data_7250 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, 15N Chemical Shift Assignments for HIV-1 unmyristoylated matrix protein ; _BMRB_accession_number 7250 _BMRB_flat_file_name bmr7250.str _Entry_type original _Submission_date 2006-08-04 _Accession_date 2006-08-04 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Saad Jamil S. . 2 Miller Jaime . . 3 Tai Janet . . 4 Kim Andrew . . 5 Ghanam Ruba H. . 6 Summers Michael F. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 644 "13C chemical shifts" 429 "15N chemical shifts" 131 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2006-08-17 update BMRB 'Related entry added' 2006-08-16 update author 'Chemical shift referencing added' 2006-08-15 original author 'Original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Structural Basis for targeting HIV-1 Gag proteins to the plasma membrane for virus assembly' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 16840558 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Saad Jamil S. . 2 Miller Jaime . . 3 Tai Janet . . 4 Kim Andrew . . 5 Ghanam Ruba H. . 6 Summers Michael F. . stop_ _Journal_abbreviation 'Proc. Natl. Acad. Sci. U.S.A.' _Journal_volume 103 _Journal_issue 30 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 11364 _Page_last 11369 _Year 2006 _Details . loop_ _Keyword NMR stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'HIV-1 unmyristoylated Matrix' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'HIV-1 unmyristoylated Matrix' $HIV-1_MA stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'all free' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_HIV-1_MA _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'Matrix protein' _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 131 _Mol_residue_sequence ; GARASVLSGGELDKWEKIRL RPGGKKQYKLKHIVWASREL ERFAVNPGLLETSEGCRQIL GQLQPSLQTGSEELRSLYNT IAVLYCVHQRIDVKDTKEAL DKIEEEQNKSKKKAQQAAAD TGNNSQVSQNY ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 2 GLY 2 3 ALA 3 4 ARG 4 5 ALA 5 6 SER 6 7 VAL 7 8 LEU 8 9 SER 9 10 GLY 10 11 GLY 11 12 GLU 12 13 LEU 13 14 ASP 14 15 LYS 15 16 TRP 16 17 GLU 17 18 LYS 18 19 ILE 19 20 ARG 20 21 LEU 21 22 ARG 22 23 PRO 23 24 GLY 24 25 GLY 25 26 LYS 26 27 LYS 27 28 GLN 28 29 TYR 29 30 LYS 30 31 LEU 31 32 LYS 32 33 HIS 33 34 ILE 34 35 VAL 35 36 TRP 36 37 ALA 37 38 SER 38 39 ARG 39 40 GLU 40 41 LEU 41 42 GLU 42 43 ARG 43 44 PHE 44 45 ALA 45 46 VAL 46 47 ASN 47 48 PRO 48 49 GLY 49 50 LEU 50 51 LEU 51 52 GLU 52 53 THR 53 54 SER 54 55 GLU 55 56 GLY 56 57 CYS 57 58 ARG 58 59 GLN 59 60 ILE 60 61 LEU 61 62 GLY 62 63 GLN 63 64 LEU 64 65 GLN 65 66 PRO 66 67 SER 67 68 LEU 68 69 GLN 69 70 THR 70 71 GLY 71 72 SER 72 73 GLU 73 74 GLU 74 75 LEU 75 76 ARG 76 77 SER 77 78 LEU 78 79 TYR 79 80 ASN 80 81 THR 81 82 ILE 82 83 ALA 83 84 VAL 84 85 LEU 85 86 TYR 86 87 CYS 87 88 VAL 88 89 HIS 89 90 GLN 90 91 ARG 91 92 ILE 92 93 ASP 93 94 VAL 94 95 LYS 95 96 ASP 96 97 THR 97 98 LYS 98 99 GLU 99 100 ALA 100 101 LEU 101 102 ASP 102 103 LYS 103 104 ILE 104 105 GLU 105 106 GLU 106 107 GLU 107 108 GLN 108 109 ASN 109 110 LYS 110 111 SER 111 112 LYS 112 113 LYS 113 114 LYS 114 115 ALA 115 116 GLN 116 117 GLN 117 118 ALA 118 119 ALA 119 120 ALA 120 121 ASP 121 122 THR 122 123 GLY 123 124 ASN 124 125 ASN 125 126 SER 126 127 GLN 127 128 VAL 128 129 SER 129 130 GLN 130 131 ASN 131 132 TYR stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 15114 Gag_polyprotein 100.00 131 99.24 99.24 1.25e-88 BMRB 15116 Gag_polyprotein 100.00 131 99.24 99.24 2.04e-88 BMRB 18715 MA 100.00 131 100.00 100.00 1.67e-89 BMRB 18716 MA 100.00 131 100.00 100.00 1.67e-89 BMRB 5316 Gag283 100.00 288 100.00 100.00 6.10e-88 BMRB 5960 MA 100.00 132 100.00 100.00 1.73e-89 BMRB 7267 HIV-1_MA 100.00 131 100.00 100.00 1.67e-89 BMRB 7275 HIV-1_MA 100.00 131 100.00 100.00 1.67e-89 BMRB 7309 HIV-1_myrMA 100.00 132 100.00 100.00 1.73e-89 PDB 1HIW "Trimeric Hiv-1 Matrix Protein" 100.00 133 100.00 100.00 1.35e-89 PDB 1L6N "Structure Of The N-Terminal 283-Residue Fragment Of The Hiv- 1 Gag Polyprotein" 100.00 289 100.00 100.00 5.90e-88 PDB 1UPH "Hiv-1 Myristoylated Matrix" 99.24 132 100.00 100.00 2.04e-88 PDB 2GOL "Xray Structure Of Gag278" 100.00 133 100.00 100.00 1.35e-89 PDB 2H3F "Solution Structure Of The Hiv-1 Ma Protein" 99.24 131 100.00 100.00 1.98e-88 PDB 2H3I "Solution Structure Of The Hiv-1 Myristoylated Matrix Protein" 98.47 131 100.00 100.00 1.40e-87 PDB 2H3Q "Solution Structure Of Hiv-1 Myrma Bound To Di-c4-phosphatidylinositol- (4,5)-bisphosphate" 98.47 131 100.00 100.00 1.40e-87 PDB 2H3V "Structure Of The Hiv-1 Matrix Protein Bound To Di-C8- Phosphatidylinositol-(4,5)-Bisphosphate" 99.24 131 100.00 100.00 1.98e-88 PDB 2H3Z "Structure Of The Hiv-1 Matrix Protein Bound To Di-c4- Phosphatidylinositol-(4,5)-bisphosphate" 99.24 131 100.00 100.00 1.98e-88 PDB 2HMX "Human Immunodeficiency Virus Type 1 Matrix Protein" 99.24 133 100.00 100.00 1.55e-88 PDB 2JMG "Solution Structure Of V7r Mutant Of Hiv-1 Myristoylated Matrix Protein" 98.47 131 99.22 99.22 1.76e-86 PDB 2LYA "Structure Of Hiv-1 Myr(-) Matrix Protein In Complex With 1,2- Dioctanoyl-sn-phosphatidylcholine" 100.00 137 100.00 100.00 1.55e-89 PDB 2LYB "Structure Of Hiv-1 Myr(-) Matrix Protein In Complex With 1,2- Dioctanoyl-sn-phosphatidyl-l-serine" 100.00 137 100.00 100.00 1.55e-89 PDB 2NV3 "Solution Structure Of L8a Mutant Of Hiv-1 Myristoylated Matrix Protein" 98.47 131 99.22 99.22 9.96e-87 PDB 4JMU "Crystal Structure Of Hiv Matrix Residues 1-111 In Complex With Inhibitor" 83.97 112 100.00 100.00 2.10e-73 DBJ BAF34641 "gag polyprotein [HIV-1 vector pNL-DT5R]" 100.00 498 100.00 100.00 7.06e-85 DBJ BAG48474 "gag protein [Human immunodeficiency virus 1]" 100.00 147 100.00 100.00 1.18e-89 EMBL CBI61180 "gag polyprotein [HIV-1 M:B 2003_KC005]" 100.00 497 99.24 99.24 1.44e-83 EMBL CBI61181 "gag polyprotein [HIV-1 M:B 2003_KC005]" 100.00 497 99.24 99.24 2.87e-84 EMBL CBI61182 "gag polyprotein [HIV-1 M:B 2003_KC005]" 100.00 497 99.24 100.00 2.01e-84 EMBL CBI61183 "gag polyprotein [HIV-1 M:B 2003_KC005]" 100.00 497 99.24 99.24 3.67e-84 EMBL CBI61184 "gag polyprotein [HIV-1 M:B 2003_KC005]" 100.00 497 100.00 100.00 5.32e-85 GB AAA44987 "gag polyprotein [Human immunodeficiency virus 1]" 100.00 500 100.00 100.00 7.19e-85 GB AAB00898 "p17 protein, partial [Human immunodeficiency virus 1]" 78.63 117 97.09 99.03 6.68e-64 GB AAB60571 "Gag polyprotein precursor [Human immunodeficiency virus 1]" 100.00 500 100.00 100.00 7.19e-85 GB AAC28445 "gag protein [Human immunodeficiency virus 1]" 100.00 500 97.71 98.47 7.42e-83 GB AAC29216 "Gag [Human immunodeficiency virus 1]" 63.36 83 98.80 100.00 1.99e-52 SP P12493 "RecName: Full=Gag polyprotein; AltName: Full=Pr55Gag; Contains: RecName: Full=Matrix protein p17; Short=MA; Contains: RecName: " 100.00 500 100.00 100.00 7.19e-85 SP P12497 "RecName: Full=Gag-Pol polyprotein; AltName: Full=Pr160Gag-Pol; Contains: RecName: Full=Matrix protein p17; Short=MA; Contains: " 100.00 1435 100.00 100.00 7.00e-80 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $HIV-1_MA Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $HIV-1_MA 'recombinant technology' 'Escherichia coli' . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $HIV-1_MA 0.5 mM '[U-15 N; U-13 C]' stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ save_800MHz _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_15N-edited_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 15N-edited NOESY' _Sample_label $sample_1 save_ save_13C-edited_NOESY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '13C-edited NOESY' _Sample_label $sample_1 save_ save_4D_15N,13C-edited_NOESY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '4D 15N,13C-edited NOESY' _Sample_label $sample_1 save_ save_4D_13C,13C-edited_NOESY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '4D 13C,13C-edited NOESY' _Sample_label $sample_1 save_ save_2D_1H-15N_HSQC _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _BMRB_pulse_sequence_accession_number . _Details . save_ save_3D_15N-edited_NOESY _Saveframe_category NMR_applied_experiment _Experiment_name '3D 15N-edited NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_13C-edited_NOESY _Saveframe_category NMR_applied_experiment _Experiment_name '13C-edited NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_4D_15N-13C-edited_NOESY _Saveframe_category NMR_applied_experiment _Experiment_name '4D 15N,13C-edited NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_4D_13C-13C-edited_NOESY _Saveframe_category NMR_applied_experiment _Experiment_name '4D 13C,13C-edited NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 5.5 . pH temperature 308 0.05 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 H2O H 1 protons ppm 4.706 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 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_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name 'HIV-1 unmyristoylated Matrix' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 2 1 GLY H H 8.594 . 1 2 2 1 GLY HA2 H 3.950 . 1 3 2 1 GLY CA C 45.102 . 1 4 2 1 GLY N N 110.802 . 1 5 3 2 ALA H H 8.160 . 1 6 3 2 ALA HA H 4.305 . 1 7 3 2 ALA HB H 1.515 . 1 8 3 2 ALA CA C 49.847 . 1 9 3 2 ALA CB C 14.561 . 1 10 3 2 ALA N N 123.802 . 1 11 4 3 ARG H H 8.406 . 1 12 4 3 ARG HA H 4.233 . 1 13 4 3 ARG HB2 H 1.765 . 2 14 4 3 ARG HG2 H 1.641 . 2 15 4 3 ARG HD2 H 3.164 . 1 16 4 3 ARG CA C 53.275 . 1 17 4 3 ARG CB C 28.271 . 1 18 4 3 ARG CG C 24.623 . 1 19 4 3 ARG CD C 40.737 . 1 20 4 3 ARG N N 120.125 . 1 21 5 4 ALA H H 8.347 . 1 22 5 4 ALA HA H 4.259 . 1 23 5 4 ALA HB H 1.305 . 1 24 5 4 ALA CA C 49.681 . 1 25 5 4 ALA CB C 16.982 . 1 26 5 4 ALA N N 125.125 . 1 27 6 5 SER H H 8.111 . 1 28 6 5 SER HA H 4.456 . 1 29 6 5 SER HB2 H 3.767 . 1 30 6 5 SER CA C 55.114 . 1 31 6 5 SER CB C 61.344 . 1 32 6 5 SER N N 114.500 . 1 33 7 6 VAL H H 8.096 . 1 34 7 6 VAL HA H 3.594 . 1 35 7 6 VAL HB H 1.805 . 1 36 7 6 VAL HG1 H 0.738 . 1 37 7 6 VAL HG2 H 0.738 . 1 38 7 6 VAL CA C 63.007 . 1 39 7 6 VAL CB C 29.669 . 1 40 7 6 VAL CG1 C 19.857 . 1 41 7 6 VAL CG2 C 19.601 . 1 42 7 6 VAL N N 121.375 . 1 43 8 7 LEU H H 7.359 . 1 44 8 7 LEU HA H 4.891 . 1 45 8 7 LEU HB2 H 1.437 . 2 46 8 7 LEU HG H 1.040 . 1 47 8 7 LEU HD1 H 0.144 . 1 48 8 7 LEU HD2 H 0.241 . 1 49 8 7 LEU CA C 49.893 . 1 50 8 7 LEU CB C 41.412 . 1 51 8 7 LEU CG C 23.419 . 1 52 8 7 LEU CD1 C 23.525 . 2 53 8 7 LEU CD2 C 20.507 . 2 54 8 7 LEU N N 115.438 . 1 55 9 8 SER H H 9.143 . 1 56 9 8 SER HA H 4.583 . 1 57 9 8 SER HB2 H 3.957 . 2 58 9 8 SER CA C 54.507 . 1 59 9 8 SER CB C 62.736 . 1 60 9 8 SER N N 118.250 . 1 61 10 9 GLY H H 8.936 . 1 62 10 9 GLY HA2 H 3.838 . 2 63 10 9 GLY HA3 H 3.974 . 1 64 10 9 GLY CA C 44.984 . 1 65 10 9 GLY N N 109.188 . 1 66 11 10 GLY H H 8.759 . 1 67 11 10 GLY HA2 H 3.910 . 2 68 11 10 GLY HA3 H 3.986 . 1 69 11 10 GLY CA C 43.971 . 1 70 11 10 GLY N N 111.062 . 1 71 12 11 GLU H H 7.728 . 1 72 12 11 GLU HA H 3.927 . 1 73 12 11 GLU HB2 H 2.253 . 2 74 12 11 GLU HB3 H 1.763 . 1 75 12 11 GLU HG2 H 2.106 . 2 76 12 11 GLU HG3 H 2.559 . 1 77 12 11 GLU CA C 56.406 . 1 78 12 11 GLU CB C 28.600 . 1 79 12 11 GLU CG C 34.633 . 1 80 12 11 GLU N N 120.125 . 1 81 13 12 LEU H H 8.317 . 1 82 13 12 LEU HA H 4.085 . 1 83 13 12 LEU HB2 H 1.367 . 2 84 13 12 LEU HG H 1.679 . 1 85 13 12 LEU HD1 H 0.937 . 2 86 13 12 LEU HD2 H 0.924 . 2 87 13 12 LEU CA C 55.372 . 1 88 13 12 LEU CB C 38.246 . 1 89 13 12 LEU CG C 24.531 . 1 90 13 12 LEU CD1 C 22.614 . 2 91 13 12 LEU CD2 C 21.420 . 2 92 13 12 LEU N N 121.375 . 1 93 14 13 ASP H H 7.551 . 1 94 14 13 ASP HA H 4.370 . 1 95 14 13 ASP HB2 H 2.690 . 2 96 14 13 ASP CA C 54.446 . 1 97 14 13 ASP CB C 38.396 . 1 98 14 13 ASP N N 116.375 . 1 99 15 14 LYS H H 7.094 . 1 100 15 14 LYS HA H 4.023 . 1 101 15 14 LYS HB2 H 2.105 . 2 102 15 14 LYS HB3 H 1.864 . 1 103 15 14 LYS HG2 H 1.587 . 2 104 15 14 LYS HD2 H 1.649 . 1 105 15 14 LYS HE2 H 2.937 . 1 106 15 14 LYS CA C 55.712 . 1 107 15 14 LYS CB C 29.669 . 1 108 15 14 LYS CG C 21.935 . 1 109 15 14 LYS CD C 26.256 . 1 110 15 14 LYS CE C 39.685 . 1 111 15 14 LYS N N 115.438 . 1 112 16 15 TRP H H 8.623 . 1 113 16 15 TRP HA H 4.002 . 1 114 16 15 TRP HB2 H 3.158 . 2 115 16 15 TRP HB3 H 3.527 . 2 116 16 15 TRP HD1 H 6.491 . 1 117 16 15 TRP HE1 H 9.303 . 2 118 16 15 TRP HE3 H 7.106 . 2 119 16 15 TRP HZ2 H 7.080 . 2 120 16 15 TRP HZ3 H 6.429 . 2 121 16 15 TRP CA C 57.596 . 1 122 16 15 TRP CB C 28.423 . 1 123 16 15 TRP CD1 C 121.353 . 2 124 16 15 TRP CE3 C 116.814 . 2 125 16 15 TRP CZ2 C 111.263 . 2 126 16 15 TRP CZ3 C 119.634 . 2 127 16 15 TRP N N 121.653 . 1 128 16 15 TRP NE1 N 126.442 . 1 129 17 16 GLU H H 7.548 . 1 130 17 16 GLU HA H 4.668 . 1 131 17 16 GLU HB2 H 2.212 . 2 132 17 16 GLU HB3 H 2.080 . 1 133 17 16 GLU HG2 H 2.863 . 2 134 17 16 GLU HG3 H 2.464 . 1 135 17 16 GLU CA C 54.079 . 1 136 17 16 GLU CB C 27.055 . 1 137 17 16 GLU CG C 35.697 . 1 138 17 16 GLU N N 127.670 . 1 139 18 17 LYS H H 7.433 . 1 140 18 17 LYS HA H 4.474 . 1 141 18 17 LYS HB2 H 1.982 . 2 142 18 17 LYS HB3 H 1.758 . 1 143 18 17 LYS HG2 H 1.566 . 2 144 18 17 LYS HD2 H 1.643 . 1 145 18 17 LYS HE2 H 3.033 . 2 146 18 17 LYS CA C 52.879 . 1 147 18 17 LYS CB C 31.249 . 1 148 18 17 LYS CG C 22.717 . 1 149 18 17 LYS CD C 26.370 . 1 150 18 17 LYS CE C 39.699 . 2 151 18 17 LYS N N 115.750 . 1 152 19 18 ILE H H 7.610 . 1 153 19 18 ILE HA H 3.534 . 1 154 19 18 ILE HB H 1.569 . 1 155 19 18 ILE HG12 H 1.938 . 9 156 19 18 ILE HG13 H 0.807 . 9 157 19 18 ILE HG2 H 0.550 . 1 158 19 18 ILE HD1 H 0.453 . 1 159 19 18 ILE CA C 60.546 . 1 160 19 18 ILE CB C 35.431 . 1 161 19 18 ILE CG1 C 25.130 . 2 162 19 18 ILE CG2 C 13.946 . 2 163 19 18 ILE CD1 C 12.290 . 1 164 19 18 ILE N N 124.188 . 1 165 20 19 ARG H H 8.008 . 1 166 20 19 ARG HA H 4.405 . 1 167 20 19 ARG HB2 H 1.809 . 2 168 20 19 ARG HB3 H 1.648 . 2 169 20 19 ARG HG2 H 1.750 . 2 170 20 19 ARG HG3 H 1.660 . 1 171 20 19 ARG HD2 H 3.288 . 2 172 20 19 ARG CA C 53.805 . 1 173 20 19 ARG CB C 28.847 . 1 174 20 19 ARG CG C 26.091 . 1 175 20 19 ARG CD C 40.811 . 1 176 20 19 ARG N N 125.750 . 1 177 21 20 LEU H H 7.787 . 1 178 21 20 LEU HA H 3.408 . 1 179 21 20 LEU HB2 H 1.293 . 2 180 21 20 LEU HB3 H 1.210 . 2 181 21 20 LEU HG H 0.701 . 1 182 21 20 LEU HD1 H 0.186 . 2 183 21 20 LEU HD2 H -0.375 . 2 184 21 20 LEU CA C 55.737 . 1 185 21 20 LEU CB C 38.891 . 1 186 21 20 LEU CG C 25.725 . 1 187 21 20 LEU CD1 C 22.146 . 2 188 21 20 LEU CD2 C 18.969 . 2 189 21 20 LEU N N 120.125 . 1 190 22 21 ARG H H 8.951 . 1 191 22 21 ARG HA H 4.822 . 1 192 22 21 ARG HB2 H 1.820 . 2 193 22 21 ARG HB3 H 1.604 . 2 194 22 21 ARG HG2 H 1.517 . 2 195 22 21 ARG HD2 H 3.162 . 2 196 22 21 ARG CA C 50.154 . 1 197 22 21 ARG CB C 28.927 . 1 198 22 21 ARG CG C 23.917 . 1 199 22 21 ARG CD C 40.750 . 1 200 22 21 ARG N N 119.500 . 1 201 23 22 PRO HA H 4.337 . 1 202 23 22 PRO HB2 H 2.226 . 2 203 23 22 PRO HB3 H 1.881 . 2 204 23 22 PRO HG2 H 2.076 . 2 205 23 22 PRO HD2 H 3.579 . 2 206 23 22 PRO CA C 60.746 . 1 207 23 22 PRO CB C 28.875 . 1 208 23 22 PRO CG C 25.432 . 1 209 23 22 PRO CD C 47.795 . 1 210 24 23 GLY H H 9.115 . 1 211 24 23 GLY HA2 H 3.899 . 2 212 24 23 GLY HA3 H 3.781 . 2 213 24 23 GLY CA C 43.115 . 1 214 24 23 GLY N N 112.625 . 1 215 25 24 GLY H H 8.111 . 1 216 25 24 GLY HA2 H 4.109 . 2 217 25 24 GLY HA3 H 4.110 . 2 218 25 24 GLY CA C 41.882 . 1 219 25 24 GLY N N 107.938 . 1 220 26 25 LYS H H 8.642 . 1 221 26 25 LYS HA H 4.241 . 1 222 26 25 LYS HB2 H 1.764 . 2 223 26 25 LYS HG2 H 1.427 . 2 224 26 25 LYS CA C 54.163 . 1 225 26 25 LYS CB C 31.366 . 1 226 26 25 LYS CG C 22.673 . 1 227 26 25 LYS N N 117.625 . 1 228 27 26 LYS H H 7.794 . 1 229 27 26 LYS HA H 4.288 . 1 230 27 26 LYS HB2 H 1.778 . 2 231 27 26 LYS HG2 H 1.609 . 2 232 27 26 LYS HD2 H 1.790 . 2 233 27 26 LYS CA C 54.521 . 1 234 27 26 LYS CB C 31.188 . 1 235 27 26 LYS CG C 23.178 . 1 236 27 26 LYS CD C 28.100 . 1 237 27 26 LYS N N 117.885 . 1 238 28 27 GLN H H 8.435 . 1 239 28 27 GLN HA H 4.793 . 1 240 28 27 GLN HB2 H 2.055 . 2 241 28 27 GLN HB3 H 1.895 . 2 242 28 27 GLN HG2 H 1.991 . 2 243 28 27 GLN CA C 51.783 . 1 244 28 27 GLN CB C 31.364 . 1 245 28 27 GLN CG C 32.117 . 1 246 28 27 GLN N N 122.938 . 1 247 29 28 TYR H H 7.801 . 1 248 29 28 TYR HA H 3.709 . 1 249 29 28 TYR HB2 H 1.913 . 2 250 29 28 TYR HB3 H 1.533 . 2 251 29 28 TYR HD2 H 6.364 . 2 252 29 28 TYR HE2 H 6.339 . 2 253 29 28 TYR CA C 58.320 . 1 254 29 28 TYR CB C 34.526 . 1 255 29 28 TYR CD2 C 133.914 . 2 256 29 28 TYR CE2 C 113.875 . 2 257 29 28 TYR N N 119.500 . 1 258 30 29 LYS H H 10.587 . 1 259 30 29 LYS HA H 5.193 . 1 260 30 29 LYS HB2 H 1.906 . 2 261 30 29 LYS HB3 H 2.357 . 2 262 30 29 LYS HG2 H 1.643 . 2 263 30 29 LYS HD2 H 1.755 . 2 264 30 29 LYS CA C 51.375 . 1 265 30 29 LYS CB C 35.898 . 1 266 30 29 LYS CG C 21.955 . 2 267 30 29 LYS CD C 26.410 . 1 268 30 29 LYS N N 117.938 . 1 269 31 30 LEU H H 9.968 . 1 270 31 30 LEU HA H 4.158 . 1 271 31 30 LEU HB2 H 1.783 . 2 272 31 30 LEU HB3 H 1.759 . 2 273 31 30 LEU HG H 1.737 . 1 274 31 30 LEU HD1 H 0.951 . 2 275 31 30 LEU HD2 H 0.936 . 2 276 31 30 LEU CA C 56.544 . 1 277 31 30 LEU CB C 38.312 . 1 278 31 30 LEU CG C 24.518 . 1 279 31 30 LEU CD1 C 21.436 . 2 280 31 30 LEU CD2 C 21.350 . 2 281 31 30 LEU N N 128.562 . 1 282 32 31 LYS H H 8.376 . 1 283 32 31 LYS HA H 4.122 . 1 284 32 31 LYS HB2 H 1.763 . 2 285 32 31 LYS HB3 H 1.855 . 2 286 32 31 LYS HG2 H 1.611 . 1 287 32 31 LYS HD2 H 1.438 . 2 288 32 31 LYS HE2 H 3.007 . 2 289 32 31 LYS CA C 56.407 . 1 290 32 31 LYS CB C 28.869 . 1 291 32 31 LYS CG C 21.845 . 1 292 32 31 LYS CD C 26.911 . 1 293 32 31 LYS CE C 39.628 . 1 294 32 31 LYS N N 115.125 . 1 295 33 32 HIS H H 8.170 . 1 296 33 32 HIS HA H 4.581 . 1 297 33 32 HIS HB2 H 3.870 . 2 298 33 32 HIS HB3 H 3.875 . 2 299 33 32 HIS HD2 H 7.159 . 3 300 33 32 HIS HE1 H 7.654 . 3 301 33 32 HIS CA C 60.201 . 1 302 33 32 HIS CB C 30.094 . 1 303 33 32 HIS CD2 C 114.469 . 1 304 33 32 HIS CE1 C 134.949 . 1 305 33 32 HIS N N 119.500 . 1 306 34 33 ILE H H 7.875 . 1 307 34 33 ILE HA H 3.771 . 1 308 34 33 ILE HB H 2.153 . 1 309 34 33 ILE HG12 H 1.331 . 9 310 34 33 ILE HG13 H 0.650 . 1 311 34 33 ILE HG2 H 0.696 . 1 312 34 33 ILE HD1 H -0.205 . 1 313 34 33 ILE CA C 61.347 . 1 314 34 33 ILE CB C 34.320 . 1 315 34 33 ILE CG1 C 26.311 . 2 316 34 33 ILE CG2 C 14.850 . 2 317 34 33 ILE CD1 C 9.046 . 1 318 34 33 ILE N N 119.500 . 1 319 35 34 VAL H H 7.683 . 1 320 35 34 VAL HA H 3.589 . 1 321 35 34 VAL HB H 2.121 . 1 322 35 34 VAL HG1 H 1.039 . 2 323 35 34 VAL HG2 H 1.003 . 2 324 35 34 VAL CA C 64.056 . 1 325 35 34 VAL CB C 29.452 . 1 326 35 34 VAL CG1 C 18.968 . 2 327 35 34 VAL CG2 C 19.440 . 2 328 35 34 VAL N N 122.000 . 1 329 36 35 TRP H H 8.429 . 1 330 36 35 TRP HA H 4.210 . 1 331 36 35 TRP HB2 H 3.472 . 2 332 36 35 TRP HD1 H 7.404 . 1 333 36 35 TRP HE1 H 10.263 . 2 334 36 35 TRP HE3 H 6.899 . 2 335 36 35 TRP HZ2 H 7.416 . 2 336 36 35 TRP HH2 H 7.359 . 1 337 36 35 TRP CA C 59.420 . 1 338 36 35 TRP CB C 25.722 . 1 339 36 35 TRP CD1 C 125.117 . 2 340 36 35 TRP CZ2 C 111.994 . 2 341 36 35 TRP CZ3 C 117.074 . 2 342 36 35 TRP CH2 C 121.363 . 1 343 36 35 TRP N N 119.946 . 1 344 36 35 TRP NE1 N 131.062 . 1 345 37 36 ALA H H 8.288 . 1 346 37 36 ALA HA H 3.349 . 1 347 37 36 ALA HB H 1.518 . 1 348 37 36 ALA CA C 52.545 . 1 349 37 36 ALA CB C 14.743 . 1 350 37 36 ALA N N 120.438 . 1 351 38 37 SER H H 8.236 . 1 352 38 37 SER HA H 3.883 . 1 353 38 37 SER HB2 H 3.886 . 2 354 38 37 SER CA C 60.111 . 1 355 38 37 SER CB C 60.139 . 1 356 38 37 SER N N 111.375 . 1 357 39 38 ARG H H 7.536 . 1 358 39 38 ARG HA H 4.123 . 1 359 39 38 ARG HB2 H 1.859 . 2 360 39 38 ARG HG2 H 1.738 . 2 361 39 38 ARG HD2 H 3.173 . 2 362 39 38 ARG CA C 55.720 . 1 363 39 38 ARG CB C 27.318 . 1 364 39 38 ARG CG C 24.526 . 1 365 39 38 ARG CD C 40.760 . 1 366 39 38 ARG N N 119.812 . 1 367 40 39 GLU H H 8.199 . 1 368 40 39 GLU HA H 3.764 . 1 369 40 39 GLU HB2 H 1.544 . 2 370 40 39 GLU CA C 55.591 . 1 371 40 39 GLU CB C 26.984 . 1 372 40 39 GLU CG C 31.673 . 1 373 40 39 GLU N N 121.062 . 1 374 41 40 LEU H H 7.993 . 1 375 41 40 LEU HA H 3.888 . 1 376 41 40 LEU HB2 H 1.870 . 2 377 41 40 LEU HB3 H 1.407 . 2 378 41 40 LEU HG H 1.709 . 1 379 41 40 LEU HD1 H 0.803 . 2 380 41 40 LEU HD2 H 0.752 . 2 381 41 40 LEU CA C 55.556 . 1 382 41 40 LEU CB C 37.601 . 1 383 41 40 LEU CG C 24.204 . 1 384 41 40 LEU CD1 C 23.897 . 2 385 41 40 LEU CD2 C 19.663 . 2 386 41 40 LEU N N 117.000 . 1 387 42 41 GLU H H 7.536 . 1 388 42 41 GLU HA H 4.104 . 1 389 42 41 GLU HB2 H 2.107 . 2 390 42 41 GLU HB3 H 1.650 . 2 391 42 41 GLU HG2 H 2.520 . 2 392 42 41 GLU HG3 H 2.150 . 2 393 42 41 GLU CA C 56.881 . 1 394 42 41 GLU CB C 26.975 . 1 395 42 41 GLU CG C 34.129 . 1 396 42 41 GLU N N 117.312 . 1 397 43 42 ARG H H 7.624 . 1 398 43 42 ARG HA H 4.004 . 1 399 43 42 ARG HB2 H 1.639 . 2 400 43 42 ARG HB3 H 2.101 . 2 401 43 42 ARG HG2 H 1.418 . 2 402 43 42 ARG HG3 H 1.646 . 2 403 43 42 ARG HD2 H 2.984 . 2 404 43 42 ARG CA C 55.911 . 1 405 43 42 ARG CB C 26.975 . 1 406 43 42 ARG CG C 24.591 . 1 407 43 42 ARG CD C 40.805 . 1 408 43 42 ARG N N 119.500 . 1 409 44 43 PHE H H 7.506 . 1 410 44 43 PHE HA H 4.593 . 1 411 44 43 PHE HB2 H 3.414 . 2 412 44 43 PHE HB3 H 2.704 . 2 413 44 43 PHE HD1 H 7.126 . 2 414 44 43 PHE HE1 H 7.012 . 2 415 44 43 PHE CA C 54.528 . 1 416 44 43 PHE CB C 36.384 . 1 417 44 43 PHE CD1 C 128.724 . 2 418 44 43 PHE CE1 C 130.701 . 2 419 44 43 PHE N N 117.625 . 1 420 45 44 ALA H H 7.905 . 1 421 45 44 ALA HA H 3.992 . 1 422 45 44 ALA HB H 1.429 . 1 423 45 44 ALA CA C 50.724 . 1 424 45 44 ALA CB C 13.665 . 1 425 45 44 ALA N N 118.875 . 1 426 46 45 VAL H H 7.742 . 1 427 46 45 VAL HA H 4.104 . 1 428 46 45 VAL HB H 1.753 . 1 429 46 45 VAL HG1 H 0.815 . 2 430 46 45 VAL HG2 H 0.786 . 2 431 46 45 VAL CA C 57.967 . 1 432 46 45 VAL CB C 30.815 . 1 433 46 45 VAL CG1 C 19.135 . 2 434 46 45 VAL CG2 C 19.455 . 2 435 46 45 VAL N N 119.500 . 1 436 47 46 ASN H H 8.376 . 1 437 47 46 ASN HA H 4.623 . 1 438 47 46 ASN HB2 H 2.855 . 2 439 47 46 ASN CA C 48.307 . 1 440 47 46 ASN CB C 36.396 . 1 441 47 46 ASN N N 125.750 . 1 442 48 47 PRO HA H 4.199 . 1 443 48 47 PRO HB2 H 2.002 . 2 444 48 47 PRO HB3 H 2.338 . 2 445 48 47 PRO HG2 H 1.987 . 2 446 48 47 PRO HG3 H 1.763 . 2 447 48 47 PRO HD2 H 3.864 . 2 448 48 47 PRO HD3 H 4.230 . 2 449 48 47 PRO CA C 61.624 . 1 450 48 47 PRO CB C 29.050 . 1 451 48 47 PRO CG C 25.124 . 1 452 48 47 PRO CD C 48.248 . 1 453 49 48 GLY H H 8.597 . 1 454 49 48 GLY HA2 H 3.793 . 2 455 49 48 GLY HA3 H 3.747 . 2 456 49 48 GLY CA C 43.840 . 1 457 49 48 GLY N N 108.250 . 1 458 50 49 LEU H H 7.742 . 1 459 50 49 LEU HA H 4.114 . 1 460 50 49 LEU HB2 H 1.699 . 2 461 50 49 LEU HB3 H 1.454 . 2 462 50 49 LEU HG H 1.730 . 1 463 50 49 LEU HD1 H 0.927 . 2 464 50 49 LEU HD2 H 0.888 . 2 465 50 49 LEU CA C 54.609 . 1 466 50 49 LEU CB C 38.873 . 1 467 50 49 LEU CG C 25.135 . 1 468 50 49 LEU CD1 C 23.068 . 2 469 50 49 LEU CD2 C 19.745 . 2 470 50 49 LEU N N 121.688 . 1 471 51 50 LEU H H 7.389 . 1 472 51 50 LEU HA H 4.203 . 1 473 51 50 LEU HB2 H 1.362 . 2 474 51 50 LEU HB3 H 1.761 . 2 475 51 50 LEU HG H 1.602 . 1 476 51 50 LEU HD1 H 0.812 . 2 477 51 50 LEU HD2 H 0.784 . 2 478 51 50 LEU CA C 53.817 . 1 479 51 50 LEU CB C 39.800 . 1 480 51 50 LEU CG C 24.391 . 1 481 51 50 LEU CD1 C 20.398 . 2 482 51 50 LEU CD2 C 23.110 . 2 483 51 50 LEU N N 112.000 . 1 484 52 51 GLU H H 7.477 . 1 485 52 51 GLU HA H 4.032 . 1 486 52 51 GLU HB2 H 2.110 . 2 487 52 51 GLU HB3 H 2.153 . 2 488 52 51 GLU HG2 H 2.249 . 2 489 52 51 GLU HG3 H 2.292 . 2 490 52 51 GLU CA C 55.694 . 1 491 52 51 GLU CB C 28.368 . 1 492 52 51 GLU CG C 34.452 . 1 493 52 51 GLU N N 114.500 . 1 494 53 52 THR H H 7.212 . 1 495 53 52 THR HA H 4.379 . 1 496 53 52 THR HB H 4.521 . 1 497 53 52 THR HG2 H 1.063 . 1 498 53 52 THR CA C 55.616 . 1 499 53 52 THR CB C 70.532 . 1 500 53 52 THR CG2 C 18.792 . 1 501 53 52 THR N N 122.938 . 1 502 54 53 SER H H 9.290 . 1 503 54 53 SER HA H 4.020 . 1 504 54 53 SER HB2 H 3.729 . 2 505 54 53 SER CA C 59.967 . 1 506 54 53 SER CB C 59.872 . 1 507 54 53 SER N N 119.188 . 1 508 55 54 GLU H H 8.952 . 1 509 55 54 GLU HA H 4.046 . 1 510 55 54 GLU HB2 H 1.991 . 2 511 55 54 GLU HB3 H 1.977 . 2 512 55 54 GLU HG2 H 2.340 . 2 513 55 54 GLU HG3 H 2.284 . 2 514 55 54 GLU CA C 56.985 . 1 515 55 54 GLU CB C 26.309 . 1 516 55 54 GLU CG C 33.393 . 1 517 55 54 GLU N N 121.193 . 1 518 56 55 GLY H H 8.494 . 1 519 56 55 GLY HA2 H 4.605 . 2 520 56 55 GLY HA3 H 3.758 . 2 521 56 55 GLY CA C 45.176 . 1 522 56 55 GLY N N 110.750 . 1 523 57 56 CYS H H 8.111 . 1 524 57 56 CYS HA H 4.001 . 1 525 57 56 CYS HB2 H 2.476 . 2 526 57 56 CYS HB3 H 3.455 . 2 527 57 56 CYS CA C 61.912 . 1 528 57 56 CYS CB C 45.105 . 1 529 57 56 CYS N N 118.562 . 1 530 58 57 ARG H H 8.465 . 1 531 58 57 ARG HA H 3.527 . 1 532 58 57 ARG HB2 H 1.942 . 2 533 58 57 ARG HB3 H 1.966 . 2 534 58 57 ARG HG2 H 1.477 . 2 535 58 57 ARG HD2 H 3.072 . 2 536 58 57 ARG CA C 57.017 . 1 537 58 57 ARG CB C 26.759 . 1 538 58 57 ARG CG C 25.059 . 1 539 58 57 ARG CD C 40.557 . 1 540 58 57 ARG N N 119.500 . 1 541 59 58 GLN H H 7.993 . 1 542 59 58 GLN HA H 4.029 . 1 543 59 58 GLN HB2 H 2.326 . 2 544 59 58 GLN HG2 H 2.404 . 2 545 59 58 GLN HG3 H 2.459 . 2 546 59 58 GLN CA C 56.710 . 1 547 59 58 GLN CB C 25.544 . 1 548 59 58 GLN CG C 31.145 . 1 549 59 58 GLN N N 119.812 . 1 550 60 59 ILE H H 8.140 . 1 551 60 59 ILE HA H 3.526 . 1 552 60 59 ILE HB H 1.889 . 1 553 60 59 ILE HG12 H 1.762 . 9 554 60 59 ILE HG2 H 0.812 . 1 555 60 59 ILE HD1 H 0.696 . 1 556 60 59 ILE CA C 63.205 . 1 557 60 59 ILE CB C 35.118 . 1 558 60 59 ILE CG1 C 26.206 . 2 559 60 59 ILE CG2 C 16.107 . 2 560 60 59 ILE CD1 C 12.064 . 1 561 60 59 ILE N N 120.750 . 1 562 61 60 LEU H H 8.347 . 1 563 61 60 LEU HA H 3.872 . 1 564 61 60 LEU HB2 H 1.729 . 2 565 61 60 LEU HB3 H 1.247 . 2 566 61 60 LEU HG H 1.640 . 1 567 61 60 LEU HD1 H 0.350 . 2 568 61 60 LEU HD2 H -0.016 . 2 569 61 60 LEU CA C 56.222 . 1 570 61 60 LEU CB C 38.089 . 1 571 61 60 LEU CG C 23.275 . 1 572 61 60 LEU CD1 C 22.718 . 2 573 61 60 LEU CD2 C 19.601 . 2 574 61 60 LEU N N 118.875 . 1 575 62 61 GLY H H 7.860 . 1 576 62 61 GLY HA2 H 3.927 . 2 577 62 61 GLY HA3 H 3.995 . 2 578 62 61 GLY CA C 44.494 . 1 579 62 61 GLY N N 104.292 . 1 580 63 62 GLN H H 7.772 . 1 581 63 62 GLN HA H 4.150 . 1 582 63 62 GLN HB2 H 2.171 . 2 583 63 62 GLN HB3 H 2.143 . 2 584 63 62 GLN HG2 H 2.422 . 2 585 63 62 GLN HG3 H 2.363 . 2 586 63 62 GLN CA C 55.570 . 1 587 63 62 GLN CB C 26.324 . 1 588 63 62 GLN CG C 31.485 . 1 589 63 62 GLN N N 119.812 . 1 590 64 63 LEU H H 8.229 . 1 591 64 63 LEU HA H 4.208 . 1 592 64 63 LEU HB2 H 1.996 . 2 593 64 63 LEU HG H 1.879 . 1 594 64 63 LEU HD1 H 0.694 . 2 595 64 63 LEU HD2 H 0.562 . 2 596 64 63 LEU CA C 53.423 . 1 597 64 63 LEU CB C 41.399 . 1 598 64 63 LEU CG C 23.905 . 1 599 64 63 LEU CD1 C 23.255 . 2 600 64 63 LEU CD2 C 18.834 . 2 601 64 63 LEU N N 117.000 . 1 602 65 64 GLN H H 8.081 . 1 603 65 64 GLN HA H 3.756 . 1 604 65 64 GLN HB2 H 2.471 . 2 605 65 64 GLN HG2 H 2.354 . 2 606 65 64 GLN CA C 58.857 . 1 607 65 64 GLN CB C 23.266 . 1 608 65 64 GLN CG C 31.387 . 1 609 65 64 GLN N N 118.875 . 1 610 66 65 PRO HA H 4.360 . 1 611 66 65 PRO HB2 H 2.356 . 2 612 66 65 PRO HB3 H 1.811 . 2 613 66 65 PRO HG2 H 2.019 . 2 614 66 65 PRO HG3 H 2.020 . 2 615 66 65 PRO HD2 H 3.745 . 2 616 66 65 PRO HD3 H 3.544 . 2 617 66 65 PRO CA C 63.227 . 1 618 66 65 PRO CB C 28.409 . 1 619 66 65 PRO CG C 25.547 . 1 620 66 65 PRO CD C 48.192 . 1 621 67 66 SER H H 7.801 . 1 622 67 66 SER HA H 4.470 . 1 623 67 66 SER HB2 H 3.910 . 2 624 67 66 SER CA C 57.006 . 1 625 67 66 SER CB C 61.341 . 1 626 67 66 SER N N 111.375 . 1 627 68 67 LEU H H 7.624 . 1 628 68 67 LEU HA H 3.793 . 1 629 68 67 LEU HB2 H 1.572 . 2 630 68 67 LEU HB3 H 1.337 . 2 631 68 67 LEU HG H 1.404 . 1 632 68 67 LEU HD1 H 0.103 . 2 633 68 67 LEU HD2 H 0.333 . 2 634 68 67 LEU CA C 55.203 . 1 635 68 67 LEU CB C 38.977 . 1 636 68 67 LEU CG C 23.334 . 1 637 68 67 LEU CD1 C 21.394 . 2 638 68 67 LEU CD2 C 19.530 . 2 639 68 67 LEU N N 121.062 . 1 640 69 68 GLN H H 8.037 . 1 641 69 68 GLN HA H 4.046 . 1 642 69 68 GLN HB2 H 2.109 . 2 643 69 68 GLN HG2 H 2.375 . 2 644 69 68 GLN CA C 55.780 . 1 645 69 68 GLN CB C 25.738 . 1 646 69 68 GLN CG C 31.081 . 1 647 69 68 GLN N N 116.375 . 1 648 70 69 THR H H 7.492 . 1 649 70 69 THR HA H 4.450 . 1 650 70 69 THR HB H 4.496 . 1 651 70 69 THR HG2 H 1.169 . 1 652 70 69 THR CA C 58.846 . 1 653 70 69 THR CB C 66.871 . 1 654 70 69 THR CG2 C 18.883 . 1 655 70 69 THR N N 106.688 . 1 656 71 70 GLY H H 7.669 . 1 657 71 70 GLY HA2 H 4.188 . 2 658 71 70 GLY HA3 H 3.886 . 2 659 71 70 GLY CA C 42.863 . 1 660 71 70 GLY N N 109.500 . 1 661 72 71 SER H H 8.022 . 1 662 72 71 SER HA H 4.596 . 1 663 72 71 SER HB2 H 4.364 . 2 664 72 71 SER HB3 H 4.004 . 2 665 72 71 SER CA C 54.545 . 1 666 72 71 SER CB C 61.909 . 1 667 72 71 SER N N 114.500 . 1 668 73 72 GLU H H 9.069 . 1 669 73 72 GLU HA H 4.064 . 1 670 73 72 GLU HB2 H 2.091 . 2 671 73 72 GLU HB3 H 2.014 . 2 672 73 72 GLU HG2 H 2.359 . 2 673 73 72 GLU CA C 56.690 . 1 674 73 72 GLU CB C 26.612 . 1 675 73 72 GLU CG C 33.373 . 1 676 73 72 GLU N N 124.188 . 1 677 74 73 GLU H H 8.642 . 1 678 74 73 GLU HA H 4.235 . 1 679 74 73 GLU HB2 H 2.205 . 2 680 74 73 GLU HB3 H 2.105 . 2 681 74 73 GLU HG2 H 2.481 . 2 682 74 73 GLU HG3 H 2.383 . 2 683 74 73 GLU CA C 57.616 . 1 684 74 73 GLU CB C 26.772 . 1 685 74 73 GLU CG C 33.933 . 1 686 74 73 GLU N N 120.125 . 1 687 75 74 LEU H H 7.742 . 1 688 75 74 LEU HA H 4.113 . 1 689 75 74 LEU HB2 H 1.792 . 2 690 75 74 LEU HB3 H 1.672 . 2 691 75 74 LEU HG H 1.672 . 1 692 75 74 LEU HD1 H 0.812 . 2 693 75 74 LEU HD2 H 0.839 . 2 694 75 74 LEU CA C 55.450 . 1 695 75 74 LEU CB C 38.611 . 1 696 75 74 LEU CG C 25.136 . 1 697 75 74 LEU CD1 C 21.921 . 2 698 75 74 LEU CD2 C 22.443 . 2 699 75 74 LEU N N 121.375 . 1 700 76 75 ARG H H 7.845 . 1 701 76 75 ARG HA H 3.910 . 1 702 76 75 ARG HB2 H 1.999 . 2 703 76 75 ARG HG2 H 1.649 . 2 704 76 75 ARG HD2 H 3.223 . 2 705 76 75 ARG CA C 56.992 . 1 706 76 75 ARG CB C 26.507 . 1 707 76 75 ARG CG C 24.681 . 1 708 76 75 ARG CD C 40.361 . 1 709 76 75 ARG N N 119.188 . 1 710 77 76 SER H H 8.553 . 1 711 77 76 SER HA H 4.240 . 1 712 77 76 SER HB2 H 4.194 . 2 713 77 76 SER CA C 59.978 . 1 714 77 76 SER CB C 60.159 . 1 715 77 76 SER N N 114.188 . 1 716 78 77 LEU H H 8.435 . 1 717 78 77 LEU HA H 4.398 . 1 718 78 77 LEU HB2 H 2.344 . 2 719 78 77 LEU HB3 H 1.742 . 2 720 78 77 LEU HG H 1.480 . 1 721 78 77 LEU HD1 H 0.810 . 2 722 78 77 LEU HD2 H 0.805 . 2 723 78 77 LEU CA C 56.436 . 1 724 78 77 LEU CB C 39.508 . 1 725 78 77 LEU CG C 24.378 . 1 726 78 77 LEU CD1 C 21.855 . 2 727 78 77 LEU CD2 C 23.162 . 2 728 78 77 LEU N N 125.750 . 1 729 79 78 TYR H H 8.671 . 1 730 79 78 TYR HA H 3.638 . 1 731 79 78 TYR HB2 H 3.288 . 2 732 79 78 TYR HB3 H 2.747 . 2 733 79 78 TYR HD1 H 7.680 . 2 734 79 78 TYR HD2 H 7.026 . 2 735 79 78 TYR HE1 H 6.824 . 2 736 79 78 TYR HE2 H 6.835 . 2 737 79 78 TYR CA C 60.112 . 1 738 79 78 TYR CB C 37.002 . 1 739 79 78 TYR CD1 C 130.756 . 2 740 79 78 TYR CD2 C 130.879 . 2 741 79 78 TYR CE1 C 115.820 . 2 742 79 78 TYR CE2 C 115.916 . 2 743 79 78 TYR N N 119.812 . 1 744 80 79 ASN H H 8.848 . 1 745 80 79 ASN HA H 4.261 . 1 746 80 79 ASN HB2 H 3.188 . 2 747 80 79 ASN HB3 H 2.705 . 2 748 80 79 ASN HD21 H 7.462 . 2 749 80 79 ASN HD22 H 6.386 . 2 750 80 79 ASN CA C 53.097 . 1 751 80 79 ASN CB C 35.149 . 1 752 80 79 ASN N N 117.000 . 1 753 80 79 ASN ND2 N 104.500 . 1 754 81 80 THR H H 8.096 . 1 755 81 80 THR HA H 3.922 . 1 756 81 80 THR HB H 4.702 . 1 757 81 80 THR HG2 H 1.529 . 1 758 81 80 THR CA C 65.165 . 1 759 81 80 THR CB C 66.450 . 1 760 81 80 THR CG2 C 18.335 . 1 761 81 80 THR N N 115.750 . 1 762 82 81 ILE H H 8.067 . 1 763 82 81 ILE HA H 3.645 . 1 764 82 81 ILE HB H 1.819 . 1 765 82 81 ILE HG12 H 1.176 . 9 766 82 81 ILE HG13 H 1.769 . 9 767 82 81 ILE HG2 H 0.814 . 1 768 82 81 ILE HD1 H 0.737 . 1 769 82 81 ILE CA C 61.388 . 1 770 82 81 ILE CB C 33.796 . 1 771 82 81 ILE CG1 C 26.204 . 2 772 82 81 ILE CG2 C 15.513 . 2 773 82 81 ILE CD1 C 11.349 . 1 774 82 81 ILE N N 121.062 . 1 775 83 82 ALA H H 8.759 . 1 776 83 82 ALA HA H 3.868 . 1 777 83 82 ALA HB H 1.302 . 1 778 83 82 ALA CA C 53.165 . 1 779 83 82 ALA CB C 15.138 . 1 780 83 82 ALA N N 125.125 . 1 781 84 83 VAL H H 7.772 . 1 782 84 83 VAL HA H 3.305 . 1 783 84 83 VAL HB H 1.923 . 1 784 84 83 VAL HG1 H 0.352 . 2 785 84 83 VAL HG2 H 0.937 . 2 786 84 83 VAL CA C 64.621 . 1 787 84 83 VAL CB C 28.143 . 1 788 84 83 VAL CG1 C 22.028 . 2 789 84 83 VAL CG2 C 20.762 . 2 790 84 83 VAL N N 117.625 . 1 791 85 84 LEU H H 8.140 . 1 792 85 84 LEU HA H 3.792 . 1 793 85 84 LEU HB2 H 1.897 . 2 794 85 84 LEU HB3 H 1.730 . 2 795 85 84 LEU HG H 1.370 . 1 796 85 84 LEU HD1 H 0.476 . 2 797 85 84 LEU HD2 H 0.134 . 2 798 85 84 LEU CA C 55.746 . 1 799 85 84 LEU CB C 39.545 . 1 800 85 84 LEU CG C 23.838 . 1 801 85 84 LEU CD1 C 23.271 . 2 802 85 84 LEU CD2 C 21.121 . 2 803 85 84 LEU N N 122.000 . 1 804 86 85 TYR H H 9.039 . 1 805 86 85 TYR HA H 3.889 . 1 806 86 85 TYR HB2 H 3.425 . 2 807 86 85 TYR HB3 H 2.838 . 2 808 86 85 TYR HD1 H 7.191 . 2 809 86 85 TYR HD2 H 7.181 . 2 810 86 85 TYR HE1 H 6.653 . 2 811 86 85 TYR HE2 H 6.597 . 2 812 86 85 TYR CA C 60.128 . 1 813 86 85 TYR CB C 35.597 . 1 814 86 85 TYR CD1 C 130.738 . 2 815 86 85 TYR CD2 C 130.720 . 2 816 86 85 TYR CE1 C 115.486 . 2 817 86 85 TYR CE2 C 115.541 . 2 818 86 85 TYR N N 118.875 . 1 819 87 86 CYS H H 7.492 . 1 820 87 86 CYS HA H 3.771 . 1 821 87 86 CYS HB2 H 3.301 . 2 822 87 86 CYS HB3 H 2.845 . 2 823 87 86 CYS CA C 63.276 . 1 824 87 86 CYS CB C 43.867 . 1 825 87 86 CYS N N 116.062 . 1 826 88 87 VAL H H 8.406 . 1 827 88 87 VAL HA H 3.855 . 1 828 88 87 VAL HB H 2.093 . 1 829 88 87 VAL HG1 H 0.937 . 2 830 88 87 VAL HG2 H 1.116 . 2 831 88 87 VAL CA C 63.731 . 1 832 88 87 VAL CB C 28.897 . 1 833 88 87 VAL CG1 C 18.966 . 2 834 88 87 VAL CG2 C 21.395 . 2 835 88 87 VAL N N 119.938 . 1 836 89 88 HIS H H 8.774 . 1 837 89 88 HIS HA H 4.852 . 1 838 89 88 HIS HB2 H 3.217 . 2 839 89 88 HIS HD2 H 6.868 . 2 840 89 88 HIS HE1 H 8.923 . 2 841 89 88 HIS CA C 54.430 . 1 842 89 88 HIS CB C 26.393 . 1 843 89 88 HIS CD2 C 115.765 . 2 844 89 88 HIS N N 118.875 . 1 845 90 89 GLN H H 7.963 . 1 846 90 89 GLN HA H 4.362 . 1 847 90 89 GLN HB2 H 1.878 . 2 848 90 89 GLN HB3 H 1.644 . 2 849 90 89 GLN HG2 H 1.794 . 2 850 90 89 GLN CA C 52.599 . 1 851 90 89 GLN CB C 28.262 . 1 852 90 89 GLN CG C 30.708 . 1 853 90 89 GLN N N 116.688 . 1 854 91 90 ARG H H 7.860 . 1 855 91 90 ARG HA H 3.990 . 1 856 91 90 ARG HB2 H 2.106 . 2 857 91 90 ARG HB3 H 1.897 . 2 858 91 90 ARG HG2 H 1.539 . 2 859 91 90 ARG HD2 H 3.178 . 2 860 91 90 ARG CA C 54.493 . 1 861 91 90 ARG CB C 23.359 . 1 862 91 90 ARG CG C 24.991 . 1 863 91 90 ARG CD C 40.745 . 1 864 91 90 ARG N N 115.125 . 1 865 92 91 ILE H H 8.312 . 1 866 92 91 ILE HA H 3.962 . 1 867 92 91 ILE HB H 1.521 . 1 868 92 91 ILE HG12 H 1.480 . 9 869 92 91 ILE HG13 H 0.938 . 9 870 92 91 ILE HG2 H 0.823 . 1 871 92 91 ILE HD1 H 0.823 . 1 872 92 91 ILE CA C 58.169 . 1 873 92 91 ILE CB C 36.419 . 1 874 92 91 ILE CG1 C 24.496 . 2 875 92 91 ILE CG2 C 15.098 . 2 876 92 91 ILE CD1 C 10.892 . 1 877 92 91 ILE N N 120.047 . 1 878 93 92 ASP H H 8.597 . 1 879 93 92 ASP HA H 4.462 . 1 880 93 92 ASP HB2 H 2.630 . 2 881 93 92 ASP HB3 H 2.512 . 2 882 93 92 ASP CA C 52.353 . 1 883 93 92 ASP CB C 37.706 . 1 884 93 92 ASP N N 129.188 . 1 885 94 93 VAL H H 7.728 . 1 886 94 93 VAL HA H 4.610 . 1 887 94 93 VAL HB H 2.124 . 1 888 94 93 VAL HG1 H 0.819 . 2 889 94 93 VAL HG2 H 0.893 . 2 890 94 93 VAL CA C 56.430 . 1 891 94 93 VAL CB C 32.822 . 1 892 94 93 VAL CG1 C 25.194 . 2 893 94 93 VAL CG2 C 20.726 . 2 894 94 93 VAL N N 115.750 . 1 895 95 94 LYS H H 9.216 . 1 896 95 94 LYS HA H 4.370 . 1 897 95 94 LYS HB2 H 1.811 . 2 898 95 94 LYS HB3 H 1.765 . 2 899 95 94 LYS HG2 H 1.535 . 2 900 95 94 LYS HD2 H 2.105 . 2 901 95 94 LYS HE2 H 2.966 . 2 902 95 94 LYS CA C 53.981 . 1 903 95 94 LYS CB C 31.318 . 1 904 95 94 LYS CG C 21.896 . 1 905 95 94 LYS CD C 27.607 . 1 906 95 94 LYS CE C 39.355 . 1 907 95 94 LYS N N 118.875 . 1 908 96 95 ASP H H 7.389 . 1 909 96 95 ASP HA H 5.539 . 1 910 96 95 ASP HB2 H 2.586 . 2 911 96 95 ASP HB3 H 2.066 . 2 912 96 95 ASP CA C 50.139 . 1 913 96 95 ASP CB C 41.914 . 1 914 96 95 ASP N N 112.000 . 1 915 97 96 THR H H 7.227 . 1 916 97 96 THR HA H 3.638 . 1 917 97 96 THR HB H 4.000 . 1 918 97 96 THR HG2 H 1.291 . 1 919 97 96 THR CA C 63.257 . 1 920 97 96 THR CB C 67.595 . 1 921 97 96 THR CG2 C 20.081 . 1 922 97 96 THR N N 109.500 . 1 923 98 97 LYS H H 7.845 . 1 924 98 97 LYS HA H 3.922 . 1 925 98 97 LYS HB2 H 2.089 . 2 926 98 97 LYS HB3 H 1.758 . 2 927 98 97 LYS HG2 H 1.421 . 2 928 98 97 LYS HD2 H 2.003 . 2 929 98 97 LYS HE2 H 3.206 . 2 930 98 97 LYS CA C 56.938 . 1 931 98 97 LYS CB C 29.237 . 1 932 98 97 LYS CG C 22.300 . 1 933 98 97 LYS CD C 25.264 . 1 934 98 97 LYS CE C 40.386 . 1 935 98 97 LYS N N 121.062 . 1 936 99 98 GLU H H 8.361 . 1 937 99 98 GLU HA H 4.054 . 1 938 99 98 GLU HB2 H 2.106 . 2 939 99 98 GLU HG2 H 2.524 . 2 940 99 98 GLU HG3 H 2.230 . 2 941 99 98 GLU CA C 57.105 . 1 942 99 98 GLU CB C 27.556 . 1 943 99 98 GLU CG C 34.508 . 1 944 99 98 GLU N N 119.188 . 1 945 100 99 ALA H H 7.359 . 1 946 100 99 ALA HA H 4.363 . 1 947 100 99 ALA HB H 1.496 . 1 948 100 99 ALA CA C 52.706 . 1 949 100 99 ALA CB C 17.069 . 1 950 100 99 ALA N N 118.875 . 1 951 101 100 LEU H H 8.096 . 1 952 101 100 LEU HA H 3.997 . 1 953 101 100 LEU HB2 H 2.067 . 2 954 101 100 LEU HB3 H 1.544 . 2 955 101 100 LEU HG H 1.864 . 1 956 101 100 LEU HD1 H 0.917 . 2 957 101 100 LEU HD2 H 1.040 . 2 958 101 100 LEU CA C 55.285 . 1 959 101 100 LEU CB C 38.803 . 1 960 101 100 LEU CG C 24.517 . 1 961 101 100 LEU CD1 C 22.921 . 2 962 101 100 LEU CD2 C 19.535 . 2 963 101 100 LEU N N 117.938 . 1 964 102 101 ASP H H 8.656 . 1 965 102 101 ASP HA H 4.344 . 1 966 102 101 ASP HB2 H 2.803 . 2 967 102 101 ASP HB3 H 2.683 . 2 968 102 101 ASP CA C 54.662 . 1 969 102 101 ASP CB C 37.032 . 1 970 102 101 ASP N N 120.438 . 1 971 103 102 LYS H H 8.184 . 1 972 103 102 LYS HA H 4.141 . 1 973 103 102 LYS HB2 H 2.240 . 2 974 103 102 LYS HB3 H 1.871 . 2 975 103 102 LYS HG2 H 1.749 . 2 976 103 102 LYS HD2 H 1.737 . 2 977 103 102 LYS CA C 55.674 . 1 978 103 102 LYS CB C 28.842 . 1 979 103 102 LYS CG C 21.935 . 1 980 103 102 LYS CD C 25.260 . 1 981 103 102 LYS N N 120.125 . 1 982 104 103 ILE H H 8.140 . 1 983 104 103 ILE HA H 3.787 . 1 984 104 103 ILE HB H 1.964 . 1 985 104 103 ILE HG12 H 1.541 . 9 986 104 103 ILE HG13 H 1.339 . 9 987 104 103 ILE HG2 H 0.817 . 1 988 104 103 ILE HD1 H 0.696 . 1 989 104 103 ILE CA C 61.918 . 1 990 104 103 ILE CB C 34.744 . 1 991 104 103 ILE CG1 C 25.855 . 2 992 104 103 ILE CG2 C 15.170 . 2 993 104 103 ILE CD1 C 11.502 . 1 994 104 103 ILE N N 119.812 . 1 995 105 104 GLU H H 7.978 . 1 996 105 104 GLU HA H 4.012 . 1 997 105 104 GLU HB2 H 1.785 . 2 998 105 104 GLU HG2 H 2.343 . 2 999 105 104 GLU CA C 56.944 . 1 1000 105 104 GLU CB C 30.066 . 1 1001 105 104 GLU CG C 33.392 . 1 1002 105 104 GLU N N 121.375 . 1 1003 106 105 GLU H H 8.008 . 1 1004 106 105 GLU HA H 4.067 . 1 1005 106 105 GLU HB2 H 2.168 . 2 1006 106 105 GLU HG2 H 2.358 . 2 1007 106 105 GLU CA C 56.577 . 1 1008 106 105 GLU CB C 26.907 . 1 1009 106 105 GLU CG C 33.594 . 1 1010 106 105 GLU N N 119.188 . 1 1011 107 106 GLU H H 7.993 . 1 1012 107 106 GLU HA H 4.050 . 1 1013 107 106 GLU HB2 H 2.207 . 2 1014 107 106 GLU HB3 H 2.162 . 2 1015 107 106 GLU HG2 H 2.387 . 2 1016 107 106 GLU HG3 H 2.265 . 2 1017 107 106 GLU CA C 56.651 . 1 1018 107 106 GLU CB C 27.180 . 1 1019 107 106 GLU CG C 33.745 . 1 1020 107 106 GLU N N 118.875 . 1 1021 108 107 GLN H H 8.229 . 1 1022 108 107 GLN HA H 4.124 . 1 1023 108 107 GLN HB2 H 2.136 . 2 1024 108 107 GLN HG2 H 2.493 . 2 1025 108 107 GLN CA C 55.717 . 1 1026 108 107 GLN CB C 26.155 . 1 1027 108 107 GLN CG C 31.395 . 1 1028 108 107 GLN N N 118.250 . 1 1029 109 108 ASN H H 8.229 . 1 1030 109 108 ASN HA H 4.594 . 1 1031 109 108 ASN HB2 H 2.857 . 2 1032 109 108 ASN CA C 52.192 . 1 1033 109 108 ASN CB C 35.835 . 1 1034 109 108 ASN N N 118.250 . 1 1035 110 109 LYS H H 8.008 . 1 1036 110 109 LYS HA H 4.207 . 1 1037 110 109 LYS HB2 H 1.860 . 2 1038 110 109 LYS HG2 H 1.503 . 2 1039 110 109 LYS HD2 H 1.666 . 2 1040 110 109 LYS HE2 H 2.984 . 2 1041 110 109 LYS CA C 55.621 . 1 1042 110 109 LYS CB C 30.001 . 1 1043 110 109 LYS CG C 21.868 . 1 1044 110 109 LYS CD C 26.446 . 1 1045 110 109 LYS CE C 39.385 . 1 1046 110 109 LYS N N 120.438 . 1 1047 111 110 SER H H 8.008 . 1 1048 111 110 SER HA H 4.345 . 1 1049 111 110 SER HB2 H 3.909 . 2 1050 111 110 SER CA C 57.074 . 1 1051 111 110 SER CB C 60.752 . 1 1052 111 110 SER N N 114.500 . 1 1053 112 111 LYS H H 7.934 . 1 1054 112 111 LYS HA H 4.222 . 1 1055 112 111 LYS HB2 H 1.843 . 2 1056 112 111 LYS HG2 H 1.539 . 2 1057 112 111 LYS HG3 H 1.407 . 2 1058 112 111 LYS HD2 H 1.640 . 2 1059 112 111 LYS CA C 54.639 . 1 1060 112 111 LYS CB C 30.085 . 1 1061 112 111 LYS CG C 21.964 . 1 1062 112 111 LYS CD C 26.447 . 1 1063 112 111 LYS N N 122.000 . 1 1064 113 112 LYS H H 7.993 . 1 1065 113 112 LYS HA H 4.127 . 1 1066 113 112 LYS HB2 H 1.812 . 2 1067 113 112 LYS HG2 H 1.481 . 2 1068 113 112 LYS HD2 H 1.658 . 2 1069 113 112 LYS CA C 56.444 . 1 1070 113 112 LYS CB C 30.076 . 1 1071 113 112 LYS CG C 21.903 . 1 1072 113 112 LYS CD C 26.363 . 1 1073 113 112 LYS N N 120.750 . 1 1074 114 113 LYS H H 8.096 . 1 1075 114 113 LYS HA H 4.240 . 1 1076 114 113 LYS HB2 H 1.807 . 2 1077 114 113 LYS HG2 H 1.407 . 2 1078 114 113 LYS HD2 H 1.653 . 2 1079 114 113 LYS CA C 54.495 . 1 1080 114 113 LYS CB C 30.167 . 1 1081 114 113 LYS CG C 21.931 . 1 1082 114 113 LYS CD C 26.392 . 1 1083 114 113 LYS N N 121.688 . 1 1084 115 114 ALA H H 8.155 . 1 1085 115 114 ALA HA H 4.245 . 1 1086 115 114 ALA HB H 1.403 . 1 1087 115 114 ALA CA C 50.345 . 1 1088 115 114 ALA CB C 16.348 . 1 1089 115 114 ALA N N 124.188 . 1 1090 116 115 GLN H H 8.214 . 1 1091 116 115 GLN HA H 4.225 . 1 1092 116 115 GLN HB2 H 2.052 . 2 1093 116 115 GLN HG2 H 2.396 . 2 1094 116 115 GLN CA C 53.859 . 1 1095 116 115 GLN CG C 31.346 . 1 1096 116 115 GLN N N 119.188 . 1 1097 117 116 GLN H H 8.243 . 1 1098 117 116 GLN HA H 4.246 . 1 1099 117 116 GLN HB2 H 1.995 . 2 1100 117 116 GLN HG2 H 2.360 . 2 1101 117 116 GLN CA C 53.634 . 1 1102 117 116 GLN CB C 26.916 . 1 1103 117 116 GLN CG C 31.286 . 1 1104 117 116 GLN N N 120.438 . 1 1105 118 117 ALA H H 8.243 . 1 1106 118 117 ALA HA H 4.253 . 1 1107 118 117 ALA HB H 1.392 . 1 1108 118 117 ALA CA C 50.147 . 1 1109 118 117 ALA CB C 16.372 . 1 1110 118 117 ALA N N 124.812 . 1 1111 119 118 ALA H H 8.140 . 1 1112 119 118 ALA HA H 4.271 . 1 1113 119 118 ALA HB H 1.381 . 1 1114 119 118 ALA CA C 49.947 . 1 1115 119 118 ALA CB C 16.511 . 1 1116 119 118 ALA N N 122.938 . 1 1117 120 119 ALA H H 8.140 . 1 1118 120 119 ALA HA H 4.254 . 1 1119 120 119 ALA HB H 1.370 . 1 1120 120 119 ALA CA C 50.046 . 1 1121 120 119 ALA CB C 16.477 . 1 1122 120 119 ALA N N 122.625 . 1 1123 121 120 ASP H H 8.229 . 1 1124 121 120 ASP HA H 4.659 . 1 1125 121 120 ASP HB2 H 2.695 . 2 1126 121 120 ASP CA C 51.574 . 1 1127 121 120 ASP CB C 38.438 . 1 1128 121 120 ASP N N 119.188 . 1 1129 122 121 THR H H 8.052 . 1 1130 122 121 THR HA H 4.335 . 1 1131 122 121 THR HB H 4.326 . 1 1132 122 121 THR HG2 H 1.171 . 1 1133 122 121 THR CA C 59.455 . 1 1134 122 121 THR CB C 66.959 . 1 1135 122 121 THR CG2 C 18.929 . 1 1136 122 121 THR N N 113.562 . 1 1137 123 122 GLY H H 8.391 . 1 1138 123 122 GLY HA2 H 3.911 . 2 1139 123 122 GLY HA3 H 3.953 . 2 1140 123 122 GLY CA C 42.913 . 1 1141 123 122 GLY N N 110.438 . 1 1142 124 123 ASN H H 8.243 . 1 1143 124 123 ASN HA H 4.585 . 1 1144 124 123 ASN HB2 H 2.817 . 2 1145 124 123 ASN CA C 52.043 . 1 1146 124 123 ASN CB C 35.848 . 1 1147 124 123 ASN N N 118.562 . 1 1148 125 124 ASN H H 8.420 . 1 1149 125 124 ASN HA H 4.701 . 1 1150 125 124 ASN HB2 H 2.775 . 2 1151 125 124 ASN CA C 50.763 . 1 1152 125 124 ASN CB C 36.123 . 1 1153 125 124 ASN N N 119.188 . 1 1154 126 125 SER H H 8.243 . 1 1155 126 125 SER HA H 4.365 . 1 1156 126 125 SER HB2 H 3.864 . 2 1157 126 125 SER CA C 56.161 . 1 1158 126 125 SER CB C 61.236 . 1 1159 126 125 SER N N 115.750 . 1 1160 127 126 GLN H H 8.332 . 1 1161 127 126 GLN HA H 4.300 . 1 1162 127 126 GLN HB2 H 1.941 . 2 1163 127 126 GLN HG2 H 2.323 . 2 1164 127 126 GLN HG3 H 2.275 . 2 1165 127 126 GLN CA C 53.533 . 1 1166 127 126 GLN CB C 26.478 . 1 1167 127 126 GLN CG C 31.084 . 1 1168 127 126 GLN N N 121.688 . 1 1169 128 127 VAL H H 7.963 . 1 1170 128 127 VAL HA H 4.086 . 1 1171 128 127 VAL HB H 2.000 . 1 1172 128 127 VAL HG1 H 0.906 . 2 1173 128 127 VAL HG2 H 0.877 . 2 1174 128 127 VAL CA C 59.975 . 1 1175 128 127 VAL CB C 30.079 . 1 1176 128 127 VAL CG1 C 16.506 . 2 1177 128 127 VAL CG2 C 17.911 . 2 1178 128 127 VAL N N 119.812 . 1 1179 129 128 SER H H 8.229 . 1 1180 129 128 SER HA H 4.113 . 1 1181 129 128 SER HB2 H 3.816 . 2 1182 129 128 SER CA C 55.714 . 1 1183 129 128 SER CB C 61.065 . 1 1184 129 128 SER N N 117.938 . 1 1185 130 129 GLN H H 8.332 . 1 1186 130 129 GLN HA H 4.332 . 1 1187 130 129 GLN HB2 H 1.972 . 2 1188 130 129 GLN HG2 H 2.310 . 2 1189 130 129 GLN CA C 53.460 . 1 1190 130 129 GLN CB C 26.683 . 1 1191 130 129 GLN CG C 31.344 . 1 1192 130 129 GLN N N 121.688 . 1 1193 131 130 ASN H H 8.229 . 1 1194 131 130 ASN HA H 4.609 . 1 1195 131 130 ASN CA C 50.878 . 1 1196 131 130 ASN N N 118.250 . 1 1197 132 131 TYR H H 7.934 . 1 1198 132 131 TYR HA H 4.408 . 1 1199 132 131 TYR HB2 H 2.803 . 2 1200 132 131 TYR HE2 H 6.931 . 2 1201 132 131 TYR CA C 55.495 . 1 1202 132 131 TYR CB C 35.802 . 1 1203 132 131 TYR CE2 C 115.502 . 2 1204 132 131 TYR N N 120.125 . 1 stop_ save_