data_15820 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; RRM1 of hnRNPLL ; _BMRB_accession_number 15820 _BMRB_flat_file_name bmr15820.str _Entry_type original _Submission_date 2008-06-24 _Accession_date 2008-06-24 _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 Otting Gottfried . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 96 "13C chemical shifts" 292 "15N chemical shifts" 96 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-02-13 original author . stop_ _Original_release_date 2009-02-13 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Memory T cell RNA rearrangement programmed by heterogeneous nuclear ribonucleoprotein hnRNPLL' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 19100700 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Wu Zuopeng . . 2 Jia Xinying . . 3 'de la Cruz' Laura . . 4 Su Xun-Cheng . . 5 Marzolf Bruz . . 6 Troisch Pamela . . 7 Zak Daniel . . 8 Hamilton Adam . . 9 Whittle Belinda . . 10 Yu Di . . 11 Sheahan Daniel . . 12 Bertram Edward . . 13 Alderem Alan . . 14 Otting Gottfried . . 15 Goodnow Christopher . . 16 Hoyne Gerard . . stop_ _Journal_abbreviation Immunity _Journal_volume 29 _Journal_issue 6 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 863 _Page_last 875 _Year 2008 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'RRM1 of hnRNPLL' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'RRM1 of hnRNPLL' $RRM1 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_RRM1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common RRM1 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 112 _Mol_residue_sequence ; MHHHHHHMLSTEGGGSHHKV SVSPVVHVRGLCESVVEADL VEALEKFGTICYVMMMPFKR QALVEFENIDSAKECVTFAA DVPVYIAGQQAFFNYSTSKR ITRPGNTDDPSG ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -7 MET 2 -6 HIS 3 -5 HIS 4 -4 HIS 5 -3 HIS 6 -2 HIS 7 -1 HIS 8 0 MET 9 110 LEU 10 111 SER 11 112 THR 12 113 GLU 13 114 GLY 14 115 GLY 15 116 GLY 16 117 SER 17 118 HIS 18 119 HIS 19 120 LYS 20 121 VAL 21 122 SER 22 123 VAL 23 124 SER 24 125 PRO 25 126 VAL 26 127 VAL 27 128 HIS 28 129 VAL 29 130 ARG 30 131 GLY 31 132 LEU 32 133 CYS 33 134 GLU 34 135 SER 35 136 VAL 36 137 VAL 37 138 GLU 38 139 ALA 39 140 ASP 40 141 LEU 41 142 VAL 42 143 GLU 43 144 ALA 44 145 LEU 45 146 GLU 46 147 LYS 47 148 PHE 48 149 GLY 49 150 THR 50 151 ILE 51 152 CYS 52 153 TYR 53 154 VAL 54 155 MET 55 156 MET 56 157 MET 57 158 PRO 58 159 PHE 59 160 LYS 60 161 ARG 61 162 GLN 62 163 ALA 63 164 LEU 64 165 VAL 65 166 GLU 66 167 PHE 67 168 GLU 68 169 ASN 69 170 ILE 70 171 ASP 71 172 SER 72 173 ALA 73 174 LYS 74 175 GLU 75 176 CYS 76 177 VAL 77 178 THR 78 179 PHE 79 180 ALA 80 181 ALA 81 182 ASP 82 183 VAL 83 184 PRO 84 185 VAL 85 186 TYR 86 187 ILE 87 188 ALA 88 189 GLY 89 190 GLN 90 191 GLN 91 192 ALA 92 193 PHE 93 194 PHE 94 195 ASN 95 196 TYR 96 197 SER 97 198 THR 98 199 SER 99 200 LYS 100 201 ARG 101 202 ILE 102 203 THR 103 204 ARG 104 205 PRO 105 206 GLY 106 207 ASN 107 208 THR 108 209 ASP 109 210 ASP 110 211 PRO 111 212 SER 112 213 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-07-08 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 DBJ BAB28521 "unnamed protein product [Mus musculus]" 92.86 588 100.00 100.00 1.25e-64 DBJ BAC28858 "unnamed protein product [Mus musculus]" 92.86 326 100.00 100.00 4.85e-68 DBJ BAE02506 "unnamed protein product [Macaca fascicularis]" 52.68 437 98.31 98.31 1.71e-31 DBJ BAE27500 "unnamed protein product [Mus musculus]" 92.86 670 100.00 100.00 1.34e-64 DBJ BAE42243 "unnamed protein product [Mus musculus]" 52.68 172 100.00 100.00 1.50e-34 EMBL CAH56358 "hypothetical protein [Homo sapiens]" 87.50 216 98.98 98.98 1.82e-63 GB AAH08217 "HNRPLL protein [Homo sapiens]" 90.18 275 98.02 98.02 3.04e-64 GB AAH12849 "Hnrpll protein [Mus musculus]" 92.86 594 100.00 100.00 8.32e-65 GB AAH17480 "Heterogeneous nuclear ribonucleoprotein L-like [Homo sapiens]" 90.18 542 98.02 98.02 1.63e-61 GB AAI23452 "Heterogeneous nuclear ribonucleoprotein L-like [Bos taurus]" 90.18 541 98.02 98.02 1.52e-61 GB AAN76189 "BLOCK24 variant [Homo sapiens]" 90.18 537 98.02 98.02 1.76e-61 REF NP_001070368 "heterogeneous nuclear ribonucleoprotein L-like [Bos taurus]" 90.18 541 98.02 98.02 1.52e-61 REF NP_001136122 "heterogeneous nuclear ribonucleoprotein L-like isoform 2 [Homo sapiens]" 90.18 537 98.02 98.02 1.76e-61 REF NP_001267087 "heterogeneous nuclear ribonucleoprotein L-like [Pan troglodytes]" 90.18 513 98.02 98.02 9.74e-62 REF NP_612403 "heterogeneous nuclear ribonucleoprotein L-like isoform 1 [Homo sapiens]" 90.18 542 98.02 98.02 1.63e-61 REF NP_659051 "heterogeneous nuclear ribonucleoprotein L-like [Mus musculus]" 92.86 591 100.00 100.00 7.66e-65 SP Q8WVV9 "RecName: Full=Heterogeneous nuclear ribonucleoprotein L-like; Short=hnRNPLL; AltName: Full=Stromal RNA-regulating factor" 90.18 542 98.02 98.02 1.63e-61 SP Q921F4 "RecName: Full=Heterogeneous nuclear ribonucleoprotein L-like" 92.86 591 100.00 100.00 7.66e-65 TPG DAA24711 "TPA: heterogeneous nuclear ribonucleoprotein L-like [Bos taurus]" 90.18 541 98.02 98.02 1.52e-61 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $RRM1 Mouse 10090 Eukaryota Metazoa Mus musculus 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 $RRM1 'recombinant technology' . Escherichia coli . pETMCSIII 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 $RRM1 0.5-0.8 mM '[U-100% 13C; U-100% 15N]' H2O 90 % 'natural abundance' D2O 10 % '[U-100% 2H]' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $RRM1 0.5-0.8 mM '[U-100% 15N]' H2O 90 % 'natural abundance' D2O 10 % '[U-100% 2H]' stop_ save_ ############################ # Computer software used # ############################ save_XEASY _Saveframe_category software _Name XEASY _Version . loop_ _Vendor _Address _Electronic_address 'Bartels et al.' . . 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_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_1H-15N_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-15N_TOCSY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N TOCSY' _Sample_label $sample_1 save_ save_3D_HNHA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHA' _Sample_label $sample_1 save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_2 save_ save_3D_HNCA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_2 save_ save_3D_HN(CO)CA_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_2 save_ save_3D_CBCA(CO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_2 save_ save_3D_HNCACB_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HNCACB_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_2 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' 100 . mM pH 7.2 . pH pressure 1 . atm temperature 298 . 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 0.00 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . 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 '3D HNCO' '3D HNCA' '3D HNCACB' stop_ loop_ _Sample_label $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'RRM1 of hnRNPLL' _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 1 110 9 LEU H H 8.192 0.000 1 2 110 9 LEU C C 173.811 0.000 . 3 110 9 LEU CA C 60.225 0.000 . 4 110 9 LEU CB C 31.643 0.000 . 5 110 9 LEU N N 122.713 0.000 . 6 111 10 SER H H 8.544 0.002 1 7 111 10 SER C C 172.329 0.000 . 8 111 10 SER CA C 55.660 0.000 . 9 111 10 SER CB C 60.991 0.000 . 10 111 10 SER N N 116.137 0.000 . 11 112 11 THR H H 8.092 0.001 1 12 112 11 THR C C 172.145 0.000 . 13 112 11 THR CA C 57.805 1.720 . 14 112 11 THR CB C 66.718 0.000 . 15 112 11 THR N N 115.041 0.000 . 16 113 12 GLU H H 8.290 0.080 1 17 113 12 GLU C C 174.338 0.000 . 18 113 12 GLU CA C 54.027 0.028 . 19 113 12 GLU CB C 27.268 0.000 . 20 113 12 GLU N N 122.713 3.084 . 21 114 13 GLY H H 8.371 0.004 1 22 114 13 GLY C C 172.112 0.000 . 23 114 13 GLY CA C 42.554 0.111 . 24 114 13 GLY N N 109.835 0.000 . 25 115 14 GLY H H 8.248 0.004 1 26 115 14 GLY CA C 42.507 0.000 . 27 115 14 GLY N N 108.466 0.000 . 28 118 17 HIS C C 174.354 0.000 . 29 118 17 HIS CA C 51.798 0.019 . 30 118 17 HIS CB C 28.524 0.222 . 31 119 18 HIS H H 8.054 0.003 1 32 119 18 HIS C C 172.414 0.000 . 33 119 18 HIS CA C 52.864 0.080 . 34 119 18 HIS CB C 28.373 0.000 . 35 119 18 HIS N N 119.699 0.159 . 36 120 19 LYS H H 8.188 0.003 1 37 120 19 LYS C C 173.323 0.000 . 38 120 19 LYS CA C 52.989 0.305 . 39 120 19 LYS CB C 30.086 0.125 . 40 120 19 LYS N N 122.713 0.000 . 41 121 20 VAL H H 8.111 0.003 1 42 121 20 VAL C C 172.989 0.000 . 43 121 20 VAL CA C 59.154 0.097 . 44 121 20 VAL CB C 30.360 0.068 . 45 121 20 VAL N N 122.439 0.159 . 46 122 21 SER H H 8.242 0.003 1 47 122 21 SER C C 170.634 0.000 . 48 122 21 SER CA C 55.049 0.057 . 49 122 21 SER CB C 61.150 0.000 . 50 122 21 SER N N 120.795 0.000 . 51 123 22 VAL H H 7.583 0.002 1 52 123 22 VAL C C 171.695 0.000 . 53 123 22 VAL CA C 59.864 0.000 . 54 123 22 VAL CB C 29.062 0.035 . 55 123 22 VAL N N 119.699 0.000 . 56 124 23 SER H H 6.445 0.006 1 57 124 23 SER CA C 50.335 0.013 . 58 124 23 SER CB C 64.372 0.039 . 59 124 23 SER N N 118.603 0.157 . 60 125 24 PRO C C 172.220 0.000 . 61 125 24 PRO CA C 61.339 0.000 . 62 125 24 PRO CB C 28.859 0.000 . 63 126 25 VAL H H 8.360 0.004 1 64 126 25 VAL C C 172.035 0.000 . 65 126 25 VAL CA C 58.246 0.000 . 66 126 25 VAL CB C 28.324 0.137 . 67 126 25 VAL N N 118.603 0.000 . 68 127 26 VAL H H 9.555 0.002 1 69 127 26 VAL C C 170.975 0.000 . 70 127 26 VAL CA C 58.246 0.000 . 71 127 26 VAL CB C 31.841 0.040 . 72 127 26 VAL N N 126.274 0.000 . 73 128 27 HIS H H 9.562 0.009 1 74 128 27 HIS C C 171.443 0.000 . 75 128 27 HIS CA C 51.655 0.025 . 76 128 27 HIS CB C 31.210 0.035 . 77 128 27 HIS N N 128.466 0.161 . 78 129 28 VAL H H 9.380 0.000 1 79 129 28 VAL C C 171.899 0.000 . 80 129 28 VAL CA C 58.056 0.000 . 81 129 28 VAL CB C 30.439 0.011 . 82 129 28 VAL N N 129.288 0.000 . 83 130 29 ARG H H 8.850 0.004 1 84 130 29 ARG C C 172.260 0.000 . 85 130 29 ARG CA C 50.976 0.000 . 86 130 29 ARG CB C 31.131 0.044 . 87 130 29 ARG N N 123.534 0.000 . 88 131 30 GLY H H 8.886 0.003 1 89 131 30 GLY C C 172.721 0.000 . 90 131 30 GLY CA C 42.830 0.000 . 91 131 30 GLY N N 107.370 0.000 . 92 132 31 LEU H H 7.321 0.001 1 93 132 31 LEU C C 174.165 0.000 . 94 132 31 LEU CA C 51.206 0.003 . 95 132 31 LEU CB C 39.590 0.007 . 96 132 31 LEU N N 117.233 0.000 . 97 133 32 CYS H H 8.439 0.003 1 98 133 32 CYS C C 172.779 0.000 . 99 133 32 CYS CA C 55.025 0.033 . 100 133 32 CYS CB C 25.112 0.009 . 101 133 32 CYS N N 118.877 0.151 . 102 134 33 GLU H H 9.059 0.006 1 103 134 33 GLU C C 173.898 0.000 . 104 134 33 GLU CA C 56.369 0.069 . 105 134 33 GLU CB C 26.755 0.123 . 106 134 33 GLU N N 122.713 0.160 . 107 135 34 SER H H 7.796 0.004 1 108 135 34 SER C C 171.704 0.000 . 109 135 34 SER CA C 55.740 0.000 . 110 135 34 SER CB C 60.435 0.000 . 111 135 34 SER N N 111.753 0.000 . 112 136 35 VAL H H 6.992 0.002 1 113 136 35 VAL C C 172.097 0.000 . 114 136 35 VAL CA C 60.435 0.000 . 115 136 35 VAL CB C 29.257 0.000 . 116 136 35 VAL N N 122.439 0.000 . 117 137 36 VAL H H 8.702 0.001 1 118 137 36 VAL C C 174.433 0.000 . 119 137 36 VAL CA C 56.438 0.000 . 120 137 36 VAL CB C 32.438 0.000 . 121 137 36 VAL N N 119.425 0.000 . 122 138 37 GLU H H 9.354 0.002 1 123 138 37 GLU C C 175.846 0.000 . 124 138 37 GLU CA C 58.675 0.000 . 125 138 37 GLU CB C 26.553 0.000 . 126 138 37 GLU N N 123.534 0.000 . 127 139 38 ALA H H 8.522 0.003 1 128 139 38 ALA C C 177.261 0.000 . 129 139 38 ALA CA C 52.394 0.000 . 130 139 38 ALA CB C 15.656 0.000 . 131 139 38 ALA N N 117.781 0.000 . 132 140 39 ASP H H 7.558 0.001 1 133 140 39 ASP C C 176.840 0.000 . 134 140 39 ASP CA C 54.487 0.000 . 135 140 39 ASP CB C 38.960 0.000 . 136 140 39 ASP N N 115.589 0.000 . 137 141 40 LEU H H 7.273 0.006 1 138 141 40 LEU C C 174.933 0.000 . 139 141 40 LEU CA C 55.487 0.000 . 140 141 40 LEU CB C 38.732 0.000 . 141 141 40 LEU N N 120.247 0.000 . 142 142 41 VAL H H 7.878 0.006 1 143 142 41 VAL C C 174.793 0.000 . 144 142 41 VAL CA C 64.146 0.000 . 145 142 41 VAL CB C 29.013 0.000 . 146 142 41 VAL N N 118.603 0.000 . 147 143 42 GLU H H 7.933 0.008 1 148 143 42 GLU C C 176.053 0.000 . 149 143 42 GLU CA C 56.438 0.000 . 150 143 42 GLU CB C 26.759 0.000 . 151 143 42 GLU N N 116.411 0.000 . 152 144 43 ALA H H 7.149 0.007 1 153 144 43 ALA C C 176.154 0.000 . 154 144 43 ALA CA C 51.252 0.000 . 155 144 43 ALA CB C 17.510 0.000 . 156 144 43 ALA N N 116.959 0.000 . 157 145 44 LEU H H 7.846 0.001 1 158 145 44 LEU C C 171.133 0.000 . 159 145 44 LEU CA C 52.377 0.031 . 160 145 44 LEU CB C 40.360 0.000 . 161 145 44 LEU N N 113.397 0.000 . 162 146 45 GLU H H 8.474 0.002 1 163 146 45 GLU C C 175.173 0.000 . 164 146 45 GLU CA C 55.712 0.030 . 165 146 45 GLU CB C 25.286 0.004 . 166 146 45 GLU N N 120.795 0.158 . 167 147 46 LYS H H 7.537 0.003 1 168 147 46 LYS C C 174.789 0.000 . 169 147 46 LYS CA C 54.773 0.000 . 170 147 46 LYS CB C 27.691 0.000 . 171 147 46 LYS N N 117.507 0.000 . 172 148 47 PHE H H 7.856 0.003 1 173 148 47 PHE C C 172.808 0.000 . 174 148 47 PHE CA C 56.581 0.000 . 175 148 47 PHE CB C 35.774 0.000 . 176 148 47 PHE N N 117.781 0.000 . 177 149 48 GLY H H 7.548 0.000 1 178 149 48 GLY C C 168.169 0.000 . 179 149 48 GLY CA C 41.498 0.000 . 180 149 48 GLY N N 107.370 0.000 . 181 150 49 THR H H 8.056 0.001 1 182 150 49 THR C C 172.511 0.000 . 183 150 49 THR CA C 61.434 0.000 . 184 150 49 THR CB C 67.019 0.000 . 185 150 49 THR N N 112.301 0.000 . 186 151 50 ILE H H 9.112 0.003 1 187 151 50 ILE C C 172.875 0.000 . 188 151 50 ILE CA C 58.627 0.000 . 189 151 50 ILE CB C 37.173 0.000 . 190 151 50 ILE N N 130.384 0.000 . 191 152 51 CYS H H 9.090 0.000 1 192 152 51 CYS C C 171.654 0.000 . 193 152 51 CYS CA C 56.153 0.000 . 194 152 51 CYS CB C 26.370 0.000 . 195 152 51 CYS N N 124.356 0.000 . 196 153 52 TYR H H 7.546 0.004 1 197 153 52 TYR C C 169.158 0.000 . 198 153 52 TYR CA C 56.606 0.000 . 199 153 52 TYR CB C 39.350 0.000 . 200 153 52 TYR N N 120.247 0.000 . 201 154 53 VAL H H 7.338 0.002 1 202 154 53 VAL C C 170.332 0.000 . 203 154 53 VAL CA C 57.866 0.000 . 204 154 53 VAL CB C 32.432 0.000 . 205 154 53 VAL N N 124.356 0.000 . 206 155 54 MET H H 9.122 0.007 1 207 155 54 MET C C 172.000 0.000 . 208 155 54 MET CA C 50.919 0.000 . 209 155 54 MET CB C 33.754 0.000 . 210 155 54 MET N N 125.726 0.000 . 211 156 55 MET H H 8.996 0.008 1 212 156 55 MET C C 173.892 0.000 . 213 156 55 MET CA C 51.299 0.000 . 214 156 55 MET CB C 28.624 0.000 . 215 156 55 MET N N 125.452 0.000 . 216 157 56 MET H H 8.218 0.003 1 217 157 56 MET CA C 50.728 0.000 . 218 157 56 MET CB C 30.489 0.000 . 219 157 56 MET N N 120.247 0.000 . 220 158 57 PRO C C 176.631 0.000 . 221 158 57 PRO CA C 52.470 0.000 . 222 158 57 PRO CB C 39.634 0.000 . 223 159 58 PHE H H 8.237 0.000 1 224 159 58 PHE C C 174.007 0.000 . 225 159 58 PHE CA C 56.815 0.133 . 226 159 58 PHE CB C 34.564 0.045 . 227 159 58 PHE N N 116.137 0.000 . 228 160 59 LYS H H 7.363 0.002 1 229 160 59 LYS C C 172.742 0.000 . 230 160 59 LYS CA C 52.252 0.000 . 231 160 59 LYS CB C 30.489 0.000 . 232 160 59 LYS N N 115.589 0.000 . 233 161 60 ARG H H 8.007 0.005 1 234 161 60 ARG C C 172.565 0.000 . 235 161 60 ARG CA C 54.125 0.019 . 236 161 60 ARG CB C 23.730 0.158 . 237 161 60 ARG N N 116.959 0.157 . 238 162 61 GLN H H 7.303 0.005 1 239 162 61 GLN C C 171.850 0.000 . 240 162 61 GLN CA C 50.538 0.000 . 241 162 61 GLN CB C 32.588 0.000 . 242 162 61 GLN N N 113.945 0.000 . 243 163 62 ALA H H 8.799 0.003 1 244 163 62 ALA C C 171.977 0.000 . 245 163 62 ALA CA C 49.016 0.000 . 246 163 62 ALA CB C 21.474 0.000 . 247 163 62 ALA N N 119.699 0.000 . 248 164 63 LEU H H 8.855 0.002 1 249 164 63 LEU C C 172.651 0.000 . 250 164 63 LEU CA C 50.633 0.000 . 251 164 63 LEU CB C 42.381 0.000 . 252 164 63 LEU N N 118.877 0.000 . 253 165 64 VAL H H 9.159 0.003 1 254 165 64 VAL C C 170.015 0.000 . 255 165 64 VAL CA C 58.341 0.000 . 256 165 64 VAL CB C 31.888 0.000 . 257 165 64 VAL N N 121.617 0.000 . 258 166 65 GLU H H 8.988 0.005 1 259 166 65 GLU C C 172.845 0.000 . 260 166 65 GLU CA C 51.870 0.000 . 261 166 65 GLU CB C 29.557 0.000 . 262 166 65 GLU N N 128.192 0.000 . 263 167 66 PHE H H 8.942 0.006 1 264 167 66 PHE C C 172.659 0.000 . 265 167 66 PHE CA C 56.295 0.000 . 266 167 66 PHE CB C 37.795 0.000 . 267 167 66 PHE N N 127.644 0.000 . 268 168 67 GLU H H 8.243 0.003 1 269 168 67 GLU C C 172.734 0.000 . 270 168 67 GLU CA C 56.343 0.000 . 271 168 67 GLU CB C 28.002 0.000 . 272 168 67 GLU N N 119.973 0.000 . 273 169 68 ASN H H 8.602 0.177 1 274 169 68 ASN C C 173.323 0.000 . 275 169 68 ASN CA C 52.326 3.881 . 276 169 68 ASN CB C 33.340 5.154 . 277 169 68 ASN N N 114.219 2.891 . 278 170 69 ILE H H 8.893 0.004 1 279 170 69 ILE C C 173.247 0.000 . 280 170 69 ILE CA C 62.047 0.042 . 281 170 69 ILE CB C 35.876 0.039 . 282 170 69 ILE N N 124.630 0.161 . 283 171 70 ASP H H 8.457 0.002 1 284 171 70 ASP C C 176.520 0.000 . 285 171 70 ASP CA C 54.627 0.039 . 286 171 70 ASP CB C 36.995 0.093 . 287 171 70 ASP N N 121.069 0.151 . 288 172 71 SER H H 7.760 0.004 1 289 172 71 SER C C 171.563 0.000 . 290 172 71 SER CA C 58.960 0.049 . 291 172 71 SER CB C 60.024 0.000 . 292 172 71 SER N N 116.959 0.128 . 293 173 72 ALA H H 6.497 0.004 1 294 173 72 ALA C C 176.063 0.000 . 295 173 72 ALA CA C 52.441 0.000 . 296 173 72 ALA CB C 17.354 0.000 . 297 173 72 ALA N N 123.260 0.000 . 298 174 73 LYS H H 7.967 0.004 1 299 174 73 LYS C C 177.681 0.000 . 300 174 73 LYS CA C 55.391 0.000 . 301 174 73 LYS CB C 29.557 0.000 . 302 174 73 LYS N N 116.137 0.000 . 303 175 74 GLU H H 8.051 0.003 1 304 175 74 GLU C C 174.146 0.000 . 305 175 74 GLU CA C 56.866 0.000 . 306 175 74 GLU CB C 26.137 0.000 . 307 175 74 GLU N N 122.439 0.000 . 308 176 75 CYS H H 7.411 0.004 1 309 176 75 CYS C C 171.827 0.000 . 310 176 75 CYS CA C 58.373 0.111 . 311 176 75 CYS CB C 23.629 0.021 . 312 176 75 CYS N N 118.329 0.160 . 313 177 76 VAL H H 7.886 0.001 1 314 177 76 VAL C C 176.258 0.000 . 315 177 76 VAL CA C 64.099 0.000 . 316 177 76 VAL CB C 28.779 0.000 . 317 177 76 VAL N N 115.589 0.000 . 318 178 77 THR H H 8.134 0.002 1 319 178 77 THR C C 174.061 0.000 . 320 178 77 THR CA C 63.433 0.000 . 321 178 77 THR CB C 66.397 0.000 . 322 178 77 THR N N 113.397 0.000 . 323 179 78 PHE H H 8.472 0.001 1 324 179 78 PHE C C 174.822 0.000 . 325 179 78 PHE CA C 59.073 0.000 . 326 179 78 PHE CB C 37.251 0.000 . 327 179 78 PHE N N 124.630 0.000 . 328 180 79 ALA H H 7.809 0.003 1 329 180 79 ALA C C 175.427 0.000 . 330 180 79 ALA CA C 49.701 0.033 . 331 180 79 ALA CB C 16.715 0.017 . 332 180 79 ALA N N 117.233 0.160 . 333 181 80 ALA H H 7.214 0.003 1 334 181 80 ALA C C 175.663 0.000 . 335 181 80 ALA CA C 51.068 0.092 . 336 181 80 ALA CB C 15.533 0.044 . 337 181 80 ALA N N 119.151 0.161 . 338 182 81 ASP H H 7.126 0.000 1 339 182 81 ASP C C 172.738 0.000 . 340 182 81 ASP CA C 52.126 0.000 . 341 182 81 ASP CB C 40.671 0.000 . 342 182 81 ASP N N 115.315 0.000 . 343 183 82 VAL H H 7.997 0.004 1 344 183 82 VAL CA C 56.128 0.000 . 345 183 82 VAL CB C 31.033 0.000 . 346 183 82 VAL N N 123.260 0.000 . 347 184 83 PRO C C 173.991 0.000 . 348 184 83 PRO CA C 60.085 0.000 . 349 184 83 PRO CB C 29.868 0.000 . 350 185 84 VAL H H 8.750 0.003 1 351 185 84 VAL C C 171.484 0.000 . 352 185 84 VAL CA C 59.027 0.000 . 353 185 84 VAL CB C 30.800 0.000 . 354 185 84 VAL N N 125.452 0.000 . 355 186 85 TYR H H 8.451 0.008 1 356 186 85 TYR C C 172.979 0.000 . 357 186 85 TYR CA C 54.150 0.000 . 358 186 85 TYR CB C 37.484 0.000 . 359 186 85 TYR N N 124.904 0.000 . 360 187 86 ILE H H 8.590 0.004 1 361 187 86 ILE C C 173.012 0.000 . 362 187 86 ILE CA C 57.279 0.000 . 363 187 86 ILE CB C 36.008 0.000 . 364 187 86 ILE N N 121.069 0.000 . 365 188 87 ALA H H 9.452 0.004 1 366 188 87 ALA C C 174.356 0.000 . 367 188 87 ALA CA C 50.148 0.000 . 368 188 87 ALA CB C 14.712 0.000 . 369 188 87 ALA N N 131.754 0.000 . 370 189 88 GLY H H 8.487 0.000 1 371 189 88 GLY C C 171.154 0.000 . 372 189 88 GLY CA C 42.556 0.000 . 373 189 88 GLY N N 101.068 0.000 . 374 190 89 GLN H H 7.708 0.003 1 375 190 89 GLN C C 172.495 0.000 . 376 190 89 GLN CA C 51.298 0.000 . 377 190 89 GLN CB C 29.090 0.000 . 378 190 89 GLN N N 118.877 0.000 . 379 191 90 GLN H H 9.141 0.004 1 380 191 90 GLN C C 170.628 0.000 . 381 191 90 GLN CA C 54.637 0.018 . 382 191 90 GLN CB C 24.637 0.000 . 383 191 90 GLN N N 129.836 0.152 . 384 192 91 ALA H H 7.940 0.606 1 385 192 91 ALA C C 170.996 0.000 . 386 192 91 ALA CA C 46.605 0.000 . 387 192 91 ALA CB C 24.505 0.000 . 388 192 91 ALA N N 128.192 0.803 . 389 193 92 PHE H H 7.739 0.094 1 390 193 92 PHE C C 172.415 0.000 . 391 193 92 PHE CA C 53.828 0.000 . 392 193 92 PHE CB C 28.896 9.987 . 393 193 92 PHE N N 115.315 6.058 . 394 194 93 PHE H H 8.760 0.001 1 395 194 93 PHE C C 172.025 0.000 . 396 194 93 PHE CA C 54.380 0.000 . 397 194 93 PHE CB C 40.127 0.000 . 398 194 93 PHE N N 119.425 0.000 . 399 195 94 ASN H H 8.646 0.006 1 400 195 94 ASN C C 175.871 0.000 . 401 195 94 ASN CA C 48.905 0.000 . 402 195 94 ASN CB C 39.116 0.000 . 403 195 94 ASN N N 119.151 0.000 . 404 196 95 TYR H H 8.478 0.004 1 405 196 95 TYR C C 173.609 0.000 . 406 196 95 TYR CA C 56.699 0.212 . 407 196 95 TYR CB C 36.191 0.028 . 408 196 95 TYR N N 120.795 0.161 . 409 197 96 SER H H 8.795 0.004 1 410 197 96 SER C C 172.656 0.000 . 411 197 96 SER CA C 53.920 0.000 . 412 197 96 SER CB C 61.190 0.000 . 413 197 96 SER N N 115.041 0.000 . 414 198 97 THR H H 8.033 0.000 1 415 198 97 THR C C 173.570 0.000 . 416 198 97 THR CA C 60.867 0.000 . 417 198 97 THR CB C 65.931 0.000 . 418 198 97 THR N N 115.315 0.000 . 419 199 98 SER H H 8.509 0.001 1 420 199 98 SER C C 171.126 0.000 . 421 199 98 SER CA C 55.806 0.000 . 422 199 98 SER CB C 61.190 0.000 . 423 199 98 SER N N 118.877 0.000 . 424 200 99 LYS H H 8.693 0.000 1 425 200 99 LYS C C 172.425 0.000 . 426 200 99 LYS CA C 53.053 0.024 . 427 200 99 LYS CB C 29.860 0.085 . 428 200 99 LYS N N 121.343 0.000 . 429 201 100 ARG H H 7.374 0.004 1 430 201 100 ARG C C 172.519 0.000 . 431 201 100 ARG CA C 52.360 0.113 . 432 201 100 ARG CB C 30.116 0.062 . 433 201 100 ARG N N 115.589 0.157 . 434 202 101 ILE H H 8.690 0.002 1 435 202 101 ILE C C 173.633 0.000 . 436 202 101 ILE CA C 59.252 0.000 . 437 202 101 ILE CB C 35.697 0.000 . 438 202 101 ILE N N 125.452 0.000 . 439 203 102 THR H H 8.478 0.003 1 440 203 102 THR C C 170.697 0.000 . 441 203 102 THR CA C 60.851 0.000 . 442 203 102 THR CB C 66.039 0.000 . 443 203 102 THR N N 124.904 0.000 . 444 204 103 ARG H H 8.221 0.004 1 445 204 103 ARG CA C 50.546 0.000 . 446 204 103 ARG CB C 26.577 0.000 . 447 204 103 ARG N N 126.822 0.000 . 448 205 104 PRO C C 174.668 0.000 . 449 205 104 PRO CA C 60.544 0.041 . 450 205 104 PRO CB C 29.307 0.000 . 451 206 105 GLY H H 8.463 0.005 1 452 206 105 GLY C C 171.200 0.000 . 453 206 105 GLY CA C 42.355 0.028 . 454 206 105 GLY N N 109.561 0.157 . 455 207 106 ASN H H 8.244 0.006 1 456 207 106 ASN C C 172.813 0.000 . 457 207 106 ASN CA C 50.412 0.000 . 458 207 106 ASN CB C 36.346 0.000 . 459 207 106 ASN N N 118.877 0.000 . 460 208 107 THR H H 8.166 0.001 1 461 208 107 THR C C 171.493 0.000 . 462 208 107 THR CA C 59.030 0.000 . 463 208 107 THR CB C 67.039 0.000 . 464 208 107 THR N N 113.671 0.000 . 465 209 108 ASP H H 8.268 0.002 1 466 209 108 ASP C C 172.890 0.000 . 467 209 108 ASP CA C 51.612 0.000 . 468 209 108 ASP CB C 38.346 0.000 . 469 209 108 ASP N N 121.891 0.000 . 470 210 109 ASP H H 8.118 0.005 1 471 210 109 ASP CA C 49.480 0.000 . 472 210 109 ASP CB C 38.346 0.000 . 473 210 109 ASP N N 121.617 0.000 . 474 211 110 PRO C C 174.478 0.000 . 475 211 110 PRO CA C 60.674 0.000 . 476 211 110 PRO CB C 29.277 0.030 . 477 212 111 SER H H 8.402 0.004 1 478 212 111 SER C C 171.359 0.000 . 479 212 111 SER CA C 55.810 0.023 . 480 212 111 SER CB C 61.345 0.000 . 481 212 111 SER N N 116.137 0.151 . 482 213 112 GLY H H 7.845 0.000 1 483 213 112 GLY CA C 43.394 0.000 . 484 213 112 GLY N N 116.685 0.000 . stop_ save_