 ILE HG2# . 11010 1 2000 . 2 2 2 2 ILE HG23 H 1 0.906 0.0 . 1 . . . . 1120 ILE HG2# . 11010 1 2001 . 2 2 2 2 ILE CA C 13 58.963 0.0 . 1 . . . . 1120 ILE CA . 11010 1 2002 . 2 2 2 2 ILE CB C 13 38.671 0.0 . 1 . . . . 1120 ILE CB . 11010 1 2003 . 2 2 2 2 ILE CD1 C 13 12.88544 0.0 . 1 . . . . 1120 ILE CD1 . 11010 1 2004 . 2 2 2 2 ILE CG1 C 13 26.84709 0.0 . 1 . . . . 1120 ILE CG1 . 11010 1 2005 . 2 2 2 2 ILE CG2 C 13 17.234 0.0 . 1 . . . . 1120 ILE CG2 . 11010 1 2006 . 2 2 3 3 PRO HA H 1 4.358 0.0 . 1 . . . . 1121 PRO HA . 11010 1 2007 . 2 2 3 3 PRO HB2 H 1 1.844 0.0 . 1 . . . . 1121 PRO HB1 . 11010 1 2008 . 2 2 3 3 PRO HB3 H 1 2.254611 0.0 . 1 . . . . 1121 PRO HB2 . 11010 1 2009 . 2 2 3 3 PRO HD2 H 1 3.633218 0.0 . 1 . . . . 1121 PRO HD1 . 11010 1 2010 . 2 2 3 3 PRO HD3 H 1 3.854 0.0 . 1 . . . . 1121 PRO HD2 . 11010 1 2011 . 2 2 3 3 PRO HG2 H 1 1.930935 0.0 . 1 . . . . 1121 PRO HG1 . 11010 1 2012 . 2 2 3 3 PRO HG3 H 1 1.990503 0.0 . 1 . . . . 1121 PRO HG2 . 11010 1 2013 . 2 2 3 3 PRO CA C 13 63.339 0.0 . 1 . . . . 1121 PRO CA . 11010 1 2014 . 2 2 3 3 PRO CB C 13 31.935 0.0 . 1 . . . . 1121 PRO CB . 11010 1 2015 . 2 2 3 3 PRO CD C 13 51.023 0.0 . 1 . . . . 1121 PRO CD . 11010 1 2016 . 2 2 3 3 PRO CG C 13 27.433 0.0 . 1 . . . . 1121 PRO CG . 11010 1 2017 . 2 2 4 4 ALA H H 1 8.414 0.0 . 1 . . . . 1122 ALA HN . 11010 1 2018 . 2 2 4 4 ALA HA H 1 4.249 0.0 . 1 . . . . 1122 ALA HA . 11010 1 2019 . 2 2 4 4 ALA HB1 H 1 1.364 0.0 . 1 . . . . 1122 ALA HB# . 11010 1 2020 . 2 2 4 4 ALA HB2 H 1 1.364 0.0 . 1 . . . . 1122 ALA HB# . 11010 1 2021 . 2 2 4 4 ALA HB3 H 1 1.364 0.0 . 1 . . . . 1122 ALA HB# . 11010 1 2022 . 2 2 4 4 ALA CA C 13 52.79 0.0 . 1 . . . . 1122 ALA CA . 11010 1 2023 . 2 2 4 4 ALA CB C 13 19.058 0.0 . 1 . . . . 1122 ALA CB . 11010 1 2024 . 2 2 4 4 ALA N N 15 124.374 0.0 . 1 . . . . 1122 ALA N . 11010 1 2025 . 2 2 5 5 THR H H 1 8.048 0.0 . 1 . . . . 1123 THR HN . 11010 1 2026 . 2 2 5 5 THR HA H 1 4.249 0.0 . 1 . . . . 1123 THR HA . 11010 1 2027 . 2 2 5 5 THR HB H 1 4.184 0.0 . 1 . . . . 1123 THR HB . 11010 1 2028 . 2 2 5 5 THR HG21 H 1 1.156 0.0 . 1 . . . . 1123 THR HG2# . 11010 1 2029 . 2 2 5 5 THR HG22 H 1 1.156 0.0 . 1 . . . . 1123 THR HG2# . 11010 1 2030 . 2 2 5 5 THR HG23 H 1 1.156 0.0 . 1 . . . . 1123 THR HG2# . 11010 1 2031 . 2 2 5 5 THR CA C 13 62.194 0.0 . 1 . . . . 1123 THR CA . 11010 1 2032 . 2 2 5 5 THR CB C 13 69.67 0.0 . 1 . . . . 1123 THR CB . 11010 1 2033 . 2 2 5 5 THR CG2 C 13 21.78 0.0 . 1 . . . . 1123 THR CG2 . 11010 1 2034 . 2 2 5 5 THR N N 15 112.098 0.0 . 1 . . . . 1123 THR N . 11010 1 2035 . 2 2 6 6 ASN H H 1 8.433 0.0 . 1 . . . . 1124 ASN HN . 11010 1 2036 . 2 2 6 6 ASN HA H 1 4.626 0.0 . 1 . . . . 1124 ASN HA . 11010 1 2037 . 2 2 6 6 ASN HB2 H 1 2.732 0.0 . 1 . . . . 1124 ASN HB1 . 11010 1 2038 . 2 2 6 6 ASN HB3 H 1 2.809 0.0 . 1 . . . . 1124 ASN HB2 . 11010 1 2039 . 2 2 6 6 ASN HD21 H 1 6.913 0.0 . 1 . . . . 1124 ASN HD21 . 11010 1 2040 . 2 2 6 6 ASN HD22 H 1 7.635 0.0 . 1 . . . . 1124 ASN HD22 . 11010 1 2041 . 2 2 6 6 ASN CA C 13 53.851 0.0 . 1 . . . . 1124 ASN CA . 11010 1 2042 . 2 2 6 6 ASN CB C 13 38.384 0.0 . 1 . . . . 1124 ASN CB . 11010 1 2043 . 2 2 6 6 ASN N N 15 120.649 0.0 . 1 . . . . 1124 ASN N . 11010 1 2044 . 2 2 6 6 ASN ND2 N 15 112.418 0.0 . 1 . . . . 1124 ASN ND2 . 11010 1 2045 . 2 2 7 7 LEU H H 1 8.058 0.0 . 1 . . . . 1125 LEU HN . 11010 1 2046 . 2 2 7 7 LEU HA H 1 4.196 0.0 . 1 . . . . 1125 LEU HA . 11010 1 2047 . 2 2 7 7 LEU HB2 H 1 1.526 0.0 . 1 . . . . 1125 LEU HB1 . 11010 1 2048 . 2 2 7 7 LEU HB3 H 1 1.597 0.0 . 1 . . . . 1125 LEU HB2 . 11010 1 2049 . 2 2 7 7 LEU HD11 H 1 0.819 0.0 . 2 . . . . 1125 LEU HD# . 11010 1 2050 . 2 2 7 7 LEU HD12 H 1 0.819 0.0 . 2 . . . . 1125 LEU HD# . 11010 1 2051 . 2 2 7 7 LEU HD13 H 1 0.819 0.0 . 2 . . . . 1125 LEU HD# . 11010 1 2052 . 2 2 7 7 LEU CA C 13 56.299 0.0 . 1 . . . . 1125 LEU CA . 11010 1 2053 . 2 2 7 7 LEU CB C 13 41.825 0.0 . 1 . . . . 1125 LEU CB . 11010 1 2054 . 2 2 7 7 LEU N N 15 121.57 0.0 . 1 . . . . 1125 LEU N . 11010 1 2055 . 2 2 8 8 SER H H 1 8.257 0.0 . 1 . . . . 1126 SER HN . 11010 1 2056 . 2 2 8 8 SER HA H 1 4.299 0.0 . 1 . . . . 1126 SER HA . 11010 1 2057 . 2 2 8 8 SER HB2 H 1 3.892 0.0 . 1 . . . . 1126 SER HB1 . 11010 1 2058 . 2 2 8 8 SER HB3 H 1 4.025 0.0 . 1 . . . . 1126 SER HB2 . 11010 1 2059 . 2 2 8 8 SER CA C 13 59.455 0.0 . 1 . . . . 1126 SER CA . 11010 1 2060 . 2 2 8 8 SER CB C 13 63.235 0.0 . 1 . . . . 1126 SER CB . 11010 1 2061 . 2 2 8 8 SER N N 15 116.058 0.0 . 1 . . . . 1126 SER N . 11010 1 2062 . 2 2 9 9 ARG HA H 1 4.116891 0.0 . 1 . . . . 1127 ARG HA . 11010 1 2063 . 2 2 9 9 ARG HB2 H 1 1.866574 0.0 . 2 . . . . 1127 ARG HB# . 11010 1 2064 . 2 2 9 9 ARG HD2 H 1 3.170302 0.0 . 2 . . . . 1127 ARG HD# . 11010 1 2065 . 2 2 9 9 ARG HG2 H 1 1.535966 0.0 . 1 . . . . 1127 ARG HG1 . 11010 1 2066 . 2 2 9 9 ARG HG3 H 1 1.650427 0.0 . 1 . . . . 1127 ARG HG2 . 11010 1 2067 . 2 2 9 9 ARG CA C 13 58.432 0.0 . 1 . . . . 1127 ARG CA . 11010 1 2068 . 2 2 9 9 ARG CB C 13 29.99 0.0 . 1 . . . . 1127 ARG CB . 11010 1 2069 . 2 2 9 9 ARG CD C 13 43.267 0.0 . 1 . . . . 1127 ARG CD . 11010 1 2070 . 2 2 9 9 ARG CG C 13 27.09 0.0 . 1 . . . . 1127 ARG CG . 11010 1 2071 . 2 2 10 10 VAL H H 1 8.032243 0.0 . 1 . . . . 1128 VAL HN . 11010 1 2072 . 2 2 10 10 VAL HA H 1 3.455467 0.0 . 1 . . . . 1128 VAL HA . 11010 1 2073 . 2 2 10 10 VAL HB H 1 1.997 0.0 . 1 . . . . 1128 VAL HB . 11010 1 2074 . 2 2 10 10 VAL HG11 H 1 0.841 0.0 . 1 . . . . 1128 VAL HG1# . 11010 1 2075 . 2 2 10 10 VAL HG12 H 1 0.841 0.0 . 1 . . . . 1128 VAL HG1# . 11010 1 2076 . 2 2 10 10 VAL HG13 H 1 0.841 0.0 . 1 . . . . 1128 VAL HG1# . 11010 1 2077 . 2 2 10 10 VAL HG21 H 1 0.933 0.0 . 1 . . . . 1128 VAL HG2# . 11010 1 2078 . 2 2 10 10 VAL HG22 H 1 0.933 0.0 . 1 . . . . 1128 VAL HG2# . 11010 1 2079 . 2 2 10 10 VAL HG23 H 1 0.933 0.0 . 1 . . . . 1128 VAL HG2# . 11010 1 2080 . 2 2 10 10 VAL CA C 13 66.65 0.0 . 1 . . . . 1128 VAL CA . 11010 1 2081 . 2 2 10 10 VAL CB C 13 31.948 0.0 . 1 . . . . 1128 VAL CB . 11010 1 2082 . 2 2 10 10 VAL CG1 C 13 21.24722 0.0 . 1 . . . . 1128 VAL CG1 . 11010 1 2083 . 2 2 10 10 VAL CG2 C 13 23.13782 0.0 . 1 . . . . 1128 VAL CG2 . 11010 1 2084 . 2 2 10 10 VAL N N 15 118.515 0.0 . 1 . . . . 1128 VAL N . 11010 1 2085 . 2 2 11 11 ALA H H 1 8.003 0.0 . 1 . . . . 1129 ALA HN . 11010 1 2086 . 2 2 11 11 ALA HA H 1 4.17 0.0 . 1 . . . . 1129 ALA HA . 11010 1 2087 . 2 2 11 11 ALA HB1 H 1 1.405 0.0 . 1 . . . . 1129 ALA HB# . 11010 1 2088 . 2 2 11 11 ALA HB2 H 1 1.405 0.0 . 1 . . . . 1129 ALA HB# . 11010 1 2089 . 2 2 11 11 ALA HB3 H 1 1.405 0.0 . 1 . . . . 1129 ALA HB# . 11010 1 2090 . 2 2 11 11 ALA CA C 13 55.054 0.0 . 1 . . . . 1129 ALA CA . 11010 1 2091 . 2 2 11 11 ALA CB C 13 18.423 0.0 . 1 . . . . 1129 ALA CB . 11010 1 2092 . 2 2 11 11 ALA N N 15 121.16 0.0 . 1 . . . . 1129 ALA N . 11010 1 2093 . 2 2 12 12 GLY H H 1 8.225965 0.0 . 1 . . . . 1130 GLY HN . 11010 1 2094 . 2 2 12 12 GLY HA2 H 1 3.854 0.0 . 1 . . . . 1130 GLY HA1 . 11010 1 2095 . 2 2 12 12 GLY HA3 H 1 3.917 0.0 . 1 . . . . 1130 GLY HA2 . 11010 1 2096 . 2 2 12 12 GLY CA C 13 47.086 0.0 . 1 . . . . 1130 GLY CA . 11010 1 2097 . 2 2 12 12 GLY N N 15 105.436 0.0 . 1 . . . . 1130 GLY N . 11010 1 2098 . 2 2 13 13 LEU H H 1 7.866793 0.0 . 1 . . . . 1131 LEU HN . 11010 1 2099 . 2 2 13 13 LEU HA H 1 4.073 0.0 . 1 . . . . 1131 LEU HA . 11010 1 2100 . 2 2 13 13 LEU HB2 H 1 1.171 0.0 . 1 . . . . 1131 LEU HB1 . 11010 1 2101 . 2 2 13 13 LEU HB3 H 1 2.058 0.0 . 1 . . . . 1131 LEU HB2 . 11010 1 2102 . 2 2 13 13 LEU HD11 H 1 0.6800402 0.0 . 1 . . . . 1131 LEU HD1# . 11010 1 2103 . 2 2 13 13 LEU HD12 H 1 0.6800402 0.0 . 1 . . . . 1131 LEU HD1# . 11010 1 2104 . 2 2 13 13 LEU HD13 H 1 0.6800402 0.0 . 1 . . . . 1131 LEU HD1# . 11010 1 2105 . 2 2 13 13 LEU HD21 H 1 0.893 0.0 . 1 . . . . 1131 LEU HD2# . 11010 1 2106 . 2 2 13 13 LEU HD22 H 1 0.893 0.0 . 1 . . . . 1131 LEU HD2# . 11010 1 2107 . 2 2 13 13 LEU HD23 H 1 0.893 0.0 . 1 . . . . 1131 LEU HD2# . 11010 1 2108 . 2 2 13 13 LEU HG H 1 1.707 0.0 . 1 . . . . 1131 LEU HG . 11010 1 2109 . 2 2 13 13 LEU CA C 13 57.79 0.0 . 1 . . . . 1131 LEU CA . 11010 1 2110 . 2 2 13 13 LEU CB C 13 42.685 0.0 . 1 . . . . 1131 LEU CB . 11010 1 2111 . 2 2 13 13 LEU CD1 C 13 26.123 0.0 . 1 . . . . 1131 LEU CD1 . 11010 1 2112 . 2 2 13 13 LEU CD2 C 13 23.134 0.0 . 1 . . . . 1131 LEU CD2 . 11010 1 2113 . 2 2 13 13 LEU CG C 13 27.243 0.0 . 1 . . . . 1131 LEU CG . 11010 1 2114 . 2 2 13 13 LEU N N 15 124.009 0.0 . 1 . . . . 1131 LEU N . 11010 1 2115 . 2 2 14 14 GLU H H 1 8.658 0.0 . 1 . . . . 1132 GLU HN . 11010 1 2116 . 2 2 14 14 GLU HA H 1 3.839 0.0 . 1 . . . . 1132 GLU HA . 11010 1 2117 . 2 2 14 14 GLU HB2 H 1 1.906 0.0 . 1 . . . . 1132 GLU HB1 . 11010 1 2118 . 2 2 14 14 GLU HB3 H 1 2.131 0.0 . 1 . . . . 1132 GLU HB2 . 11010 1 2119 . 2 2 14 14 GLU HG2 H 1 2.055 0.0 . 1 . . . . 1132 GLU HG1 . 11010 1 2120 . 2 2 14 14 GLU HG3 H 1 2.499 0.0 . 1 . . . . 1132 GLU HG2 . 11010 1 2121 . 2 2 14 14 GLU CA C 13 60.103 0.0 . 1 . . . . 1132 GLU CA . 11010 1 2122 . 2 2 14 14 GLU CB C 13 29.316 0.0 . 1 . . . . 1132 GLU CB . 11010 1 2123 . 2 2 14 14 GLU CG C 13 37.595 0.0 . 1 . . . . 1132 GLU CG . 11010 1 2124 . 2 2 14 14 GLU N N 15 118.527 0.0 . 1 . . . . 1132 GLU N . 11010 1 2125 . 2 2 15 15 LYS H H 1 7.835 0.0 . 1 . . . . 1133 LYS HN . 11010 1 2126 . 2 2 15 15 LYS HA H 1 4.085 0.0 . 1 . . . . 1133 LYS HA . 11010 1 2127 . 2 2 15 15 LYS HB2 H 1 1.929659 0.0 . 2 . . . . 1133 LYS HB# . 11010 1 2128 . 2 2 15 15 LYS HD2 H 1 1.653 0.0 . 2 . . . . 1133 LYS HD# . 11010 1 2129 . 2 2 15 15 LYS HE2 H 1 2.888883 0.0 . 2 . . . . 1133 LYS HE# . 11010 1 2130 . 2 2 15 15 LYS HG2 H 1 1.367483 0.0 . 1 . . . . 1133 LYS HG1 . 11010 1 2131 . 2 2 15 15 LYS HG3 H 1 1.54 0.0 . 1 . . . . 1133 LYS HG2 . 11010 1 2132 . 2 2 15 15 LYS CA C 13 59.395 0.0 . 1 . . . . 1133 LYS CA . 11010 1 2133 . 2 2 15 15 LYS CB C 13 32.162 0.0 . 1 . . . . 1133 LYS CB . 11010 1 2134 . 2 2 15 15 LYS CD C 13 29.294 0.0 . 1 . . . . 1133 LYS CD . 11010 1 2135 . 2 2 15 15 LYS CE C 13 42.069 0.0 . 1 . . . . 1133 LYS CE . 11010 1 2136 . 2 2 15 15 LYS CG C 13 25.19795 0.0 . 1 . . . . 1133 LYS CG . 11010 1 2137 . 2 2 15 15 LYS N N 15 120.272 0.0 . 1 . . . . 1133 LYS N . 11010 1 2138 . 2 2 16 16 GLN H H 1 7.845 0.0 . 1 . . . . 1134 GLN HN . 11010 1 2139 . 2 2 16 16 GLN HA H 1 3.934 0.0 . 1 . . . . 1134 GLN HA . 11010 1 2140 . 2 2 16 16 GLN HB2 H 1 2.112419 0.0 . 1 . . . . 1134 GLN HB1 . 11010 1 2141 . 2 2 16 16 GLN HB3 H 1 2.237 0.0 . 1 . . . . 1134 GLN HB2 . 11010 1 2142 . 2 2 16 16 GLN HE21 H 1 6.719 0.0 . 1 . . . . 1134 GLN HE21 . 11010 1 2143 . 2 2 16 16 GLN HE22 H 1 7.5 0.0 . 1 . . . . 1134 GLN HE22 . 11010 1 2144 . 2 2 16 16 GLN HG2 H 1 2.394 0.0 . 1 . . . . 1134 GLN HG1 . 11010 1 2145 . 2 2 16 16 GLN HG3 H 1 2.517 0.0 . 1 . . . . 1134 GLN HG2 . 11010 1 2146 . 2 2 16 16 GLN CA C 13 58.916 0.0 . 1 . . . . 1134 GLN CA . 11010 1 2147 . 2 2 16 16 GLN CB C 13 28.671 0.0 . 1 . . . . 1134 GLN CB . 11010 1 2148 . 2 2 16 16 GLN CG C 13 34.139 0.0 . 1 . . . . 1134 GLN CG . 11010 1 2149 . 2 2 16 16 GLN N N 15 118.39 0.0 . 1 . . . . 1134 GLN N . 11010 1 2150 . 2 2 16 16 GLN NE2 N 15 111.324 0.0 . 1 . . . . 1134 GLN NE2 . 11010 1 2151 . 2 2 17 17 LEU H H 1 8.648 0.0 . 1 . . . . 1135 LEU HN . 11010 1 2152 . 2 2 17 17 LEU HA H 1 3.879 0.0 . 1 . . . . 1135 LEU HA . 11010 1 2153 . 2 2 17 17 LEU HB2 H 1 1.562 0.0 . 1 . . . . 1135 LEU HB1 . 11010 1 2154 . 2 2 17 17 LEU HB3 H 1 2.01 0.0 . 1 . . . . 1135 LEU HB2 . 11010 1 2155 . 2 2 17 17 LEU HD11 H 1 0.8180224 0.0 . 1 . . . . 1135 LEU HD1# . 11010 1 2156 . 2 2 17 17 LEU HD12 H 1 0.8180224 0.0 . 1 . . . . 1135 LEU HD1# . 11010 1 2157 . 2 2 17 17 LEU HD13 H 1 0.8180224 0.0 . 1 . . . . 1135 LEU HD1# . 11010 1 2158 . 2 2 17 17 LEU HD21 H 1 0.877 0.0 . 1 . . . . 1135 LEU HD2# . 11010 1 2159 . 2 2 17 17 LEU HD22 H 1 0.877 0.0 . 1 . . . . 1135 LEU HD2# . 11010 1 2160 . 2 2 17 17 LEU HD23 H 1 0.877 0.0 . 1 . . . . 1135 LEU HD2# . 11010 1 2161 . 2 2 17 17 LEU HG H 1 1.740789 0.0 . 1 . . . . 1135 LEU HG . 11010 1 2162 . 2 2 17 17 LEU CA C 13 58.285 0.0 . 1 . . . . 1135 LEU CA . 11010 1 2163 . 2 2 17 17 LEU CB C 13 41.608 0.0 . 1 . . . . 1135 LEU CB . 11010 1 2164 . 2 2 17 17 LEU CD1 C 13 26.03081 0.0 . 1 . . . . 1135 LEU CD1 . 11010 1 2165 . 2 2 17 17 LEU CD2 C 13 24.68063 0.0 . 1 . . . . 1135 LEU CD2 . 11010 1 2166 . 2 2 17 17 LEU CG C 13 27.42398 0.0 . 1 . . . . 1135 LEU CG . 11010 1 2167 . 2 2 17 17 LEU N N 15 120.435 0.0 . 1 . . . . 1135 LEU N . 11010 1 2168 . 2 2 18 18 ALA H H 1 7.653206 0.0 . 1 . . . . 1136 ALA HN . 11010 1 2169 . 2 2 18 18 ALA HA H 1 3.988 0.0 . 1 . . . . 1136 ALA HA . 11010 1 2170 . 2 2 18 18 ALA HB1 H 1 1.505 0.0 . 1 . . . . 1136 ALA HB# . 11010 1 2171 . 2 2 18 18 ALA HB2 H 1 1.505 0.0 . 1 . . . . 1136 ALA HB# . 11010 1 2172 . 2 2 18 18 ALA HB3 H 1 1.505 0.0 . 1 . . . . 1136 ALA HB# . 11010 1 2173 . 2 2 18 18 ALA CA C 13 55.27 0.0 . 1 . . . . 1136 ALA CA . 11010 1 2174 . 2 2 18 18 ALA CB C 13 17.956 0.0 . 1 . . . . 1136 ALA CB . 11010 1 2175 . 2 2 18 18 ALA N N 15 118.807 0.0 . 1 . . . . 1136 ALA N . 11010 1 2176 . 2 2 19 19 ILE H H 1 7.66 0.0 . 1 . . . . 1137 ILE HN . 11010 1 2177 . 2 2 19 19 ILE HA H 1 3.612 0.0 . 1 . . . . 1137 ILE HA . 11010 1 2178 . 2 2 19 19 ILE HB H 1 1.93 0.0 . 1 . . . . 1137 ILE HB . 11010 1 2179 . 2 2 19 19 ILE HD11 H 1 0.766 0.0 . 1 . . . . 1137 ILE HD1# . 11010 1 2180 . 2 2 19 19 ILE HD12 H 1 0.766 0.0 . 1 . . . . 1137 ILE HD1# . 11010 1 2181 . 2 2 19 19 ILE HD13 H 1 0.766 0.0 . 1 . . . . 1137 ILE HD1# . 11010 1 2182 . 2 2 19 19 ILE HG12 H 1 1.035 0.0 . 1 . . . . 1137 ILE HG11 . 11010 1 2183 . 2 2 19 19 ILE HG13 H 1 1.648 0.0 . 1 . . . . 1137 ILE HG12 . 11010 1 2184 . 2 2 19 19 ILE HG21 H 1 0.815 0.0 . 1 . . . . 1137 ILE HG2# . 11010 1 2185 . 2 2 19 19 ILE HG22 H 1 0.815 0.0 . 1 . . . . 1137 ILE HG2# . 11010 1 2186 . 2 2 19 19 ILE HG23 H 1 0.815 0.0 . 1 . . . . 1137 ILE HG2# . 11010 1 2187 . 2 2 19 19 ILE CA C 13 65.152 0.0 . 1 . . . . 1137 ILE CA . 11010 1 2188 . 2 2 19 19 ILE CB C 13 38.222 0.0 . 1 . . . . 1137 ILE CB . 11010 1 2189 . 2 2 19 19 ILE CD1 C 13 13.424 0.0 . 1 . . . . 1137 ILE CD1 . 11010 1 2190 . 2 2 19 19 ILE CG1 C 13 29.237 0.0 . 1 . . . . 1137 ILE CG1 . 11010 1 2191 . 2 2 19 19 ILE CG2 C 13 16.911 0.0 . 1 . . . . 1137 ILE CG2 . 11010 1 2192 . 2 2 19 19 ILE N N 15 118.288 0.0 . 1 . . . . 1137 ILE N . 11010 1 2193 . 2 2 20 20 GLU H H 1 8.191 0.0 . 1 . . . . 1138 GLU HN . 11010 1 2194 . 2 2 20 20 GLU HA H 1 4.076 0.0 . 1 . . . . 1138 GLU HA . 11010 1 2195 . 2 2 20 20 GLU HB2 H 1 1.888 0.0 . 2 . . . . 1138 GLU HB# . 11010 1 2196 . 2 2 20 20 GLU HG2 H 1 2.152 0.0 . 1 . . . . 1138 GLU HG1 . 11010 1 2197 . 2 2 20 20 GLU HG3 H 1 2.329 0.0 . 1 . . . . 1138 GLU HG2 . 11010 1 2198 . 2 2 20 20 GLU CA C 13 58.505 0.0 . 1 . . . . 1138 GLU CA . 11010 1 2199 . 2 2 20 20 GLU CG C 13 36.435 0.0 . 1 . . . . 1138 GLU CG . 11010 1 2200 . 2 2 20 20 GLU N N 15 120.424 0.0 . 1 . . . . 1138 GLU N . 11010 1 2201 . 2 2 21 21 LEU H H 1 8.698 0.0 . 1 . . . . 1139 LEU HN . 11010 1 2202 . 2 2 21 21 LEU HA H 1 3.937 0.0 . 1 . . . . 1139 LEU HA . 11010 1 2203 . 2 2 21 21 LEU HB2 H 1 1.369835 0.0 . 1 . . . . 1139 LEU HB1 . 11010 1 2204 . 2 2 21 21 LEU HB3 H 1 1.826 0.0 . 1 . . . . 1139 LEU HB2 . 11010 1 2205 . 2 2 21 21 LEU HD11 H 1 0.813376 0.0 . 1 . . . . 1139 LEU HD1# . 11010 1 2206 . 2 2 21 21 LEU HD12 H 1 0.813376 0.0 . 1 . . . . 1139 LEU HD1# . 11010 1 2207 . 2 2 21 21 LEU HD13 H 1 0.813376 0.0 . 1 . . . . 1139 LEU HD1# . 11010 1 2208 . 2 2 21 21 LEU HD21 H 1 0.845 0.0 . 1 . . . . 1139 LEU HD2# . 11010 1 2209 . 2 2 21 21 LEU HD22 H 1 0.845 0.0 . 1 . . . . 1139 LEU HD2# . 11010 1 2210 . 2 2 21 21 LEU HD23 H 1 0.845 0.0 . 1 . . . . 1139 LEU HD2# . 11010 1 2211 . 2 2 21 21 LEU HG H 1 1.71437 0.0 . 1 . . . . 1139 LEU HG . 11010 1 2212 . 2 2 21 21 LEU CA C 13 58.286 0.0 . 1 . . . . 1139 LEU CA . 11010 1 2213 . 2 2 21 21 LEU CB C 13 41.628 0.0 . 1 . . . . 1139 LEU CB . 11010 1 2214 . 2 2 21 21 LEU CD1 C 13 25.743 0.0 . 1 . . . . 1139 LEU CD1 . 11010 1 2215 . 2 2 21 21 LEU CD2 C 13 23.20416 0.0 . 1 . . . . 1139 LEU CD2 . 11010 1 2216 . 2 2 21 21 LEU CG C 13 27.467 0.0 . 1 . . . . 1139 LEU CG . 11010 1 2217 . 2 2 21 21 LEU N N 15 118.812 0.0 . 1 . . . . 1139 LEU N . 11010 1 2218 . 2 2 22 22 LYS H H 1 7.384542 0.0 . 1 . . . . 1140 LYS HN . 11010 1 2219 . 2 2 22 22 LYS HA H 1 4.141747 0.0 . 1 . . . . 1140 LYS HA . 11010 1 2220 . 2 2 22 22 LYS HB2 H 1 1.936288 0.0 . 1 . . . . 1140 LYS HB1 . 11010 1 2221 . 2 2 22 22 LYS HB3 H 1 2.03656 0.0 . 1 . . . . 1140 LYS HB2 . 11010 1 2222 . 2 2 22 22 LYS HD2 H 1 1.625957 0.0 . 2 . . . . 1140 LYS HD# . 11010 1 2223 . 2 2 22 22 LYS HE2 H 1 2.904 0.0 . 2 . . . . 1140 LYS HE# . 11010 1 2224 . 2 2 22 22 LYS HG2 H 1 1.398067 0.0 . 1 . . . . 1140 LYS HG1 . 11010 1 2225 . 2 2 22 22 LYS HG3 H 1 1.606 0.0 . 1 . . . . 1140 LYS HG2 . 11010 1 2226 . 2 2 22 22 LYS CA C 13 59.314 0.0 . 1 . . . . 1140 LYS CA . 11010 1 2227 . 2 2 22 22 LYS CB C 13 31.95 0.0 . 1 . . . . 1140 LYS CB . 11010 1 2228 . 2 2 22 22 LYS CD C 13 29.13 0.0 . 1 . . . . 1140 LYS CD . 11010 1 2229 . 2 2 22 22 LYS CE C 13 42.05 0.0 . 1 . . . . 1140 LYS CE . 11010 1 2230 . 2 2 22 22 LYS CG C 13 25.36488 0.0 . 1 . . . . 1140 LYS CG . 11010 1 2231 . 2 2 22 22 LYS N N 15 119.855 0.0 . 1 . . . . 1140 LYS N . 11010 1 2232 . 2 2 23 23 VAL H H 1 8.024 0.0 . 1 . . . . 1141 VAL HN . 11010 1 2233 . 2 2 23 23 VAL HA H 1 3.59 0.0 . 1 . . . . 1141 VAL HA . 11010 1 2234 . 2 2 23 23 VAL HB H 1 2.345 0.0 . 1 . . . . 1141 VAL HB . 11010 1 2235 . 2 2 23 23 VAL HG11 H 1 0.8825769 0.0 . 1 . . . . 1141 VAL HG1# . 11010 1 2236 . 2 2 23 23 VAL HG12 H 1 0.8825769 0.0 . 1 . . . . 1141 VAL HG1# . 11010 1 2237 . 2 2 23 23 VAL HG13 H 1 0.8825769 0.0 . 1 . . . . 1141 VAL HG1# . 11010 1 2238 . 2 2 23 23 VAL HG21 H 1 0.9797797 0.0 . 1 . . . . 1141 VAL HG2# . 11010 1 2239 . 2 2 23 23 VAL HG22 H 1 0.9797797 0.0 . 1 . . . . 1141 VAL HG2# . 11010 1 2240 . 2 2 23 23 VAL HG23 H 1 0.9797797 0.0 . 1 . . . . 1141 VAL HG2# . 11010 1 2241 . 2 2 23 23 VAL CA C 13 66.72 0.0 . 1 . . . . 1141 VAL CA . 11010 1 2242 . 2 2 23 23 VAL CB C 13 31.191 0.0 . 1 . . . . 1141 VAL CB . 11010 1 2243 . 2 2 23 23 VAL CG1 C 13 21.524 0.0 . 1 . . . . 1141 VAL CG1 . 11010 1 2244 . 2 2 23 23 VAL CG2 C 13 22.32216 0.0 . 1 . . . . 1141 VAL CG2 . 11010 1 2245 . 2 2 23 23 VAL N N 15 124.026 0.0 . 1 . . . . 1141 VAL N . 11010 1 2246 . 2 2 24 24 LYS H H 1 8.457918 0.0 . 1 . . . . 1142 LYS HN . 11010 1 2247 . 2 2 24 24 LYS HA H 1 3.761 0.0 . 1 . . . . 1142 LYS HA . 11010 1 2248 . 2 2 24 24 LYS HB2 H 1 1.905823 0.0 . 1 . . . . 1142 LYS HB1 . 11010 1 2249 . 2 2 24 24 LYS HB3 H 1 2.012 0.0 . 1 . . . . 1142 LYS HB2 . 11010 1 2250 . 2 2 24 24 LYS HD2 H 1 1.487 0.0 . 2 . . . . 1142 LYS HD# . 11010 1 2251 . 2 2 24 24 LYS HE2 H 1 2.72 0.0 . 1 . . . . 1142 LYS HE1 . 11010 1 2252 . 2 2 24 24 LYS HE3 H 1 2.917 0.0 . 1 . . . . 1142 LYS HE2 . 11010 1 2253 . 2 2 24 24 LYS HG2 H 1 1.233 0.0 . 2 . . . . 1142 LYS HG# . 11010 1 2254 . 2 2 24 24 LYS CA C 13 60.475 0.0 . 1 . . . . 1142 LYS CA . 11010 1 2255 . 2 2 24 24 LYS CB C 13 32.487 0.0 . 1 . . . . 1142 LYS CB . 11010 1 2256 . 2 2 24 24 LYS CD C 13 30.343 0.0 . 1 . . . . 1142 LYS CD . 11010 1 2257 . 2 2 24 24 LYS CE C 13 42.04 0.0 . 1 . . . . 1142 LYS CE . 11010 1 2258 . 2 2 24 24 LYS CG C 13 24.679 0.0 . 1 . . . . 1142 LYS CG . 11010 1 2259 . 2 2 24 24 LYS N N 15 121.789 0.0 . 1 . . . . 1142 LYS N . 11010 1 2260 . 2 2 25 25 GLN H H 1 7.866 0.0 . 1 . . . . 1143 GLN HN . 11010 1 2261 . 2 2 25 25 GLN HA H 1 4.101 0.0 . 1 . . . . 1143 GLN HA . 11010 1 2262 . 2 2 25 25 GLN HB2 H 1 2.128 0.0 . 2 . . . . 1143 GLN HB# . 11010 1 2263 . 2 2 25 25 GLN HE21 H 1 6.889 0.0 . 1 . . . . 1143 GLN HE21 . 11010 1 2264 . 2 2 25 25 GLN HE22 H 1 7.409 0.0 . 1 . . . . 1143 GLN HE22 . 11010 1 2265 . 2 2 25 25 GLN HG2 H 1 2.308 0.0 . 1 . . . . 1143 GLN HG1 . 11010 1 2266 . 2 2 25 25 GLN HG3 H 1 2.455 0.0 . 1 . . . . 1143 GLN HG2 . 11010 1 2267 . 2 2 25 25 GLN CA C 13 58.542 0.0 . 1 . . . . 1143 GLN CA . 11010 1 2268 . 2 2 25 25 GLN CB C 13 28.455 0.0 . 1 . . . . 1143 GLN CB . 11010 1 2269 . 2 2 25 25 GLN CG C 13 33.999 0.0 . 1 . . . . 1143 GLN CG . 11010 1 2270 . 2 2 25 25 GLN N N 15 117.202 0.0 . 1 . . . . 1143 GLN N . 11010 1 2271 . 2 2 25 25 GLN NE2 N 15 112.318 0.0 . 1 . . . . 1143 GLN NE2 . 11010 1 2272 . 2 2 26 26 GLY H H 1 8.268 0.0 . 1 . . . . 1144 GLY HN . 11010 1 2273 . 2 2 26 26 GLY HA2 H 1 3.864 0.0 . 2 . . . . 1144 GLY HA# . 11010 1 2274 . 2 2 26 26 GLY CA C 13 47.393 0.0 . 1 . . . . 1144 GLY CA . 11010 1 2275 . 2 2 26 26 GLY N N 15 107.342 0.0 . 1 . . . . 1144 GLY N . 11010 1 2276 . 2 2 27 27 ALA H H 1 8.542 0.0 . 1 . . . . 1145 ALA HN . 11010 1 2277 . 2 2 27 27 ALA HA H 1 4.139 0.0 . 1 . . . . 1145 ALA HA . 11010 1 2278 . 2 2 27 27 ALA HB1 H 1 1.510956 0.0 . 1 . . . . 1145 ALA HB# . 11010 1 2279 . 2 2 27 27 ALA HB2 H 1 1.510956 0.0 . 1 . . . . 1145 ALA HB# . 11010 1 2280 . 2 2 27 27 ALA HB3 H 1 1.510956 0.0 . 1 . . . . 1145 ALA HB# . 11010 1 2281 . 2 2 27 27 ALA CA C 13 55.599 0.0 . 1 . . . . 1145 ALA CA . 11010 1 2282 . 2 2 27 27 ALA CB C 13 17.862 0.0 . 1 . . . . 1145 ALA CB . 11010 1 2283 . 2 2 27 27 ALA N N 15 125.659 0.0 . 1 . . . . 1145 ALA N . 11010 1 2284 . 2 2 28 28 GLU H H 1 8.495257 0.0 . 1 . . . . 1146 GLU HN . 11010 1 2285 . 2 2 28 28 GLU HA H 1 3.877 0.0 . 1 . . . . 1146 GLU HA . 11010 1 2286 . 2 2 28 28 GLU HB2 H 1 1.900259 0.0 . 1 . . . . 1146 GLU HB1 . 11010 1 2287 . 2 2 28 28 GLU HB3 H 1 2.285856 0.0 . 1 . . . . 1146 GLU HB2 . 11010 1 2288 . 2 2 28 28 GLU HG2 H 1 2.157 0.0 . 1 . . . . 1146 GLU HG1 . 11010 1 2289 . 2 2 28 28 GLU HG3 H 1 2.544 0.0 . 1 . . . . 1146 GLU HG2 . 11010 1 2290 . 2 2 28 28 GLU CA C 13 60.032 0.0 . 1 . . . . 1146 GLU CA . 11010 1 2291 . 2 2 28 28 GLU CB C 13 29.179 0.0 . 1 . . . . 1146 GLU CB . 11010 1 2292 . 2 2 28 28 GLU CG C 13 37.828 0.0 . 1 . . . . 1146 GLU CG . 11010 1 2293 . 2 2 28 28 GLU N N 15 117.442 0.0 . 1 . . . . 1146 GLU N . 11010 1 2294 . 2 2 29 29 ASN H H 1 8.254 0.0 . 1 . . . . 1147 ASN HN . 11010 1 2295 . 2 2 29 29 ASN HA H 1 4.415 0.0 . 1 . . . . 1147 ASN HA . 11010 1 2296 . 2 2 29 29 ASN HB2 H 1 2.863881 0.0 . 1 . . . . 1147 ASN HB1 . 11010 1 2297 . 2 2 29 29 ASN HB3 H 1 2.968194 0.0 . 1 . . . . 1147 ASN HB2 . 11010 1 2298 . 2 2 29 29 ASN HD21 H 1 6.874 0.0 . 1 . . . . 1147 ASN HD21 . 11010 1 2299 . 2 2 29 29 ASN HD22 H 1 7.567539 0.0 . 1 . . . . 1147 ASN HD22 . 11010 1 2300 . 2 2 29 29 ASN CA C 13 56.072 0.0 . 1 . . . . 1147 ASN CA . 11010 1 2301 . 2 2 29 29 ASN CB C 13 38.057 0.0 . 1 . . . . 1147 ASN CB . 11010 1 2302 . 2 2 29 29 ASN N N 15 118.754 0.0 . 1 . . . . 1147 ASN N . 11010 1 2303 . 2 2 29 29 ASN ND2 N 15 111.366 0.0 . 1 . . . . 1147 ASN ND2 . 11010 1 2304 . 2 2 30 30 MET H H 1 8.135 0.0 . 1 . . . . 1148 MET HN . 11010 1 2305 . 2 2 30 30 MET HB2 H 1 1.973 0.0 . 2 . . . . 1148 MET HB# . 11010 1 2306 . 2 2 30 30 MET HE1 H 1 1.941 0.0 . 1 . . . . 1148 MET HE# . 11010 1 2307 . 2 2 30 30 MET HE2 H 1 1.941 0.0 . 1 . . . . 1148 MET HE# . 11010 1 2308 . 2 2 30 30 MET HE3 H 1 1.941 0.0 . 1 . . . . 1148 MET HE# . 11010 1 2309 . 2 2 30 30 MET HG2 H 1 2.343 0.0 . 2 . . . . 1148 MET HG# . 11010 1 2310 . 2 2 30 30 MET CA C 13 59.005 0.0 . 1 . . . . 1148 MET CA . 11010 1 2311 . 2 2 30 30 MET CE C 13 17.417 0.0 . 1 . . . . 1148 MET CE . 11010 1 2312 . 2 2 30 30 MET N N 15 121.069 0.0 . 1 . . . . 1148 MET N . 11010 1 2313 . 2 2 31 31 ILE H H 1 8.335 0.0 . 1 . . . . 1149 ILE HN . 11010 1 2314 . 2 2 31 31 ILE HA H 1 3.456 0.0 . 1 . . . . 1149 ILE HA . 11010 1 2315 . 2 2 31 31 ILE HB H 1 1.891 0.0 . 1 . . . . 1149 ILE HB . 11010 1 2316 . 2 2 31 31 ILE HD11 H 1 0.79 0.0 . 1 . . . . 1149 ILE HD1# . 11010 1 2317 . 2 2 31 31 ILE HD12 H 1 0.79 0.0 . 1 . . . . 1149 ILE HD1# . 11010 1 2318 . 2 2 31 31 ILE HD13 H 1 0.79 0.0 . 1 . . . . 1149 ILE HD1# . 11010 1 2319 . 2 2 31 31 ILE HG12 H 1 0.814 0.0 . 1 . . . . 1149 ILE HG11 . 11010 1 2320 . 2 2 31 31 ILE HG13 H 1 1.84165 0.0 . 1 . . . . 1149 ILE HG12 . 11010 1 2321 . 2 2 31 31 ILE HG21 H 1 0.825 0.0 . 1 . . . . 1149 ILE HG2# . 11010 1 2322 . 2 2 31 31 ILE HG22 H 1 0.825 0.0 . 1 . . . . 1149 ILE HG2# . 11010 1 2323 . 2 2 31 31 ILE HG23 H 1 0.825 0.0 . 1 . . . . 1149 ILE HG2# . 11010 1 2324 . 2 2 31 31 ILE CA C 13 65.931 0.0 . 1 . . . . 1149 ILE CA . 11010 1 2325 . 2 2 31 31 ILE CB C 13 38.253 0.0 . 1 . . . . 1149 ILE CB . 11010 1 2326 . 2 2 31 31 ILE CD1 C 13 15.213 0.0 . 1 . . . . 1149 ILE CD1 . 11010 1 2327 . 2 2 31 31 ILE CG1 C 13 30.691 0.0 . 1 . . . . 1149 ILE CG1 . 11010 1 2328 . 2 2 31 31 ILE CG2 C 13 16.807 0.0 . 1 . . . . 1149 ILE CG2 . 11010 1 2329 . 2 2 31 31 ILE N N 15 119.968 0.0 . 1 . . . . 1149 ILE N . 11010 1 2330 . 2 2 32 32 GLN H H 1 7.685 0.0 . 1 . . . . 1150 GLN HN . 11010 1 2331 . 2 2 32 32 GLN HA H 1 3.927 0.0 . 1 . . . . 1150 GLN HA . 11010 1 2332 . 2 2 32 32 GLN HB2 H 1 2.173 0.0 . 2 . . . . 1150 GLN HB# . 11010 1 2333 . 2 2 32 32 GLN HE21 H 1 6.74 0.0 . 1 . . . . 1150 GLN HE21 . 11010 1 2334 . 2 2 32 32 GLN HE22 H 1 7.616 0.0 . 1 . . . . 1150 GLN HE22 . 11010 1 2335 . 2 2 32 32 GLN HG2 H 1 2.369 0.0 . 1 . . . . 1150 GLN HG1 . 11010 1 2336 . 2 2 32 32 GLN HG3 H 1 2.427 0.0 . 1 . . . . 1150 GLN HG2 . 11010 1 2337 . 2 2 32 32 GLN CA C 13 58.921 0.0 . 1 . . . . 1150 GLN CA . 11010 1 2338 . 2 2 32 32 GLN CB C 13 28.0639 0.0 . 1 . . . . 1150 GLN CB . 11010 1 2339 . 2 2 32 32 GLN CG C 13 33.631 0.0 . 1 . . . . 1150 GLN CG . 11010 1 2340 . 2 2 32 32 GLN N N 15 118.823 0.0 . 1 . . . . 1150 GLN N . 11010 1 2341 . 2 2 32 32 GLN NE2 N 15 113.188 0.0 . 1 . . . . 1150 GLN NE2 . 11010 1 2342 . 2 2 33 33 THR H H 1 7.904 0.0 . 1 . . . . 1151 THR HN . 11010 1 2343 . 2 2 33 33 THR HA H 1 3.799 0.0 . 1 . . . . 1151 THR HA . 11010 1 2344 . 2 2 33 33 THR HB H 1 3.8 0.0 . 1 . . . . 1151 THR HB . 11010 1 2345 . 2 2 33 33 THR HG21 H 1 0.787 0.0 . 1 . . . . 1151 THR HG2# . 11010 1 2346 . 2 2 33 33 THR HG22 H 1 0.787 0.0 . 1 . . . . 1151 THR HG2# . 11010 1 2347 . 2 2 33 33 THR HG23 H 1 0.787 0.0 . 1 . . . . 1151 THR HG2# . 11010 1 2348 . 2 2 33 33 THR CA C 13 66.113 0.0 . 1 . . . . 1151 THR CA . 11010 1 2349 . 2 2 33 33 THR CB C 13 68.823 0.0 . 1 . . . . 1151 THR CB . 11010 1 2350 . 2 2 33 33 THR CG2 C 13 21.228 0.0 . 1 . . . . 1151 THR CG2 . 11010 1 2351 . 2 2 33 33 THR N N 15 115.598 0.0 . 1 . . . . 1151 THR N . 11010 1 2352 . 2 2 34 34 TYR H H 1 8.101 0.0 . 1 . . . . 1152 TYR HN . 11010 1 2353 . 2 2 34 34 TYR HA H 1 4.663 0.0 . 1 . . . . 1152 TYR HA . 11010 1 2354 . 2 2 34 34 TYR HB2 H 1 3.408 0.0 . 1 . . . . 1152 TYR HB2 . 11010 1 2355 . 2 2 34 34 TYR HB3 H 1 2.618 0.0 . 1 . . . . 1152 TYR HB1 . 11010 1 2356 . 2 2 34 34 TYR HD1 H 1 7.012 0.0 . 3 . . . . 1152 TYR HD# . 11010 1 2357 . 2 2 34 34 TYR HE1 H 1 6.677 0.0 . 3 . . . . 1152 TYR HE# . 11010 1 2358 . 2 2 34 34 TYR CA C 13 59.03 0.0 . 1 . . . . 1152 TYR CA . 11010 1 2359 . 2 2 34 34 TYR CB C 13 37.494 0.0 . 1 . . . . 1152 TYR CB . 11010 1 2360 . 2 2 34 34 TYR CD1 C 13 132.496 0.0 . 3 . . . . 1152 TYR CD# . 11010 1 2361 . 2 2 34 34 TYR CE1 C 13 118.237 0.0 . 3 . . . . 1152 TYR CE# . 11010 1 2362 . 2 2 34 34 TYR N N 15 118.152 0.0 . 1 . . . . 1152 TYR N . 11010 1 2363 . 2 2 35 35 SER H H 1 7.842 0.0 . 1 . . . . 1153 SER HN . 11010 1 2364 . 2 2 35 35 SER HA H 1 4.39 0.0 . 1 . . . . 1153 SER HA . 11010 1 2365 . 2 2 35 35 SER HB2 H 1 3.882 0.0 . 1 . . . . 1153 SER HB1 . 11010 1 2366 . 2 2 35 35 SER HB3 H 1 3.951 0.0 . 1 . . . . 1153 SER HB2 . 11010 1 2367 . 2 2 35 35 SER CA C 13 59.719 0.0 . 1 . . . . 1153 SER CA . 11010 1 2368 . 2 2 35 35 SER CB C 13 63.816 0.0 . 1 . . . . 1153 SER CB . 11010 1 2369 . 2 2 35 35 SER N N 15 114.117 0.0 . 1 . . . . 1153 SER N . 11010 1 2370 . 2 2 36 36 ASN H H 1 7.641 0.0 . 1 . . . . 1154 ASN HN . 11010 1 2371 . 2 2 36 36 ASN HA H 1 4.784 0.0 . 1 . . . . 1154 ASN HA . 11010 1 2372 . 2 2 36 36 ASN HB2 H 1 2.762 0.0 . 2 . . . . 1154 ASN HB# . 11010 1 2373 . 2 2 36 36 ASN HD21 H 1 7.031 0.0 . 1 . . . . 1154 ASN HD21 . 11010 1 2374 . 2 2 36 36 ASN HD22 H 1 7.624 0.0 . 1 . . . . 1154 ASN HD22 . 11010 1 2375 . 2 2 36 36 ASN CA C 13 53.23 0.0 . 1 . . . . 1154 ASN CA . 11010 1 2376 . 2 2 36 36 ASN CB C 13 40.396 0.0 . 1 . . . . 1154 ASN CB . 11010 1 2377 . 2 2 36 36 ASN N N 15 118.195 0.0 . 1 . . . . 1154 ASN N . 11010 1 2378 . 2 2 36 36 ASN ND2 N 15 113.651 0.0 . 1 . . . . 1154 ASN ND2 . 11010 1 2379 . 2 2 37 37 GLY H H 1 8.154 0.0 . 1 . . . . 1155 GLY HN . 11010 1 2380 . 2 2 37 37 GLY CA C 13 45.621 0.0 . 1 . . . . 1155 GLY CA . 11010 1 2381 . 2 2 37 37 GLY N N 15 107.355 0.0 . 1 . . . . 1155 GLY N . 11010 1 2382 . 2 2 39 39 THR HA H 1 3.909132 0.0 . 1 . . . . 1157 THR HA . 11010 1 2383 . 2 2 39 39 THR HG21 H 1 1.147059 0.0 . 1 . . . . 1157 THR HG2# . 11010 1 2384 . 2 2 39 39 THR HG22 H 1 1.147059 0.0 . 1 . . . . 1157 THR HG2# . 11010 1 2385 . 2 2 39 39 THR HG23 H 1 1.147059 0.0 . 1 . . . . 1157 THR HG2# . 11010 1 2386 . 2 2 39 39 THR CG2 C 13 21.84111 0.0 . 1 . . . . 1157 THR CG2 . 11010 1 2387 . 2 2 40 40 LYS HA H 1 4.025 0.0 . 1 . . . . 1158 LYS HA . 11010 1 2388 . 2 2 40 40 LYS HB2 H 1 1.642 0.0 . 2 . . . . 1158 LYS HB# . 11010 1 2389 . 2 2 40 40 LYS HD2 H 1 1.583 0.0 . 2 . . . . 1158 LYS HD# . 11010 1 2390 . 2 2 40 40 LYS HE2 H 1 2.919 0.0 . 2 . . . . 1158 LYS HE# . 11010 1 2391 . 2 2 40 40 LYS HG2 H 1 1.248 0.0 . 1 . . . . 1158 LYS HG1 . 11010 1 2392 . 2 2 40 40 LYS HG3 H 1 1.331 0.0 . 1 . . . . 1158 LYS HG2 . 11010 1 2393 . 2 2 40 40 LYS CA C 13 57.272 0.0 . 1 . . . . 1158 LYS CA . 11010 1 2394 . 2 2 40 40 LYS CB C 13 32.629 0.0 . 1 . . . . 1158 LYS CB . 11010 1 2395 . 2 2 40 40 LYS CD C 13 29.135 0.0 . 1 . . . . 1158 LYS CD . 11010 1 2396 . 2 2 40 40 LYS CE C 13 42.025 0.0 . 1 . . . . 1158 LYS CE . 11010 1 2397 . 2 2 40 40 LYS CG C 13 24.546 0.0 . 1 . . . . 1158 LYS CG . 11010 1 2398 . 2 2 41 41 ASP H H 1 8.008 0.0 . 1 . . . . 1159 ASP HN . 11010 1 2399 . 2 2 41 41 ASP HB2 H 1 2.57 0.0 . 1 . . . . 1159 ASP HB1 . 11010 1 2400 . 2 2 41 41 ASP HB3 H 1 2.738 0.0 . 1 . . . . 1159 ASP HB2 . 11010 1 2401 . 2 2 41 41 ASP N N 15 121.13 0.0 . 1 . . . . 1159 ASP N . 11010 1 2402 . 2 2 42 42 ARG HA H 1 3.96865 0.0 . 1 . . . . 1160 ARG HA . 11010 1 2403 . 2 2 42 42 ARG HB2 H 1 1.853969 0.0 . 2 . . . . 1160 ARG HB# . 11010 1 2404 . 2 2 42 42 ARG HD2 H 1 3.169107 0.0 . 2 . . . . 1160 ARG HD# . 11010 1 2405 . 2 2 42 42 ARG HG2 H 1 1.664446 0.0 . 2 . . . . 1160 ARG HG# . 11010 1 2406 . 2 2 42 42 ARG CA C 13 59.28324 0.0 . 1 . . . . 1160 ARG CA . 11010 1 2407 . 2 2 42 42 ARG CB C 13 30.02858 0.0 . 1 . . . . 1160 ARG CB . 11010 1 2408 . 2 2 42 42 ARG CD C 13 43.27 0.0 . 1 . . . . 1160 ARG CD . 11010 1 2409 . 2 2 42 42 ARG CG C 13 27.466 0.0 . 1 . . . . 1160 ARG CG . 11010 1 2410 . 2 2 43 43 LYS H H 1 8.108718 0.0 . 1 . . . . 1161 LYS HN . 11010 1 2411 . 2 2 43 43 LYS HA H 1 3.948521 0.0 . 1 . . . . 1161 LYS HA . 11010 1 2412 . 2 2 43 43 LYS HB2 H 1 1.8 0.0 . 1 . . . . 1161 LYS HB1 . 11010 1 2413 . 2 2 43 43 LYS HB3 H 1 1.839 0.0 . 1 . . . . 1161 LYS HB2 . 11010 1 2414 . 2 2 43 43 LYS HD2 H 1 1.621 0.0 . 2 . . . . 1161 LYS HD# . 11010 1 2415 . 2 2 43 43 LYS HE2 H 1 2.893624 0.0 . 2 . . . . 1161 LYS HE# . 11010 1 2416 . 2 2 43 43 LYS HG2 H 1 1.316828 0.0 . 1 . . . . 1161 LYS HG1 . 11010 1 2417 . 2 2 43 43 LYS HG3 H 1 1.439165 0.0 . 1 . . . . 1161 LYS HG2 . 11010 1 2418 . 2 2 43 43 LYS CA C 13 59.51 0.0 . 1 . . . . 1161 LYS CA . 11010 1 2419 . 2 2 43 43 LYS CB C 13 31.976 0.0 . 1 . . . . 1161 LYS CB . 11010 1 2420 . 2 2 43 43 LYS CD C 13 29.10365 0.0 . 1 . . . . 1161 LYS CD . 11010 1 2421 . 2 2 43 43 LYS CE C 13 41.997 0.0 . 1 . . . . 1161 LYS CE . 11010 1 2422 . 2 2 43 43 LYS CG C 13 25.1932 0.0 . 1 . . . . 1161 LYS CG . 11010 1 2423 . 2 2 43 43 LYS N N 15 118.693 0.0 . 1 . . . . 1161 LYS N . 11010 1 2424 . 2 2 44 44 LEU H H 1 7.662 0.0 . 1 . . . . 1162 LEU HN . 11010 1 2425 . 2 2 44 44 LEU HA H 1 3.893 0.0 . 1 . . . . 1162 LEU HA . 11010 1 2426 . 2 2 44 44 LEU HB2 H 1 0.845 0.0 . 1 . . . . 1162 LEU HB1 . 11010 1 2427 . 2 2 44 44 LEU HB3 H 1 1.12 0.0 . 1 . . . . 1162 LEU HB2 . 11010 1 2428 . 2 2 44 44 LEU HD11 H 1 0.624 0.0 . 1 . . . . 1162 LEU HD1# . 11010 1 2429 . 2 2 44 44 LEU HD12 H 1 0.624 0.0 . 1 . . . . 1162 LEU HD1# . 11010 1 2430 . 2 2 44 44 LEU HD13 H 1 0.624 0.0 . 1 . . . . 1162 LEU HD1# . 11010 1 2431 . 2 2 44 44 LEU HD21 H 1 0.634 0.0 . 1 . . . . 1162 LEU HD2# . 11010 1 2432 . 2 2 44 44 LEU HD22 H 1 0.634 0.0 . 1 . . . . 1162 LEU HD2# . 11010 1 2433 . 2 2 44 44 LEU HD23 H 1 0.634 0.0 . 1 . . . . 1162 LEU HD2# . 11010 1 2434 . 2 2 44 44 LEU HG H 1 1.37 0.0 . 1 . . . . 1162 LEU HG . 11010 1 2435 . 2 2 44 44 LEU CA C 13 57.456 0.0 . 1 . . . . 1162 LEU CA . 11010 1 2436 . 2 2 44 44 LEU CB C 13 40.246 0.0 . 1 . . . . 1162 LEU CB . 11010 1 2437 . 2 2 44 44 LEU CD1 C 13 22.957 0.0 . 1 . . . . 1162 LEU CD1 . 11010 1 2438 . 2 2 44 44 LEU CD2 C 13 25.193 0.0 . 1 . . . . 1162 LEU CD2 . 11010 1 2439 . 2 2 44 44 LEU CG C 13 26.986 0.0 . 1 . . . . 1162 LEU CG . 11010 1 2440 . 2 2 44 44 LEU N N 15 120.509 0.0 . 1 . . . . 1162 LEU N . 11010 1 2441 . 2 2 45 45 LEU H H 1 7.708 0.0 . 1 . . . . 1163 LEU HN . 11010 1 2442 . 2 2 45 45 LEU HA H 1 3.887 0.0 . 1 . . . . 1163 LEU HA . 11010 1 2443 . 2 2 45 45 LEU HB2 H 1 1.359 0.0 . 1 . . . . 1163 LEU HB1 . 11010 1 2444 . 2 2 45 45 LEU HB3 H 1 1.803 0.0 . 1 . . . . 1163 LEU HB2 . 11010 1 2445 . 2 2 45 45 LEU HD11 H 1 0.794 0.0 . 1 . . . . 1163 LEU HD1# . 11010 1 2446 . 2 2 45 45 LEU HD12 H 1 0.794 0.0 . 1 . . . . 1163 LEU HD1# . 11010 1 2447 . 2 2 45 45 LEU HD13 H 1 0.794 0.0 . 1 . . . . 1163 LEU HD1# . 11010 1 2448 . 2 2 45 45 LEU HD21 H 1 0.884 0.0 . 1 . . . . 1163 LEU HD2# . 11010 1 2449 . 2 2 45 45 LEU HD22 H 1 0.884 0.0 . 1 . . . . 1163 LEU HD2# . 11010 1 2450 . 2 2 45 45 LEU HD23 H 1 0.884 0.0 . 1 . . . . 1163 LEU HD2# . 11010 1 2451 . 2 2 45 45 LEU HG H 1 1.410096 0.0 . 1 . . . . 1163 LEU HG . 11010 1 2452 . 2 2 45 45 LEU CA C 13 58.23 0.0 . 1 . . . . 1163 LEU CA . 11010 1 2453 . 2 2 45 45 LEU CB C 13 41.466 0.0 . 1 . . . . 1163 LEU CB . 11010 1 2454 . 2 2 45 45 LEU CD1 C 13 25.505 0.0 . 1 . . . . 1163 LEU CD1 . 11010 1 2455 . 2 2 45 45 LEU CD2 C 13 24.62 0.0 . 1 . . . . 1163 LEU CD2 . 11010 1 2456 . 2 2 45 45 LEU CG C 13 26.90722 0.0 . 1 . . . . 1163 LEU CG . 11010 1 2457 . 2 2 45 45 LEU N N 15 120.072 0.0 . 1 . . . . 1163 LEU N . 11010 1 2458 . 2 2 46 46 LEU H H 1 7.806 0.0 . 1 . . . . 1164 LEU HN . 11010 1 2459 . 2 2 46 46 LEU HA H 1 4.08 0.0 . 1 . . . . 1164 LEU HA . 11010 1 2460 . 2 2 46 46 LEU HB2 H 1 1.56 0.0 . 1 . . . . 1164 LEU HB1 . 11010 1 2461 . 2 2 46 46 LEU HB3 H 1 1.77 0.0 . 1 . . . . 1164 LEU HB2 . 11010 1 2462 . 2 2 46 46 LEU HD11 H 1 0.83 0.0 . 1 . . . . 1164 LEU HD1# . 11010 1 2463 . 2 2 46 46 LEU HD12 H 1 0.83 0.0 . 1 . . . . 1164 LEU HD1# . 11010 1 2464 . 2 2 46 46 LEU HD13 H 1 0.83 0.0 . 1 . . . . 1164 LEU HD1# . 11010 1 2465 . 2 2 46 46 LEU HD21 H 1 0.861 0.0 . 1 . . . . 1164 LEU HD2# . 11010 1 2466 . 2 2 46 46 LEU HD22 H 1 0.861 0.0 . 1 . . . . 1164 LEU HD2# . 11010 1 2467 . 2 2 46 46 LEU HD23 H 1 0.861 0.0 . 1 . . . . 1164 LEU HD2# . 11010 1 2468 . 2 2 46 46 LEU HG H 1 1.707 0.0 . 1 . . . . 1164 LEU HG . 11010 1 2469 . 2 2 46 46 LEU CA C 13 58.117 0.0 . 1 . . . . 1164 LEU CA . 11010 1 2470 . 2 2 46 46 LEU CB C 13 41.56943 0.0 . 1 . . . . 1164 LEU CB . 11010 1 2471 . 2 2 46 46 LEU CD1 C 13 23.527 0.0 . 1 . . . . 1164 LEU CD1 . 11010 1 2472 . 2 2 46 46 LEU CD2 C 13 24.858 0.0 . 1 . . . . 1164 LEU CD2 . 11010 1 2473 . 2 2 46 46 LEU CG C 13 27.173 0.0 . 1 . . . . 1164 LEU CG . 11010 1 2474 . 2 2 46 46 LEU N N 15 118.24 0.0 . 1 . . . . 1164 LEU N . 11010 1 2475 . 2 2 47 47 THR H H 1 7.845 0.0 . 1 . . . . 1165 THR HN . 11010 1 2476 . 2 2 47 47 THR HA H 1 3.933 0.0 . 1 . . . . 1165 THR HA . 11010 1 2477 . 2 2 47 47 THR HB H 1 4.21804 0.0 . 1 . . . . 1165 THR HB . 11010 1 2478 . 2 2 47 47 THR HG21 H 1 1.195 0.0 . 1 . . . . 1165 THR HG2# . 11010 1 2479 . 2 2 47 47 THR HG22 H 1 1.195 0.0 . 1 . . . . 1165 THR HG2# . 11010 1 2480 . 2 2 47 47 THR HG23 H 1 1.195 0.0 . 1 . . . . 1165 THR HG2# . 11010 1 2481 . 2 2 47 47 THR CA C 13 66.72351 0.0 . 1 . . . . 1165 THR CA . 11010 1 2482 . 2 2 47 47 THR CB C 13 68.748 0.0 . 1 . . . . 1165 THR CB . 11010 1 2483 . 2 2 47 47 THR CG2 C 13 21.845 0.0 . 1 . . . . 1165 THR CG2 . 11010 1 2484 . 2 2 47 47 THR N N 15 115.95 0.0 . 1 . . . . 1165 THR N . 11010 1 2485 . 2 2 48 48 ALA H H 1 8.199 0.0 . 1 . . . . 1166 ALA HN . 11010 1 2486 . 2 2 48 48 ALA HA H 1 4.1 0.0 . 1 . . . . 1166 ALA HA . 11010 1 2487 . 2 2 48 48 ALA HB1 H 1 1.589 0.0 . 1 . . . . 1166 ALA HB# . 11010 1 2488 . 2 2 48 48 ALA HB2 H 1 1.589 0.0 . 1 . . . . 1166 ALA HB# . 11010 1 2489 . 2 2 48 48 ALA HB3 H 1 1.589 0.0 . 1 . . . . 1166 ALA HB# . 11010 1 2490 . 2 2 48 48 ALA CA C 13 55.567 0.0 . 1 . . . . 1166 ALA CA . 11010 1 2491 . 2 2 48 48 ALA CB C 13 18.994 0.0 . 1 . . . . 1166 ALA CB . 11010 1 2492 . 2 2 48 48 ALA N N 15 125.29 0.0 . 1 . . . . 1166 ALA N . 11010 1 2493 . 2 2 49 49 GLN H H 1 8.624 0.0 . 1 . . . . 1167 GLN HN . 11010 1 2494 . 2 2 49 49 GLN HA H 1 3.94 0.0 . 1 . . . . 1167 GLN HA . 11010 1 2495 . 2 2 49 49 GLN HB2 H 1 1.95 0.0 . 1 . . . . 1167 GLN HB1 . 11010 1 2496 . 2 2 49 49 GLN HB3 H 1 2.317 0.0 . 1 . . . . 1167 GLN HB2 . 11010 1 2497 . 2 2 49 49 GLN HE21 H 1 6.606 0.0 . 1 . . . . 1167 GLN HE21 . 11010 1 2498 . 2 2 49 49 GLN HE22 H 1 7.107 0.0 . 1 . . . . 1167 GLN HE22 . 11010 1 2499 . 2 2 49 49 GLN HG2 H 1 2.305 0.0 . 1 . . . . 1167 GLN HG1 . 11010 1 2500 . 2 2 49 49 GLN HG3 H 1 2.583 0.0 . 1 . . . . 1167 GLN HG2 . 11010 1 2501 . 2 2 49 49 GLN CA C 13 59.32 0.0 . 1 . . . . 1167 GLN CA . 11010 1 2502 . 2 2 49 49 GLN CB C 13 28.278 0.0 . 1 . . . . 1167 GLN CB . 11010 1 2503 . 2 2 49 49 GLN CG C 13 34.088 0.0 . 1 . . . . 1167 GLN CG . 11010 1 2504 . 2 2 49 49 GLN N N 15 116.912 0.0 . 1 . . . . 1167 GLN N . 11010 1 2505 . 2 2 49 49 GLN NE2 N 15 109.092 0.0 . 1 . . . . 1167 GLN NE2 . 11010 1 2506 . 2 2 50 50 GLN H H 1 8.01 0.0 . 1 . . . . 1168 GLN HN . 11010 1 2507 . 2 2 50 50 GLN HA H 1 3.982 0.0 . 1 . . . . 1168 GLN HA . 11010 1 2508 . 2 2 50 50 GLN HB2 H 1 2.161596 0.0 . 1 . . . . 1168 GLN HB1 . 11010 1 2509 . 2 2 50 50 GLN HB3 H 1 2.224349 0.0 . 1 . . . . 1168 GLN HB2 . 11010 1 2510 . 2 2 50 50 GLN HE21 H 1 6.774 0.0 . 1 . . . . 1168 GLN HE21 . 11010 1 2511 . 2 2 50 50 GLN HE22 H 1 7.417 0.0 . 1 . . . . 1168 GLN HE22 . 11010 1 2512 . 2 2 50 50 GLN HG2 H 1 2.347 0.0 . 1 . . . . 1168 GLN HG1 . 11010 1 2513 . 2 2 50 50 GLN HG3 H 1 2.39 0.0 . 1 . . . . 1168 GLN HG2 . 11010 1 2514 . 2 2 50 50 GLN CA C 13 58.737 0.0 . 1 . . . . 1168 GLN CA . 11010 1 2515 . 2 2 50 50 GLN CB C 13 28.053 0.0 . 1 . . . . 1168 GLN CB . 11010 1 2516 . 2 2 50 50 GLN CG C 13 33.625 0.0 . 1 . . . . 1168 GLN CG . 11010 1 2517 . 2 2 50 50 GLN N N 15 120.716 0.0 . 1 . . . . 1168 GLN N . 11010 1 2518 . 2 2 50 50 GLN NE2 N 15 111.841 0.0 . 1 . . . . 1168 GLN NE2 . 11010 1 2519 . 2 2 51 51 MET H H 1 8.239 0.0 . 1 . . . . 1169 MET HN . 11010 1 2520 . 2 2 51 51 MET HA H 1 4.109 0.0 . 1 . . . . 1169 MET HA . 11010 1 2521 . 2 2 51 51 MET HB2 H 1 2.015 0.0 . 1 . . . . 1169 MET HB1 . 11010 1 2522 . 2 2 51 51 MET HB3 H 1 2.201992 0.0 . 1 . . . . 1169 MET HB2 . 11010 1 2523 . 2 2 51 51 MET HE1 H 1 2.027 0.0 . 1 . . . . 1169 MET HE# . 11010 1 2524 . 2 2 51 51 MET HE2 H 1 2.027 0.0 . 1 . . . . 1169 MET HE# . 11010 1 2525 . 2 2 51 51 MET HE3 H 1 2.027 0.0 . 1 . . . . 1169 MET HE# . 11010 1 2526 . 2 2 51 51 MET HG2 H 1 2.429389 0.0 . 1 . . . . 1169 MET HG1 . 11010 1 2527 . 2 2 51 51 MET HG3 H 1 2.715256 0.0 . 1 . . . . 1169 MET HG2 . 11010 1 2528 . 2 2 51 51 MET CA C 13 58.715 0.0 . 1 . . . . 1169 MET CA . 11010 1 2529 . 2 2 51 51 MET CB C 13 32.934 0.0 . 1 . . . . 1169 MET CB . 11010 1 2530 . 2 2 51 51 MET CE C 13 17.458 0.0 . 1 . . . . 1169 MET CE . 11010 1 2531 . 2 2 51 51 MET CG C 13 31.8024 0.0 . 1 . . . . 1169 MET CG . 11010 1 2532 . 2 2 51 51 MET N N 15 119.51 0.0 . 1 . . . . 1169 MET N . 11010 1 2533 . 2 2 52 52 LEU H H 1 8.384471 0.0 . 1 . . . . 1170 LEU HN . 11010 1 2534 . 2 2 52 52 LEU HA H 1 3.896 0.0 . 1 . . . . 1170 LEU HA . 11010 1 2535 . 2 2 52 52 LEU HB2 H 1 1.479 0.0 . 1 . . . . 1170 LEU HB1 . 11010 1 2536 . 2 2 52 52 LEU HB3 H 1 2.056984 0.0 . 1 . . . . 1170 LEU HB2 . 11010 1 2537 . 2 2 52 52 LEU HD11 H 1 0.9038467 0.0 . 1 . . . . 1170 LEU HD1# . 11010 1 2538 . 2 2 52 52 LEU HD12 H 1 0.9038467 0.0 . 1 . . . . 1170 LEU HD1# . 11010 1 2539 . 2 2 52 52 LEU HD13 H 1 0.9038467 0.0 . 1 . . . . 1170 LEU HD1# . 11010 1 2540 . 2 2 52 52 LEU HD21 H 1 1.025102 0.0 . 1 . . . . 1170 LEU HD2# . 11010 1 2541 . 2 2 52 52 LEU HD22 H 1 1.025102 0.0 . 1 . . . . 1170 LEU HD2# . 11010 1 2542 . 2 2 52 52 LEU HD23 H 1 1.025102 0.0 . 1 . . . . 1170 LEU HD2# . 11010 1 2543 . 2 2 52 52 LEU HG H 1 1.503 0.0 . 1 . . . . 1170 LEU HG . 11010 1 2544 . 2 2 52 52 LEU CA C 13 58.287 0.0 . 1 . . . . 1170 LEU CA . 11010 1 2545 . 2 2 52 52 LEU CB C 13 41.844 0.0 . 1 . . . . 1170 LEU CB . 11010 1 2546 . 2 2 52 52 LEU CD1 C 13 26.295 0.0 . 1 . . . . 1170 LEU CD1 . 11010 1 2547 . 2 2 52 52 LEU CD2 C 13 25.18591 0.0 . 1 . . . . 1170 LEU CD2 . 11010 1 2548 . 2 2 52 52 LEU CG C 13 27.213 0.0 . 1 . . . . 1170 LEU CG . 11010 1 2549 . 2 2 52 52 LEU N N 15 120.451 0.0 . 1 . . . . 1170 LEU N . 11010 1 2550 . 2 2 53 53 GLN H H 1 7.855254 0.0 . 1 . . . . 1171 GLN HN . 11010 1 2551 . 2 2 53 53 GLN HA H 1 3.942 0.0 . 1 . . . . 1171 GLN HA . 11010 1 2552 . 2 2 53 53 GLN HB2 H 1 2.143 0.0 . 2 . . . . 1171 GLN HB# . 11010 1 2553 . 2 2 53 53 GLN HE21 H 1 6.873 0.0 . 1 . . . . 1171 GLN HE21 . 11010 1 2554 . 2 2 53 53 GLN HE22 H 1 7.381 0.0 . 1 . . . . 1171 GLN HE22 . 11010 1 2555 . 2 2 53 53 GLN HG2 H 1 2.424 0.0 . 2 . . . . 1171 GLN HG# . 11010 1 2556 . 2 2 53 53 GLN CA C 13 58.882 0.0 . 1 . . . . 1171 GLN CA . 11010 1 2557 . 2 2 53 53 GLN CB C 13 28.198 0.0 . 1 . . . . 1171 GLN CB . 11010 1 2558 . 2 2 53 53 GLN CG C 13 33.62 0.0 . 1 . . . . 1171 GLN CG . 11010 1 2559 . 2 2 53 53 GLN N N 15 118.243 0.0 . 1 . . . . 1171 GLN N . 11010 1 2560 . 2 2 53 53 GLN NE2 N 15 112.113 0.0 . 1 . . . . 1171 GLN NE2 . 11010 1 2561 . 2 2 54 54 ASP H H 1 8.457 0.0 . 1 . . . . 1172 ASP HN . 11010 1 2562 . 2 2 54 54 ASP HA H 1 4.352 0.0 . 1 . . . . 1172 ASP HA . 11010 1 2563 . 2 2 54 54 ASP HB2 H 1 2.636 0.0 . 1 . . . . 1172 ASP HB1 . 11010 1 2564 . 2 2 54 54 ASP HB3 H 1 2.782 0.0 . 1 . . . . 1172 ASP HB2 . 11010 1 2565 . 2 2 54 54 ASP CA C 13 57.56 0.0 . 1 . . . . 1172 ASP CA . 11010 1 2566 . 2 2 54 54 ASP CB C 13 40.66 0.0 . 1 . . . . 1172 ASP CB . 11010 1 2567 . 2 2 54 54 ASP N N 15 119.875 0.0 . 1 . . . . 1172 ASP N . 11010 1 2568 . 2 2 55 55 SER H H 1 8.213 0.0 . 1 . . . . 1173 SER HN . 11010 1 2569 . 2 2 55 55 SER HA H 1 4.297 0.0 . 1 . . . . 1173 SER HA . 11010 1 2570 . 2 2 55 55 SER HB2 H 1 3.853 0.0 . 1 . . . . 1173 SER HB1 . 11010 1 2571 . 2 2 55 55 SER HB3 H 1 3.922 0.0 . 1 . . . . 1173 SER HB2 . 11010 1 2572 . 2 2 55 55 SER CA C 13 62.198 0.0 . 1 . . . . 1173 SER CA . 11010 1 2573 . 2 2 55 55 SER CB C 13 63.776 0.0 . 1 . . . . 1173 SER CB . 11010 1 2574 . 2 2 55 55 SER N N 15 116.239 0.0 . 1 . . . . 1173 SER N . 11010 1 2575 . 2 2 56 56 LYS H H 1 8.388626 0.0 . 1 . . . . 1174 LYS HN . 11010 1 2576 . 2 2 56 56 LYS HA H 1 3.807 0.0 . 1 . . . . 1174 LYS HA . 11010 1 2577 . 2 2 56 56 LYS HB2 H 1 1.902 0.0 . 2 . . . . 1174 LYS HB# . 11010 1 2578 . 2 2 56 56 LYS HD2 H 1 1.566397 0.0 . 2 . . . . 1174 LYS HD# . 11010 1 2579 . 2 2 56 56 LYS HE2 H 1 2.823 0.0 . 1 . . . . 1174 LYS HE1 . 11010 1 2580 . 2 2 56 56 LYS HE3 H 1 2.907 0.0 . 1 . . . . 1174 LYS HE2 . 11010 1 2581 . 2 2 56 56 LYS HG2 H 1 1.298 0.0 . 1 . . . . 1174 LYS HG1 . 11010 1 2582 . 2 2 56 56 LYS HG3 H 1 1.654 0.0 . 1 . . . . 1174 LYS HG2 . 11010 1 2583 . 2 2 56 56 LYS CA C 13 60.65 0.0 . 1 . . . . 1174 LYS CA . 11010 1 2584 . 2 2 56 56 LYS CB C 13 32.001 0.0 . 1 . . . . 1174 LYS CB . 11010 1 2585 . 2 2 56 56 LYS CD C 13 29.672 0.0 . 1 . . . . 1174 LYS CD . 11010 1 2586 . 2 2 56 56 LYS CE C 13 42.026 0.0 . 1 . . . . 1174 LYS CE . 11010 1 2587 . 2 2 56 56 LYS CG C 13 26.048 0.0 . 1 . . . . 1174 LYS CG . 11010 1 2588 . 2 2 56 56 LYS N N 15 120.084 0.0 . 1 . . . . 1174 LYS N . 11010 1 2589 . 2 2 57 57 THR H H 1 7.953 0.0 . 1 . . . . 1175 THR HN . 11010 1 2590 . 2 2 57 57 THR HA H 1 3.913 0.0 . 1 . . . . 1175 THR HA . 11010 1 2591 . 2 2 57 57 THR HB H 1 4.302327 0.0 . 1 . . . . 1175 THR HB . 11010 1 2592 . 2 2 57 57 THR HG21 H 1 1.212 0.0 . 1 . . . . 1175 THR HG2# . 11010 1 2593 . 2 2 57 57 THR HG22 H 1 1.212 0.0 . 1 . . . . 1175 THR HG2# . 11010 1 2594 . 2 2 57 57 THR HG23 H 1 1.212 0.0 . 1 . . . . 1175 THR HG2# . 11010 1 2595 . 2 2 57 57 THR CA C 13 66.621 0.0 . 1 . . . . 1175 THR CA . 11010 1 2596 . 2 2 57 57 THR CB C 13 68.908 0.0 . 1 . . . . 1175 THR CB . 11010 1 2597 . 2 2 57 57 THR CG2 C 13 21.852 0.0 . 1 . . . . 1175 THR CG2 . 11010 1 2598 . 2 2 57 57 THR N N 15 115.761 0.0 . 1 . . . . 1175 THR N . 11010 1 2599 . 2 2 58 58 LYS H H 1 7.829 0.0 . 1 . . . . 1176 LYS HN . 11010 1 2600 . 2 2 58 58 LYS HA H 1 3.874525 0.0 . 1 . . . . 1176 LYS HA . 11010 1 2601 . 2 2 58 58 LYS HB2 H 1 1.724 0.0 . 1 . . . . 1176 LYS HB1 . 11010 1 2602 . 2 2 58 58 LYS HB3 H 1 1.89493 0.0 . 1 . . . . 1176 LYS HB2 . 11010 1 2603 . 2 2 58 58 LYS HD2 H 1 1.539 0.0 . 1 . . . . 1176 LYS HD1 . 11010 1 2604 . 2 2 58 58 LYS HD3 H 1 1.588 0.0 . 1 . . . . 1176 LYS HD2 . 11010 1 2605 . 2 2 58 58 LYS HE2 H 1 2.794 0.0 . 1 . . . . 1176 LYS HE1 . 11010 1 2606 . 2 2 58 58 LYS HE3 H 1 2.837 0.0 . 1 . . . . 1176 LYS HE2 . 11010 1 2607 . 2 2 58 58 LYS HG2 H 1 1.318 0.0 . 1 . . . . 1176 LYS HG1 . 11010 1 2608 . 2 2 58 58 LYS HG3 H 1 1.549 0.0 . 1 . . . . 1176 LYS HG2 . 11010 1 2609 . 2 2 58 58 LYS CA C 13 59.972 0.0 . 1 . . . . 1176 LYS CA . 11010 1 2610 . 2 2 58 58 LYS CB C 13 32.634 0.0 . 1 . . . . 1176 LYS CB . 11010 1 2611 . 2 2 58 58 LYS CD C 13 29.155 0.0 . 1 . . . . 1176 LYS CD . 11010 1 2612 . 2 2 58 58 LYS CE C 13 41.952 0.0 . 1 . . . . 1176 LYS CE . 11010 1 2613 . 2 2 58 58 LYS CG C 13 25.75506 0.0 . 1 . . . . 1176 LYS CG . 11010 1 2614 . 2 2 58 58 LYS N N 15 121.239 0.0 . 1 . . . . 1176 LYS N . 11010 1 2615 . 2 2 59 59 ILE H H 1 8.84 0.0 . 1 . . . . 1177 ILE HN . 11010 1 2616 . 2 2 59 59 ILE HA H 1 3.348 0.0 . 1 . . . . 1177 ILE HA . 11010 1 2617 . 2 2 59 59 ILE HB H 1 1.848 0.0 . 1 . . . . 1177 ILE HB . 11010 1 2618 . 2 2 59 59 ILE HD11 H 1 0.727 0.0 . 1 . . . . 1177 ILE HD1# . 11010 1 2619 . 2 2 59 59 ILE HD12 H 1 0.727 0.0 . 1 . . . . 1177 ILE HD1# . 11010 1 2620 . 2 2 59 59 ILE HD13 H 1 0.727 0.0 . 1 . . . . 1177 ILE HD1# . 11010 1 2621 . 2 2 59 59 ILE HG12 H 1 0.678 0.0 . 1 . . . . 1177 ILE HG11 . 11010 1 2622 . 2 2 59 59 ILE HG13 H 1 1.851 0.0 . 1 . . . . 1177 ILE HG12 . 11010 1 2623 . 2 2 59 59 ILE HG21 H 1 0.82 0.0 . 1 . . . . 1177 ILE HG2# . 11010 1 2624 . 2 2 59 59 ILE HG22 H 1 0.82 0.0 . 1 . . . . 1177 ILE HG2# . 11010 1 2625 . 2 2 59 59 ILE HG23 H 1 0.82 0.0 . 1 . . . . 1177 ILE HG2# . 11010 1 2626 . 2 2 59 59 ILE CA C 13 66.363 0.0 . 1 . . . . 1177 ILE CA . 11010 1 2627 . 2 2 59 59 ILE CB C 13 38.198 0.0 . 1 . . . . 1177 ILE CB . 11010 1 2628 . 2 2 59 59 ILE CD1 C 13 14.984 0.0 . 1 . . . . 1177 ILE CD1 . 11010 1 2629 . 2 2 59 59 ILE CG1 C 13 31.39177 0.0 . 1 . . . . 1177 ILE CG1 . 11010 1 2630 . 2 2 59 59 ILE CG2 C 13 17.228 0.0 . 1 . . . . 1177 ILE CG2 . 11010 1 2631 . 2 2 59 59 ILE N N 15 119.995 0.0 . 1 . . . . 1177 ILE N . 11010 1 2632 . 2 2 60 60 ASP H H 1 7.712 0.0 . 1 . . . . 1178 ASP HN . 11010 1 2633 . 2 2 60 60 ASP HA H 1 4.349 0.0 . 1 . . . . 1178 ASP HA . 11010 1 2634 . 2 2 60 60 ASP HB2 H 1 2.631 0.0 . 1 . . . . 1178 ASP HB1 . 11010 1 2635 . 2 2 60 60 ASP HB3 H 1 2.826811 0.0 . 1 . . . . 1178 ASP HB2 . 11010 1 2636 . 2 2 60 60 ASP CA C 13 57.886 0.0 . 1 . . . . 1178 ASP CA . 11010 1 2637 . 2 2 60 60 ASP CB C 13 40.415 0.0 . 1 . . . . 1178 ASP CB . 11010 1 2638 . 2 2 60 60 ASP N N 15 118.989 0.0 . 1 . . . . 1178 ASP N . 11010 1 2639 . 2 2 61 61 ILE H H 1 7.69 0.0 . 1 . . . . 1179 ILE HN . 11010 1 2640 . 2 2 61 61 ILE HA H 1 3.707 0.0 . 1 . . . . 1179 ILE HA . 11010 1 2641 . 2 2 61 61 ILE HB H 1 1.958 0.0 . 1 . . . . 1179 ILE HB . 11010 1 2642 . 2 2 61 61 ILE HD11 H 1 0.785 0.0 . 1 . . . . 1179 ILE HD1# . 11010 1 2643 . 2 2 61 61 ILE HD12 H 1 0.785 0.0 . 1 . . . . 1179 ILE HD1# . 11010 1 2644 . 2 2 61 61 ILE HD13 H 1 0.785 0.0 . 1 . . . . 1179 ILE HD1# . 11010 1 2645 . 2 2 61 61 ILE HG12 H 1 1.078 0.0 . 1 . . . . 1179 ILE HG11 . 11010 1 2646 . 2 2 61 61 ILE HG13 H 1 1.754 0.0 . 1 . . . . 1179 ILE HG12 . 11010 1 2647 . 2 2 61 61 ILE HG21 H 1 0.828957 0.0 . 1 . . . . 1179 ILE HG2# . 11010 1 2648 . 2 2 61 61 ILE HG22 H 1 0.828957 0.0 . 1 . . . . 1179 ILE HG2# . 11010 1 2649 . 2 2 61 61 ILE HG23 H 1 0.828957 0.0 . 1 . . . . 1179 ILE HG2# . 11010 1 2650 . 2 2 61 61 ILE CA C 13 65.162 0.0 . 1 . . . . 1179 ILE CA . 11010 1 2651 . 2 2 61 61 ILE CB C 13 38.254 0.0 . 1 . . . . 1179 ILE CB . 11010 1 2652 . 2 2 61 61 ILE CD1 C 13 13.401 0.0 . 1 . . . . 1179 ILE CD1 . 11010 1 2653 . 2 2 61 61 ILE CG1 C 13 29.157 0.0 . 1 . . . . 1179 ILE CG1 . 11010 1 2654 . 2 2 61 61 ILE CG2 C 13 17.055 0.0 . 1 . . . . 1179 ILE CG2 . 11010 1 2655 . 2 2 61 61 ILE N N 15 120.884 0.0 . 1 . . . . 1179 ILE N . 11010 1 2656 . 2 2 62 62 ILE H H 1 8.587 0.0 . 1 . . . . 1180 ILE HN . 11010 1 2657 . 2 2 62 62 ILE HA H 1 3.653 0.0 . 1 . . . . 1180 ILE HA . 11010 1 2658 . 2 2 62 62 ILE HB H 1 1.722 0.0 . 1 . . . . 1180 ILE HB . 11010 1 2659 . 2 2 62 62 ILE HD11 H 1 0.698 0.0 . 1 . . . . 1180 ILE HD1# . 11010 1 2660 . 2 2 62 62 ILE HD12 H 1 0.698 0.0 . 1 . . . . 1180 ILE HD1# . 11010 1 2661 . 2 2 62 62 ILE HD13 H 1 0.698 0.0 . 1 . . . . 1180 ILE HD1# . 11010 1 2662 . 2 2 62 62 ILE HG12 H 1 0.8849284 0.0 . 1 . . . . 1180 ILE HG11 . 11010 1 2663 . 2 2 62 62 ILE HG13 H 1 1.760155 0.0 . 1 . . . . 1180 ILE HG12 . 11010 1 2664 . 2 2 62 62 ILE HG21 H 1 0.895 0.0 . 1 . . . . 1180 ILE HG2# . 11010 1 2665 . 2 2 62 62 ILE HG22 H 1 0.895 0.0 . 1 . . . . 1180 ILE HG2# . 11010 1 2666 . 2 2 62 62 ILE HG23 H 1 0.895 0.0 . 1 . . . . 1180 ILE HG2# . 11010 1 2667 . 2 2 62 62 ILE CA C 13 65.587 0.0 . 1 . . . . 1180 ILE CA . 11010 1 2668 . 2 2 62 62 ILE CB C 13 38.049 0.0 . 1 . . . . 1180 ILE CB . 11010 1 2669 . 2 2 62 62 ILE CD1 C 13 14.401 0.0 . 1 . . . . 1180 ILE CD1 . 11010 1 2670 . 2 2 62 62 ILE CG1 C 13 29.304 0.0 . 1 . . . . 1180 ILE CG1 . 11010 1 2671 . 2 2 62 62 ILE CG2 C 13 19.588 0.0 . 1 . . . . 1180 ILE CG2 . 11010 1 2672 . 2 2 62 62 ILE N N 15 121.683 0.0 . 1 . . . . 1180 ILE N . 11010 1 2673 . 2 2 63 63 ARG H H 1 8.918 0.0 . 1 . . . . 1181 ARG HN . 11010 1 2674 . 2 2 63 63 ARG HA H 1 3.865 0.0 . 1 . . . . 1181 ARG HA . 11010 1 2675 . 2 2 63 63 ARG HB2 H 1 1.51963 0.0 . 1 . . . . 1181 ARG HB1 . 11010 1 2676 . 2 2 63 63 ARG HB3 H 1 1.934 0.0 . 1 . . . . 1181 ARG HB2 . 11010 1 2677 . 2 2 63 63 ARG HD2 H 1 3.101 0.0 . 1 . . . . 1181 ARG HD1 . 11010 1 2678 . 2 2 63 63 ARG HD3 H 1 3.155 0.0 . 1 . . . . 1181 ARG HD2 . 11010 1 2679 . 2 2 63 63 ARG HG2 H 1 1.755 0.0 . 2 . . . . 1181 ARG HG# . 11010 1 2680 . 2 2 63 63 ARG CA C 13 60.874 0.0 . 1 . . . . 1181 ARG CA . 11010 1 2681 . 2 2 63 63 ARG CB C 13 29.639 0.0 . 1 . . . . 1181 ARG CB . 11010 1 2682 . 2 2 63 63 ARG CD C 13 43.63 0.0 . 1 . . . . 1181 ARG CD . 11010 1 2683 . 2 2 63 63 ARG CG C 13 29.575 0.0 . 1 . . . . 1181 ARG CG . 11010 1 2684 . 2 2 63 63 ARG N N 15 117.365 0.0 . 1 . . . . 1181 ARG N . 11010 1 2685 . 2 2 64 64 MET H H 1 7.783 0.0 . 1 . . . . 1182 MET HN . 11010 1 2686 . 2 2 64 64 MET HA H 1 4.173 0.0 . 1 . . . . 1182 MET HA . 11010 1 2687 . 2 2 64 64 MET HB2 H 1 2.245 0.0 . 2 . . . . 1182 MET HB# . 11010 1 2688 . 2 2 64 64 MET HE1 H 1 2.052 0.0 . 1 . . . . 1182 MET HE# . 11010 1 2689 . 2 2 64 64 MET HE2 H 1 2.052 0.0 . 1 . . . . 1182 MET HE# . 11010 1 2690 . 2 2 64 64 MET HE3 H 1 2.052 0.0 . 1 . . . . 1182 MET HE# . 11010 1 2691 . 2 2 64 64 MET HG2 H 1 2.541 0.0 . 1 . . . . 1182 MET HG1 . 11010 1 2692 . 2 2 64 64 MET HG3 H 1 2.669651 0.0 . 1 . . . . 1182 MET HG2 . 11010 1 2693 . 2 2 64 64 MET CA C 13 58.758 0.0 . 1 . . . . 1182 MET CA . 11010 1 2694 . 2 2 64 64 MET CB C 13 31.951 0.0 . 1 . . . . 1182 MET CB . 11010 1 2695 . 2 2 64 64 MET CE C 13 17.069 0.0 . 1 . . . . 1182 MET CE . 11010 1 2696 . 2 2 64 64 MET CG C 13 31.947 0.0 . 1 . . . . 1182 MET CG . 11010 1 2697 . 2 2 64 64 MET N N 15 119.339 0.0 . 1 . . . . 1182 MET N . 11010 1 2698 . 2 2 65 65 GLN H H 1 8.284709 0.0 . 1 . . . . 1183 GLN HN . 11010 1 2699 . 2 2 65 65 GLN HA H 1 3.899 0.0 . 1 . . . . 1183 GLN HA . 11010 1 2700 . 2 2 65 65 GLN HB2 H 1 1.972 0.0 . 1 . . . . 1183 GLN HB1 . 11010 1 2701 . 2 2 65 65 GLN HB3 H 1 2.326 0.0 . 1 . . . . 1183 GLN HB2 . 11010 1 2702 . 2 2 65 65 GLN HE21 H 1 6.614 0.0 . 1 . . . . 1183 GLN HE21 . 11010 1 2703 . 2 2 65 65 GLN HE22 H 1 6.971 0.0 . 1 . . . . 1183 GLN HE22 . 11010 1 2704 . 2 2 65 65 GLN HG2 H 1 2.305 0.0 . 1 . . . . 1183 GLN HG1 . 11010 1 2705 . 2 2 65 65 GLN HG3 H 1 2.589 0.0 . 1 . . . . 1183 GLN HG2 . 11010 1 2706 . 2 2 65 65 GLN CA C 13 59.139 0.0 . 1 . . . . 1183 GLN CA . 11010 1 2707 . 2 2 65 65 GLN CB C 13 29.188 0.0 . 1 . . . . 1183 GLN CB . 11010 1 2708 . 2 2 65 65 GLN CG C 13 34.327 0.0 . 1 . . . . 1183 GLN CG . 11010 1 2709 . 2 2 65 65 GLN N N 15 120.131 0.0 . 1 . . . . 1183 GLN N . 11010 1 2710 . 2 2 65 65 GLN NE2 N 15 109.206 0.0 . 1 . . . . 1183 GLN NE2 . 11010 1 2711 . 2 2 66 66 LEU H H 1 9.02 0.0 . 1 . . . . 1184 LEU HN . 11010 1 2712 . 2 2 66 66 LEU HA H 1 3.947 0.0 . 1 . . . . 1184 LEU HA . 11010 1 2713 . 2 2 66 66 LEU HB2 H 1 1.664 0.0 . 2 . . . . 1184 LEU HB# . 11010 1 2714 . 2 2 66 66 LEU HD11 H 1 0.8911121 0.0 . 2 . . . . 1184 LEU HD# . 11010 1 2715 . 2 2 66 66 LEU HD12 H 1 0.8911121 0.0 . 2 . . . . 1184 LEU HD# . 11010 1 2716 . 2 2 66 66 LEU HD13 H 1 0.8911121 0.0 . 2 . . . . 1184 LEU HD# . 11010 1 2717 . 2 2 66 66 LEU HG H 1 1.595 0.0 . 1 . . . . 1184 LEU HG . 11010 1 2718 . 2 2 66 66 LEU CA C 13 58.296 0.0 . 1 . . . . 1184 LEU CA . 11010 1 2719 . 2 2 66 66 LEU CB C 13 42.235 0.0 . 1 . . . . 1184 LEU CB . 11010 1 2720 . 2 2 66 66 LEU CD1 C 13 25.69522 0.0 . 2 . . . . 1184 LEU CD# . 11010 1 2721 . 2 2 66 66 LEU CG C 13 27.481 0.0 . 1 . . . . 1184 LEU CG . 11010 1 2722 . 2 2 66 66 LEU N N 15 122.556 0.0 . 1 . . . . 1184 LEU N . 11010 1 2723 . 2 2 67 67 ARG H H 1 7.92 0.0 . 1 . . . . 1185 ARG HN . 11010 1 2724 . 2 2 67 67 ARG HA H 1 3.929 0.0 . 1 . . . . 1185 ARG HA . 11010 1 2725 . 2 2 67 67 ARG HB2 H 1 1.882389 0.0 . 1 . . . . 1185 ARG HB1 . 11010 1 2726 . 2 2 67 67 ARG HB3 H 1 1.927132 0.0 . 1 . . . . 1185 ARG HB2 . 11010 1 2727 . 2 2 67 67 ARG HD2 H 1 3.16 0.0 . 2 . . . . 1185 ARG HD# . 11010 1 2728 . 2 2 67 67 ARG HG2 H 1 1.54505 0.0 . 1 . . . . 1185 ARG HG1 . 11010 1 2729 . 2 2 67 67 ARG HG3 H 1 1.762 0.0 . 1 . . . . 1185 ARG HG2 . 11010 1 2730 . 2 2 67 67 ARG CA C 13 59.673 0.0 . 1 . . . . 1185 ARG CA . 11010 1 2731 . 2 2 67 67 ARG CB C 13 29.86465 0.0 . 1 . . . . 1185 ARG CB . 11010 1 2732 . 2 2 67 67 ARG CD C 13 43.721 0.0 . 1 . . . . 1185 ARG CD . 11010 1 2733 . 2 2 67 67 ARG CG C 13 27.461 0.0 . 1 . . . . 1185 ARG CG . 11010 1 2734 . 2 2 67 67 ARG N N 15 118.192 0.0 . 1 . . . . 1185 ARG N . 11010 1 2735 . 2 2 68 68 ARG H H 1 7.676 0.0 . 1 . . . . 1186 ARG HN . 11010 1 2736 . 2 2 68 68 ARG HA H 1 3.993 0.0 . 1 . . . . 1186 ARG HA . 11010 1 2737 . 2 2 68 68 ARG HB2 H 1 1.857 0.0 . 2 . . . . 1186 ARG HB# . 11010 1 2738 . 2 2 68 68 ARG HD2 H 1 3.13 0.0 . 2 . . . . 1186 ARG HD# . 11010 1 2739 . 2 2 68 68 ARG HG2 H 1 1.619 0.0 . 1 . . . . 1186 ARG HG1 . 11010 1 2740 . 2 2 68 68 ARG HG3 H 1 1.758901 0.0 . 1 . . . . 1186 ARG HG2 . 11010 1 2741 . 2 2 68 68 ARG CA C 13 58.721 0.0 . 1 . . . . 1186 ARG CA . 11010 1 2742 . 2 2 68 68 ARG CB C 13 30.113 0.0 . 1 . . . . 1186 ARG CB . 11010 1 2743 . 2 2 68 68 ARG CD C 13 43.496 0.0 . 1 . . . . 1186 ARG CD . 11010 1 2744 . 2 2 68 68 ARG CG C 13 27.438 0.0 . 1 . . . . 1186 ARG CG . 11010 1 2745 . 2 2 68 68 ARG N N 15 117.014 0.0 . 1 . . . . 1186 ARG N . 11010 1 2746 . 2 2 69 69 ALA H H 1 8.035 0.0 . 1 . . . . 1187 ALA HN . 11010 1 2747 . 2 2 69 69 ALA HA H 1 4.11 0.0 . 1 . . . . 1187 ALA HA . 11010 1 2748 . 2 2 69 69 ALA HB1 H 1 1.371 0.0 . 1 . . . . 1187 ALA HB# . 11010 1 2749 . 2 2 69 69 ALA HB2 H 1 1.371 0.0 . 1 . . . . 1187 ALA HB# . 11010 1 2750 . 2 2 69 69 ALA HB3 H 1 1.371 0.0 . 1 . . . . 1187 ALA HB# . 11010 1 2751 . 2 2 69 69 ALA CA C 13 54.388 0.0 . 1 . . . . 1187 ALA CA . 11010 1 2752 . 2 2 69 69 ALA CB C 13 18.48479 0.0 . 1 . . . . 1187 ALA CB . 11010 1 2753 . 2 2 69 69 ALA N N 15 121.941 0.0 . 1 . . . . 1187 ALA N . 11010 1 2754 . 2 2 70 70 LEU H H 1 8.002 0.0 . 1 . . . . 1188 LEU HN . 11010 1 2755 . 2 2 70 70 LEU HA H 1 4.101 0.0 . 1 . . . . 1188 LEU HA . 11010 1 2756 . 2 2 70 70 LEU HB2 H 1 1.488 0.0 . 1 . . . . 1188 LEU HB1 . 11010 1 2757 . 2 2 70 70 LEU HB3 H 1 1.758 0.0 . 1 . . . . 1188 LEU HB2 . 11010 1 2758 . 2 2 70 70 LEU HD11 H 1 0.8243731 0.0 . 1 . . . . 1188 LEU HD1# . 11010 1 2759 . 2 2 70 70 LEU HD12 H 1 0.8243731 0.0 . 1 . . . . 1188 LEU HD1# . 11010 1 2760 . 2 2 70 70 LEU HD13 H 1 0.8243731 0.0 . 1 . . . . 1188 LEU HD1# . 11010 1 2761 . 2 2 70 70 LEU HD21 H 1 0.8412992 0.0 . 1 . . . . 1188 LEU HD2# . 11010 1 2762 . 2 2 70 70 LEU HD22 H 1 0.8412992 0.0 . 1 . . . . 1188 LEU HD2# . 11010 1 2763 . 2 2 70 70 LEU HD23 H 1 0.8412992 0.0 . 1 . . . . 1188 LEU HD2# . 11010 1 2764 . 2 2 70 70 LEU HG H 1 1.69 0.0 . 1 . . . . 1188 LEU HG . 11010 1 2765 . 2 2 70 70 LEU CA C 13 56.388 0.0 . 1 . . . . 1188 LEU CA . 11010 1 2766 . 2 2 70 70 LEU CB C 13 42.123 0.0 . 1 . . . . 1188 LEU CB . 11010 1 2767 . 2 2 70 70 LEU CD1 C 13 25.464 0.0 . 1 . . . . 1188 LEU CD1 . 11010 1 2768 . 2 2 70 70 LEU CD2 C 13 23.4966 0.0 . 1 . . . . 1188 LEU CD2 . 11010 1 2769 . 2 2 70 70 LEU CG C 13 27.035 0.0 . 1 . . . . 1188 LEU CG . 11010 1 2770 . 2 2 70 70 LEU N N 15 117.452 0.0 . 1 . . . . 1188 LEU N . 11010 1 2771 . 2 2 71 71 GLN H H 1 7.629026 0.0 . 1 . . . . 1189 GLN HN . 11010 1 2772 . 2 2 71 71 GLN HA H 1 4.139732 0.0 . 1 . . . . 1189 GLN HA . 11010 1 2773 . 2 2 71 71 GLN HB2 H 1 2.08481 0.0 . 1 . . . . 1189 GLN HB# . 11010 1 2774 . 2 2 71 71 GLN HE21 H 1 6.748 0.0 . 1 . . . . 1189 GLN HE21 . 11010 1 2775 . 2 2 71 71 GLN HE22 H 1 7.456 0.0 . 1 . . . . 1189 GLN HE22 . 11010 1 2776 . 2 2 71 71 GLN HG2 H 1 2.337576 0.0 . 1 . . . . 1189 GLN HG1 . 11010 1 2777 . 2 2 71 71 GLN HG3 H 1 2.432 0.0 . 1 . . . . 1189 GLN HG2 . 11010 1 2778 . 2 2 71 71 GLN CA C 13 56.626 0.0 . 1 . . . . 1189 GLN CA . 11010 1 2779 . 2 2 71 71 GLN CB C 13 28.75695 0.0 . 1 . . . . 1189 GLN CB . 11010 1 2780 . 2 2 71 71 GLN CG C 13 34.149 0.0 . 1 . . . . 1189 GLN CG . 11010 1 2781 . 2 2 71 71 GLN N N 15 117.796 0.0 . 1 . . . . 1189 GLN N . 11010 1 2782 . 2 2 71 71 GLN NE2 N 15 111.388 0.0 . 1 . . . . 1189 GLN NE2 . 11010 1 2783 . 2 2 72 72 ALA H H 1 7.9 0.0 . 1 . . . . 1190 ALA HN . 11010 1 2784 . 2 2 72 72 ALA HA H 1 4.168 0.0 . 1 . . . . 1190 ALA HA . 11010 1 2785 . 2 2 72 72 ALA HB1 H 1 1.382 0.0 . 1 . . . . 1190 ALA HB# . 11010 1 2786 . 2 2 72 72 ALA HB2 H 1 1.382 0.0 . 1 . . . . 1190 ALA HB# . 11010 1 2787 . 2 2 72 72 ALA HB3 H 1 1.382 0.0 . 1 . . . . 1190 ALA HB# . 11010 1 2788 . 2 2 72 72 ALA CA C 13 53.715 0.0 . 1 . . . . 1190 ALA CA . 11010 1 2789 . 2 2 72 72 ALA CB C 13 18.666 0.0 . 1 . . . . 1190 ALA CB . 11010 1 2790 . 2 2 72 72 ALA N N 15 122.652 0.0 . 1 . . . . 1190 ALA N . 11010 1 2791 . 2 2 73 73 ASP H H 1 8.086 0.0 . 1 . . . . 1191 ASP HN . 11010 1 2792 . 2 2 73 73 ASP HA H 1 4.491 0.0 . 1 . . . . 1191 ASP HA . 11010 1 2793 . 2 2 73 73 ASP HB2 H 1 2.617 0.0 . 1 . . . . 1191 ASP HB1 . 11010 1 2794 . 2 2 73 73 ASP HB3 H 1 2.64 0.0 . 1 . . . . 1191 ASP HB2 . 11010 1 2795 . 2 2 73 73 ASP CA C 13 55.134 0.0 . 1 . . . . 1191 ASP CA . 11010 1 2796 . 2 2 73 73 ASP CB C 13 40.983 0.0 . 1 . . . . 1191 ASP CB . 11010 1 2797 . 2 2 73 73 ASP N N 15 117.878 0.0 . 1 . . . . 1191 ASP N . 11010 1 2798 . 2 2 74 74 GLN H H 1 7.987 0.0 . 1 . . . . 1192 GLN HN . 11010 1 2799 . 2 2 74 74 GLN HA H 1 4.195396 0.0 . 1 . . . . 1192 GLN HA . 11010 1 2800 . 2 2 74 74 GLN HB2 H 1 1.99 0.0 . 1 . . . . 1192 GLN HB1 . 11010 1 2801 . 2 2 74 74 GLN HB3 H 1 2.098456 0.0 . 1 . . . . 1192 GLN HB2 . 11010 1 2802 . 2 2 74 74 GLN HG2 H 1 2.307 0.0 . 2 . . . . 1192 GLN HG# . 11010 1 2803 . 2 2 74 74 GLN CA C 13 56.304 0.0 . 1 . . . . 1192 GLN CA . 11010 1 2804 . 2 2 74 74 GLN CB C 13 29.089 0.0 . 1 . . . . 1192 GLN CB . 11010 1 2805 . 2 2 74 74 GLN CG C 13 33.96 0.0 . 1 . . . . 1192 GLN CG . 11010 1 2806 . 2 2 74 74 GLN N N 15 118.807 0.0 . 1 . . . . 1192 GLN N . 11010 1 2807 . 2 2 75 75 LEU H H 1 8.037 0.0 . 1 . . . . 1193 LEU HN . 11010 1 2808 . 2 2 75 75 LEU HA H 1 4.189 0.0 . 1 . . . . 1193 LEU HA . 11010 1 2809 . 2 2 75 75 LEU HB2 H 1 1.525 0.0 . 1 . . . . 1193 LEU HB1 . 11010 1 2810 . 2 2 75 75 LEU HB3 H 1 1.639 0.0 . 1 . . . . 1193 LEU HB2 . 11010 1 2811 . 2 2 75 75 LEU HD11 H 1 0.7931783 0.0 . 1 . . . . 1193 LEU HD1# . 11010 1 2812 . 2 2 75 75 LEU HD12 H 1 0.7931783 0.0 . 1 . . . . 1193 LEU HD1# . 11010 1 2813 . 2 2 75 75 LEU HD13 H 1 0.7931783 0.0 . 1 . . . . 1193 LEU HD1# . 11010 1 2814 . 2 2 75 75 LEU HD21 H 1 0.8589498 0.0 . 1 . . . . 1193 LEU HD2# . 11010 1 2815 . 2 2 75 75 LEU HD22 H 1 0.8589498 0.0 . 1 . . . . 1193 LEU HD2# . 11010 1 2816 . 2 2 75 75 LEU HD23 H 1 0.8589498 0.0 . 1 . . . . 1193 LEU HD2# . 11010 1 2817 . 2 2 75 75 LEU HG H 1 1.599 0.0 . 1 . . . . 1193 LEU HG . 11010 1 2818 . 2 2 75 75 LEU CA C 13 55.478 0.0 . 1 . . . . 1193 LEU CA . 11010 1 2819 . 2 2 75 75 LEU CB C 13 42.139 0.0 . 1 . . . . 1193 LEU CB . 11010 1 2820 . 2 2 75 75 LEU CD1 C 13 23.412 0.0 . 1 . . . . 1193 LEU CD1 . 11010 1 2821 . 2 2 75 75 LEU CD2 C 13 25.17479 0.0 . 1 . . . . 1193 LEU CD2 . 11010 1 2822 . 2 2 75 75 LEU CG C 13 26.972 0.0 . 1 . . . . 1193 LEU CG . 11010 1 2823 . 2 2 75 75 LEU N N 15 121.514 0.0 . 1 . . . . 1193 LEU N . 11010 1 2824 . 2 2 76 76 GLU H H 1 8.248 0.0 . 1 . . . . 1194 GLU HN . 11010 1 2825 . 2 2 76 76 GLU HA H 1 4.147084 0.0 . 1 . . . . 1194 GLU HA . 11010 1 2826 . 2 2 76 76 GLU HB2 H 1 1.856 0.0 . 1 . . . . 1194 GLU HB1 . 11010 1 2827 . 2 2 76 76 GLU HB3 H 1 1.979413 0.0 . 1 . . . . 1194 GLU HB2 . 11010 1 2828 . 2 2 76 76 GLU HG2 H 1 2.162 0.0 . 1 . . . . 1194 GLU HG1 . 11010 1 2829 . 2 2 76 76 GLU HG3 H 1 2.204 0.0 . 1 . . . . 1194 GLU HG2 . 11010 1 2830 . 2 2 76 76 GLU CA C 13 56.933 0.0 . 1 . . . . 1194 GLU CA . 11010 1 2831 . 2 2 76 76 GLU CB C 13 30.016 0.0 . 1 . . . . 1194 GLU CB . 11010 1 2832 . 2 2 76 76 GLU CG C 13 36.256 0.0 . 1 . . . . 1194 GLU CG . 11010 1 2833 . 2 2 76 76 GLU N N 15 119.952 0.0 . 1 . . . . 1194 GLU N . 11010 1 2834 . 2 2 77 77 ASN H H 1 8.301 0.0 . 1 . . . . 1195 ASN HN . 11010 1 2835 . 2 2 77 77 ASN HA H 1 4.618 0.0 . 1 . . . . 1195 ASN HA . 11010 1 2836 . 2 2 77 77 ASN HB2 H 1 2.716 0.0 . 1 . . . . 1195 ASN HB1 . 11010 1 2837 . 2 2 77 77 ASN HB3 H 1 2.791626 0.0 . 1 . . . . 1195 ASN HB2 . 11010 1 2838 . 2 2 77 77 ASN HD21 H 1 6.845 0.0 . 1 . . . . 1195 ASN HD21 . 11010 1 2839 . 2 2 77 77 ASN HD22 H 1 7.553 0.0 . 1 . . . . 1195 ASN HD22 . 11010 1 2840 . 2 2 77 77 ASN CA C 13 53.437 0.0 . 1 . . . . 1195 ASN CA . 11010 1 2841 . 2 2 77 77 ASN CB C 13 38.761 0.0 . 1 . . . . 1195 ASN CB . 11010 1 2842 . 2 2 77 77 ASN N N 15 118.369 0.0 . 1 . . . . 1195 ASN N . 11010 1 2843 . 2 2 77 77 ASN ND2 N 15 112.635 0.0 . 1 . . . . 1195 ASN ND2 . 11010 1 2844 . 2 2 78 78 GLN H H 1 8.221 0.0 . 1 . . . . 1196 GLN HN . 11010 1 2845 . 2 2 78 78 GLN HA H 1 4.25 0.0 . 1 . . . . 1196 GLN HA . 11010 1 2846 . 2 2 78 78 GLN HB2 H 1 1.922674 0.0 . 1 . . . . 1196 GLN HB1 . 11010 1 2847 . 2 2 78 78 GLN HB3 H 1 2.061024 0.0 . 1 . . . . 1196 GLN HB2 . 11010 1 2848 . 2 2 78 78 GLN HE21 H 1 6.761 0.0 . 1 . . . . 1196 GLN HE21 . 11010 1 2849 . 2 2 78 78 GLN HE22 H 1 7.47 0.0 . 1 . . . . 1196 GLN HE22 . 11010 1 2850 . 2 2 78 78 GLN HG2 H 1 2.313 0.0 . 2 . . . . 1196 GLN HG# . 11010 1 2851 . 2 2 78 78 GLN CA C 13 56.009 0.0 . 1 . . . . 1196 GLN CA . 11010 1 2852 . 2 2 78 78 GLN CB C 13 29.295 0.0 . 1 . . . . 1196 GLN CB . 11010 1 2853 . 2 2 78 78 GLN CG C 13 33.908 0.0 . 1 . . . . 1196 GLN CG . 11010 1 2854 . 2 2 78 78 GLN N N 15 120.073 0.0 . 1 . . . . 1196 GLN N . 11010 1 2855 . 2 2 78 78 GLN NE2 N 15 112.091 0.0 . 1 . . . . 1196 GLN NE2 . 11010 1 2856 . 2 2 79 79 ALA H H 1 8.172 0.0 . 1 . . . . 1197 ALA HN . 11010 1 2857 . 2 2 79 79 ALA HA H 1 4.235 0.0 . 1 . . . . 1197 ALA HA . 11010 1 2858 . 2 2 79 79 ALA HB1 H 1 1.321 0.0 . 1 . . . . 1197 ALA HB# . 11010 1 2859 . 2 2 79 79 ALA HB2 H 1 1.321 0.0 . 1 . . . . 1197 ALA HB# . 11010 1 2860 . 2 2 79 79 ALA HB3 H 1 1.321 0.0 . 1 . . . . 1197 ALA HB# . 11010 1 2861 . 2 2 79 79 ALA CA C 13 52.231 0.0 . 1 . . . . 1197 ALA CA . 11010 1 2862 . 2 2 79 79 ALA CB C 13 19.184 0.0 . 1 . . . . 1197 ALA CB . 11010 1 2863 . 2 2 79 79 ALA N N 15 124.799 0.0 . 1 . . . . 1197 ALA N . 11010 1 2864 . 2 2 80 80 ALA H H 1 8.122 0.0 . 1 . . . . 1198 ALA HN . 11010 1 2865 . 2 2 80 80 ALA HA H 1 4.499 0.0 . 1 . . . . 1198 ALA HA . 11010 1 2866 . 2 2 80 80 ALA HB1 H 1 1.289 0.0 . 1 . . . . 1198 ALA HB# . 11010 1 2867 . 2 2 80 80 ALA HB2 H 1 1.289 0.0 . 1 . . . . 1198 ALA HB# . 11010 1 2868 . 2 2 80 80 ALA HB3 H 1 1.289 0.0 . 1 . . . . 1198 ALA HB# . 11010 1 2869 . 2 2 80 80 ALA CA C 13 50.239 0.0 . 1 . . . . 1198 ALA CA . 11010 1 2870 . 2 2 80 80 ALA CB C 13 18.085 0.0 . 1 . . . . 1198 ALA CB . 11010 1 2871 . 2 2 80 80 ALA N N 15 125.025 0.0 . 1 . . . . 1198 ALA N . 11010 1 2872 . 2 2 81 81 PRO HA H 1 4.109 0.0 . 1 . . . . 1199 PRO HA . 11010 1 2873 . 2 2 81 81 PRO HB2 H 1 1.824 0.0 . 1 . . . . 1199 PRO HB1 . 11010 1 2874 . 2 2 81 81 PRO HB3 H 1 2.132 0.0 . 1 . . . . 1199 PRO HB2 . 11010 1 2875 . 2 2 81 81 PRO HD2 H 1 3.529 0.0 . 1 . . . . 1199 PRO HD1 . 11010 1 2876 . 2 2 81 81 PRO HD3 H 1 3.639 0.0 . 1 . . . . 1199 PRO HD2 . 11010 1 2877 . 2 2 81 81 PRO HG2 H 1 1.878 0.0 . 2 . . . . 1199 PRO HG# . 11010 1 2878 . 2 2 81 81 PRO CA C 13 64.584 0.0 . 1 . . . . 1199 PRO CA . 11010 1 2879 . 2 2 81 81 PRO CB C 13 32.04 0.0 . 1 . . . . 1199 PRO CB . 11010 1 2880 . 2 2 81 81 PRO CD C 13 50.065 0.0 . 1 . . . . 1199 PRO CD . 11010 1 2881 . 2 2 81 81 PRO CG C 13 27.255 0.0 . 1 . . . . 1199 PRO CG . 11010 1 stop_ save_