data_25264 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; ctNsa-2 1-84 ; _BMRB_accession_number 25264 _BMRB_flat_file_name bmr25264.str _Entry_type original _Submission_date 2014-10-02 _Accession_date 2014-10-02 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Residues 1-84 of the N-terminal domain of Nsa2, a ribosomal biogenesis factor.' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Clark Sarah . . 2 Barbar Elisar . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 89 "13C chemical shifts" 176 "15N chemical shifts" 89 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2014-12-19 original author . stop_ _Original_release_date 2014-12-19 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'ctNsa-2, 1-84' _Citation_status na _Citation_type 'BMRB only' _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Clark Sarah . . 2 Barbar Elisar . . stop_ _Journal_abbreviation . _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year . _Details . loop_ _Keyword 'Ribosomal Biogenesis' Nsa-2 stop_ save_ ####################################### # Cited references within the entry # ####################################### save_reference_citation _Saveframe_category citation _Citation_full . _Citation_title 'Structural insight into an essential assembly factor network on the pre- ribosome' _Citation_status submitted _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Babler Jochen . . 2 Paternoga Helge . . 3 Holdermann Iris . . 4 Thoms Matthias . . 5 Granneman Sander . . 6 Barrio-Garcia Clara . . 7 Nyarko Afua . . 8 stier Gunter . . 9 Clark Sarah A. . 10 Schraivogel Daniel . . 11 Kallas Martina . . 12 Beckmann Roland . . 13 Tollervey David . . 14 Barbar Elisar . . 15 Sinning Irmi . . 16 Hurt Ed . . stop_ _Journal_abbreviation 'Journal of Cell Biology' _Journal_name_full . _Journal_volume . _Journal_issue . _Journal_CSD . _Book_title . _Book_chapter_title . _Book_volume . _Book_series . _Book_publisher . _Book_publisher_city . _Book_ISBN . _Conference_title . _Conference_site . _Conference_state_province . _Conference_country . _Conference_start_date . _Conference_end_date . _Conference_abstract_number . _Thesis_institution . _Thesis_institution_city . _Thesis_institution_country . _Page_first . _Page_last . _Year . _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name '60S pre-ribosome' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label '60S Pre-ribosome' $Nsa2 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Nsa2 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Nsa2 _Molecular_mass . _Mol_thiol_state 'not present' loop_ _Biological_function 'Participates in the assembly of the 60S pre-ribosome' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 98 _Mol_residue_sequence ; DYDIPTTENLYFQGAHMPQN EYIERHRKLHGRRLDAEERA RKKAAREGHKNSENAQNLRG LRAKLYAKQRHAQKIQMRKA IKQHEERNVKGRPAEKEP ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -14 ASP 2 -13 TYR 3 -12 ASP 4 -11 ILE 5 -10 PRO 6 -9 THR 7 -8 THR 8 -7 GLU 9 -6 ASN 10 -5 LEU 11 -4 TYR 12 -3 PHE 13 -2 GLN 14 -1 GLY 15 1 ALA 16 2 HIS 17 3 MET 18 4 PRO 19 5 GLN 20 6 ASN 21 7 GLU 22 8 TYR 23 9 ILE 24 10 GLU 25 11 ARG 26 12 HIS 27 13 ARG 28 14 LYS 29 15 LEU 30 16 HIS 31 17 GLY 32 18 ARG 33 19 ARG 34 20 LEU 35 21 ASP 36 22 ALA 37 23 GLU 38 24 GLU 39 25 ARG 40 26 ALA 41 27 ARG 42 28 LYS 43 29 LYS 44 30 ALA 45 31 ALA 46 32 ARG 47 33 GLU 48 34 GLY 49 35 HIS 50 36 LYS 51 37 ASN 52 38 SER 53 39 GLU 54 40 ASN 55 41 ALA 56 42 GLN 57 43 ASN 58 44 LEU 59 45 ARG 60 46 GLY 61 47 LEU 62 48 ARG 63 49 ALA 64 50 LYS 65 51 LEU 66 52 TYR 67 53 ALA 68 54 LYS 69 55 GLN 70 56 ARG 71 57 HIS 72 58 ALA 73 59 GLN 74 60 LYS 75 61 ILE 76 62 GLN 77 63 MET 78 64 ARG 79 65 LYS 80 66 ALA 81 67 ILE 82 68 LYS 83 69 GLN 84 70 HIS 85 71 GLU 86 72 GLU 87 73 ARG 88 74 ASN 89 75 VAL 90 76 LYS 91 77 GLY 92 78 ARG 93 79 PRO 94 80 ALA 95 81 GLU 96 82 LYS 97 83 GLU 98 84 PRO stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2014-12-28 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 GB EGS23242 "hypothetical protein CTHT_0009080 [Chaetomium thermophilum var. thermophilum DSM 1495]" 83.67 261 100.00 100.00 1.04e-47 REF XP_006691433 "hypothetical protein CTHT_0009080 [Chaetomium thermophilum var. thermophilum DSM 1495]" 83.67 261 100.00 100.00 1.04e-47 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Nsa2 ascomycetes 209285 Eukaryota Fungi Chaetomium thermophilum 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 $Nsa2 'recombinant technology' . Escherichia coli . pET24 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 $Nsa2 0.3 mM '[U-100% 13C; U-100% 15N]' NaCl 5 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 90 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version 5.5 loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version 3.115 loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_CS-Rosetta _Saveframe_category software _Name CS-Rosetta _Version . loop_ _Vendor _Address _Electronic_address 'Shen, Vernon, Baker and Bax' . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ save_NMRDraw _Saveframe_category software _Name NMRDraw _Version 5.5 loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance III' _Field_strength 600 _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_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_3D_H(CCO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $sample_1 save_ save_3D_HNCO_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units temperature 273 . K pH 7.4 . pH pressure 1 . atm 'ionic strength' 5 . mM stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _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 water H 1 protons ppm . internal direct . . . 1.0 glucose C 13 'methyl carbon' ppm . internal direct . . . 1.0 '[15N] ammonium chloride' N 15 nitrogen ppm . internal direct . . . 1.0 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $NMRPipe $SPARKY $CS-Rosetta $NMRDraw stop_ loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCACB' '3D HN(CO)CA' '3D H(CCO)NH' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name '60S Pre-ribosome' _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 -14 1 ASP H H 8.22 0.000 1 2 -14 1 ASP CA C 54.716 0.000 1 3 -14 1 ASP CB C 40.785 0.000 1 4 -14 1 ASP N N 119.953 0.000 1 5 -13 2 TYR H H 8.192 0.000 1 6 -13 2 TYR CA C 57.42 0.000 1 7 -13 2 TYR CB C 38.499 0.000 1 8 -13 2 TYR N N 120.821 0.000 1 9 -12 3 ASP H H 8.155 0.000 1 10 -12 3 ASP CA C 54.211 0.000 1 11 -12 3 ASP CB C 41.073 0.000 1 12 -12 3 ASP N N 122.294 0.000 1 13 -11 4 ILE H H 8.095 0.000 1 14 -11 4 ILE CA C 58.994 0.000 1 15 -11 4 ILE CB C 38.532 0.000 1 16 -11 4 ILE N N 122.551 0.000 1 17 -10 5 PRO CA C 63.202 0.000 1 18 -10 5 PRO CB C 32.154 0.000 1 19 -9 6 THR H H 8.295 0.000 1 20 -9 6 THR CA C 61.747 0.000 1 21 -9 6 THR CB C 69.833 0.000 1 22 -9 6 THR N N 115.224 0.000 1 23 -8 7 THR H H 8.392 0.000 1 24 -8 7 THR CA C 62.308 0.000 1 25 -8 7 THR CB C 69.49 0.000 1 26 -8 7 THR N N 120.271 0.000 1 27 -7 8 GLU H H 8.461 0.000 1 28 -7 8 GLU CA C 57.019 0.000 1 29 -7 8 GLU CB C 30.15 0.000 1 30 -7 8 GLU N N 120.575 0.000 1 31 -6 9 ASN H H 8.299 0.000 1 32 -6 9 ASN CA C 53.426 0.000 1 33 -6 9 ASN CB C 38.616 0.000 1 34 -6 9 ASN N N 121.37 0.000 1 35 -5 10 LEU H H 8.172 0.000 1 36 -5 10 LEU CA C 55.588 0.000 1 37 -5 10 LEU CB C 42.112 0.000 1 38 -5 10 LEU N N 120.575 0.000 1 39 -4 11 TYR H H 8.104 0.000 1 40 -4 11 TYR CA C 57.962 0.000 1 41 -4 11 TYR CB C 38.583 0.000 1 42 -4 11 TYR N N 120.85 0.000 1 43 -3 12 PHE H H 8.274 0.000 1 44 -3 12 PHE CA C 55.945 0.000 1 45 -3 12 PHE CB C 39.541 0.000 1 46 -3 12 PHE N N 122.019 0.000 1 47 -2 13 GLN H H 8.117 0.000 1 48 -2 13 GLN CA C 56.036 0.000 1 49 -2 13 GLN CB C 29.052 0.000 1 50 -2 13 GLN N N 113.544 0.000 1 51 -1 14 GLY H H 8.072 0.000 1 52 -1 14 GLY CA C 45.18 0.000 1 53 -1 14 GLY N N 116.225 0.000 1 54 1 15 ALA H H 8.38 0.000 1 55 1 15 ALA CA C 52.412 0.000 1 56 1 15 ALA CB C 19.297 0.000 1 57 1 15 ALA N N 119.686 0.000 1 58 2 16 HIS H H 8.356 0.000 1 59 2 16 HIS CA C 55.635 0.000 1 60 2 16 HIS CB C 29.751 0.000 1 61 2 16 HIS N N 121.388 0.000 1 62 3 17 MET H H 8.289 0.000 1 63 3 17 MET CA C 53.4 0.000 1 64 3 17 MET CB C 32.463 0.000 1 65 3 17 MET N N 123.137 0.000 1 66 4 18 PRO CA C 63.207 0.000 1 67 4 18 PRO CB C 32.12 0.000 1 68 5 19 GLN H H 8.699 0.000 1 69 5 19 GLN CA C 56.736 0.000 1 70 5 19 GLN N N 119.916 0.000 1 71 6 20 ASN H H 8.416 0.000 1 72 6 20 ASN CA C 54.271 0.000 1 73 6 20 ASN CB C 38.356 0.000 1 74 6 20 ASN N N 120.409 0.000 1 75 7 21 GLU H H 8.325 0.000 1 76 7 21 GLU CA C 57.949 0.000 1 77 7 21 GLU CB C 29.856 0.000 1 78 7 21 GLU N N 121.247 0.000 1 79 8 22 TYR H H 8.06 0.000 1 80 8 22 TYR CA C 60.057 0.000 1 81 8 22 TYR CB C 38.27 0.000 1 82 8 22 TYR N N 121.792 0.000 1 83 9 23 ILE H H 8.057 0.000 1 84 9 23 ILE CA C 60.348 0.000 1 85 9 23 ILE CB C 38.321 0.000 1 86 9 23 ILE N N 121.753 0.000 1 87 14 28 LYS H H 8.126 0.000 1 88 14 28 LYS CA C 57.475 0.000 1 89 14 28 LYS CB C 32.63 0.000 1 90 14 28 LYS N N 121.642 0.000 1 91 15 29 LEU H H 8.274 0.000 1 92 15 29 LEU CA C 55.845 0.000 1 93 15 29 LEU CB C 42.249 0.000 1 94 15 29 LEU N N 119.896 0.000 1 95 16 30 HIS H H 8.402 0.000 1 96 16 30 HIS CA C 57.193 0.000 1 97 16 30 HIS CB C 30.413 0.000 1 98 16 30 HIS N N 112.393 0.000 1 99 17 31 GLY H H 8.383 0.000 1 100 17 31 GLY CA C 45.983 0.000 1 101 17 31 GLY N N 115.057 0.000 1 102 18 32 ARG H H 8.331 0.000 1 103 18 32 ARG CA C 57.313 0.000 1 104 18 32 ARG CB C 30.487 0.000 1 105 18 32 ARG N N 121.033 0.000 1 106 20 34 LEU H H 8.456 0.000 1 107 20 34 LEU CA C 56.4 0.000 1 108 20 34 LEU CB C 41.607 0.000 1 109 20 34 LEU N N 120.809 0.000 1 110 21 35 ASP H H 8.306 0.000 1 111 21 35 ASP CA C 55.578 0.000 1 112 21 35 ASP CB C 40.762 0.000 1 113 21 35 ASP N N 122.167 0.000 1 114 22 36 ALA H H 8.355 0.000 1 115 22 36 ALA CA C 55.149 0.000 1 116 22 36 ALA CB C 18.356 0.000 1 117 22 36 ALA N N 120.951 0.000 1 118 23 37 GLU H H 8.358 0.000 1 119 23 37 GLU CA C 58.945 0.000 1 120 23 37 GLU CB C 29.375 0.000 1 121 23 37 GLU N N 121.245 0.000 1 122 24 38 GLU H H 8.337 0.000 1 123 24 38 GLU CA C 58.805 0.000 1 124 24 38 GLU CB C 29.336 0.000 1 125 24 38 GLU N N 120.391 0.000 1 126 25 39 ARG H H 8.119 0.000 1 127 25 39 ARG CA C 59.438 0.000 1 128 25 39 ARG CB C 30.229 0.000 1 129 25 39 ARG N N 121.278 0.000 1 130 26 40 ALA H H 8.103 0.000 1 131 26 40 ALA CA C 54.535 0.000 1 132 26 40 ALA CB C 18.092 0.000 1 133 26 40 ALA N N 121.164 0.000 1 134 27 41 ARG H H 8.216 0.000 1 135 27 41 ARG CA C 58.902 0.000 1 136 27 41 ARG CB C 30.371 0.000 1 137 27 41 ARG N N 120.729 0.000 1 138 28 42 LYS H H 8.108 0.000 1 139 28 42 LYS CA C 58.655 0.000 1 140 28 42 LYS CB C 32.481 0.000 1 141 28 42 LYS N N 121.025 0.000 1 142 29 43 LYS H H 8.051 0.000 1 143 29 43 LYS CA C 58.59 0.000 1 144 29 43 LYS CB C 32.812 0.000 1 145 29 43 LYS N N 121.682 0.000 1 146 30 44 ALA H H 8.02 0.000 1 147 30 44 ALA CA C 53.825 0.000 1 148 30 44 ALA CB C 18.342 0.000 1 149 30 44 ALA N N 121.476 0.000 1 150 31 45 ALA H H 8.013 0.000 1 151 31 45 ALA CA C 53.582 0.000 1 152 31 45 ALA CB C 18.51 0.000 1 153 31 45 ALA N N 119.752 0.000 1 154 32 46 ARG H H 8.14 0.000 1 155 32 46 ARG CA C 57.429 0.000 1 156 32 46 ARG N N 119.596 0.000 1 157 33 47 GLU H H 8.283 0.000 1 158 33 47 GLU CA C 57.235 0.000 1 159 33 47 GLU CB C 29.968 0.000 1 160 33 47 GLU N N 112.542 0.000 1 161 34 48 GLY H H 8.273 0.000 1 162 34 48 GLY CA C 45.54 0.000 1 163 34 48 GLY N N 114.065 0.000 1 164 35 49 HIS H H 8.249 0.000 1 165 35 49 HIS CA C 56.536 0.000 1 166 35 49 HIS CB C 30.095 0.000 1 167 35 49 HIS N N 119.414 0.000 1 168 36 50 LYS H H 8.623 0.000 1 169 36 50 LYS CA C 56.723 0.000 1 170 36 50 LYS CB C 32.755 0.000 1 171 36 50 LYS N N 120.688 0.000 1 172 37 51 ASN H H 8.512 0.000 1 173 37 51 ASN CA C 53.699 0.000 1 174 37 51 ASN CB C 38.688 0.000 1 175 37 51 ASN N N 117.788 0.000 1 176 38 52 SER H H 8.108 0.000 1 177 38 52 SER CA C 59.096 0.000 1 178 38 52 SER CB C 63.496 0.000 1 179 38 52 SER N N 123.109 0.000 1 180 39 53 GLU H H 8.493 0.000 1 181 39 53 GLU CA C 57.327 0.000 1 182 39 53 GLU CB C 29.89 0.000 1 183 39 53 GLU N N 120.47 0.000 1 184 40 54 ASN H H 8.382 0.000 1 185 40 54 ASN CA C 53.778 0.000 1 186 40 54 ASN CB C 38.719 0.000 1 187 40 54 ASN N N 122.4 0.000 1 188 41 55 ALA H H 8.389 0.000 1 189 41 55 ALA CA C 53.744 0.000 1 190 41 55 ALA CB C 18.773 0.000 1 191 41 55 ALA N N 120.268 0.000 1 192 42 56 GLN H H 8.399 0.000 1 193 42 56 GLN CA C 57.034 0.000 1 194 42 56 GLN CB C 28.835 0.000 1 195 42 56 GLN N N 118.851 0.000 1 196 43 57 ASN H H 8.261 0.000 1 197 43 57 ASN CA C 53.887 0.000 1 198 43 57 ASN CB C 38.21 0.000 1 199 43 57 ASN N N 120.894 0.000 1 200 44 58 LEU H H 8.236 0.000 1 201 44 58 LEU CA C 56.12 0.000 1 202 44 58 LEU CB C 41.867 0.000 1 203 44 58 LEU N N 120.74 0.000 1 204 45 59 ARG H H 8.363 0.000 1 205 45 59 ARG CA C 57.519 0.000 1 206 45 59 ARG CB C 30.475 0.000 1 207 45 59 ARG N N 112.696 0.000 1 208 46 60 GLY H H 8.284 0.000 1 209 46 60 GLY CA C 45.917 0.000 1 210 46 60 GLY N N 115.787 0.000 1 211 47 61 LEU H H 8.304 0.000 1 212 47 61 LEU CA C 56.667 0.000 1 213 47 61 LEU CB C 42.055 0.000 1 214 47 61 LEU N N 121.178 0.000 1 215 48 62 ARG H H 8.242 0.000 1 216 48 62 ARG CA C 57.665 0.000 1 217 48 62 ARG N N 121.774 0.000 1 218 49 63 ALA H H 8.112 0.000 1 219 49 63 ALA CA C 53.809 0.000 1 220 49 63 ALA CB C 18.624 0.000 1 221 49 63 ALA N N 121.091 0.000 1 222 50 64 LYS H H 8.115 0.000 1 223 50 64 LYS CA C 57.732 0.000 1 224 50 64 LYS CB C 32.65 0.000 1 225 50 64 LYS N N 121.336 0.000 1 226 51 65 LEU H H 8.205 0.000 1 227 51 65 LEU CA C 56.263 0.000 1 228 51 65 LEU CB C 41.895 0.000 1 229 51 65 LEU N N 120.929 0.000 1 230 52 66 TYR H H 8.151 0.000 1 231 52 66 TYR CA C 58.921 0.000 1 232 52 66 TYR CB C 38.28 0.000 1 233 52 66 TYR N N 122.494 0.000 1 234 53 67 ALA H H 8.127 0.000 1 235 53 67 ALA CA C 53.634 0.000 1 236 53 67 ALA CB C 18.787 0.000 1 237 53 67 ALA N N 121.125 0.000 1 238 54 68 LYS H H 8.254 0.000 1 239 54 68 LYS CA C 57.588 0.000 1 240 54 68 LYS CB C 32.706 0.000 1 241 54 68 LYS N N 120.629 0.000 1 242 55 69 GLN H H 8.314 0.000 1 243 55 69 GLN CA C 57.084 0.000 1 244 55 69 GLN CB C 28.955 0.000 1 245 55 69 GLN N N 120.983 0.000 1 246 56 70 ARG H H 8.396 0.000 1 247 56 70 ARG CA C 56.811 0.000 1 248 56 70 ARG CB C 28.943 0.000 1 249 56 70 ARG N N 121.698 0.000 1 250 57 71 HIS H H 8.336 0.000 1 251 57 71 HIS CA C 57.103 0.000 1 252 57 71 HIS CB C 30.322 0.000 1 253 57 71 HIS N N 123.101 0.000 1 254 58 72 ALA H H 8.338 0.000 1 255 58 72 ALA CA C 53.282 0.000 1 256 58 72 ALA CB C 18.802 0.000 1 257 58 72 ALA N N 120.902 0.000 1 258 59 73 GLN H H 8.338 0.000 1 259 59 73 GLN CA C 56.519 0.000 1 260 59 73 GLN CB C 29.245 0.000 1 261 59 73 GLN N N 121.647 0.000 1 262 60 74 LYS H H 8.233 0.000 1 263 60 74 LYS CA C 57.325 0.000 1 264 60 74 LYS CB C 32.621 0.000 1 265 60 74 LYS N N 122.195 0.000 1 266 61 75 ILE H H 8.339 0.000 1 267 61 75 ILE CA C 61.781 0.000 1 268 61 75 ILE CB C 38.172 0.000 1 269 61 75 ILE N N 123.269 0.000 1 270 62 76 GLN H H 8.482 0.000 1 271 62 76 GLN CA C 56.161 0.000 1 272 62 76 GLN CB C 29.415 0.000 1 273 62 76 GLN N N 121.492 0.000 1 274 63 77 MET H H 8.516 0.000 1 275 63 77 MET CA C 56.442 0.000 1 276 63 77 MET CB C 29.926 0.000 1 277 63 77 MET N N 120.264 0.000 1 278 64 78 ARG H H 8.366 0.000 1 279 64 78 ARG CA C 56.58 0.000 1 280 64 78 ARG CB C 30.626 0.000 1 281 64 78 ARG N N 122.809 0.000 1 282 65 79 LYS H H 8.362 0.000 1 283 65 79 LYS CA C 56.646 0.000 1 284 65 79 LYS CB C 33.063 0.000 1 285 65 79 LYS N N 124.534 0.000 1 286 66 80 ALA H H 8.268 0.000 1 287 66 80 ALA CA C 53.177 0.000 1 288 66 80 ALA CB C 19.041 0.000 1 289 66 80 ALA N N 122.437 0.000 1 290 67 81 ILE H H 8.386 0.000 1 291 67 81 ILE CA C 61.307 0.000 1 292 67 81 ILE CB C 38.665 0.000 1 293 67 81 ILE N N 124.184 0.000 1 294 68 82 LYS H H 8.542 0.000 1 295 68 82 LYS CA C 56.388 0.000 1 296 68 82 LYS CB C 32.873 0.000 1 297 68 82 LYS N N 123.399 0.000 1 298 69 83 GLN H H 8.484 0.000 1 299 69 83 GLN CA C 56.231 0.000 1 300 69 83 GLN CB C 30.372 0.000 1 301 69 83 GLN N N 122.42 0.000 1 302 70 84 HIS H H 8.436 0.000 1 303 70 84 HIS CA C 56.114 0.000 1 304 70 84 HIS CB C 33.169 0.000 1 305 70 84 HIS N N 122.533 0.000 1 306 71 85 GLU H H 8.641 0.000 1 307 71 85 GLU CA C 56.494 0.000 1 308 71 85 GLU CB C 30.373 0.000 1 309 71 85 GLU N N 122.721 0.000 1 310 72 86 GLU H H 8.53 0.000 1 311 72 86 GLU CA C 56.61 0.000 1 312 72 86 GLU CB C 30.072 0.000 1 313 72 86 GLU N N 122.235 0.000 1 314 73 87 ARG H H 8.551 0.000 1 315 73 87 ARG CA C 56.214 0.000 1 316 73 87 ARG CB C 30.755 0.000 1 317 73 87 ARG N N 120.604 0.000 1 318 74 88 ASN H H 8.34 0.000 1 319 74 88 ASN CA C 57.922 0.000 1 320 74 88 ASN CB C 38.667 0.000 1 321 74 88 ASN N N 120.609 0.000 1 322 75 89 VAL H H 8.434 0.000 1 323 75 89 VAL CA C 62.494 0.000 1 324 75 89 VAL CB C 32.575 0.000 1 325 75 89 VAL N N 123.738 0.000 1 326 76 90 LYS H H 8.521 0.000 1 327 76 90 LYS CA C 56.544 0.000 1 328 76 90 LYS CB C 32.703 0.000 1 329 76 90 LYS N N 115.25 0.000 1 330 77 91 GLY H H 8.366 0.000 1 331 77 91 GLY CA C 44.979 0.000 1 332 77 91 GLY N N 116.037 0.000 1 333 78 92 ARG H H 8.222 0.000 1 334 78 92 ARG CA C 53.924 0.000 1 335 78 92 ARG CB C 30.132 0.000 1 336 78 92 ARG N N 121.767 0.000 1 337 79 93 PRO CA C 63.053 0.000 1 338 79 93 PRO CB C 32.044 0.000 1 339 80 94 ALA H H 8.536 0.000 1 340 80 94 ALA CA C 52.424 0.000 1 341 80 94 ALA CB C 19.114 0.000 1 342 80 94 ALA N N 121.976 0.000 1 343 81 95 GLU H H 8.466 0.000 1 344 81 95 GLU CA C 56.258 0.000 1 345 81 95 GLU CB C 30.361 0.000 1 346 81 95 GLU N N 121.693 0.000 1 347 82 96 LYS H H 8.493 0.000 1 348 82 96 LYS CA C 56.088 0.000 1 349 82 96 LYS CB C 33.085 0.000 1 350 82 96 LYS N N 123.007 0.000 1 351 83 97 GLU H H 8.518 0.000 1 352 83 97 GLU CA C 54.353 0.000 1 353 83 97 GLU CB C 29.174 0.000 1 354 83 97 GLU N N 123.364 0.000 1 stop_ save_