data_18147 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Assigned NMR chemical shift of Escherichia coli Ribosome binding factor A ; _BMRB_accession_number 18147 _BMRB_flat_file_name bmr18147.str _Entry_type original _Submission_date 2011-12-16 _Accession_date 2011-12-16 _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 Kobayashi Hiroshi . . 2 Swapna G.V.T . . 3 Wu Kuen-Phon . . 4 Yuliya Afinogenova . . 5 Conover Kenith . . 6 Mao Binchen . . 7 Montelione Gaetano T. . 8 Inouye Masayori . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 136 "13C chemical shifts" 393 "15N chemical shifts" 136 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2012-05-10 update BMRB 'update entry citation' 2012-03-07 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_citations _Saveframe_category entry_citation _Citation_full . _Citation_title 'Segmental isotope labeling of proteins for NMR structural study using a protein S tag for higher expression and solubility.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 22389115 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kobayashi Hiroshi . . 2 Swapna G. V.T. . 3 Wu Kuen-Phon . . 4 Afinogenova Yuliya . . 5 Conover Kenith . . 6 Mao Binchen . . 7 Montelione Gaetano T. . 8 Inouye Masayori . . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_name_full 'Journal of biomolecular NMR' _Journal_volume 52 _Journal_issue 4 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 303 _Page_last 313 _Year 2012 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name RbfA _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label RbfA $RbfA 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_RbfA _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common RbfA _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 147 _Mol_residue_sequence ; SGVHMAKEFGRPQRVAQEMQ KEIALILQREIKDPRLGMMT TVSGVEMSRDLAYAKVYVTF LNDKDEDAVKAGIKALQEAS GFIRSLLGKAMRLRIVPELT FFYDNSLVEGMRMSNLVTSV VKHDEERRVNPDDSKEDGSW SHPQFEK ; loop_ _Residue_seq_code _Residue_label 1 SER 2 GLY 3 VAL 4 HIS 5 MET 6 ALA 7 LYS 8 GLU 9 PHE 10 GLY 11 ARG 12 PRO 13 GLN 14 ARG 15 VAL 16 ALA 17 GLN 18 GLU 19 MET 20 GLN 21 LYS 22 GLU 23 ILE 24 ALA 25 LEU 26 ILE 27 LEU 28 GLN 29 ARG 30 GLU 31 ILE 32 LYS 33 ASP 34 PRO 35 ARG 36 LEU 37 GLY 38 MET 39 MET 40 THR 41 THR 42 VAL 43 SER 44 GLY 45 VAL 46 GLU 47 MET 48 SER 49 ARG 50 ASP 51 LEU 52 ALA 53 TYR 54 ALA 55 LYS 56 VAL 57 TYR 58 VAL 59 THR 60 PHE 61 LEU 62 ASN 63 ASP 64 LYS 65 ASP 66 GLU 67 ASP 68 ALA 69 VAL 70 LYS 71 ALA 72 GLY 73 ILE 74 LYS 75 ALA 76 LEU 77 GLN 78 GLU 79 ALA 80 SER 81 GLY 82 PHE 83 ILE 84 ARG 85 SER 86 LEU 87 LEU 88 GLY 89 LYS 90 ALA 91 MET 92 ARG 93 LEU 94 ARG 95 ILE 96 VAL 97 PRO 98 GLU 99 LEU 100 THR 101 PHE 102 PHE 103 TYR 104 ASP 105 ASN 106 SER 107 LEU 108 VAL 109 GLU 110 GLY 111 MET 112 ARG 113 MET 114 SER 115 ASN 116 LEU 117 VAL 118 THR 119 SER 120 VAL 121 VAL 122 LYS 123 HIS 124 ASP 125 GLU 126 GLU 127 ARG 128 ARG 129 VAL 130 ASN 131 PRO 132 ASP 133 ASP 134 SER 135 LYS 136 GLU 137 ASP 138 GLY 139 SER 140 TRP 141 SER 142 HIS 143 PRO 144 GLN 145 PHE 146 GLU 147 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-08-12 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 PDB 1KKG "Nmr Structure Of Ribosome-Binding Factor A (Rbfa)" 72.79 108 100.00 100.00 8.94e-70 DBJ BAB37471 "ribosome-binding factor A [Escherichia coli O157:H7 str. Sakai]" 90.48 133 100.00 100.00 3.12e-90 DBJ BAE77213 "30s ribosome binding factor [Escherichia coli str. K12 substr. W3110]" 90.48 133 100.00 100.00 3.12e-90 DBJ BAG78977 "ribosome-binding factor A [Escherichia coli SE11]" 90.48 133 100.00 100.00 3.12e-90 DBJ BAH65352 "ribosome-binding factor A [Klebsiella pneumoniae subsp. pneumoniae NTUH-K2044]" 90.48 133 97.74 99.25 2.96e-88 DBJ BAI27447 "30S ribosome binding factor RbfA [Escherichia coli O26:H11 str. 11368]" 90.48 133 100.00 100.00 3.12e-90 EMBL CAA31634 "unnamed protein product [Escherichia coli]" 90.48 133 100.00 100.00 3.12e-90 EMBL CAA32020 "P15B gene product (AA 1 - 133) [Escherichia coli]" 90.48 133 100.00 100.00 3.12e-90 EMBL CAP77629 "ribosome-binding factor A [Escherichia coli LF82]" 90.48 133 100.00 100.00 3.12e-90 EMBL CAQ33502 "30S ribosome binding factor [Escherichia coli BL21(DE3)]" 90.48 133 100.00 100.00 3.12e-90 EMBL CAQ90639 "30s ribosome binding factor [Escherichia fergusonii ATCC 35469]" 90.48 133 100.00 100.00 3.12e-90 GB AAA57970 "P15B [Escherichia coli str. K-12 substr. MG1655]" 90.48 133 100.00 100.00 3.12e-90 GB AAC76201 "30s ribosome binding factor [Escherichia coli str. K-12 substr. MG1655]" 90.48 133 100.00 100.00 3.12e-90 GB AAG58303 "ribosome-binding factor A [Escherichia coli O157:H7 str. EDL933]" 90.48 133 100.00 100.00 3.12e-90 GB AAL22157 "ribosome-binding factor [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" 90.48 133 97.74 100.00 9.73e-89 GB AAN44675 "ribosome-binding factor A [Shigella flexneri 2a str. 301]" 90.48 133 100.00 100.00 3.12e-90 REF NP_312075 "ribosome-binding factor A [Escherichia coli O157:H7 str. Sakai]" 90.48 133 100.00 100.00 3.12e-90 REF NP_417636 "30s ribosome binding factor [Escherichia coli str. K-12 substr. MG1655]" 90.48 133 100.00 100.00 3.12e-90 REF NP_462198 "ribosome-binding factor A [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" 90.48 133 97.74 100.00 9.73e-89 REF NP_708968 "ribosome-binding factor A [Shigella flexneri 2a str. 301]" 90.48 133 100.00 100.00 3.12e-90 REF WP_001040197 "ribosome-binding factor A [Escherichia coli]" 90.48 133 99.25 99.25 3.23e-89 SP A1AG72 "RecName: Full=Ribosome-binding factor A" 90.48 133 100.00 100.00 3.12e-90 SP A6TEI6 "RecName: Full=Ribosome-binding factor A" 90.48 133 97.74 99.25 2.96e-88 SP A7ZS64 "RecName: Full=Ribosome-binding factor A" 90.48 133 100.00 100.00 3.12e-90 SP A8A4Y3 "RecName: Full=Ribosome-binding factor A" 90.48 133 100.00 100.00 3.12e-90 SP A8AQ56 "RecName: Full=Ribosome-binding factor A" 90.48 133 97.74 100.00 5.22e-89 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $RbfA 'E. coli' 562 Bacteria . Escherichia coli 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 $RbfA 'recombinant technology' . Escherichia coli . pCold 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 $RbfA 0.5 mM '[U-100% 13C; U-100% 15N]' NaCl 150 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_AutoAssign _Saveframe_category software _Name AutoAssign _Version . loop_ _Vendor _Address _Electronic_address 'Zimmerman, Moseley, Kulikowski and Montelione' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _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_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_NMR_spectrometer_expt _Saveframe_category NMR_applied_experiment _Experiment_name . _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 150 . mM pH 4.0 . pH pressure 1 . atm temperature 308 . K 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 DSS C 13 'methyl protons' ppm 0.0 external indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.00 DSS N 15 'methyl protons' ppm 0.0 external 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_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '2D 1H-13C HSQC' '3D CBCA(CO)NH' '3D HNCO' '3D HNCA' '3D HNCACB' 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 RbfA _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 1 1 SER H H 8.343 0.025 1 2 1 1 SER C C 175.198 0.25 1 3 1 1 SER CA C 58.856 0.25 1 4 1 1 SER CB C 64.114 0.25 1 5 1 1 SER N N 117.959 0.25 1 6 2 2 GLY H H 8.357 0.025 1 7 2 2 GLY C C 174.232 0.25 1 8 2 2 GLY CA C 45.522 0.25 1 9 2 2 GLY N N 110.709 0.25 1 10 3 3 VAL H H 7.878 0.025 1 11 3 3 VAL C C 176.146 0.25 1 12 3 3 VAL CA C 62.605 0.25 1 13 3 3 VAL CB C 32.612 0.25 1 14 3 3 VAL N N 119.069 0.25 1 15 4 4 HIS H H 8.290 0.025 1 16 4 4 HIS CA C 56.541 0.25 1 17 4 4 HIS CB C 33.044 0.25 1 18 4 4 HIS N N 125.148 0.25 1 19 5 5 MET H H 8.205 0.025 1 20 5 5 MET C C 175.953 0.25 1 21 5 5 MET CA C 55.714 0.25 1 22 5 5 MET CB C 33.172 0.25 1 23 5 5 MET N N 116.076 0.25 1 24 6 6 ALA H H 8.352 0.025 1 25 6 6 ALA C C 177.943 0.25 1 26 6 6 ALA CA C 52.907 0.25 1 27 6 6 ALA CB C 19.254 0.25 1 28 6 6 ALA N N 125.555 0.25 1 29 7 7 LYS H H 8.232 0.025 1 30 7 7 LYS CA C 56.642 0.25 1 31 7 7 LYS CB C 32.999 0.25 1 32 7 7 LYS N N 120.310 0.25 1 33 8 8 GLU H H 8.571 0.025 1 34 8 8 GLU C C 176.010 0.25 1 35 8 8 GLU CA C 56.532 0.25 1 36 8 8 GLU CB C 29.604 0.25 1 37 8 8 GLU N N 122.190 0.25 1 38 9 9 PHE H H 8.218 0.025 1 39 9 9 PHE C C 176.242 0.25 1 40 9 9 PHE CA C 58.029 0.25 1 41 9 9 PHE CB C 39.862 0.25 1 42 9 9 PHE N N 121.009 0.25 1 43 10 10 GLY H H 8.302 0.025 1 44 10 10 GLY C C 174.000 0.25 1 45 10 10 GLY CA C 45.288 0.25 1 46 10 10 GLY N N 110.088 0.25 1 47 11 11 ARG H H 8.357 0.025 1 48 11 11 ARG CA C 56.950 0.25 1 49 11 11 ARG CB C 29.334 0.25 1 50 11 11 ARG N N 121.418 0.25 1 51 12 12 PRO C C 178.042 0.25 1 52 12 12 PRO CA C 65.593 0.25 1 53 12 12 PRO CB C 31.095 0.25 1 54 13 13 GLN H H 8.105 0.025 1 55 13 13 GLN CA C 58.446 0.25 1 56 13 13 GLN CB C 28.539 0.25 1 57 13 13 GLN N N 117.341 0.25 1 58 14 14 ARG H H 8.062 0.025 1 59 14 14 ARG C C 176.249 0.25 1 60 14 14 ARG CA C 55.288 0.25 1 61 14 14 ARG CB C 28.889 0.25 1 62 14 14 ARG N N 121.021 0.25 1 63 15 15 VAL H H 8.570 0.025 1 64 15 15 VAL CA C 62.582 0.25 1 65 15 15 VAL CB C 32.799 0.25 1 66 15 15 VAL N N 122.176 0.25 1 67 16 16 ALA H H 7.940 0.025 1 68 16 16 ALA C C 179.739 0.25 1 69 16 16 ALA CA C 56.013 0.25 1 70 16 16 ALA CB C 18.392 0.25 1 71 16 16 ALA N N 120.944 0.25 1 72 17 17 GLN H H 7.818 0.025 1 73 17 17 GLN C C 179.252 0.25 1 74 17 17 GLN CA C 59.362 0.25 1 75 17 17 GLN CB C 28.732 0.25 1 76 17 17 GLN N N 116.866 0.25 1 77 18 18 GLU H H 8.002 0.025 1 78 18 18 GLU C C 179.136 0.25 1 79 18 18 GLU CA C 59.109 0.25 1 80 18 18 GLU CB C 28.652 0.25 1 81 18 18 GLU N N 120.244 0.25 1 82 19 19 MET H H 8.884 0.025 1 83 19 19 MET C C 177.887 0.25 1 84 19 19 MET CA C 59.545 0.25 1 85 19 19 MET CB C 28.542 0.25 1 86 19 19 MET N N 119.236 0.25 1 87 20 20 GLN H H 8.430 0.025 1 88 20 20 GLN C C 177.011 0.25 1 89 20 20 GLN CA C 60.488 0.25 1 90 20 20 GLN CB C 27.783 0.25 1 91 20 20 GLN N N 119.818 0.25 1 92 21 21 LYS H H 7.337 0.025 1 93 21 21 LYS CA C 59.540 0.25 1 94 21 21 LYS CB C 32.730 0.25 1 95 21 21 LYS N N 117.167 0.25 1 96 22 22 GLU H H 8.140 0.025 1 97 22 22 GLU C C 179.029 0.25 1 98 22 22 GLU CA C 58.513 0.25 1 99 22 22 GLU CB C 28.300 0.25 1 100 22 22 GLU N N 117.448 0.25 1 101 23 23 ILE H H 9.105 0.025 1 102 23 23 ILE C C 177.171 0.25 1 103 23 23 ILE CA C 66.401 0.25 1 104 23 23 ILE CB C 37.598 0.25 1 105 23 23 ILE N N 119.037 0.25 1 106 24 24 ALA H H 7.856 0.025 1 107 24 24 ALA C C 180.036 0.25 1 108 24 24 ALA CA C 56.294 0.25 1 109 24 24 ALA CB C 18.255 0.25 1 110 24 24 ALA N N 121.134 0.25 1 111 25 25 LEU H H 7.526 0.025 1 112 25 25 LEU CA C 58.472 0.25 1 113 25 25 LEU CB C 42.339 0.25 1 114 25 25 LEU N N 118.416 0.25 1 115 26 26 ILE C C 178.918 0.25 1 116 26 26 ILE CA C 65.712 0.25 1 117 26 26 ILE CB C 38.437 0.25 1 118 27 27 LEU H H 8.540 0.025 1 119 27 27 LEU C C 178.478 0.25 1 120 27 27 LEU CA C 58.208 0.25 1 121 27 27 LEU CB C 41.335 0.25 1 122 27 27 LEU N N 118.575 0.25 1 123 28 28 GLN H H 7.807 0.025 1 124 28 28 GLN C C 178.409 0.25 1 125 28 28 GLN CA C 58.419 0.25 1 126 28 28 GLN CB C 29.440 0.25 1 127 28 28 GLN N N 115.314 0.25 1 128 29 29 ARG H H 8.123 0.025 1 129 29 29 ARG C C 178.066 0.25 1 130 29 29 ARG CA C 57.987 0.25 1 131 29 29 ARG CB C 32.819 0.25 1 132 29 29 ARG N N 114.548 0.25 1 133 30 30 GLU H H 8.336 0.025 1 134 30 30 GLU C C 176.000 0.25 1 135 30 30 GLU CA C 57.036 0.25 1 136 30 30 GLU CB C 30.464 0.25 1 137 30 30 GLU N N 115.566 0.25 1 138 31 31 ILE H H 7.363 0.025 1 139 31 31 ILE C C 175.476 0.25 1 140 31 31 ILE CA C 60.438 0.25 1 141 31 31 ILE CB C 37.302 0.25 1 142 31 31 ILE N N 118.373 0.25 1 143 32 32 LYS H H 8.375 0.025 1 144 32 32 LYS C C 175.746 0.25 1 145 32 32 LYS CA C 55.706 0.25 1 146 32 32 LYS CB C 32.195 0.25 1 147 32 32 LYS N N 125.036 0.25 1 148 33 33 ASP H H 7.757 0.025 1 149 33 33 ASP CA C 51.580 0.25 1 150 33 33 ASP CB C 43.123 0.25 1 151 33 33 ASP N N 121.859 0.25 1 152 34 34 PRO C C 178.300 0.25 1 153 34 34 PRO CA C 64.561 0.25 1 154 34 34 PRO CB C 32.122 0.25 1 155 35 35 ARG H H 8.652 0.025 1 156 35 35 ARG C C 177.226 0.25 1 157 35 35 ARG CA C 58.022 0.25 1 158 35 35 ARG CB C 30.169 0.25 1 159 35 35 ARG N N 117.596 0.25 1 160 36 36 LEU H H 7.681 0.025 1 161 36 36 LEU C C 178.004 0.25 1 162 36 36 LEU CA C 55.437 0.25 1 163 36 36 LEU CB C 42.516 0.25 1 164 36 36 LEU N N 118.368 0.25 1 165 37 37 GLY H H 7.990 0.025 1 166 37 37 GLY CA C 46.585 0.25 1 167 37 37 GLY N N 107.210 0.25 1 168 38 38 MET H H 8.103 0.025 1 169 38 38 MET C C 176.563 0.25 1 170 38 38 MET CA C 56.384 0.25 1 171 38 38 MET CB C 33.092 0.25 1 172 38 38 MET N N 117.729 0.25 1 173 39 39 MET H H 8.532 0.025 1 174 39 39 MET CA C 55.765 0.25 1 175 39 39 MET CB C 29.014 0.25 1 176 39 39 MET N N 119.970 0.25 1 177 41 41 THR C C 173.177 0.25 1 178 41 41 THR CA C 61.209 0.25 1 179 41 41 THR CB C 70.855 0.25 1 180 42 42 VAL H H 8.770 0.025 1 181 42 42 VAL CA C 61.547 0.25 1 182 42 42 VAL CB C 31.593 0.25 1 183 42 42 VAL N N 124.694 0.25 1 184 43 43 SER H H 9.154 0.025 1 185 43 43 SER C C 175.647 0.25 1 186 43 43 SER CA C 59.333 0.25 1 187 43 43 SER CB C 64.078 0.25 1 188 43 43 SER N N 125.497 0.25 1 189 44 44 GLY H H 7.630 0.025 1 190 44 44 GLY CA C 46.172 0.25 1 191 44 44 GLY N N 107.684 0.25 1 192 45 45 VAL CA C 61.448 0.25 1 193 45 45 VAL CB C 35.687 0.25 1 194 46 46 GLU H H 9.230 0.025 1 195 46 46 GLU C C 175.545 0.25 1 196 46 46 GLU CA C 54.420 0.25 1 197 46 46 GLU CB C 32.099 0.25 1 198 46 46 GLU N N 125.742 0.25 1 199 47 47 MET H H 9.055 0.025 1 200 47 47 MET C C 176.805 0.25 1 201 47 47 MET CA C 53.510 0.25 1 202 47 47 MET CB C 33.953 0.25 1 203 47 47 MET N N 124.906 0.25 1 204 48 48 SER H H 8.705 0.025 1 205 48 48 SER C C 176.723 0.25 1 206 48 48 SER CA C 58.690 0.25 1 207 48 48 SER CB C 62.817 0.25 1 208 48 48 SER N N 118.351 0.25 1 209 49 49 ARG H H 8.871 0.025 1 210 49 49 ARG C C 176.854 0.25 1 211 49 49 ARG CA C 59.507 0.25 1 212 49 49 ARG CB C 29.807 0.25 1 213 49 49 ARG N N 122.281 0.25 1 214 50 50 ASP H H 7.949 0.025 1 215 50 50 ASP C C 176.220 0.25 1 216 50 50 ASP CA C 52.906 0.25 1 217 50 50 ASP CB C 40.133 0.25 1 218 50 50 ASP N N 114.433 0.25 1 219 51 51 LEU H H 8.008 0.025 1 220 51 51 LEU C C 174.853 0.25 1 221 51 51 LEU CA C 56.737 0.25 1 222 51 51 LEU CB C 38.951 0.25 1 223 51 51 LEU N N 114.120 0.25 1 224 52 52 ALA H H 7.524 0.025 1 225 52 52 ALA C C 177.585 0.25 1 226 52 52 ALA CA C 53.577 0.25 1 227 52 52 ALA CB C 19.787 0.25 1 228 52 52 ALA N N 118.389 0.25 1 229 53 53 TYR H H 8.057 0.025 1 230 53 53 TYR CA C 56.993 0.25 1 231 53 53 TYR CB C 41.785 0.25 1 232 53 53 TYR N N 117.391 0.25 1 233 54 54 ALA H H 8.877 0.025 1 234 54 54 ALA C C 175.598 0.25 1 235 54 54 ALA CA C 50.800 0.25 1 236 54 54 ALA CB C 22.213 0.25 1 237 54 54 ALA N N 123.769 0.25 1 238 55 55 LYS H H 8.852 0.025 1 239 55 55 LYS C C 174.688 0.25 1 240 55 55 LYS CA C 55.432 0.25 1 241 55 55 LYS CB C 34.094 0.25 1 242 55 55 LYS N N 123.527 0.25 1 243 56 56 VAL H H 8.852 0.025 1 244 56 56 VAL CA C 61.513 0.25 1 245 56 56 VAL CB C 32.281 0.25 1 246 56 56 VAL N N 124.599 0.25 1 247 57 57 TYR H H 8.871 0.025 1 248 57 57 TYR C C 176.327 0.25 1 249 57 57 TYR CA C 57.683 0.25 1 250 57 57 TYR CB C 37.857 0.25 1 251 57 57 TYR N N 127.504 0.25 1 252 58 58 VAL H H 8.822 0.025 1 253 58 58 VAL C C 174.675 0.25 1 254 58 58 VAL CA C 58.848 0.25 1 255 58 58 VAL CB C 35.711 0.25 1 256 58 58 VAL N N 116.857 0.25 1 257 59 59 THR H H 8.596 0.025 1 258 59 59 THR CA C 59.850 0.25 1 259 59 59 THR CB C 71.317 0.25 1 260 59 59 THR N N 113.400 0.25 1 261 60 60 PHE H H 9.080 0.025 1 262 60 60 PHE CA C 56.945 0.25 1 263 60 60 PHE CB C 44.233 0.25 1 264 60 60 PHE N N 119.558 0.25 1 265 61 61 LEU H H 8.173 0.025 1 266 61 61 LEU C C 177.541 0.25 1 267 61 61 LEU CA C 57.287 0.25 1 268 61 61 LEU CB C 40.916 0.25 1 269 61 61 LEU N N 120.977 0.25 1 270 62 62 ASN H H 8.417 0.025 1 271 62 62 ASN C C 174.699 0.25 1 272 62 62 ASN CA C 52.900 0.25 1 273 62 62 ASN CB C 38.153 0.25 1 274 62 62 ASN N N 117.944 0.25 1 275 63 63 ASP H H 8.088 0.025 1 276 63 63 ASP C C 175.648 0.25 1 277 63 63 ASP CA C 53.443 0.25 1 278 63 63 ASP CB C 39.159 0.25 1 279 63 63 ASP N N 118.958 0.25 1 280 64 64 LYS H H 8.278 0.025 1 281 64 64 LYS C C 176.249 0.25 1 282 64 64 LYS CA C 57.036 0.25 1 283 64 64 LYS CB C 32.788 0.25 1 284 64 64 LYS N N 119.523 0.25 1 285 65 65 ASP H H 7.702 0.025 1 286 65 65 ASP C C 175.764 0.25 1 287 65 65 ASP CA C 52.741 0.25 1 288 65 65 ASP CB C 40.590 0.25 1 289 65 65 ASP N N 118.055 0.25 1 290 66 66 GLU H H 8.676 0.025 1 291 66 66 GLU C C 178.193 0.25 1 292 66 66 GLU CA C 59.260 0.25 1 293 66 66 GLU CB C 28.461 0.25 1 294 66 66 GLU N N 123.208 0.25 1 295 67 67 ASP H H 8.377 0.025 1 296 67 67 ASP C C 178.493 0.25 1 297 67 67 ASP CA C 57.139 0.25 1 298 67 67 ASP CB C 39.157 0.25 1 299 67 67 ASP N N 118.661 0.25 1 300 68 68 ALA H H 7.729 0.025 1 301 68 68 ALA C C 180.900 0.25 1 302 68 68 ALA CA C 54.752 0.25 1 303 68 68 ALA CB C 18.319 0.25 1 304 68 68 ALA N N 124.213 0.25 1 305 69 69 VAL H H 7.757 0.025 1 306 69 69 VAL C C 177.792 0.25 1 307 69 69 VAL CA C 66.538 0.25 1 308 69 69 VAL CB C 31.480 0.25 1 309 69 69 VAL N N 120.231 0.25 1 310 70 70 LYS H H 7.962 0.025 1 311 70 70 LYS C C 179.899 0.25 1 312 70 70 LYS CA C 60.131 0.25 1 313 70 70 LYS CB C 32.305 0.25 1 314 70 70 LYS N N 118.430 0.25 1 315 71 71 ALA H H 7.842 0.025 1 316 71 71 ALA C C 180.276 0.25 1 317 71 71 ALA CA C 54.945 0.25 1 318 71 71 ALA CB C 18.001 0.25 1 319 71 71 ALA N N 120.870 0.25 1 320 72 72 GLY H H 8.080 0.025 1 321 72 72 GLY C C 175.380 0.25 1 322 72 72 GLY CA C 47.250 0.25 1 323 72 72 GLY N N 108.408 0.25 1 324 73 73 ILE H H 8.287 0.025 1 325 73 73 ILE CA C 62.803 0.25 1 326 73 73 ILE CB C 35.475 0.25 1 327 73 73 ILE N N 121.500 0.25 1 328 74 74 LYS H H 7.797 0.025 1 329 74 74 LYS C C 178.653 0.25 1 330 74 74 LYS CA C 59.535 0.25 1 331 74 74 LYS CB C 32.443 0.25 1 332 74 74 LYS N N 120.147 0.25 1 333 75 75 ALA H H 7.908 0.025 1 334 75 75 ALA C C 181.104 0.25 1 335 75 75 ALA CA C 55.431 0.25 1 336 75 75 ALA CB C 18.142 0.25 1 337 75 75 ALA N N 120.856 0.25 1 338 76 76 LEU H H 7.792 0.025 1 339 76 76 LEU C C 178.087 0.25 1 340 76 76 LEU CA C 57.945 0.25 1 341 76 76 LEU CB C 40.196 0.25 1 342 76 76 LEU N N 119.546 0.25 1 343 77 77 GLN H H 8.432 0.025 1 344 77 77 GLN C C 181.522 0.25 1 345 77 77 GLN CA C 59.186 0.25 1 346 77 77 GLN CB C 28.650 0.25 1 347 77 77 GLN N N 118.071 0.25 1 348 78 78 GLU H H 8.658 0.025 1 349 78 78 GLU C C 178.150 0.25 1 350 78 78 GLU CA C 59.030 0.25 1 351 78 78 GLU CB C 28.566 0.25 1 352 78 78 GLU N N 119.624 0.25 1 353 79 79 ALA H H 7.629 0.025 1 354 79 79 ALA C C 178.400 0.25 1 355 79 79 ALA CA C 52.162 0.25 1 356 79 79 ALA CB C 18.494 0.25 1 357 79 79 ALA N N 120.623 0.25 1 358 80 80 SER H H 7.824 0.025 1 359 80 80 SER C C 176.417 0.25 1 360 80 80 SER CA C 64.131 0.25 1 361 80 80 SER CB C 63.455 0.25 1 362 80 80 SER N N 116.390 0.25 1 363 81 81 GLY H H 8.793 0.025 1 364 81 81 GLY C C 176.536 0.25 1 365 81 81 GLY CA C 47.653 0.25 1 366 81 81 GLY N N 111.205 0.25 1 367 82 82 PHE H H 8.056 0.025 1 368 82 82 PHE C C 178.263 0.25 1 369 82 82 PHE CA C 60.090 0.25 1 370 82 82 PHE CB C 39.152 0.25 1 371 82 82 PHE N N 125.627 0.25 1 372 83 83 ILE H H 8.733 0.025 1 373 83 83 ILE C C 177.923 0.25 1 374 83 83 ILE CA C 66.343 0.25 1 375 83 83 ILE CB C 38.317 0.25 1 376 83 83 ILE N N 119.659 0.25 1 377 84 84 ARG H H 8.819 0.025 1 378 84 84 ARG C C 178.265 0.25 1 379 84 84 ARG CA C 60.915 0.25 1 380 84 84 ARG CB C 30.510 0.25 1 381 84 84 ARG N N 118.827 0.25 1 382 85 85 SER H H 7.868 0.025 1 383 85 85 SER C C 177.720 0.25 1 384 85 85 SER CA C 61.659 0.25 1 385 85 85 SER CB C 62.814 0.25 1 386 85 85 SER N N 115.025 0.25 1 387 86 86 LEU H H 7.706 0.025 1 388 86 86 LEU C C 180.487 0.25 1 389 86 86 LEU CA C 57.945 0.25 1 390 86 86 LEU CB C 41.883 0.25 1 391 86 86 LEU N N 122.402 0.25 1 392 87 87 LEU H H 8.730 0.025 1 393 87 87 LEU C C 178.871 0.25 1 394 87 87 LEU CA C 58.109 0.25 1 395 87 87 LEU CB C 42.690 0.25 1 396 87 87 LEU N N 122.638 0.25 1 397 88 88 GLY H H 8.348 0.025 1 398 88 88 GLY C C 175.869 0.25 1 399 88 88 GLY CA C 47.903 0.25 1 400 88 88 GLY N N 104.511 0.25 1 401 89 89 LYS H H 7.245 0.025 1 402 89 89 LYS C C 178.667 0.25 1 403 89 89 LYS CA C 58.390 0.25 1 404 89 89 LYS CB C 32.881 0.25 1 405 89 89 LYS N N 118.586 0.25 1 406 90 90 ALA H H 7.955 0.025 1 407 90 90 ALA C C 179.106 0.25 1 408 90 90 ALA CA C 54.625 0.25 1 409 90 90 ALA CB C 19.368 0.25 1 410 90 90 ALA N N 120.970 0.25 1 411 91 91 MET H H 8.069 0.025 1 412 91 91 MET C C 174.666 0.25 1 413 91 91 MET CA C 56.115 0.25 1 414 91 91 MET CB C 35.892 0.25 1 415 91 91 MET N N 113.024 0.25 1 416 92 92 ARG H H 7.941 0.025 1 417 92 92 ARG C C 175.758 0.25 1 418 92 92 ARG CA C 56.549 0.25 1 419 92 92 ARG CB C 27.249 0.25 1 420 92 92 ARG N N 119.779 0.25 1 421 93 93 LEU H H 7.758 0.025 1 422 93 93 LEU C C 177.104 0.25 1 423 93 93 LEU CA C 53.964 0.25 1 424 93 93 LEU CB C 44.502 0.25 1 425 93 93 LEU N N 119.877 0.25 1 426 94 94 ARG H H 8.542 0.025 1 427 94 94 ARG C C 176.693 0.25 1 428 94 94 ARG CA C 58.416 0.25 1 429 94 94 ARG CB C 30.451 0.25 1 430 94 94 ARG N N 122.732 0.25 1 431 95 95 ILE H H 7.510 0.025 1 432 95 95 ILE C C 174.497 0.25 1 433 95 95 ILE CA C 59.957 0.25 1 434 95 95 ILE CB C 39.737 0.25 1 435 95 95 ILE N N 117.478 0.25 1 436 96 96 VAL H H 8.646 0.025 1 437 96 96 VAL CA C 59.750 0.25 1 438 96 96 VAL CB C 32.645 0.25 1 439 96 96 VAL N N 127.920 0.25 1 440 97 97 PRO C C 176.695 0.25 1 441 97 97 PRO CA C 63.161 0.25 1 442 97 97 PRO CB C 31.533 0.25 1 443 98 98 GLU H H 7.748 0.025 1 444 98 98 GLU C C 175.767 0.25 1 445 98 98 GLU CA C 57.039 0.25 1 446 98 98 GLU CB C 29.229 0.25 1 447 98 98 GLU N N 119.793 0.25 1 448 99 99 LEU H H 8.458 0.025 1 449 99 99 LEU C C 176.866 0.25 1 450 99 99 LEU CA C 54.107 0.25 1 451 99 99 LEU CB C 44.444 0.25 1 452 99 99 LEU N N 122.812 0.25 1 453 100 100 THR H H 8.064 0.025 1 454 100 100 THR C C 172.622 0.25 1 455 100 100 THR CA C 61.792 0.25 1 456 100 100 THR CB C 71.052 0.25 1 457 100 100 THR N N 117.978 0.25 1 458 101 101 PHE H H 8.509 0.025 1 459 101 101 PHE C C 174.453 0.25 1 460 101 101 PHE CA C 57.996 0.25 1 461 101 101 PHE CB C 41.715 0.25 1 462 101 101 PHE N N 123.995 0.25 1 463 102 102 PHE H H 9.080 0.025 1 464 102 102 PHE C C 174.440 0.25 1 465 102 102 PHE CA C 56.898 0.25 1 466 102 102 PHE CB C 44.230 0.25 1 467 102 102 PHE N N 119.546 0.25 1 468 103 103 TYR H H 9.006 0.025 1 469 103 103 TYR C C 174.369 0.25 1 470 103 103 TYR CA C 57.401 0.25 1 471 103 103 TYR CB C 39.498 0.25 1 472 103 103 TYR N N 122.653 0.25 1 473 104 104 ASP H H 8.565 0.025 1 474 104 104 ASP CA C 53.316 0.25 1 475 104 104 ASP CB C 40.359 0.25 1 476 104 104 ASP N N 127.116 0.25 1 477 105 105 ASN H H 7.982 0.025 1 478 105 105 ASN C C 175.947 0.25 1 479 105 105 ASN CA C 53.274 0.25 1 480 105 105 ASN CB C 38.861 0.25 1 481 105 105 ASN N N 121.887 0.25 1 482 106 106 SER H H 8.265 0.025 1 483 106 106 SER C C 175.103 0.25 1 484 106 106 SER CA C 60.163 0.25 1 485 106 106 SER CB C 63.737 0.25 1 486 106 106 SER N N 115.697 0.25 1 487 107 107 LEU H H 7.946 0.025 1 488 107 107 LEU C C 177.883 0.25 1 489 107 107 LEU CA C 56.076 0.25 1 490 107 107 LEU CB C 42.154 0.25 1 491 107 107 LEU N N 123.013 0.25 1 492 108 108 VAL H H 7.825 0.025 1 493 108 108 VAL C C 176.822 0.25 1 494 108 108 VAL CA C 63.206 0.25 1 495 108 108 VAL CB C 32.621 0.25 1 496 108 108 VAL N N 119.584 0.25 1 497 109 109 GLU H H 8.302 0.025 1 498 109 109 GLU C C 177.178 0.25 1 499 109 109 GLU CA C 56.955 0.25 1 500 109 109 GLU CB C 28.844 0.25 1 501 109 109 GLU N N 122.683 0.25 1 502 110 110 GLY H H 8.268 0.025 1 503 110 110 GLY C C 174.625 0.25 1 504 110 110 GLY CA C 45.725 0.25 1 505 110 110 GLY N N 108.832 0.25 1 506 111 111 MET H H 8.029 0.025 1 507 111 111 MET CA C 56.018 0.25 1 508 111 111 MET CB C 30.753 0.25 1 509 111 111 MET N N 119.622 0.25 1 510 112 112 ARG H H 7.979 0.025 1 511 112 112 ARG CA C 57.555 0.25 1 512 112 112 ARG CB C 33.553 0.25 1 513 112 112 ARG N N 126.550 0.25 1 514 113 113 MET CA C 58.698 0.25 1 515 114 114 SER H H 8.870 0.025 1 516 114 114 SER C C 174.519 0.25 1 517 114 114 SER CA C 58.883 0.25 1 518 114 114 SER CB C 64.073 0.25 1 519 114 114 SER N N 122.330 0.25 1 520 115 115 ASN H H 8.368 0.025 1 521 115 115 ASN C C 175.163 0.25 1 522 115 115 ASN CA C 53.660 0.25 1 523 115 115 ASN CB C 38.799 0.25 1 524 115 115 ASN N N 120.234 0.25 1 525 116 116 LEU H H 8.041 0.025 1 526 116 116 LEU C C 177.468 0.25 1 527 116 116 LEU CA C 55.707 0.25 1 528 116 116 LEU CB C 42.600 0.25 1 529 116 116 LEU N N 121.697 0.25 1 530 117 117 VAL H H 8.055 0.025 1 531 117 117 VAL C C 176.534 0.25 1 532 117 117 VAL CA C 62.700 0.25 1 533 117 117 VAL CB C 32.678 0.25 1 534 117 117 VAL N N 120.722 0.25 1 535 118 118 THR H H 8.118 0.025 1 536 118 118 THR C C 174.658 0.25 1 537 118 118 THR CA C 62.096 0.25 1 538 118 118 THR CB C 69.930 0.25 1 539 118 118 THR N N 117.157 0.25 1 540 119 119 SER H H 8.194 0.025 1 541 119 119 SER C C 174.574 0.25 1 542 119 119 SER CA C 58.577 0.25 1 543 119 119 SER CB C 64.047 0.25 1 544 119 119 SER N N 117.948 0.25 1 545 120 120 VAL H H 8.064 0.025 1 546 120 120 VAL C C 176.244 0.25 1 547 120 120 VAL CA C 62.667 0.25 1 548 120 120 VAL CB C 32.540 0.25 1 549 120 120 VAL N N 121.869 0.25 1 550 121 121 VAL H H 8.076 0.025 1 551 121 121 VAL C C 176.999 0.25 1 552 121 121 VAL CA C 63.350 0.25 1 553 121 121 VAL CB C 32.171 0.25 1 554 121 121 VAL N N 123.932 0.25 1 555 122 122 LYS H H 8.473 0.025 1 556 122 122 LYS CA C 56.392 0.25 1 557 122 122 LYS CB C 29.565 0.25 1 558 122 122 LYS N N 120.748 0.25 1 559 123 123 HIS H H 8.374 0.025 1 560 123 123 HIS C C 174.468 0.25 1 561 123 123 HIS CA C 55.681 0.25 1 562 123 123 HIS CB C 29.004 0.25 1 563 123 123 HIS N N 125.037 0.25 1 564 124 124 ASP H H 8.465 0.025 1 565 124 124 ASP C C 176.071 0.25 1 566 124 124 ASP CA C 54.381 0.25 1 567 124 124 ASP CB C 40.162 0.25 1 568 124 124 ASP N N 121.185 0.25 1 569 125 125 GLU H H 8.419 0.025 1 570 125 125 GLU C C 176.451 0.25 1 571 125 125 GLU CA C 56.669 0.25 1 572 125 125 GLU CB C 29.285 0.25 1 573 125 125 GLU N N 120.923 0.25 1 574 126 126 GLU H H 8.276 0.025 1 575 126 126 GLU CA C 56.636 0.25 1 576 126 126 GLU CB C 29.268 0.25 1 577 126 126 GLU N N 121.031 0.25 1 578 127 127 ARG H H 8.125 0.025 1 579 127 127 ARG C C 176.289 0.25 1 580 127 127 ARG CA C 56.429 0.25 1 581 127 127 ARG CB C 29.190 0.25 1 582 127 127 ARG N N 120.332 0.25 1 583 128 128 ARG H H 8.214 0.025 1 584 128 128 ARG C C 176.238 0.25 1 585 128 128 ARG CA C 56.278 0.25 1 586 128 128 ARG CB C 30.799 0.25 1 587 128 128 ARG N N 121.849 0.25 1 588 129 129 VAL H H 8.128 0.025 1 589 129 129 VAL C C 175.631 0.25 1 590 129 129 VAL CA C 62.299 0.25 1 591 129 129 VAL CB C 32.835 0.25 1 592 129 129 VAL N N 121.248 0.25 1 593 130 130 ASN H H 8.512 0.025 1 594 130 130 ASN CA C 51.202 0.25 1 595 130 130 ASN CB C 39.044 0.25 1 596 130 130 ASN N N 123.534 0.25 1 597 131 131 PRO C C 176.986 0.25 1 598 131 131 PRO CA C 63.909 0.25 1 599 131 131 PRO CB C 32.096 0.25 1 600 132 132 ASP H H 8.280 0.025 1 601 132 132 ASP C C 175.823 0.25 1 602 132 132 ASP CA C 54.216 0.25 1 603 132 132 ASP CB C 39.791 0.25 1 604 132 132 ASP N N 118.318 0.25 1 605 133 133 ASP H H 8.119 0.025 1 606 133 133 ASP C C 176.243 0.25 1 607 133 133 ASP CA C 54.025 0.25 1 608 133 133 ASP CB C 39.866 0.25 1 609 133 133 ASP N N 120.281 0.25 1 610 134 134 SER H H 8.188 0.025 1 611 134 134 SER C C 175.066 0.25 1 612 134 134 SER CA C 59.233 0.25 1 613 134 134 SER CB C 63.946 0.25 1 614 134 134 SER N N 116.099 0.25 1 615 135 135 LYS H H 8.172 0.025 1 616 135 135 LYS CA C 56.782 0.25 1 617 135 135 LYS CB C 32.737 0.25 1 618 135 135 LYS N N 122.275 0.25 1 619 136 136 GLU H H 8.652 0.025 1 620 136 136 GLU C C 176.178 0.25 1 621 136 136 GLU CA C 56.741 0.25 1 622 136 136 GLU CB C 29.346 0.25 1 623 136 136 GLU N N 117.576 0.25 1 624 137 137 ASP H H 8.139 0.025 1 625 137 137 ASP C C 176.482 0.25 1 626 137 137 ASP CA C 53.929 0.25 1 627 137 137 ASP CB C 40.068 0.25 1 628 137 137 ASP N N 120.040 0.25 1 629 138 138 GLY H H 8.227 0.025 1 630 138 138 GLY C C 174.697 0.25 1 631 138 138 GLY CA C 45.683 0.25 1 632 138 138 GLY N N 109.189 0.25 1 633 139 139 SER H H 8.159 0.025 1 634 139 139 SER C C 174.654 0.25 1 635 139 139 SER CA C 59.079 0.25 1 636 139 139 SER CB C 63.822 0.25 1 637 139 139 SER N N 116.057 0.25 1 638 140 140 TRP H H 7.953 0.025 1 639 140 140 TRP C C 176.351 0.25 1 640 140 140 TRP CA C 57.419 0.25 1 641 140 140 TRP CB C 29.455 0.25 1 642 140 140 TRP N N 121.993 0.25 1 643 141 141 SER H H 7.909 0.025 1 644 141 141 SER C C 173.832 0.25 1 645 141 141 SER CA C 58.453 0.25 1 646 141 141 SER CB C 63.933 0.25 1 647 141 141 SER N N 116.420 0.25 1 648 142 142 HIS H H 8.089 0.025 1 649 142 142 HIS CA C 53.464 0.25 1 650 142 142 HIS CB C 28.601 0.25 1 651 142 142 HIS N N 119.956 0.25 1 652 144 144 GLN H H 8.142 0.025 1 653 144 144 GLN CA C 57.449 0.25 1 654 144 144 GLN N N 117.496 0.25 1 655 145 145 PHE H H 8.192 0.025 1 656 145 145 PHE CA C 56.072 0.25 1 657 145 145 PHE CB C 39.793 0.25 1 658 145 145 PHE N N 122.121 0.25 1 659 146 146 GLU C C 174.431 0.25 1 660 146 146 GLU CA C 55.320 0.25 1 661 146 146 GLU CB C 28.864 0.25 1 662 147 147 LYS H H 8.343 0.025 1 663 147 147 LYS CA C 55.320 0.25 1 664 147 147 LYS CB C 33.266 0.25 1 665 147 147 LYS N N 122.106 0.25 1 stop_ save_