data_4384 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4384 _Entry.Title ; Solution Structure and Dynamics of the Rous Sarcoma Virus Capsid Protein and Comparison with Capsid Proteins ofOther Retroviruses ; _Entry.Type . _Entry.Version_type original _Entry.Submission_date 1999-08-28 _Entry.Accession_date 1999-08-30 _Entry.Last_release_date 2000-03-07 _Entry.Original_release_date 2000-03-07 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Ramon Campos-Olivas . . . 4384 2 John Newman . L. . 4384 3 Michael Summers . F. . 4384 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4384 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 1067 4384 '15N chemical shifts' 241 4384 '1H chemical shifts' 1595 4384 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 . . 2000-03-07 1999-08-28 original author . 4384 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4384 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 20142320 _Citation.DOI . _Citation.PubMed_ID 10677830 _Citation.Full_citation . _Citation.Title ; 1H, 13C, and 15N Chemical Shift Assignments of the Capsid Protein from Rous Sarcoma Virus ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full 'Journal of Biomolecular NMR' _Citation.Journal_volume 15 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 267 _Citation.Page_last 268 _Citation.Year 1999 _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 Ramon Campos-Olivas . . . 4384 1 2 John Newman . L. . 4384 1 3 Y. Ndassa . . . 4384 1 4 Michael Summers . F. . 4384 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID Capsid 4384 1 Retrovirus 4384 1 Rous 4384 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_CA_RSV _Assembly.Sf_category assembly _Assembly.Sf_framecode system_CA_RSV _Assembly.Entry_ID 4384 _Assembly.ID 1 _Assembly.Name 'Capsid protein from Rous Sarcoma Virus' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 28401 _Assembly.Enzyme_commission_number . _Assembly.Details ; CA_RSV is a recombinant protein overexpressed in E. coli The source of the CA_RSV gene is plasmid pSRA-2 of ATCC 45000, which is a plasmid clone containing full lenght Rous sarcoma virus, strain Schmidt Ruppin A-2, derived from unintegrated DNA from an acute infection of QT-6 cells. The DNA fragment coding for the entire 240 aminoacid mature capsid protein was amplified by PCR from pSRA-2. Flanking VspI (upstream) and BamHI (downstream) restriction sites were introduced that allowed insertion of the amplifyed fragment between the NdeI and the BamHI sites of the expresion vector pET-16b (Novagen). Thus, plasmid pET-16b(CA_RSV) was produced. Transformation of HMS174(DE3) pLysS E. coli cells with pET-16b(CA_RSV) and IPTG induction resulted in the overexpression of a 263 residue polypeptide containing 23 extra N-terminal residues, including a tag of 10 histidines, (MGHHHHHHHHHHSSGHIEGRHNM) before the actual 240 residues of the Capsid protein from Rous Sarcoma Virus. The N-terminal methionine is cleaved in the cell resulting in a 262 residue polypeptide that is purified and here referred to as CA_RSV. The actual protein sequence of the 240 residue wild-type portion, derived from DNA and here confirmed by NMR analysis, is that in protein database entries g508278 (GenBank) and S35430 (PIR). The 240 residue native sequence is numbered from 1 to 240. Numbers -22 to -1 are used to identify the non-native, N-terminal extension, from N to C termini. ; _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4384 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'CA RSV' 1 $CA_RSV . . . native . . . . . 4384 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 1D1D . 'Chain A, Nmr Solution Structure Of The Capsid Protein From Rous Sarcoma Virus' . . . . 4384 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'Capsid protein from Rous Sarcoma Virus' system 4384 1 'CA RSV' abbreviation 4384 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID ; Retroviral Capsid proteins oligomerize to form the core particle, that encapsulates the RNA viral genome. ; 4384 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CA_RSV _Entity.Sf_category entity _Entity.Sf_framecode CA_RSV _Entity.Entry_ID 4384 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Capsid protein from RSV' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GHHHHHHHHHHSSGHIEGRH NMPVVIKTEGPAWTPLEPKL ITRLADTVRTKGLRSPITMA EVEALMSSPLLPHDVTNLMR VILGPAPYALWMDAWGVQLQ TVIAAATRDPRHPANGQGRG ERTNLDRLKGLADGMVGNPQ GQAALLRPGELVAITASALQ AFREVARLAEPAGPWADITQ GPSESFVDFANRLIKAVEGS DLPPSARAPVIIDCFRQKSQ PDIQQLIRAAPSTLTTPGEI IKYVLDRQKIAPLTDQGIAA AM ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 262 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 28401 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-24 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1D1D . "Nmr Solution Structure Of The Capsid Protein From Rous Sarcoma Virus" . . . . . 100.00 262 100.00 100.00 0.00e+00 . . . . 4384 1 2 no PDB 1EM9 . "Rous Sarcoma Virus Capsid Protein: N-Terminal Domain" . . . . . 58.78 154 99.35 100.00 4.22e-102 . . . . 4384 1 3 no PDB 1P7N . "Dimeric Rous Sarcoma Virus Capsid Protein Structure With An Upstream 25-Amino Acid Residue Extension Of C-Terminal Of Gag P10 P" . . . . . 56.49 176 99.32 100.00 1.26e-96 . . . . 4384 1 4 no PDB 2X8Q . "Cryo-Em 3d Model Of The Icosahedral Particle Composed Of Rous Sarcoma Virus Capsid Protein Pentamers" . . . . . 86.26 226 98.67 99.12 2.13e-157 . . . . 4384 1 5 no PDB 3TIR . "Pseudo-Atomic Model Of The Rous Sarcoma Virus Capsid Hexamer" . . . . . 86.26 226 98.67 99.12 2.13e-157 . . . . 4384 1 6 no PDB 5A9E . "Cryo-electron Tomography And Subtomogram Averaging Of Rous- Sarcoma-virus Deltambd Virus-like Particles" . . . . . 91.98 495 98.34 98.76 9.69e-165 . . . . 4384 1 7 no DBJ BAA01499 . "gag polyprotein [Rous sarcoma virus - Schmidt-Ruppin D]" . . . . . 91.98 699 99.17 99.59 2.11e-163 . . . . 4384 1 8 no DBJ BAC65349 . "gag protein [Cloning vector RCAS-L14]" . . . . . 91.98 703 100.00 100.00 1.51e-164 . . . . 4384 1 9 no DBJ BAC78442 . "gag protein [Avian leukosis virus]" . . . . . 91.98 701 99.17 99.59 3.20e-163 . . . . 4384 1 10 no DBJ BAG16456 . "gag protein [Avian leukosis virus]" . . . . . 91.98 703 97.51 98.34 5.48e-160 . . . . 4384 1 11 no DBJ BAK64239 . "gag protein [Avian leukosis virus]" . . . . . 91.98 701 99.59 99.59 9.20e-164 . . . . 4384 1 12 no EMBL CAA24499 . "p96 polyprotein [Avian myelocytomatosis virus]" . . . . . 81.30 875 98.59 99.06 8.67e-140 . . . . 4384 1 13 no EMBL CAA24512 . "polyprotein gag [Rous sarcoma virus]" . . . . . 91.98 701 98.34 98.76 7.24e-162 . . . . 4384 1 14 no EMBL CAA32008 . "unnamed protein product [Avian retrovirus IC10]" . . . . . 91.98 1079 99.17 99.17 1.08e-159 . . . . 4384 1 15 no EMBL CAA36153 . "unnamed protein product [Rous sarcoma virus]" . . . . . 91.98 701 97.10 97.93 6.44e-159 . . . . 4384 1 16 no EMBL CAA48534 . "gag [Rous sarcoma virus]" . . . . . 91.98 701 97.10 97.93 6.44e-159 . . . . 4384 1 17 no GB AAA19606 . "gag protein, partial [Rous sarcoma virus]" . . . . . 91.98 648 98.76 99.17 4.65e-163 . . . . 4384 1 18 no GB AAA19607 . "gag protein, partial [Rous sarcoma virus]" . . . . . 91.98 648 100.00 100.00 3.56e-165 . . . . 4384 1 19 no GB AAA19608 . "gag protein, partial [Rous sarcoma virus]" . . . . . 91.98 650 100.00 100.00 1.81e-165 . . . . 4384 1 20 no GB AAA42377 . "AS42-specific fusion protein, partial [Avian musculoaponeurotic fibrosarcoma virus AS42]" . . . . . 91.98 648 97.51 98.34 2.93e-161 . . . . 4384 1 21 no GB AAA42406 . "gag-myc fusion protein [Avian myelocytomatosis virus]" . . . . . 81.30 875 99.06 99.53 3.72e-141 . . . . 4384 1 22 no PIR FOFV29 . "gag-myc polyprotein - avian myelocytomatosis virus MC29 (provirus)" . . . . . 81.30 875 98.59 99.06 8.67e-140 . . . . 4384 1 23 no PRF 2019512A . "gag gene" . . . . . 91.98 648 98.76 99.17 4.65e-163 . . . . 4384 1 24 no PRF 2019512B . "gag gene" . . . . . 91.98 648 100.00 100.00 3.56e-165 . . . . 4384 1 25 no PRF 2019512C . "gag gene" . . . . . 91.98 650 100.00 100.00 1.81e-165 . . . . 4384 1 26 no REF NP_045935 . "p110 [Avian myelocytomatosis virus]" . . . . . 81.30 875 98.59 99.06 8.67e-140 . . . . 4384 1 27 no REF NP_056886 . "Pr180 polyprotein precursor [Rous sarcoma virus]" . . . . . 91.98 1603 98.34 98.76 1.19e-152 . . . . 4384 1 28 no REF NP_056887 . "Pr76 polyprotein precursor [Rous sarcoma virus]" . . . . . 91.98 701 98.34 98.76 7.24e-162 . . . . 4384 1 29 no REF NP_955601 . "CA [Avian myelocytomatosis virus]" . . . . . 80.92 212 98.58 99.06 7.78e-146 . . . . 4384 1 30 no REF NP_955609 . "p27 CA [Rous sarcoma virus]" . . . . . 91.60 240 98.33 98.75 6.27e-167 . . . . 4384 1 31 no SP O92954 . "RecName: Full=Gag-Pro polyprotein; Contains: RecName: Full=Matrix protein p19; Contains: RecName: Full=p2A; Contains: RecName: " . . . . . 91.98 701 100.00 100.00 1.81e-164 . . . . 4384 1 32 no SP O92956 . "RecName: Full=Gag-Pro-Pol polyprotein; Contains: RecName: Full=Matrix protein p19; Contains: RecName: Full=p2A; Contains: RecNa" . . . . . 91.98 1603 100.00 100.00 2.78e-155 . . . . 4384 1 33 no SP P03322 . "RecName: Full=Gag-Pro polyprotein; Contains: RecName: Full=p3; Contains: RecName: Full=Matrix protein p19; Contains: RecName: F" . . . . . 91.98 701 98.34 98.76 7.24e-162 . . . . 4384 1 34 no SP P03323 . "RecName: Full=Gag polyprotein; Contains: RecName: Full=Matrix protein p19; Contains: RecName: Full=Core protein p10; Contains: " . . . . . 81.30 453 98.59 99.06 4.79e-144 . . . . 4384 1 35 no SP P03354 . "RecName: Full=Gag-Pro-Pol polyprotein; Contains: RecName: Full=Matrix protein p19; Contains: RecName: Full=p2A; Contains: RecNa" . . . . . 91.98 1603 98.34 98.76 1.19e-152 . . . . 4384 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Capsid protein from RSV' common 4384 1 'CA RSV' abbreviation 4384 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 -22 GLY . 4384 1 2 -21 HIS . 4384 1 3 -20 HIS . 4384 1 4 -19 HIS . 4384 1 5 -18 HIS . 4384 1 6 -17 HIS . 4384 1 7 -16 HIS . 4384 1 8 -15 HIS . 4384 1 9 -14 HIS . 4384 1 10 -13 HIS . 4384 1 11 -12 HIS . 4384 1 12 -11 SER . 4384 1 13 -10 SER . 4384 1 14 -9 GLY . 4384 1 15 -8 HIS . 4384 1 16 -7 ILE . 4384 1 17 -6 GLU . 4384 1 18 -5 GLY . 4384 1 19 -4 ARG . 4384 1 20 -3 HIS . 4384 1 21 -2 ASN . 4384 1 22 -1 MET . 4384 1 23 1 PRO . 4384 1 24 2 VAL . 4384 1 25 3 VAL . 4384 1 26 4 ILE . 4384 1 27 5 LYS . 4384 1 28 6 THR . 4384 1 29 7 GLU . 4384 1 30 8 GLY . 4384 1 31 9 PRO . 4384 1 32 10 ALA . 4384 1 33 11 TRP . 4384 1 34 12 THR . 4384 1 35 13 PRO . 4384 1 36 14 LEU . 4384 1 37 15 GLU . 4384 1 38 16 PRO . 4384 1 39 17 LYS . 4384 1 40 18 LEU . 4384 1 41 19 ILE . 4384 1 42 20 THR . 4384 1 43 21 ARG . 4384 1 44 22 LEU . 4384 1 45 23 ALA . 4384 1 46 24 ASP . 4384 1 47 25 THR . 4384 1 48 26 VAL . 4384 1 49 27 ARG . 4384 1 50 28 THR . 4384 1 51 29 LYS . 4384 1 52 30 GLY . 4384 1 53 31 LEU . 4384 1 54 32 ARG . 4384 1 55 33 SER . 4384 1 56 34 PRO . 4384 1 57 35 ILE . 4384 1 58 36 THR . 4384 1 59 37 MET . 4384 1 60 38 ALA . 4384 1 61 39 GLU . 4384 1 62 40 VAL . 4384 1 63 41 GLU . 4384 1 64 42 ALA . 4384 1 65 43 LEU . 4384 1 66 44 MET . 4384 1 67 45 SER . 4384 1 68 46 SER . 4384 1 69 47 PRO . 4384 1 70 48 LEU . 4384 1 71 49 LEU . 4384 1 72 50 PRO . 4384 1 73 51 HIS . 4384 1 74 52 ASP . 4384 1 75 53 VAL . 4384 1 76 54 THR . 4384 1 77 55 ASN . 4384 1 78 56 LEU . 4384 1 79 57 MET . 4384 1 80 58 ARG . 4384 1 81 59 VAL . 4384 1 82 60 ILE . 4384 1 83 61 LEU . 4384 1 84 62 GLY . 4384 1 85 63 PRO . 4384 1 86 64 ALA . 4384 1 87 65 PRO . 4384 1 88 66 TYR . 4384 1 89 67 ALA . 4384 1 90 68 LEU . 4384 1 91 69 TRP . 4384 1 92 70 MET . 4384 1 93 71 ASP . 4384 1 94 72 ALA . 4384 1 95 73 TRP . 4384 1 96 74 GLY . 4384 1 97 75 VAL . 4384 1 98 76 GLN . 4384 1 99 77 LEU . 4384 1 100 78 GLN . 4384 1 101 79 THR . 4384 1 102 80 VAL . 4384 1 103 81 ILE . 4384 1 104 82 ALA . 4384 1 105 83 ALA . 4384 1 106 84 ALA . 4384 1 107 85 THR . 4384 1 108 86 ARG . 4384 1 109 87 ASP . 4384 1 110 88 PRO . 4384 1 111 89 ARG . 4384 1 112 90 HIS . 4384 1 113 91 PRO . 4384 1 114 92 ALA . 4384 1 115 93 ASN . 4384 1 116 94 GLY . 4384 1 117 95 GLN . 4384 1 118 96 GLY . 4384 1 119 97 ARG . 4384 1 120 98 GLY . 4384 1 121 99 GLU . 4384 1 122 100 ARG . 4384 1 123 101 THR . 4384 1 124 102 ASN . 4384 1 125 103 LEU . 4384 1 126 104 ASP . 4384 1 127 105 ARG . 4384 1 128 106 LEU . 4384 1 129 107 LYS . 4384 1 130 108 GLY . 4384 1 131 109 LEU . 4384 1 132 110 ALA . 4384 1 133 111 ASP . 4384 1 134 112 GLY . 4384 1 135 113 MET . 4384 1 136 114 VAL . 4384 1 137 115 GLY . 4384 1 138 116 ASN . 4384 1 139 117 PRO . 4384 1 140 118 GLN . 4384 1 141 119 GLY . 4384 1 142 120 GLN . 4384 1 143 121 ALA . 4384 1 144 122 ALA . 4384 1 145 123 LEU . 4384 1 146 124 LEU . 4384 1 147 125 ARG . 4384 1 148 126 PRO . 4384 1 149 127 GLY . 4384 1 150 128 GLU . 4384 1 151 129 LEU . 4384 1 152 130 VAL . 4384 1 153 131 ALA . 4384 1 154 132 ILE . 4384 1 155 133 THR . 4384 1 156 134 ALA . 4384 1 157 135 SER . 4384 1 158 136 ALA . 4384 1 159 137 LEU . 4384 1 160 138 GLN . 4384 1 161 139 ALA . 4384 1 162 140 PHE . 4384 1 163 141 ARG . 4384 1 164 142 GLU . 4384 1 165 143 VAL . 4384 1 166 144 ALA . 4384 1 167 145 ARG . 4384 1 168 146 LEU . 4384 1 169 147 ALA . 4384 1 170 148 GLU . 4384 1 171 149 PRO . 4384 1 172 150 ALA . 4384 1 173 151 GLY . 4384 1 174 152 PRO . 4384 1 175 153 TRP . 4384 1 176 154 ALA . 4384 1 177 155 ASP . 4384 1 178 156 ILE . 4384 1 179 157 THR . 4384 1 180 158 GLN . 4384 1 181 159 GLY . 4384 1 182 160 PRO . 4384 1 183 161 SER . 4384 1 184 162 GLU . 4384 1 185 163 SER . 4384 1 186 164 PHE . 4384 1 187 165 VAL . 4384 1 188 166 ASP . 4384 1 189 167 PHE . 4384 1 190 168 ALA . 4384 1 191 169 ASN . 4384 1 192 170 ARG . 4384 1 193 171 LEU . 4384 1 194 172 ILE . 4384 1 195 173 LYS . 4384 1 196 174 ALA . 4384 1 197 175 VAL . 4384 1 198 176 GLU . 4384 1 199 177 GLY . 4384 1 200 178 SER . 4384 1 201 179 ASP . 4384 1 202 180 LEU . 4384 1 203 181 PRO . 4384 1 204 182 PRO . 4384 1 205 183 SER . 4384 1 206 184 ALA . 4384 1 207 185 ARG . 4384 1 208 186 ALA . 4384 1 209 187 PRO . 4384 1 210 188 VAL . 4384 1 211 189 ILE . 4384 1 212 190 ILE . 4384 1 213 191 ASP . 4384 1 214 192 CYS . 4384 1 215 193 PHE . 4384 1 216 194 ARG . 4384 1 217 195 GLN . 4384 1 218 196 LYS . 4384 1 219 197 SER . 4384 1 220 198 GLN . 4384 1 221 199 PRO . 4384 1 222 200 ASP . 4384 1 223 201 ILE . 4384 1 224 202 GLN . 4384 1 225 203 GLN . 4384 1 226 204 LEU . 4384 1 227 205 ILE . 4384 1 228 206 ARG . 4384 1 229 207 ALA . 4384 1 230 208 ALA . 4384 1 231 209 PRO . 4384 1 232 210 SER . 4384 1 233 211 THR . 4384 1 234 212 LEU . 4384 1 235 213 THR . 4384 1 236 214 THR . 4384 1 237 215 PRO . 4384 1 238 216 GLY . 4384 1 239 217 GLU . 4384 1 240 218 ILE . 4384 1 241 219 ILE . 4384 1 242 220 LYS . 4384 1 243 221 TYR . 4384 1 244 222 VAL . 4384 1 245 223 LEU . 4384 1 246 224 ASP . 4384 1 247 225 ARG . 4384 1 248 226 GLN . 4384 1 249 227 LYS . 4384 1 250 228 ILE . 4384 1 251 229 ALA . 4384 1 252 230 PRO . 4384 1 253 231 LEU . 4384 1 254 232 THR . 4384 1 255 233 ASP . 4384 1 256 234 GLN . 4384 1 257 235 GLY . 4384 1 258 236 ILE . 4384 1 259 237 ALA . 4384 1 260 238 ALA . 4384 1 261 239 ALA . 4384 1 262 240 MET . 4384 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 4384 1 . HIS 2 2 4384 1 . HIS 3 3 4384 1 . HIS 4 4 4384 1 . HIS 5 5 4384 1 . HIS 6 6 4384 1 . HIS 7 7 4384 1 . HIS 8 8 4384 1 . HIS 9 9 4384 1 . HIS 10 10 4384 1 . HIS 11 11 4384 1 . SER 12 12 4384 1 . SER 13 13 4384 1 . GLY 14 14 4384 1 . HIS 15 15 4384 1 . ILE 16 16 4384 1 . GLU 17 17 4384 1 . GLY 18 18 4384 1 . ARG 19 19 4384 1 . HIS 20 20 4384 1 . ASN 21 21 4384 1 . MET 22 22 4384 1 . PRO 23 23 4384 1 . VAL 24 24 4384 1 . VAL 25 25 4384 1 . ILE 26 26 4384 1 . LYS 27 27 4384 1 . THR 28 28 4384 1 . GLU 29 29 4384 1 . GLY 30 30 4384 1 . PRO 31 31 4384 1 . ALA 32 32 4384 1 . TRP 33 33 4384 1 . THR 34 34 4384 1 . PRO 35 35 4384 1 . LEU 36 36 4384 1 . GLU 37 37 4384 1 . PRO 38 38 4384 1 . LYS 39 39 4384 1 . LEU 40 40 4384 1 . ILE 41 41 4384 1 . THR 42 42 4384 1 . ARG 43 43 4384 1 . LEU 44 44 4384 1 . ALA 45 45 4384 1 . ASP 46 46 4384 1 . THR 47 47 4384 1 . VAL 48 48 4384 1 . ARG 49 49 4384 1 . THR 50 50 4384 1 . LYS 51 51 4384 1 . GLY 52 52 4384 1 . LEU 53 53 4384 1 . ARG 54 54 4384 1 . SER 55 55 4384 1 . PRO 56 56 4384 1 . ILE 57 57 4384 1 . THR 58 58 4384 1 . MET 59 59 4384 1 . ALA 60 60 4384 1 . GLU 61 61 4384 1 . VAL 62 62 4384 1 . GLU 63 63 4384 1 . ALA 64 64 4384 1 . LEU 65 65 4384 1 . MET 66 66 4384 1 . SER 67 67 4384 1 . SER 68 68 4384 1 . PRO 69 69 4384 1 . LEU 70 70 4384 1 . LEU 71 71 4384 1 . PRO 72 72 4384 1 . HIS 73 73 4384 1 . ASP 74 74 4384 1 . VAL 75 75 4384 1 . THR 76 76 4384 1 . ASN 77 77 4384 1 . LEU 78 78 4384 1 . MET 79 79 4384 1 . ARG 80 80 4384 1 . VAL 81 81 4384 1 . ILE 82 82 4384 1 . LEU 83 83 4384 1 . GLY 84 84 4384 1 . PRO 85 85 4384 1 . ALA 86 86 4384 1 . PRO 87 87 4384 1 . TYR 88 88 4384 1 . ALA 89 89 4384 1 . LEU 90 90 4384 1 . TRP 91 91 4384 1 . MET 92 92 4384 1 . ASP 93 93 4384 1 . ALA 94 94 4384 1 . TRP 95 95 4384 1 . GLY 96 96 4384 1 . VAL 97 97 4384 1 . GLN 98 98 4384 1 . LEU 99 99 4384 1 . GLN 100 100 4384 1 . THR 101 101 4384 1 . VAL 102 102 4384 1 . ILE 103 103 4384 1 . ALA 104 104 4384 1 . ALA 105 105 4384 1 . ALA 106 106 4384 1 . THR 107 107 4384 1 . ARG 108 108 4384 1 . ASP 109 109 4384 1 . PRO 110 110 4384 1 . ARG 111 111 4384 1 . HIS 112 112 4384 1 . PRO 113 113 4384 1 . ALA 114 114 4384 1 . ASN 115 115 4384 1 . GLY 116 116 4384 1 . GLN 117 117 4384 1 . GLY 118 118 4384 1 . ARG 119 119 4384 1 . GLY 120 120 4384 1 . GLU 121 121 4384 1 . ARG 122 122 4384 1 . THR 123 123 4384 1 . ASN 124 124 4384 1 . LEU 125 125 4384 1 . ASP 126 126 4384 1 . ARG 127 127 4384 1 . LEU 128 128 4384 1 . LYS 129 129 4384 1 . GLY 130 130 4384 1 . LEU 131 131 4384 1 . ALA 132 132 4384 1 . ASP 133 133 4384 1 . GLY 134 134 4384 1 . MET 135 135 4384 1 . VAL 136 136 4384 1 . GLY 137 137 4384 1 . ASN 138 138 4384 1 . PRO 139 139 4384 1 . GLN 140 140 4384 1 . GLY 141 141 4384 1 . GLN 142 142 4384 1 . ALA 143 143 4384 1 . ALA 144 144 4384 1 . LEU 145 145 4384 1 . LEU 146 146 4384 1 . ARG 147 147 4384 1 . PRO 148 148 4384 1 . GLY 149 149 4384 1 . GLU 150 150 4384 1 . LEU 151 151 4384 1 . VAL 152 152 4384 1 . ALA 153 153 4384 1 . ILE 154 154 4384 1 . THR 155 155 4384 1 . ALA 156 156 4384 1 . SER 157 157 4384 1 . ALA 158 158 4384 1 . LEU 159 159 4384 1 . GLN 160 160 4384 1 . ALA 161 161 4384 1 . PHE 162 162 4384 1 . ARG 163 163 4384 1 . GLU 164 164 4384 1 . VAL 165 165 4384 1 . ALA 166 166 4384 1 . ARG 167 167 4384 1 . LEU 168 168 4384 1 . ALA 169 169 4384 1 . GLU 170 170 4384 1 . PRO 171 171 4384 1 . ALA 172 172 4384 1 . GLY 173 173 4384 1 . PRO 174 174 4384 1 . TRP 175 175 4384 1 . ALA 176 176 4384 1 . ASP 177 177 4384 1 . ILE 178 178 4384 1 . THR 179 179 4384 1 . GLN 180 180 4384 1 . GLY 181 181 4384 1 . PRO 182 182 4384 1 . SER 183 183 4384 1 . GLU 184 184 4384 1 . SER 185 185 4384 1 . PHE 186 186 4384 1 . VAL 187 187 4384 1 . ASP 188 188 4384 1 . PHE 189 189 4384 1 . ALA 190 190 4384 1 . ASN 191 191 4384 1 . ARG 192 192 4384 1 . LEU 193 193 4384 1 . ILE 194 194 4384 1 . LYS 195 195 4384 1 . ALA 196 196 4384 1 . VAL 197 197 4384 1 . GLU 198 198 4384 1 . GLY 199 199 4384 1 . SER 200 200 4384 1 . ASP 201 201 4384 1 . LEU 202 202 4384 1 . PRO 203 203 4384 1 . PRO 204 204 4384 1 . SER 205 205 4384 1 . ALA 206 206 4384 1 . ARG 207 207 4384 1 . ALA 208 208 4384 1 . PRO 209 209 4384 1 . VAL 210 210 4384 1 . ILE 211 211 4384 1 . ILE 212 212 4384 1 . ASP 213 213 4384 1 . CYS 214 214 4384 1 . PHE 215 215 4384 1 . ARG 216 216 4384 1 . GLN 217 217 4384 1 . LYS 218 218 4384 1 . SER 219 219 4384 1 . GLN 220 220 4384 1 . PRO 221 221 4384 1 . ASP 222 222 4384 1 . ILE 223 223 4384 1 . GLN 224 224 4384 1 . GLN 225 225 4384 1 . LEU 226 226 4384 1 . ILE 227 227 4384 1 . ARG 228 228 4384 1 . ALA 229 229 4384 1 . ALA 230 230 4384 1 . PRO 231 231 4384 1 . SER 232 232 4384 1 . THR 233 233 4384 1 . LEU 234 234 4384 1 . THR 235 235 4384 1 . THR 236 236 4384 1 . PRO 237 237 4384 1 . GLY 238 238 4384 1 . GLU 239 239 4384 1 . ILE 240 240 4384 1 . ILE 241 241 4384 1 . LYS 242 242 4384 1 . TYR 243 243 4384 1 . VAL 244 244 4384 1 . LEU 245 245 4384 1 . ASP 246 246 4384 1 . ARG 247 247 4384 1 . GLN 248 248 4384 1 . LYS 249 249 4384 1 . ILE 250 250 4384 1 . ALA 251 251 4384 1 . PRO 252 252 4384 1 . LEU 253 253 4384 1 . THR 254 254 4384 1 . ASP 255 255 4384 1 . GLN 256 256 4384 1 . GLY 257 257 4384 1 . ILE 258 258 4384 1 . ALA 259 259 4384 1 . ALA 260 260 4384 1 . ALA 261 261 4384 1 . MET 262 262 4384 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 4384 _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 $CA_RSV . 11889 . . 'Avian type C retroviruses Rous Sarcoma Virus' 'Rous Sarcoma Virus' RSV 61.0.3.0.007 . . 'Avian type C retroviruses' 'Rous Sarcoma Virus' . . . . . . . . ATCC45000 . . . . . . . . . 'CA_RSV is a recombinant protein overexpressed in E. coli (see molecular system description).' . . 4384 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 4384 _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 $CA_RSV . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli 'HMS174(DE3) pLysS' . . . . . . . . . . . . plasmid . . pET16b . Novagen . ATCC45000 . . 4384 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 4384 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Samples were either in 90%H2O/10%D2O or in 100%D2O, 1 mM protein concentration, 10 mM phosphate pH 6.0, 0.2 mM N3Na, 0.1 mM EDTA, 0.1 mM PMSF, 1 mg/L pepstatin A, and 5 mM beta-mercaptoethanol. ; _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Capsid protein from RSV' '[U-13C; U-15N]' . . 1 $CA_RSV . . 1.0 . . mM . . . . 4384 1 2 H2O . . . . . . . . 0 90 % . . . . 4384 1 3 D2O . . . . . . . . 10 100 % . . . . 4384 1 4 phosphate . . . . . . . 10 . . mM . . . . 4384 1 5 N3Na . . . . . . . 0.2 . . mM . . . . 4384 1 6 EDTA . . . . . . . 0.1 . . mM . . . . 4384 1 7 PMSF . . . . . . . 0.1 . . mM . . . . 4384 1 8 'pepstatin A' . . . . . . . 1 . . mg/L . . . . 4384 1 9 beta-mercaptoethanol . . . . . . . 5 . . mM . . . . 4384 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 4384 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Samples were either in 90%H2O/10%D2O or in 100%D2O, 1 mM protein concentration, 10 mM phosphate pH 6.0, 0.2 mM N3Na, 0.1 mM EDTA, 0.1 mM PMSF, 1 mg/L pepstatin A, and 5 mM beta-mercaptoethanol. ; _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Capsid protein from RSV' [U-15N] . . 1 $CA_RSV . . 1.0 . . mM . . . . 4384 2 2 H2O . . . . . . . . 0 90 % . . . . 4384 2 3 D2O . . . . . . . . 10 100 % . . . . 4384 2 4 phosphate . . . . . . . 10 . . mM . . . . 4384 2 5 N3Na . . . . . . . 0.2 . . mM . . . . 4384 2 6 EDTA . . . . . . . 0.1 . . mM . . . . 4384 2 7 PMSF . . . . . . . 0.1 . . mM . . . . 4384 2 8 'pepstatin A' . . . . . . . 1 . . mg/L . . . . 4384 2 9 beta-mercaptoethanol . . . . . . . 5 . . mM . . . . 4384 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 4384 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Samples were either in 90%H2O/10%D2O or in 100%D2O, 1 mM protein concentration, 10 mM phosphate pH 6.0, 0.2 mM N3Na, 0.1 mM EDTA, 0.1 mM PMSF, 1 mg/L pepstatin A, and 5 mM beta-mercaptoethanol. ; _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Capsid protein from RSV' '[U-80% 2H; U-13C; U-15N]' . . 1 $CA_RSV . . 1.0 . . mM . . . . 4384 3 2 H2O . . . . . . . . 0 90 % . . . . 4384 3 3 D2O . . . . . . . . 10 100 % . . . . 4384 3 4 phosphate . . . . . . . 10 . . mM . . . . 4384 3 5 N3Na . . . . . . . 0.2 . . mM . . . . 4384 3 6 EDTA . . . . . . . 0.1 . . mM . . . . 4384 3 7 PMSF . . . . . . . 0.1 . . mM . . . . 4384 3 8 'pepstatin A' . . . . . . . 1 . . mg/L . . . . 4384 3 9 beta-mercaptoethanol . . . . . . . 5 . . mM . . . . 4384 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 4384 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Samples were either in 90%H2O/10%D2O or in 100%D2O, 1 mM protein concentration, 10 mM phosphate pH 6.0, 0.2 mM N3Na, 0.1 mM EDTA, 0.1 mM PMSF, 1 mg/L pepstatin A, and 5 mM beta-mercaptoethanol. ; _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Capsid protein from RSV' '[U-80% 2H; U-15N]' . . 1 $CA_RSV . . 1.0 . . mM . . . . 4384 4 2 H2O . . . . . . . . 0 90 % . . . . 4384 4 3 D2O . . . . . . . . 10 100 % . . . . 4384 4 4 phosphate . . . . . . . 10 . . mM . . . . 4384 4 5 N3Na . . . . . . . 0.2 . . mM . . . . 4384 4 6 EDTA . . . . . . . 0.1 . . mM . . . . 4384 4 7 PMSF . . . . . . . 0.1 . . mM . . . . 4384 4 8 'pepstatin A' . . . . . . . 1 . . mg/L . . . . 4384 4 9 beta-mercaptoethanol . . . . . . . 5 . . mM . . . . 4384 4 stop_ save_ save_sample_5 _Sample.Sf_category sample _Sample.Sf_framecode sample_5 _Sample.Entry_ID 4384 _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Samples were either in 90%H2O/10%D2O or in 100%D2O, 1 mM protein concentration, 10 mM phosphate pH 6.0, 0.2 mM N3Na, 0.1 mM EDTA, 0.1 mM PMSF, 1 mg/L pepstatin A, and 5 mM beta-mercaptoethanol. ; _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Capsid protein from RSV' [U-15N]-V . . 1 $CA_RSV . . 1.0 . . mM . . . . 4384 5 2 H2O . . . . . . . . 0 90 % . . . . 4384 5 3 D2O . . . . . . . . 10 100 % . . . . 4384 5 4 phosphate . . . . . . . 10 . . mM . . . . 4384 5 5 N3Na . . . . . . . 0.2 . . mM . . . . 4384 5 6 EDTA . . . . . . . 0.1 . . mM . . . . 4384 5 7 PMSF . . . . . . . 0.1 . . mM . . . . 4384 5 8 'pepstatin A' . . . . . . . 1 . . mg/L . . . . 4384 5 9 beta-mercaptoethanol . . . . . . . 5 . . mM . . . . 4384 5 stop_ save_ save_sample_6 _Sample.Sf_category sample _Sample.Sf_framecode sample_6 _Sample.Entry_ID 4384 _Sample.ID 6 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Samples were either in 90%H2O/10%D2O or in 100%D2O, 1 mM protein concentration, 10 mM phosphate pH 6.0, 0.2 mM N3Na, 0.1 mM EDTA, 0.1 mM PMSF, 1 mg/L pepstatin A, and 5 mM beta-mercaptoethanol. ; _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Capsid protein from RSV' [U-15N]-L . . 1 $CA_RSV . . 1.0 . . mM . . . . 4384 6 2 H2O . . . . . . . . 0 90 % . . . . 4384 6 3 D2O . . . . . . . . 10 100 % . . . . 4384 6 4 phosphate . . . . . . . 10 . . mM . . . . 4384 6 5 N3Na . . . . . . . 0.2 . . mM . . . . 4384 6 6 EDTA . . . . . . . 0.1 . . mM . . . . 4384 6 7 PMSF . . . . . . . 0.1 . . mM . . . . 4384 6 8 'pepstatin A' . . . . . . . 1 . . mg/L . . . . 4384 6 9 beta-mercaptoethanol . . . . . . . 5 . . mM . . . . 4384 6 stop_ save_ save_sample_7 _Sample.Sf_category sample _Sample.Sf_framecode sample_7 _Sample.Entry_ID 4384 _Sample.ID 7 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Samples were either in 90%H2O/10%D2O or in 100%D2O, 1 mM protein concentration, 10 mM phosphate pH 6.0, 0.2 mM N3Na, 0.1 mM EDTA, 0.1 mM PMSF, 1 mg/L pepstatin A, and 5 mM beta-mercaptoethanol. ; _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Capsid protein from RSV' [U-15N]-I . . 1 $CA_RSV . . 1.0 . . mM . . . . 4384 7 2 H2O . . . . . . . . 0 90 % . . . . 4384 7 3 D2O . . . . . . . . 10 100 % . . . . 4384 7 4 phosphate . . . . . . . 10 . . mM . . . . 4384 7 5 N3Na . . . . . . . 0.2 . . mM . . . . 4384 7 6 EDTA . . . . . . . 0.1 . . mM . . . . 4384 7 7 PMSF . . . . . . . 0.1 . . mM . . . . 4384 7 8 'pepstatin A' . . . . . . . 1 . . mg/L . . . . 4384 7 9 beta-mercaptoethanol . . . . . . . 5 . . mM . . . . 4384 7 stop_ save_ save_sample_8 _Sample.Sf_category sample _Sample.Sf_framecode sample_8 _Sample.Entry_ID 4384 _Sample.ID 8 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Samples were either in 90%H2O/10%D2O or in 100%D2O, 1 mM protein concentration, 10 mM phosphate pH 6.0, 0.2 mM N3Na, 0.1 mM EDTA, 0.1 mM PMSF, 1 mg/L pepstatin A, and 5 mM beta-mercaptoethanol. ; _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Capsid protein from RSV' [U-15N]-D,N,E,Q,S,F,Y,W,C . . 1 $CA_RSV . . 1.0 . . mM . . . . 4384 8 2 H2O . . . . . . . . 0 90 % . . . . 4384 8 3 D2O . . . . . . . . 10 100 % . . . . 4384 8 4 phosphate . . . . . . . 10 . . mM . . . . 4384 8 5 N3Na . . . . . . . 0.2 . . mM . . . . 4384 8 6 EDTA . . . . . . . 0.1 . . mM . . . . 4384 8 7 PMSF . . . . . . . 0.1 . . mM . . . . 4384 8 8 'pepstatin A' . . . . . . . 1 . . mg/L . . . . 4384 8 9 beta-mercaptoethanol . . . . . . . 5 . . mM . . . . 4384 8 stop_ save_ save_sample_9 _Sample.Sf_category sample _Sample.Sf_framecode sample_9 _Sample.Entry_ID 4384 _Sample.ID 9 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Samples were either in 90%H2O/10%D2O or in 100%D2O, 1 mM protein concentration, 10 mM phosphate pH 6.0, 0.2 mM N3Na, 0.1 mM EDTA, 0.1 mM PMSF, 1 mg/L pepstatin A, and 5 mM beta-mercaptoethanol. ; _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Capsid protein from RSV' '[U-10% 13C; U-15N]' . . 1 $CA_RSV . . 1.0 . . mM . . . . 4384 9 2 H2O . . . . . . . . 0 90 % . . . . 4384 9 3 D2O . . . . . . . . 10 100 % . . . . 4384 9 4 phosphate . . . . . . . 10 . . mM . . . . 4384 9 5 N3Na . . . . . . . 0.2 . . mM . . . . 4384 9 6 EDTA . . . . . . . 0.1 . . mM . . . . 4384 9 7 PMSF . . . . . . . 0.1 . . mM . . . . 4384 9 8 'pepstatin A' . . . . . . . 1 . . mg/L . . . . 4384 9 9 beta-mercaptoethanol . . . . . . . 5 . . mM . . . . 4384 9 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions _Sample_condition_list.Entry_ID 4384 _Sample_condition_list.ID 1 _Sample_condition_list.Details ; Samples were either in 90%H2O/10%D2O or in 100%D2O, ~1 mM protein concentration, 10 mM phosphate pH 6.0, 0.2 mM N3Na, 0.1 mM EDTA, 0.1 mM PMSF, 1 mg/L pepstatin A, and 5 mM beta-mercaptoethanol. ; loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.0 0.1 n/a 4384 1 temperature 303 0.5 K 4384 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 4384 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 4384 _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 NMR_spectrometer Bruker DRX . 800 . . . 4384 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 4384 _Experiment_list.ID 1 _Experiment_list.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 4384 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; 1H is referenced directly by assigning to the detected H2O signal (at 303K) a value of 4.725167 ppm. 13C and 15N shifts are referenced indirectly to 1H. The errors in the chemical shift of a particular atom are upper limit estimates from the spectral resolution in the spectrum where the corresponding signal was assigned. H and N are obtained from HSQC, C' from HNCO, and aliphatic/aromatic H and C from 4D-C,C-NOESY. ; 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 0.0 . indirect . . . . . . . 0.251449530 . . 4384 1 H 1 H2O proton . . . . ppm 4.725167 internal direct . . . . . . . . . . 4384 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect . . . . . . . 0.101329118 . . 4384 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_chemical_shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts _Assigned_chem_shift_list.Entry_ID 4384 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details ; Backbone assignments were obtained using data recorded on both protonated and deuterated protein. This entry contains only the chemical shifts of the protonated sample. 1HN and 15N shifts are obtained from the 1H-15N HSQC, aliphatic and aromatic 1H and 13C shifts are from two different 1H-13C HMQC spectra optimized for each region, and CO shifts are determined from the HNCO spectra. The native sequence is numbered with "Residue Seq_code" from 1 to 240. "Residue Seq_code" from -22 to -1 are used to identify the non-native, N-terminal extension, from N to C termini. ; _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 4384 1 . . 2 $sample_2 . 4384 1 . . 3 $sample_3 . 4384 1 . . 4 $sample_4 . 4384 1 . . 5 $sample_5 . 4384 1 . . 6 $sample_6 . 4384 1 . . 7 $sample_7 . 4384 1 . . 8 $sample_8 . 4384 1 . . 9 $sample_9 . 4384 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 11 11 HIS CA C 13 55.89 0.20 . 1 . . . . . . . . 4384 1 2 . 1 1 11 11 HIS HA H 1 4.58 0.08 . 1 . . . . . . . . 4384 1 3 . 1 1 11 11 HIS CB C 13 30.18 0.20 . 1 . . . . . . . . 4384 1 4 . 1 1 11 11 HIS HB3 H 1 2.99 0.08 . 2 . . . . . . . . 4384 1 5 . 1 1 11 11 HIS HB2 H 1 3.07 0.08 . 2 . . . . . . . . 4384 1 6 . 1 1 11 11 HIS CD2 C 13 119.74 0.20 . 1 . . . . . . . . 4384 1 7 . 1 1 11 11 HIS HD2 H 1 7.04 0.08 . 2 . . . . . . . . 4384 1 8 . 1 1 11 11 HIS CE1 C 13 137.33 0.20 . 1 . . . . . . . . 4384 1 9 . 1 1 11 11 HIS HE1 H 1 8.16 0.08 . 1 . . . . . . . . 4384 1 10 . 1 1 12 12 SER CA C 13 58.64 0.20 . 1 . . . . . . . . 4384 1 11 . 1 1 12 12 SER HA H 1 4.46 0.08 . 1 . . . . . . . . 4384 1 12 . 1 1 12 12 SER CB C 13 63.78 0.20 . 1 . . . . . . . . 4384 1 13 . 1 1 12 12 SER HB3 H 1 3.88 0.08 . 2 . . . . . . . . 4384 1 14 . 1 1 12 12 SER HB2 H 1 4.08 0.08 . 2 . . . . . . . . 4384 1 15 . 1 1 13 13 SER CA C 13 58.41 0.20 . 1 . . . . . . . . 4384 1 16 . 1 1 13 13 SER HA H 1 4.47 0.08 . 1 . . . . . . . . 4384 1 17 . 1 1 14 14 GLY CA C 13 45.33 0.20 . 1 . . . . . . . . 4384 1 18 . 1 1 14 14 GLY HA2 H 1 3.92 0.08 . 2 . . . . . . . . 4384 1 19 . 1 1 15 15 HIS C C 13 179.38 0.05 . 1 . . . . . . . . 4384 1 20 . 1 1 16 16 ILE N N 15 122.93 0.05 . 1 . . . . . . . . 4384 1 21 . 1 1 16 16 ILE H H 1 8.21 0.02 . 1 . . . . . . . . 4384 1 22 . 1 1 16 16 ILE CA C 13 61.08 0.20 . 1 . . . . . . . . 4384 1 23 . 1 1 16 16 ILE HA H 1 4.11 0.08 . 1 . . . . . . . . 4384 1 24 . 1 1 16 16 ILE CB C 13 38.94 0.20 . 1 . . . . . . . . 4384 1 25 . 1 1 16 16 ILE HB H 1 1.78 0.08 . 1 . . . . . . . . 4384 1 26 . 1 1 16 16 ILE CG1 C 13 27.41 0.20 . 1 . . . . . . . . 4384 1 27 . 1 1 16 16 ILE HG13 H 1 1.10 0.08 . 2 . . . . . . . . 4384 1 28 . 1 1 16 16 ILE HG12 H 1 1.39 0.08 . 2 . . . . . . . . 4384 1 29 . 1 1 16 16 ILE CG2 C 13 17.71 0.20 . 1 . . . . . . . . 4384 1 30 . 1 1 16 16 ILE HG21 H 1 0.84 0.08 . 1 . . . . . . . . 4384 1 31 . 1 1 16 16 ILE HG22 H 1 0.84 0.08 . 1 . . . . . . . . 4384 1 32 . 1 1 16 16 ILE HG23 H 1 0.84 0.08 . 1 . . . . . . . . 4384 1 33 . 1 1 16 16 ILE C C 13 176.03 0.05 . 1 . . . . . . . . 4384 1 34 . 1 1 17 17 GLU N N 15 125.56 0.05 . 1 . . . . . . . . 4384 1 35 . 1 1 17 17 GLU H H 1 8.55 0.02 . 1 . . . . . . . . 4384 1 36 . 1 1 17 17 GLU CA C 13 56.89 0.20 . 1 . . . . . . . . 4384 1 37 . 1 1 17 17 GLU HA H 1 4.26 0.08 . 1 . . . . . . . . 4384 1 38 . 1 1 17 17 GLU CB C 13 30.37 0.20 . 1 . . . . . . . . 4384 1 39 . 1 1 17 17 GLU HB3 H 1 1.94 0.08 . 2 . . . . . . . . 4384 1 40 . 1 1 17 17 GLU HB2 H 1 2.04 0.08 . 2 . . . . . . . . 4384 1 41 . 1 1 17 17 GLU C C 13 177.03 0.05 . 1 . . . . . . . . 4384 1 42 . 1 1 18 18 GLY N N 15 110.33 0.05 . 1 . . . . . . . . 4384 1 43 . 1 1 18 18 GLY H H 1 8.42 0.02 . 1 . . . . . . . . 4384 1 44 . 1 1 18 18 GLY CA C 13 45.40 0.20 . 1 . . . . . . . . 4384 1 45 . 1 1 18 18 GLY HA2 H 1 3.94 0.08 . 2 . . . . . . . . 4384 1 46 . 1 1 18 18 GLY C C 13 179.47 0.05 . 1 . . . . . . . . 4384 1 47 . 1 1 19 19 ARG N N 15 120.21 0.05 . 1 . . . . . . . . 4384 1 48 . 1 1 19 19 ARG H H 1 8.11 0.02 . 1 . . . . . . . . 4384 1 49 . 1 1 19 19 ARG CA C 13 56.22 0.20 . 1 . . . . . . . . 4384 1 50 . 1 1 19 19 ARG HA H 1 4.28 0.08 . 1 . . . . . . . . 4384 1 51 . 1 1 21 21 ASN CA C 13 53.23 0.20 . 1 . . . . . . . . 4384 1 52 . 1 1 21 21 ASN HA H 1 4.66 0.08 . 1 . . . . . . . . 4384 1 53 . 1 1 21 21 ASN CB C 13 38.87 0.20 . 1 . . . . . . . . 4384 1 54 . 1 1 21 21 ASN HB3 H 1 2.68 0.08 . 2 . . . . . . . . 4384 1 55 . 1 1 21 21 ASN HB2 H 1 2.79 0.08 . 2 . . . . . . . . 4384 1 56 . 1 1 21 21 ASN CG C 13 177.24 0.20 . 1 . . . . . . . . 4384 1 57 . 1 1 21 21 ASN ND2 N 15 112.59 0.05 . 1 . . . . . . . . 4384 1 58 . 1 1 21 21 ASN HD21 H 1 7.54 0.02 . 1 . . . . . . . . 4384 1 59 . 1 1 21 21 ASN HD22 H 1 6.85 0.02 . 1 . . . . . . . . 4384 1 60 . 1 1 21 21 ASN C C 13 174.77 0.05 . 1 . . . . . . . . 4384 1 61 . 1 1 22 22 MET N N 15 121.53 0.05 . 1 . . . . . . . . 4384 1 62 . 1 1 22 22 MET H H 1 8.21 0.02 . 1 . . . . . . . . 4384 1 63 . 1 1 22 22 MET CA C 13 53.34 0.20 . 1 . . . . . . . . 4384 1 64 . 1 1 22 22 MET HA H 1 4.79 0.08 . 1 . . . . . . . . 4384 1 65 . 1 1 22 22 MET CB C 13 32.70 0.20 . 1 . . . . . . . . 4384 1 66 . 1 1 22 22 MET HB3 H 1 1.94 0.08 . 2 . . . . . . . . 4384 1 67 . 1 1 22 22 MET HB2 H 1 2.07 0.08 . 2 . . . . . . . . 4384 1 68 . 1 1 22 22 MET CG C 13 32.50 0.20 . 1 . . . . . . . . 4384 1 69 . 1 1 22 22 MET HG3 H 1 2.50 0.08 . 2 . . . . . . . . 4384 1 70 . 1 1 22 22 MET HG2 H 1 2.55 0.08 . 2 . . . . . . . . 4384 1 71 . 1 1 23 23 PRO HA H 1 4.442 0.08 . 1 . . . . . . . . 4384 1 72 . 1 1 23 23 PRO CA C 13 63.101 0.20 . 1 . . . . . . . . 4384 1 73 . 1 1 23 23 PRO CB C 13 32.222 0.20 . 1 . . . . . . . . 4384 1 74 . 1 1 23 23 PRO HB3 H 1 1.876 0.08 . 2 . . . . . . . . 4384 1 75 . 1 1 23 23 PRO HB2 H 1 2.279 0.08 . 2 . . . . . . . . 4384 1 76 . 1 1 23 23 PRO CG C 13 27.530 0.20 . 1 . . . . . . . . 4384 1 77 . 1 1 23 23 PRO HG2 H 1 2.012 0.08 . 2 . . . . . . . . 4384 1 78 . 1 1 23 23 PRO CD C 13 50.597 0.20 . 1 . . . . . . . . 4384 1 79 . 1 1 23 23 PRO HD3 H 1 3.649 0.08 . 2 . . . . . . . . 4384 1 80 . 1 1 23 23 PRO HD2 H 1 3.772 0.08 . 2 . . . . . . . . 4384 1 81 . 1 1 23 23 PRO C C 13 176.684 0.05 . 1 . . . . . . . . 4384 1 82 . 1 1 24 24 VAL N N 15 120.847 0.05 . 1 . . . . . . . . 4384 1 83 . 1 1 24 24 VAL H H 1 8.163 0.02 . 1 . . . . . . . . 4384 1 84 . 1 1 24 24 VAL CA C 13 62.350 0.20 . 1 . . . . . . . . 4384 1 85 . 1 1 24 24 VAL HA H 1 4.068 0.08 . 1 . . . . . . . . 4384 1 86 . 1 1 24 24 VAL CB C 13 33.001 0.20 . 1 . . . . . . . . 4384 1 87 . 1 1 24 24 VAL HB H 1 2.006 0.08 . 1 . . . . . . . . 4384 1 88 . 1 1 24 24 VAL CG2 C 13 20.938 0.20 . 1 . . . . . . . . 4384 1 89 . 1 1 24 24 VAL HG21 H 1 0.935 0.08 . 2 . . . . . . . . 4384 1 90 . 1 1 24 24 VAL HG22 H 1 0.935 0.08 . 2 . . . . . . . . 4384 1 91 . 1 1 24 24 VAL HG23 H 1 0.935 0.08 . 2 . . . . . . . . 4384 1 92 . 1 1 24 24 VAL CG1 C 13 21.320 0.20 . 1 . . . . . . . . 4384 1 93 . 1 1 24 24 VAL HG11 H 1 0.889 0.08 . 1 . . . . . . . . 4384 1 94 . 1 1 24 24 VAL HG12 H 1 0.889 0.08 . 1 . . . . . . . . 4384 1 95 . 1 1 24 24 VAL HG13 H 1 0.889 0.08 . 1 . . . . . . . . 4384 1 96 . 1 1 24 24 VAL C C 13 176.145 0.05 . 1 . . . . . . . . 4384 1 97 . 1 1 25 25 VAL N N 15 125.294 0.05 . 1 . . . . . . . . 4384 1 98 . 1 1 25 25 VAL H H 1 8.207 0.02 . 1 . . . . . . . . 4384 1 99 . 1 1 25 25 VAL CA C 13 62.347 0.20 . 1 . . . . . . . . 4384 1 100 . 1 1 25 25 VAL HA H 1 4.066 0.08 . 1 . . . . . . . . 4384 1 101 . 1 1 25 25 VAL CB C 13 32.782 0.20 . 1 . . . . . . . . 4384 1 102 . 1 1 25 25 VAL HB H 1 2.006 0.08 . 1 . . . . . . . . 4384 1 103 . 1 1 25 25 VAL CG2 C 13 20.972 0.20 . 1 . . . . . . . . 4384 1 104 . 1 1 25 25 VAL HG21 H 1 0.940 0.08 . 2 . . . . . . . . 4384 1 105 . 1 1 25 25 VAL HG22 H 1 0.940 0.08 . 2 . . . . . . . . 4384 1 106 . 1 1 25 25 VAL HG23 H 1 0.940 0.08 . 2 . . . . . . . . 4384 1 107 . 1 1 25 25 VAL CG1 C 13 21.378 0.20 . 1 . . . . . . . . 4384 1 108 . 1 1 25 25 VAL HG11 H 1 0.885 0.08 . 1 . . . . . . . . 4384 1 109 . 1 1 25 25 VAL HG12 H 1 0.885 0.08 . 1 . . . . . . . . 4384 1 110 . 1 1 25 25 VAL HG13 H 1 0.885 0.08 . 1 . . . . . . . . 4384 1 111 . 1 1 25 25 VAL C C 13 175.875 0.05 . 1 . . . . . . . . 4384 1 112 . 1 1 26 26 ILE N N 15 126.249 0.05 . 1 . . . . . . . . 4384 1 113 . 1 1 26 26 ILE H H 1 8.283 0.02 . 1 . . . . . . . . 4384 1 114 . 1 1 26 26 ILE CA C 13 60.681 0.20 . 1 . . . . . . . . 4384 1 115 . 1 1 26 26 ILE HA H 1 4.172 0.08 . 1 . . . . . . . . 4384 1 116 . 1 1 26 26 ILE CB C 13 38.778 0.20 . 1 . . . . . . . . 4384 1 117 . 1 1 26 26 ILE HB H 1 1.838 0.08 . 1 . . . . . . . . 4384 1 118 . 1 1 26 26 ILE CG1 C 13 27.425 0.20 . 1 . . . . . . . . 4384 1 119 . 1 1 26 26 ILE HG13 H 1 1.168 0.08 . 2 . . . . . . . . 4384 1 120 . 1 1 26 26 ILE HG12 H 1 1.454 0.08 . 2 . . . . . . . . 4384 1 121 . 1 1 26 26 ILE CD1 C 13 12.858 0.20 . 1 . . . . . . . . 4384 1 122 . 1 1 26 26 ILE HD11 H 1 0.828 0.08 . 1 . . . . . . . . 4384 1 123 . 1 1 26 26 ILE HD12 H 1 0.828 0.08 . 1 . . . . . . . . 4384 1 124 . 1 1 26 26 ILE HD13 H 1 0.828 0.08 . 1 . . . . . . . . 4384 1 125 . 1 1 26 26 ILE CG2 C 13 17.698 0.20 . 1 . . . . . . . . 4384 1 126 . 1 1 26 26 ILE HG21 H 1 0.897 0.08 . 1 . . . . . . . . 4384 1 127 . 1 1 26 26 ILE HG22 H 1 0.897 0.08 . 1 . . . . . . . . 4384 1 128 . 1 1 26 26 ILE HG23 H 1 0.897 0.08 . 1 . . . . . . . . 4384 1 129 . 1 1 26 26 ILE C C 13 176.000 0.05 . 1 . . . . . . . . 4384 1 130 . 1 1 27 27 LYS N N 15 126.603 0.05 . 1 . . . . . . . . 4384 1 131 . 1 1 27 27 LYS H H 1 8.421 0.02 . 1 . . . . . . . . 4384 1 132 . 1 1 27 27 LYS CA C 13 56.168 0.20 . 1 . . . . . . . . 4384 1 133 . 1 1 27 27 LYS HA H 1 4.437 0.08 . 1 . . . . . . . . 4384 1 134 . 1 1 27 27 LYS CB C 13 33.387 0.20 . 1 . . . . . . . . 4384 1 135 . 1 1 27 27 LYS HB3 H 1 1.757 0.08 . 2 . . . . . . . . 4384 1 136 . 1 1 27 27 LYS HB2 H 1 1.860 0.08 . 2 . . . . . . . . 4384 1 137 . 1 1 27 27 LYS CG C 13 24.993 0.20 . 1 . . . . . . . . 4384 1 138 . 1 1 27 27 LYS HG2 H 1 1.403 0.08 . 2 . . . . . . . . 4384 1 139 . 1 1 27 27 LYS CD C 13 29.179 0.20 . 1 . . . . . . . . 4384 1 140 . 1 1 27 27 LYS HD2 H 1 1.687 0.08 . 2 . . . . . . . . 4384 1 141 . 1 1 27 27 LYS CE C 13 42.061 0.20 . 1 . . . . . . . . 4384 1 142 . 1 1 27 27 LYS HE2 H 1 2.986 0.08 . 2 . . . . . . . . 4384 1 143 . 1 1 27 27 LYS C C 13 176.522 0.05 . 1 . . . . . . . . 4384 1 144 . 1 1 28 28 THR N N 15 116.650 0.05 . 1 . . . . . . . . 4384 1 145 . 1 1 28 28 THR H H 1 8.234 0.02 . 1 . . . . . . . . 4384 1 146 . 1 1 28 28 THR CA C 13 61.649 0.20 . 1 . . . . . . . . 4384 1 147 . 1 1 28 28 THR HA H 1 4.354 0.08 . 1 . . . . . . . . 4384 1 148 . 1 1 28 28 THR CB C 13 69.785 0.20 . 1 . . . . . . . . 4384 1 149 . 1 1 28 28 THR HB H 1 4.227 0.08 . 1 . . . . . . . . 4384 1 150 . 1 1 28 28 THR CG2 C 13 21.701 0.20 . 1 . . . . . . . . 4384 1 151 . 1 1 28 28 THR HG21 H 1 1.194 0.08 . 1 . . . . . . . . 4384 1 152 . 1 1 28 28 THR HG22 H 1 1.194 0.08 . 1 . . . . . . . . 4384 1 153 . 1 1 28 28 THR HG23 H 1 1.194 0.08 . 1 . . . . . . . . 4384 1 154 . 1 1 28 28 THR C C 13 174.531 0.05 . 1 . . . . . . . . 4384 1 155 . 1 1 29 29 GLU N N 15 123.323 0.05 . 1 . . . . . . . . 4384 1 156 . 1 1 29 29 GLU H H 1 8.443 0.02 . 1 . . . . . . . . 4384 1 157 . 1 1 29 29 GLU CA C 13 56.333 0.20 . 1 . . . . . . . . 4384 1 158 . 1 1 29 29 GLU HA H 1 4.407 0.08 . 1 . . . . . . . . 4384 1 159 . 1 1 29 29 GLU CB C 13 30.770 0.20 . 1 . . . . . . . . 4384 1 160 . 1 1 29 29 GLU HB3 H 1 1.940 0.08 . 2 . . . . . . . . 4384 1 161 . 1 1 29 29 GLU HB2 H 1 2.100 0.08 . 2 . . . . . . . . 4384 1 162 . 1 1 29 29 GLU CG C 13 36.340 0.20 . 1 . . . . . . . . 4384 1 163 . 1 1 29 29 GLU HG2 H 1 2.275 0.08 . 2 . . . . . . . . 4384 1 164 . 1 1 29 29 GLU C C 13 176.531 0.05 . 1 . . . . . . . . 4384 1 165 . 1 1 30 30 GLY N N 15 110.206 0.05 . 1 . . . . . . . . 4384 1 166 . 1 1 30 30 GLY H H 1 8.241 0.02 . 1 . . . . . . . . 4384 1 167 . 1 1 30 30 GLY CA C 13 44.569 0.20 . 1 . . . . . . . . 4384 1 168 . 1 1 30 30 GLY HA3 H 1 4.062 0.08 . 2 . . . . . . . . 4384 1 169 . 1 1 30 30 GLY HA2 H 1 4.163 0.08 . 2 . . . . . . . . 4384 1 170 . 1 1 30 30 GLY C C 13 171.669 0.05 . 1 . . . . . . . . 4384 1 171 . 1 1 31 31 PRO CA C 13 63.034 0.20 . 1 . . . . . . . . 4384 1 172 . 1 1 31 31 PRO HA H 1 4.440 0.08 . 1 . . . . . . . . 4384 1 173 . 1 1 31 31 PRO CB C 13 32.379 0.20 . 1 . . . . . . . . 4384 1 174 . 1 1 31 31 PRO HB3 H 1 1.864 0.08 . 2 . . . . . . . . 4384 1 175 . 1 1 31 31 PRO HB2 H 1 2.235 0.08 . 2 . . . . . . . . 4384 1 176 . 1 1 31 31 PRO CG C 13 27.298 0.20 . 1 . . . . . . . . 4384 1 177 . 1 1 31 31 PRO HG2 H 1 2.012 0.08 . 2 . . . . . . . . 4384 1 178 . 1 1 31 31 PRO CD C 13 49.893 0.20 . 1 . . . . . . . . 4384 1 179 . 1 1 31 31 PRO HD2 H 1 3.615 0.08 . 2 . . . . . . . . 4384 1 180 . 1 1 31 31 PRO C C 13 176.754 0.05 . 1 . . . . . . . . 4384 1 181 . 1 1 32 32 ALA N N 15 124.325 0.05 . 1 . . . . . . . . 4384 1 182 . 1 1 32 32 ALA H H 1 8.433 0.02 . 1 . . . . . . . . 4384 1 183 . 1 1 32 32 ALA CA C 13 52.325 0.20 . 1 . . . . . . . . 4384 1 184 . 1 1 32 32 ALA HA H 1 4.404 0.08 . 1 . . . . . . . . 4384 1 185 . 1 1 32 32 ALA CB C 13 19.825 0.20 . 1 . . . . . . . . 4384 1 186 . 1 1 32 32 ALA HB1 H 1 1.428 0.08 . 1 . . . . . . . . 4384 1 187 . 1 1 32 32 ALA HB2 H 1 1.428 0.08 . 1 . . . . . . . . 4384 1 188 . 1 1 32 32 ALA HB3 H 1 1.428 0.08 . 1 . . . . . . . . 4384 1 189 . 1 1 32 32 ALA C C 13 177.132 0.05 . 1 . . . . . . . . 4384 1 190 . 1 1 33 33 TRP N N 15 120.390 0.05 . 1 . . . . . . . . 4384 1 191 . 1 1 33 33 TRP H H 1 8.173 0.02 . 1 . . . . . . . . 4384 1 192 . 1 1 33 33 TRP CA C 13 57.142 0.20 . 1 . . . . . . . . 4384 1 193 . 1 1 33 33 TRP HA H 1 4.709 0.08 . 1 . . . . . . . . 4384 1 194 . 1 1 33 33 TRP CB C 13 30.170 0.20 . 1 . . . . . . . . 4384 1 195 . 1 1 33 33 TRP HB2 H 1 3.132 0.08 . 2 . . . . . . . . 4384 1 196 . 1 1 33 33 TRP CD1 C 13 127.411 0.20 . 1 . . . . . . . . 4384 1 197 . 1 1 33 33 TRP HD1 H 1 7.340 0.08 . 2 . . . . . . . . 4384 1 198 . 1 1 33 33 TRP NE1 N 15 133.127 0.05 . 1 . . . . . . . . 4384 1 199 . 1 1 33 33 TRP HE1 H 1 11.347 0.08 . 1 . . . . . . . . 4384 1 200 . 1 1 33 33 TRP CZ2 C 13 114.374 0.20 . 1 . . . . . . . . 4384 1 201 . 1 1 33 33 TRP HZ2 H 1 7.606 0.08 . 1 . . . . . . . . 4384 1 202 . 1 1 33 33 TRP CH2 C 13 123.993 0.20 . 1 . . . . . . . . 4384 1 203 . 1 1 33 33 TRP HH2 H 1 7.147 0.08 . 1 . . . . . . . . 4384 1 204 . 1 1 33 33 TRP CZ3 C 13 120.474 0.20 . 1 . . . . . . . . 4384 1 205 . 1 1 33 33 TRP HZ3 H 1 7.418 0.08 . 1 . . . . . . . . 4384 1 206 . 1 1 33 33 TRP CE3 C 13 121.463 0.20 . 1 . . . . . . . . 4384 1 207 . 1 1 33 33 TRP HE3 H 1 6.992 0.08 . 1 . . . . . . . . 4384 1 208 . 1 1 33 33 TRP C C 13 175.473 0.05 . 1 . . . . . . . . 4384 1 209 . 1 1 34 34 THR N N 15 122.625 0.05 . 1 . . . . . . . . 4384 1 210 . 1 1 34 34 THR H H 1 7.913 0.02 . 1 . . . . . . . . 4384 1 211 . 1 1 34 34 THR CA C 13 58.296 0.20 . 1 . . . . . . . . 4384 1 212 . 1 1 34 34 THR HA H 1 4.169 0.08 . 1 . . . . . . . . 4384 1 213 . 1 1 34 34 THR CB C 13 70.450 0.20 . 1 . . . . . . . . 4384 1 214 . 1 1 34 34 THR HB H 1 3.867 0.08 . 1 . . . . . . . . 4384 1 215 . 1 1 34 34 THR CG2 C 13 21.186 0.20 . 1 . . . . . . . . 4384 1 216 . 1 1 34 34 THR HG21 H 1 1.068 0.08 . 1 . . . . . . . . 4384 1 217 . 1 1 34 34 THR HG22 H 1 1.068 0.08 . 1 . . . . . . . . 4384 1 218 . 1 1 34 34 THR HG23 H 1 1.068 0.08 . 1 . . . . . . . . 4384 1 219 . 1 1 34 34 THR C C 13 173.062 0.05 . 1 . . . . . . . . 4384 1 220 . 1 1 35 35 PRO CA C 13 62.018 0.20 . 1 . . . . . . . . 4384 1 221 . 1 1 35 35 PRO HA H 1 4.236 0.08 . 1 . . . . . . . . 4384 1 222 . 1 1 35 35 PRO CB C 13 32.456 0.20 . 1 . . . . . . . . 4384 1 223 . 1 1 35 35 PRO HB3 H 1 1.769 0.08 . 2 . . . . . . . . 4384 1 224 . 1 1 35 35 PRO HB2 H 1 2.218 0.08 . 2 . . . . . . . . 4384 1 225 . 1 1 35 35 PRO CG C 13 26.583 0.20 . 1 . . . . . . . . 4384 1 226 . 1 1 35 35 PRO HG3 H 1 1.354 0.08 . 2 . . . . . . . . 4384 1 227 . 1 1 35 35 PRO HG2 H 1 1.636 0.08 . 2 . . . . . . . . 4384 1 228 . 1 1 35 35 PRO CD C 13 50.514 0.20 . 1 . . . . . . . . 4384 1 229 . 1 1 35 35 PRO HD3 H 1 2.696 0.08 . 2 . . . . . . . . 4384 1 230 . 1 1 35 35 PRO HD2 H 1 3.302 0.08 . 2 . . . . . . . . 4384 1 231 . 1 1 35 35 PRO C C 13 177.259 0.05 . 1 . . . . . . . . 4384 1 232 . 1 1 36 36 LEU N N 15 123.021 0.05 . 1 . . . . . . . . 4384 1 233 . 1 1 36 36 LEU H H 1 8.487 0.02 . 1 . . . . . . . . 4384 1 234 . 1 1 36 36 LEU CA C 13 54.964 0.20 . 1 . . . . . . . . 4384 1 235 . 1 1 36 36 LEU HA H 1 4.170 0.08 . 1 . . . . . . . . 4384 1 236 . 1 1 36 36 LEU CB C 13 42.701 0.20 . 1 . . . . . . . . 4384 1 237 . 1 1 36 36 LEU HB3 H 1 1.286 0.08 . 2 . . . . . . . . 4384 1 238 . 1 1 36 36 LEU HB2 H 1 1.689 0.08 . 2 . . . . . . . . 4384 1 239 . 1 1 36 36 LEU CG C 13 27.455 0.20 . 1 . . . . . . . . 4384 1 240 . 1 1 36 36 LEU HG H 1 1.752 0.08 . 1 . . . . . . . . 4384 1 241 . 1 1 36 36 LEU CD1 C 13 25.971 0.20 . 1 . . . . . . . . 4384 1 242 . 1 1 36 36 LEU HD11 H 1 0.937 0.08 . 1 . . . . . . . . 4384 1 243 . 1 1 36 36 LEU HD12 H 1 0.937 0.08 . 1 . . . . . . . . 4384 1 244 . 1 1 36 36 LEU HD13 H 1 0.937 0.08 . 1 . . . . . . . . 4384 1 245 . 1 1 36 36 LEU CD2 C 13 24.717 0.20 . 1 . . . . . . . . 4384 1 246 . 1 1 36 36 LEU HD21 H 1 0.922 0.08 . 2 . . . . . . . . 4384 1 247 . 1 1 36 36 LEU HD22 H 1 0.922 0.08 . 2 . . . . . . . . 4384 1 248 . 1 1 36 36 LEU HD23 H 1 0.922 0.08 . 2 . . . . . . . . 4384 1 249 . 1 1 36 36 LEU C C 13 177.049 0.05 . 1 . . . . . . . . 4384 1 250 . 1 1 37 37 GLU N N 15 125.392 0.05 . 1 . . . . . . . . 4384 1 251 . 1 1 37 37 GLU H H 1 8.195 0.02 . 1 . . . . . . . . 4384 1 252 . 1 1 37 37 GLU CA C 13 54.452 0.20 . 1 . . . . . . . . 4384 1 253 . 1 1 37 37 GLU HA H 1 4.378 0.08 . 1 . . . . . . . . 4384 1 254 . 1 1 37 37 GLU CB C 13 30.392 0.20 . 1 . . . . . . . . 4384 1 255 . 1 1 37 37 GLU HB2 H 1 2.059 0.08 . 2 . . . . . . . . 4384 1 256 . 1 1 37 37 GLU CG C 13 36.693 0.20 . 1 . . . . . . . . 4384 1 257 . 1 1 37 37 GLU HG2 H 1 2.366 0.08 . 2 . . . . . . . . 4384 1 258 . 1 1 37 37 GLU C C 13 176.348 0.05 . 1 . . . . . . . . 4384 1 259 . 1 1 38 38 PRO CA C 13 66.042 0.20 . 1 . . . . . . . . 4384 1 260 . 1 1 38 38 PRO HA H 1 4.099 0.08 . 1 . . . . . . . . 4384 1 261 . 1 1 38 38 PRO CB C 13 32.420 0.20 . 1 . . . . . . . . 4384 1 262 . 1 1 38 38 PRO HB3 H 1 1.974 0.08 . 2 . . . . . . . . 4384 1 263 . 1 1 38 38 PRO HB2 H 1 2.366 0.08 . 2 . . . . . . . . 4384 1 264 . 1 1 38 38 PRO CG C 13 27.964 0.20 . 1 . . . . . . . . 4384 1 265 . 1 1 38 38 PRO HG2 H 1 2.009 0.08 . 2 . . . . . . . . 4384 1 266 . 1 1 38 38 PRO CD C 13 51.759 0.20 . 1 . . . . . . . . 4384 1 267 . 1 1 38 38 PRO HD3 H 1 3.824 0.08 . 2 . . . . . . . . 4384 1 268 . 1 1 38 38 PRO HD2 H 1 4.114 0.08 . 2 . . . . . . . . 4384 1 269 . 1 1 38 38 PRO C C 13 179.488 0.05 . 1 . . . . . . . . 4384 1 270 . 1 1 39 39 LYS N N 15 116.087 0.05 . 1 . . . . . . . . 4384 1 271 . 1 1 39 39 LYS H H 1 9.021 0.02 . 1 . . . . . . . . 4384 1 272 . 1 1 39 39 LYS CA C 13 59.338 0.20 . 1 . . . . . . . . 4384 1 273 . 1 1 39 39 LYS HA H 1 4.108 0.08 . 1 . . . . . . . . 4384 1 274 . 1 1 39 39 LYS CB C 13 32.178 0.20 . 1 . . . . . . . . 4384 1 275 . 1 1 39 39 LYS HB2 H 1 1.856 0.08 . 2 . . . . . . . . 4384 1 276 . 1 1 39 39 LYS CG C 13 25.179 0.20 . 1 . . . . . . . . 4384 1 277 . 1 1 39 39 LYS HG2 H 1 1.452 0.08 . 2 . . . . . . . . 4384 1 278 . 1 1 39 39 LYS CD C 13 29.215 0.20 . 1 . . . . . . . . 4384 1 279 . 1 1 39 39 LYS HD2 H 1 1.671 0.08 . 2 . . . . . . . . 4384 1 280 . 1 1 39 39 LYS CE C 13 42.458 0.20 . 1 . . . . . . . . 4384 1 281 . 1 1 39 39 LYS HE2 H 1 2.954 0.08 . 2 . . . . . . . . 4384 1 282 . 1 1 39 39 LYS C C 13 179.411 0.05 . 1 . . . . . . . . 4384 1 283 . 1 1 40 40 LEU N N 15 119.380 0.05 . 1 . . . . . . . . 4384 1 284 . 1 1 40 40 LEU H H 1 7.611 0.02 . 1 . . . . . . . . 4384 1 285 . 1 1 40 40 LEU CA C 13 57.225 0.20 . 1 . . . . . . . . 4384 1 286 . 1 1 40 40 LEU HA H 1 4.163 0.08 . 1 . . . . . . . . 4384 1 287 . 1 1 40 40 LEU CB C 13 41.650 0.20 . 1 . . . . . . . . 4384 1 288 . 1 1 40 40 LEU HB3 H 1 1.615 0.08 . 2 . . . . . . . . 4384 1 289 . 1 1 40 40 LEU HB2 H 1 1.928 0.08 . 2 . . . . . . . . 4384 1 290 . 1 1 40 40 LEU CG C 13 27.402 0.20 . 1 . . . . . . . . 4384 1 291 . 1 1 40 40 LEU HG H 1 1.612 0.08 . 1 . . . . . . . . 4384 1 292 . 1 1 40 40 LEU CD1 C 13 25.407 0.20 . 1 . . . . . . . . 4384 1 293 . 1 1 40 40 LEU HD11 H 1 0.961 0.08 . 1 . . . . . . . . 4384 1 294 . 1 1 40 40 LEU HD12 H 1 0.961 0.08 . 1 . . . . . . . . 4384 1 295 . 1 1 40 40 LEU HD13 H 1 0.961 0.08 . 1 . . . . . . . . 4384 1 296 . 1 1 40 40 LEU CD2 C 13 23.186 0.20 . 1 . . . . . . . . 4384 1 297 . 1 1 40 40 LEU HD21 H 1 0.862 0.08 . 2 . . . . . . . . 4384 1 298 . 1 1 40 40 LEU HD22 H 1 0.862 0.08 . 2 . . . . . . . . 4384 1 299 . 1 1 40 40 LEU HD23 H 1 0.862 0.08 . 2 . . . . . . . . 4384 1 300 . 1 1 40 40 LEU C C 13 179.554 0.05 . 1 . . . . . . . . 4384 1 301 . 1 1 41 41 ILE N N 15 120.494 0.05 . 1 . . . . . . . . 4384 1 302 . 1 1 41 41 ILE H H 1 7.360 0.02 . 1 . . . . . . . . 4384 1 303 . 1 1 41 41 ILE CA C 13 65.487 0.20 . 1 . . . . . . . . 4384 1 304 . 1 1 41 41 ILE HA H 1 3.407 0.08 . 1 . . . . . . . . 4384 1 305 . 1 1 41 41 ILE CB C 13 37.656 0.20 . 1 . . . . . . . . 4384 1 306 . 1 1 41 41 ILE HB H 1 1.994 0.08 . 1 . . . . . . . . 4384 1 307 . 1 1 41 41 ILE CG1 C 13 28.271 0.20 . 1 . . . . . . . . 4384 1 308 . 1 1 41 41 ILE HG13 H 1 0.832 0.08 . 2 . . . . . . . . 4384 1 309 . 1 1 41 41 ILE HG12 H 1 1.600 0.08 . 2 . . . . . . . . 4384 1 310 . 1 1 41 41 ILE CD1 C 13 13.358 0.20 . 1 . . . . . . . . 4384 1 311 . 1 1 41 41 ILE HD11 H 1 0.785 0.08 . 1 . . . . . . . . 4384 1 312 . 1 1 41 41 ILE HD12 H 1 0.785 0.08 . 1 . . . . . . . . 4384 1 313 . 1 1 41 41 ILE HD13 H 1 0.785 0.08 . 1 . . . . . . . . 4384 1 314 . 1 1 41 41 ILE CG2 C 13 17.754 0.20 . 1 . . . . . . . . 4384 1 315 . 1 1 41 41 ILE HG21 H 1 0.864 0.08 . 1 . . . . . . . . 4384 1 316 . 1 1 41 41 ILE HG22 H 1 0.864 0.08 . 1 . . . . . . . . 4384 1 317 . 1 1 41 41 ILE HG23 H 1 0.864 0.08 . 1 . . . . . . . . 4384 1 318 . 1 1 41 41 ILE C C 13 177.758 0.05 . 1 . . . . . . . . 4384 1 319 . 1 1 42 42 THR N N 15 114.672 0.05 . 1 . . . . . . . . 4384 1 320 . 1 1 42 42 THR H H 1 8.226 0.02 . 1 . . . . . . . . 4384 1 321 . 1 1 42 42 THR CA C 13 66.314 0.20 . 1 . . . . . . . . 4384 1 322 . 1 1 42 42 THR HA H 1 3.799 0.08 . 1 . . . . . . . . 4384 1 323 . 1 1 42 42 THR CB C 13 68.477 0.20 . 1 . . . . . . . . 4384 1 324 . 1 1 42 42 THR HB H 1 4.103 0.08 . 1 . . . . . . . . 4384 1 325 . 1 1 42 42 THR CG2 C 13 22.698 0.20 . 1 . . . . . . . . 4384 1 326 . 1 1 42 42 THR HG21 H 1 1.200 0.08 . 1 . . . . . . . . 4384 1 327 . 1 1 42 42 THR HG22 H 1 1.200 0.08 . 1 . . . . . . . . 4384 1 328 . 1 1 42 42 THR HG23 H 1 1.200 0.08 . 1 . . . . . . . . 4384 1 329 . 1 1 42 42 THR C C 13 176.716 0.05 . 1 . . . . . . . . 4384 1 330 . 1 1 43 43 ARG N N 15 121.438 0.05 . 1 . . . . . . . . 4384 1 331 . 1 1 43 43 ARG H H 1 7.555 0.02 . 1 . . . . . . . . 4384 1 332 . 1 1 43 43 ARG CA C 13 59.481 0.20 . 1 . . . . . . . . 4384 1 333 . 1 1 43 43 ARG HA H 1 4.135 0.08 . 1 . . . . . . . . 4384 1 334 . 1 1 43 43 ARG CB C 13 30.582 0.20 . 1 . . . . . . . . 4384 1 335 . 1 1 43 43 ARG HB2 H 1 1.909 0.08 . 2 . . . . . . . . 4384 1 336 . 1 1 43 43 ARG CG C 13 27.542 0.20 . 1 . . . . . . . . 4384 1 337 . 1 1 43 43 ARG HG3 H 1 1.632 0.08 . 2 . . . . . . . . 4384 1 338 . 1 1 43 43 ARG HG2 H 1 1.732 0.08 . 2 . . . . . . . . 4384 1 339 . 1 1 43 43 ARG CD C 13 43.813 0.20 . 1 . . . . . . . . 4384 1 340 . 1 1 43 43 ARG HD2 H 1 3.203 0.08 . 2 . . . . . . . . 4384 1 341 . 1 1 43 43 ARG C C 13 178.814 0.05 . 1 . . . . . . . . 4384 1 342 . 1 1 44 44 LEU N N 15 121.469 0.05 . 1 . . . . . . . . 4384 1 343 . 1 1 44 44 LEU H H 1 7.727 0.02 . 1 . . . . . . . . 4384 1 344 . 1 1 44 44 LEU CA C 13 57.732 0.20 . 1 . . . . . . . . 4384 1 345 . 1 1 44 44 LEU HA H 1 4.188 0.08 . 1 . . . . . . . . 4384 1 346 . 1 1 44 44 LEU CB C 13 41.337 0.20 . 1 . . . . . . . . 4384 1 347 . 1 1 44 44 LEU HB2 H 1 1.653 0.08 . 2 . . . . . . . . 4384 1 348 . 1 1 44 44 LEU CG C 13 27.260 0.20 . 1 . . . . . . . . 4384 1 349 . 1 1 44 44 LEU HG H 1 1.683 0.08 . 1 . . . . . . . . 4384 1 350 . 1 1 44 44 LEU CD1 C 13 27.042 0.20 . 1 . . . . . . . . 4384 1 351 . 1 1 44 44 LEU HD11 H 1 0.788 0.08 . 1 . . . . . . . . 4384 1 352 . 1 1 44 44 LEU HD12 H 1 0.788 0.08 . 1 . . . . . . . . 4384 1 353 . 1 1 44 44 LEU HD13 H 1 0.788 0.08 . 1 . . . . . . . . 4384 1 354 . 1 1 44 44 LEU CD2 C 13 23.722 0.20 . 1 . . . . . . . . 4384 1 355 . 1 1 44 44 LEU HD21 H 1 0.883 0.08 . 2 . . . . . . . . 4384 1 356 . 1 1 44 44 LEU HD22 H 1 0.883 0.08 . 2 . . . . . . . . 4384 1 357 . 1 1 44 44 LEU HD23 H 1 0.883 0.08 . 2 . . . . . . . . 4384 1 358 . 1 1 44 44 LEU C C 13 178.541 0.05 . 1 . . . . . . . . 4384 1 359 . 1 1 45 45 ALA N N 15 121.915 0.05 . 1 . . . . . . . . 4384 1 360 . 1 1 45 45 ALA H H 1 8.613 0.02 . 1 . . . . . . . . 4384 1 361 . 1 1 45 45 ALA CA C 13 55.712 0.20 . 1 . . . . . . . . 4384 1 362 . 1 1 45 45 ALA HA H 1 3.884 0.08 . 1 . . . . . . . . 4384 1 363 . 1 1 45 45 ALA CB C 13 17.961 0.20 . 1 . . . . . . . . 4384 1 364 . 1 1 45 45 ALA HB1 H 1 1.482 0.08 . 1 . . . . . . . . 4384 1 365 . 1 1 45 45 ALA HB2 H 1 1.482 0.08 . 1 . . . . . . . . 4384 1 366 . 1 1 45 45 ALA HB3 H 1 1.482 0.08 . 1 . . . . . . . . 4384 1 367 . 1 1 45 45 ALA C C 13 180.656 0.05 . 1 . . . . . . . . 4384 1 368 . 1 1 46 46 ASP N N 15 119.106 0.05 . 1 . . . . . . . . 4384 1 369 . 1 1 46 46 ASP H H 1 8.038 0.02 . 1 . . . . . . . . 4384 1 370 . 1 1 46 46 ASP CA C 13 57.603 0.20 . 1 . . . . . . . . 4384 1 371 . 1 1 46 46 ASP HA H 1 4.499 0.08 . 1 . . . . . . . . 4384 1 372 . 1 1 46 46 ASP CB C 13 40.796 0.20 . 1 . . . . . . . . 4384 1 373 . 1 1 46 46 ASP HB3 H 1 2.766 0.08 . 2 . . . . . . . . 4384 1 374 . 1 1 46 46 ASP HB2 H 1 2.870 0.08 . 2 . . . . . . . . 4384 1 375 . 1 1 46 46 ASP C C 13 179.231 0.05 . 1 . . . . . . . . 4384 1 376 . 1 1 47 47 THR N N 15 121.937 0.05 . 1 . . . . . . . . 4384 1 377 . 1 1 47 47 THR H H 1 8.503 0.02 . 1 . . . . . . . . 4384 1 378 . 1 1 47 47 THR CA C 13 67.194 0.20 . 1 . . . . . . . . 4384 1 379 . 1 1 47 47 THR HA H 1 3.815 0.08 . 1 . . . . . . . . 4384 1 380 . 1 1 47 47 THR CB C 13 68.362 0.20 . 1 . . . . . . . . 4384 1 381 . 1 1 47 47 THR HB H 1 4.497 0.08 . 1 . . . . . . . . 4384 1 382 . 1 1 47 47 THR CG2 C 13 17.800 0.20 . 1 . . . . . . . . 4384 1 383 . 1 1 47 47 THR HG21 H 1 1.440 0.08 . 1 . . . . . . . . 4384 1 384 . 1 1 47 47 THR HG22 H 1 1.440 0.08 . 1 . . . . . . . . 4384 1 385 . 1 1 47 47 THR HG23 H 1 1.440 0.08 . 1 . . . . . . . . 4384 1 386 . 1 1 47 47 THR C C 13 176.005 0.05 . 1 . . . . . . . . 4384 1 387 . 1 1 48 48 VAL N N 15 121.712 0.05 . 1 . . . . . . . . 4384 1 388 . 1 1 48 48 VAL H H 1 8.683 0.02 . 1 . . . . . . . . 4384 1 389 . 1 1 48 48 VAL CA C 13 67.187 0.20 . 1 . . . . . . . . 4384 1 390 . 1 1 48 48 VAL HA H 1 3.352 0.08 . 1 . . . . . . . . 4384 1 391 . 1 1 48 48 VAL CB C 13 32.010 0.20 . 1 . . . . . . . . 4384 1 392 . 1 1 48 48 VAL HB H 1 2.146 0.08 . 1 . . . . . . . . 4384 1 393 . 1 1 48 48 VAL CG2 C 13 23.426 0.20 . 1 . . . . . . . . 4384 1 394 . 1 1 48 48 VAL HG21 H 1 1.001 0.08 . 2 . . . . . . . . 4384 1 395 . 1 1 48 48 VAL HG22 H 1 1.001 0.08 . 2 . . . . . . . . 4384 1 396 . 1 1 48 48 VAL HG23 H 1 1.001 0.08 . 2 . . . . . . . . 4384 1 397 . 1 1 48 48 VAL CG1 C 13 21.949 0.20 . 1 . . . . . . . . 4384 1 398 . 1 1 48 48 VAL HG11 H 1 0.988 0.08 . 1 . . . . . . . . 4384 1 399 . 1 1 48 48 VAL HG12 H 1 0.988 0.08 . 1 . . . . . . . . 4384 1 400 . 1 1 48 48 VAL HG13 H 1 0.988 0.08 . 1 . . . . . . . . 4384 1 401 . 1 1 48 48 VAL C C 13 179.176 0.05 . 1 . . . . . . . . 4384 1 402 . 1 1 49 49 ARG N N 15 118.569 0.05 . 1 . . . . . . . . 4384 1 403 . 1 1 49 49 ARG H H 1 7.989 0.02 . 1 . . . . . . . . 4384 1 404 . 1 1 49 49 ARG CA C 13 59.571 0.20 . 1 . . . . . . . . 4384 1 405 . 1 1 49 49 ARG HA H 1 4.082 0.08 . 1 . . . . . . . . 4384 1 406 . 1 1 49 49 ARG CB C 13 30.748 0.20 . 1 . . . . . . . . 4384 1 407 . 1 1 49 49 ARG HB2 H 1 1.998 0.08 . 2 . . . . . . . . 4384 1 408 . 1 1 49 49 ARG CG C 13 28.098 0.20 . 1 . . . . . . . . 4384 1 409 . 1 1 49 49 ARG HG3 H 1 1.653 0.08 . 2 . . . . . . . . 4384 1 410 . 1 1 49 49 ARG HG2 H 1 1.776 0.08 . 2 . . . . . . . . 4384 1 411 . 1 1 49 49 ARG CD C 13 43.742 0.20 . 1 . . . . . . . . 4384 1 412 . 1 1 49 49 ARG HD2 H 1 3.229 0.08 . 2 . . . . . . . . 4384 1 413 . 1 1 49 49 ARG C C 13 178.123 0.05 . 1 . . . . . . . . 4384 1 414 . 1 1 50 50 THR N N 15 108.634 0.05 . 1 . . . . . . . . 4384 1 415 . 1 1 50 50 THR H H 1 8.118 0.02 . 1 . . . . . . . . 4384 1 416 . 1 1 50 50 THR CA C 13 64.098 0.20 . 1 . . . . . . . . 4384 1 417 . 1 1 50 50 THR HA H 1 4.265 0.08 . 1 . . . . . . . . 4384 1 418 . 1 1 50 50 THR CB C 13 70.583 0.20 . 1 . . . . . . . . 4384 1 419 . 1 1 50 50 THR HB H 1 4.204 0.08 . 1 . . . . . . . . 4384 1 420 . 1 1 50 50 THR CG2 C 13 21.994 0.20 . 1 . . . . . . . . 4384 1 421 . 1 1 50 50 THR HG21 H 1 1.221 0.08 . 1 . . . . . . . . 4384 1 422 . 1 1 50 50 THR HG22 H 1 1.221 0.08 . 1 . . . . . . . . 4384 1 423 . 1 1 50 50 THR HG23 H 1 1.221 0.08 . 1 . . . . . . . . 4384 1 424 . 1 1 50 50 THR C C 13 176.562 0.05 . 1 . . . . . . . . 4384 1 425 . 1 1 51 51 LYS N N 15 120.005 0.05 . 1 . . . . . . . . 4384 1 426 . 1 1 51 51 LYS H H 1 8.933 0.02 . 1 . . . . . . . . 4384 1 427 . 1 1 51 51 LYS CA C 13 55.928 0.20 . 1 . . . . . . . . 4384 1 428 . 1 1 51 51 LYS HA H 1 4.586 0.08 . 1 . . . . . . . . 4384 1 429 . 1 1 51 51 LYS CB C 13 32.476 0.20 . 1 . . . . . . . . 4384 1 430 . 1 1 51 51 LYS HB3 H 1 1.912 0.08 . 2 . . . . . . . . 4384 1 431 . 1 1 51 51 LYS HB2 H 1 2.143 0.08 . 2 . . . . . . . . 4384 1 432 . 1 1 51 51 LYS CG C 13 25.559 0.20 . 1 . . . . . . . . 4384 1 433 . 1 1 51 51 LYS HG3 H 1 1.446 0.08 . 2 . . . . . . . . 4384 1 434 . 1 1 51 51 LYS HG2 H 1 1.636 0.08 . 2 . . . . . . . . 4384 1 435 . 1 1 51 51 LYS CD C 13 28.317 0.20 . 1 . . . . . . . . 4384 1 436 . 1 1 51 51 LYS HD2 H 1 1.643 0.08 . 2 . . . . . . . . 4384 1 437 . 1 1 51 51 LYS CE C 13 42.452 0.20 . 1 . . . . . . . . 4384 1 438 . 1 1 51 51 LYS HE2 H 1 2.995 0.08 . 2 . . . . . . . . 4384 1 439 . 1 1 51 51 LYS C C 13 178.469 0.05 . 1 . . . . . . . . 4384 1 440 . 1 1 52 52 GLY N N 15 107.461 0.05 . 1 . . . . . . . . 4384 1 441 . 1 1 52 52 GLY H H 1 7.614 0.02 . 1 . . . . . . . . 4384 1 442 . 1 1 52 52 GLY CA C 13 44.433 0.20 . 1 . . . . . . . . 4384 1 443 . 1 1 52 52 GLY HA3 H 1 4.058 0.08 . 2 . . . . . . . . 4384 1 444 . 1 1 52 52 GLY HA2 H 1 4.512 0.08 . 2 . . . . . . . . 4384 1 445 . 1 1 52 52 GLY C C 13 175.126 0.05 . 1 . . . . . . . . 4384 1 446 . 1 1 53 53 LEU N N 15 121.380 0.05 . 1 . . . . . . . . 4384 1 447 . 1 1 53 53 LEU H H 1 8.993 0.02 . 1 . . . . . . . . 4384 1 448 . 1 1 53 53 LEU CA C 13 57.734 0.20 . 1 . . . . . . . . 4384 1 449 . 1 1 53 53 LEU HA H 1 4.216 0.08 . 1 . . . . . . . . 4384 1 450 . 1 1 53 53 LEU CB C 13 43.069 0.20 . 1 . . . . . . . . 4384 1 451 . 1 1 53 53 LEU HB3 H 1 1.466 0.08 . 2 . . . . . . . . 4384 1 452 . 1 1 53 53 LEU HB2 H 1 1.645 0.08 . 2 . . . . . . . . 4384 1 453 . 1 1 53 53 LEU CG C 13 27.357 0.20 . 1 . . . . . . . . 4384 1 454 . 1 1 53 53 LEU HG H 1 1.710 0.08 . 1 . . . . . . . . 4384 1 455 . 1 1 53 53 LEU CD1 C 13 24.980 0.20 . 1 . . . . . . . . 4384 1 456 . 1 1 53 53 LEU HD11 H 1 0.823 0.08 . 1 . . . . . . . . 4384 1 457 . 1 1 53 53 LEU HD12 H 1 0.823 0.08 . 1 . . . . . . . . 4384 1 458 . 1 1 53 53 LEU HD13 H 1 0.823 0.08 . 1 . . . . . . . . 4384 1 459 . 1 1 53 53 LEU CD2 C 13 25.211 0.20 . 1 . . . . . . . . 4384 1 460 . 1 1 53 53 LEU HD21 H 1 0.903 0.08 . 2 . . . . . . . . 4384 1 461 . 1 1 53 53 LEU HD22 H 1 0.903 0.08 . 2 . . . . . . . . 4384 1 462 . 1 1 53 53 LEU HD23 H 1 0.903 0.08 . 2 . . . . . . . . 4384 1 463 . 1 1 53 53 LEU C C 13 176.355 0.05 . 1 . . . . . . . . 4384 1 464 . 1 1 54 54 ARG N N 15 112.016 0.05 . 1 . . . . . . . . 4384 1 465 . 1 1 54 54 ARG H H 1 8.032 0.02 . 1 . . . . . . . . 4384 1 466 . 1 1 54 54 ARG CA C 13 55.612 0.20 . 1 . . . . . . . . 4384 1 467 . 1 1 54 54 ARG HA H 1 4.290 0.08 . 1 . . . . . . . . 4384 1 468 . 1 1 54 54 ARG CB C 13 30.864 0.20 . 1 . . . . . . . . 4384 1 469 . 1 1 54 54 ARG HB3 H 1 1.695 0.08 . 2 . . . . . . . . 4384 1 470 . 1 1 54 54 ARG HB2 H 1 2.031 0.08 . 2 . . . . . . . . 4384 1 471 . 1 1 54 54 ARG CG C 13 27.867 0.20 . 1 . . . . . . . . 4384 1 472 . 1 1 54 54 ARG HG2 H 1 1.650 0.08 . 2 . . . . . . . . 4384 1 473 . 1 1 54 54 ARG CD C 13 43.735 0.20 . 1 . . . . . . . . 4384 1 474 . 1 1 54 54 ARG HD2 H 1 3.235 0.08 . 2 . . . . . . . . 4384 1 475 . 1 1 54 54 ARG C C 13 176.705 0.05 . 1 . . . . . . . . 4384 1 476 . 1 1 55 55 SER N N 15 113.497 0.05 . 1 . . . . . . . . 4384 1 477 . 1 1 55 55 SER H H 1 6.856 0.02 . 1 . . . . . . . . 4384 1 478 . 1 1 55 55 SER CA C 13 55.240 0.20 . 1 . . . . . . . . 4384 1 479 . 1 1 55 55 SER HA H 1 4.777 0.08 . 1 . . . . . . . . 4384 1 480 . 1 1 55 55 SER CB C 13 67.965 0.20 . 1 . . . . . . . . 4384 1 481 . 1 1 55 55 SER HB2 H 1 4.363 0.08 . 2 . . . . . . . . 4384 1 482 . 1 1 55 55 SER C C 13 176.845 0.05 . 9 . . . . . . . . 4384 1 483 . 1 1 56 56 PRO CA C 13 63.078 0.20 . 1 . . . . . . . . 4384 1 484 . 1 1 56 56 PRO HA H 1 4.477 0.08 . 1 . . . . . . . . 4384 1 485 . 1 1 56 56 PRO CB C 13 32.458 0.20 . 1 . . . . . . . . 4384 1 486 . 1 1 56 56 PRO HB3 H 1 2.058 0.08 . 2 . . . . . . . . 4384 1 487 . 1 1 56 56 PRO HB2 H 1 2.451 0.08 . 2 . . . . . . . . 4384 1 488 . 1 1 56 56 PRO CG C 13 27.495 0.20 . 1 . . . . . . . . 4384 1 489 . 1 1 56 56 PRO HG2 H 1 2.092 0.08 . 2 . . . . . . . . 4384 1 490 . 1 1 56 56 PRO CD C 13 51.326 0.20 . 1 . . . . . . . . 4384 1 491 . 1 1 56 56 PRO HD2 H 1 3.985 0.08 . 2 . . . . . . . . 4384 1 492 . 1 1 56 56 PRO C C 13 173.962 0.05 . 1 . . . . . . . . 4384 1 493 . 1 1 57 57 ILE N N 15 120.466 0.05 . 1 . . . . . . . . 4384 1 494 . 1 1 57 57 ILE H H 1 8.074 0.02 . 1 . . . . . . . . 4384 1 495 . 1 1 57 57 ILE CA C 13 64.030 0.20 . 1 . . . . . . . . 4384 1 496 . 1 1 57 57 ILE HA H 1 3.802 0.08 . 1 . . . . . . . . 4384 1 497 . 1 1 57 57 ILE CB C 13 37.560 0.20 . 1 . . . . . . . . 4384 1 498 . 1 1 57 57 ILE HB H 1 1.738 0.08 . 1 . . . . . . . . 4384 1 499 . 1 1 57 57 ILE CG1 C 13 28.622 0.20 . 1 . . . . . . . . 4384 1 500 . 1 1 57 57 ILE HG13 H 1 1.242 0.08 . 2 . . . . . . . . 4384 1 501 . 1 1 57 57 ILE HG12 H 1 1.540 0.08 . 2 . . . . . . . . 4384 1 502 . 1 1 57 57 ILE CD1 C 13 12.485 0.20 . 1 . . . . . . . . 4384 1 503 . 1 1 57 57 ILE HD11 H 1 0.877 0.08 . 1 . . . . . . . . 4384 1 504 . 1 1 57 57 ILE HD12 H 1 0.877 0.08 . 1 . . . . . . . . 4384 1 505 . 1 1 57 57 ILE HD13 H 1 0.877 0.08 . 1 . . . . . . . . 4384 1 506 . 1 1 57 57 ILE CG2 C 13 17.902 0.20 . 1 . . . . . . . . 4384 1 507 . 1 1 57 57 ILE HG21 H 1 0.924 0.08 . 1 . . . . . . . . 4384 1 508 . 1 1 57 57 ILE HG22 H 1 0.924 0.08 . 1 . . . . . . . . 4384 1 509 . 1 1 57 57 ILE HG23 H 1 0.924 0.08 . 1 . . . . . . . . 4384 1 510 . 1 1 57 57 ILE C C 13 177.587 0.05 . 1 . . . . . . . . 4384 1 511 . 1 1 58 58 THR N N 15 117.201 0.05 . 1 . . . . . . . . 4384 1 512 . 1 1 58 58 THR H H 1 6.605 0.02 . 1 . . . . . . . . 4384 1 513 . 1 1 58 58 THR CA C 13 66.174 0.20 . 1 . . . . . . . . 4384 1 514 . 1 1 58 58 THR HA H 1 3.554 0.08 . 1 . . . . . . . . 4384 1 515 . 1 1 58 58 THR CB C 13 68.347 0.20 . 1 . . . . . . . . 4384 1 516 . 1 1 58 58 THR HB H 1 4.380 0.08 . 1 . . . . . . . . 4384 1 517 . 1 1 58 58 THR CG2 C 13 24.718 0.20 . 1 . . . . . . . . 4384 1 518 . 1 1 58 58 THR HG21 H 1 1.234 0.08 . 1 . . . . . . . . 4384 1 519 . 1 1 58 58 THR HG22 H 1 1.234 0.08 . 1 . . . . . . . . 4384 1 520 . 1 1 58 58 THR HG23 H 1 1.234 0.08 . 1 . . . . . . . . 4384 1 521 . 1 1 58 58 THR C C 13 176.088 0.05 . 1 . . . . . . . . 4384 1 522 . 1 1 59 59 MET N N 15 117.893 0.05 . 1 . . . . . . . . 4384 1 523 . 1 1 59 59 MET H H 1 7.803 0.02 . 1 . . . . . . . . 4384 1 524 . 1 1 59 59 MET CA C 13 57.715 0.20 . 1 . . . . . . . . 4384 1 525 . 1 1 59 59 MET HA H 1 4.311 0.08 . 1 . . . . . . . . 4384 1 526 . 1 1 59 59 MET CB C 13 31.239 0.20 . 1 . . . . . . . . 4384 1 527 . 1 1 59 59 MET HB3 H 1 2.076 0.08 . 2 . . . . . . . . 4384 1 528 . 1 1 59 59 MET HB2 H 1 2.274 0.08 . 2 . . . . . . . . 4384 1 529 . 1 1 59 59 MET CG C 13 32.096 0.20 . 1 . . . . . . . . 4384 1 530 . 1 1 59 59 MET HG3 H 1 2.549 0.08 . 2 . . . . . . . . 4384 1 531 . 1 1 59 59 MET HG2 H 1 2.779 0.08 . 2 . . . . . . . . 4384 1 532 . 1 1 59 59 MET CE C 13 17.737 0.20 . 1 . . . . . . . . 4384 1 533 . 1 1 59 59 MET HE1 H 1 2.106 0.20 . 1 . . . . . . . . 4384 1 534 . 1 1 59 59 MET HE2 H 1 2.106 0.20 . 1 . . . . . . . . 4384 1 535 . 1 1 59 59 MET HE3 H 1 2.106 0.20 . 1 . . . . . . . . 4384 1 536 . 1 1 59 59 MET C C 13 177.606 0.05 . 1 . . . . . . . . 4384 1 537 . 1 1 60 60 ALA N N 15 119.927 0.05 . 1 . . . . . . . . 4384 1 538 . 1 1 60 60 ALA H H 1 7.775 0.02 . 1 . . . . . . . . 4384 1 539 . 1 1 60 60 ALA CA C 13 54.929 0.20 . 1 . . . . . . . . 4384 1 540 . 1 1 60 60 ALA HA H 1 4.192 0.08 . 1 . . . . . . . . 4384 1 541 . 1 1 60 60 ALA CB C 13 17.931 0.20 . 1 . . . . . . . . 4384 1 542 . 1 1 60 60 ALA HB1 H 1 1.483 0.08 . 1 . . . . . . . . 4384 1 543 . 1 1 60 60 ALA HB2 H 1 1.483 0.08 . 1 . . . . . . . . 4384 1 544 . 1 1 60 60 ALA HB3 H 1 1.483 0.08 . 1 . . . . . . . . 4384 1 545 . 1 1 60 60 ALA C C 13 181.380 0.05 . 1 . . . . . . . . 4384 1 546 . 1 1 61 61 GLU N N 15 119.163 0.05 . 1 . . . . . . . . 4384 1 547 . 1 1 61 61 GLU H H 1 7.976 0.02 . 1 . . . . . . . . 4384 1 548 . 1 1 61 61 GLU CA C 13 59.735 0.20 . 1 . . . . . . . . 4384 1 549 . 1 1 61 61 GLU HA H 1 4.090 0.08 . 1 . . . . . . . . 4384 1 550 . 1 1 61 61 GLU CB C 13 29.961 0.20 . 1 . . . . . . . . 4384 1 551 . 1 1 61 61 GLU HB2 H 1 2.054 0.08 . 2 . . . . . . . . 4384 1 552 . 1 1 61 61 GLU CG C 13 36.823 0.20 . 1 . . . . . . . . 4384 1 553 . 1 1 61 61 GLU HG3 H 1 2.234 0.08 . 2 . . . . . . . . 4384 1 554 . 1 1 61 61 GLU HG2 H 1 2.438 0.08 . 2 . . . . . . . . 4384 1 555 . 1 1 61 61 GLU C C 13 179.829 0.05 . 1 . . . . . . . . 4384 1 556 . 1 1 62 62 VAL N N 15 121.317 0.05 . 1 . . . . . . . . 4384 1 557 . 1 1 62 62 VAL H H 1 8.249 0.02 . 1 . . . . . . . . 4384 1 558 . 1 1 62 62 VAL CA C 13 67.160 0.20 . 1 . . . . . . . . 4384 1 559 . 1 1 62 62 VAL HA H 1 3.311 0.08 . 1 . . . . . . . . 4384 1 560 . 1 1 62 62 VAL CB C 13 31.390 0.20 . 1 . . . . . . . . 4384 1 561 . 1 1 62 62 VAL HB H 1 1.775 0.08 . 1 . . . . . . . . 4384 1 562 . 1 1 62 62 VAL CG2 C 13 23.273 0.20 . 1 . . . . . . . . 4384 1 563 . 1 1 62 62 VAL HG21 H 1 0.426 0.08 . 2 . . . . . . . . 4384 1 564 . 1 1 62 62 VAL HG22 H 1 0.426 0.08 . 2 . . . . . . . . 4384 1 565 . 1 1 62 62 VAL HG23 H 1 0.426 0.08 . 2 . . . . . . . . 4384 1 566 . 1 1 62 62 VAL CG1 C 13 21.298 0.20 . 1 . . . . . . . . 4384 1 567 . 1 1 62 62 VAL HG11 H 1 0.184 0.08 . 1 . . . . . . . . 4384 1 568 . 1 1 62 62 VAL HG12 H 1 0.184 0.08 . 1 . . . . . . . . 4384 1 569 . 1 1 62 62 VAL HG13 H 1 0.184 0.08 . 1 . . . . . . . . 4384 1 570 . 1 1 62 62 VAL C C 13 177.884 0.05 . 1 . . . . . . . . 4384 1 571 . 1 1 63 63 GLU N N 15 118.638 0.05 . 1 . . . . . . . . 4384 1 572 . 1 1 63 63 GLU H H 1 8.529 0.02 . 1 . . . . . . . . 4384 1 573 . 1 1 63 63 GLU CA C 13 60.163 0.20 . 1 . . . . . . . . 4384 1 574 . 1 1 63 63 GLU HA H 1 3.638 0.08 . 1 . . . . . . . . 4384 1 575 . 1 1 63 63 GLU CB C 13 29.660 0.20 . 1 . . . . . . . . 4384 1 576 . 1 1 63 63 GLU HB3 H 1 1.926 0.08 . 2 . . . . . . . . 4384 1 577 . 1 1 63 63 GLU HB2 H 1 2.171 0.08 . 2 . . . . . . . . 4384 1 578 . 1 1 63 63 GLU CG C 13 37.827 0.20 . 1 . . . . . . . . 4384 1 579 . 1 1 63 63 GLU HG3 H 1 2.147 0.08 . 2 . . . . . . . . 4384 1 580 . 1 1 63 63 GLU HG2 H 1 2.471 0.08 . 2 . . . . . . . . 4384 1 581 . 1 1 63 63 GLU C C 13 179.496 0.05 . 1 . . . . . . . . 4384 1 582 . 1 1 64 64 ALA N N 15 119.545 0.05 . 1 . . . . . . . . 4384 1 583 . 1 1 64 64 ALA H H 1 7.739 0.02 . 1 . . . . . . . . 4384 1 584 . 1 1 64 64 ALA CA C 13 55.096 0.20 . 1 . . . . . . . . 4384 1 585 . 1 1 64 64 ALA HA H 1 4.113 0.08 . 1 . . . . . . . . 4384 1 586 . 1 1 64 64 ALA CB C 13 18.127 0.20 . 1 . . . . . . . . 4384 1 587 . 1 1 64 64 ALA HB1 H 1 1.512 0.08 . 1 . . . . . . . . 4384 1 588 . 1 1 64 64 ALA HB2 H 1 1.512 0.08 . 1 . . . . . . . . 4384 1 589 . 1 1 64 64 ALA HB3 H 1 1.512 0.08 . 1 . . . . . . . . 4384 1 590 . 1 1 64 64 ALA C C 13 181.322 0.05 . 1 . . . . . . . . 4384 1 591 . 1 1 65 65 LEU N N 15 120.024 0.05 . 1 . . . . . . . . 4384 1 592 . 1 1 65 65 LEU H H 1 7.573 0.02 . 1 . . . . . . . . 4384 1 593 . 1 1 65 65 LEU CA C 13 57.595 0.20 . 1 . . . . . . . . 4384 1 594 . 1 1 65 65 LEU HA H 1 4.157 0.08 . 1 . . . . . . . . 4384 1 595 . 1 1 65 65 LEU CB C 13 42.261 0.20 . 1 . . . . . . . . 4384 1 596 . 1 1 65 65 LEU HB3 H 1 1.671 0.08 . 2 . . . . . . . . 4384 1 597 . 1 1 65 65 LEU HB2 H 1 1.714 0.08 . 2 . . . . . . . . 4384 1 598 . 1 1 65 65 LEU CG C 13 27.387 0.20 . 1 . . . . . . . . 4384 1 599 . 1 1 65 65 LEU HG H 1 1.709 0.08 . 1 . . . . . . . . 4384 1 600 . 1 1 65 65 LEU CD1 C 13 25.948 0.20 . 1 . . . . . . . . 4384 1 601 . 1 1 65 65 LEU HD11 H 1 0.869 0.08 . 1 . . . . . . . . 4384 1 602 . 1 1 65 65 LEU HD12 H 1 0.869 0.08 . 1 . . . . . . . . 4384 1 603 . 1 1 65 65 LEU HD13 H 1 0.869 0.08 . 1 . . . . . . . . 4384 1 604 . 1 1 65 65 LEU CD2 C 13 23.454 0.20 . 1 . . . . . . . . 4384 1 605 . 1 1 65 65 LEU HD21 H 1 0.905 0.08 . 2 . . . . . . . . 4384 1 606 . 1 1 65 65 LEU HD22 H 1 0.905 0.08 . 2 . . . . . . . . 4384 1 607 . 1 1 65 65 LEU HD23 H 1 0.905 0.08 . 2 . . . . . . . . 4384 1 608 . 1 1 65 65 LEU C C 13 178.024 0.05 . 1 . . . . . . . . 4384 1 609 . 1 1 66 66 MET N N 15 114.053 0.05 . 1 . . . . . . . . 4384 1 610 . 1 1 66 66 MET H H 1 7.712 0.02 . 1 . . . . . . . . 4384 1 611 . 1 1 66 66 MET CA C 13 55.370 0.20 . 1 . . . . . . . . 4384 1 612 . 1 1 66 66 MET HA H 1 4.462 0.08 . 1 . . . . . . . . 4384 1 613 . 1 1 66 66 MET CB C 13 31.835 0.20 . 1 . . . . . . . . 4384 1 614 . 1 1 66 66 MET HB2 H 1 1.835 0.08 . 2 . . . . . . . . 4384 1 615 . 1 1 66 66 MET CG C 13 33.706 0.20 . 1 . . . . . . . . 4384 1 616 . 1 1 66 66 MET HG3 H 1 2.127 0.08 . 2 . . . . . . . . 4384 1 617 . 1 1 66 66 MET HG2 H 1 2.564 0.08 . 2 . . . . . . . . 4384 1 618 . 1 1 66 66 MET CE C 13 18.855 0.20 . 1 . . . . . . . . 4384 1 619 . 1 1 66 66 MET HE1 H 1 1.804 0.20 . 1 . . . . . . . . 4384 1 620 . 1 1 66 66 MET HE2 H 1 1.804 0.20 . 1 . . . . . . . . 4384 1 621 . 1 1 66 66 MET HE3 H 1 1.804 0.20 . 1 . . . . . . . . 4384 1 622 . 1 1 66 66 MET C C 13 174.600 0.05 . 1 . . . . . . . . 4384 1 623 . 1 1 67 67 SER N N 15 112.371 0.05 . 1 . . . . . . . . 4384 1 624 . 1 1 67 67 SER H H 1 7.194 0.02 . 1 . . . . . . . . 4384 1 625 . 1 1 67 67 SER CA C 13 59.820 0.20 . 1 . . . . . . . . 4384 1 626 . 1 1 67 67 SER HA H 1 4.341 0.08 . 1 . . . . . . . . 4384 1 627 . 1 1 67 67 SER CB C 13 63.582 0.20 . 1 . . . . . . . . 4384 1 628 . 1 1 67 67 SER HB2 H 1 4.054 0.08 . 2 . . . . . . . . 4384 1 629 . 1 1 67 67 SER C C 13 174.506 0.05 . 1 . . . . . . . . 4384 1 630 . 1 1 68 68 SER N N 15 118.222 0.05 . 1 . . . . . . . . 4384 1 631 . 1 1 68 68 SER H H 1 7.556 0.02 . 1 . . . . . . . . 4384 1 632 . 1 1 68 68 SER CA C 13 56.130 0.20 . 1 . . . . . . . . 4384 1 633 . 1 1 68 68 SER HA H 1 4.945 0.08 . 1 . . . . . . . . 4384 1 634 . 1 1 68 68 SER CB C 13 64.017 0.20 . 1 . . . . . . . . 4384 1 635 . 1 1 68 68 SER HB3 H 1 3.728 0.08 . 2 . . . . . . . . 4384 1 636 . 1 1 68 68 SER HB2 H 1 3.867 0.08 . 2 . . . . . . . . 4384 1 637 . 1 1 68 68 SER C C 13 171.171 0.05 . 1 . . . . . . . . 4384 1 638 . 1 1 69 69 PRO CA C 13 63.894 0.20 . 1 . . . . . . . . 4384 1 639 . 1 1 69 69 PRO HA H 1 4.312 0.08 . 1 . . . . . . . . 4384 1 640 . 1 1 69 69 PRO CB C 13 32.451 0.20 . 1 . . . . . . . . 4384 1 641 . 1 1 69 69 PRO HB2 H 1 2.023 0.08 . 2 . . . . . . . . 4384 1 642 . 1 1 69 69 PRO CG C 13 28.004 0.20 . 1 . . . . . . . . 4384 1 643 . 1 1 69 69 PRO HG3 H 1 2.002 0.08 . 2 . . . . . . . . 4384 1 644 . 1 1 69 69 PRO HG2 H 1 2.222 0.08 . 2 . . . . . . . . 4384 1 645 . 1 1 69 69 PRO CD C 13 50.876 0.20 . 1 . . . . . . . . 4384 1 646 . 1 1 69 69 PRO HD3 H 1 3.642 0.08 . 2 . . . . . . . . 4384 1 647 . 1 1 69 69 PRO HD2 H 1 3.869 0.08 . 2 . . . . . . . . 4384 1 648 . 1 1 69 69 PRO C C 13 175.960 0.05 . 1 . . . . . . . . 4384 1 649 . 1 1 70 70 LEU N N 15 126.145 0.05 . 1 . . . . . . . . 4384 1 650 . 1 1 70 70 LEU H H 1 8.344 0.02 . 1 . . . . . . . . 4384 1 651 . 1 1 70 70 LEU CA C 13 53.379 0.20 . 1 . . . . . . . . 4384 1 652 . 1 1 70 70 LEU HA H 1 4.863 0.08 . 1 . . . . . . . . 4384 1 653 . 1 1 70 70 LEU CG C 13 26.591 0.20 . 1 . . . . . . . . 4384 1 654 . 1 1 70 70 LEU HG H 1 2.054 0.08 . 1 . . . . . . . . 4384 1 655 . 1 1 70 70 LEU CD1 C 13 27.061 0.20 . 1 . . . . . . . . 4384 1 656 . 1 1 70 70 LEU HD11 H 1 0.866 0.08 . 1 . . . . . . . . 4384 1 657 . 1 1 70 70 LEU HD12 H 1 0.866 0.08 . 1 . . . . . . . . 4384 1 658 . 1 1 70 70 LEU HD13 H 1 0.866 0.08 . 1 . . . . . . . . 4384 1 659 . 1 1 70 70 LEU CD2 C 13 23.961 0.20 . 1 . . . . . . . . 4384 1 660 . 1 1 70 70 LEU HD21 H 1 0.974 0.08 . 2 . . . . . . . . 4384 1 661 . 1 1 70 70 LEU HD22 H 1 0.974 0.08 . 2 . . . . . . . . 4384 1 662 . 1 1 70 70 LEU HD23 H 1 0.974 0.08 . 2 . . . . . . . . 4384 1 663 . 1 1 70 70 LEU C C 13 174.526 0.05 . 1 . . . . . . . . 4384 1 664 . 1 1 71 71 LEU N N 15 112.417 0.05 . 1 . . . . . . . . 4384 1 665 . 1 1 71 71 LEU H H 1 8.484 0.02 . 1 . . . . . . . . 4384 1 666 . 1 1 71 71 LEU CA C 13 52.938 0.20 . 1 . . . . . . . . 4384 1 667 . 1 1 71 71 LEU HA H 1 4.566 0.08 . 1 . . . . . . . . 4384 1 668 . 1 1 71 71 LEU CG C 13 26.485 0.20 . 1 . . . . . . . . 4384 1 669 . 1 1 71 71 LEU HG H 1 2.071 0.08 . 1 . . . . . . . . 4384 1 670 . 1 1 71 71 LEU CD1 C 13 27.133 0.20 . 1 . . . . . . . . 4384 1 671 . 1 1 71 71 LEU HD11 H 1 0.621 0.08 . 1 . . . . . . . . 4384 1 672 . 1 1 71 71 LEU HD12 H 1 0.621 0.08 . 1 . . . . . . . . 4384 1 673 . 1 1 71 71 LEU HD13 H 1 0.621 0.08 . 1 . . . . . . . . 4384 1 674 . 1 1 71 71 LEU CD2 C 13 22.230 0.20 . 1 . . . . . . . . 4384 1 675 . 1 1 71 71 LEU HD21 H 1 0.719 0.08 . 2 . . . . . . . . 4384 1 676 . 1 1 71 71 LEU HD22 H 1 0.719 0.08 . 2 . . . . . . . . 4384 1 677 . 1 1 71 71 LEU HD23 H 1 0.719 0.08 . 2 . . . . . . . . 4384 1 678 . 1 1 72 72 PRO CA C 13 66.518 0.20 . 1 . . . . . . . . 4384 1 679 . 1 1 72 72 PRO HA H 1 4.376 0.08 . 1 . . . . . . . . 4384 1 680 . 1 1 72 72 PRO CB C 13 31.215 0.20 . 1 . . . . . . . . 4384 1 681 . 1 1 72 72 PRO HB3 H 1 2.045 0.08 . 2 . . . . . . . . 4384 1 682 . 1 1 72 72 PRO HB2 H 1 2.569 0.08 . 2 . . . . . . . . 4384 1 683 . 1 1 72 72 PRO C C 13 178.971 0.05 . 1 . . . . . . . . 4384 1 684 . 1 1 73 73 HIS N N 15 116.022 0.05 . 1 . . . . . . . . 4384 1 685 . 1 1 73 73 HIS H H 1 8.943 0.02 . 1 . . . . . . . . 4384 1 686 . 1 1 73 73 HIS CA C 13 60.640 0.20 . 1 . . . . . . . . 4384 1 687 . 1 1 73 73 HIS HA H 1 4.113 0.08 . 1 . . . . . . . . 4384 1 688 . 1 1 73 73 HIS CB C 13 32.370 0.20 . 1 . . . . . . . . 4384 1 689 . 1 1 73 73 HIS HB3 H 1 2.417 0.08 . 2 . . . . . . . . 4384 1 690 . 1 1 73 73 HIS HB2 H 1 3.170 0.08 . 2 . . . . . . . . 4384 1 691 . 1 1 73 73 HIS C C 13 177.238 0.05 . 1 . . . . . . . . 4384 1 692 . 1 1 74 74 ASP N N 15 115.395 0.05 . 1 . . . . . . . . 4384 1 693 . 1 1 74 74 ASP H H 1 7.047 0.02 . 1 . . . . . . . . 4384 1 694 . 1 1 74 74 ASP CA C 13 57.391 0.20 . 1 . . . . . . . . 4384 1 695 . 1 1 74 74 ASP HA H 1 4.542 0.08 . 1 . . . . . . . . 4384 1 696 . 1 1 74 74 ASP CB C 13 43.123 0.20 . 1 . . . . . . . . 4384 1 697 . 1 1 74 74 ASP HB3 H 1 2.648 0.08 . 2 . . . . . . . . 4384 1 698 . 1 1 74 74 ASP HB2 H 1 3.145 0.08 . 2 . . . . . . . . 4384 1 699 . 1 1 74 74 ASP C C 13 179.170 0.05 . 1 . . . . . . . . 4384 1 700 . 1 1 75 75 VAL N N 15 116.922 0.05 . 1 . . . . . . . . 4384 1 701 . 1 1 75 75 VAL H H 1 8.176 0.02 . 1 . . . . . . . . 4384 1 702 . 1 1 75 75 VAL CA C 13 66.392 0.20 . 1 . . . . . . . . 4384 1 703 . 1 1 75 75 VAL HA H 1 3.522 0.08 . 1 . . . . . . . . 4384 1 704 . 1 1 75 75 VAL CB C 13 31.625 0.20 . 1 . . . . . . . . 4384 1 705 . 1 1 75 75 VAL HB H 1 1.927 0.08 . 1 . . . . . . . . 4384 1 706 . 1 1 75 75 VAL CG2 C 13 23.147 0.20 . 1 . . . . . . . . 4384 1 707 . 1 1 75 75 VAL HG21 H 1 0.949 0.08 . 2 . . . . . . . . 4384 1 708 . 1 1 75 75 VAL HG22 H 1 0.949 0.08 . 2 . . . . . . . . 4384 1 709 . 1 1 75 75 VAL HG23 H 1 0.949 0.08 . 2 . . . . . . . . 4384 1 710 . 1 1 75 75 VAL CG1 C 13 23.374 0.20 . 1 . . . . . . . . 4384 1 711 . 1 1 75 75 VAL HG11 H 1 0.745 0.08 . 1 . . . . . . . . 4384 1 712 . 1 1 75 75 VAL HG12 H 1 0.745 0.08 . 1 . . . . . . . . 4384 1 713 . 1 1 75 75 VAL HG13 H 1 0.745 0.08 . 1 . . . . . . . . 4384 1 714 . 1 1 75 75 VAL C C 13 177.046 0.05 . 1 . . . . . . . . 4384 1 715 . 1 1 76 76 THR N N 15 111.117 0.05 . 1 . . . . . . . . 4384 1 716 . 1 1 76 76 THR H H 1 8.194 0.02 . 1 . . . . . . . . 4384 1 717 . 1 1 76 76 THR CA C 13 65.780 0.20 . 1 . . . . . . . . 4384 1 718 . 1 1 76 76 THR HA H 1 3.805 0.08 . 1 . . . . . . . . 4384 1 719 . 1 1 76 76 THR CB C 13 68.327 0.20 . 1 . . . . . . . . 4384 1 720 . 1 1 76 76 THR HB H 1 4.387 0.08 . 1 . . . . . . . . 4384 1 721 . 1 1 76 76 THR CG2 C 13 23.253 0.20 . 1 . . . . . . . . 4384 1 722 . 1 1 76 76 THR HG21 H 1 1.494 0.08 . 1 . . . . . . . . 4384 1 723 . 1 1 76 76 THR HG22 H 1 1.494 0.08 . 1 . . . . . . . . 4384 1 724 . 1 1 76 76 THR HG23 H 1 1.494 0.08 . 1 . . . . . . . . 4384 1 725 . 1 1 76 76 THR C C 13 177.072 0.05 . 1 . . . . . . . . 4384 1 726 . 1 1 77 77 ASN N N 15 119.194 0.05 . 1 . . . . . . . . 4384 1 727 . 1 1 77 77 ASN H H 1 7.223 0.02 . 1 . . . . . . . . 4384 1 728 . 1 1 77 77 ASN CA C 13 56.939 0.20 . 1 . . . . . . . . 4384 1 729 . 1 1 77 77 ASN HA H 1 4.228 0.08 . 1 . . . . . . . . 4384 1 730 . 1 1 77 77 ASN CB C 13 38.690 0.20 . 1 . . . . . . . . 4384 1 731 . 1 1 77 77 ASN HB3 H 1 2.569 0.08 . 2 . . . . . . . . 4384 1 732 . 1 1 77 77 ASN HB2 H 1 2.696 0.08 . 2 . . . . . . . . 4384 1 733 . 1 1 77 77 ASN CG C 13 176.946 0.20 . 1 . . . . . . . . 4384 1 734 . 1 1 77 77 ASN ND2 N 15 113.302 0.05 . 1 . . . . . . . . 4384 1 735 . 1 1 77 77 ASN HD21 H 1 7.565 0.02 . 1 . . . . . . . . 4384 1 736 . 1 1 77 77 ASN HD22 H 1 6.497 0.02 . 1 . . . . . . . . 4384 1 737 . 1 1 77 77 ASN C C 13 176.722 0.05 . 1 . . . . . . . . 4384 1 738 . 1 1 78 78 LEU N N 15 119.444 0.05 . 1 . . . . . . . . 4384 1 739 . 1 1 78 78 LEU H H 1 7.801 0.02 . 1 . . . . . . . . 4384 1 740 . 1 1 78 78 LEU CA C 13 58.309 0.20 . 1 . . . . . . . . 4384 1 741 . 1 1 78 78 LEU HA H 1 3.835 0.08 . 1 . . . . . . . . 4384 1 742 . 1 1 78 78 LEU CB C 13 42.163 0.20 . 1 . . . . . . . . 4384 1 743 . 1 1 78 78 LEU HB3 H 1 1.509 0.08 . 2 . . . . . . . . 4384 1 744 . 1 1 78 78 LEU HB2 H 1 1.800 0.08 . 2 . . . . . . . . 4384 1 745 . 1 1 78 78 LEU CG C 13 27.132 0.20 . 1 . . . . . . . . 4384 1 746 . 1 1 78 78 LEU HG H 1 1.319 0.08 . 1 . . . . . . . . 4384 1 747 . 1 1 78 78 LEU CD1 C 13 24.916 0.20 . 1 . . . . . . . . 4384 1 748 . 1 1 78 78 LEU HD11 H 1 0.737 0.08 . 1 . . . . . . . . 4384 1 749 . 1 1 78 78 LEU HD12 H 1 0.737 0.08 . 1 . . . . . . . . 4384 1 750 . 1 1 78 78 LEU HD13 H 1 0.737 0.08 . 1 . . . . . . . . 4384 1 751 . 1 1 78 78 LEU CD2 C 13 26.161 0.20 . 1 . . . . . . . . 4384 1 752 . 1 1 78 78 LEU HD21 H 1 0.603 0.08 . 2 . . . . . . . . 4384 1 753 . 1 1 78 78 LEU HD22 H 1 0.603 0.08 . 2 . . . . . . . . 4384 1 754 . 1 1 78 78 LEU HD23 H 1 0.603 0.08 . 2 . . . . . . . . 4384 1 755 . 1 1 78 78 LEU C C 13 178.035 0.05 . 1 . . . . . . . . 4384 1 756 . 1 1 79 79 MET N N 15 114.779 0.05 . 1 . . . . . . . . 4384 1 757 . 1 1 79 79 MET H H 1 7.559 0.02 . 1 . . . . . . . . 4384 1 758 . 1 1 79 79 MET CA C 13 56.547 0.20 . 1 . . . . . . . . 4384 1 759 . 1 1 79 79 MET HA H 1 3.986 0.08 . 1 . . . . . . . . 4384 1 760 . 1 1 79 79 MET CB C 13 32.455 0.20 . 1 . . . . . . . . 4384 1 761 . 1 1 79 79 MET HB3 H 1 1.868 0.08 . 2 . . . . . . . . 4384 1 762 . 1 1 79 79 MET HB2 H 1 2.215 0.08 . 2 . . . . . . . . 4384 1 763 . 1 1 79 79 MET CG C 13 32.395 0.20 . 1 . . . . . . . . 4384 1 764 . 1 1 79 79 MET HG3 H 1 0.325 0.08 . 2 . . . . . . . . 4384 1 765 . 1 1 79 79 MET HG2 H 1 1.658 0.08 . 2 . . . . . . . . 4384 1 766 . 1 1 79 79 MET CE C 13 18.250 0.20 . 1 . . . . . . . . 4384 1 767 . 1 1 79 79 MET HE1 H 1 1.346 0.20 . 1 . . . . . . . . 4384 1 768 . 1 1 79 79 MET HE2 H 1 1.346 0.20 . 1 . . . . . . . . 4384 1 769 . 1 1 79 79 MET HE3 H 1 1.346 0.20 . 1 . . . . . . . . 4384 1 770 . 1 1 79 79 MET C C 13 177.542 0.05 . 1 . . . . . . . . 4384 1 771 . 1 1 80 80 ARG N N 15 118.568 0.05 . 1 . . . . . . . . 4384 1 772 . 1 1 80 80 ARG H H 1 7.809 0.02 . 1 . . . . . . . . 4384 1 773 . 1 1 80 80 ARG CA C 13 58.501 0.20 . 1 . . . . . . . . 4384 1 774 . 1 1 80 80 ARG HA H 1 3.297 0.08 . 1 . . . . . . . . 4384 1 775 . 1 1 80 80 ARG CB C 13 29.769 0.20 . 1 . . . . . . . . 4384 1 776 . 1 1 80 80 ARG HB3 H 1 1.324 0.08 . 2 . . . . . . . . 4384 1 777 . 1 1 80 80 ARG HB2 H 1 1.522 0.08 . 2 . . . . . . . . 4384 1 778 . 1 1 80 80 ARG CG C 13 27.388 0.20 . 1 . . . . . . . . 4384 1 779 . 1 1 80 80 ARG HG3 H 1 1.099 0.08 . 2 . . . . . . . . 4384 1 780 . 1 1 80 80 ARG HG2 H 1 1.172 0.08 . 2 . . . . . . . . 4384 1 781 . 1 1 80 80 ARG CD C 13 43.129 0.20 . 1 . . . . . . . . 4384 1 782 . 1 1 80 80 ARG HD3 H 1 2.771 0.08 . 2 . . . . . . . . 4384 1 783 . 1 1 80 80 ARG HD2 H 1 2.920 0.08 . 2 . . . . . . . . 4384 1 784 . 1 1 80 80 ARG C C 13 178.563 0.05 . 1 . . . . . . . . 4384 1 785 . 1 1 81 81 VAL N N 15 116.201 0.05 . 1 . . . . . . . . 4384 1 786 . 1 1 81 81 VAL H H 1 7.279 0.02 . 1 . . . . . . . . 4384 1 787 . 1 1 81 81 VAL CA C 13 65.289 0.20 . 1 . . . . . . . . 4384 1 788 . 1 1 81 81 VAL HA H 1 3.708 0.08 . 1 . . . . . . . . 4384 1 789 . 1 1 81 81 VAL CB C 13 32.136 0.20 . 1 . . . . . . . . 4384 1 790 . 1 1 81 81 VAL HB H 1 1.999 0.08 . 1 . . . . . . . . 4384 1 791 . 1 1 81 81 VAL CG2 C 13 22.445 0.20 . 1 . . . . . . . . 4384 1 792 . 1 1 81 81 VAL HG21 H 1 0.950 0.08 . 2 . . . . . . . . 4384 1 793 . 1 1 81 81 VAL HG22 H 1 0.950 0.08 . 2 . . . . . . . . 4384 1 794 . 1 1 81 81 VAL HG23 H 1 0.950 0.08 . 2 . . . . . . . . 4384 1 795 . 1 1 81 81 VAL CG1 C 13 21.590 0.20 . 1 . . . . . . . . 4384 1 796 . 1 1 81 81 VAL HG11 H 1 0.794 0.08 . 1 . . . . . . . . 4384 1 797 . 1 1 81 81 VAL HG12 H 1 0.794 0.08 . 1 . . . . . . . . 4384 1 798 . 1 1 81 81 VAL HG13 H 1 0.794 0.08 . 1 . . . . . . . . 4384 1 799 . 1 1 81 81 VAL C C 13 178.384 0.05 . 1 . . . . . . . . 4384 1 800 . 1 1 82 82 ILE N N 15 111.422 0.05 . 1 . . . . . . . . 4384 1 801 . 1 1 82 82 ILE H H 1 7.656 0.02 . 1 . . . . . . . . 4384 1 802 . 1 1 82 82 ILE CA C 13 63.658 0.20 . 1 . . . . . . . . 4384 1 803 . 1 1 82 82 ILE HA H 1 4.148 0.08 . 1 . . . . . . . . 4384 1 804 . 1 1 82 82 ILE CB C 13 38.671 0.20 . 1 . . . . . . . . 4384 1 805 . 1 1 82 82 ILE HB H 1 1.883 0.08 . 1 . . . . . . . . 4384 1 806 . 1 1 82 82 ILE CG1 C 13 27.319 0.20 . 1 . . . . . . . . 4384 1 807 . 1 1 82 82 ILE HG13 H 1 0.852 0.08 . 2 . . . . . . . . 4384 1 808 . 1 1 82 82 ILE HG12 H 1 1.538 0.08 . 2 . . . . . . . . 4384 1 809 . 1 1 82 82 ILE CD1 C 13 14.148 0.20 . 1 . . . . . . . . 4384 1 810 . 1 1 82 82 ILE HD11 H 1 0.506 0.08 . 1 . . . . . . . . 4384 1 811 . 1 1 82 82 ILE HD12 H 1 0.506 0.08 . 1 . . . . . . . . 4384 1 812 . 1 1 82 82 ILE HD13 H 1 0.506 0.08 . 1 . . . . . . . . 4384 1 813 . 1 1 82 82 ILE CG2 C 13 18.089 0.20 . 1 . . . . . . . . 4384 1 814 . 1 1 82 82 ILE HG21 H 1 0.817 0.08 . 1 . . . . . . . . 4384 1 815 . 1 1 82 82 ILE HG22 H 1 0.817 0.08 . 1 . . . . . . . . 4384 1 816 . 1 1 82 82 ILE HG23 H 1 0.817 0.08 . 1 . . . . . . . . 4384 1 817 . 1 1 82 82 ILE C C 13 175.756 0.05 . 1 . . . . . . . . 4384 1 818 . 1 1 83 83 LEU N N 15 118.876 0.05 . 1 . . . . . . . . 4384 1 819 . 1 1 83 83 LEU H H 1 7.926 0.02 . 1 . . . . . . . . 4384 1 820 . 1 1 83 83 LEU CA C 13 54.436 0.20 . 1 . . . . . . . . 4384 1 821 . 1 1 83 83 LEU HA H 1 4.620 0.08 . 1 . . . . . . . . 4384 1 822 . 1 1 83 83 LEU CB C 13 43.623 0.20 . 1 . . . . . . . . 4384 1 823 . 1 1 83 83 LEU HB3 H 1 1.941 0.08 . 2 . . . . . . . . 4384 1 824 . 1 1 83 83 LEU HB2 H 1 2.068 0.08 . 2 . . . . . . . . 4384 1 825 . 1 1 83 83 LEU CD1 C 13 27.094 0.20 . 1 . . . . . . . . 4384 1 826 . 1 1 83 83 LEU HD11 H 1 0.848 0.08 . 1 . . . . . . . . 4384 1 827 . 1 1 83 83 LEU HD12 H 1 0.848 0.08 . 1 . . . . . . . . 4384 1 828 . 1 1 83 83 LEU HD13 H 1 0.848 0.08 . 1 . . . . . . . . 4384 1 829 . 1 1 83 83 LEU CD2 C 13 23.447 0.20 . 1 . . . . . . . . 4384 1 830 . 1 1 83 83 LEU HD21 H 1 0.908 0.08 . 2 . . . . . . . . 4384 1 831 . 1 1 83 83 LEU HD22 H 1 0.908 0.08 . 2 . . . . . . . . 4384 1 832 . 1 1 83 83 LEU HD23 H 1 0.908 0.08 . 2 . . . . . . . . 4384 1 833 . 1 1 83 83 LEU C C 13 178.218 0.05 . 1 . . . . . . . . 4384 1 834 . 1 1 84 84 GLY N N 15 105.826 0.05 . 1 . . . . . . . . 4384 1 835 . 1 1 84 84 GLY H H 1 7.749 0.02 . 1 . . . . . . . . 4384 1 836 . 1 1 84 84 GLY CA C 13 44.168 0.20 . 1 . . . . . . . . 4384 1 837 . 1 1 84 84 GLY HA3 H 1 3.700 0.08 . 2 . . . . . . . . 4384 1 838 . 1 1 84 84 GLY HA2 H 1 4.061 0.08 . 2 . . . . . . . . 4384 1 839 . 1 1 84 84 GLY C C 13 172.067 0.05 . 1 . . . . . . . . 4384 1 840 . 1 1 85 85 PRO CA C 13 66.809 0.20 . 1 . . . . . . . . 4384 1 841 . 1 1 85 85 PRO HA H 1 4.185 0.08 . 1 . . . . . . . . 4384 1 842 . 1 1 85 85 PRO CD C 13 49.883 0.20 . 1 . . . . . . . . 4384 1 843 . 1 1 85 85 PRO HD2 H 1 3.637 0.08 . 2 . . . . . . . . 4384 1 844 . 1 1 85 85 PRO C C 13 179.628 0.05 . 1 . . . . . . . . 4384 1 845 . 1 1 86 86 ALA N N 15 119.842 0.05 . 1 . . . . . . . . 4384 1 846 . 1 1 86 86 ALA H H 1 8.947 0.02 . 1 . . . . . . . . 4384 1 847 . 1 1 86 86 ALA CA C 13 56.232 0.20 . 1 . . . . . . . . 4384 1 848 . 1 1 86 86 ALA HA H 1 4.613 0.08 . 1 . . . . . . . . 4384 1 849 . 1 1 86 86 ALA CB C 13 15.770 0.20 . 1 . . . . . . . . 4384 1 850 . 1 1 86 86 ALA HB1 H 1 1.566 0.08 . 1 . . . . . . . . 4384 1 851 . 1 1 86 86 ALA HB2 H 1 1.566 0.08 . 1 . . . . . . . . 4384 1 852 . 1 1 86 86 ALA HB3 H 1 1.566 0.08 . 1 . . . . . . . . 4384 1 853 . 1 1 86 86 ALA C C 13 177.940 0.05 . 1 . . . . . . . . 4384 1 854 . 1 1 87 87 PRO CA C 13 65.492 0.20 . 1 . . . . . . . . 4384 1 855 . 1 1 87 87 PRO HA H 1 4.389 0.08 . 1 . . . . . . . . 4384 1 856 . 1 1 87 87 PRO CB C 13 30.839 0.20 . 1 . . . . . . . . 4384 1 857 . 1 1 87 87 PRO HB3 H 1 1.939 0.08 . 2 . . . . . . . . 4384 1 858 . 1 1 87 87 PRO HB2 H 1 2.219 0.08 . 2 . . . . . . . . 4384 1 859 . 1 1 87 87 PRO CG C 13 28.712 0.20 . 1 . . . . . . . . 4384 1 860 . 1 1 87 87 PRO HG3 H 1 1.998 0.08 . 2 . . . . . . . . 4384 1 861 . 1 1 87 87 PRO HG2 H 1 2.273 0.08 . 2 . . . . . . . . 4384 1 862 . 1 1 87 87 PRO CD C 13 50.290 0.20 . 1 . . . . . . . . 4384 1 863 . 1 1 87 87 PRO HD3 H 1 3.548 0.08 . 2 . . . . . . . . 4384 1 864 . 1 1 87 87 PRO HD2 H 1 3.802 0.08 . 2 . . . . . . . . 4384 1 865 . 1 1 87 87 PRO C C 13 177.978 0.05 . 1 . . . . . . . . 4384 1 866 . 1 1 88 88 TYR N N 15 118.235 0.05 . 1 . . . . . . . . 4384 1 867 . 1 1 88 88 TYR H H 1 8.650 0.02 . 1 . . . . . . . . 4384 1 868 . 1 1 88 88 TYR CA C 13 62.478 0.20 . 1 . . . . . . . . 4384 1 869 . 1 1 88 88 TYR HA H 1 4.242 0.08 . 1 . . . . . . . . 4384 1 870 . 1 1 88 88 TYR CB C 13 38.774 0.20 . 1 . . . . . . . . 4384 1 871 . 1 1 88 88 TYR HB2 H 1 3.108 0.08 . 2 . . . . . . . . 4384 1 872 . 1 1 88 88 TYR CD1 C 13 132.597 0.20 . 1 . . . . . . . . 4384 1 873 . 1 1 88 88 TYR HD1 H 1 6.914 0.08 . 3 . . . . . . . . 4384 1 874 . 1 1 88 88 TYR CE1 C 13 118.710 0.20 . 1 . . . . . . . . 4384 1 875 . 1 1 88 88 TYR HE1 H 1 6.851 0.08 . 3 . . . . . . . . 4384 1 876 . 1 1 88 88 TYR C C 13 175.875 0.05 . 1 . . . . . . . . 4384 1 877 . 1 1 89 89 ALA N N 15 121.466 0.05 . 1 . . . . . . . . 4384 1 878 . 1 1 89 89 ALA H H 1 7.780 0.02 . 1 . . . . . . . . 4384 1 879 . 1 1 89 89 ALA CA C 13 55.220 0.20 . 1 . . . . . . . . 4384 1 880 . 1 1 89 89 ALA HA H 1 4.040 0.08 . 1 . . . . . . . . 4384 1 881 . 1 1 89 89 ALA CB C 13 18.033 0.20 . 1 . . . . . . . . 4384 1 882 . 1 1 89 89 ALA HB1 H 1 1.614 0.08 . 1 . . . . . . . . 4384 1 883 . 1 1 89 89 ALA HB2 H 1 1.614 0.08 . 1 . . . . . . . . 4384 1 884 . 1 1 89 89 ALA HB3 H 1 1.614 0.08 . 1 . . . . . . . . 4384 1 885 . 1 1 89 89 ALA C C 13 181.222 0.05 . 1 . . . . . . . . 4384 1 886 . 1 1 90 90 LEU N N 15 117.757 0.05 . 1 . . . . . . . . 4384 1 887 . 1 1 90 90 LEU H H 1 7.558 0.02 . 1 . . . . . . . . 4384 1 888 . 1 1 90 90 LEU CA C 13 57.745 0.20 . 1 . . . . . . . . 4384 1 889 . 1 1 90 90 LEU HA H 1 4.165 0.08 . 1 . . . . . . . . 4384 1 890 . 1 1 90 90 LEU CB C 13 42.250 0.20 . 1 . . . . . . . . 4384 1 891 . 1 1 90 90 LEU HB3 H 1 1.562 0.08 . 2 . . . . . . . . 4384 1 892 . 1 1 90 90 LEU HB2 H 1 2.053 0.08 . 2 . . . . . . . . 4384 1 893 . 1 1 90 90 LEU CG C 13 27.045 0.20 . 1 . . . . . . . . 4384 1 894 . 1 1 90 90 LEU HG H 1 1.802 0.08 . 1 . . . . . . . . 4384 1 895 . 1 1 90 90 LEU CD1 C 13 25.045 0.20 . 1 . . . . . . . . 4384 1 896 . 1 1 90 90 LEU HD11 H 1 0.889 0.08 . 1 . . . . . . . . 4384 1 897 . 1 1 90 90 LEU HD12 H 1 0.889 0.08 . 1 . . . . . . . . 4384 1 898 . 1 1 90 90 LEU HD13 H 1 0.889 0.08 . 1 . . . . . . . . 4384 1 899 . 1 1 90 90 LEU CD2 C 13 23.330 0.20 . 1 . . . . . . . . 4384 1 900 . 1 1 90 90 LEU HD21 H 1 0.908 0.08 . 2 . . . . . . . . 4384 1 901 . 1 1 90 90 LEU HD22 H 1 0.908 0.08 . 2 . . . . . . . . 4384 1 902 . 1 1 90 90 LEU HD23 H 1 0.908 0.08 . 2 . . . . . . . . 4384 1 903 . 1 1 90 90 LEU C C 13 178.609 0.05 . 1 . . . . . . . . 4384 1 904 . 1 1 91 91 TRP N N 15 121.334 0.05 . 9 . . . . . . . . 4384 1 905 . 1 1 91 91 TRP H H 1 9.158 0.02 . 9 . . . . . . . . 4384 1 906 . 1 1 91 91 TRP CA C 13 63.071 0.20 . 1 . . . . . . . . 4384 1 907 . 1 1 91 91 TRP HA H 1 3.735 0.08 . 1 . . . . . . . . 4384 1 908 . 1 1 91 91 TRP CB C 13 28.077 0.20 . 1 . . . . . . . . 4384 1 909 . 1 1 91 91 TRP HB3 H 1 3.031 0.08 . 2 . . . . . . . . 4384 1 910 . 1 1 91 91 TRP HB2 H 1 3.544 0.08 . 2 . . . . . . . . 4384 1 911 . 1 1 91 91 TRP CD1 C 13 123.842 0.20 . 1 . . . . . . . . 4384 1 912 . 1 1 91 91 TRP HD1 H 1 6.657 0.08 . 2 . . . . . . . . 4384 1 913 . 1 1 91 91 TRP NE1 N 15 125.374 0.05 . 1 . . . . . . . . 4384 1 914 . 1 1 91 91 TRP HE1 H 1 9.477 0.08 . 1 . . . . . . . . 4384 1 915 . 1 1 91 91 TRP CZ2 C 13 111.182 0.20 . 1 . . . . . . . . 4384 1 916 . 1 1 91 91 TRP HZ2 H 1 6.015 0.08 . 1 . . . . . . . . 4384 1 917 . 1 1 91 91 TRP CH2 C 13 124.279 0.20 . 1 . . . . . . . . 4384 1 918 . 1 1 91 91 TRP HH2 H 1 5.403 0.08 . 1 . . . . . . . . 4384 1 919 . 1 1 91 91 TRP CZ3 C 13 120.698 0.20 . 1 . . . . . . . . 4384 1 920 . 1 1 91 91 TRP HZ3 H 1 6.759 0.08 . 1 . . . . . . . . 4384 1 921 . 1 1 91 91 TRP CE3 C 13 118.041 0.20 . 1 . . . . . . . . 4384 1 922 . 1 1 91 91 TRP HE3 H 1 6.818 0.08 . 1 . . . . . . . . 4384 1 923 . 1 1 91 91 TRP C C 13 176.418 0.05 . 1 . . . . . . . . 4384 1 924 . 1 1 92 92 MET N N 15 120.133 0.05 . 1 . . . . . . . . 4384 1 925 . 1 1 92 92 MET H H 1 8.910 0.02 . 1 . . . . . . . . 4384 1 926 . 1 1 92 92 MET CA C 13 57.971 0.20 . 1 . . . . . . . . 4384 1 927 . 1 1 92 92 MET HA H 1 3.588 0.08 . 1 . . . . . . . . 4384 1 928 . 1 1 92 92 MET CB C 13 31.021 0.20 . 1 . . . . . . . . 4384 1 929 . 1 1 92 92 MET HB3 H 1 1.916 0.08 . 2 . . . . . . . . 4384 1 930 . 1 1 92 92 MET HB2 H 1 2.048 0.08 . 2 . . . . . . . . 4384 1 931 . 1 1 92 92 MET HG3 H 1 2.447 0.08 . 2 . . . . . . . . 4384 1 932 . 1 1 92 92 MET HG2 H 1 2.574 0.08 . 2 . . . . . . . . 4384 1 933 . 1 1 92 92 MET CE C 13 17.300 0.20 . 1 . . . . . . . . 4384 1 934 . 1 1 92 92 MET HE1 H 1 2.321 0.20 . 1 . . . . . . . . 4384 1 935 . 1 1 92 92 MET HE2 H 1 2.321 0.20 . 1 . . . . . . . . 4384 1 936 . 1 1 92 92 MET HE3 H 1 2.321 0.20 . 1 . . . . . . . . 4384 1 937 . 1 1 92 92 MET C C 13 179.933 0.05 . 1 . . . . . . . . 4384 1 938 . 1 1 93 93 ASP N N 15 120.561 0.05 . 1 . . . . . . . . 4384 1 939 . 1 1 93 93 ASP H H 1 7.450 0.02 . 1 . . . . . . . . 4384 1 940 . 1 1 93 93 ASP CA C 13 57.265 0.20 . 1 . . . . . . . . 4384 1 941 . 1 1 93 93 ASP HA H 1 4.331 0.08 . 1 . . . . . . . . 4384 1 942 . 1 1 93 93 ASP CB C 13 40.398 0.20 . 1 . . . . . . . . 4384 1 943 . 1 1 93 93 ASP HB2 H 1 2.646 0.08 . 2 . . . . . . . . 4384 1 944 . 1 1 93 93 ASP C C 13 178.540 0.05 . 1 . . . . . . . . 4384 1 945 . 1 1 94 94 ALA N N 15 123.500 0.05 . 1 . . . . . . . . 4384 1 946 . 1 1 94 94 ALA H H 1 8.058 0.02 . 1 . . . . . . . . 4384 1 947 . 1 1 94 94 ALA CA C 13 55.055 0.20 . 1 . . . . . . . . 4384 1 948 . 1 1 94 94 ALA HA H 1 4.135 0.08 . 1 . . . . . . . . 4384 1 949 . 1 1 94 94 ALA CB C 13 17.822 0.20 . 1 . . . . . . . . 4384 1 950 . 1 1 94 94 ALA HB1 H 1 1.429 0.08 . 1 . . . . . . . . 4384 1 951 . 1 1 94 94 ALA HB2 H 1 1.429 0.08 . 1 . . . . . . . . 4384 1 952 . 1 1 94 94 ALA HB3 H 1 1.429 0.08 . 1 . . . . . . . . 4384 1 953 . 1 1 94 94 ALA C C 13 180.448 0.05 . 1 . . . . . . . . 4384 1 954 . 1 1 95 95 TRP N N 15 123.326 0.05 . 1 . . . . . . . . 4384 1 955 . 1 1 95 95 TRP H H 1 9.460 0.02 . 1 . . . . . . . . 4384 1 956 . 1 1 95 95 TRP CA C 13 59.355 0.20 . 1 . . . . . . . . 4384 1 957 . 1 1 95 95 TRP HA H 1 3.933 0.08 . 1 . . . . . . . . 4384 1 958 . 1 1 95 95 TRP CB C 13 27.330 0.20 . 1 . . . . . . . . 4384 1 959 . 1 1 95 95 TRP HB3 H 1 1.511 0.08 . 2 . . . . . . . . 4384 1 960 . 1 1 95 95 TRP HB2 H 1 2.637 0.08 . 2 . . . . . . . . 4384 1 961 . 1 1 95 95 TRP CD1 C 13 122.305 0.20 . 1 . . . . . . . . 4384 1 962 . 1 1 95 95 TRP HD1 H 1 6.500 0.08 . 2 . . . . . . . . 4384 1 963 . 1 1 95 95 TRP NE1 N 15 123.185 0.05 . 1 . . . . . . . . 4384 1 964 . 1 1 95 95 TRP HE1 H 1 9.090 0.08 . 1 . . . . . . . . 4384 1 965 . 1 1 95 95 TRP CZ2 C 13 113.496 0.20 . 1 . . . . . . . . 4384 1 966 . 1 1 95 95 TRP HZ2 H 1 7.457 0.08 . 1 . . . . . . . . 4384 1 967 . 1 1 95 95 TRP CH2 C 13 124.633 0.20 . 1 . . . . . . . . 4384 1 968 . 1 1 95 95 TRP HH2 H 1 7.172 0.08 . 1 . . . . . . . . 4384 1 969 . 1 1 95 95 TRP CZ3 C 13 121.976 0.20 . 1 . . . . . . . . 4384 1 970 . 1 1 95 95 TRP HZ3 H 1 7.118 0.08 . 1 . . . . . . . . 4384 1 971 . 1 1 95 95 TRP CE3 C 13 120.908 0.20 . 1 . . . . . . . . 4384 1 972 . 1 1 95 95 TRP HE3 H 1 7.061 0.08 . 1 . . . . . . . . 4384 1 973 . 1 1 95 95 TRP C C 13 178.008 0.05 . 1 . . . . . . . . 4384 1 974 . 1 1 96 96 GLY N N 15 104.706 0.05 . 1 . . . . . . . . 4384 1 975 . 1 1 96 96 GLY H H 1 7.797 0.02 . 1 . . . . . . . . 4384 1 976 . 1 1 96 96 GLY CA C 13 47.737 0.20 . 1 . . . . . . . . 4384 1 977 . 1 1 96 96 GLY HA3 H 1 3.195 0.08 . 2 . . . . . . . . 4384 1 978 . 1 1 96 96 GLY HA2 H 1 3.933 0.08 . 2 . . . . . . . . 4384 1 979 . 1 1 96 96 GLY C C 13 176.201 0.05 . 1 . . . . . . . . 4384 1 980 . 1 1 97 97 VAL N N 15 121.920 0.05 . 1 . . . . . . . . 4384 1 981 . 1 1 97 97 VAL H H 1 7.553 0.02 . 1 . . . . . . . . 4384 1 982 . 1 1 97 97 VAL CA C 13 66.720 0.20 . 1 . . . . . . . . 4384 1 983 . 1 1 97 97 VAL HA H 1 3.600 0.08 . 1 . . . . . . . . 4384 1 984 . 1 1 97 97 VAL CB C 13 31.347 0.20 . 1 . . . . . . . . 4384 1 985 . 1 1 97 97 VAL HB H 1 2.165 0.08 . 1 . . . . . . . . 4384 1 986 . 1 1 97 97 VAL CG2 C 13 22.829 0.20 . 1 . . . . . . . . 4384 1 987 . 1 1 97 97 VAL HG21 H 1 1.002 0.08 . 2 . . . . . . . . 4384 1 988 . 1 1 97 97 VAL HG22 H 1 1.002 0.08 . 2 . . . . . . . . 4384 1 989 . 1 1 97 97 VAL HG23 H 1 1.002 0.08 . 2 . . . . . . . . 4384 1 990 . 1 1 97 97 VAL CG1 C 13 21.296 0.20 . 1 . . . . . . . . 4384 1 991 . 1 1 97 97 VAL HG11 H 1 0.866 0.08 . 1 . . . . . . . . 4384 1 992 . 1 1 97 97 VAL HG12 H 1 0.866 0.08 . 1 . . . . . . . . 4384 1 993 . 1 1 97 97 VAL HG13 H 1 0.866 0.08 . 1 . . . . . . . . 4384 1 994 . 1 1 97 97 VAL C C 13 179.741 0.05 . 1 . . . . . . . . 4384 1 995 . 1 1 98 98 GLN N N 15 119.018 0.05 . 1 . . . . . . . . 4384 1 996 . 1 1 98 98 GLN H H 1 7.941 0.02 . 1 . . . . . . . . 4384 1 997 . 1 1 98 98 GLN CA C 13 58.180 0.20 . 1 . . . . . . . . 4384 1 998 . 1 1 98 98 GLN HA H 1 3.958 0.08 . 1 . . . . . . . . 4384 1 999 . 1 1 98 98 GLN CB C 13 29.409 0.20 . 1 . . . . . . . . 4384 1 1000 . 1 1 98 98 GLN HB2 H 1 2.072 0.08 . 2 . . . . . . . . 4384 1 1001 . 1 1 98 98 GLN CG C 13 34.403 0.20 . 1 . . . . . . . . 4384 1 1002 . 1 1 98 98 GLN HG3 H 1 2.217 0.08 . 2 . . . . . . . . 4384 1 1003 . 1 1 98 98 GLN HG2 H 1 2.468 0.08 . 2 . . . . . . . . 4384 1 1004 . 1 1 98 98 GLN CD C 13 178.490 0.20 . 1 . . . . . . . . 4384 1 1005 . 1 1 98 98 GLN NE2 N 15 115.112 0.05 . 1 . . . . . . . . 4384 1 1006 . 1 1 98 98 GLN HE21 H 1 8.079 0.02 . 1 . . . . . . . . 4384 1 1007 . 1 1 98 98 GLN HE22 H 1 6.942 0.02 . 1 . . . . . . . . 4384 1 1008 . 1 1 98 98 GLN C C 13 180.176 0.05 . 1 . . . . . . . . 4384 1 1009 . 1 1 99 99 LEU N N 15 120.471 0.05 . 1 . . . . . . . . 4384 1 1010 . 1 1 99 99 LEU H H 1 8.908 0.02 . 1 . . . . . . . . 4384 1 1011 . 1 1 99 99 LEU CA C 13 57.765 0.20 . 1 . . . . . . . . 4384 1 1012 . 1 1 99 99 LEU HA H 1 3.844 0.08 . 1 . . . . . . . . 4384 1 1013 . 1 1 99 99 LEU CB C 13 41.875 0.20 . 1 . . . . . . . . 4384 1 1014 . 1 1 99 99 LEU HB2 H 1 1.611 0.08 . 2 . . . . . . . . 4384 1 1015 . 1 1 99 99 LEU CG C 13 25.987 0.20 . 1 . . . . . . . . 4384 1 1016 . 1 1 99 99 LEU HG H 1 1.114 0.08 . 1 . . . . . . . . 4384 1 1017 . 1 1 99 99 LEU CD1 C 13 25.019 0.20 . 1 . . . . . . . . 4384 1 1018 . 1 1 99 99 LEU HD11 H 1 -0.618 0.08 . 1 . . . . . . . . 4384 1 1019 . 1 1 99 99 LEU HD12 H 1 -0.618 0.08 . 1 . . . . . . . . 4384 1 1020 . 1 1 99 99 LEU HD13 H 1 -0.618 0.08 . 1 . . . . . . . . 4384 1 1021 . 1 1 99 99 LEU CD2 C 13 22.386 0.20 . 1 . . . . . . . . 4384 1 1022 . 1 1 99 99 LEU HD21 H 1 0.665 0.08 . 2 . . . . . . . . 4384 1 1023 . 1 1 99 99 LEU HD22 H 1 0.665 0.08 . 2 . . . . . . . . 4384 1 1024 . 1 1 99 99 LEU HD23 H 1 0.665 0.08 . 2 . . . . . . . . 4384 1 1025 . 1 1 99 99 LEU C C 13 179.539 0.05 . 1 . . . . . . . . 4384 1 1026 . 1 1 100 100 GLN N N 15 118.376 0.05 . 1 . . . . . . . . 4384 1 1027 . 1 1 100 100 GLN H H 1 8.082 0.02 . 1 . . . . . . . . 4384 1 1028 . 1 1 100 100 GLN CA C 13 59.282 0.20 . 1 . . . . . . . . 4384 1 1029 . 1 1 100 100 GLN HA H 1 3.932 0.08 . 1 . . . . . . . . 4384 1 1030 . 1 1 100 100 GLN CB C 13 27.917 0.20 . 1 . . . . . . . . 4384 1 1031 . 1 1 100 100 GLN HB3 H 1 2.132 0.08 . 2 . . . . . . . . 4384 1 1032 . 1 1 100 100 GLN HB2 H 1 2.264 0.08 . 2 . . . . . . . . 4384 1 1033 . 1 1 100 100 GLN CG C 13 34.242 0.20 . 1 . . . . . . . . 4384 1 1034 . 1 1 100 100 GLN HG3 H 1 2.355 0.08 . 2 . . . . . . . . 4384 1 1035 . 1 1 100 100 GLN HG2 H 1 2.406 0.08 . 2 . . . . . . . . 4384 1 1036 . 1 1 100 100 GLN CD C 13 180.085 0.20 . 1 . . . . . . . . 4384 1 1037 . 1 1 100 100 GLN NE2 N 15 110.889 0.05 . 1 . . . . . . . . 4384 1 1038 . 1 1 100 100 GLN HE21 H 1 7.095 0.02 . 1 . . . . . . . . 4384 1 1039 . 1 1 100 100 GLN HE22 H 1 6.691 0.02 . 1 . . . . . . . . 4384 1 1040 . 1 1 100 100 GLN C C 13 179.327 0.05 . 1 . . . . . . . . 4384 1 1041 . 1 1 101 101 THR N N 15 116.117 0.05 . 1 . . . . . . . . 4384 1 1042 . 1 1 101 101 THR H H 1 7.770 0.02 . 1 . . . . . . . . 4384 1 1043 . 1 1 101 101 THR CA C 13 66.150 0.20 . 1 . . . . . . . . 4384 1 1044 . 1 1 101 101 THR HA H 1 4.090 0.08 . 1 . . . . . . . . 4384 1 1045 . 1 1 101 101 THR CB C 13 68.452 0.20 . 1 . . . . . . . . 4384 1 1046 . 1 1 101 101 THR HB H 1 4.404 0.08 . 1 . . . . . . . . 4384 1 1047 . 1 1 101 101 THR CG2 C 13 21.899 0.20 . 1 . . . . . . . . 4384 1 1048 . 1 1 101 101 THR HG21 H 1 1.323 0.08 . 1 . . . . . . . . 4384 1 1049 . 1 1 101 101 THR HG22 H 1 1.323 0.08 . 1 . . . . . . . . 4384 1 1050 . 1 1 101 101 THR HG23 H 1 1.323 0.08 . 1 . . . . . . . . 4384 1 1051 . 1 1 101 101 THR C C 13 177.273 0.05 . 1 . . . . . . . . 4384 1 1052 . 1 1 102 102 VAL N N 15 125.075 0.05 . 1 . . . . . . . . 4384 1 1053 . 1 1 102 102 VAL H H 1 7.431 0.02 . 1 . . . . . . . . 4384 1 1054 . 1 1 102 102 VAL CA C 13 65.943 0.20 . 1 . . . . . . . . 4384 1 1055 . 1 1 102 102 VAL HA H 1 3.691 0.08 . 1 . . . . . . . . 4384 1 1056 . 1 1 102 102 VAL CB C 13 31.107 0.20 . 1 . . . . . . . . 4384 1 1057 . 1 1 102 102 VAL HB H 1 2.351 0.08 . 1 . . . . . . . . 4384 1 1058 . 1 1 102 102 VAL CG2 C 13 22.324 0.20 . 1 . . . . . . . . 4384 1 1059 . 1 1 102 102 VAL HG21 H 1 1.094 0.08 . 2 . . . . . . . . 4384 1 1060 . 1 1 102 102 VAL HG22 H 1 1.094 0.08 . 2 . . . . . . . . 4384 1 1061 . 1 1 102 102 VAL HG23 H 1 1.094 0.08 . 2 . . . . . . . . 4384 1 1062 . 1 1 102 102 VAL CG1 C 13 20.840 0.20 . 1 . . . . . . . . 4384 1 1063 . 1 1 102 102 VAL HG11 H 1 0.731 0.08 . 1 . . . . . . . . 4384 1 1064 . 1 1 102 102 VAL HG12 H 1 0.731 0.08 . 1 . . . . . . . . 4384 1 1065 . 1 1 102 102 VAL HG13 H 1 0.731 0.08 . 1 . . . . . . . . 4384 1 1066 . 1 1 102 102 VAL C C 13 177.056 0.05 . 1 . . . . . . . . 4384 1 1067 . 1 1 103 103 ILE N N 15 118.999 0.05 . 1 . . . . . . . . 4384 1 1068 . 1 1 103 103 ILE H H 1 8.006 0.02 . 1 . . . . . . . . 4384 1 1069 . 1 1 103 103 ILE CA C 13 63.287 0.20 . 1 . . . . . . . . 4384 1 1070 . 1 1 103 103 ILE HA H 1 3.304 0.08 . 1 . . . . . . . . 4384 1 1071 . 1 1 103 103 ILE CB C 13 36.299 0.20 . 1 . . . . . . . . 4384 1 1072 . 1 1 103 103 ILE HB H 1 1.939 0.08 . 1 . . . . . . . . 4384 1 1073 . 1 1 103 103 ILE CG1 C 13 28.722 0.20 . 1 . . . . . . . . 4384 1 1074 . 1 1 103 103 ILE HG13 H 1 1.211 0.08 . 2 . . . . . . . . 4384 1 1075 . 1 1 103 103 ILE HG12 H 1 1.273 0.08 . 2 . . . . . . . . 4384 1 1076 . 1 1 103 103 ILE CD1 C 13 12.451 0.20 . 1 . . . . . . . . 4384 1 1077 . 1 1 103 103 ILE HD11 H 1 0.514 0.08 . 1 . . . . . . . . 4384 1 1078 . 1 1 103 103 ILE HD12 H 1 0.514 0.08 . 1 . . . . . . . . 4384 1 1079 . 1 1 103 103 ILE HD13 H 1 0.514 0.08 . 1 . . . . . . . . 4384 1 1080 . 1 1 103 103 ILE CG2 C 13 17.812 0.20 . 1 . . . . . . . . 4384 1 1081 . 1 1 103 103 ILE HG21 H 1 0.803 0.08 . 1 . . . . . . . . 4384 1 1082 . 1 1 103 103 ILE HG22 H 1 0.803 0.08 . 1 . . . . . . . . 4384 1 1083 . 1 1 103 103 ILE HG23 H 1 0.803 0.08 . 1 . . . . . . . . 4384 1 1084 . 1 1 103 103 ILE C C 13 179.398 0.05 . 1 . . . . . . . . 4384 1 1085 . 1 1 104 104 ALA N N 15 124.385 0.05 . 1 . . . . . . . . 4384 1 1086 . 1 1 104 104 ALA H H 1 8.238 0.02 . 1 . . . . . . . . 4384 1 1087 . 1 1 104 104 ALA CA C 13 55.547 0.20 . 1 . . . . . . . . 4384 1 1088 . 1 1 104 104 ALA HA H 1 4.050 0.08 . 1 . . . . . . . . 4384 1 1089 . 1 1 104 104 ALA CB C 13 17.839 0.20 . 1 . . . . . . . . 4384 1 1090 . 1 1 104 104 ALA HB1 H 1 1.464 0.08 . 1 . . . . . . . . 4384 1 1091 . 1 1 104 104 ALA HB2 H 1 1.464 0.08 . 1 . . . . . . . . 4384 1 1092 . 1 1 104 104 ALA HB3 H 1 1.464 0.08 . 1 . . . . . . . . 4384 1 1093 . 1 1 104 104 ALA C C 13 180.604 0.05 . 1 . . . . . . . . 4384 1 1094 . 1 1 105 105 ALA N N 15 122.289 0.05 . 1 . . . . . . . . 4384 1 1095 . 1 1 105 105 ALA H H 1 7.623 0.02 . 1 . . . . . . . . 4384 1 1096 . 1 1 105 105 ALA CA C 13 55.282 0.20 . 1 . . . . . . . . 4384 1 1097 . 1 1 105 105 ALA HA H 1 4.131 0.08 . 1 . . . . . . . . 4384 1 1098 . 1 1 105 105 ALA CB C 13 18.286 0.20 . 1 . . . . . . . . 4384 1 1099 . 1 1 105 105 ALA HB1 H 1 1.623 0.08 . 1 . . . . . . . . 4384 1 1100 . 1 1 105 105 ALA HB2 H 1 1.623 0.08 . 1 . . . . . . . . 4384 1 1101 . 1 1 105 105 ALA HB3 H 1 1.623 0.08 . 1 . . . . . . . . 4384 1 1102 . 1 1 105 105 ALA C C 13 180.132 0.05 . 1 . . . . . . . . 4384 1 1103 . 1 1 106 106 ALA N N 15 121.025 0.05 . 1 . . . . . . . . 4384 1 1104 . 1 1 106 106 ALA H H 1 8.531 0.02 . 1 . . . . . . . . 4384 1 1105 . 1 1 106 106 ALA CA C 13 53.484 0.20 . 1 . . . . . . . . 4384 1 1106 . 1 1 106 106 ALA HA H 1 4.051 0.08 . 1 . . . . . . . . 4384 1 1107 . 1 1 106 106 ALA CB C 13 17.653 0.20 . 1 . . . . . . . . 4384 1 1108 . 1 1 106 106 ALA HB1 H 1 0.959 0.08 . 1 . . . . . . . . 4384 1 1109 . 1 1 106 106 ALA HB2 H 1 0.959 0.08 . 1 . . . . . . . . 4384 1 1110 . 1 1 106 106 ALA HB3 H 1 0.959 0.08 . 1 . . . . . . . . 4384 1 1111 . 1 1 106 106 ALA C C 13 178.604 0.05 . 1 . . . . . . . . 4384 1 1112 . 1 1 107 107 THR N N 15 114.102 0.05 . 1 . . . . . . . . 4384 1 1113 . 1 1 107 107 THR H H 1 7.911 0.02 . 1 . . . . . . . . 4384 1 1114 . 1 1 107 107 THR CA C 13 65.174 0.20 . 1 . . . . . . . . 4384 1 1115 . 1 1 107 107 THR HA H 1 3.955 0.08 . 1 . . . . . . . . 4384 1 1116 . 1 1 107 107 THR CB C 13 68.983 0.20 . 1 . . . . . . . . 4384 1 1117 . 1 1 107 107 THR HB H 1 4.270 0.08 . 1 . . . . . . . . 4384 1 1118 . 1 1 107 107 THR CG2 C 13 20.974 0.20 . 1 . . . . . . . . 4384 1 1119 . 1 1 107 107 THR HG21 H 1 1.213 0.08 . 1 . . . . . . . . 4384 1 1120 . 1 1 107 107 THR HG22 H 1 1.213 0.08 . 1 . . . . . . . . 4384 1 1121 . 1 1 107 107 THR HG23 H 1 1.213 0.08 . 1 . . . . . . . . 4384 1 1122 . 1 1 107 107 THR C C 13 175.246 0.05 . 1 . . . . . . . . 4384 1 1123 . 1 1 108 108 ARG N N 15 119.911 0.05 . 1 . . . . . . . . 4384 1 1124 . 1 1 108 108 ARG H H 1 7.337 0.02 . 1 . . . . . . . . 4384 1 1125 . 1 1 108 108 ARG CA C 13 57.737 0.20 . 1 . . . . . . . . 4384 1 1126 . 1 1 108 108 ARG HA H 1 4.248 0.08 . 1 . . . . . . . . 4384 1 1127 . 1 1 108 108 ARG CB C 13 31.042 0.20 . 1 . . . . . . . . 4384 1 1128 . 1 1 108 108 ARG HB2 H 1 1.899 0.08 . 2 . . . . . . . . 4384 1 1129 . 1 1 108 108 ARG CG C 13 27.384 0.20 . 1 . . . . . . . . 4384 1 1130 . 1 1 108 108 ARG HG2 H 1 1.696 0.08 . 2 . . . . . . . . 4384 1 1131 . 1 1 108 108 ARG CD C 13 43.507 0.20 . 1 . . . . . . . . 4384 1 1132 . 1 1 108 108 ARG HD2 H 1 3.245 0.08 . 2 . . . . . . . . 4384 1 1133 . 1 1 108 108 ARG C C 13 176.035 0.05 . 1 . . . . . . . . 4384 1 1134 . 1 1 109 109 ASP N N 15 116.790 0.05 . 1 . . . . . . . . 4384 1 1135 . 1 1 109 109 ASP H H 1 7.456 0.02 . 1 . . . . . . . . 4384 1 1136 . 1 1 109 109 ASP CA C 13 49.890 0.20 . 1 . . . . . . . . 4384 1 1137 . 1 1 109 109 ASP HA H 1 5.238 0.08 . 1 . . . . . . . . 4384 1 1138 . 1 1 109 109 ASP CB C 13 42.565 0.20 . 1 . . . . . . . . 4384 1 1139 . 1 1 109 109 ASP HB3 H 1 2.590 0.08 . 2 . . . . . . . . 4384 1 1140 . 1 1 109 109 ASP HB2 H 1 3.048 0.08 . 2 . . . . . . . . 4384 1 1141 . 1 1 109 109 ASP C C 13 174.456 0.05 . 1 . . . . . . . . 4384 1 1142 . 1 1 110 110 PRO CA C 13 64.713 0.20 . 1 . . . . . . . . 4384 1 1143 . 1 1 110 110 PRO HA H 1 4.276 0.08 . 1 . . . . . . . . 4384 1 1144 . 1 1 110 110 PRO CB C 13 32.950 0.20 . 1 . . . . . . . . 4384 1 1145 . 1 1 110 110 PRO HB3 H 1 1.967 0.08 . 2 . . . . . . . . 4384 1 1146 . 1 1 110 110 PRO HB2 H 1 2.437 0.08 . 2 . . . . . . . . 4384 1 1147 . 1 1 110 110 PRO CG C 13 27.413 0.20 . 1 . . . . . . . . 4384 1 1148 . 1 1 110 110 PRO HG2 H 1 2.050 0.08 . 2 . . . . . . . . 4384 1 1149 . 1 1 110 110 PRO CD C 13 51.117 0.20 . 1 . . . . . . . . 4384 1 1150 . 1 1 110 110 PRO HD3 H 1 3.866 0.08 . 2 . . . . . . . . 4384 1 1151 . 1 1 110 110 PRO HD2 H 1 4.033 0.08 . 2 . . . . . . . . 4384 1 1152 . 1 1 110 110 PRO C C 13 178.496 0.05 . 1 . . . . . . . . 4384 1 1153 . 1 1 111 111 ARG N N 15 115.229 0.05 . 1 . . . . . . . . 4384 1 1154 . 1 1 111 111 ARG H H 1 8.061 0.02 . 1 . . . . . . . . 4384 1 1155 . 1 1 111 111 ARG CA C 13 55.420 0.20 . 1 . . . . . . . . 4384 1 1156 . 1 1 111 111 ARG HA H 1 4.386 0.08 . 1 . . . . . . . . 4384 1 1157 . 1 1 111 111 ARG CB C 13 29.396 0.20 . 1 . . . . . . . . 4384 1 1158 . 1 1 111 111 ARG HB3 H 1 1.833 0.08 . 2 . . . . . . . . 4384 1 1159 . 1 1 111 111 ARG HB2 H 1 2.053 0.08 . 2 . . . . . . . . 4384 1 1160 . 1 1 111 111 ARG CG C 13 27.441 0.20 . 1 . . . . . . . . 4384 1 1161 . 1 1 111 111 ARG HG3 H 1 1.633 0.08 . 2 . . . . . . . . 4384 1 1162 . 1 1 111 111 ARG HG2 H 1 2.064 0.08 . 2 . . . . . . . . 4384 1 1163 . 1 1 111 111 ARG CD C 13 43.343 0.20 . 1 . . . . . . . . 4384 1 1164 . 1 1 111 111 ARG HD2 H 1 3.243 0.08 . 2 . . . . . . . . 4384 1 1165 . 1 1 111 111 ARG C C 13 175.845 0.05 . 1 . . . . . . . . 4384 1 1166 . 1 1 112 112 HIS N N 15 124.480 0.05 . 1 . . . . . . . . 4384 1 1167 . 1 1 112 112 HIS H H 1 7.876 0.02 . 1 . . . . . . . . 4384 1 1168 . 1 1 112 112 HIS CA C 13 56.963 0.20 . 1 . . . . . . . . 4384 1 1169 . 1 1 112 112 HIS HA H 1 4.325 0.08 . 1 . . . . . . . . 4384 1 1170 . 1 1 112 112 HIS CB C 13 32.370 0.20 . 1 . . . . . . . . 4384 1 1171 . 1 1 112 112 HIS HB3 H 1 3.081 0.08 . 2 . . . . . . . . 4384 1 1172 . 1 1 112 112 HIS HB2 H 1 3.407 0.08 . 2 . . . . . . . . 4384 1 1173 . 1 1 112 112 HIS CD2 C 13 118.049 0.20 . 1 . . . . . . . . 4384 1 1174 . 1 1 112 112 HIS HD2 H 1 7.040 0.08 . 2 . . . . . . . . 4384 1 1175 . 1 1 112 112 HIS CE1 C 13 137.863 0.20 . 1 . . . . . . . . 4384 1 1176 . 1 1 112 112 HIS HE1 H 1 7.481 0.08 . 1 . . . . . . . . 4384 1 1177 . 1 1 112 112 HIS C C 13 176.049 0.05 . 9 . . . . . . . . 4384 1 1178 . 1 1 113 113 PRO CA C 13 64.702 0.20 . 1 . . . . . . . . 4384 1 1179 . 1 1 113 113 PRO HA H 1 4.437 0.08 . 1 . . . . . . . . 4384 1 1180 . 1 1 113 113 PRO CB C 13 32.202 0.20 . 1 . . . . . . . . 4384 1 1181 . 1 1 113 113 PRO HB3 H 1 1.995 0.08 . 2 . . . . . . . . 4384 1 1182 . 1 1 113 113 PRO HB2 H 1 2.430 0.08 . 2 . . . . . . . . 4384 1 1183 . 1 1 113 113 PRO CG C 13 27.466 0.20 . 1 . . . . . . . . 4384 1 1184 . 1 1 113 113 PRO HG3 H 1 1.784 0.08 . 2 . . . . . . . . 4384 1 1185 . 1 1 113 113 PRO HG2 H 1 1.828 0.08 . 2 . . . . . . . . 4384 1 1186 . 1 1 113 113 PRO CD C 13 50.683 0.20 . 1 . . . . . . . . 4384 1 1187 . 1 1 113 113 PRO HD3 H 1 2.228 0.08 . 2 . . . . . . . . 4384 1 1188 . 1 1 113 113 PRO HD2 H 1 3.469 0.08 . 2 . . . . . . . . 4384 1 1189 . 1 1 113 113 PRO C C 13 177.464 0.05 . 1 . . . . . . . . 4384 1 1190 . 1 1 114 114 ALA N N 15 122.882 0.05 . 1 . . . . . . . . 4384 1 1191 . 1 1 114 114 ALA H H 1 11.136 0.02 . 1 . . . . . . . . 4384 1 1192 . 1 1 114 114 ALA CA C 13 53.519 0.20 . 1 . . . . . . . . 4384 1 1193 . 1 1 114 114 ALA HA H 1 4.055 0.08 . 1 . . . . . . . . 4384 1 1194 . 1 1 114 114 ALA CB C 13 18.465 0.20 . 1 . . . . . . . . 4384 1 1195 . 1 1 114 114 ALA HB1 H 1 1.355 0.08 . 1 . . . . . . . . 4384 1 1196 . 1 1 114 114 ALA HB2 H 1 1.355 0.08 . 1 . . . . . . . . 4384 1 1197 . 1 1 114 114 ALA HB3 H 1 1.355 0.08 . 1 . . . . . . . . 4384 1 1198 . 1 1 114 114 ALA C C 13 178.109 0.05 . 1 . . . . . . . . 4384 1 1199 . 1 1 115 115 ASN N N 15 117.240 0.05 . 1 . . . . . . . . 4384 1 1200 . 1 1 115 115 ASN H H 1 8.414 0.02 . 1 . . . . . . . . 4384 1 1201 . 1 1 115 115 ASN CA C 13 52.635 0.20 . 1 . . . . . . . . 4384 1 1202 . 1 1 115 115 ASN HA H 1 4.846 0.08 . 1 . . . . . . . . 4384 1 1203 . 1 1 115 115 ASN CB C 13 39.868 0.20 . 1 . . . . . . . . 4384 1 1204 . 1 1 115 115 ASN HB3 H 1 2.988 0.08 . 2 . . . . . . . . 4384 1 1205 . 1 1 115 115 ASN HB2 H 1 3.076 0.08 . 2 . . . . . . . . 4384 1 1206 . 1 1 115 115 ASN CG C 13 175.110 0.20 . 1 . . . . . . . . 4384 1 1207 . 1 1 115 115 ASN ND2 N 15 113.405 0.05 . 1 . . . . . . . . 4384 1 1208 . 1 1 115 115 ASN HD21 H 1 7.906 0.02 . 1 . . . . . . . . 4384 1 1209 . 1 1 115 115 ASN HD22 H 1 6.618 0.02 . 1 . . . . . . . . 4384 1 1210 . 1 1 115 115 ASN C C 13 176.616 0.05 . 1 . . . . . . . . 4384 1 1211 . 1 1 116 116 GLY N N 15 107.229 0.05 . 1 . . . . . . . . 4384 1 1212 . 1 1 116 116 GLY H H 1 8.623 0.02 . 1 . . . . . . . . 4384 1 1213 . 1 1 116 116 GLY CA C 13 44.647 0.20 . 1 . . . . . . . . 4384 1 1214 . 1 1 116 116 GLY HA3 H 1 3.871 0.08 . 2 . . . . . . . . 4384 1 1215 . 1 1 116 116 GLY HA2 H 1 4.372 0.08 . 2 . . . . . . . . 4384 1 1216 . 1 1 116 116 GLY C C 13 174.010 0.05 . 1 . . . . . . . . 4384 1 1217 . 1 1 117 117 GLN N N 15 118.972 0.05 . 1 . . . . . . . . 4384 1 1218 . 1 1 117 117 GLN H H 1 8.592 0.02 . 1 . . . . . . . . 4384 1 1219 . 1 1 117 117 GLN CA C 13 56.669 0.20 . 1 . . . . . . . . 4384 1 1220 . 1 1 117 117 GLN HA H 1 4.269 0.08 . 1 . . . . . . . . 4384 1 1221 . 1 1 117 117 GLN CB C 13 29.582 0.20 . 1 . . . . . . . . 4384 1 1222 . 1 1 117 117 GLN HB2 H 1 2.148 0.08 . 2 . . . . . . . . 4384 1 1223 . 1 1 117 117 GLN CG C 13 34.093 0.20 . 1 . . . . . . . . 4384 1 1224 . 1 1 117 117 GLN HG2 H 1 2.372 0.08 . 2 . . . . . . . . 4384 1 1225 . 1 1 117 117 GLN CD C 13 180.667 0.20 . 1 . . . . . . . . 4384 1 1226 . 1 1 117 117 GLN NE2 N 15 112.959 0.05 . 1 . . . . . . . . 4384 1 1227 . 1 1 117 117 GLN HE21 H 1 7.517 0.02 . 1 . . . . . . . . 4384 1 1228 . 1 1 117 117 GLN HE22 H 1 6.833 0.02 . 1 . . . . . . . . 4384 1 1229 . 1 1 117 117 GLN C C 13 177.377 0.05 . 1 . . . . . . . . 4384 1 1230 . 1 1 118 118 GLY N N 15 109.243 0.05 . 1 . . . . . . . . 4384 1 1231 . 1 1 118 118 GLY H H 1 8.541 0.02 . 1 . . . . . . . . 4384 1 1232 . 1 1 118 118 GLY CA C 13 44.690 0.20 . 1 . . . . . . . . 4384 1 1233 . 1 1 118 118 GLY HA3 H 1 3.831 0.08 . 2 . . . . . . . . 4384 1 1234 . 1 1 118 118 GLY HA2 H 1 4.075 0.08 . 2 . . . . . . . . 4384 1 1235 . 1 1 118 118 GLY C C 13 174.877 0.05 . 1 . . . . . . . . 4384 1 1236 . 1 1 119 119 ARG N N 15 121.799 0.05 . 1 . . . . . . . . 4384 1 1237 . 1 1 119 119 ARG H H 1 8.554 0.02 . 1 . . . . . . . . 4384 1 1238 . 1 1 119 119 ARG CA C 13 57.702 0.20 . 1 . . . . . . . . 4384 1 1239 . 1 1 119 119 ARG HA H 1 4.150 0.08 . 1 . . . . . . . . 4384 1 1240 . 1 1 119 119 ARG CB C 13 30.120 0.20 . 1 . . . . . . . . 4384 1 1241 . 1 1 119 119 ARG HB2 H 1 1.832 0.08 . 2 . . . . . . . . 4384 1 1242 . 1 1 119 119 ARG CG C 13 27.372 0.20 . 1 . . . . . . . . 4384 1 1243 . 1 1 119 119 ARG HG2 H 1 1.636 0.08 . 2 . . . . . . . . 4384 1 1244 . 1 1 119 119 ARG CD C 13 43.403 0.20 . 1 . . . . . . . . 4384 1 1245 . 1 1 119 119 ARG HD2 H 1 3.219 0.08 . 2 . . . . . . . . 4384 1 1246 . 1 1 119 119 ARG C C 13 177.975 0.05 . 1 . . . . . . . . 4384 1 1247 . 1 1 120 120 GLY N N 15 110.067 0.05 . 1 . . . . . . . . 4384 1 1248 . 1 1 120 120 GLY H H 1 8.728 0.02 . 1 . . . . . . . . 4384 1 1249 . 1 1 120 120 GLY CA C 13 45.707 0.20 . 1 . . . . . . . . 4384 1 1250 . 1 1 120 120 GLY HA3 H 1 3.955 0.08 . 2 . . . . . . . . 4384 1 1251 . 1 1 120 120 GLY HA2 H 1 4.020 0.08 . 2 . . . . . . . . 4384 1 1252 . 1 1 120 120 GLY C C 13 175.308 0.05 . 1 . . . . . . . . 4384 1 1253 . 1 1 121 121 GLU N N 15 120.221 0.05 . 1 . . . . . . . . 4384 1 1254 . 1 1 121 121 GLU H H 1 7.608 0.02 . 1 . . . . . . . . 4384 1 1255 . 1 1 121 121 GLU CA C 13 55.620 0.20 . 1 . . . . . . . . 4384 1 1256 . 1 1 121 121 GLU HA H 1 4.433 0.08 . 1 . . . . . . . . 4384 1 1257 . 1 1 121 121 GLU CB C 13 29.245 0.20 . 1 . . . . . . . . 4384 1 1258 . 1 1 121 121 GLU HB3 H 1 1.760 0.08 . 2 . . . . . . . . 4384 1 1259 . 1 1 121 121 GLU HB2 H 1 2.085 0.08 . 2 . . . . . . . . 4384 1 1260 . 1 1 121 121 GLU CG C 13 36.460 0.20 . 1 . . . . . . . . 4384 1 1261 . 1 1 121 121 GLU HG3 H 1 2.065 0.08 . 2 . . . . . . . . 4384 1 1262 . 1 1 121 121 GLU HG2 H 1 2.121 0.08 . 2 . . . . . . . . 4384 1 1263 . 1 1 121 121 GLU C C 13 176.907 0.05 . 1 . . . . . . . . 4384 1 1264 . 1 1 122 122 ARG N N 15 121.581 0.05 . 1 . . . . . . . . 4384 1 1265 . 1 1 122 122 ARG H H 1 7.796 0.02 . 1 . . . . . . . . 4384 1 1266 . 1 1 122 122 ARG CA C 13 55.166 0.20 . 1 . . . . . . . . 4384 1 1267 . 1 1 122 122 ARG HA H 1 4.445 0.08 . 1 . . . . . . . . 4384 1 1268 . 1 1 122 122 ARG CB C 13 31.526 0.20 . 1 . . . . . . . . 4384 1 1269 . 1 1 122 122 ARG HB2 H 1 1.818 0.08 . 2 . . . . . . . . 4384 1 1270 . 1 1 122 122 ARG CG C 13 27.286 0.20 . 1 . . . . . . . . 4384 1 1271 . 1 1 122 122 ARG HG2 H 1 1.710 0.08 . 2 . . . . . . . . 4384 1 1272 . 1 1 122 122 ARG CD C 13 43.435 0.20 . 1 . . . . . . . . 4384 1 1273 . 1 1 122 122 ARG HD2 H 1 3.223 0.08 . 2 . . . . . . . . 4384 1 1274 . 1 1 122 122 ARG HD3 H 1 3.151 0.08 . 2 . . . . . . . . 4384 1 1275 . 1 1 122 122 ARG C C 13 178.608 0.05 . 1 . . . . . . . . 4384 1 1276 . 1 1 123 123 THR N N 15 117.463 0.05 . 1 . . . . . . . . 4384 1 1277 . 1 1 123 123 THR H H 1 8.101 0.02 . 1 . . . . . . . . 4384 1 1278 . 1 1 123 123 THR CA C 13 63.001 0.20 . 1 . . . . . . . . 4384 1 1279 . 1 1 123 123 THR HA H 1 4.215 0.08 . 1 . . . . . . . . 4384 1 1280 . 1 1 123 123 THR CB C 13 66.458 0.20 . 1 . . . . . . . . 4384 1 1281 . 1 1 123 123 THR HB H 1 4.046 0.08 . 1 . . . . . . . . 4384 1 1282 . 1 1 123 123 THR CG2 C 13 19.409 0.20 . 1 . . . . . . . . 4384 1 1283 . 1 1 123 123 THR HG21 H 1 0.712 0.08 . 1 . . . . . . . . 4384 1 1284 . 1 1 123 123 THR HG22 H 1 0.712 0.08 . 1 . . . . . . . . 4384 1 1285 . 1 1 123 123 THR HG23 H 1 0.712 0.08 . 1 . . . . . . . . 4384 1 1286 . 1 1 123 123 THR C C 13 172.874 0.05 . 1 . . . . . . . . 4384 1 1287 . 1 1 124 124 ASN N N 15 114.164 0.05 . 1 . . . . . . . . 4384 1 1288 . 1 1 124 124 ASN H H 1 8.100 0.02 . 1 . . . . . . . . 4384 1 1289 . 1 1 124 124 ASN CA C 13 53.054 0.20 . 1 . . . . . . . . 4384 1 1290 . 1 1 124 124 ASN HA H 1 4.463 0.08 . 1 . . . . . . . . 4384 1 1291 . 1 1 124 124 ASN CB C 13 40.118 0.20 . 1 . . . . . . . . 4384 1 1292 . 1 1 124 124 ASN HB3 H 1 2.872 0.08 . 2 . . . . . . . . 4384 1 1293 . 1 1 124 124 ASN HB2 H 1 2.941 0.08 . 2 . . . . . . . . 4384 1 1294 . 1 1 124 124 ASN CG C 13 175.850 0.20 . 1 . . . . . . . . 4384 1 1295 . 1 1 124 124 ASN ND2 N 15 114.675 0.05 . 1 . . . . . . . . 4384 1 1296 . 1 1 124 124 ASN HD21 H 1 7.526 0.02 . 1 . . . . . . . . 4384 1 1297 . 1 1 124 124 ASN HD22 H 1 6.979 0.02 . 1 . . . . . . . . 4384 1 1298 . 1 1 124 124 ASN C C 13 174.388 0.05 . 1 . . . . . . . . 4384 1 1299 . 1 1 125 125 LEU N N 15 120.072 0.05 . 1 . . . . . . . . 4384 1 1300 . 1 1 125 125 LEU H H 1 8.768 0.02 . 1 . . . . . . . . 4384 1 1301 . 1 1 125 125 LEU CA C 13 58.226 0.20 . 1 . . . . . . . . 4384 1 1302 . 1 1 125 125 LEU HA H 1 3.717 0.08 . 1 . . . . . . . . 4384 1 1303 . 1 1 125 125 LEU CB C 13 42.449 0.20 . 1 . . . . . . . . 4384 1 1304 . 1 1 125 125 LEU HB3 H 1 1.337 0.08 . 2 . . . . . . . . 4384 1 1305 . 1 1 125 125 LEU HB2 H 1 1.662 0.08 . 2 . . . . . . . . 4384 1 1306 . 1 1 125 125 LEU CG C 13 26.683 0.20 . 1 . . . . . . . . 4384 1 1307 . 1 1 125 125 LEU HG H 1 1.480 0.08 . 1 . . . . . . . . 4384 1 1308 . 1 1 125 125 LEU CD1 C 13 24.651 0.20 . 1 . . . . . . . . 4384 1 1309 . 1 1 125 125 LEU HD11 H 1 0.700 0.08 . 1 . . . . . . . . 4384 1 1310 . 1 1 125 125 LEU HD12 H 1 0.700 0.08 . 1 . . . . . . . . 4384 1 1311 . 1 1 125 125 LEU HD13 H 1 0.700 0.08 . 1 . . . . . . . . 4384 1 1312 . 1 1 125 125 LEU CD2 C 13 25.442 0.20 . 1 . . . . . . . . 4384 1 1313 . 1 1 125 125 LEU HD21 H 1 0.744 0.08 . 2 . . . . . . . . 4384 1 1314 . 1 1 125 125 LEU HD22 H 1 0.744 0.08 . 2 . . . . . . . . 4384 1 1315 . 1 1 125 125 LEU HD23 H 1 0.744 0.08 . 2 . . . . . . . . 4384 1 1316 . 1 1 125 125 LEU C C 13 177.184 0.05 . 1 . . . . . . . . 4384 1 1317 . 1 1 126 126 ASP N N 15 116.731 0.05 . 1 . . . . . . . . 4384 1 1318 . 1 1 126 126 ASP H H 1 7.835 0.02 . 1 . . . . . . . . 4384 1 1319 . 1 1 126 126 ASP CA C 13 57.612 0.20 . 1 . . . . . . . . 4384 1 1320 . 1 1 126 126 ASP HA H 1 4.199 0.08 . 1 . . . . . . . . 4384 1 1321 . 1 1 126 126 ASP CB C 13 39.450 0.20 . 1 . . . . . . . . 4384 1 1322 . 1 1 126 126 ASP HB3 H 1 2.068 0.08 . 2 . . . . . . . . 4384 1 1323 . 1 1 126 126 ASP HB2 H 1 2.635 0.08 . 2 . . . . . . . . 4384 1 1324 . 1 1 126 126 ASP C C 13 179.378 0.05 . 1 . . . . . . . . 4384 1 1325 . 1 1 127 127 ARG N N 15 119.931 0.05 . 1 . . . . . . . . 4384 1 1326 . 1 1 127 127 ARG H H 1 8.186 0.02 . 1 . . . . . . . . 4384 1 1327 . 1 1 127 127 ARG CA C 13 60.587 0.20 . 1 . . . . . . . . 4384 1 1328 . 1 1 127 127 ARG HA H 1 3.760 0.08 . 1 . . . . . . . . 4384 1 1329 . 1 1 127 127 ARG CB C 13 30.543 0.20 . 1 . . . . . . . . 4384 1 1330 . 1 1 127 127 ARG HB2 H 1 1.938 0.08 . 2 . . . . . . . . 4384 1 1331 . 1 1 127 127 ARG CG C 13 28.539 0.20 . 1 . . . . . . . . 4384 1 1332 . 1 1 127 127 ARG HG2 H 1 1.897 0.08 . 2 . . . . . . . . 4384 1 1333 . 1 1 127 127 ARG CD C 13 43.714 0.20 . 1 . . . . . . . . 4384 1 1334 . 1 1 127 127 ARG HD2 H 1 3.257 0.08 . 2 . . . . . . . . 4384 1 1335 . 1 1 127 127 ARG C C 13 178.112 0.05 . 1 . . . . . . . . 4384 1 1336 . 1 1 128 128 LEU N N 15 114.088 0.05 . 1 . . . . . . . . 4384 1 1337 . 1 1 128 128 LEU H H 1 7.361 0.02 . 1 . . . . . . . . 4384 1 1338 . 1 1 128 128 LEU CA C 13 57.036 0.20 . 1 . . . . . . . . 4384 1 1339 . 1 1 128 128 LEU HA H 1 3.979 0.08 . 1 . . . . . . . . 4384 1 1340 . 1 1 128 128 LEU CG C 13 26.398 0.20 . 1 . . . . . . . . 4384 1 1341 . 1 1 128 128 LEU HG H 1 2.127 0.08 . 1 . . . . . . . . 4384 1 1342 . 1 1 128 128 LEU CD1 C 13 27.206 0.20 . 1 . . . . . . . . 4384 1 1343 . 1 1 128 128 LEU HD11 H 1 0.664 0.08 . 1 . . . . . . . . 4384 1 1344 . 1 1 128 128 LEU HD12 H 1 0.664 0.08 . 1 . . . . . . . . 4384 1 1345 . 1 1 128 128 LEU HD13 H 1 0.664 0.08 . 1 . . . . . . . . 4384 1 1346 . 1 1 128 128 LEU CD2 C 13 22.018 0.20 . 1 . . . . . . . . 4384 1 1347 . 1 1 128 128 LEU HD21 H 1 0.863 0.08 . 2 . . . . . . . . 4384 1 1348 . 1 1 128 128 LEU HD22 H 1 0.863 0.08 . 2 . . . . . . . . 4384 1 1349 . 1 1 128 128 LEU HD23 H 1 0.863 0.08 . 2 . . . . . . . . 4384 1 1350 . 1 1 128 128 LEU C C 13 175.472 0.05 . 1 . . . . . . . . 4384 1 1351 . 1 1 129 129 LYS N N 15 108.383 0.05 . 1 . . . . . . . . 4384 1 1352 . 1 1 129 129 LYS H H 1 7.272 0.02 . 1 . . . . . . . . 4384 1 1353 . 1 1 129 129 LYS CA C 13 56.282 0.20 . 1 . . . . . . . . 4384 1 1354 . 1 1 129 129 LYS HA H 1 4.240 0.08 . 1 . . . . . . . . 4384 1 1355 . 1 1 129 129 LYS CD C 13 29.948 0.20 . 1 . . . . . . . . 4384 1 1356 . 1 1 129 129 LYS HD2 H 1 1.350 0.08 . 2 . . . . . . . . 4384 1 1357 . 1 1 129 129 LYS CE C 13 41.402 0.20 . 1 . . . . . . . . 4384 1 1358 . 1 1 129 129 LYS HE2 H 1 2.594 0.08 . 2 . . . . . . . . 4384 1 1359 . 1 1 129 129 LYS C C 13 178.207 0.05 . 1 . . . . . . . . 4384 1 1360 . 1 1 130 130 GLY N N 15 108.934 0.05 . 1 . . . . . . . . 4384 1 1361 . 1 1 130 130 GLY H H 1 8.174 0.02 . 1 . . . . . . . . 4384 1 1362 . 1 1 130 130 GLY CA C 13 46.701 0.20 . 1 . . . . . . . . 4384 1 1363 . 1 1 130 130 GLY HA3 H 1 3.767 0.08 . 2 . . . . . . . . 4384 1 1364 . 1 1 130 130 GLY HA2 H 1 3.889 0.08 . 2 . . . . . . . . 4384 1 1365 . 1 1 130 130 GLY C C 13 173.963 0.05 . 1 . . . . . . . . 4384 1 1366 . 1 1 131 131 LEU N N 15 116.098 0.05 . 1 . . . . . . . . 4384 1 1367 . 1 1 131 131 LEU H H 1 8.695 0.02 . 1 . . . . . . . . 4384 1 1368 . 1 1 131 131 LEU CA C 13 53.630 0.20 . 1 . . . . . . . . 4384 1 1369 . 1 1 131 131 LEU HA H 1 4.532 0.08 . 1 . . . . . . . . 4384 1 1370 . 1 1 131 131 LEU CB C 13 43.650 0.20 . 1 . . . . . . . . 4384 1 1371 . 1 1 131 131 LEU HB3 H 1 1.498 0.08 . 2 . . . . . . . . 4384 1 1372 . 1 1 131 131 LEU HB2 H 1 1.653 0.08 . 2 . . . . . . . . 4384 1 1373 . 1 1 131 131 LEU CG C 13 26.437 0.20 . 1 . . . . . . . . 4384 1 1374 . 1 1 131 131 LEU HG H 1 1.450 0.08 . 1 . . . . . . . . 4384 1 1375 . 1 1 131 131 LEU CD1 C 13 25.864 0.20 . 1 . . . . . . . . 4384 1 1376 . 1 1 131 131 LEU HD11 H 1 0.866 0.08 . 1 . . . . . . . . 4384 1 1377 . 1 1 131 131 LEU HD12 H 1 0.866 0.08 . 1 . . . . . . . . 4384 1 1378 . 1 1 131 131 LEU HD13 H 1 0.866 0.08 . 1 . . . . . . . . 4384 1 1379 . 1 1 131 131 LEU CD2 C 13 22.701 0.20 . 1 . . . . . . . . 4384 1 1380 . 1 1 131 131 LEU HD21 H 1 0.865 0.08 . 2 . . . . . . . . 4384 1 1381 . 1 1 131 131 LEU HD22 H 1 0.865 0.08 . 2 . . . . . . . . 4384 1 1382 . 1 1 131 131 LEU HD23 H 1 0.865 0.08 . 2 . . . . . . . . 4384 1 1383 . 1 1 131 131 LEU C C 13 176.801 0.05 . 1 . . . . . . . . 4384 1 1384 . 1 1 132 132 ALA N N 15 121.221 0.05 . 1 . . . . . . . . 4384 1 1385 . 1 1 132 132 ALA H H 1 6.499 0.02 . 1 . . . . . . . . 4384 1 1386 . 1 1 132 132 ALA CA C 13 51.307 0.20 . 1 . . . . . . . . 4384 1 1387 . 1 1 132 132 ALA HA H 1 4.237 0.08 . 1 . . . . . . . . 4384 1 1388 . 1 1 132 132 ALA CB C 13 19.677 0.20 . 1 . . . . . . . . 4384 1 1389 . 1 1 132 132 ALA HB1 H 1 1.315 0.08 . 1 . . . . . . . . 4384 1 1390 . 1 1 132 132 ALA HB2 H 1 1.315 0.08 . 1 . . . . . . . . 4384 1 1391 . 1 1 132 132 ALA HB3 H 1 1.315 0.08 . 1 . . . . . . . . 4384 1 1392 . 1 1 132 132 ALA C C 13 175.768 0.05 . 1 . . . . . . . . 4384 1 1393 . 1 1 133 133 ASP N N 15 119.663 0.05 . 1 . . . . . . . . 4384 1 1394 . 1 1 133 133 ASP H H 1 8.396 0.02 . 1 . . . . . . . . 4384 1 1395 . 1 1 133 133 ASP CA C 13 56.742 0.20 . 1 . . . . . . . . 4384 1 1396 . 1 1 133 133 ASP HA H 1 4.253 0.08 . 1 . . . . . . . . 4384 1 1397 . 1 1 133 133 ASP CB C 13 40.771 0.20 . 1 . . . . . . . . 4384 1 1398 . 1 1 133 133 ASP HB2 H 1 2.584 0.08 . 2 . . . . . . . . 4384 1 1399 . 1 1 133 133 ASP C C 13 177.091 0.05 . 1 . . . . . . . . 4384 1 1400 . 1 1 134 134 GLY N N 15 112.507 0.05 . 1 . . . . . . . . 4384 1 1401 . 1 1 134 134 GLY H H 1 8.748 0.02 . 1 . . . . . . . . 4384 1 1402 . 1 1 134 134 GLY CA C 13 44.917 0.20 . 1 . . . . . . . . 4384 1 1403 . 1 1 134 134 GLY HA3 H 1 3.621 0.08 . 2 . . . . . . . . 4384 1 1404 . 1 1 134 134 GLY HA2 H 1 4.177 0.08 . 2 . . . . . . . . 4384 1 1405 . 1 1 134 134 GLY C C 13 174.754 0.05 . 1 . . . . . . . . 4384 1 1406 . 1 1 135 135 MET N N 15 113.895 0.05 . 1 . . . . . . . . 4384 1 1407 . 1 1 135 135 MET H H 1 8.311 0.02 . 1 . . . . . . . . 4384 1 1408 . 1 1 135 135 MET CA C 13 57.107 0.20 . 1 . . . . . . . . 4384 1 1409 . 1 1 135 135 MET HA H 1 4.403 0.08 . 1 . . . . . . . . 4384 1 1410 . 1 1 135 135 MET CE C 13 19.452 0.20 . 1 . . . . . . . . 4384 1 1411 . 1 1 135 135 MET HE1 H 1 2.004 0.20 . 1 . . . . . . . . 4384 1 1412 . 1 1 135 135 MET HE2 H 1 2.004 0.20 . 1 . . . . . . . . 4384 1 1413 . 1 1 135 135 MET HE3 H 1 2.004 0.20 . 1 . . . . . . . . 4384 1 1414 . 1 1 135 135 MET C C 13 177.610 0.05 . 1 . . . . . . . . 4384 1 1415 . 1 1 136 136 VAL N N 15 121.143 0.05 . 1 . . . . . . . . 4384 1 1416 . 1 1 136 136 VAL H H 1 7.721 0.02 . 1 . . . . . . . . 4384 1 1417 . 1 1 136 136 VAL CA C 13 64.886 0.20 . 1 . . . . . . . . 4384 1 1418 . 1 1 136 136 VAL HA H 1 3.901 0.08 . 1 . . . . . . . . 4384 1 1419 . 1 1 136 136 VAL CB C 13 30.963 0.20 . 1 . . . . . . . . 4384 1 1420 . 1 1 136 136 VAL HB H 1 2.061 0.08 . 1 . . . . . . . . 4384 1 1421 . 1 1 136 136 VAL CG2 C 13 22.467 0.20 . 1 . . . . . . . . 4384 1 1422 . 1 1 136 136 VAL HG21 H 1 1.011 0.08 . 2 . . . . . . . . 4384 1 1423 . 1 1 136 136 VAL HG22 H 1 1.011 0.08 . 2 . . . . . . . . 4384 1 1424 . 1 1 136 136 VAL HG23 H 1 1.011 0.08 . 2 . . . . . . . . 4384 1 1425 . 1 1 136 136 VAL CG1 C 13 20.762 0.20 . 1 . . . . . . . . 4384 1 1426 . 1 1 136 136 VAL HG11 H 1 0.896 0.08 . 1 . . . . . . . . 4384 1 1427 . 1 1 136 136 VAL HG12 H 1 0.896 0.08 . 1 . . . . . . . . 4384 1 1428 . 1 1 136 136 VAL HG13 H 1 0.896 0.08 . 1 . . . . . . . . 4384 1 1429 . 1 1 136 136 VAL C C 13 178.680 0.05 . 1 . . . . . . . . 4384 1 1430 . 1 1 137 137 GLY N N 15 118.029 0.05 . 1 . . . . . . . . 4384 1 1431 . 1 1 137 137 GLY H H 1 9.601 0.02 . 1 . . . . . . . . 4384 1 1432 . 1 1 137 137 GLY CA C 13 46.539 0.20 . 1 . . . . . . . . 4384 1 1433 . 1 1 137 137 GLY HA3 H 1 3.849 0.08 . 2 . . . . . . . . 4384 1 1434 . 1 1 137 137 GLY HA2 H 1 3.994 0.08 . 2 . . . . . . . . 4384 1 1435 . 1 1 137 137 GLY C C 13 174.613 0.05 . 1 . . . . . . . . 4384 1 1436 . 1 1 138 138 ASN N N 15 113.276 0.05 . 1 . . . . . . . . 4384 1 1437 . 1 1 138 138 ASN H H 1 7.446 0.02 . 1 . . . . . . . . 4384 1 1438 . 1 1 138 138 ASN CA C 13 49.660 0.20 . 1 . . . . . . . . 4384 1 1439 . 1 1 138 138 ASN HA H 1 5.092 0.08 . 1 . . . . . . . . 4384 1 1440 . 1 1 138 138 ASN CB C 13 38.818 0.20 . 1 . . . . . . . . 4384 1 1441 . 1 1 138 138 ASN HB3 H 1 2.275 0.08 . 2 . . . . . . . . 4384 1 1442 . 1 1 138 138 ASN HB2 H 1 2.838 0.08 . 2 . . . . . . . . 4384 1 1443 . 1 1 138 138 ASN C C 13 172.465 0.05 . 1 . . . . . . . . 4384 1 1444 . 1 1 139 139 PRO CA C 13 64.637 0.20 . 1 . . . . . . . . 4384 1 1445 . 1 1 139 139 PRO HA H 1 3.483 0.08 . 1 . . . . . . . . 4384 1 1446 . 1 1 139 139 PRO CB C 13 30.671 0.20 . 1 . . . . . . . . 4384 1 1447 . 1 1 139 139 PRO HB3 H 1 0.572 0.08 . 2 . . . . . . . . 4384 1 1448 . 1 1 139 139 PRO HB2 H 1 0.960 0.08 . 2 . . . . . . . . 4384 1 1449 . 1 1 139 139 PRO CG C 13 26.862 0.20 . 1 . . . . . . . . 4384 1 1450 . 1 1 139 139 PRO HG3 H 1 0.630 0.08 . 2 . . . . . . . . 4384 1 1451 . 1 1 139 139 PRO HG2 H 1 1.256 0.08 . 2 . . . . . . . . 4384 1 1452 . 1 1 139 139 PRO CD C 13 49.778 0.20 . 1 . . . . . . . . 4384 1 1453 . 1 1 139 139 PRO HD3 H 1 2.393 0.08 . 2 . . . . . . . . 4384 1 1454 . 1 1 139 139 PRO HD2 H 1 3.662 0.08 . 2 . . . . . . . . 4384 1 1455 . 1 1 139 139 PRO C C 13 177.439 0.05 . 1 . . . . . . . . 4384 1 1456 . 1 1 140 140 GLN N N 15 115.913 0.05 . 1 . . . . . . . . 4384 1 1457 . 1 1 140 140 GLN H H 1 7.886 0.02 . 1 . . . . . . . . 4384 1 1458 . 1 1 140 140 GLN CA C 13 60.015 0.20 . 1 . . . . . . . . 4384 1 1459 . 1 1 140 140 GLN HA H 1 3.803 0.08 . 1 . . . . . . . . 4384 1 1460 . 1 1 140 140 GLN CB C 13 27.306 0.20 . 1 . . . . . . . . 4384 1 1461 . 1 1 140 140 GLN HB2 H 1 2.004 0.08 . 2 . . . . . . . . 4384 1 1462 . 1 1 140 140 GLN CG C 13 34.452 0.20 . 1 . . . . . . . . 4384 1 1463 . 1 1 140 140 GLN HG3 H 1 2.441 0.08 . 2 . . . . . . . . 4384 1 1464 . 1 1 140 140 GLN HG2 H 1 2.532 0.08 . 2 . . . . . . . . 4384 1 1465 . 1 1 140 140 GLN CD C 13 180.418 0.20 . 1 . . . . . . . . 4384 1 1466 . 1 1 140 140 GLN NE2 N 15 111.506 0.05 . 1 . . . . . . . . 4384 1 1467 . 1 1 140 140 GLN HE21 H 1 7.620 0.02 . 1 . . . . . . . . 4384 1 1468 . 1 1 140 140 GLN HE22 H 1 6.948 0.02 . 1 . . . . . . . . 4384 1 1469 . 1 1 140 140 GLN C C 13 179.379 0.05 . 1 . . . . . . . . 4384 1 1470 . 1 1 141 141 GLY N N 15 108.828 0.05 . 1 . . . . . . . . 4384 1 1471 . 1 1 141 141 GLY H H 1 7.433 0.02 . 1 . . . . . . . . 4384 1 1472 . 1 1 141 141 GLY CA C 13 46.971 0.20 . 1 . . . . . . . . 4384 1 1473 . 1 1 141 141 GLY HA3 H 1 3.808 0.08 . 2 . . . . . . . . 4384 1 1474 . 1 1 141 141 GLY HA2 H 1 3.896 0.08 . 2 . . . . . . . . 4384 1 1475 . 1 1 141 141 GLY C C 13 175.996 0.05 . 1 . . . . . . . . 4384 1 1476 . 1 1 142 142 GLN N N 15 120.162 0.05 . 1 . . . . . . . . 4384 1 1477 . 1 1 142 142 GLN H H 1 8.023 0.02 . 1 . . . . . . . . 4384 1 1478 . 1 1 142 142 GLN CA C 13 60.323 0.20 . 1 . . . . . . . . 4384 1 1479 . 1 1 142 142 GLN HA H 1 3.751 0.08 . 1 . . . . . . . . 4384 1 1480 . 1 1 142 142 GLN CB C 13 28.919 0.20 . 1 . . . . . . . . 4384 1 1481 . 1 1 142 142 GLN HB2 H 1 2.167 0.08 . 2 . . . . . . . . 4384 1 1482 . 1 1 142 142 GLN CG C 13 34.399 0.20 . 1 . . . . . . . . 4384 1 1483 . 1 1 142 142 GLN HG2 H 1 2.291 0.08 . 2 . . . . . . . . 4384 1 1484 . 1 1 142 142 GLN C C 13 177.253 0.05 . 1 . . . . . . . . 4384 1 1485 . 1 1 143 143 ALA N N 15 118.905 0.05 . 1 . . . . . . . . 4384 1 1486 . 1 1 143 143 ALA H H 1 8.228 0.02 . 1 . . . . . . . . 4384 1 1487 . 1 1 143 143 ALA CA C 13 54.310 0.20 . 1 . . . . . . . . 4384 1 1488 . 1 1 143 143 ALA HA H 1 3.929 0.08 . 1 . . . . . . . . 4384 1 1489 . 1 1 143 143 ALA CB C 13 18.438 0.20 . 1 . . . . . . . . 4384 1 1490 . 1 1 143 143 ALA HB1 H 1 1.334 0.08 . 1 . . . . . . . . 4384 1 1491 . 1 1 143 143 ALA HB2 H 1 1.334 0.08 . 1 . . . . . . . . 4384 1 1492 . 1 1 143 143 ALA HB3 H 1 1.334 0.08 . 1 . . . . . . . . 4384 1 1493 . 1 1 143 143 ALA C C 13 179.351 0.05 . 1 . . . . . . . . 4384 1 1494 . 1 1 144 144 ALA N N 15 117.010 0.05 . 1 . . . . . . . . 4384 1 1495 . 1 1 144 144 ALA H H 1 7.535 0.02 . 1 . . . . . . . . 4384 1 1496 . 1 1 144 144 ALA CA C 13 53.881 0.20 . 1 . . . . . . . . 4384 1 1497 . 1 1 144 144 ALA HA H 1 4.234 0.08 . 1 . . . . . . . . 4384 1 1498 . 1 1 144 144 ALA CB C 13 19.430 0.20 . 1 . . . . . . . . 4384 1 1499 . 1 1 144 144 ALA HB1 H 1 1.517 0.08 . 1 . . . . . . . . 4384 1 1500 . 1 1 144 144 ALA HB2 H 1 1.517 0.08 . 1 . . . . . . . . 4384 1 1501 . 1 1 144 144 ALA HB3 H 1 1.517 0.08 . 1 . . . . . . . . 4384 1 1502 . 1 1 144 144 ALA C C 13 179.728 0.05 . 1 . . . . . . . . 4384 1 1503 . 1 1 145 145 LEU N N 15 115.960 0.05 . 1 . . . . . . . . 4384 1 1504 . 1 1 145 145 LEU H H 1 7.791 0.02 . 1 . . . . . . . . 4384 1 1505 . 1 1 145 145 LEU CA C 13 56.248 0.20 . 1 . . . . . . . . 4384 1 1506 . 1 1 145 145 LEU HA H 1 4.407 0.08 . 1 . . . . . . . . 4384 1 1507 . 1 1 145 145 LEU CB C 13 39.519 0.20 . 1 . . . . . . . . 4384 1 1508 . 1 1 145 145 LEU HB3 H 1 1.502 0.08 . 2 . . . . . . . . 4384 1 1509 . 1 1 145 145 LEU HB2 H 1 1.988 0.08 . 2 . . . . . . . . 4384 1 1510 . 1 1 145 145 LEU CG C 13 27.952 0.20 . 1 . . . . . . . . 4384 1 1511 . 1 1 145 145 LEU HG H 1 1.862 0.08 . 1 . . . . . . . . 4384 1 1512 . 1 1 145 145 LEU CD1 C 13 25.429 0.20 . 1 . . . . . . . . 4384 1 1513 . 1 1 145 145 LEU HD11 H 1 0.770 0.08 . 1 . . . . . . . . 4384 1 1514 . 1 1 145 145 LEU HD12 H 1 0.770 0.08 . 1 . . . . . . . . 4384 1 1515 . 1 1 145 145 LEU HD13 H 1 0.770 0.08 . 1 . . . . . . . . 4384 1 1516 . 1 1 145 145 LEU CD2 C 13 22.670 0.20 . 1 . . . . . . . . 4384 1 1517 . 1 1 145 145 LEU HD21 H 1 0.865 0.08 . 2 . . . . . . . . 4384 1 1518 . 1 1 145 145 LEU HD22 H 1 0.865 0.08 . 2 . . . . . . . . 4384 1 1519 . 1 1 145 145 LEU HD23 H 1 0.865 0.08 . 2 . . . . . . . . 4384 1 1520 . 1 1 145 145 LEU C C 13 177.403 0.05 . 1 . . . . . . . . 4384 1 1521 . 1 1 146 146 LEU N N 15 120.267 0.05 . 1 . . . . . . . . 4384 1 1522 . 1 1 146 146 LEU H H 1 8.110 0.02 . 1 . . . . . . . . 4384 1 1523 . 1 1 146 146 LEU CA C 13 55.425 0.20 . 1 . . . . . . . . 4384 1 1524 . 1 1 146 146 LEU HA H 1 4.298 0.08 . 1 . . . . . . . . 4384 1 1525 . 1 1 146 146 LEU CD1 C 13 22.466 0.20 . 1 . . . . . . . . 4384 1 1526 . 1 1 146 146 LEU HD11 H 1 0.865 0.08 . 1 . . . . . . . . 4384 1 1527 . 1 1 146 146 LEU HD12 H 1 0.865 0.08 . 1 . . . . . . . . 4384 1 1528 . 1 1 146 146 LEU HD13 H 1 0.865 0.08 . 1 . . . . . . . . 4384 1 1529 . 1 1 146 146 LEU CD2 C 13 24.049 0.20 . 1 . . . . . . . . 4384 1 1530 . 1 1 146 146 LEU HD21 H 1 0.861 0.08 . 2 . . . . . . . . 4384 1 1531 . 1 1 146 146 LEU HD22 H 1 0.861 0.08 . 2 . . . . . . . . 4384 1 1532 . 1 1 146 146 LEU HD23 H 1 0.861 0.08 . 2 . . . . . . . . 4384 1 1533 . 1 1 146 146 LEU C C 13 177.373 0.05 . 1 . . . . . . . . 4384 1 1534 . 1 1 147 147 ARG N N 15 122.870 0.05 . 1 . . . . . . . . 4384 1 1535 . 1 1 147 147 ARG H H 1 9.729 0.02 . 1 . . . . . . . . 4384 1 1536 . 1 1 147 147 ARG CA C 13 54.351 0.20 . 1 . . . . . . . . 4384 1 1537 . 1 1 147 147 ARG HA H 1 4.631 0.08 . 1 . . . . . . . . 4384 1 1538 . 1 1 147 147 ARG C C 13 175.949 0.05 . 9 . . . . . . . . 4384 1 1539 . 1 1 148 148 PRO CA C 13 66.757 0.20 . 1 . . . . . . . . 4384 1 1540 . 1 1 148 148 PRO HA H 1 4.242 0.08 . 1 . . . . . . . . 4384 1 1541 . 1 1 148 148 PRO CB C 13 31.900 0.20 . 1 . . . . . . . . 4384 1 1542 . 1 1 148 148 PRO HB3 H 1 2.053 0.08 . 2 . . . . . . . . 4384 1 1543 . 1 1 148 148 PRO HB2 H 1 2.529 0.08 . 2 . . . . . . . . 4384 1 1544 . 1 1 148 148 PRO CG C 13 28.066 0.20 . 1 . . . . . . . . 4384 1 1545 . 1 1 148 148 PRO HG2 H 1 2.225 0.08 . 2 . . . . . . . . 4384 1 1546 . 1 1 148 148 PRO CD C 13 50.630 0.20 . 1 . . . . . . . . 4384 1 1547 . 1 1 148 148 PRO HD2 H 1 3.791 0.08 . 2 . . . . . . . . 4384 1 1548 . 1 1 148 148 PRO C C 13 179.445 0.05 . 1 . . . . . . . . 4384 1 1549 . 1 1 149 149 GLY N N 15 102.067 0.05 . 1 . . . . . . . . 4384 1 1550 . 1 1 149 149 GLY H H 1 8.993 0.02 . 1 . . . . . . . . 4384 1 1551 . 1 1 149 149 GLY CA C 13 46.688 0.20 . 1 . . . . . . . . 4384 1 1552 . 1 1 149 149 GLY HA2 H 1 3.809 0.08 . 2 . . . . . . . . 4384 1 1553 . 1 1 149 149 GLY C C 13 178.611 0.05 . 1 . . . . . . . . 4384 1 1554 . 1 1 150 150 GLU N N 15 119.787 0.05 . 1 . . . . . . . . 4384 1 1555 . 1 1 150 150 GLU H H 1 7.557 0.02 . 1 . . . . . . . . 4384 1 1556 . 1 1 150 150 GLU CA C 13 60.402 0.20 . 1 . . . . . . . . 4384 1 1557 . 1 1 150 150 GLU HA H 1 4.035 0.08 . 1 . . . . . . . . 4384 1 1558 . 1 1 150 150 GLU CB C 13 29.339 0.20 . 1 . . . . . . . . 4384 1 1559 . 1 1 150 150 GLU HB3 H 1 1.599 0.08 . 2 . . . . . . . . 4384 1 1560 . 1 1 150 150 GLU HB2 H 1 1.993 0.08 . 2 . . . . . . . . 4384 1 1561 . 1 1 150 150 GLU CG C 13 31.207 0.20 . 1 . . . . . . . . 4384 1 1562 . 1 1 150 150 GLU HG3 H 1 1.982 0.08 . 2 . . . . . . . . 4384 1 1563 . 1 1 150 150 GLU HG2 H 1 2.292 0.08 . 2 . . . . . . . . 4384 1 1564 . 1 1 150 150 GLU C C 13 177.755 0.05 . 1 . . . . . . . . 4384 1 1565 . 1 1 151 151 LEU N N 15 117.923 0.05 . 1 . . . . . . . . 4384 1 1566 . 1 1 151 151 LEU H H 1 7.871 0.02 . 1 . . . . . . . . 4384 1 1567 . 1 1 151 151 LEU CA C 13 58.746 0.20 . 1 . . . . . . . . 4384 1 1568 . 1 1 151 151 LEU HA H 1 4.256 0.08 . 1 . . . . . . . . 4384 1 1569 . 1 1 151 151 LEU CD1 C 13 25.875 0.20 . 1 . . . . . . . . 4384 1 1570 . 1 1 151 151 LEU HD11 H 1 0.881 0.08 . 1 . . . . . . . . 4384 1 1571 . 1 1 151 151 LEU HD12 H 1 0.881 0.08 . 1 . . . . . . . . 4384 1 1572 . 1 1 151 151 LEU HD13 H 1 0.881 0.08 . 1 . . . . . . . . 4384 1 1573 . 1 1 151 151 LEU CD2 C 13 24.941 0.20 . 1 . . . . . . . . 4384 1 1574 . 1 1 151 151 LEU HD21 H 1 0.919 0.08 . 2 . . . . . . . . 4384 1 1575 . 1 1 151 151 LEU HD22 H 1 0.919 0.08 . 2 . . . . . . . . 4384 1 1576 . 1 1 151 151 LEU HD23 H 1 0.919 0.08 . 2 . . . . . . . . 4384 1 1577 . 1 1 151 151 LEU C C 13 180.970 0.05 . 1 . . . . . . . . 4384 1 1578 . 1 1 152 152 VAL N N 15 120.090 0.05 . 1 . . . . . . . . 4384 1 1579 . 1 1 152 152 VAL H H 1 8.272 0.02 . 1 . . . . . . . . 4384 1 1580 . 1 1 152 152 VAL CA C 13 67.167 0.20 . 1 . . . . . . . . 4384 1 1581 . 1 1 152 152 VAL HA H 1 3.667 0.08 . 1 . . . . . . . . 4384 1 1582 . 1 1 152 152 VAL CB C 13 32.185 0.20 . 1 . . . . . . . . 4384 1 1583 . 1 1 152 152 VAL HB H 1 2.093 0.08 . 1 . . . . . . . . 4384 1 1584 . 1 1 152 152 VAL CG2 C 13 23.022 0.20 . 1 . . . . . . . . 4384 1 1585 . 1 1 152 152 VAL HG21 H 1 1.131 0.08 . 2 . . . . . . . . 4384 1 1586 . 1 1 152 152 VAL HG22 H 1 1.131 0.08 . 2 . . . . . . . . 4384 1 1587 . 1 1 152 152 VAL HG23 H 1 1.131 0.08 . 2 . . . . . . . . 4384 1 1588 . 1 1 152 152 VAL CG1 C 13 21.082 0.20 . 1 . . . . . . . . 4384 1 1589 . 1 1 152 152 VAL HG11 H 1 1.026 0.08 . 1 . . . . . . . . 4384 1 1590 . 1 1 152 152 VAL HG12 H 1 1.026 0.08 . 1 . . . . . . . . 4384 1 1591 . 1 1 152 152 VAL HG13 H 1 1.026 0.08 . 1 . . . . . . . . 4384 1 1592 . 1 1 152 152 VAL C C 13 178.272 0.05 . 1 . . . . . . . . 4384 1 1593 . 1 1 153 153 ALA N N 15 122.281 0.05 . 1 . . . . . . . . 4384 1 1594 . 1 1 153 153 ALA H H 1 7.281 0.02 . 1 . . . . . . . . 4384 1 1595 . 1 1 153 153 ALA CA C 13 55.173 0.20 . 1 . . . . . . . . 4384 1 1596 . 1 1 153 153 ALA HA H 1 4.513 0.08 . 1 . . . . . . . . 4384 1 1597 . 1 1 153 153 ALA CB C 13 18.987 0.20 . 1 . . . . . . . . 4384 1 1598 . 1 1 153 153 ALA HB1 H 1 1.698 0.08 . 1 . . . . . . . . 4384 1 1599 . 1 1 153 153 ALA HB2 H 1 1.698 0.08 . 1 . . . . . . . . 4384 1 1600 . 1 1 153 153 ALA HB3 H 1 1.698 0.08 . 1 . . . . . . . . 4384 1 1601 . 1 1 153 153 ALA C C 13 181.869 0.05 . 1 . . . . . . . . 4384 1 1602 . 1 1 154 154 ILE N N 15 123.009 0.05 . 1 . . . . . . . . 4384 1 1603 . 1 1 154 154 ILE H H 1 9.341 0.02 . 1 . . . . . . . . 4384 1 1604 . 1 1 154 154 ILE CA C 13 66.831 0.20 . 1 . . . . . . . . 4384 1 1605 . 1 1 154 154 ILE HA H 1 3.776 0.08 . 1 . . . . . . . . 4384 1 1606 . 1 1 154 154 ILE CB C 13 39.880 0.20 . 1 . . . . . . . . 4384 1 1607 . 1 1 154 154 ILE HB H 1 2.339 0.08 . 1 . . . . . . . . 4384 1 1608 . 1 1 154 154 ILE CG1 C 13 28.400 0.20 . 1 . . . . . . . . 4384 1 1609 . 1 1 154 154 ILE HG13 H 1 1.986 0.08 . 2 . . . . . . . . 4384 1 1610 . 1 1 154 154 ILE HG12 H 1 2.419 0.08 . 2 . . . . . . . . 4384 1 1611 . 1 1 154 154 ILE CD1 C 13 16.622 0.20 . 1 . . . . . . . . 4384 1 1612 . 1 1 154 154 ILE HD11 H 1 1.095 0.08 . 1 . . . . . . . . 4384 1 1613 . 1 1 154 154 ILE HD12 H 1 1.095 0.08 . 1 . . . . . . . . 4384 1 1614 . 1 1 154 154 ILE HD13 H 1 1.095 0.08 . 1 . . . . . . . . 4384 1 1615 . 1 1 154 154 ILE CG2 C 13 18.039 0.20 . 1 . . . . . . . . 4384 1 1616 . 1 1 154 154 ILE HG21 H 1 1.294 0.08 . 1 . . . . . . . . 4384 1 1617 . 1 1 154 154 ILE HG22 H 1 1.294 0.08 . 1 . . . . . . . . 4384 1 1618 . 1 1 154 154 ILE HG23 H 1 1.294 0.08 . 1 . . . . . . . . 4384 1 1619 . 1 1 154 154 ILE C C 13 178.350 0.05 . 1 . . . . . . . . 4384 1 1620 . 1 1 155 155 THR N N 15 117.096 0.05 . 1 . . . . . . . . 4384 1 1621 . 1 1 155 155 THR H H 1 8.196 0.02 . 1 . . . . . . . . 4384 1 1622 . 1 1 155 155 THR CA C 13 65.447 0.20 . 1 . . . . . . . . 4384 1 1623 . 1 1 155 155 THR HA H 1 3.882 0.08 . 1 . . . . . . . . 4384 1 1624 . 1 1 155 155 THR CB C 13 68.956 0.20 . 1 . . . . . . . . 4384 1 1625 . 1 1 155 155 THR HB H 1 4.401 0.08 . 1 . . . . . . . . 4384 1 1626 . 1 1 155 155 THR CG2 C 13 21.846 0.20 . 1 . . . . . . . . 4384 1 1627 . 1 1 155 155 THR HG21 H 1 1.445 0.08 . 1 . . . . . . . . 4384 1 1628 . 1 1 155 155 THR HG22 H 1 1.445 0.08 . 1 . . . . . . . . 4384 1 1629 . 1 1 155 155 THR HG23 H 1 1.445 0.08 . 1 . . . . . . . . 4384 1 1630 . 1 1 155 155 THR C C 13 176.444 0.05 . 1 . . . . . . . . 4384 1 1631 . 1 1 156 156 ALA N N 15 126.170 0.05 . 1 . . . . . . . . 4384 1 1632 . 1 1 156 156 ALA H H 1 8.368 0.02 . 1 . . . . . . . . 4384 1 1633 . 1 1 156 156 ALA CA C 13 55.734 0.20 . 1 . . . . . . . . 4384 1 1634 . 1 1 156 156 ALA HA H 1 4.328 0.08 . 1 . . . . . . . . 4384 1 1635 . 1 1 156 156 ALA CB C 13 18.081 0.20 . 1 . . . . . . . . 4384 1 1636 . 1 1 156 156 ALA HB1 H 1 1.602 0.08 . 1 . . . . . . . . 4384 1 1637 . 1 1 156 156 ALA HB2 H 1 1.602 0.08 . 1 . . . . . . . . 4384 1 1638 . 1 1 156 156 ALA HB3 H 1 1.602 0.08 . 1 . . . . . . . . 4384 1 1639 . 1 1 156 156 ALA C C 13 182.191 0.05 . 1 . . . . . . . . 4384 1 1640 . 1 1 157 157 SER N N 15 113.776 0.05 . 1 . . . . . . . . 4384 1 1641 . 1 1 157 157 SER H H 1 8.369 0.02 . 1 . . . . . . . . 4384 1 1642 . 1 1 157 157 SER C C 13 175.844 0.05 . 1 . . . . . . . . 4384 1 1643 . 1 1 158 158 ALA N N 15 124.597 0.05 . 1 . . . . . . . . 4384 1 1644 . 1 1 158 158 ALA H H 1 8.754 0.02 . 1 . . . . . . . . 4384 1 1645 . 1 1 158 158 ALA CA C 13 55.942 0.20 . 1 . . . . . . . . 4384 1 1646 . 1 1 158 158 ALA HA H 1 4.243 0.08 . 1 . . . . . . . . 4384 1 1647 . 1 1 158 158 ALA CB C 13 20.559 0.20 . 1 . . . . . . . . 4384 1 1648 . 1 1 158 158 ALA HB1 H 1 1.666 0.08 . 1 . . . . . . . . 4384 1 1649 . 1 1 158 158 ALA HB2 H 1 1.666 0.08 . 1 . . . . . . . . 4384 1 1650 . 1 1 158 158 ALA HB3 H 1 1.666 0.08 . 1 . . . . . . . . 4384 1 1651 . 1 1 158 158 ALA C C 13 180.015 0.05 . 1 . . . . . . . . 4384 1 1652 . 1 1 159 159 LEU N N 15 122.001 0.05 . 1 . . . . . . . . 4384 1 1653 . 1 1 159 159 LEU H H 1 8.471 0.02 . 1 . . . . . . . . 4384 1 1654 . 1 1 159 159 LEU CA C 13 57.885 0.20 . 1 . . . . . . . . 4384 1 1655 . 1 1 159 159 LEU HA H 1 4.256 0.08 . 1 . . . . . . . . 4384 1 1656 . 1 1 159 159 LEU CB C 13 41.799 0.20 . 1 . . . . . . . . 4384 1 1657 . 1 1 159 159 LEU HB3 H 1 1.801 0.08 . 2 . . . . . . . . 4384 1 1658 . 1 1 159 159 LEU HB2 H 1 2.127 0.08 . 2 . . . . . . . . 4384 1 1659 . 1 1 159 159 LEU CG C 13 27.796 0.20 . 1 . . . . . . . . 4384 1 1660 . 1 1 159 159 LEU HG H 1 1.649 0.08 . 1 . . . . . . . . 4384 1 1661 . 1 1 159 159 LEU CD1 C 13 23.460 0.20 . 1 . . . . . . . . 4384 1 1662 . 1 1 159 159 LEU HD11 H 1 0.972 0.08 . 1 . . . . . . . . 4384 1 1663 . 1 1 159 159 LEU HD12 H 1 0.972 0.08 . 1 . . . . . . . . 4384 1 1664 . 1 1 159 159 LEU HD13 H 1 0.972 0.08 . 1 . . . . . . . . 4384 1 1665 . 1 1 159 159 LEU CD2 C 13 26.461 0.20 . 1 . . . . . . . . 4384 1 1666 . 1 1 159 159 LEU HD21 H 1 0.994 0.08 . 2 . . . . . . . . 4384 1 1667 . 1 1 159 159 LEU HD22 H 1 0.994 0.08 . 2 . . . . . . . . 4384 1 1668 . 1 1 159 159 LEU HD23 H 1 0.994 0.08 . 2 . . . . . . . . 4384 1 1669 . 1 1 159 159 LEU C C 13 178.706 0.05 . 1 . . . . . . . . 4384 1 1670 . 1 1 160 160 GLN N N 15 119.499 0.05 . 1 . . . . . . . . 4384 1 1671 . 1 1 160 160 GLN H H 1 8.444 0.02 . 1 . . . . . . . . 4384 1 1672 . 1 1 160 160 GLN CA C 13 59.031 0.20 . 1 . . . . . . . . 4384 1 1673 . 1 1 160 160 GLN HA H 1 4.151 0.08 . 1 . . . . . . . . 4384 1 1674 . 1 1 160 160 GLN CB C 13 28.072 0.20 . 1 . . . . . . . . 4384 1 1675 . 1 1 160 160 GLN HB3 H 1 1.961 0.08 . 2 . . . . . . . . 4384 1 1676 . 1 1 160 160 GLN HB2 H 1 2.355 0.08 . 2 . . . . . . . . 4384 1 1677 . 1 1 160 160 GLN CG C 13 32.924 0.20 . 1 . . . . . . . . 4384 1 1678 . 1 1 160 160 GLN HG3 H 1 2.397 0.08 . 2 . . . . . . . . 4384 1 1679 . 1 1 160 160 GLN HG2 H 1 2.554 0.08 . 2 . . . . . . . . 4384 1 1680 . 1 1 160 160 GLN CD C 13 179.777 0.20 . 1 . . . . . . . . 4384 1 1681 . 1 1 160 160 GLN NE2 N 15 113.148 0.05 . 1 . . . . . . . . 4384 1 1682 . 1 1 160 160 GLN HE21 H 1 7.842 0.02 . 1 . . . . . . . . 4384 1 1683 . 1 1 160 160 GLN HE22 H 1 6.915 0.02 . 1 . . . . . . . . 4384 1 1684 . 1 1 160 160 GLN C C 13 178.836 0.05 . 1 . . . . . . . . 4384 1 1685 . 1 1 161 161 ALA CA C 13 54.924 0.20 . 1 . . . . . . . . 4384 1 1686 . 1 1 161 161 ALA HA H 1 4.186 0.08 . 1 . . . . . . . . 4384 1 1687 . 1 1 161 161 ALA CB C 13 19.067 0.20 . 1 . . . . . . . . 4384 1 1688 . 1 1 161 161 ALA HB1 H 1 1.581 0.08 . 1 . . . . . . . . 4384 1 1689 . 1 1 161 161 ALA HB2 H 1 1.581 0.08 . 1 . . . . . . . . 4384 1 1690 . 1 1 161 161 ALA HB3 H 1 1.581 0.08 . 1 . . . . . . . . 4384 1 1691 . 1 1 161 161 ALA C C 13 179.111 0.05 . 1 . . . . . . . . 4384 1 1692 . 1 1 162 162 PHE N N 15 118.998 0.05 . 1 . . . . . . . . 4384 1 1693 . 1 1 162 162 PHE H H 1 8.318 0.02 . 1 . . . . . . . . 4384 1 1694 . 1 1 162 162 PHE CA C 13 63.055 0.20 . 1 . . . . . . . . 4384 1 1695 . 1 1 162 162 PHE HA H 1 4.192 0.08 . 1 . . . . . . . . 4384 1 1696 . 1 1 162 162 PHE CB C 13 38.846 0.20 . 1 . . . . . . . . 4384 1 1697 . 1 1 162 162 PHE HB3 H 1 3.162 0.08 . 2 . . . . . . . . 4384 1 1698 . 1 1 162 162 PHE HB2 H 1 3.575 0.08 . 2 . . . . . . . . 4384 1 1699 . 1 1 162 162 PHE CD1 C 13 131.550 0.20 . 1 . . . . . . . . 4384 1 1700 . 1 1 162 162 PHE HD1 H 1 7.025 0.08 . 3 . . . . . . . . 4384 1 1701 . 1 1 162 162 PHE CE1 C 13 131.022 0.20 . 1 . . . . . . . . 4384 1 1702 . 1 1 162 162 PHE HE1 H 1 7.185 0.08 . 3 . . . . . . . . 4384 1 1703 . 1 1 162 162 PHE CZ C 13 129.684 0.20 . 1 . . . . . . . . 4384 1 1704 . 1 1 162 162 PHE HZ H 1 7.016 0.08 . 1 . . . . . . . . 4384 1 1705 . 1 1 162 162 PHE C C 13 176.150 0.05 . 1 . . . . . . . . 4384 1 1706 . 1 1 163 163 ARG N N 15 118.364 0.05 . 1 . . . . . . . . 4384 1 1707 . 1 1 163 163 ARG H H 1 8.450 0.02 . 1 . . . . . . . . 4384 1 1708 . 1 1 163 163 ARG CA C 13 60.490 0.20 . 1 . . . . . . . . 4384 1 1709 . 1 1 163 163 ARG HA H 1 3.722 0.08 . 1 . . . . . . . . 4384 1 1710 . 1 1 163 163 ARG CB C 13 28.987 0.20 . 1 . . . . . . . . 4384 1 1711 . 1 1 163 163 ARG HB3 H 1 1.769 0.08 . 2 . . . . . . . . 4384 1 1712 . 1 1 163 163 ARG HB2 H 1 2.104 0.08 . 2 . . . . . . . . 4384 1 1713 . 1 1 163 163 ARG CD C 13 43.749 0.20 . 1 . . . . . . . . 4384 1 1714 . 1 1 163 163 ARG HD2 H 1 3.242 0.08 . 2 . . . . . . . . 4384 1 1715 . 1 1 163 163 ARG C C 13 179.336 0.05 . 1 . . . . . . . . 4384 1 1716 . 1 1 164 164 GLU N N 15 117.674 0.05 . 1 . . . . . . . . 4384 1 1717 . 1 1 164 164 GLU H H 1 7.837 0.02 . 1 . . . . . . . . 4384 1 1718 . 1 1 164 164 GLU CA C 13 59.338 0.20 . 1 . . . . . . . . 4384 1 1719 . 1 1 164 164 GLU HA H 1 4.024 0.08 . 1 . . . . . . . . 4384 1 1720 . 1 1 164 164 GLU CB C 13 29.303 0.20 . 1 . . . . . . . . 4384 1 1721 . 1 1 164 164 GLU HB3 H 1 2.104 0.08 . 2 . . . . . . . . 4384 1 1722 . 1 1 164 164 GLU HB2 H 1 2.235 0.08 . 2 . . . . . . . . 4384 1 1723 . 1 1 164 164 GLU CG C 13 35.929 0.20 . 1 . . . . . . . . 4384 1 1724 . 1 1 164 164 GLU HG3 H 1 2.297 0.08 . 2 . . . . . . . . 4384 1 1725 . 1 1 164 164 GLU HG2 H 1 2.438 0.08 . 2 . . . . . . . . 4384 1 1726 . 1 1 164 164 GLU C C 13 179.032 0.05 . 1 . . . . . . . . 4384 1 1727 . 1 1 165 165 VAL N N 15 118.655 0.05 . 1 . . . . . . . . 4384 1 1728 . 1 1 165 165 VAL H H 1 7.869 0.02 . 1 . . . . . . . . 4384 1 1729 . 1 1 165 165 VAL CA C 13 65.968 0.20 . 1 . . . . . . . . 4384 1 1730 . 1 1 165 165 VAL HA H 1 3.704 0.08 . 1 . . . . . . . . 4384 1 1731 . 1 1 165 165 VAL CB C 13 31.576 0.20 . 1 . . . . . . . . 4384 1 1732 . 1 1 165 165 VAL HB H 1 2.096 0.08 . 1 . . . . . . . . 4384 1 1733 . 1 1 165 165 VAL CG2 C 13 21.594 0.20 . 1 . . . . . . . . 4384 1 1734 . 1 1 165 165 VAL HG21 H 1 1.100 0.08 . 2 . . . . . . . . 4384 1 1735 . 1 1 165 165 VAL HG22 H 1 1.100 0.08 . 2 . . . . . . . . 4384 1 1736 . 1 1 165 165 VAL HG23 H 1 1.100 0.08 . 2 . . . . . . . . 4384 1 1737 . 1 1 165 165 VAL CG1 C 13 23.014 0.20 . 1 . . . . . . . . 4384 1 1738 . 1 1 165 165 VAL HG11 H 1 0.980 0.08 . 1 . . . . . . . . 4384 1 1739 . 1 1 165 165 VAL HG12 H 1 0.980 0.08 . 1 . . . . . . . . 4384 1 1740 . 1 1 165 165 VAL HG13 H 1 0.980 0.08 . 1 . . . . . . . . 4384 1 1741 . 1 1 165 165 VAL C C 13 177.965 0.05 . 1 . . . . . . . . 4384 1 1742 . 1 1 166 166 ALA N N 15 122.225 0.05 . 1 . . . . . . . . 4384 1 1743 . 1 1 166 166 ALA H H 1 8.347 0.02 . 1 . . . . . . . . 4384 1 1744 . 1 1 166 166 ALA CA C 13 54.797 0.20 . 1 . . . . . . . . 4384 1 1745 . 1 1 166 166 ALA HA H 1 3.683 0.08 . 1 . . . . . . . . 4384 1 1746 . 1 1 166 166 ALA CB C 13 17.805 0.20 . 1 . . . . . . . . 4384 1 1747 . 1 1 166 166 ALA HB1 H 1 0.925 0.08 . 1 . . . . . . . . 4384 1 1748 . 1 1 166 166 ALA HB2 H 1 0.925 0.08 . 1 . . . . . . . . 4384 1 1749 . 1 1 166 166 ALA HB3 H 1 0.925 0.08 . 1 . . . . . . . . 4384 1 1750 . 1 1 166 166 ALA C C 13 178.583 0.05 . 1 . . . . . . . . 4384 1 1751 . 1 1 167 167 ARG N N 15 113.420 0.05 . 1 . . . . . . . . 4384 1 1752 . 1 1 167 167 ARG H H 1 7.177 0.02 . 1 . . . . . . . . 4384 1 1753 . 1 1 167 167 ARG CA C 13 57.697 0.20 . 1 . . . . . . . . 4384 1 1754 . 1 1 167 167 ARG HA H 1 4.033 0.08 . 1 . . . . . . . . 4384 1 1755 . 1 1 167 167 ARG CB C 13 30.389 0.20 . 1 . . . . . . . . 4384 1 1756 . 1 1 167 167 ARG HB2 H 1 1.882 0.08 . 2 . . . . . . . . 4384 1 1757 . 1 1 167 167 ARG CG C 13 27.330 0.20 . 1 . . . . . . . . 4384 1 1758 . 1 1 167 167 ARG HG2 H 1 1.620 0.08 . 2 . . . . . . . . 4384 1 1759 . 1 1 167 167 ARG CD C 13 43.714 0.20 . 1 . . . . . . . . 4384 1 1760 . 1 1 167 167 ARG HD2 H 1 3.199 0.08 . 2 . . . . . . . . 4384 1 1761 . 1 1 167 167 ARG C C 13 177.539 0.05 . 1 . . . . . . . . 4384 1 1762 . 1 1 168 168 LEU N N 15 118.854 0.05 . 1 . . . . . . . . 4384 1 1763 . 1 1 168 168 LEU H H 1 7.439 0.02 . 1 . . . . . . . . 4384 1 1764 . 1 1 168 168 LEU CA C 13 55.555 0.20 . 1 . . . . . . . . 4384 1 1765 . 1 1 168 168 LEU HA H 1 4.236 0.08 . 1 . . . . . . . . 4384 1 1766 . 1 1 168 168 LEU CB C 13 43.065 0.20 . 1 . . . . . . . . 4384 1 1767 . 1 1 168 168 LEU HB3 H 1 1.549 0.08 . 2 . . . . . . . . 4384 1 1768 . 1 1 168 168 LEU HB2 H 1 1.758 0.08 . 2 . . . . . . . . 4384 1 1769 . 1 1 168 168 LEU CG C 13 26.888 0.20 . 1 . . . . . . . . 4384 1 1770 . 1 1 168 168 LEU HG H 1 1.776 0.08 . 1 . . . . . . . . 4384 1 1771 . 1 1 168 168 LEU CD1 C 13 25.741 0.20 . 1 . . . . . . . . 4384 1 1772 . 1 1 168 168 LEU HD11 H 1 0.923 0.08 . 1 . . . . . . . . 4384 1 1773 . 1 1 168 168 LEU HD12 H 1 0.923 0.08 . 1 . . . . . . . . 4384 1 1774 . 1 1 168 168 LEU HD13 H 1 0.923 0.08 . 1 . . . . . . . . 4384 1 1775 . 1 1 168 168 LEU CD2 C 13 23.024 0.20 . 1 . . . . . . . . 4384 1 1776 . 1 1 168 168 LEU HD21 H 1 0.863 0.08 . 2 . . . . . . . . 4384 1 1777 . 1 1 168 168 LEU HD22 H 1 0.863 0.08 . 2 . . . . . . . . 4384 1 1778 . 1 1 168 168 LEU HD23 H 1 0.863 0.08 . 2 . . . . . . . . 4384 1 1779 . 1 1 168 168 LEU C C 13 177.723 0.05 . 1 . . . . . . . . 4384 1 1780 . 1 1 169 169 ALA N N 15 122.317 0.05 . 1 . . . . . . . . 4384 1 1781 . 1 1 169 169 ALA H H 1 7.928 0.02 . 1 . . . . . . . . 4384 1 1782 . 1 1 169 169 ALA CA C 13 52.699 0.20 . 1 . . . . . . . . 4384 1 1783 . 1 1 169 169 ALA HA H 1 4.226 0.08 . 1 . . . . . . . . 4384 1 1784 . 1 1 169 169 ALA CB C 13 19.412 0.20 . 1 . . . . . . . . 4384 1 1785 . 1 1 169 169 ALA HB1 H 1 1.395 0.08 . 1 . . . . . . . . 4384 1 1786 . 1 1 169 169 ALA HB2 H 1 1.395 0.08 . 1 . . . . . . . . 4384 1 1787 . 1 1 169 169 ALA HB3 H 1 1.395 0.08 . 1 . . . . . . . . 4384 1 1788 . 1 1 169 169 ALA C C 13 177.389 0.05 . 1 . . . . . . . . 4384 1 1789 . 1 1 170 170 GLU N N 15 120.393 0.05 . 1 . . . . . . . . 4384 1 1790 . 1 1 170 170 GLU H H 1 8.074 0.02 . 1 . . . . . . . . 4384 1 1791 . 1 1 170 170 GLU CA C 13 54.237 0.20 . 1 . . . . . . . . 4384 1 1792 . 1 1 170 170 GLU HA H 1 4.567 0.08 . 1 . . . . . . . . 4384 1 1793 . 1 1 170 170 GLU CB C 13 29.776 0.20 . 1 . . . . . . . . 4384 1 1794 . 1 1 170 170 GLU HB3 H 1 1.924 0.08 . 2 . . . . . . . . 4384 1 1795 . 1 1 170 170 GLU HB2 H 1 2.037 0.08 . 2 . . . . . . . . 4384 1 1796 . 1 1 170 170 GLU CG C 13 36.036 0.20 . 1 . . . . . . . . 4384 1 1797 . 1 1 170 170 GLU HG2 H 1 2.276 0.08 . 2 . . . . . . . . 4384 1 1798 . 1 1 170 170 GLU C C 13 174.556 0.05 . 1 . . . . . . . . 4384 1 1799 . 1 1 171 171 PRO CA C 13 63.200 0.20 . 1 . . . . . . . . 4384 1 1800 . 1 1 171 171 PRO HA H 1 4.403 0.08 . 1 . . . . . . . . 4384 1 1801 . 1 1 171 171 PRO CB C 13 32.264 0.20 . 1 . . . . . . . . 4384 1 1802 . 1 1 171 171 PRO HB3 H 1 1.921 0.08 . 2 . . . . . . . . 4384 1 1803 . 1 1 171 171 PRO HB2 H 1 2.277 0.08 . 2 . . . . . . . . 4384 1 1804 . 1 1 171 171 PRO CG C 13 27.396 0.20 . 1 . . . . . . . . 4384 1 1805 . 1 1 171 171 PRO HG2 H 1 2.008 0.08 . 2 . . . . . . . . 4384 1 1806 . 1 1 171 171 PRO CD C 13 50.692 0.20 . 1 . . . . . . . . 4384 1 1807 . 1 1 171 171 PRO HD2 H 1 3.783 0.08 . 2 . . . . . . . . 4384 1 1808 . 1 1 171 171 PRO C C 13 176.620 0.05 . 1 . . . . . . . . 4384 1 1809 . 1 1 172 172 ALA N N 15 124.358 0.05 . 1 . . . . . . . . 4384 1 1810 . 1 1 172 172 ALA H H 1 8.364 0.02 . 1 . . . . . . . . 4384 1 1811 . 1 1 172 172 ALA CA C 13 52.159 0.20 . 1 . . . . . . . . 4384 1 1812 . 1 1 172 172 ALA HA H 1 4.274 0.08 . 1 . . . . . . . . 4384 1 1813 . 1 1 172 172 ALA CB C 13 20.021 0.20 . 1 . . . . . . . . 4384 1 1814 . 1 1 172 172 ALA HB1 H 1 1.292 0.08 . 1 . . . . . . . . 4384 1 1815 . 1 1 172 172 ALA HB2 H 1 1.292 0.08 . 1 . . . . . . . . 4384 1 1816 . 1 1 172 172 ALA HB3 H 1 1.292 0.08 . 1 . . . . . . . . 4384 1 1817 . 1 1 172 172 ALA C C 13 177.115 0.05 . 1 . . . . . . . . 4384 1 1818 . 1 1 173 173 GLY N N 15 106.145 0.05 . 1 . . . . . . . . 4384 1 1819 . 1 1 173 173 GLY H H 1 7.261 0.02 . 1 . . . . . . . . 4384 1 1820 . 1 1 173 173 GLY CA C 13 44.591 0.20 . 1 . . . . . . . . 4384 1 1821 . 1 1 173 173 GLY HA3 H 1 2.964 0.08 . 2 . . . . . . . . 4384 1 1822 . 1 1 173 173 GLY HA2 H 1 3.843 0.08 . 2 . . . . . . . . 4384 1 1823 . 1 1 173 173 GLY C C 13 176.547 0.05 . 1 . . . . . . . . 4384 1 1824 . 1 1 174 174 PRO CA C 13 64.373 0.20 . 1 . . . . . . . . 4384 1 1825 . 1 1 174 174 PRO HA H 1 4.295 0.08 . 1 . . . . . . . . 4384 1 1826 . 1 1 174 174 PRO CB C 13 32.016 0.20 . 1 . . . . . . . . 4384 1 1827 . 1 1 174 174 PRO HB3 H 1 1.988 0.08 . 2 . . . . . . . . 4384 1 1828 . 1 1 174 174 PRO HB2 H 1 2.349 0.08 . 2 . . . . . . . . 4384 1 1829 . 1 1 174 174 PRO CG C 13 27.817 0.20 . 1 . . . . . . . . 4384 1 1830 . 1 1 174 174 PRO HG2 H 1 2.041 0.08 . 2 . . . . . . . . 4384 1 1831 . 1 1 174 174 PRO CD C 13 49.909 0.20 . 1 . . . . . . . . 4384 1 1832 . 1 1 174 174 PRO HD2 H 1 3.491 0.08 . 2 . . . . . . . . 4384 1 1833 . 1 1 174 174 PRO C C 13 177.614 0.05 . 1 . . . . . . . . 4384 1 1834 . 1 1 175 175 TRP N N 15 115.248 0.05 . 1 . . . . . . . . 4384 1 1835 . 1 1 175 175 TRP H H 1 6.712 0.02 . 1 . . . . . . . . 4384 1 1836 . 1 1 175 175 TRP CA C 13 58.077 0.20 . 1 . . . . . . . . 4384 1 1837 . 1 1 175 175 TRP HA H 1 4.345 0.08 . 1 . . . . . . . . 4384 1 1838 . 1 1 175 175 TRP CB C 13 28.319 0.20 . 1 . . . . . . . . 4384 1 1839 . 1 1 175 175 TRP HB3 H 1 2.907 0.08 . 2 . . . . . . . . 4384 1 1840 . 1 1 175 175 TRP HB2 H 1 3.366 0.08 . 2 . . . . . . . . 4384 1 1841 . 1 1 175 175 TRP CD1 C 13 127.147 0.20 . 1 . . . . . . . . 4384 1 1842 . 1 1 175 175 TRP HD1 H 1 7.083 0.08 . 2 . . . . . . . . 4384 1 1843 . 1 1 175 175 TRP NE1 N 15 132.193 0.05 . 1 . . . . . . . . 4384 1 1844 . 1 1 175 175 TRP HE1 H 1 10.575 0.08 . 1 . . . . . . . . 4384 1 1845 . 1 1 175 175 TRP CZ2 C 13 115.262 0.20 . 1 . . . . . . . . 4384 1 1846 . 1 1 175 175 TRP HZ2 H 1 7.535 0.08 . 1 . . . . . . . . 4384 1 1847 . 1 1 175 175 TRP CH2 C 13 125.356 0.20 . 1 . . . . . . . . 4384 1 1848 . 1 1 175 175 TRP HH2 H 1 7.351 0.08 . 1 . . . . . . . . 4384 1 1849 . 1 1 175 175 TRP CZ3 C 13 122.913 0.20 . 1 . . . . . . . . 4384 1 1850 . 1 1 175 175 TRP HZ3 H 1 7.301 0.08 . 1 . . . . . . . . 4384 1 1851 . 1 1 175 175 TRP CE3 C 13 118.923 0.20 . 1 . . . . . . . . 4384 1 1852 . 1 1 175 175 TRP HE3 H 1 7.276 0.08 . 1 . . . . . . . . 4384 1 1853 . 1 1 175 175 TRP C C 13 176.962 0.05 . 1 . . . . . . . . 4384 1 1854 . 1 1 176 176 ALA N N 15 123.964 0.05 . 1 . . . . . . . . 4384 1 1855 . 1 1 176 176 ALA H H 1 7.003 0.02 . 1 . . . . . . . . 4384 1 1856 . 1 1 176 176 ALA CA C 13 54.719 0.20 . 1 . . . . . . . . 4384 1 1857 . 1 1 176 176 ALA HA H 1 3.890 0.08 . 1 . . . . . . . . 4384 1 1858 . 1 1 176 176 ALA CB C 13 18.626 0.20 . 1 . . . . . . . . 4384 1 1859 . 1 1 176 176 ALA HB1 H 1 1.044 0.08 . 1 . . . . . . . . 4384 1 1860 . 1 1 176 176 ALA HB2 H 1 1.044 0.08 . 1 . . . . . . . . 4384 1 1861 . 1 1 176 176 ALA HB3 H 1 1.044 0.08 . 1 . . . . . . . . 4384 1 1862 . 1 1 176 176 ALA C C 13 177.463 0.05 . 1 . . . . . . . . 4384 1 1863 . 1 1 177 177 ASP N N 15 114.498 0.05 . 1 . . . . . . . . 4384 1 1864 . 1 1 177 177 ASP H H 1 7.616 0.02 . 1 . . . . . . . . 4384 1 1865 . 1 1 177 177 ASP CA C 13 53.516 0.20 . 1 . . . . . . . . 4384 1 1866 . 1 1 177 177 ASP HA H 1 4.787 0.08 . 1 . . . . . . . . 4384 1 1867 . 1 1 177 177 ASP CB C 13 41.522 0.20 . 1 . . . . . . . . 4384 1 1868 . 1 1 177 177 ASP HB3 H 1 2.502 0.08 . 2 . . . . . . . . 4384 1 1869 . 1 1 177 177 ASP HB2 H 1 2.791 0.08 . 2 . . . . . . . . 4384 1 1870 . 1 1 177 177 ASP C C 13 176.419 0.05 . 1 . . . . . . . . 4384 1 1871 . 1 1 178 178 ILE N N 15 121.640 0.05 . 1 . . . . . . . . 4384 1 1872 . 1 1 178 178 ILE H H 1 7.247 0.02 . 1 . . . . . . . . 4384 1 1873 . 1 1 178 178 ILE CA C 13 62.131 0.20 . 1 . . . . . . . . 4384 1 1874 . 1 1 178 178 ILE HA H 1 4.117 0.08 . 1 . . . . . . . . 4384 1 1875 . 1 1 178 178 ILE CB C 13 37.460 0.20 . 1 . . . . . . . . 4384 1 1876 . 1 1 178 178 ILE HB H 1 2.096 0.08 . 1 . . . . . . . . 4384 1 1877 . 1 1 178 178 ILE HG13 H 1 1.167 0.08 . 2 . . . . . . . . 4384 1 1878 . 1 1 178 178 ILE HG12 H 1 1.658 0.08 . 2 . . . . . . . . 4384 1 1879 . 1 1 178 178 ILE CD1 C 13 14.325 0.20 . 1 . . . . . . . . 4384 1 1880 . 1 1 178 178 ILE HD11 H 1 0.876 0.08 . 1 . . . . . . . . 4384 1 1881 . 1 1 178 178 ILE HD12 H 1 0.876 0.08 . 1 . . . . . . . . 4384 1 1882 . 1 1 178 178 ILE HD13 H 1 0.876 0.08 . 1 . . . . . . . . 4384 1 1883 . 1 1 178 178 ILE CG2 C 13 16.854 0.20 . 1 . . . . . . . . 4384 1 1884 . 1 1 178 178 ILE HG21 H 1 0.952 0.08 . 1 . . . . . . . . 4384 1 1885 . 1 1 178 178 ILE HG22 H 1 0.952 0.08 . 1 . . . . . . . . 4384 1 1886 . 1 1 178 178 ILE HG23 H 1 0.952 0.08 . 1 . . . . . . . . 4384 1 1887 . 1 1 178 178 ILE C C 13 174.652 0.05 . 1 . . . . . . . . 4384 1 1888 . 1 1 179 179 THR N N 15 119.060 0.05 . 1 . . . . . . . . 4384 1 1889 . 1 1 179 179 THR H H 1 8.323 0.02 . 1 . . . . . . . . 4384 1 1890 . 1 1 179 179 THR CA C 13 59.940 0.20 . 1 . . . . . . . . 4384 1 1891 . 1 1 179 179 THR HA H 1 4.800 0.08 . 1 . . . . . . . . 4384 1 1892 . 1 1 179 179 THR CB C 13 71.672 0.20 . 1 . . . . . . . . 4384 1 1893 . 1 1 179 179 THR HB H 1 4.064 0.08 . 1 . . . . . . . . 4384 1 1894 . 1 1 179 179 THR CG2 C 13 21.676 0.20 . 1 . . . . . . . . 4384 1 1895 . 1 1 179 179 THR HG21 H 1 1.194 0.08 . 1 . . . . . . . . 4384 1 1896 . 1 1 179 179 THR HG22 H 1 1.194 0.08 . 1 . . . . . . . . 4384 1 1897 . 1 1 179 179 THR HG23 H 1 1.194 0.08 . 1 . . . . . . . . 4384 1 1898 . 1 1 179 179 THR C C 13 173.559 0.05 . 1 . . . . . . . . 4384 1 1899 . 1 1 180 180 GLN N N 15 126.197 0.05 . 1 . . . . . . . . 4384 1 1900 . 1 1 180 180 GLN H H 1 7.454 0.02 . 1 . . . . . . . . 4384 1 1901 . 1 1 180 180 GLN CA C 13 55.922 0.20 . 1 . . . . . . . . 4384 1 1902 . 1 1 180 180 GLN HA H 1 3.967 0.08 . 1 . . . . . . . . 4384 1 1903 . 1 1 180 180 GLN CB C 13 27.362 0.20 . 1 . . . . . . . . 4384 1 1904 . 1 1 180 180 GLN HB3 H 1 0.180 0.08 . 2 . . . . . . . . 4384 1 1905 . 1 1 180 180 GLN HB2 H 1 1.646 0.08 . 2 . . . . . . . . 4384 1 1906 . 1 1 180 180 GLN CG C 13 32.440 0.20 . 1 . . . . . . . . 4384 1 1907 . 1 1 180 180 GLN HG3 H 1 2.057 0.08 . 2 . . . . . . . . 4384 1 1908 . 1 1 180 180 GLN HG2 H 1 2.986 0.08 . 2 . . . . . . . . 4384 1 1909 . 1 1 180 180 GLN CD C 13 178.566 0.20 . 1 . . . . . . . . 4384 1 1910 . 1 1 180 180 GLN NE2 N 15 105.343 0.05 . 1 . . . . . . . . 4384 1 1911 . 1 1 180 180 GLN HE21 H 1 7.473 0.02 . 1 . . . . . . . . 4384 1 1912 . 1 1 180 180 GLN HE22 H 1 6.118 0.02 . 1 . . . . . . . . 4384 1 1913 . 1 1 180 180 GLN C C 13 177.248 0.05 . 1 . . . . . . . . 4384 1 1914 . 1 1 181 181 GLY N N 15 119.743 0.05 . 1 . . . . . . . . 4384 1 1915 . 1 1 181 181 GLY H H 1 9.827 0.02 . 1 . . . . . . . . 4384 1 1916 . 1 1 181 181 GLY CA C 13 45.135 0.20 . 1 . . . . . . . . 4384 1 1917 . 1 1 181 181 GLY HA3 H 1 3.895 0.08 . 2 . . . . . . . . 4384 1 1918 . 1 1 181 181 GLY HA2 H 1 4.367 0.08 . 2 . . . . . . . . 4384 1 1919 . 1 1 181 181 GLY C C 13 173.361 0.05 . 9 . . . . . . . . 4384 1 1920 . 1 1 182 182 PRO CA C 13 65.026 0.20 . 1 . . . . . . . . 4384 1 1921 . 1 1 182 182 PRO HA H 1 4.200 0.08 . 1 . . . . . . . . 4384 1 1922 . 1 1 182 182 PRO CB C 13 31.892 0.20 . 1 . . . . . . . . 4384 1 1923 . 1 1 182 182 PRO HB3 H 1 2.031 0.08 . 2 . . . . . . . . 4384 1 1924 . 1 1 182 182 PRO HB2 H 1 2.331 0.08 . 2 . . . . . . . . 4384 1 1925 . 1 1 182 182 PRO CG C 13 27.709 0.20 . 1 . . . . . . . . 4384 1 1926 . 1 1 182 182 PRO HG2 H 1 2.084 0.08 . 2 . . . . . . . . 4384 1 1927 . 1 1 182 182 PRO CD C 13 50.157 0.20 . 1 . . . . . . . . 4384 1 1928 . 1 1 182 182 PRO HD3 H 1 3.678 0.08 . 2 . . . . . . . . 4384 1 1929 . 1 1 182 182 PRO HD2 H 1 3.739 0.08 . 2 . . . . . . . . 4384 1 1930 . 1 1 182 182 PRO C C 13 178.031 0.05 . 1 . . . . . . . . 4384 1 1931 . 1 1 183 183 SER N N 15 112.397 0.05 . 1 . . . . . . . . 4384 1 1932 . 1 1 183 183 SER H H 1 8.378 0.02 . 1 . . . . . . . . 4384 1 1933 . 1 1 183 183 SER CA C 13 56.828 0.20 . 1 . . . . . . . . 4384 1 1934 . 1 1 183 183 SER HA H 1 4.702 0.08 . 1 . . . . . . . . 4384 1 1935 . 1 1 183 183 SER CB C 13 63.635 0.20 . 1 . . . . . . . . 4384 1 1936 . 1 1 183 183 SER HB2 H 1 3.898 0.08 . 2 . . . . . . . . 4384 1 1937 . 1 1 183 183 SER C C 13 173.233 0.05 . 1 . . . . . . . . 4384 1 1938 . 1 1 184 184 GLU N N 15 125.602 0.05 . 1 . . . . . . . . 4384 1 1939 . 1 1 184 184 GLU H H 1 7.341 0.02 . 1 . . . . . . . . 4384 1 1940 . 1 1 184 184 GLU CA C 13 54.897 0.20 . 1 . . . . . . . . 4384 1 1941 . 1 1 184 184 GLU HA H 1 4.489 0.08 . 1 . . . . . . . . 4384 1 1942 . 1 1 184 184 GLU CB C 13 31.787 0.20 . 1 . . . . . . . . 4384 1 1943 . 1 1 184 184 GLU HB2 H 1 1.777 0.08 . 2 . . . . . . . . 4384 1 1944 . 1 1 184 184 GLU CG C 13 36.273 0.20 . 1 . . . . . . . . 4384 1 1945 . 1 1 184 184 GLU HG3 H 1 2.357 0.08 . 2 . . . . . . . . 4384 1 1946 . 1 1 184 184 GLU HG2 H 1 2.853 0.08 . 2 . . . . . . . . 4384 1 1947 . 1 1 184 184 GLU C C 13 176.673 0.05 . 1 . . . . . . . . 4384 1 1948 . 1 1 185 185 SER N N 15 126.645 0.05 . 1 . . . . . . . . 4384 1 1949 . 1 1 185 185 SER H H 1 9.710 0.02 . 1 . . . . . . . . 4384 1 1950 . 1 1 185 185 SER CA C 13 58.129 0.20 . 1 . . . . . . . . 4384 1 1951 . 1 1 185 185 SER HA H 1 4.440 0.08 . 1 . . . . . . . . 4384 1 1952 . 1 1 185 185 SER CB C 13 63.917 0.20 . 1 . . . . . . . . 4384 1 1953 . 1 1 185 185 SER HB3 H 1 4.113 0.08 . 2 . . . . . . . . 4384 1 1954 . 1 1 185 185 SER HB2 H 1 4.363 0.08 . 2 . . . . . . . . 4384 1 1955 . 1 1 185 185 SER C C 13 175.396 0.05 . 1 . . . . . . . . 4384 1 1956 . 1 1 186 186 PHE N N 15 124.574 0.05 . 1 . . . . . . . . 4384 1 1957 . 1 1 186 186 PHE H H 1 9.364 0.02 . 1 . . . . . . . . 4384 1 1958 . 1 1 186 186 PHE CA C 13 62.628 0.20 . 1 . . . . . . . . 4384 1 1959 . 1 1 186 186 PHE HA H 1 4.293 0.08 . 1 . . . . . . . . 4384 1 1960 . 1 1 186 186 PHE CB C 13 39.007 0.20 . 1 . . . . . . . . 4384 1 1961 . 1 1 186 186 PHE HB3 H 1 2.862 0.08 . 2 . . . . . . . . 4384 1 1962 . 1 1 186 186 PHE HB2 H 1 3.266 0.08 . 2 . . . . . . . . 4384 1 1963 . 1 1 186 186 PHE CD1 C 13 132.029 0.20 . 1 . . . . . . . . 4384 1 1964 . 1 1 186 186 PHE HD1 H 1 7.104 0.08 . 3 . . . . . . . . 4384 1 1965 . 1 1 186 186 PHE CE1 C 13 130.807 0.20 . 1 . . . . . . . . 4384 1 1966 . 1 1 186 186 PHE HE1 H 1 6.976 0.08 . 3 . . . . . . . . 4384 1 1967 . 1 1 186 186 PHE CZ C 13 127.832 0.20 . 1 . . . . . . . . 4384 1 1968 . 1 1 186 186 PHE HZ H 1 5.768 0.08 . 1 . . . . . . . . 4384 1 1969 . 1 1 186 186 PHE C C 13 176.877 0.05 . 1 . . . . . . . . 4384 1 1970 . 1 1 187 187 VAL N N 15 115.655 0.05 . 1 . . . . . . . . 4384 1 1971 . 1 1 187 187 VAL H H 1 8.259 0.02 . 1 . . . . . . . . 4384 1 1972 . 1 1 187 187 VAL CA C 13 66.314 0.20 . 1 . . . . . . . . 4384 1 1973 . 1 1 187 187 VAL HA H 1 3.411 0.08 . 1 . . . . . . . . 4384 1 1974 . 1 1 187 187 VAL CB C 13 32.091 0.20 . 1 . . . . . . . . 4384 1 1975 . 1 1 187 187 VAL HB H 1 1.974 0.08 . 1 . . . . . . . . 4384 1 1976 . 1 1 187 187 VAL CG2 C 13 23.169 0.20 . 1 . . . . . . . . 4384 1 1977 . 1 1 187 187 VAL HG21 H 1 1.075 0.08 . 2 . . . . . . . . 4384 1 1978 . 1 1 187 187 VAL HG22 H 1 1.075 0.08 . 2 . . . . . . . . 4384 1 1979 . 1 1 187 187 VAL HG23 H 1 1.075 0.08 . 2 . . . . . . . . 4384 1 1980 . 1 1 187 187 VAL CG1 C 13 20.747 0.20 . 1 . . . . . . . . 4384 1 1981 . 1 1 187 187 VAL HG11 H 1 0.915 0.08 . 1 . . . . . . . . 4384 1 1982 . 1 1 187 187 VAL HG12 H 1 0.915 0.08 . 1 . . . . . . . . 4384 1 1983 . 1 1 187 187 VAL HG13 H 1 0.915 0.08 . 1 . . . . . . . . 4384 1 1984 . 1 1 187 187 VAL C C 13 176.815 0.05 . 1 . . . . . . . . 4384 1 1985 . 1 1 188 188 ASP N N 15 121.470 0.05 . 1 . . . . . . . . 4384 1 1986 . 1 1 188 188 ASP H H 1 7.388 0.02 . 1 . . . . . . . . 4384 1 1987 . 1 1 188 188 ASP CA C 13 57.645 0.20 . 1 . . . . . . . . 4384 1 1988 . 1 1 188 188 ASP HA H 1 4.474 0.08 . 1 . . . . . . . . 4384 1 1989 . 1 1 188 188 ASP CB C 13 39.853 0.20 . 1 . . . . . . . . 4384 1 1990 . 1 1 188 188 ASP HB2 H 1 2.758 0.08 . 2 . . . . . . . . 4384 1 1991 . 1 1 188 188 ASP C C 13 179.424 0.05 . 1 . . . . . . . . 4384 1 1992 . 1 1 189 189 PHE N N 15 123.906 0.05 . 1 . . . . . . . . 4384 1 1993 . 1 1 189 189 PHE H H 1 7.876 0.02 . 1 . . . . . . . . 4384 1 1994 . 1 1 189 189 PHE CA C 13 59.479 0.20 . 1 . . . . . . . . 4384 1 1995 . 1 1 189 189 PHE HA H 1 4.409 0.08 . 1 . . . . . . . . 4384 1 1996 . 1 1 189 189 PHE CB C 13 38.911 0.20 . 1 . . . . . . . . 4384 1 1997 . 1 1 189 189 PHE HB3 H 1 2.890 0.08 . 2 . . . . . . . . 4384 1 1998 . 1 1 189 189 PHE HB2 H 1 3.330 0.08 . 2 . . . . . . . . 4384 1 1999 . 1 1 189 189 PHE CD1 C 13 132.370 0.20 . 1 . . . . . . . . 4384 1 2000 . 1 1 189 189 PHE HD1 H 1 7.004 0.08 . 3 . . . . . . . . 4384 1 2001 . 1 1 189 189 PHE CE1 C 13 131.202 0.20 . 1 . . . . . . . . 4384 1 2002 . 1 1 189 189 PHE HE1 H 1 7.201 0.08 . 3 . . . . . . . . 4384 1 2003 . 1 1 189 189 PHE CZ C 13 129.464 0.20 . 1 . . . . . . . . 4384 1 2004 . 1 1 189 189 PHE HZ H 1 7.105 0.08 . 1 . . . . . . . . 4384 1 2005 . 1 1 189 189 PHE C C 13 175.626 0.05 . 1 . . . . . . . . 4384 1 2006 . 1 1 190 190 ALA N N 15 122.416 0.05 . 1 . . . . . . . . 4384 1 2007 . 1 1 190 190 ALA H H 1 8.873 0.02 . 1 . . . . . . . . 4384 1 2008 . 1 1 190 190 ALA CA C 13 54.982 0.20 . 1 . . . . . . . . 4384 1 2009 . 1 1 190 190 ALA HA H 1 3.262 0.08 . 1 . . . . . . . . 4384 1 2010 . 1 1 190 190 ALA CB C 13 17.432 0.20 . 1 . . . . . . . . 4384 1 2011 . 1 1 190 190 ALA HB1 H 1 0.809 0.08 . 1 . . . . . . . . 4384 1 2012 . 1 1 190 190 ALA HB2 H 1 0.809 0.08 . 1 . . . . . . . . 4384 1 2013 . 1 1 190 190 ALA HB3 H 1 0.809 0.08 . 1 . . . . . . . . 4384 1 2014 . 1 1 190 190 ALA C C 13 179.400 0.05 . 1 . . . . . . . . 4384 1 2015 . 1 1 191 191 ASN N N 15 114.261 0.05 . 1 . . . . . . . . 4384 1 2016 . 1 1 191 191 ASN H H 1 8.076 0.02 . 1 . . . . . . . . 4384 1 2017 . 1 1 191 191 ASN CA C 13 56.243 0.20 . 1 . . . . . . . . 4384 1 2018 . 1 1 191 191 ASN HA H 1 4.396 0.08 . 1 . . . . . . . . 4384 1 2019 . 1 1 191 191 ASN CB C 13 38.208 0.20 . 1 . . . . . . . . 4384 1 2020 . 1 1 191 191 ASN HB3 H 1 2.702 0.08 . 2 . . . . . . . . 4384 1 2021 . 1 1 191 191 ASN HB2 H 1 2.892 0.08 . 2 . . . . . . . . 4384 1 2022 . 1 1 191 191 ASN CG C 13 175.868 0.20 . 1 . . . . . . . . 4384 1 2023 . 1 1 191 191 ASN ND2 N 15 112.125 0.05 . 1 . . . . . . . . 4384 1 2024 . 1 1 191 191 ASN HD21 H 1 7.711 0.02 . 1 . . . . . . . . 4384 1 2025 . 1 1 191 191 ASN HD22 H 1 6.779 0.02 . 1 . . . . . . . . 4384 1 2026 . 1 1 191 191 ASN C C 13 178.283 0.05 . 1 . . . . . . . . 4384 1 2027 . 1 1 192 192 ARG N N 15 120.518 0.05 . 1 . . . . . . . . 4384 1 2028 . 1 1 192 192 ARG H H 1 7.665 0.02 . 1 . . . . . . . . 4384 1 2029 . 1 1 192 192 ARG CA C 13 59.996 0.20 . 1 . . . . . . . . 4384 1 2030 . 1 1 192 192 ARG HA H 1 4.090 0.08 . 1 . . . . . . . . 4384 1 2031 . 1 1 192 192 ARG CB C 13 30.674 0.20 . 1 . . . . . . . . 4384 1 2032 . 1 1 192 192 ARG HB3 H 1 1.878 0.08 . 2 . . . . . . . . 4384 1 2033 . 1 1 192 192 ARG HB2 H 1 2.076 0.08 . 2 . . . . . . . . 4384 1 2034 . 1 1 192 192 ARG CG C 13 28.756 0.20 . 1 . . . . . . . . 4384 1 2035 . 1 1 192 192 ARG HG3 H 1 1.688 0.08 . 2 . . . . . . . . 4384 1 2036 . 1 1 192 192 ARG HG2 H 1 1.906 0.08 . 2 . . . . . . . . 4384 1 2037 . 1 1 192 192 ARG CD C 13 43.644 0.20 . 1 . . . . . . . . 4384 1 2038 . 1 1 192 192 ARG HD2 H 1 3.225 0.08 . 2 . . . . . . . . 4384 1 2039 . 1 1 192 192 ARG C C 13 179.347 0.05 . 1 . . . . . . . . 4384 1 2040 . 1 1 193 193 LEU N N 15 122.081 0.05 . 1 . . . . . . . . 4384 1 2041 . 1 1 193 193 LEU H H 1 8.306 0.02 . 1 . . . . . . . . 4384 1 2042 . 1 1 193 193 LEU CA C 13 58.031 0.20 . 1 . . . . . . . . 4384 1 2043 . 1 1 193 193 LEU HA H 1 4.017 0.08 . 1 . . . . . . . . 4384 1 2044 . 1 1 193 193 LEU CB C 13 42.215 0.20 . 1 . . . . . . . . 4384 1 2045 . 1 1 193 193 LEU HB3 H 1 1.182 0.08 . 2 . . . . . . . . 4384 1 2046 . 1 1 193 193 LEU HB2 H 1 1.510 0.08 . 2 . . . . . . . . 4384 1 2047 . 1 1 193 193 LEU CG C 13 27.458 0.20 . 1 . . . . . . . . 4384 1 2048 . 1 1 193 193 LEU HG H 1 1.288 0.08 . 1 . . . . . . . . 4384 1 2049 . 1 1 193 193 LEU CD1 C 13 26.968 0.20 . 1 . . . . . . . . 4384 1 2050 . 1 1 193 193 LEU HD11 H 1 0.753 0.08 . 1 . . . . . . . . 4384 1 2051 . 1 1 193 193 LEU HD12 H 1 0.753 0.08 . 1 . . . . . . . . 4384 1 2052 . 1 1 193 193 LEU HD13 H 1 0.753 0.08 . 1 . . . . . . . . 4384 1 2053 . 1 1 193 193 LEU CD2 C 13 24.866 0.20 . 1 . . . . . . . . 4384 1 2054 . 1 1 193 193 LEU HD21 H 1 0.853 0.08 . 2 . . . . . . . . 4384 1 2055 . 1 1 193 193 LEU HD22 H 1 0.853 0.08 . 2 . . . . . . . . 4384 1 2056 . 1 1 193 193 LEU HD23 H 1 0.853 0.08 . 2 . . . . . . . . 4384 1 2057 . 1 1 193 193 LEU C C 13 178.335 0.05 . 1 . . . . . . . . 4384 1 2058 . 1 1 194 194 ILE N N 15 119.344 0.05 . 1 . . . . . . . . 4384 1 2059 . 1 1 194 194 ILE H H 1 8.841 0.02 . 1 . . . . . . . . 4384 1 2060 . 1 1 194 194 ILE CA C 13 66.636 0.20 . 1 . . . . . . . . 4384 1 2061 . 1 1 194 194 ILE HA H 1 3.239 0.08 . 1 . . . . . . . . 4384 1 2062 . 1 1 194 194 ILE CB C 13 38.112 0.20 . 1 . . . . . . . . 4384 1 2063 . 1 1 194 194 ILE HB H 1 1.781 0.08 . 1 . . . . . . . . 4384 1 2064 . 1 1 194 194 ILE CG1 C 13 31.090 0.20 . 1 . . . . . . . . 4384 1 2065 . 1 1 194 194 ILE HG13 H 1 0.859 0.08 . 2 . . . . . . . . 4384 1 2066 . 1 1 194 194 ILE HG12 H 1 1.825 0.08 . 2 . . . . . . . . 4384 1 2067 . 1 1 194 194 ILE CD1 C 13 13.801 0.20 . 1 . . . . . . . . 4384 1 2068 . 1 1 194 194 ILE HD11 H 1 0.853 0.08 . 1 . . . . . . . . 4384 1 2069 . 1 1 194 194 ILE HD12 H 1 0.853 0.08 . 1 . . . . . . . . 4384 1 2070 . 1 1 194 194 ILE HD13 H 1 0.853 0.08 . 1 . . . . . . . . 4384 1 2071 . 1 1 194 194 ILE CG2 C 13 17.325 0.20 . 1 . . . . . . . . 4384 1 2072 . 1 1 194 194 ILE HG21 H 1 0.824 0.08 . 1 . . . . . . . . 4384 1 2073 . 1 1 194 194 ILE HG22 H 1 0.824 0.08 . 1 . . . . . . . . 4384 1 2074 . 1 1 194 194 ILE HG23 H 1 0.824 0.08 . 1 . . . . . . . . 4384 1 2075 . 1 1 194 194 ILE C C 13 178.242 0.05 . 1 . . . . . . . . 4384 1 2076 . 1 1 195 195 LYS N N 15 118.049 0.05 . 1 . . . . . . . . 4384 1 2077 . 1 1 195 195 LYS H H 1 7.763 0.02 . 1 . . . . . . . . 4384 1 2078 . 1 1 195 195 LYS CA C 13 59.500 0.20 . 1 . . . . . . . . 4384 1 2079 . 1 1 195 195 LYS HA H 1 4.025 0.08 . 1 . . . . . . . . 4384 1 2080 . 1 1 195 195 LYS CB C 13 32.368 0.20 . 1 . . . . . . . . 4384 1 2081 . 1 1 195 195 LYS HB3 H 1 1.836 0.08 . 2 . . . . . . . . 4384 1 2082 . 1 1 195 195 LYS HB2 H 1 1.912 0.08 . 2 . . . . . . . . 4384 1 2083 . 1 1 195 195 LYS CG C 13 25.319 0.20 . 1 . . . . . . . . 4384 1 2084 . 1 1 195 195 LYS HG2 H 1 1.680 0.08 . 2 . . . . . . . . 4384 1 2085 . 1 1 195 195 LYS CD C 13 29.044 0.20 . 1 . . . . . . . . 4384 1 2086 . 1 1 195 195 LYS HD2 H 1 1.684 0.08 . 2 . . . . . . . . 4384 1 2087 . 1 1 195 195 LYS CE C 13 42.143 0.20 . 1 . . . . . . . . 4384 1 2088 . 1 1 195 195 LYS HE2 H 1 2.977 0.08 . 2 . . . . . . . . 4384 1 2089 . 1 1 195 195 LYS C C 13 179.818 0.05 . 1 . . . . . . . . 4384 1 2090 . 1 1 196 196 ALA N N 15 121.274 0.05 . 1 . . . . . . . . 4384 1 2091 . 1 1 196 196 ALA H H 1 7.610 0.02 . 1 . . . . . . . . 4384 1 2092 . 1 1 196 196 ALA CA C 13 54.848 0.20 . 1 . . . . . . . . 4384 1 2093 . 1 1 196 196 ALA HA H 1 4.220 0.08 . 1 . . . . . . . . 4384 1 2094 . 1 1 196 196 ALA CB C 13 19.012 0.20 . 1 . . . . . . . . 4384 1 2095 . 1 1 196 196 ALA HB1 H 1 1.582 0.08 . 1 . . . . . . . . 4384 1 2096 . 1 1 196 196 ALA HB2 H 1 1.582 0.08 . 1 . . . . . . . . 4384 1 2097 . 1 1 196 196 ALA HB3 H 1 1.582 0.08 . 1 . . . . . . . . 4384 1 2098 . 1 1 196 196 ALA C C 13 180.672 0.05 . 1 . . . . . . . . 4384 1 2099 . 1 1 197 197 VAL N N 15 118.236 0.05 . 1 . . . . . . . . 4384 1 2100 . 1 1 197 197 VAL H H 1 8.273 0.02 . 1 . . . . . . . . 4384 1 2101 . 1 1 197 197 VAL CA C 13 66.550 0.20 . 1 . . . . . . . . 4384 1 2102 . 1 1 197 197 VAL HA H 1 3.559 0.08 . 1 . . . . . . . . 4384 1 2103 . 1 1 197 197 VAL CB C 13 31.772 0.20 . 1 . . . . . . . . 4384 1 2104 . 1 1 197 197 VAL HB H 1 1.842 0.08 . 1 . . . . . . . . 4384 1 2105 . 1 1 197 197 VAL CG2 C 13 23.147 0.20 . 1 . . . . . . . . 4384 1 2106 . 1 1 197 197 VAL HG21 H 1 0.584 0.08 . 2 . . . . . . . . 4384 1 2107 . 1 1 197 197 VAL HG22 H 1 0.584 0.08 . 2 . . . . . . . . 4384 1 2108 . 1 1 197 197 VAL HG23 H 1 0.584 0.08 . 2 . . . . . . . . 4384 1 2109 . 1 1 197 197 VAL CG1 C 13 21.315 0.20 . 1 . . . . . . . . 4384 1 2110 . 1 1 197 197 VAL HG11 H 1 0.577 0.08 . 1 . . . . . . . . 4384 1 2111 . 1 1 197 197 VAL HG12 H 1 0.577 0.08 . 1 . . . . . . . . 4384 1 2112 . 1 1 197 197 VAL HG13 H 1 0.577 0.08 . 1 . . . . . . . . 4384 1 2113 . 1 1 197 197 VAL C C 13 180.140 0.05 . 1 . . . . . . . . 4384 1 2114 . 1 1 198 198 GLU N N 15 121.403 0.05 . 1 . . . . . . . . 4384 1 2115 . 1 1 198 198 GLU H H 1 9.151 0.02 . 1 . . . . . . . . 4384 1 2116 . 1 1 198 198 GLU CA C 13 59.776 0.20 . 1 . . . . . . . . 4384 1 2117 . 1 1 198 198 GLU HA H 1 3.874 0.08 . 1 . . . . . . . . 4384 1 2118 . 1 1 198 198 GLU CB C 13 29.352 0.20 . 1 . . . . . . . . 4384 1 2119 . 1 1 198 198 GLU HB2 H 1 2.041 0.08 . 2 . . . . . . . . 4384 1 2120 . 1 1 198 198 GLU CG C 13 37.431 0.20 . 1 . . . . . . . . 4384 1 2121 . 1 1 198 198 GLU HG3 H 1 2.066 0.08 . 2 . . . . . . . . 4384 1 2122 . 1 1 198 198 GLU HG2 H 1 2.481 0.08 . 2 . . . . . . . . 4384 1 2123 . 1 1 198 198 GLU C C 13 177.498 0.05 . 1 . . . . . . . . 4384 1 2124 . 1 1 199 199 GLY N N 15 103.946 0.05 . 1 . . . . . . . . 4384 1 2125 . 1 1 199 199 GLY H H 1 7.540 0.02 . 1 . . . . . . . . 4384 1 2126 . 1 1 199 199 GLY CA C 13 45.064 0.20 . 1 . . . . . . . . 4384 1 2127 . 1 1 199 199 GLY HA3 H 1 3.773 0.08 . 2 . . . . . . . . 4384 1 2128 . 1 1 199 199 GLY HA2 H 1 4.331 0.08 . 2 . . . . . . . . 4384 1 2129 . 1 1 199 199 GLY C C 13 174.297 0.05 . 1 . . . . . . . . 4384 1 2130 . 1 1 200 200 SER N N 15 116.984 0.05 . 1 . . . . . . . . 4384 1 2131 . 1 1 200 200 SER H H 1 7.450 0.02 . 1 . . . . . . . . 4384 1 2132 . 1 1 200 200 SER CA C 13 58.657 0.20 . 1 . . . . . . . . 4384 1 2133 . 1 1 200 200 SER HA H 1 4.801 0.08 . 1 . . . . . . . . 4384 1 2134 . 1 1 200 200 SER CB C 13 65.957 0.20 . 1 . . . . . . . . 4384 1 2135 . 1 1 200 200 SER HB3 H 1 4.411 0.08 . 2 . . . . . . . . 4384 1 2136 . 1 1 200 200 SER HB2 H 1 4.583 0.08 . 2 . . . . . . . . 4384 1 2137 . 1 1 200 200 SER HG H 1 5.94 0.08 . 1 . . . . . . . . 4384 1 2138 . 1 1 200 200 SER C C 13 173.315 0.05 . 1 . . . . . . . . 4384 1 2139 . 1 1 201 201 ASP N N 15 116.918 0.05 . 1 . . . . . . . . 4384 1 2140 . 1 1 201 201 ASP H H 1 8.599 0.02 . 1 . . . . . . . . 4384 1 2141 . 1 1 201 201 ASP CA C 13 53.681 0.20 . 1 . . . . . . . . 4384 1 2142 . 1 1 201 201 ASP HA H 1 4.750 0.08 . 1 . . . . . . . . 4384 1 2143 . 1 1 201 201 ASP CB C 13 40.526 0.20 . 1 . . . . . . . . 4384 1 2144 . 1 1 201 201 ASP HB2 H 1 2.838 0.08 . 2 . . . . . . . . 4384 1 2145 . 1 1 201 201 ASP C C 13 176.937 0.05 . 1 . . . . . . . . 4384 1 2146 . 1 1 202 202 LEU N N 15 122.329 0.05 . 1 . . . . . . . . 4384 1 2147 . 1 1 202 202 LEU H H 1 8.012 0.02 . 1 . . . . . . . . 4384 1 2148 . 1 1 202 202 LEU CA C 13 53.793 0.20 . 1 . . . . . . . . 4384 1 2149 . 1 1 202 202 LEU HA H 1 4.425 0.08 . 1 . . . . . . . . 4384 1 2150 . 1 1 202 202 LEU CB C 13 42.640 0.20 . 1 . . . . . . . . 4384 1 2151 . 1 1 202 202 LEU HB3 H 1 1.190 0.08 . 2 . . . . . . . . 4384 1 2152 . 1 1 202 202 LEU HB2 H 1 1.525 0.08 . 2 . . . . . . . . 4384 1 2153 . 1 1 202 202 LEU CG C 13 26.960 0.20 . 1 . . . . . . . . 4384 1 2154 . 1 1 202 202 LEU HG H 1 1.802 0.08 . 1 . . . . . . . . 4384 1 2155 . 1 1 202 202 LEU CD1 C 13 26.177 0.20 . 1 . . . . . . . . 4384 1 2156 . 1 1 202 202 LEU HD11 H 1 0.521 0.08 . 1 . . . . . . . . 4384 1 2157 . 1 1 202 202 LEU HD12 H 1 0.521 0.08 . 1 . . . . . . . . 4384 1 2158 . 1 1 202 202 LEU HD13 H 1 0.521 0.08 . 1 . . . . . . . . 4384 1 2159 . 1 1 202 202 LEU CD2 C 13 24.194 0.20 . 1 . . . . . . . . 4384 1 2160 . 1 1 202 202 LEU HD21 H 1 0.806 0.08 . 2 . . . . . . . . 4384 1 2161 . 1 1 202 202 LEU HD22 H 1 0.806 0.08 . 2 . . . . . . . . 4384 1 2162 . 1 1 202 202 LEU HD23 H 1 0.806 0.08 . 2 . . . . . . . . 4384 1 2163 . 1 1 202 202 LEU C C 13 171.669 0.05 . 9 . . . . . . . . 4384 1 2164 . 1 1 203 203 PRO CA C 13 61.567 0.20 . 1 . . . . . . . . 4384 1 2165 . 1 1 203 203 PRO HA H 1 4.773 0.08 . 1 . . . . . . . . 4384 1 2166 . 1 1 203 203 PRO CB C 13 31.187 0.20 . 1 . . . . . . . . 4384 1 2167 . 1 1 203 203 PRO HB3 H 1 1.895 0.08 . 2 . . . . . . . . 4384 1 2168 . 1 1 203 203 PRO HB2 H 1 2.465 0.08 . 2 . . . . . . . . 4384 1 2169 . 1 1 203 203 PRO CG C 13 27.907 0.20 . 1 . . . . . . . . 4384 1 2170 . 1 1 203 203 PRO HG2 H 1 2.108 0.08 . 2 . . . . . . . . 4384 1 2171 . 1 1 203 203 PRO CD C 13 50.617 0.20 . 1 . . . . . . . . 4384 1 2172 . 1 1 203 203 PRO HD3 H 1 3.484 0.08 . 2 . . . . . . . . 4384 1 2173 . 1 1 203 203 PRO HD2 H 1 4.002 0.08 . 2 . . . . . . . . 4384 1 2174 . 1 1 203 203 PRO C C 13 176.348 0.05 . 1 . . . . . . . . 4384 1 2175 . 1 1 204 204 PRO CA C 13 66.371 0.20 . 1 . . . . . . . . 4384 1 2176 . 1 1 204 204 PRO HA H 1 3.869 0.08 . 1 . . . . . . . . 4384 1 2177 . 1 1 204 204 PRO CB C 13 32.349 0.20 . 1 . . . . . . . . 4384 1 2178 . 1 1 204 204 PRO HB3 H 1 2.005 0.08 . 2 . . . . . . . . 4384 1 2179 . 1 1 204 204 PRO HB2 H 1 2.360 0.08 . 2 . . . . . . . . 4384 1 2180 . 1 1 204 204 PRO CG C 13 28.013 0.20 . 1 . . . . . . . . 4384 1 2181 . 1 1 204 204 PRO HG3 H 1 1.981 0.08 . 2 . . . . . . . . 4384 1 2182 . 1 1 204 204 PRO HG2 H 1 2.204 0.08 . 2 . . . . . . . . 4384 1 2183 . 1 1 204 204 PRO CD C 13 50.552 0.20 . 1 . . . . . . . . 4384 1 2184 . 1 1 204 204 PRO HD3 H 1 3.822 0.08 . 2 . . . . . . . . 4384 1 2185 . 1 1 204 204 PRO HD2 H 1 3.883 0.08 . 2 . . . . . . . . 4384 1 2186 . 1 1 204 204 PRO C C 13 179.271 0.05 . 1 . . . . . . . . 4384 1 2187 . 1 1 205 205 SER N N 15 110.792 0.05 . 1 . . . . . . . . 4384 1 2188 . 1 1 205 205 SER H H 1 8.395 0.02 . 1 . . . . . . . . 4384 1 2189 . 1 1 205 205 SER CA C 13 60.541 0.20 . 1 . . . . . . . . 4384 1 2190 . 1 1 205 205 SER HA H 1 4.182 0.08 . 1 . . . . . . . . 4384 1 2191 . 1 1 205 205 SER CB C 13 63.093 0.20 . 1 . . . . . . . . 4384 1 2192 . 1 1 205 205 SER HB2 H 1 3.932 0.08 . 2 . . . . . . . . 4384 1 2193 . 1 1 205 205 SER C C 13 174.715 0.05 . 1 . . . . . . . . 4384 1 2194 . 1 1 206 206 ALA N N 15 122.690 0.05 . 1 . . . . . . . . 4384 1 2195 . 1 1 206 206 ALA H H 1 7.922 0.02 . 1 . . . . . . . . 4384 1 2196 . 1 1 206 206 ALA CA C 13 51.663 0.20 . 1 . . . . . . . . 4384 1 2197 . 1 1 206 206 ALA HA H 1 4.456 0.08 . 1 . . . . . . . . 4384 1 2198 . 1 1 206 206 ALA CB C 13 20.638 0.20 . 1 . . . . . . . . 4384 1 2199 . 1 1 206 206 ALA HB1 H 1 1.442 0.08 . 1 . . . . . . . . 4384 1 2200 . 1 1 206 206 ALA HB2 H 1 1.442 0.08 . 1 . . . . . . . . 4384 1 2201 . 1 1 206 206 ALA HB3 H 1 1.442 0.08 . 1 . . . . . . . . 4384 1 2202 . 1 1 206 206 ALA C C 13 177.932 0.05 . 1 . . . . . . . . 4384 1 2203 . 1 1 207 207 ARG N N 15 116.470 0.05 . 1 . . . . . . . . 4384 1 2204 . 1 1 207 207 ARG H H 1 7.161 0.02 . 1 . . . . . . . . 4384 1 2205 . 1 1 207 207 ARG CA C 13 60.701 0.20 . 1 . . . . . . . . 4384 1 2206 . 1 1 207 207 ARG HA H 1 3.462 0.08 . 1 . . . . . . . . 4384 1 2207 . 1 1 207 207 ARG CB C 13 30.814 0.20 . 1 . . . . . . . . 4384 1 2208 . 1 1 207 207 ARG HB3 H 1 1.543 0.08 . 2 . . . . . . . . 4384 1 2209 . 1 1 207 207 ARG HB2 H 1 1.755 0.08 . 2 . . . . . . . . 4384 1 2210 . 1 1 207 207 ARG CG C 13 28.542 0.20 . 1 . . . . . . . . 4384 1 2211 . 1 1 207 207 ARG HG3 H 1 1.070 0.08 . 2 . . . . . . . . 4384 1 2212 . 1 1 207 207 ARG HG2 H 1 1.940 0.08 . 2 . . . . . . . . 4384 1 2213 . 1 1 207 207 ARG CD C 13 43.406 0.20 . 1 . . . . . . . . 4384 1 2214 . 1 1 207 207 ARG HD3 H 1 2.969 0.08 . 2 . . . . . . . . 4384 1 2215 . 1 1 207 207 ARG HD2 H 1 3.202 0.08 . 2 . . . . . . . . 4384 1 2216 . 1 1 207 207 ARG C C 13 176.778 0.05 . 1 . . . . . . . . 4384 1 2217 . 1 1 208 208 ALA N N 15 119.293 0.05 . 1 . . . . . . . . 4384 1 2218 . 1 1 208 208 ALA H H 1 8.673 0.02 . 1 . . . . . . . . 4384 1 2219 . 1 1 208 208 ALA CA C 13 57.132 0.20 . 1 . . . . . . . . 4384 1 2220 . 1 1 208 208 ALA HA H 1 4.015 0.08 . 1 . . . . . . . . 4384 1 2221 . 1 1 208 208 ALA CB C 13 15.771 0.20 . 1 . . . . . . . . 4384 1 2222 . 1 1 208 208 ALA HB1 H 1 1.513 0.08 . 1 . . . . . . . . 4384 1 2223 . 1 1 208 208 ALA HB2 H 1 1.513 0.08 . 1 . . . . . . . . 4384 1 2224 . 1 1 208 208 ALA HB3 H 1 1.513 0.08 . 1 . . . . . . . . 4384 1 2225 . 1 1 208 208 ALA C C 13 176.148 0.05 . 1 . . . . . . . . 4384 1 2226 . 1 1 209 209 PRO CA C 13 65.987 0.20 . 1 . . . . . . . . 4384 1 2227 . 1 1 209 209 PRO HA H 1 4.142 0.08 . 1 . . . . . . . . 4384 1 2228 . 1 1 209 209 PRO CB C 13 31.046 0.20 . 1 . . . . . . . . 4384 1 2229 . 1 1 209 209 PRO HB3 H 1 1.809 0.08 . 2 . . . . . . . . 4384 1 2230 . 1 1 209 209 PRO HB2 H 1 2.249 0.08 . 2 . . . . . . . . 4384 1 2231 . 1 1 209 209 PRO CG C 13 27.890 0.20 . 1 . . . . . . . . 4384 1 2232 . 1 1 209 209 PRO HG2 H 1 2.110 0.08 . 2 . . . . . . . . 4384 1 2233 . 1 1 209 209 PRO CD C 13 49.888 0.20 . 1 . . . . . . . . 4384 1 2234 . 1 1 209 209 PRO HD2 H 1 3.569 0.08 . 2 . . . . . . . . 4384 1 2235 . 1 1 209 209 PRO C C 13 179.971 0.05 . 1 . . . . . . . . 4384 1 2236 . 1 1 210 210 VAL N N 15 118.084 0.05 . 1 . . . . . . . . 4384 1 2237 . 1 1 210 210 VAL H H 1 6.952 0.02 . 1 . . . . . . . . 4384 1 2238 . 1 1 210 210 VAL CA C 13 66.571 0.20 . 1 . . . . . . . . 4384 1 2239 . 1 1 210 210 VAL HA H 1 3.642 0.08 . 1 . . . . . . . . 4384 1 2240 . 1 1 210 210 VAL CB C 13 31.813 0.20 . 1 . . . . . . . . 4384 1 2241 . 1 1 210 210 VAL HB H 1 1.772 0.08 . 1 . . . . . . . . 4384 1 2242 . 1 1 210 210 VAL CG2 C 13 23.409 0.20 . 1 . . . . . . . . 4384 1 2243 . 1 1 210 210 VAL HG21 H 1 0.864 0.08 . 2 . . . . . . . . 4384 1 2244 . 1 1 210 210 VAL HG22 H 1 0.864 0.08 . 2 . . . . . . . . 4384 1 2245 . 1 1 210 210 VAL HG23 H 1 0.864 0.08 . 2 . . . . . . . . 4384 1 2246 . 1 1 210 210 VAL CG1 C 13 20.605 0.20 . 1 . . . . . . . . 4384 1 2247 . 1 1 210 210 VAL HG11 H 1 0.026 0.08 . 1 . . . . . . . . 4384 1 2248 . 1 1 210 210 VAL HG12 H 1 0.026 0.08 . 1 . . . . . . . . 4384 1 2249 . 1 1 210 210 VAL HG13 H 1 0.026 0.08 . 1 . . . . . . . . 4384 1 2250 . 1 1 210 210 VAL C C 13 179.440 0.05 . 1 . . . . . . . . 4384 1 2251 . 1 1 211 211 ILE N N 15 120.879 0.05 . 1 . . . . . . . . 4384 1 2252 . 1 1 211 211 ILE H H 1 8.083 0.02 . 1 . . . . . . . . 4384 1 2253 . 1 1 211 211 ILE CA C 13 66.010 0.20 . 1 . . . . . . . . 4384 1 2254 . 1 1 211 211 ILE HA H 1 2.950 0.08 . 1 . . . . . . . . 4384 1 2255 . 1 1 211 211 ILE CB C 13 37.894 0.20 . 1 . . . . . . . . 4384 1 2256 . 1 1 211 211 ILE HB H 1 1.565 0.08 . 1 . . . . . . . . 4384 1 2257 . 1 1 211 211 ILE CG1 C 13 30.910 0.20 . 1 . . . . . . . . 4384 1 2258 . 1 1 211 211 ILE HG13 H 1 0.327 0.08 . 2 . . . . . . . . 4384 1 2259 . 1 1 211 211 ILE HG12 H 1 1.602 0.08 . 2 . . . . . . . . 4384 1 2260 . 1 1 211 211 ILE CD1 C 13 14.828 0.20 . 1 . . . . . . . . 4384 1 2261 . 1 1 211 211 ILE HD11 H 1 0.690 0.08 . 1 . . . . . . . . 4384 1 2262 . 1 1 211 211 ILE HD12 H 1 0.690 0.08 . 1 . . . . . . . . 4384 1 2263 . 1 1 211 211 ILE HD13 H 1 0.690 0.08 . 1 . . . . . . . . 4384 1 2264 . 1 1 211 211 ILE CG2 C 13 18.706 0.20 . 1 . . . . . . . . 4384 1 2265 . 1 1 211 211 ILE HG21 H 1 0.016 0.08 . 1 . . . . . . . . 4384 1 2266 . 1 1 211 211 ILE HG22 H 1 0.016 0.08 . 1 . . . . . . . . 4384 1 2267 . 1 1 211 211 ILE HG23 H 1 0.016 0.08 . 1 . . . . . . . . 4384 1 2268 . 1 1 211 211 ILE C C 13 177.056 0.05 . 9 . . . . . . . . 4384 1 2269 . 1 1 212 212 ILE N N 15 117.173 0.05 . 1 . . . . . . . . 4384 1 2270 . 1 1 212 212 ILE H H 1 8.164 0.02 . 1 . . . . . . . . 4384 1 2271 . 1 1 212 212 ILE CA C 13 65.692 0.20 . 1 . . . . . . . . 4384 1 2272 . 1 1 212 212 ILE HA H 1 3.320 0.08 . 1 . . . . . . . . 4384 1 2273 . 1 1 212 212 ILE CB C 13 37.548 0.20 . 1 . . . . . . . . 4384 1 2274 . 1 1 212 212 ILE HB H 1 1.743 0.08 . 1 . . . . . . . . 4384 1 2275 . 1 1 212 212 ILE CG1 C 13 29.949 0.20 . 1 . . . . . . . . 4384 1 2276 . 1 1 212 212 ILE HG13 H 1 0.853 0.08 . 2 . . . . . . . . 4384 1 2277 . 1 1 212 212 ILE HG12 H 1 1.544 0.08 . 2 . . . . . . . . 4384 1 2278 . 1 1 212 212 ILE CD1 C 13 12.789 0.20 . 1 . . . . . . . . 4384 1 2279 . 1 1 212 212 ILE HD11 H 1 0.565 0.08 . 1 . . . . . . . . 4384 1 2280 . 1 1 212 212 ILE HD12 H 1 0.565 0.08 . 1 . . . . . . . . 4384 1 2281 . 1 1 212 212 ILE HD13 H 1 0.565 0.08 . 1 . . . . . . . . 4384 1 2282 . 1 1 212 212 ILE CG2 C 13 17.499 0.20 . 1 . . . . . . . . 4384 1 2283 . 1 1 212 212 ILE HG21 H 1 0.862 0.08 . 1 . . . . . . . . 4384 1 2284 . 1 1 212 212 ILE HG22 H 1 0.862 0.08 . 1 . . . . . . . . 4384 1 2285 . 1 1 212 212 ILE HG23 H 1 0.862 0.08 . 1 . . . . . . . . 4384 1 2286 . 1 1 212 212 ILE C C 13 178.055 0.05 . 1 . . . . . . . . 4384 1 2287 . 1 1 213 213 ASP N N 15 120.655 0.05 . 1 . . . . . . . . 4384 1 2288 . 1 1 213 213 ASP H H 1 7.902 0.02 . 1 . . . . . . . . 4384 1 2289 . 1 1 213 213 ASP CA C 13 58.043 0.20 . 1 . . . . . . . . 4384 1 2290 . 1 1 213 213 ASP HA H 1 4.443 0.08 . 1 . . . . . . . . 4384 1 2291 . 1 1 213 213 ASP CB C 13 41.516 0.20 . 1 . . . . . . . . 4384 1 2292 . 1 1 213 213 ASP HB3 H 1 2.754 0.08 . 2 . . . . . . . . 4384 1 2293 . 1 1 213 213 ASP HB2 H 1 2.822 0.08 . 2 . . . . . . . . 4384 1 2294 . 1 1 213 213 ASP C C 13 179.226 0.05 . 1 . . . . . . . . 4384 1 2295 . 1 1 214 214 CYS N N 15 117.491 0.05 . 1 . . . . . . . . 4384 1 2296 . 1 1 214 214 CYS H H 1 8.266 0.02 . 1 . . . . . . . . 4384 1 2297 . 1 1 214 214 CYS CA C 13 64.521 0.20 . 1 . . . . . . . . 4384 1 2298 . 1 1 214 214 CYS HA H 1 4.331 0.08 . 1 . . . . . . . . 4384 1 2299 . 1 1 214 214 CYS CB C 13 27.785 0.20 . 1 . . . . . . . . 4384 1 2300 . 1 1 214 214 CYS HB3 H 1 2.810 0.08 . 2 . . . . . . . . 4384 1 2301 . 1 1 214 214 CYS HB2 H 1 3.255 0.08 . 2 . . . . . . . . 4384 1 2302 . 1 1 214 214 CYS C C 13 178.585 0.05 . 1 . . . . . . . . 4384 1 2303 . 1 1 215 215 PHE N N 15 119.850 0.05 . 1 . . . . . . . . 4384 1 2304 . 1 1 215 215 PHE H H 1 8.899 0.02 . 1 . . . . . . . . 4384 1 2305 . 1 1 215 215 PHE CA C 13 58.005 0.20 . 1 . . . . . . . . 4384 1 2306 . 1 1 215 215 PHE HA H 1 4.809 0.08 . 1 . . . . . . . . 4384 1 2307 . 1 1 215 215 PHE CB C 13 37.489 0.20 . 1 . . . . . . . . 4384 1 2308 . 1 1 215 215 PHE HB3 H 1 3.342 0.08 . 2 . . . . . . . . 4384 1 2309 . 1 1 215 215 PHE HB2 H 1 3.911 0.08 . 2 . . . . . . . . 4384 1 2310 . 1 1 215 215 PHE CD1 C 13 129.374 0.20 . 1 . . . . . . . . 4384 1 2311 . 1 1 215 215 PHE HD1 H 1 7.107 0.08 . 3 . . . . . . . . 4384 1 2312 . 1 1 215 215 PHE CE1 C 13 131.022 0.20 . 1 . . . . . . . . 4384 1 2313 . 1 1 215 215 PHE HE1 H 1 7.041 0.08 . 3 . . . . . . . . 4384 1 2314 . 1 1 215 215 PHE CZ C 13 128.801 0.20 . 1 . . . . . . . . 4384 1 2315 . 1 1 215 215 PHE HZ H 1 6.885 0.08 . 1 . . . . . . . . 4384 1 2316 . 1 1 215 215 PHE C C 13 178.805 0.05 . 1 . . . . . . . . 4384 1 2317 . 1 1 216 216 ARG N N 15 116.866 0.05 . 1 . . . . . . . . 4384 1 2318 . 1 1 216 216 ARG H H 1 8.306 0.02 . 1 . . . . . . . . 4384 1 2319 . 1 1 216 216 ARG CA C 13 60.117 0.20 . 1 . . . . . . . . 4384 1 2320 . 1 1 216 216 ARG HA H 1 3.994 0.08 . 1 . . . . . . . . 4384 1 2321 . 1 1 216 216 ARG CB C 13 31.325 0.20 . 1 . . . . . . . . 4384 1 2322 . 1 1 216 216 ARG HB3 H 1 2.001 0.08 . 2 . . . . . . . . 4384 1 2323 . 1 1 216 216 ARG HB2 H 1 2.233 0.08 . 2 . . . . . . . . 4384 1 2324 . 1 1 216 216 ARG CG C 13 29.448 0.20 . 1 . . . . . . . . 4384 1 2325 . 1 1 216 216 ARG HG3 H 1 1.610 0.08 . 2 . . . . . . . . 4384 1 2326 . 1 1 216 216 ARG HG2 H 1 1.997 0.08 . 2 . . . . . . . . 4384 1 2327 . 1 1 216 216 ARG CD C 13 43.650 0.20 . 1 . . . . . . . . 4384 1 2328 . 1 1 216 216 ARG HD2 H 1 3.275 0.08 . 2 . . . . . . . . 4384 1 2329 . 1 1 216 216 ARG C C 13 177.471 0.05 . 1 . . . . . . . . 4384 1 2330 . 1 1 217 217 GLN N N 15 112.546 0.05 . 1 . . . . . . . . 4384 1 2331 . 1 1 217 217 GLN H H 1 7.983 0.02 . 1 . . . . . . . . 4384 1 2332 . 1 1 217 217 GLN CA C 13 58.057 0.20 . 1 . . . . . . . . 4384 1 2333 . 1 1 217 217 GLN HA H 1 4.573 0.08 . 1 . . . . . . . . 4384 1 2334 . 1 1 217 217 GLN CB C 13 32.443 0.20 . 1 . . . . . . . . 4384 1 2335 . 1 1 217 217 GLN HB3 H 1 2.024 0.08 . 2 . . . . . . . . 4384 1 2336 . 1 1 217 217 GLN HB2 H 1 2.373 0.08 . 2 . . . . . . . . 4384 1 2337 . 1 1 217 217 GLN CG C 13 34.338 0.20 . 1 . . . . . . . . 4384 1 2338 . 1 1 217 217 GLN HG3 H 1 2.431 0.08 . 2 . . . . . . . . 4384 1 2339 . 1 1 217 217 GLN HG2 H 1 2.668 0.08 . 2 . . . . . . . . 4384 1 2340 . 1 1 217 217 GLN CD C 13 179.957 0.20 . 1 . . . . . . . . 4384 1 2341 . 1 1 217 217 GLN NE2 N 15 112.993 0.05 . 1 . . . . . . . . 4384 1 2342 . 1 1 217 217 GLN HE21 H 1 7.689 0.02 . 1 . . . . . . . . 4384 1 2343 . 1 1 217 217 GLN HE22 H 1 6.812 0.02 . 1 . . . . . . . . 4384 1 2344 . 1 1 217 217 GLN C C 13 178.586 0.05 . 1 . . . . . . . . 4384 1 2345 . 1 1 218 218 LYS N N 15 114.941 0.05 . 1 . . . . . . . . 4384 1 2346 . 1 1 218 218 LYS H H 1 8.926 0.02 . 1 . . . . . . . . 4384 1 2347 . 1 1 218 218 LYS CA C 13 55.423 0.20 . 1 . . . . . . . . 4384 1 2348 . 1 1 218 218 LYS HA H 1 4.819 0.08 . 1 . . . . . . . . 4384 1 2349 . 1 1 218 218 LYS CB C 13 33.235 0.20 . 1 . . . . . . . . 4384 1 2350 . 1 1 218 218 LYS HB3 H 1 2.328 0.08 . 2 . . . . . . . . 4384 1 2351 . 1 1 218 218 LYS HB2 H 1 2.622 0.08 . 2 . . . . . . . . 4384 1 2352 . 1 1 218 218 LYS CG C 13 24.933 0.20 . 1 . . . . . . . . 4384 1 2353 . 1 1 218 218 LYS HG3 H 1 1.566 0.08 . 2 . . . . . . . . 4384 1 2354 . 1 1 218 218 LYS HG2 H 1 1.877 0.08 . 2 . . . . . . . . 4384 1 2355 . 1 1 218 218 LYS CD C 13 28.409 0.20 . 1 . . . . . . . . 4384 1 2356 . 1 1 218 218 LYS HD3 H 1 1.778 0.08 . 2 . . . . . . . . 4384 1 2357 . 1 1 218 218 LYS HD2 H 1 1.892 0.08 . 2 . . . . . . . . 4384 1 2358 . 1 1 218 218 LYS CE C 13 42.503 0.20 . 1 . . . . . . . . 4384 1 2359 . 1 1 218 218 LYS HE2 H 1 3.125 0.08 . 2 . . . . . . . . 4384 1 2360 . 1 1 218 218 LYS C C 13 177.140 0.05 . 1 . . . . . . . . 4384 1 2361 . 1 1 219 219 SER N N 15 113.069 0.05 . 1 . . . . . . . . 4384 1 2362 . 1 1 219 219 SER H H 1 7.047 0.02 . 1 . . . . . . . . 4384 1 2363 . 1 1 219 219 SER CA C 13 57.839 0.20 . 1 . . . . . . . . 4384 1 2364 . 1 1 219 219 SER HA H 1 4.386 0.08 . 1 . . . . . . . . 4384 1 2365 . 1 1 219 219 SER CB C 13 65.072 0.20 . 1 . . . . . . . . 4384 1 2366 . 1 1 219 219 SER HB3 H 1 4.011 0.08 . 2 . . . . . . . . 4384 1 2367 . 1 1 219 219 SER HB2 H 1 4.159 0.08 . 2 . . . . . . . . 4384 1 2368 . 1 1 219 219 SER HG H 1 5.66 0.08 . 1 . . . . . . . . 4384 1 2369 . 1 1 219 219 SER C C 13 174.272 0.05 . 1 . . . . . . . . 4384 1 2370 . 1 1 220 220 GLN N N 15 121.292 0.05 . 1 . . . . . . . . 4384 1 2371 . 1 1 220 220 GLN H H 1 8.497 0.02 . 1 . . . . . . . . 4384 1 2372 . 1 1 220 220 GLN CA C 13 55.551 0.20 . 1 . . . . . . . . 4384 1 2373 . 1 1 220 220 GLN HA H 1 4.299 0.08 . 1 . . . . . . . . 4384 1 2374 . 1 1 220 220 GLN CB C 13 28.639 0.20 . 1 . . . . . . . . 4384 1 2375 . 1 1 220 220 GLN HB3 H 1 1.636 0.08 . 2 . . . . . . . . 4384 1 2376 . 1 1 220 220 GLN HB2 H 1 1.785 0.08 . 2 . . . . . . . . 4384 1 2377 . 1 1 220 220 GLN CG C 13 34.194 0.20 . 1 . . . . . . . . 4384 1 2378 . 1 1 220 220 GLN HG3 H 1 1.943 0.08 . 2 . . . . . . . . 4384 1 2379 . 1 1 220 220 GLN HG2 H 1 2.383 0.08 . 2 . . . . . . . . 4384 1 2380 . 1 1 220 220 GLN CD C 13 179.555 0.20 . 1 . . . . . . . . 4384 1 2381 . 1 1 220 220 GLN NE2 N 15 114.033 0.05 . 1 . . . . . . . . 4384 1 2382 . 1 1 220 220 GLN HE21 H 1 7.418 0.02 . 1 . . . . . . . . 4384 1 2383 . 1 1 220 220 GLN HE22 H 1 7.036 0.02 . 1 . . . . . . . . 4384 1 2384 . 1 1 220 220 GLN C C 13 182.221 0.05 . 1 . . . . . . . . 4384 1 2385 . 1 1 221 221 PRO CA C 13 66.779 0.20 . 1 . . . . . . . . 4384 1 2386 . 1 1 221 221 PRO HA H 1 4.167 0.08 . 1 . . . . . . . . 4384 1 2387 . 1 1 221 221 PRO CB C 13 32.490 0.20 . 1 . . . . . . . . 4384 1 2388 . 1 1 221 221 PRO HB3 H 1 1.986 0.08 . 2 . . . . . . . . 4384 1 2389 . 1 1 221 221 PRO HB2 H 1 2.401 0.08 . 2 . . . . . . . . 4384 1 2390 . 1 1 221 221 PRO CG C 13 28.131 0.20 . 1 . . . . . . . . 4384 1 2391 . 1 1 221 221 PRO HG3 H 1 2.038 0.08 . 2 . . . . . . . . 4384 1 2392 . 1 1 221 221 PRO HG2 H 1 2.204 0.08 . 2 . . . . . . . . 4384 1 2393 . 1 1 221 221 PRO CD C 13 50.613 0.20 . 1 . . . . . . . . 4384 1 2394 . 1 1 221 221 PRO HD2 H 1 3.796 0.08 . 2 . . . . . . . . 4384 1 2395 . 1 1 221 221 PRO C C 13 178.459 0.05 . 1 . . . . . . . . 4384 1 2396 . 1 1 222 222 ASP N N 15 115.784 0.05 . 1 . . . . . . . . 4384 1 2397 . 1 1 222 222 ASP H H 1 9.009 0.02 . 1 . . . . . . . . 4384 1 2398 . 1 1 222 222 ASP CA C 13 56.781 0.20 . 1 . . . . . . . . 4384 1 2399 . 1 1 222 222 ASP HA H 1 4.319 0.08 . 1 . . . . . . . . 4384 1 2400 . 1 1 222 222 ASP CB C 13 39.060 0.20 . 1 . . . . . . . . 4384 1 2401 . 1 1 222 222 ASP HB3 H 1 2.558 0.08 . 2 . . . . . . . . 4384 1 2402 . 1 1 222 222 ASP HB2 H 1 2.686 0.08 . 2 . . . . . . . . 4384 1 2403 . 1 1 222 222 ASP C C 13 179.005 0.05 . 1 . . . . . . . . 4384 1 2404 . 1 1 223 223 ILE N N 15 122.371 0.05 . 1 . . . . . . . . 4384 1 2405 . 1 1 223 223 ILE H H 1 7.409 0.02 . 1 . . . . . . . . 4384 1 2406 . 1 1 223 223 ILE CA C 13 62.040 0.20 . 1 . . . . . . . . 4384 1 2407 . 1 1 223 223 ILE HA H 1 3.733 0.08 . 1 . . . . . . . . 4384 1 2408 . 1 1 223 223 ILE CB C 13 35.918 0.20 . 1 . . . . . . . . 4384 1 2409 . 1 1 223 223 ILE HB H 1 2.297 0.08 . 1 . . . . . . . . 4384 1 2410 . 1 1 223 223 ILE CG1 C 13 27.468 0.20 . 1 . . . . . . . . 4384 1 2411 . 1 1 223 223 ILE HG13 H 1 1.447 0.08 . 2 . . . . . . . . 4384 1 2412 . 1 1 223 223 ILE HG12 H 1 1.661 0.08 . 2 . . . . . . . . 4384 1 2413 . 1 1 223 223 ILE CD1 C 13 10.187 0.20 . 1 . . . . . . . . 4384 1 2414 . 1 1 223 223 ILE HD11 H 1 0.678 0.08 . 1 . . . . . . . . 4384 1 2415 . 1 1 223 223 ILE HD12 H 1 0.678 0.08 . 1 . . . . . . . . 4384 1 2416 . 1 1 223 223 ILE HD13 H 1 0.678 0.08 . 1 . . . . . . . . 4384 1 2417 . 1 1 223 223 ILE CG2 C 13 18.322 0.20 . 1 . . . . . . . . 4384 1 2418 . 1 1 223 223 ILE HG21 H 1 0.624 0.08 . 1 . . . . . . . . 4384 1 2419 . 1 1 223 223 ILE HG22 H 1 0.624 0.08 . 1 . . . . . . . . 4384 1 2420 . 1 1 223 223 ILE HG23 H 1 0.624 0.08 . 1 . . . . . . . . 4384 1 2421 . 1 1 223 223 ILE C C 13 178.549 0.05 . 1 . . . . . . . . 4384 1 2422 . 1 1 224 224 GLN N N 15 120.688 0.05 . 1 . . . . . . . . 4384 1 2423 . 1 1 224 224 GLN H H 1 8.499 0.02 . 1 . . . . . . . . 4384 1 2424 . 1 1 224 224 GLN CA C 13 60.482 0.20 . 1 . . . . . . . . 4384 1 2425 . 1 1 224 224 GLN HA H 1 3.720 0.08 . 1 . . . . . . . . 4384 1 2426 . 1 1 224 224 GLN CB C 13 28.320 0.20 . 1 . . . . . . . . 4384 1 2427 . 1 1 224 224 GLN HB2 H 1 2.101 0.08 . 2 . . . . . . . . 4384 1 2428 . 1 1 224 224 GLN CG C 13 34.370 0.20 . 1 . . . . . . . . 4384 1 2429 . 1 1 224 224 GLN HG2 H 1 2.281 0.08 . 2 . . . . . . . . 4384 1 2430 . 1 1 224 224 GLN C C 13 179.502 0.05 . 1 . . . . . . . . 4384 1 2431 . 1 1 225 225 GLN N N 15 115.462 0.05 . 1 . . . . . . . . 4384 1 2432 . 1 1 225 225 GLN H H 1 7.644 0.02 . 1 . . . . . . . . 4384 1 2433 . 1 1 225 225 GLN CA C 13 58.872 0.20 . 1 . . . . . . . . 4384 1 2434 . 1 1 225 225 GLN HA H 1 3.976 0.08 . 1 . . . . . . . . 4384 1 2435 . 1 1 225 225 GLN CB C 13 28.319 0.20 . 1 . . . . . . . . 4384 1 2436 . 1 1 225 225 GLN HB2 H 1 2.135 0.08 . 2 . . . . . . . . 4384 1 2437 . 1 1 225 225 GLN CG C 13 33.668 0.20 . 1 . . . . . . . . 4384 1 2438 . 1 1 225 225 GLN HG3 H 1 2.450 0.08 . 2 . . . . . . . . 4384 1 2439 . 1 1 225 225 GLN HG2 H 1 2.494 0.08 . 2 . . . . . . . . 4384 1 2440 . 1 1 225 225 GLN CD C 13 180.094 0.20 . 1 . . . . . . . . 4384 1 2441 . 1 1 225 225 GLN NE2 N 15 111.880 0.05 . 1 . . . . . . . . 4384 1 2442 . 1 1 225 225 GLN HE21 H 1 7.426 0.02 . 1 . . . . . . . . 4384 1 2443 . 1 1 225 225 GLN HE22 H 1 6.842 0.02 . 1 . . . . . . . . 4384 1 2444 . 1 1 225 225 GLN C C 13 178.561 0.05 . 1 . . . . . . . . 4384 1 2445 . 1 1 226 226 LEU N N 15 119.958 0.05 . 1 . . . . . . . . 4384 1 2446 . 1 1 226 226 LEU H H 1 7.369 0.02 . 1 . . . . . . . . 4384 1 2447 . 1 1 226 226 LEU CA C 13 57.828 0.20 . 1 . . . . . . . . 4384 1 2448 . 1 1 226 226 LEU HA H 1 4.182 0.08 . 1 . . . . . . . . 4384 1 2449 . 1 1 226 226 LEU CB C 13 42.838 0.20 . 1 . . . . . . . . 4384 1 2450 . 1 1 226 226 LEU HB3 H 1 1.525 0.08 . 2 . . . . . . . . 4384 1 2451 . 1 1 226 226 LEU HB2 H 1 2.051 0.08 . 2 . . . . . . . . 4384 1 2452 . 1 1 226 226 LEU CG C 13 26.830 0.20 . 1 . . . . . . . . 4384 1 2453 . 1 1 226 226 LEU HG H 1 1.863 0.08 . 1 . . . . . . . . 4384 1 2454 . 1 1 226 226 LEU CD1 C 13 25.795 0.20 . 1 . . . . . . . . 4384 1 2455 . 1 1 226 226 LEU HD11 H 1 0.851 0.08 . 1 . . . . . . . . 4384 1 2456 . 1 1 226 226 LEU HD12 H 1 0.851 0.08 . 1 . . . . . . . . 4384 1 2457 . 1 1 226 226 LEU HD13 H 1 0.851 0.08 . 1 . . . . . . . . 4384 1 2458 . 1 1 226 226 LEU CD2 C 13 24.487 0.20 . 1 . . . . . . . . 4384 1 2459 . 1 1 226 226 LEU HD21 H 1 0.824 0.08 . 2 . . . . . . . . 4384 1 2460 . 1 1 226 226 LEU HD22 H 1 0.824 0.08 . 2 . . . . . . . . 4384 1 2461 . 1 1 226 226 LEU HD23 H 1 0.824 0.08 . 2 . . . . . . . . 4384 1 2462 . 1 1 226 226 LEU C C 13 180.144 0.05 . 1 . . . . . . . . 4384 1 2463 . 1 1 227 227 ILE N N 15 118.977 0.05 . 1 . . . . . . . . 4384 1 2464 . 1 1 227 227 ILE H H 1 8.566 0.02 . 1 . . . . . . . . 4384 1 2465 . 1 1 227 227 ILE CA C 13 65.564 0.20 . 1 . . . . . . . . 4384 1 2466 . 1 1 227 227 ILE HA H 1 3.553 0.08 . 1 . . . . . . . . 4384 1 2467 . 1 1 227 227 ILE CB C 13 37.792 0.20 . 1 . . . . . . . . 4384 1 2468 . 1 1 227 227 ILE HB H 1 1.847 0.08 . 1 . . . . . . . . 4384 1 2469 . 1 1 227 227 ILE CG1 C 13 29.907 0.20 . 1 . . . . . . . . 4384 1 2470 . 1 1 227 227 ILE HG13 H 1 0.766 0.08 . 2 . . . . . . . . 4384 1 2471 . 1 1 227 227 ILE HG12 H 1 1.657 0.08 . 2 . . . . . . . . 4384 1 2472 . 1 1 227 227 ILE CD1 C 13 14.494 0.20 . 1 . . . . . . . . 4384 1 2473 . 1 1 227 227 ILE HD11 H 1 0.629 0.08 . 1 . . . . . . . . 4384 1 2474 . 1 1 227 227 ILE HD12 H 1 0.629 0.08 . 1 . . . . . . . . 4384 1 2475 . 1 1 227 227 ILE HD13 H 1 0.629 0.08 . 1 . . . . . . . . 4384 1 2476 . 1 1 227 227 ILE CG2 C 13 17.782 0.20 . 1 . . . . . . . . 4384 1 2477 . 1 1 227 227 ILE HG21 H 1 0.883 0.08 . 1 . . . . . . . . 4384 1 2478 . 1 1 227 227 ILE HG22 H 1 0.883 0.08 . 1 . . . . . . . . 4384 1 2479 . 1 1 227 227 ILE HG23 H 1 0.883 0.08 . 1 . . . . . . . . 4384 1 2480 . 1 1 227 227 ILE C C 13 178.929 0.05 . 1 . . . . . . . . 4384 1 2481 . 1 1 228 228 ARG N N 15 119.922 0.05 . 1 . . . . . . . . 4384 1 2482 . 1 1 228 228 ARG H H 1 8.243 0.02 . 1 . . . . . . . . 4384 1 2483 . 1 1 228 228 ARG CA C 13 59.396 0.20 . 1 . . . . . . . . 4384 1 2484 . 1 1 228 228 ARG HA H 1 4.050 0.08 . 1 . . . . . . . . 4384 1 2485 . 1 1 228 228 ARG CB C 13 30.369 0.20 . 1 . . . . . . . . 4384 1 2486 . 1 1 228 228 ARG HB2 H 1 1.914 0.08 . 2 . . . . . . . . 4384 1 2487 . 1 1 228 228 ARG CG C 13 28.456 0.20 . 1 . . . . . . . . 4384 1 2488 . 1 1 228 228 ARG HG3 H 1 1.619 0.08 . 2 . . . . . . . . 4384 1 2489 . 1 1 228 228 ARG HG2 H 1 1.897 0.08 . 2 . . . . . . . . 4384 1 2490 . 1 1 228 228 ARG CD C 13 43.369 0.20 . 1 . . . . . . . . 4384 1 2491 . 1 1 228 228 ARG HD2 H 1 3.152 0.08 . 2 . . . . . . . . 4384 1 2492 . 1 1 228 228 ARG C C 13 176.930 0.05 . 1 . . . . . . . . 4384 1 2493 . 1 1 229 229 ALA N N 15 119.046 0.05 . 1 . . . . . . . . 4384 1 2494 . 1 1 229 229 ALA H H 1 7.174 0.02 . 1 . . . . . . . . 4384 1 2495 . 1 1 229 229 ALA CA C 13 51.474 0.20 . 1 . . . . . . . . 4384 1 2496 . 1 1 229 229 ALA HA H 1 4.430 0.08 . 1 . . . . . . . . 4384 1 2497 . 1 1 229 229 ALA CB C 13 19.299 0.20 . 1 . . . . . . . . 4384 1 2498 . 1 1 229 229 ALA HB1 H 1 1.517 0.08 . 1 . . . . . . . . 4384 1 2499 . 1 1 229 229 ALA HB2 H 1 1.517 0.08 . 1 . . . . . . . . 4384 1 2500 . 1 1 229 229 ALA HB3 H 1 1.517 0.08 . 1 . . . . . . . . 4384 1 2501 . 1 1 229 229 ALA C C 13 176.618 0.05 . 1 . . . . . . . . 4384 1 2502 . 1 1 230 230 ALA N N 15 123.861 0.05 . 1 . . . . . . . . 4384 1 2503 . 1 1 230 230 ALA H H 1 7.284 0.02 . 1 . . . . . . . . 4384 1 2504 . 1 1 230 230 ALA CA C 13 50.859 0.20 . 1 . . . . . . . . 4384 1 2505 . 1 1 230 230 ALA HA H 1 3.895 0.08 . 1 . . . . . . . . 4384 1 2506 . 1 1 230 230 ALA CB C 13 17.039 0.20 . 1 . . . . . . . . 4384 1 2507 . 1 1 230 230 ALA HB1 H 1 0.872 0.08 . 1 . . . . . . . . 4384 1 2508 . 1 1 230 230 ALA HB2 H 1 0.872 0.08 . 1 . . . . . . . . 4384 1 2509 . 1 1 230 230 ALA HB3 H 1 0.872 0.08 . 1 . . . . . . . . 4384 1 2510 . 1 1 230 230 ALA C C 13 175.651 0.05 . 1 . . . . . . . . 4384 1 2511 . 1 1 231 231 PRO CA C 13 63.142 0.20 . 1 . . . . . . . . 4384 1 2512 . 1 1 231 231 PRO HA H 1 4.455 0.08 . 1 . . . . . . . . 4384 1 2513 . 1 1 231 231 PRO CB C 13 32.556 0.20 . 1 . . . . . . . . 4384 1 2514 . 1 1 231 231 PRO HB3 H 1 1.876 0.08 . 2 . . . . . . . . 4384 1 2515 . 1 1 231 231 PRO HB2 H 1 2.385 0.08 . 2 . . . . . . . . 4384 1 2516 . 1 1 231 231 PRO CG C 13 27.273 0.20 . 1 . . . . . . . . 4384 1 2517 . 1 1 231 231 PRO HG2 H 1 2.033 0.08 . 2 . . . . . . . . 4384 1 2518 . 1 1 231 231 PRO CD C 13 50.481 0.20 . 1 . . . . . . . . 4384 1 2519 . 1 1 231 231 PRO HD3 H 1 3.050 0.08 . 2 . . . . . . . . 4384 1 2520 . 1 1 231 231 PRO HD2 H 1 3.705 0.08 . 2 . . . . . . . . 4384 1 2521 . 1 1 231 231 PRO C C 13 178.428 0.05 . 1 . . . . . . . . 4384 1 2522 . 1 1 232 232 SER N N 15 117.956 0.05 . 1 . . . . . . . . 4384 1 2523 . 1 1 232 232 SER H H 1 8.717 0.02 . 1 . . . . . . . . 4384 1 2524 . 1 1 232 232 SER CA C 13 59.843 0.20 . 1 . . . . . . . . 4384 1 2525 . 1 1 232 232 SER HA H 1 4.223 0.08 . 1 . . . . . . . . 4384 1 2526 . 1 1 232 232 SER CB C 13 63.453 0.20 . 1 . . . . . . . . 4384 1 2527 . 1 1 232 232 SER HB2 H 1 3.944 0.08 . 2 . . . . . . . . 4384 1 2528 . 1 1 232 232 SER C C 13 174.549 0.05 . 1 . . . . . . . . 4384 1 2529 . 1 1 233 233 THR N N 15 108.371 0.05 . 1 . . . . . . . . 4384 1 2530 . 1 1 233 233 THR H H 1 7.104 0.02 . 1 . . . . . . . . 4384 1 2531 . 1 1 233 233 THR CA C 13 61.940 0.20 . 1 . . . . . . . . 4384 1 2532 . 1 1 233 233 THR HA H 1 4.046 0.08 . 1 . . . . . . . . 4384 1 2533 . 1 1 233 233 THR CB C 13 68.353 0.20 . 1 . . . . . . . . 4384 1 2534 . 1 1 233 233 THR HB H 1 4.351 0.08 . 1 . . . . . . . . 4384 1 2535 . 1 1 233 233 THR CG2 C 13 22.929 0.20 . 1 . . . . . . . . 4384 1 2536 . 1 1 233 233 THR HG21 H 1 1.154 0.08 . 1 . . . . . . . . 4384 1 2537 . 1 1 233 233 THR HG22 H 1 1.154 0.08 . 1 . . . . . . . . 4384 1 2538 . 1 1 233 233 THR HG23 H 1 1.154 0.08 . 1 . . . . . . . . 4384 1 2539 . 1 1 233 233 THR C C 13 175.105 0.05 . 1 . . . . . . . . 4384 1 2540 . 1 1 234 234 LEU N N 15 122.611 0.05 . 1 . . . . . . . . 4384 1 2541 . 1 1 234 234 LEU H H 1 7.266 0.02 . 1 . . . . . . . . 4384 1 2542 . 1 1 234 234 LEU CA C 13 54.322 0.20 . 1 . . . . . . . . 4384 1 2543 . 1 1 234 234 LEU HA H 1 4.538 0.08 . 1 . . . . . . . . 4384 1 2544 . 1 1 234 234 LEU CB C 13 40.389 0.20 . 1 . . . . . . . . 4384 1 2545 . 1 1 234 234 LEU HB3 H 1 1.072 0.08 . 2 . . . . . . . . 4384 1 2546 . 1 1 234 234 LEU HB2 H 1 1.843 0.08 . 2 . . . . . . . . 4384 1 2547 . 1 1 234 234 LEU CG C 13 26.672 0.20 . 1 . . . . . . . . 4384 1 2548 . 1 1 234 234 LEU HG H 1 1.583 0.08 . 1 . . . . . . . . 4384 1 2549 . 1 1 234 234 LEU CD1 C 13 26.682 0.20 . 1 . . . . . . . . 4384 1 2550 . 1 1 234 234 LEU HD11 H 1 0.680 0.08 . 1 . . . . . . . . 4384 1 2551 . 1 1 234 234 LEU HD12 H 1 0.680 0.08 . 1 . . . . . . . . 4384 1 2552 . 1 1 234 234 LEU HD13 H 1 0.680 0.08 . 1 . . . . . . . . 4384 1 2553 . 1 1 234 234 LEU CD2 C 13 22.680 0.20 . 1 . . . . . . . . 4384 1 2554 . 1 1 234 234 LEU HD21 H 1 0.742 0.08 . 2 . . . . . . . . 4384 1 2555 . 1 1 234 234 LEU HD22 H 1 0.742 0.08 . 2 . . . . . . . . 4384 1 2556 . 1 1 234 234 LEU HD23 H 1 0.742 0.08 . 2 . . . . . . . . 4384 1 2557 . 1 1 234 234 LEU C C 13 176.352 0.05 . 1 . . . . . . . . 4384 1 2558 . 1 1 235 235 THR N N 15 111.953 0.05 . 1 . . . . . . . . 4384 1 2559 . 1 1 235 235 THR H H 1 8.446 0.02 . 1 . . . . . . . . 4384 1 2560 . 1 1 235 235 THR CA C 13 61.903 0.20 . 1 . . . . . . . . 4384 1 2561 . 1 1 235 235 THR HA H 1 4.423 0.08 . 1 . . . . . . . . 4384 1 2562 . 1 1 235 235 THR CB C 13 70.417 0.20 . 1 . . . . . . . . 4384 1 2563 . 1 1 235 235 THR HB H 1 4.356 0.08 . 1 . . . . . . . . 4384 1 2564 . 1 1 235 235 THR CG2 C 13 21.633 0.20 . 1 . . . . . . . . 4384 1 2565 . 1 1 235 235 THR HG21 H 1 1.114 0.08 . 1 . . . . . . . . 4384 1 2566 . 1 1 235 235 THR HG22 H 1 1.114 0.08 . 1 . . . . . . . . 4384 1 2567 . 1 1 235 235 THR HG23 H 1 1.114 0.08 . 1 . . . . . . . . 4384 1 2568 . 1 1 235 235 THR C C 13 174.837 0.05 . 1 . . . . . . . . 4384 1 2569 . 1 1 236 236 THR N N 15 111.553 0.05 . 1 . . . . . . . . 4384 1 2570 . 1 1 236 236 THR H H 1 7.763 0.02 . 1 . . . . . . . . 4384 1 2571 . 1 1 236 236 THR CA C 13 58.220 0.20 . 1 . . . . . . . . 4384 1 2572 . 1 1 236 236 THR HA H 1 5.045 0.08 . 1 . . . . . . . . 4384 1 2573 . 1 1 236 236 THR CB C 13 69.549 0.20 . 1 . . . . . . . . 4384 1 2574 . 1 1 236 236 THR HB H 1 4.504 0.08 . 1 . . . . . . . . 4384 1 2575 . 1 1 236 236 THR CG2 C 13 22.059 0.20 . 1 . . . . . . . . 4384 1 2576 . 1 1 236 236 THR HG21 H 1 1.218 0.08 . 1 . . . . . . . . 4384 1 2577 . 1 1 236 236 THR HG22 H 1 1.218 0.08 . 1 . . . . . . . . 4384 1 2578 . 1 1 236 236 THR HG23 H 1 1.218 0.08 . 1 . . . . . . . . 4384 1 2579 . 1 1 236 236 THR C C 13 173.958 0.05 . 1 . . . . . . . . 4384 1 2580 . 1 1 237 237 PRO CA C 13 66.103 0.20 . 1 . . . . . . . . 4384 1 2581 . 1 1 237 237 PRO HA H 1 4.127 0.08 . 1 . . . . . . . . 4384 1 2582 . 1 1 237 237 PRO CB C 13 32.202 0.20 . 1 . . . . . . . . 4384 1 2583 . 1 1 237 237 PRO HB2 H 1 2.186 0.08 . 2 . . . . . . . . 4384 1 2584 . 1 1 237 237 PRO CG C 13 28.667 0.20 . 1 . . . . . . . . 4384 1 2585 . 1 1 237 237 PRO HG3 H 1 1.733 0.08 . 2 . . . . . . . . 4384 1 2586 . 1 1 237 237 PRO HG2 H 1 2.287 0.08 . 2 . . . . . . . . 4384 1 2587 . 1 1 237 237 PRO CD C 13 50.604 0.20 . 1 . . . . . . . . 4384 1 2588 . 1 1 237 237 PRO HD3 H 1 3.793 0.08 . 2 . . . . . . . . 4384 1 2589 . 1 1 237 237 PRO HD2 H 1 4.030 0.08 . 2 . . . . . . . . 4384 1 2590 . 1 1 237 237 PRO C C 13 178.422 0.05 . 1 . . . . . . . . 4384 1 2591 . 1 1 238 238 GLY N N 15 103.333 0.05 . 1 . . . . . . . . 4384 1 2592 . 1 1 238 238 GLY H H 1 8.911 0.02 . 1 . . . . . . . . 4384 1 2593 . 1 1 238 238 GLY CA C 13 47.121 0.20 . 1 . . . . . . . . 4384 1 2594 . 1 1 238 238 GLY HA3 H 1 3.794 0.08 . 2 . . . . . . . . 4384 1 2595 . 1 1 238 238 GLY HA2 H 1 3.981 0.08 . 2 . . . . . . . . 4384 1 2596 . 1 1 238 238 GLY C C 13 177.213 0.05 . 1 . . . . . . . . 4384 1 2597 . 1 1 239 239 GLU N N 15 120.649 0.05 . 1 . . . . . . . . 4384 1 2598 . 1 1 239 239 GLU H H 1 7.736 0.02 . 1 . . . . . . . . 4384 1 2599 . 1 1 239 239 GLU CA C 13 59.017 0.20 . 1 . . . . . . . . 4384 1 2600 . 1 1 239 239 GLU HA H 1 4.103 0.08 . 1 . . . . . . . . 4384 1 2601 . 1 1 239 239 GLU CB C 13 31.190 0.20 . 1 . . . . . . . . 4384 1 2602 . 1 1 239 239 GLU HB3 H 1 2.064 0.08 . 2 . . . . . . . . 4384 1 2603 . 1 1 239 239 GLU HB2 H 1 2.296 0.08 . 2 . . . . . . . . 4384 1 2604 . 1 1 239 239 GLU CG C 13 37.695 0.20 . 1 . . . . . . . . 4384 1 2605 . 1 1 239 239 GLU HG2 H 1 2.334 0.08 . 2 . . . . . . . . 4384 1 2606 . 1 1 239 239 GLU C C 13 179.835 0.05 . 1 . . . . . . . . 4384 1 2607 . 1 1 240 240 ILE N N 15 120.987 0.05 . 1 . . . . . . . . 4384 1 2608 . 1 1 240 240 ILE H H 1 7.735 0.02 . 1 . . . . . . . . 4384 1 2609 . 1 1 240 240 ILE CA C 13 63.856 0.20 . 1 . . . . . . . . 4384 1 2610 . 1 1 240 240 ILE HA H 1 3.876 0.08 . 1 . . . . . . . . 4384 1 2611 . 1 1 240 240 ILE CB C 13 36.767 0.20 . 1 . . . . . . . . 4384 1 2612 . 1 1 240 240 ILE HB H 1 2.306 0.08 . 1 . . . . . . . . 4384 1 2613 . 1 1 240 240 ILE CG1 C 13 29.020 0.20 . 1 . . . . . . . . 4384 1 2614 . 1 1 240 240 ILE HG13 H 1 1.383 0.08 . 2 . . . . . . . . 4384 1 2615 . 1 1 240 240 ILE HG12 H 1 1.601 0.08 . 2 . . . . . . . . 4384 1 2616 . 1 1 240 240 ILE CD1 C 13 11.732 0.20 . 1 . . . . . . . . 4384 1 2617 . 1 1 240 240 ILE HD11 H 1 0.776 0.08 . 1 . . . . . . . . 4384 1 2618 . 1 1 240 240 ILE HD12 H 1 0.776 0.08 . 1 . . . . . . . . 4384 1 2619 . 1 1 240 240 ILE HD13 H 1 0.776 0.08 . 1 . . . . . . . . 4384 1 2620 . 1 1 240 240 ILE CG2 C 13 18.616 0.20 . 1 . . . . . . . . 4384 1 2621 . 1 1 240 240 ILE HG21 H 1 0.974 0.08 . 1 . . . . . . . . 4384 1 2622 . 1 1 240 240 ILE HG22 H 1 0.974 0.08 . 1 . . . . . . . . 4384 1 2623 . 1 1 240 240 ILE HG23 H 1 0.974 0.08 . 1 . . . . . . . . 4384 1 2624 . 1 1 240 240 ILE C C 13 177.297 0.05 . 1 . . . . . . . . 4384 1 2625 . 1 1 241 241 ILE N N 15 120.074 0.05 . 1 . . . . . . . . 4384 1 2626 . 1 1 241 241 ILE H H 1 8.631 0.02 . 1 . . . . . . . . 4384 1 2627 . 1 1 241 241 ILE CA C 13 66.711 0.20 . 1 . . . . . . . . 4384 1 2628 . 1 1 241 241 ILE HA H 1 3.640 0.08 . 1 . . . . . . . . 4384 1 2629 . 1 1 241 241 ILE CB C 13 38.979 0.20 . 1 . . . . . . . . 4384 1 2630 . 1 1 241 241 ILE HB H 1 1.912 0.08 . 1 . . . . . . . . 4384 1 2631 . 1 1 241 241 ILE CG1 C 13 27.476 0.20 . 1 . . . . . . . . 4384 1 2632 . 1 1 241 241 ILE HG13 H 1 1.703 0.08 . 2 . . . . . . . . 4384 1 2633 . 1 1 241 241 ILE HG12 H 1 1.984 0.08 . 2 . . . . . . . . 4384 1 2634 . 1 1 241 241 ILE CD1 C 13 14.183 0.20 . 1 . . . . . . . . 4384 1 2635 . 1 1 241 241 ILE HD11 H 1 0.847 0.08 . 1 . . . . . . . . 4384 1 2636 . 1 1 241 241 ILE HD12 H 1 0.847 0.08 . 1 . . . . . . . . 4384 1 2637 . 1 1 241 241 ILE HD13 H 1 0.847 0.08 . 1 . . . . . . . . 4384 1 2638 . 1 1 241 241 ILE CG2 C 13 17.539 0.20 . 1 . . . . . . . . 4384 1 2639 . 1 1 241 241 ILE HG21 H 1 0.961 0.08 . 1 . . . . . . . . 4384 1 2640 . 1 1 241 241 ILE HG22 H 1 0.961 0.08 . 1 . . . . . . . . 4384 1 2641 . 1 1 241 241 ILE HG23 H 1 0.961 0.08 . 1 . . . . . . . . 4384 1 2642 . 1 1 241 241 ILE C C 13 177.132 0.05 . 1 . . . . . . . . 4384 1 2643 . 1 1 242 242 LYS N N 15 117.413 0.05 . 1 . . . . . . . . 4384 1 2644 . 1 1 242 242 LYS H H 1 7.608 0.02 . 1 . . . . . . . . 4384 1 2645 . 1 1 242 242 LYS CA C 13 59.692 0.20 . 1 . . . . . . . . 4384 1 2646 . 1 1 242 242 LYS HA H 1 3.890 0.08 . 1 . . . . . . . . 4384 1 2647 . 1 1 242 242 LYS CB C 13 32.260 0.20 . 1 . . . . . . . . 4384 1 2648 . 1 1 242 242 LYS HB2 H 1 1.912 0.08 . 2 . . . . . . . . 4384 1 2649 . 1 1 242 242 LYS CG C 13 25.501 0.20 . 1 . . . . . . . . 4384 1 2650 . 1 1 242 242 LYS HG3 H 1 0.870 0.08 . 2 . . . . . . . . 4384 1 2651 . 1 1 242 242 LYS HG2 H 1 1.457 0.08 . 2 . . . . . . . . 4384 1 2652 . 1 1 242 242 LYS CD C 13 29.010 0.20 . 1 . . . . . . . . 4384 1 2653 . 1 1 242 242 LYS HD2 H 1 1.695 0.08 . 2 . . . . . . . . 4384 1 2654 . 1 1 242 242 LYS CE C 13 42.286 0.20 . 1 . . . . . . . . 4384 1 2655 . 1 1 242 242 LYS HE2 H 1 3.031 0.08 . 2 . . . . . . . . 4384 1 2656 . 1 1 242 242 LYS C C 13 177.469 0.05 . 1 . . . . . . . . 4384 1 2657 . 1 1 243 243 TYR N N 15 119.221 0.05 . 1 . . . . . . . . 4384 1 2658 . 1 1 243 243 TYR H H 1 7.760 0.02 . 1 . . . . . . . . 4384 1 2659 . 1 1 243 243 TYR CA C 13 61.277 0.20 . 1 . . . . . . . . 4384 1 2660 . 1 1 243 243 TYR HA H 1 4.192 0.08 . 1 . . . . . . . . 4384 1 2661 . 1 1 243 243 TYR CB C 13 38.402 0.20 . 1 . . . . . . . . 4384 1 2662 . 1 1 243 243 TYR HB3 H 1 3.153 0.08 . 2 . . . . . . . . 4384 1 2663 . 1 1 243 243 TYR HB2 H 1 3.219 0.08 . 2 . . . . . . . . 4384 1 2664 . 1 1 243 243 TYR CD1 C 13 133.244 0.20 . 1 . . . . . . . . 4384 1 2665 . 1 1 243 243 TYR HD1 H 1 7.013 0.08 . 3 . . . . . . . . 4384 1 2666 . 1 1 243 243 TYR CE1 C 13 117.656 0.20 . 1 . . . . . . . . 4384 1 2667 . 1 1 243 243 TYR HE1 H 1 6.725 0.08 . 3 . . . . . . . . 4384 1 2668 . 1 1 243 243 TYR C C 13 177.541 0.05 . 1 . . . . . . . . 4384 1 2669 . 1 1 244 244 VAL N N 15 119.198 0.05 . 1 . . . . . . . . 4384 1 2670 . 1 1 244 244 VAL H H 1 8.269 0.02 . 1 . . . . . . . . 4384 1 2671 . 1 1 244 244 VAL CA C 13 66.951 0.20 . 1 . . . . . . . . 4384 1 2672 . 1 1 244 244 VAL HA H 1 3.095 0.08 . 1 . . . . . . . . 4384 1 2673 . 1 1 244 244 VAL CB C 13 31.568 0.20 . 1 . . . . . . . . 4384 1 2674 . 1 1 244 244 VAL HB H 1 1.898 0.08 . 1 . . . . . . . . 4384 1 2675 . 1 1 244 244 VAL CG2 C 13 23.156 0.20 . 1 . . . . . . . . 4384 1 2676 . 1 1 244 244 VAL HG21 H 1 0.572 0.08 . 2 . . . . . . . . 4384 1 2677 . 1 1 244 244 VAL HG22 H 1 0.572 0.08 . 2 . . . . . . . . 4384 1 2678 . 1 1 244 244 VAL HG23 H 1 0.572 0.08 . 2 . . . . . . . . 4384 1 2679 . 1 1 244 244 VAL CG1 C 13 21.399 0.20 . 1 . . . . . . . . 4384 1 2680 . 1 1 244 244 VAL HG11 H 1 0.300 0.08 . 1 . . . . . . . . 4384 1 2681 . 1 1 244 244 VAL HG12 H 1 0.300 0.08 . 1 . . . . . . . . 4384 1 2682 . 1 1 244 244 VAL HG13 H 1 0.300 0.08 . 1 . . . . . . . . 4384 1 2683 . 1 1 244 244 VAL C C 13 178.282 0.05 . 1 . . . . . . . . 4384 1 2684 . 1 1 245 245 LEU N N 15 119.048 0.05 . 1 . . . . . . . . 4384 1 2685 . 1 1 245 245 LEU H H 1 8.422 0.02 . 1 . . . . . . . . 4384 1 2686 . 1 1 245 245 LEU CA C 13 58.164 0.20 . 1 . . . . . . . . 4384 1 2687 . 1 1 245 245 LEU HA H 1 3.998 0.08 . 1 . . . . . . . . 4384 1 2688 . 1 1 245 245 LEU CB C 13 41.278 0.20 . 1 . . . . . . . . 4384 1 2689 . 1 1 245 245 LEU HB3 H 1 1.530 0.08 . 2 . . . . . . . . 4384 1 2690 . 1 1 245 245 LEU HB2 H 1 1.916 0.08 . 2 . . . . . . . . 4384 1 2691 . 1 1 245 245 LEU CG C 13 27.397 0.20 . 1 . . . . . . . . 4384 1 2692 . 1 1 245 245 LEU HG H 1 1.987 0.08 . 1 . . . . . . . . 4384 1 2693 . 1 1 245 245 LEU CD1 C 13 25.498 0.20 . 1 . . . . . . . . 4384 1 2694 . 1 1 245 245 LEU HD11 H 1 0.908 0.08 . 1 . . . . . . . . 4384 1 2695 . 1 1 245 245 LEU HD12 H 1 0.908 0.08 . 1 . . . . . . . . 4384 1 2696 . 1 1 245 245 LEU HD13 H 1 0.908 0.08 . 1 . . . . . . . . 4384 1 2697 . 1 1 245 245 LEU CD2 C 13 23.007 0.20 . 1 . . . . . . . . 4384 1 2698 . 1 1 245 245 LEU HD21 H 1 0.930 0.08 . 2 . . . . . . . . 4384 1 2699 . 1 1 245 245 LEU HD22 H 1 0.930 0.08 . 2 . . . . . . . . 4384 1 2700 . 1 1 245 245 LEU HD23 H 1 0.930 0.08 . 2 . . . . . . . . 4384 1 2701 . 1 1 245 245 LEU C C 13 180.724 0.05 . 1 . . . . . . . . 4384 1 2702 . 1 1 246 246 ASP N N 15 119.059 0.05 . 1 . . . . . . . . 4384 1 2703 . 1 1 246 246 ASP H H 1 8.402 0.02 . 1 . . . . . . . . 4384 1 2704 . 1 1 246 246 ASP CA C 13 56.919 0.20 . 1 . . . . . . . . 4384 1 2705 . 1 1 246 246 ASP HA H 1 4.394 0.08 . 1 . . . . . . . . 4384 1 2706 . 1 1 246 246 ASP CB C 13 40.599 0.20 . 1 . . . . . . . . 4384 1 2707 . 1 1 246 246 ASP HB3 H 1 2.542 0.08 . 2 . . . . . . . . 4384 1 2708 . 1 1 246 246 ASP HB2 H 1 2.754 0.08 . 2 . . . . . . . . 4384 1 2709 . 1 1 246 246 ASP C C 13 178.931 0.05 . 1 . . . . . . . . 4384 1 2710 . 1 1 247 247 ARG N N 15 118.356 0.05 . 1 . . . . . . . . 4384 1 2711 . 1 1 247 247 ARG H H 1 7.734 0.02 . 1 . . . . . . . . 4384 1 2712 . 1 1 247 247 ARG CA C 13 56.633 0.20 . 1 . . . . . . . . 4384 1 2713 . 1 1 247 247 ARG HA H 1 4.081 0.08 . 1 . . . . . . . . 4384 1 2714 . 1 1 247 247 ARG CB C 13 30.157 0.20 . 1 . . . . . . . . 4384 1 2715 . 1 1 247 247 ARG HB3 H 1 1.574 0.08 . 2 . . . . . . . . 4384 1 2716 . 1 1 247 247 ARG HB2 H 1 1.781 0.08 . 2 . . . . . . . . 4384 1 2717 . 1 1 247 247 ARG CG C 13 26.562 0.20 . 1 . . . . . . . . 4384 1 2718 . 1 1 247 247 ARG HG3 H 1 1.259 0.08 . 2 . . . . . . . . 4384 1 2719 . 1 1 247 247 ARG HG2 H 1 1.346 0.08 . 2 . . . . . . . . 4384 1 2720 . 1 1 247 247 ARG CD C 13 42.102 0.20 . 1 . . . . . . . . 4384 1 2721 . 1 1 247 247 ARG HD3 H 1 2.771 0.08 . 2 . . . . . . . . 4384 1 2722 . 1 1 247 247 ARG HD2 H 1 2.909 0.08 . 2 . . . . . . . . 4384 1 2723 . 1 1 247 247 ARG C C 13 178.017 0.05 . 1 . . . . . . . . 4384 1 2724 . 1 1 248 248 GLN N N 15 118.181 0.05 . 1 . . . . . . . . 4384 1 2725 . 1 1 248 248 GLN H H 1 7.955 0.02 . 1 . . . . . . . . 4384 1 2726 . 1 1 248 248 GLN CA C 13 57.197 0.20 . 1 . . . . . . . . 4384 1 2727 . 1 1 248 248 GLN HA H 1 4.152 0.08 . 1 . . . . . . . . 4384 1 2728 . 1 1 248 248 GLN CB C 13 29.427 0.20 . 1 . . . . . . . . 4384 1 2729 . 1 1 248 248 GLN HB2 H 1 2.035 0.08 . 2 . . . . . . . . 4384 1 2730 . 1 1 248 248 GLN CG C 13 34.396 0.20 . 1 . . . . . . . . 4384 1 2731 . 1 1 248 248 GLN HG3 H 1 2.233 0.08 . 2 . . . . . . . . 4384 1 2732 . 1 1 248 248 GLN HG2 H 1 2.472 0.08 . 2 . . . . . . . . 4384 1 2733 . 1 1 248 248 GLN CD C 13 180.075 0.20 . 1 . . . . . . . . 4384 1 2734 . 1 1 248 248 GLN NE2 N 15 110.318 0.05 . 1 . . . . . . . . 4384 1 2735 . 1 1 248 248 GLN HE21 H 1 7.281 0.02 . 1 . . . . . . . . 4384 1 2736 . 1 1 248 248 GLN HE22 H 1 6.573 0.02 . 1 . . . . . . . . 4384 1 2737 . 1 1 248 248 GLN C C 13 176.374 0.05 . 1 . . . . . . . . 4384 1 2738 . 1 1 249 249 LYS N N 15 119.673 0.05 . 1 . . . . . . . . 4384 1 2739 . 1 1 249 249 LYS H H 1 7.725 0.02 . 1 . . . . . . . . 4384 1 2740 . 1 1 249 249 LYS CA C 13 56.981 0.20 . 1 . . . . . . . . 4384 1 2741 . 1 1 249 249 LYS HA H 1 4.236 0.08 . 1 . . . . . . . . 4384 1 2742 . 1 1 249 249 LYS CB C 13 32.682 0.20 . 1 . . . . . . . . 4384 1 2743 . 1 1 249 249 LYS HB2 H 1 1.865 0.08 . 2 . . . . . . . . 4384 1 2744 . 1 1 249 249 LYS CG C 13 24.998 0.20 . 1 . . . . . . . . 4384 1 2745 . 1 1 249 249 LYS HG2 H 1 1.455 0.08 . 2 . . . . . . . . 4384 1 2746 . 1 1 249 249 LYS CD C 13 29.397 0.20 . 1 . . . . . . . . 4384 1 2747 . 1 1 249 249 LYS HD2 H 1 1.674 0.08 . 2 . . . . . . . . 4384 1 2748 . 1 1 249 249 LYS CE C 13 42.108 0.20 . 1 . . . . . . . . 4384 1 2749 . 1 1 249 249 LYS HE2 H 1 2.997 0.08 . 2 . . . . . . . . 4384 1 2750 . 1 1 249 249 LYS C C 13 176.600 0.05 . 1 . . . . . . . . 4384 1 2751 . 1 1 250 250 ILE N N 15 120.224 0.05 . 1 . . . . . . . . 4384 1 2752 . 1 1 250 250 ILE H H 1 7.794 0.02 . 1 . . . . . . . . 4384 1 2753 . 1 1 250 250 ILE CA C 13 60.975 0.20 . 1 . . . . . . . . 4384 1 2754 . 1 1 250 250 ILE HA H 1 4.151 0.08 . 1 . . . . . . . . 4384 1 2755 . 1 1 250 250 ILE CB C 13 38.770 0.20 . 1 . . . . . . . . 4384 1 2756 . 1 1 250 250 ILE HB H 1 1.827 0.08 . 1 . . . . . . . . 4384 1 2757 . 1 1 250 250 ILE CG1 C 13 27.396 0.20 . 1 . . . . . . . . 4384 1 2758 . 1 1 250 250 ILE HG13 H 1 1.107 0.08 . 2 . . . . . . . . 4384 1 2759 . 1 1 250 250 ILE HG12 H 1 1.427 0.08 . 2 . . . . . . . . 4384 1 2760 . 1 1 250 250 ILE CD1 C 13 12.991 0.20 . 1 . . . . . . . . 4384 1 2761 . 1 1 250 250 ILE HD11 H 1 0.804 0.08 . 1 . . . . . . . . 4384 1 2762 . 1 1 250 250 ILE HD12 H 1 0.804 0.08 . 1 . . . . . . . . 4384 1 2763 . 1 1 250 250 ILE HD13 H 1 0.804 0.08 . 1 . . . . . . . . 4384 1 2764 . 1 1 250 250 ILE CG2 C 13 17.236 0.20 . 1 . . . . . . . . 4384 1 2765 . 1 1 250 250 ILE HG21 H 1 0.891 0.08 . 1 . . . . . . . . 4384 1 2766 . 1 1 250 250 ILE HG22 H 1 0.891 0.08 . 1 . . . . . . . . 4384 1 2767 . 1 1 250 250 ILE HG23 H 1 0.891 0.08 . 1 . . . . . . . . 4384 1 2768 . 1 1 250 250 ILE C C 13 175.735 0.05 . 1 . . . . . . . . 4384 1 2769 . 1 1 251 251 ALA N N 15 129.109 0.05 . 1 . . . . . . . . 4384 1 2770 . 1 1 251 251 ALA H H 1 8.165 0.02 . 1 . . . . . . . . 4384 1 2771 . 1 1 251 251 ALA CA C 13 50.779 0.20 . 1 . . . . . . . . 4384 1 2772 . 1 1 251 251 ALA HA H 1 4.593 0.08 . 1 . . . . . . . . 4384 1 2773 . 1 1 251 251 ALA CB C 13 18.459 0.20 . 1 . . . . . . . . 4384 1 2774 . 1 1 251 251 ALA HB1 H 1 1.343 0.08 . 1 . . . . . . . . 4384 1 2775 . 1 1 251 251 ALA HB2 H 1 1.343 0.08 . 1 . . . . . . . . 4384 1 2776 . 1 1 251 251 ALA HB3 H 1 1.343 0.08 . 1 . . . . . . . . 4384 1 2777 . 1 1 251 251 ALA C C 13 175.452 0.05 . 1 . . . . . . . . 4384 1 2778 . 1 1 252 252 PRO CA C 13 63.091 0.20 . 1 . . . . . . . . 4384 1 2779 . 1 1 252 252 PRO HA H 1 4.441 0.08 . 1 . . . . . . . . 4384 1 2780 . 1 1 252 252 PRO CB C 13 32.315 0.20 . 1 . . . . . . . . 4384 1 2781 . 1 1 252 252 PRO HB3 H 1 1.880 0.08 . 2 . . . . . . . . 4384 1 2782 . 1 1 252 252 PRO HB2 H 1 2.271 0.08 . 2 . . . . . . . . 4384 1 2783 . 1 1 252 252 PRO CG C 13 27.538 0.20 . 1 . . . . . . . . 4384 1 2784 . 1 1 252 252 PRO HG2 H 1 1.996 0.08 . 2 . . . . . . . . 4384 1 2785 . 1 1 252 252 PRO CD C 13 50.607 0.20 . 1 . . . . . . . . 4384 1 2786 . 1 1 252 252 PRO HD3 H 1 3.638 0.08 . 2 . . . . . . . . 4384 1 2787 . 1 1 252 252 PRO HD2 H 1 3.771 0.08 . 2 . . . . . . . . 4384 1 2788 . 1 1 252 252 PRO C C 13 177.074 0.05 . 1 . . . . . . . . 4384 1 2789 . 1 1 253 253 LEU N N 15 121.884 0.05 . 1 . . . . . . . . 4384 1 2790 . 1 1 253 253 LEU H H 1 8.314 0.02 . 1 . . . . . . . . 4384 1 2791 . 1 1 253 253 LEU CA C 13 55.408 0.20 . 1 . . . . . . . . 4384 1 2792 . 1 1 253 253 LEU HA H 1 4.361 0.08 . 1 . . . . . . . . 4384 1 2793 . 1 1 253 253 LEU CB C 13 42.302 0.20 . 1 . . . . . . . . 4384 1 2794 . 1 1 253 253 LEU HB3 H 1 1.598 0.08 . 2 . . . . . . . . 4384 1 2795 . 1 1 253 253 LEU HB2 H 1 1.694 0.08 . 2 . . . . . . . . 4384 1 2796 . 1 1 253 253 LEU CG C 13 27.333 0.20 . 1 . . . . . . . . 4384 1 2797 . 1 1 253 253 LEU HG H 1 1.687 0.08 . 1 . . . . . . . . 4384 1 2798 . 1 1 253 253 LEU CD1 C 13 25.268 0.20 . 1 . . . . . . . . 4384 1 2799 . 1 1 253 253 LEU HD11 H 1 0.937 0.08 . 1 . . . . . . . . 4384 1 2800 . 1 1 253 253 LEU HD12 H 1 0.937 0.08 . 1 . . . . . . . . 4384 1 2801 . 1 1 253 253 LEU HD13 H 1 0.937 0.08 . 1 . . . . . . . . 4384 1 2802 . 1 1 253 253 LEU CD2 C 13 23.635 0.20 . 1 . . . . . . . . 4384 1 2803 . 1 1 253 253 LEU HD21 H 1 0.883 0.08 . 2 . . . . . . . . 4384 1 2804 . 1 1 253 253 LEU HD22 H 1 0.883 0.08 . 2 . . . . . . . . 4384 1 2805 . 1 1 253 253 LEU HD23 H 1 0.883 0.08 . 2 . . . . . . . . 4384 1 2806 . 1 1 253 253 LEU C C 13 177.746 0.05 . 1 . . . . . . . . 4384 1 2807 . 1 1 254 254 THR N N 15 113.706 0.05 . 1 . . . . . . . . 4384 1 2808 . 1 1 254 254 THR H H 1 8.036 0.02 . 1 . . . . . . . . 4384 1 2809 . 1 1 254 254 THR CA C 13 61.656 0.20 . 1 . . . . . . . . 4384 1 2810 . 1 1 254 254 THR HA H 1 4.363 0.08 . 1 . . . . . . . . 4384 1 2811 . 1 1 254 254 THR CB C 13 69.973 0.20 . 1 . . . . . . . . 4384 1 2812 . 1 1 254 254 THR HB H 1 4.250 0.08 . 1 . . . . . . . . 4384 1 2813 . 1 1 254 254 THR CG2 C 13 21.676 0.20 . 1 . . . . . . . . 4384 1 2814 . 1 1 254 254 THR HG21 H 1 1.166 0.08 . 1 . . . . . . . . 4384 1 2815 . 1 1 254 254 THR HG22 H 1 1.166 0.08 . 1 . . . . . . . . 4384 1 2816 . 1 1 254 254 THR HG23 H 1 1.166 0.08 . 1 . . . . . . . . 4384 1 2817 . 1 1 254 254 THR C C 13 174.521 0.05 . 1 . . . . . . . . 4384 1 2818 . 1 1 255 255 ASP N N 15 122.331 0.05 . 1 . . . . . . . . 4384 1 2819 . 1 1 255 255 ASP H H 1 8.322 0.02 . 1 . . . . . . . . 4384 1 2820 . 1 1 255 255 ASP CA C 13 54.632 0.20 . 1 . . . . . . . . 4384 1 2821 . 1 1 255 255 ASP HA H 1 4.586 0.08 . 1 . . . . . . . . 4384 1 2822 . 1 1 255 255 ASP CB C 13 41.233 0.20 . 1 . . . . . . . . 4384 1 2823 . 1 1 255 255 ASP HB3 H 1 2.656 0.08 . 2 . . . . . . . . 4384 1 2824 . 1 1 255 255 ASP HB2 H 1 2.719 0.08 . 2 . . . . . . . . 4384 1 2825 . 1 1 255 255 ASP C C 13 176.544 0.05 . 1 . . . . . . . . 4384 1 2826 . 1 1 256 256 GLN N N 15 120.433 0.05 . 1 . . . . . . . . 4384 1 2827 . 1 1 256 256 GLN H H 1 8.320 0.02 . 1 . . . . . . . . 4384 1 2828 . 1 1 256 256 GLN CA C 13 56.192 0.20 . 1 . . . . . . . . 4384 1 2829 . 1 1 256 256 GLN HA H 1 4.289 0.08 . 1 . . . . . . . . 4384 1 2830 . 1 1 256 256 GLN CB C 13 29.473 0.20 . 1 . . . . . . . . 4384 1 2831 . 1 1 256 256 GLN HB3 H 1 1.982 0.08 . 2 . . . . . . . . 4384 1 2832 . 1 1 256 256 GLN HB2 H 1 2.182 0.08 . 2 . . . . . . . . 4384 1 2833 . 1 1 256 256 GLN CG C 13 34.075 0.20 . 1 . . . . . . . . 4384 1 2834 . 1 1 256 256 GLN HG2 H 1 2.375 0.08 . 2 . . . . . . . . 4384 1 2835 . 1 1 256 256 GLN CD C 13 180.800 0.20 . 1 . . . . . . . . 4384 1 2836 . 1 1 256 256 GLN NE2 N 15 112.537 0.05 . 1 . . . . . . . . 4384 1 2837 . 1 1 256 256 GLN HE21 H 1 7.498 0.02 . 1 . . . . . . . . 4384 1 2838 . 1 1 256 256 GLN HE22 H 1 6.814 0.02 . 1 . . . . . . . . 4384 1 2839 . 1 1 256 256 GLN C C 13 176.691 0.05 . 1 . . . . . . . . 4384 1 2840 . 1 1 257 257 GLY N N 15 109.377 0.05 . 1 . . . . . . . . 4384 1 2841 . 1 1 257 257 GLY H H 1 8.415 0.02 . 1 . . . . . . . . 4384 1 2842 . 1 1 257 257 GLY CA C 13 45.563 0.20 . 1 . . . . . . . . 4384 1 2843 . 1 1 257 257 GLY HA2 H 1 3.924 0.08 . 2 . . . . . . . . 4384 1 2844 . 1 1 257 257 GLY C C 13 174.389 0.05 . 1 . . . . . . . . 4384 1 2845 . 1 1 258 258 ILE N N 15 119.794 0.05 . 1 . . . . . . . . 4384 1 2846 . 1 1 258 258 ILE H H 1 7.840 0.02 . 1 . . . . . . . . 4384 1 2847 . 1 1 258 258 ILE CA C 13 61.128 0.20 . 1 . . . . . . . . 4384 1 2848 . 1 1 258 258 ILE HA H 1 4.149 0.08 . 1 . . . . . . . . 4384 1 2849 . 1 1 258 258 ILE CB C 13 38.894 0.20 . 1 . . . . . . . . 4384 1 2850 . 1 1 258 258 ILE HB H 1 1.868 0.08 . 1 . . . . . . . . 4384 1 2851 . 1 1 258 258 ILE CG1 C 13 27.413 0.20 . 1 . . . . . . . . 4384 1 2852 . 1 1 258 258 ILE HG13 H 1 1.163 0.08 . 2 . . . . . . . . 4384 1 2853 . 1 1 258 258 ILE HG12 H 1 1.452 0.08 . 2 . . . . . . . . 4384 1 2854 . 1 1 258 258 ILE CD1 C 13 13.191 0.20 . 1 . . . . . . . . 4384 1 2855 . 1 1 258 258 ILE HD11 H 1 0.853 0.08 . 1 . . . . . . . . 4384 1 2856 . 1 1 258 258 ILE HD12 H 1 0.853 0.08 . 1 . . . . . . . . 4384 1 2857 . 1 1 258 258 ILE HD13 H 1 0.853 0.08 . 1 . . . . . . . . 4384 1 2858 . 1 1 258 258 ILE CG2 C 13 17.705 0.20 . 1 . . . . . . . . 4384 1 2859 . 1 1 258 258 ILE HG21 H 1 0.903 0.08 . 1 . . . . . . . . 4384 1 2860 . 1 1 258 258 ILE HG22 H 1 0.903 0.08 . 1 . . . . . . . . 4384 1 2861 . 1 1 258 258 ILE HG23 H 1 0.903 0.08 . 1 . . . . . . . . 4384 1 2862 . 1 1 258 258 ILE C C 13 176.240 0.05 . 1 . . . . . . . . 4384 1 2863 . 1 1 259 259 ALA N N 15 127.821 0.05 . 1 . . . . . . . . 4384 1 2864 . 1 1 259 259 ALA H H 1 8.276 0.02 . 1 . . . . . . . . 4384 1 2865 . 1 1 259 259 ALA CA C 13 52.486 0.20 . 1 . . . . . . . . 4384 1 2866 . 1 1 259 259 ALA HA H 1 4.299 0.08 . 1 . . . . . . . . 4384 1 2867 . 1 1 259 259 ALA CB C 13 19.497 0.20 . 1 . . . . . . . . 4384 1 2868 . 1 1 259 259 ALA HB1 H 1 1.392 0.08 . 1 . . . . . . . . 4384 1 2869 . 1 1 259 259 ALA HB2 H 1 1.392 0.08 . 1 . . . . . . . . 4384 1 2870 . 1 1 259 259 ALA HB3 H 1 1.392 0.08 . 1 . . . . . . . . 4384 1 2871 . 1 1 259 259 ALA C C 13 177.450 0.05 . 1 . . . . . . . . 4384 1 2872 . 1 1 260 260 ALA N N 15 123.324 0.05 . 1 . . . . . . . . 4384 1 2873 . 1 1 260 260 ALA H H 1 8.116 0.02 . 1 . . . . . . . . 4384 1 2874 . 1 1 260 260 ALA CA C 13 52.331 0.20 . 1 . . . . . . . . 4384 1 2875 . 1 1 260 260 ALA HA H 1 4.276 0.08 . 1 . . . . . . . . 4384 1 2876 . 1 1 260 260 ALA CB C 13 19.311 0.20 . 1 . . . . . . . . 4384 1 2877 . 1 1 260 260 ALA HB1 H 1 1.375 0.08 . 1 . . . . . . . . 4384 1 2878 . 1 1 260 260 ALA HB2 H 1 1.375 0.08 . 1 . . . . . . . . 4384 1 2879 . 1 1 260 260 ALA HB3 H 1 1.375 0.08 . 1 . . . . . . . . 4384 1 2880 . 1 1 260 260 ALA C C 13 177.337 0.05 . 1 . . . . . . . . 4384 1 2881 . 1 1 261 261 ALA N N 15 123.795 0.05 . 1 . . . . . . . . 4384 1 2882 . 1 1 261 261 ALA H H 1 8.147 0.02 . 1 . . . . . . . . 4384 1 2883 . 1 1 261 261 ALA CA C 13 52.362 0.20 . 1 . . . . . . . . 4384 1 2884 . 1 1 261 261 ALA HA H 1 4.329 0.08 . 1 . . . . . . . . 4384 1 2885 . 1 1 261 261 ALA CB C 13 19.409 0.20 . 1 . . . . . . . . 4384 1 2886 . 1 1 261 261 ALA HB1 H 1 1.383 0.08 . 1 . . . . . . . . 4384 1 2887 . 1 1 261 261 ALA HB2 H 1 1.383 0.08 . 1 . . . . . . . . 4384 1 2888 . 1 1 261 261 ALA HB3 H 1 1.383 0.08 . 1 . . . . . . . . 4384 1 2889 . 1 1 261 261 ALA C C 13 176.827 0.05 . 1 . . . . . . . . 4384 1 2890 . 1 1 262 262 MET N N 15 124.899 0.05 . 1 . . . . . . . . 4384 1 2891 . 1 1 262 262 MET H H 1 7.833 0.02 . 1 . . . . . . . . 4384 1 2892 . 1 1 262 262 MET CA C 13 57.048 0.20 . 1 . . . . . . . . 4384 1 2893 . 1 1 262 262 MET HA H 1 4.246 0.08 . 1 . . . . . . . . 4384 1 2894 . 1 1 262 262 MET CB C 13 34.187 0.20 . 1 . . . . . . . . 4384 1 2895 . 1 1 262 262 MET HB2 H 1 1.939 0.08 . 2 . . . . . . . . 4384 1 2896 . 1 1 262 262 MET CG C 13 32.211 0.20 . 1 . . . . . . . . 4384 1 2897 . 1 1 262 262 MET HG3 H 1 2.527 0.08 . 2 . . . . . . . . 4384 1 2898 . 1 1 262 262 MET HG2 H 1 2.619 0.08 . 2 . . . . . . . . 4384 1 2899 . 1 1 262 262 MET CE C 13 17.232 0.20 . 1 . . . . . . . . 4384 1 2900 . 1 1 262 262 MET HE1 H 1 2.096 0.20 . 1 . . . . . . . . 4384 1 2901 . 1 1 262 262 MET HE2 H 1 2.096 0.20 . 1 . . . . . . . . 4384 1 2902 . 1 1 262 262 MET HE3 H 1 2.096 0.20 . 1 . . . . . . . . 4384 1 2903 . 1 1 262 262 MET C C 13 181.126 0.05 . 1 . . . . . . . . 4384 1 stop_ save_