data_19610 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution NMR structure of the p300 Taz2:ETAD1 complex ; _BMRB_accession_number 19610 _BMRB_flat_file_name bmr19610.str _Entry_type original _Submission_date 2013-11-12 _Accession_date 2013-11-12 _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 Langelaan David N. . 2 Smith Steven P. . 3 Chitayat Seth . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 721 "13C chemical shifts" 558 "15N chemical shifts" 134 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2014-11-10 original author . stop_ _Original_release_date 2014-11-10 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution NMR structure of the p300 Taz2:ETAD1 complex' _Citation_status 'in preparation' _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 Langelaan David . . 2 Smith Steven . . 3 Chitayat Seth . . stop_ _Journal_abbreviation 'Not known' _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 . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'p300 Taz2:ETAD1 complex' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'E2A ETAD1' $ETAD1 'p300 Taz2' $Taz2 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_ETAD1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common ETAD1 _Molecular_mass 4267.949 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 39 _Mol_residue_sequence ; GSMNQPQRMAPVGTDKELSD LLDFSMMFPLPVTNGKGRP ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 MET 4 ASN 5 GLN 6 PRO 7 GLN 8 ARG 9 MET 10 ALA 11 PRO 12 VAL 13 GLY 14 THR 15 ASP 16 LYS 17 GLU 18 LEU 19 SER 20 ASP 21 LEU 22 LEU 23 ASP 24 PHE 25 SER 26 MET 27 MET 28 PHE 29 PRO 30 LEU 31 PRO 32 VAL 33 THR 34 ASN 35 GLY 36 LYS 37 GLY 38 ARG 39 PRO stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-08-05 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 2MH0 "Solution Nmr Structure Of The P300 Taz2:etad1 Complex" 100.00 39 100.00 100.00 1.84e-18 DBJ BAG10911 "transcription factor E2-alpha [synthetic construct]" 94.87 654 100.00 100.00 8.86e-16 GB AAA52331 "e12 protein [Homo sapiens]" 79.49 648 100.00 100.00 3.93e-11 GB AAA58445 "E2A/HLF fusion protein [Homo sapiens]" 94.87 574 100.00 100.00 7.87e-16 GB AAA61146 "transcription factor E2A [Homo sapiens]" 94.87 654 100.00 100.00 8.86e-16 GB AAC99797 "transcription factor E2A [AA 1- 48] [Homo sapiens]" 94.87 48 100.00 100.00 2.68e-17 GB AAI10580 "TCF3 protein [Homo sapiens]" 94.87 651 100.00 100.00 8.08e-16 REF NP_001129611 "transcription factor E2-alpha isoform E47 [Homo sapiens]" 94.87 651 100.00 100.00 8.08e-16 REF NP_003191 "transcription factor E2-alpha isoform E12 [Homo sapiens]" 94.87 654 100.00 100.00 8.86e-16 REF XP_002923565 "PREDICTED: LOW QUALITY PROTEIN: transcription factor E2-alpha [Ailuropoda melanoleuca]" 94.87 651 97.30 97.30 3.85e-15 REF XP_003788747 "PREDICTED: transcription factor E2-alpha [Otolemur garnettii]" 94.87 655 97.30 97.30 6.19e-15 REF XP_003805069 "PREDICTED: transcription factor E2-alpha isoform X4 [Pan paniscus]" 94.87 654 100.00 100.00 1.02e-15 SP P15923 "RecName: Full=Transcription factor E2-alpha; AltName: Full=Class B basic helix-loop-helix protein 21; Short=bHLHb21; AltName: F" 94.87 654 100.00 100.00 8.86e-16 stop_ save_ save_Taz2 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Taz2 _Molecular_mass 10107.968 _Mol_thiol_state . _Details . _Residue_count 92 _Mol_residue_sequence ; GSATQSPGDSRRLSIQRAIQ SLVHAAQCRNANCSLPSCQK MKRVVQHTKGCKRKTNGGCP ICKQLIALAAYHAKHCQENK CPVPFCLNIKQK ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1721 GLY 2 1722 SER 3 1723 ALA 4 1724 THR 5 1725 GLN 6 1726 SER 7 1727 PRO 8 1728 GLY 9 1729 ASP 10 1730 SER 11 1731 ARG 12 1732 ARG 13 1733 LEU 14 1734 SER 15 1735 ILE 16 1736 GLN 17 1737 ARG 18 1738 ALA 19 1739 ILE 20 1740 GLN 21 1741 SER 22 1742 LEU 23 1743 VAL 24 1744 HIS 25 1745 ALA 26 1746 ALA 27 1747 GLN 28 1748 CYS 29 1749 ARG 30 1750 ASN 31 1751 ALA 32 1752 ASN 33 1753 CYS 34 1754 SER 35 1755 LEU 36 1756 PRO 37 1757 SER 38 1758 CYS 39 1759 GLN 40 1760 LYS 41 1761 MET 42 1762 LYS 43 1763 ARG 44 1764 VAL 45 1765 VAL 46 1766 GLN 47 1767 HIS 48 1768 THR 49 1769 LYS 50 1770 GLY 51 1771 CYS 52 1772 LYS 53 1773 ARG 54 1774 LYS 55 1775 THR 56 1776 ASN 57 1777 GLY 58 1778 GLY 59 1779 CYS 60 1780 PRO 61 1781 ILE 62 1782 CYS 63 1783 LYS 64 1784 GLN 65 1785 LEU 66 1786 ILE 67 1787 ALA 68 1788 LEU 69 1789 ALA 70 1790 ALA 71 1791 TYR 72 1792 HIS 73 1793 ALA 74 1794 LYS 75 1795 HIS 76 1796 CYS 77 1797 GLN 78 1798 GLU 79 1799 ASN 80 1800 LYS 81 1801 CYS 82 1802 PRO 83 1803 VAL 84 1804 PRO 85 1805 PHE 86 1806 CYS 87 1807 LEU 88 1808 ASN 89 1809 ILE 90 1810 LYS 91 1811 GLN 92 1812 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-29 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 15944 TAZ2 97.83 90 100.00 100.00 4.58e-57 PDB 2K8F "Structural Basis For The Regulation Of P53 Function By P300" 97.83 90 100.00 100.00 4.58e-57 PDB 2MH0 "Solution Nmr Structure Of The P300 Taz2:etad1 Complex" 100.00 92 100.00 100.00 1.33e-58 PDB 3IO2 "Crystal Structure Of The Taz2 Domain Of P300" 97.83 114 100.00 100.00 1.61e-57 PDB 3T92 "Crystal Structure Of The Taz2:c/ebpepsilon-tad Chimera Protein" 97.83 121 100.00 100.00 6.30e-58 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $ETAD1 Human 9606 Eukaryota Metazoa Homo sapiens $Taz2 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 $ETAD1 'recombinant technology' . Escherichia coli . Pet21 $Taz2 'recombinant technology' . Escherichia coli . Pet21 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Sample1_ETAD _Saveframe_category sample _Sample_type solution _Details 'Labeled ETAD1, unlabeled Taz2 pH 6.5' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $ETAD1 1.4 mM '[U-99% 13C; U-99% 15N]' $Taz2 2 mM 'natural abundance' MES 20 mM 'natural abundance' 'sodium azide' 1 mM 'natural abundance' beta-mercaptoethanol 5 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_sample_2_Taz2 _Saveframe_category sample _Sample_type solution _Details 'Labeled Taz2 Unlabeled ETAD1 pH 6.5' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $ETAD1 3078 uM 'natural abundance' $Taz2 1038 uM '[U-99% 13C; U-99% 15N]' MES 20 mM 'natural abundance' 'sodium azide' 1 mM 'natural abundance' beta-mercaptoethanol 5 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_VNMRJ _Saveframe_category software _Name VNMRJ _Version . loop_ _Vendor _Address _Electronic_address Varian . . stop_ loop_ _Task collection stop_ _Details . save_ save_Analysis _Saveframe_category software _Name Analysis _Version 3 loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' 'peak picking' stop_ _Details . save_ save_CYANA _Saveframe_category software _Name CYANA _Version 2.1 loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ save_CNS _Saveframe_category software _Name CNS _Version . loop_ _Vendor _Address _Electronic_address 'Brunger, Adams, Clore, Gros, Nilges and Read' . . stop_ loop_ _Task refinement stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 500 _Details QANUC save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 800 _Details QANUC save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $Sample1_ETAD save_ save_3D_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $Sample1_ETAD save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $Sample1_ETAD save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $Sample1_ETAD save_ save_3D_HCACO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCACO' _Sample_label $Sample1_ETAD save_ save_3D_1H-15N_NOESY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $Sample1_ETAD save_ save_3D_HCCH-TOCSY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $Sample1_ETAD save_ save_3D_1H-13C_NOESY_aliphatic_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $Sample1_ETAD save_ save_3D_1H-13C_NOESY_aromatic_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aromatic' _Sample_label $Sample1_ETAD save_ save_2D_1H-15N_HSQC_10 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_2_Taz2 save_ save_3D_HNCO_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_2_Taz2 save_ save_3D_HCACO_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCACO' _Sample_label $sample_2_Taz2 save_ save_3D_HNCACB_13 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_2_Taz2 save_ save_3D_CBCA(CO)NH_14 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_2_Taz2 save_ save_3D_1H-15N_NOESY_15 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_2_Taz2 save_ save_3D_HCCH-TOCSY_16 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_2_Taz2 save_ save_3D_1H-13C_NOESY_aliphatic_17 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $sample_2_Taz2 save_ save_3D_1H-13C_NOESY_aromatic_18 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aromatic' _Sample_label $sample_2_Taz2 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' 0 . M pH 6.5 . pH pressure 1 . atm temperature 273 . 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 water C 13 protons ppm 4.85 internal indirect . . . 0.251449530 water H 1 protons ppm 4.85 internal direct . . . 1 water N 15 protons ppm 4.85 internal 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_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCACB' '3D HNCO' '3D HCACO' '3D 1H-15N NOESY' '3D HCCH-TOCSY' '3D 1H-13C NOESY aliphatic' '3D 1H-13C NOESY aromatic' stop_ loop_ _Sample_label $Sample1_ETAD $sample_2_Taz2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'E2A ETAD1' _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 GLY HA3 H 3.860 0.050 . 2 1 1 GLY CA C 43.379 0.500 . 3 2 2 SER HA H 4.472 0.050 . 4 2 2 SER HB2 H 3.843 0.050 . 5 2 2 SER HB3 H 3.831 0.050 . 6 2 2 SER C C 174.628 0.500 . 7 2 2 SER CA C 58.397 0.500 . 8 2 2 SER CB C 63.896 0.500 . 9 3 3 MET H H 8.627 0.050 . 10 3 3 MET HA H 4.490 0.050 . 11 3 3 MET HB2 H 1.986 0.050 . 12 3 3 MET HB3 H 2.071 0.050 . 13 3 3 MET HG2 H 2.579 0.050 . 14 3 3 MET HG3 H 2.514 0.050 . 15 3 3 MET C C 175.934 0.500 . 16 3 3 MET CA C 55.552 0.500 . 17 3 3 MET CB C 32.645 0.500 . 18 3 3 MET CG C 31.933 0.500 . 19 3 3 MET N N 122.147 0.500 . 20 4 4 ASN H H 8.497 0.050 . 21 4 4 ASN HA H 4.654 0.050 . 22 4 4 ASN HB2 H 2.695 0.050 . 23 4 4 ASN HB3 H 2.770 0.050 . 24 4 4 ASN HD21 H 6.943 0.050 . 25 4 4 ASN HD22 H 7.623 0.050 . 26 4 4 ASN C C 174.695 0.500 . 27 4 4 ASN CA C 53.237 0.500 . 28 4 4 ASN CB C 38.768 0.500 . 29 4 4 ASN CG C 176.993 0.500 . 30 4 4 ASN N N 119.930 0.500 . 31 4 4 ASN ND2 N 112.912 0.500 . 32 5 5 GLN H H 8.322 0.050 . 33 5 5 GLN HA H 4.593 0.050 . 34 5 5 GLN HB2 H 2.059 0.050 . 35 5 5 GLN HB3 H 1.891 0.050 . 36 5 5 GLN HG3 H 2.345 0.050 . 37 5 5 GLN HE21 H 6.903 0.050 . 38 5 5 GLN HE22 H 7.546 0.050 . 39 5 5 GLN C C 173.849 0.500 . 40 5 5 GLN CA C 53.724 0.500 . 41 5 5 GLN CB C 28.914 0.500 . 42 5 5 GLN CG C 33.475 0.500 . 43 5 5 GLN CD C 180.485 0.500 . 44 5 5 GLN N N 121.523 0.500 . 45 5 5 GLN NE2 N 112.656 0.500 . 46 6 6 PRO HA H 4.378 0.050 . 47 6 6 PRO HB2 H 2.265 0.050 . 48 6 6 PRO HB3 H 1.848 0.050 . 49 6 6 PRO HG2 H 1.982 0.050 . 50 6 6 PRO HD2 H 3.629 0.050 . 51 6 6 PRO HD3 H 3.744 0.050 . 52 6 6 PRO C C 176.816 0.500 . 53 6 6 PRO CA C 63.157 0.500 . 54 6 6 PRO CB C 32.086 0.500 . 55 6 6 PRO CG C 27.392 0.500 . 56 6 6 PRO CD C 50.575 0.500 . 57 7 7 GLN H H 8.576 0.050 . 58 7 7 GLN HA H 4.245 0.050 . 59 7 7 GLN HB2 H 2.039 0.050 . 60 7 7 GLN HB3 H 1.949 0.050 . 61 7 7 GLN HG3 H 2.360 0.050 . 62 7 7 GLN HE21 H 6.917 0.050 . 63 7 7 GLN HE22 H 7.578 0.050 . 64 7 7 GLN C C 175.941 0.500 . 65 7 7 GLN CA C 55.785 0.500 . 66 7 7 GLN CB C 29.495 0.500 . 67 7 7 GLN CG C 33.787 0.500 . 68 7 7 GLN CD C 180.450 0.500 . 69 7 7 GLN N N 121.005 0.500 . 70 7 7 GLN NE2 N 112.816 0.500 . 71 8 8 ARG H H 8.449 0.050 . 72 8 8 ARG HA H 4.287 0.050 . 73 8 8 ARG HB2 H 1.725 0.050 . 74 8 8 ARG HB3 H 1.797 0.050 . 75 8 8 ARG HG2 H 1.570 0.050 . 76 8 8 ARG HG3 H 1.599 0.050 . 77 8 8 ARG HD2 H 3.164 0.050 . 78 8 8 ARG C C 176.061 0.500 . 79 8 8 ARG CA C 55.996 0.500 . 80 8 8 ARG CB C 30.816 0.500 . 81 8 8 ARG CG C 27.093 0.500 . 82 8 8 ARG CD C 43.309 0.500 . 83 8 8 ARG N N 122.928 0.500 . 84 9 9 MET H H 8.471 0.050 . 85 9 9 MET HA H 4.450 0.050 . 86 9 9 MET HB2 H 1.943 0.050 . 87 9 9 MET HB3 H 2.024 0.050 . 88 9 9 MET HG2 H 2.570 0.050 . 89 9 9 MET HG3 H 2.504 0.050 . 90 9 9 MET C C 175.469 0.500 . 91 9 9 MET CA C 54.941 0.500 . 92 9 9 MET CB C 33.058 0.500 . 93 9 9 MET CG C 31.905 0.500 . 94 9 9 MET N N 122.430 0.500 . 95 10 10 ALA H H 8.398 0.050 . 96 10 10 ALA HA H 4.541 0.050 . 97 10 10 ALA HB H 1.326 0.050 . 98 10 10 ALA C C 175.353 0.500 . 99 10 10 ALA CA C 50.487 0.500 . 100 10 10 ALA CB C 18.031 0.500 . 101 10 10 ALA N N 127.153 0.500 . 102 11 11 PRO HA H 4.438 0.050 . 103 11 11 PRO HB2 H 2.247 0.050 . 104 11 11 PRO HB3 H 1.847 0.050 . 105 11 11 PRO HG2 H 1.988 0.050 . 106 11 11 PRO HD2 H 3.607 0.050 . 107 11 11 PRO HD3 H 3.783 0.050 . 108 11 11 PRO C C 176.896 0.500 . 109 11 11 PRO CA C 62.855 0.500 . 110 11 11 PRO CB C 32.021 0.500 . 111 11 11 PRO CG C 27.478 0.500 . 112 11 11 PRO CD C 50.462 0.500 . 113 12 12 VAL H H 8.373 0.050 . 114 12 12 VAL HA H 4.090 0.050 . 115 12 12 VAL HB H 2.053 0.050 . 116 12 12 VAL HG1 H 0.948 0.050 . 117 12 12 VAL HG2 H 0.956 0.050 . 118 12 12 VAL C C 176.825 0.500 . 119 12 12 VAL CA C 62.403 0.500 . 120 12 12 VAL CB C 32.901 0.500 . 121 12 12 VAL CG1 C 21.213 0.500 . 122 12 12 VAL CG2 C 20.556 0.500 . 123 12 12 VAL N N 120.652 0.500 . 124 13 13 GLY H H 8.605 0.050 . 125 13 13 GLY HA3 H 4.000 0.050 . 126 13 13 GLY C C 174.515 0.500 . 127 13 13 GLY CA C 45.328 0.500 . 128 13 13 GLY N N 112.483 0.500 . 129 14 14 THR H H 8.164 0.050 . 130 14 14 THR HA H 4.309 0.050 . 131 14 14 THR HB H 4.276 0.050 . 132 14 14 THR HG2 H 1.190 0.050 . 133 14 14 THR C C 174.742 0.500 . 134 14 14 THR CA C 62.130 0.500 . 135 14 14 THR CB C 69.981 0.500 . 136 14 14 THR CG2 C 21.669 0.500 . 137 14 14 THR N N 113.531 0.500 . 138 15 15 ASP H H 8.537 0.050 . 139 15 15 ASP HA H 4.510 0.050 . 140 15 15 ASP HB2 H 2.710 0.050 . 141 15 15 ASP HB3 H 2.636 0.050 . 142 15 15 ASP C C 177.216 0.500 . 143 15 15 ASP CA C 55.262 0.500 . 144 15 15 ASP CB C 40.693 0.500 . 145 15 15 ASP N N 122.439 0.500 . 146 16 16 LYS H H 8.288 0.050 . 147 16 16 LYS HA H 4.118 0.050 . 148 16 16 LYS HB2 H 1.803 0.050 . 149 16 16 LYS HB3 H 1.791 0.050 . 150 16 16 LYS HG3 H 1.410 0.050 . 151 16 16 LYS HD2 H 1.621 0.050 . 152 16 16 LYS HD3 H 1.670 0.050 . 153 16 16 LYS HE3 H 2.975 0.050 . 154 16 16 LYS C C 177.430 0.500 . 155 16 16 LYS CA C 57.893 0.500 . 156 16 16 LYS CB C 32.539 0.500 . 157 16 16 LYS CG C 24.780 0.500 . 158 16 16 LYS CD C 28.822 0.500 . 159 16 16 LYS CE C 42.187 0.500 . 160 16 16 LYS N N 122.807 0.500 . 161 17 17 GLU H H 8.221 0.050 . 162 17 17 GLU HA H 4.112 0.050 . 163 17 17 GLU HB2 H 2.035 0.050 . 164 17 17 GLU HG3 H 2.269 0.050 . 165 17 17 GLU C C 178.007 0.500 . 166 17 17 GLU CA C 58.252 0.500 . 167 17 17 GLU CB C 29.647 0.500 . 168 17 17 GLU CG C 36.483 0.500 . 169 17 17 GLU N N 119.492 0.500 . 170 18 18 LEU H H 7.998 0.050 . 171 18 18 LEU HA H 4.147 0.050 . 172 18 18 LEU HB2 H 1.530 0.050 . 173 18 18 LEU HB3 H 1.701 0.050 . 174 18 18 LEU HG H 1.647 0.050 . 175 18 18 LEU HD1 H 0.859 0.050 . 176 18 18 LEU HD2 H 0.813 0.050 . 177 18 18 LEU C C 178.359 0.500 . 178 18 18 LEU CA C 56.422 0.500 . 179 18 18 LEU CB C 41.760 0.500 . 180 18 18 LEU CG C 26.985 0.500 . 181 18 18 LEU CD1 C 25.166 0.500 . 182 18 18 LEU CD2 C 23.771 0.500 . 183 18 18 LEU N N 119.493 0.500 . 184 19 19 SER H H 8.068 0.050 . 185 19 19 SER HA H 4.113 0.050 . 186 19 19 SER HB2 H 3.895 0.050 . 187 19 19 SER HB3 H 3.863 0.050 . 188 19 19 SER C C 175.912 0.500 . 189 19 19 SER CA C 60.881 0.500 . 190 19 19 SER CB C 63.043 0.500 . 191 19 19 SER N N 114.728 0.500 . 192 20 20 ASP H H 8.301 0.050 . 193 20 20 ASP HA H 4.448 0.050 . 194 20 20 ASP HB2 H 2.690 0.050 . 195 20 20 ASP HB3 H 2.604 0.050 . 196 20 20 ASP C C 177.598 0.500 . 197 20 20 ASP CA C 55.995 0.500 . 198 20 20 ASP CB C 40.539 0.500 . 199 20 20 ASP N N 121.206 0.500 . 200 21 21 LEU H H 7.807 0.050 . 201 21 21 LEU HA H 4.142 0.050 . 202 21 21 LEU HB2 H 1.494 0.050 . 203 21 21 LEU HB3 H 1.731 0.050 . 204 21 21 LEU HG H 1.606 0.050 . 205 21 21 LEU HD1 H 0.844 0.050 . 206 21 21 LEU HD2 H 0.785 0.050 . 207 21 21 LEU C C 177.822 0.500 . 208 21 21 LEU CA C 56.439 0.500 . 209 21 21 LEU CB C 42.252 0.500 . 210 21 21 LEU CG C 26.870 0.500 . 211 21 21 LEU CD1 C 25.467 0.500 . 212 21 21 LEU CD2 C 23.842 0.500 . 213 21 21 LEU N N 119.944 0.500 . 214 22 22 LEU H H 7.878 0.050 . 215 22 22 LEU HA H 4.076 0.050 . 216 22 22 LEU HB2 H 1.595 0.050 . 217 22 22 LEU HB3 H 1.501 0.050 . 218 22 22 LEU HG H 1.598 0.050 . 219 22 22 LEU HD1 H 0.785 0.050 . 220 22 22 LEU HD2 H 0.823 0.050 . 221 22 22 LEU C C 177.131 0.500 . 222 22 22 LEU CA C 56.055 0.500 . 223 22 22 LEU CB C 41.844 0.500 . 224 22 22 LEU CG C 26.876 0.500 . 225 22 22 LEU CD1 C 23.838 0.500 . 226 22 22 LEU CD2 C 25.220 0.500 . 227 22 22 LEU N N 119.558 0.500 . 228 23 23 ASP H H 7.990 0.050 . 229 23 23 ASP HA H 4.464 0.050 . 230 23 23 ASP HB2 H 2.693 0.050 . 231 23 23 ASP HB3 H 2.632 0.050 . 232 23 23 ASP C C 177.379 0.500 . 233 23 23 ASP CA C 54.927 0.500 . 234 23 23 ASP CB C 40.739 0.500 . 235 23 23 ASP N N 119.509 0.500 . 236 24 24 PHE H H 8.204 0.050 . 237 24 24 PHE HA H 4.466 0.050 . 238 24 24 PHE HB2 H 3.113 0.050 . 239 24 24 PHE HB3 H 3.186 0.050 . 240 24 24 PHE HD1 H 7.222 0.050 . 241 24 24 PHE HD2 H 7.222 0.050 . 242 24 24 PHE HE1 H 7.100 0.050 . 243 24 24 PHE HE2 H 7.100 0.050 . 244 24 24 PHE HZ H 7.123 0.050 . 245 24 24 PHE C C 176.875 0.500 . 246 24 24 PHE CA C 59.229 0.500 . 247 24 24 PHE CB C 39.007 0.500 . 248 24 24 PHE CD1 C 131.895 0.500 . 249 24 24 PHE CD2 C 131.895 0.500 . 250 24 24 PHE CE1 C 129.035 0.500 . 251 24 24 PHE CE2 C 129.035 0.500 . 252 24 24 PHE CZ C 129.325 0.500 . 253 24 24 PHE N N 121.219 0.500 . 254 25 25 SER H H 8.326 0.050 . 255 25 25 SER HA H 4.108 0.050 . 256 25 25 SER HB2 H 3.791 0.050 . 257 25 25 SER HB3 H 3.815 0.050 . 258 25 25 SER C C 175.386 0.500 . 259 25 25 SER CA C 60.758 0.500 . 260 25 25 SER CB C 62.998 0.500 . 261 25 25 SER N N 115.500 0.500 . 262 26 26 MET H H 7.889 0.050 . 263 26 26 MET HA H 4.363 0.050 . 264 26 26 MET HB2 H 2.014 0.050 . 265 26 26 MET HB3 H 2.003 0.050 . 266 26 26 MET HG2 H 2.456 0.050 . 267 26 26 MET HG3 H 2.582 0.050 . 268 26 26 MET HE H 2.013 0.050 . 269 26 26 MET C C 176.450 0.500 . 270 26 26 MET CA C 55.949 0.500 . 271 26 26 MET CB C 31.868 0.500 . 272 26 26 MET CG C 32.180 0.500 . 273 26 26 MET CE C 16.874 0.500 . 274 26 26 MET N N 119.723 0.500 . 275 27 27 MET H H 7.656 0.050 . 276 27 27 MET HA H 4.186 0.050 . 277 27 27 MET HB2 H 1.798 0.050 . 278 27 27 MET HB3 H 1.698 0.050 . 279 27 27 MET HG2 H 2.241 0.050 . 280 27 27 MET HG3 H 2.414 0.050 . 281 27 27 MET HE H 1.932 0.050 . 282 27 27 MET C C 175.341 0.500 . 283 27 27 MET CA C 56.102 0.500 . 284 27 27 MET CB C 33.161 0.500 . 285 27 27 MET CG C 32.148 0.500 . 286 27 27 MET CE C 17.160 0.500 . 287 27 27 MET N N 117.872 0.500 . 288 28 28 PHE H H 7.682 0.050 . 289 28 28 PHE HA H 4.804 0.050 . 290 28 28 PHE HB2 H 2.868 0.050 . 291 28 28 PHE HB3 H 3.043 0.050 . 292 28 28 PHE HD1 H 7.153 0.050 . 293 28 28 PHE HD2 H 7.153 0.050 . 294 28 28 PHE HE1 H 7.284 0.050 . 295 28 28 PHE HE2 H 7.284 0.050 . 296 28 28 PHE HZ H 7.088 0.050 . 297 28 28 PHE C C 173.132 0.500 . 298 28 28 PHE CA C 54.795 0.500 . 299 28 28 PHE CB C 38.729 0.500 . 300 28 28 PHE CD1 C 132.082 0.500 . 301 28 28 PHE CD2 C 132.082 0.500 . 302 28 28 PHE CE1 C 131.225 0.500 . 303 28 28 PHE CE2 C 131.225 0.500 . 304 28 28 PHE CZ C 130.974 0.500 . 305 28 28 PHE N N 118.702 0.500 . 306 29 29 PRO HA H 4.461 0.050 . 307 29 29 PRO HB2 H 2.176 0.050 . 308 29 29 PRO HB3 H 1.890 0.050 . 309 29 29 PRO HG2 H 1.892 0.050 . 310 29 29 PRO HD2 H 3.595 0.050 . 311 29 29 PRO HD3 H 3.439 0.050 . 312 29 29 PRO C C 176.360 0.500 . 313 29 29 PRO CA C 62.820 0.500 . 314 29 29 PRO CB C 31.581 0.500 . 315 29 29 PRO CG C 27.414 0.500 . 316 29 29 PRO CD C 50.269 0.500 . 317 30 30 LEU H H 8.284 0.050 . 318 30 30 LEU HA H 4.539 0.050 . 319 30 30 LEU HB2 H 1.540 0.050 . 320 30 30 LEU HB3 H 1.565 0.050 . 321 30 30 LEU HG H 1.676 0.050 . 322 30 30 LEU HD1 H 0.937 0.050 . 323 30 30 LEU HD2 H 0.894 0.050 . 324 30 30 LEU C C 175.365 0.500 . 325 30 30 LEU CA C 52.911 0.500 . 326 30 30 LEU CB C 41.673 0.500 . 327 30 30 LEU CG C 27.214 0.500 . 328 30 30 LEU CD1 C 25.462 0.500 . 329 30 30 LEU CD2 C 23.478 0.500 . 330 30 30 LEU N N 123.391 0.500 . 331 31 31 PRO HA H 4.438 0.050 . 332 31 31 PRO HB2 H 2.261 0.050 . 333 31 31 PRO HB3 H 1.850 0.050 . 334 31 31 PRO HG2 H 1.996 0.050 . 335 31 31 PRO HD2 H 3.788 0.050 . 336 31 31 PRO HD3 H 3.605 0.050 . 337 31 31 PRO C C 176.688 0.500 . 338 31 31 PRO CA C 62.880 0.500 . 339 31 31 PRO CB C 32.043 0.500 . 340 31 31 PRO CG C 27.402 0.500 . 341 31 31 PRO CD C 50.470 0.500 . 342 32 32 VAL H H 8.344 0.050 . 343 32 32 VAL HA H 4.140 0.050 . 344 32 32 VAL HB H 2.046 0.050 . 345 32 32 VAL HG1 H 0.934 0.050 . 346 32 32 VAL HG2 H 0.920 0.050 . 347 32 32 VAL C C 176.579 0.500 . 348 32 32 VAL CA C 62.241 0.500 . 349 32 32 VAL CB C 32.809 0.500 . 350 32 32 VAL CG1 C 20.493 0.500 . 351 32 32 VAL CG2 C 21.254 0.500 . 352 32 32 VAL N N 120.844 0.500 . 353 33 33 THR H H 8.326 0.050 . 354 33 33 THR HA H 4.373 0.050 . 355 33 33 THR HB H 4.191 0.050 . 356 33 33 THR HG2 H 1.148 0.050 . 357 33 33 THR C C 174.172 0.500 . 358 33 33 THR CA C 61.407 0.500 . 359 33 33 THR CB C 69.891 0.500 . 360 33 33 THR CG2 C 21.445 0.500 . 361 33 33 THR N N 118.041 0.500 . 362 34 34 ASN H H 8.526 0.050 . 363 34 34 ASN HA H 4.709 0.050 . 364 34 34 ASN HB3 H 2.803 0.050 . 365 34 34 ASN HD21 H 7.652 0.050 . 366 34 34 ASN HD22 H 6.934 0.050 . 367 34 34 ASN C C 175.639 0.500 . 368 34 34 ASN CA C 53.218 0.500 . 369 34 34 ASN CB C 38.957 0.500 . 370 34 34 ASN CG C 177.014 0.500 . 371 34 34 ASN N N 121.367 0.500 . 372 34 34 ASN ND2 N 112.763 0.500 . 373 35 35 GLY H H 8.449 0.050 . 374 35 35 GLY HA3 H 3.922 0.050 . 375 35 35 GLY C C 174.112 0.500 . 376 35 35 GLY CA C 45.370 0.500 . 377 35 35 GLY N N 109.437 0.500 . 378 36 36 LYS H H 8.261 0.050 . 379 36 36 LYS HA H 4.303 0.050 . 380 36 36 LYS HB2 H 1.743 0.050 . 381 36 36 LYS HB3 H 1.843 0.050 . 382 36 36 LYS HG2 H 1.379 0.050 . 383 36 36 LYS HG3 H 1.414 0.050 . 384 36 36 LYS HD3 H 1.645 0.050 . 385 36 36 LYS HE3 H 2.965 0.050 . 386 36 36 LYS C C 177.182 0.500 . 387 36 36 LYS CA C 56.300 0.500 . 388 36 36 LYS CB C 32.895 0.500 . 389 36 36 LYS CG C 24.759 0.500 . 390 36 36 LYS CD C 28.976 0.500 . 391 36 36 LYS CE C 42.121 0.500 . 392 36 36 LYS N N 120.614 0.500 . 393 37 37 GLY H H 8.484 0.050 . 394 37 37 GLY HA3 H 3.896 0.050 . 395 37 37 GLY C C 173.463 0.500 . 396 37 37 GLY CA C 45.122 0.500 . 397 37 37 GLY N N 110.011 0.500 . 398 38 38 ARG H H 8.105 0.050 . 399 38 38 ARG HA H 4.619 0.050 . 400 38 38 ARG HB2 H 1.709 0.050 . 401 38 38 ARG HB3 H 1.861 0.050 . 402 38 38 ARG HG3 H 1.641 0.050 . 403 38 38 ARG HD2 H 3.176 0.050 . 404 38 38 ARG C C 173.448 0.500 . 405 38 38 ARG CA C 53.702 0.500 . 406 38 38 ARG CB C 30.121 0.500 . 407 38 38 ARG CG C 26.589 0.500 . 408 38 38 ARG CD C 43.354 0.500 . 409 38 38 ARG N N 121.698 0.500 . 410 39 39 PRO HA H 4.284 0.050 . 411 39 39 PRO HB2 H 2.241 0.050 . 412 39 39 PRO HB3 H 2.070 0.050 . 413 39 39 PRO HG2 H 1.870 0.050 . 414 39 39 PRO HG3 H 1.804 0.050 . 415 39 39 PRO HD2 H 3.416 0.050 . 416 39 39 PRO HD3 H 3.560 0.050 . 417 39 39 PRO CA C 64.736 0.500 . 418 39 39 PRO CB C 34.233 0.500 . 419 39 39 PRO CG C 24.759 0.500 . 420 39 39 PRO CD C 49.963 0.500 . stop_ save_ save_assigned_chem_shift_list_1_2 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCACB' '3D HNCO' '3D HCACO' '3D 1H-15N NOESY' '3D HCCH-TOCSY' '3D 1H-13C NOESY aliphatic' '3D 1H-13C NOESY aromatic' stop_ loop_ _Sample_label $Sample1_ETAD $sample_2_Taz2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'p300 Taz2' _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 1721 1 GLY HA2 H 3.856 0.050 . 2 1721 1 GLY CA C 43.399 0.500 . 3 1722 2 SER HA H 4.477 0.050 . 4 1722 2 SER HB3 H 3.845 0.050 . 5 1722 2 SER C C 174.363 0.500 . 6 1722 2 SER CA C 58.286 0.500 . 7 1722 2 SER CB C 63.951 0.500 . 8 1723 3 ALA H H 8.615 0.050 . 9 1723 3 ALA HA H 4.386 0.050 . 10 1723 3 ALA HB H 1.394 0.050 . 11 1723 3 ALA C C 177.956 0.500 . 12 1723 3 ALA CA C 52.711 0.500 . 13 1723 3 ALA CB C 19.200 0.500 . 14 1723 3 ALA N N 126.299 0.500 . 15 1724 4 THR H H 8.184 0.050 . 16 1724 4 THR HA H 4.276 0.050 . 17 1724 4 THR HB H 4.163 0.050 . 18 1724 4 THR HG2 H 1.170 0.050 . 19 1724 4 THR C C 174.381 0.500 . 20 1724 4 THR CA C 61.845 0.500 . 21 1724 4 THR CB C 69.759 0.500 . 22 1724 4 THR CG2 C 21.613 0.500 . 23 1724 4 THR N N 113.655 0.500 . 24 1725 5 GLN H H 8.402 0.050 . 25 1725 5 GLN HA H 4.398 0.050 . 26 1725 5 GLN HB2 H 2.070 0.050 . 27 1725 5 GLN HB3 H 1.952 0.050 . 28 1725 5 GLN HG2 H 2.335 0.050 . 29 1725 5 GLN HE21 H 6.823 0.050 . 30 1725 5 GLN HE22 H 7.581 0.050 . 31 1725 5 GLN C C 175.647 0.500 . 32 1725 5 GLN CA C 55.574 0.500 . 33 1725 5 GLN CB C 29.873 0.500 . 34 1725 5 GLN CG C 33.833 0.500 . 35 1725 5 GLN N N 123.096 0.500 . 36 1725 5 GLN NE2 N 111.991 0.500 . 37 1726 6 SER H H 8.716 0.050 . 38 1726 6 SER HA H 4.751 0.050 . 39 1726 6 SER HB3 H 3.897 0.050 . 40 1726 6 SER CA C 56.485 0.500 . 41 1726 6 SER CB C 63.187 0.500 . 42 1726 6 SER N N 119.809 0.500 . 43 1727 7 PRO HA H 4.405 0.050 . 44 1727 7 PRO HB2 H 1.942 0.050 . 45 1727 7 PRO HB3 H 2.316 0.050 . 46 1727 7 PRO HG2 H 2.016 0.050 . 47 1727 7 PRO HG3 H 2.072 0.050 . 48 1727 7 PRO HD2 H 3.845 0.050 . 49 1727 7 PRO HD3 H 3.764 0.050 . 50 1727 7 PRO C C 178.080 0.500 . 51 1727 7 PRO CA C 64.183 0.500 . 52 1727 7 PRO CB C 31.996 0.500 . 53 1727 7 PRO CG C 27.536 0.500 . 54 1727 7 PRO CD C 50.719 0.500 . 55 1728 8 GLY H H 8.522 0.050 . 56 1728 8 GLY HA2 H 3.900 0.050 . 57 1728 8 GLY C C 174.659 0.500 . 58 1728 8 GLY CA C 45.734 0.500 . 59 1728 8 GLY N N 108.158 0.500 . 60 1729 9 ASP H H 8.111 0.050 . 61 1729 9 ASP HA H 4.574 0.050 . 62 1729 9 ASP HB2 H 2.713 0.050 . 63 1729 9 ASP C C 177.377 0.500 . 64 1729 9 ASP CA C 55.332 0.500 . 65 1729 9 ASP CB C 41.154 0.500 . 66 1729 9 ASP N N 121.445 0.500 . 67 1730 10 SER H H 8.443 0.050 . 68 1730 10 SER HA H 4.222 0.050 . 69 1730 10 SER HB2 H 3.951 0.050 . 70 1730 10 SER HB3 H 3.907 0.050 . 71 1730 10 SER C C 176.278 0.500 . 72 1730 10 SER CA C 60.591 0.500 . 73 1730 10 SER CB C 63.052 0.500 . 74 1730 10 SER N N 117.076 0.500 . 75 1731 11 ARG H H 8.305 0.050 . 76 1731 11 ARG HA H 4.141 0.050 . 77 1731 11 ARG HB2 H 1.850 0.050 . 78 1731 11 ARG HG2 H 1.653 0.050 . 79 1731 11 ARG HG3 H 1.556 0.050 . 80 1731 11 ARG HD2 H 3.145 0.050 . 81 1731 11 ARG C C 177.555 0.500 . 82 1731 11 ARG CA C 58.425 0.500 . 83 1731 11 ARG CB C 30.054 0.500 . 84 1731 11 ARG CG C 27.372 0.500 . 85 1731 11 ARG CD C 43.352 0.500 . 86 1731 11 ARG N N 123.002 0.500 . 87 1732 12 ARG H H 8.002 0.050 . 88 1732 12 ARG HA H 3.960 0.050 . 89 1732 12 ARG HB2 H 1.847 0.050 . 90 1732 12 ARG HG2 H 1.668 0.050 . 91 1732 12 ARG HG3 H 1.527 0.050 . 92 1732 12 ARG HD2 H 3.187 0.050 . 93 1732 12 ARG C C 178.030 0.500 . 94 1732 12 ARG CA C 58.832 0.500 . 95 1732 12 ARG CB C 30.152 0.500 . 96 1732 12 ARG CG C 27.690 0.500 . 97 1732 12 ARG CD C 43.322 0.500 . 98 1732 12 ARG N N 119.421 0.500 . 99 1733 13 LEU H H 8.120 0.050 . 100 1733 13 LEU HA H 4.163 0.050 . 101 1733 13 LEU HB2 H 1.718 0.050 . 102 1733 13 LEU HB3 H 1.575 0.050 . 103 1733 13 LEU HG H 1.628 0.050 . 104 1733 13 LEU HD1 H 0.864 0.050 . 105 1733 13 LEU HD2 H 0.844 0.050 . 106 1733 13 LEU C C 178.752 0.500 . 107 1733 13 LEU CA C 57.201 0.500 . 108 1733 13 LEU CB C 41.861 0.500 . 109 1733 13 LEU CG C 27.143 0.500 . 110 1733 13 LEU CD1 C 24.677 0.500 . 111 1733 13 LEU CD2 C 23.695 0.500 . 112 1733 13 LEU N N 120.329 0.500 . 113 1734 14 SER H H 8.066 0.050 . 114 1734 14 SER HA H 4.209 0.050 . 115 1734 14 SER HB3 H 3.952 0.050 . 116 1734 14 SER C C 176.798 0.500 . 117 1734 14 SER CA C 61.046 0.500 . 118 1734 14 SER CB C 63.121 0.500 . 119 1734 14 SER N N 115.999 0.500 . 120 1735 15 ILE H H 8.145 0.050 . 121 1735 15 ILE HA H 3.572 0.050 . 122 1735 15 ILE HB H 1.712 0.050 . 123 1735 15 ILE HG12 H 1.490 0.050 . 124 1735 15 ILE HG13 H 0.703 0.050 . 125 1735 15 ILE HG2 H 0.532 0.050 . 126 1735 15 ILE HD1 H 0.499 0.050 . 127 1735 15 ILE C C 177.172 0.500 . 128 1735 15 ILE CA C 65.104 0.500 . 129 1735 15 ILE CB C 37.771 0.500 . 130 1735 15 ILE CG1 C 29.411 0.500 . 131 1735 15 ILE CG2 C 17.196 0.500 . 132 1735 15 ILE CD1 C 13.405 0.500 . 133 1735 15 ILE N N 123.602 0.500 . 134 1736 16 GLN H H 8.156 0.050 . 135 1736 16 GLN HA H 3.946 0.050 . 136 1736 16 GLN HB3 H 2.111 0.050 . 137 1736 16 GLN HG2 H 2.470 0.050 . 138 1736 16 GLN HG3 H 2.379 0.050 . 139 1736 16 GLN HE21 H 7.474 0.050 . 140 1736 16 GLN HE22 H 6.851 0.050 . 141 1736 16 GLN C C 179.097 0.500 . 142 1736 16 GLN CA C 59.208 0.500 . 143 1736 16 GLN CB C 28.129 0.500 . 144 1736 16 GLN CG C 34.063 0.500 . 145 1736 16 GLN N N 118.797 0.500 . 146 1736 16 GLN NE2 N 111.164 0.500 . 147 1737 17 ARG H H 8.200 0.050 . 148 1737 17 ARG HA H 4.079 0.050 . 149 1737 17 ARG HB2 H 1.897 0.050 . 150 1737 17 ARG HG2 H 1.824 0.050 . 151 1737 17 ARG HG3 H 1.622 0.050 . 152 1737 17 ARG HD2 H 3.172 0.050 . 153 1737 17 ARG C C 178.999 0.500 . 154 1737 17 ARG CA C 59.248 0.500 . 155 1737 17 ARG CB C 30.214 0.500 . 156 1737 17 ARG CG C 27.902 0.500 . 157 1737 17 ARG CD C 43.440 0.500 . 158 1737 17 ARG N N 118.896 0.500 . 159 1738 18 ALA H H 8.080 0.050 . 160 1738 18 ALA HA H 4.003 0.050 . 161 1738 18 ALA HB H 1.429 0.050 . 162 1738 18 ALA C C 179.794 0.500 . 163 1738 18 ALA CA C 55.364 0.500 . 164 1738 18 ALA CB C 18.564 0.500 . 165 1738 18 ALA N N 123.938 0.500 . 166 1739 19 ILE H H 8.542 0.050 . 167 1739 19 ILE HA H 3.627 0.050 . 168 1739 19 ILE HB H 2.079 0.050 . 169 1739 19 ILE HG12 H 1.190 0.050 . 170 1739 19 ILE HG13 H 1.877 0.050 . 171 1739 19 ILE HG2 H 1.016 0.050 . 172 1739 19 ILE HD1 H 0.905 0.050 . 173 1739 19 ILE C C 177.692 0.500 . 174 1739 19 ILE CA C 65.149 0.500 . 175 1739 19 ILE CB C 37.416 0.500 . 176 1739 19 ILE CG1 C 29.494 0.500 . 177 1739 19 ILE CG2 C 18.288 0.500 . 178 1739 19 ILE CD1 C 14.180 0.500 . 179 1739 19 ILE N N 118.218 0.500 . 180 1740 20 GLN H H 8.189 0.050 . 181 1740 20 GLN HA H 4.011 0.050 . 182 1740 20 GLN HB2 H 2.123 0.050 . 183 1740 20 GLN HB3 H 2.237 0.050 . 184 1740 20 GLN HG2 H 2.575 0.050 . 185 1740 20 GLN HG3 H 2.437 0.050 . 186 1740 20 GLN HE21 H 6.880 0.050 . 187 1740 20 GLN HE22 H 7.540 0.050 . 188 1740 20 GLN C C 179.611 0.500 . 189 1740 20 GLN CA C 59.263 0.500 . 190 1740 20 GLN CB C 28.088 0.500 . 191 1740 20 GLN CG C 34.107 0.500 . 192 1740 20 GLN N N 118.665 0.500 . 193 1740 20 GLN NE2 N 111.370 0.500 . 194 1741 21 SER H H 8.149 0.050 . 195 1741 21 SER HA H 4.313 0.050 . 196 1741 21 SER HB3 H 3.896 0.050 . 197 1741 21 SER C C 176.141 0.500 . 198 1741 21 SER CA C 61.888 0.500 . 199 1741 21 SER CB C 63.019 0.500 . 200 1741 21 SER N N 116.063 0.500 . 201 1742 22 LEU H H 8.243 0.050 . 202 1742 22 LEU HA H 4.005 0.050 . 203 1742 22 LEU HB2 H 2.017 0.050 . 204 1742 22 LEU HB3 H 1.646 0.050 . 205 1742 22 LEU HG H 1.487 0.050 . 206 1742 22 LEU HD1 H 0.805 0.050 . 207 1742 22 LEU HD2 H 0.881 0.050 . 208 1742 22 LEU C C 177.071 0.500 . 209 1742 22 LEU CA C 58.646 0.500 . 210 1742 22 LEU CB C 42.242 0.500 . 211 1742 22 LEU CG C 27.351 0.500 . 212 1742 22 LEU CD1 C 25.845 0.500 . 213 1742 22 LEU CD2 C 23.597 0.500 . 214 1742 22 LEU N N 125.303 0.500 . 215 1743 23 VAL H H 8.539 0.050 . 216 1743 23 VAL HA H 3.240 0.050 . 217 1743 23 VAL HB H 2.049 0.050 . 218 1743 23 VAL HG1 H 0.871 0.050 . 219 1743 23 VAL HG2 H 0.890 0.050 . 220 1743 23 VAL C C 178.389 0.500 . 221 1743 23 VAL CA C 66.828 0.500 . 222 1743 23 VAL CB C 31.785 0.500 . 223 1743 23 VAL CG1 C 20.991 0.500 . 224 1743 23 VAL CG2 C 23.506 0.500 . 225 1743 23 VAL N N 118.472 0.500 . 226 1744 24 HIS H H 7.954 0.050 . 227 1744 24 HIS HA H 4.170 0.050 . 228 1744 24 HIS HB2 H 3.277 0.050 . 229 1744 24 HIS HB3 H 3.226 0.050 . 230 1744 24 HIS HD2 H 7.261 0.050 . 231 1744 24 HIS HE1 H 7.905 0.050 . 232 1744 24 HIS C C 178.040 0.500 . 233 1744 24 HIS CA C 60.099 0.500 . 234 1744 24 HIS CB C 27.741 0.500 . 235 1744 24 HIS CD2 C 129.228 0.500 . 236 1744 24 HIS CE1 C 139.276 0.500 . 237 1744 24 HIS N N 115.703 0.500 . 238 1745 25 ALA H H 8.633 0.050 . 239 1745 25 ALA HA H 4.089 0.050 . 240 1745 25 ALA HB H 1.516 0.050 . 241 1745 25 ALA C C 179.146 0.500 . 242 1745 25 ALA CA C 55.127 0.500 . 243 1745 25 ALA CB C 19.627 0.500 . 244 1745 25 ALA N N 121.279 0.500 . 245 1746 26 ALA H H 8.215 0.050 . 246 1746 26 ALA HA H 4.011 0.050 . 247 1746 26 ALA HB H 1.347 0.050 . 248 1746 26 ALA C C 177.428 0.500 . 249 1746 26 ALA CA C 53.987 0.500 . 250 1746 26 ALA CB C 18.516 0.500 . 251 1746 26 ALA N N 116.453 0.500 . 252 1747 27 GLN H H 7.181 0.050 . 253 1747 27 GLN HA H 4.454 0.050 . 254 1747 27 GLN HB2 H 1.944 0.050 . 255 1747 27 GLN HB3 H 2.145 0.050 . 256 1747 27 GLN HG2 H 2.468 0.050 . 257 1747 27 GLN HG3 H 2.228 0.050 . 258 1747 27 GLN HE21 H 7.030 0.050 . 259 1747 27 GLN HE22 H 7.414 0.050 . 260 1747 27 GLN C C 174.186 0.500 . 261 1747 27 GLN CA C 54.426 0.500 . 262 1747 27 GLN CB C 30.582 0.500 . 263 1747 27 GLN CG C 33.282 0.500 . 264 1747 27 GLN N N 111.630 0.500 . 265 1747 27 GLN NE2 N 112.788 0.500 . 266 1748 28 CYS H H 7.232 0.050 . 267 1748 28 CYS HA H 3.833 0.050 . 268 1748 28 CYS HB2 H 2.498 0.050 . 269 1748 28 CYS HB3 H 1.994 0.050 . 270 1748 28 CYS C C 176.070 0.500 . 271 1748 28 CYS CA C 60.708 0.500 . 272 1748 28 CYS CB C 29.139 0.500 . 273 1748 28 CYS N N 124.365 0.500 . 274 1749 29 ARG H H 8.936 0.050 . 275 1749 29 ARG HA H 4.548 0.050 . 276 1749 29 ARG HB2 H 2.101 0.050 . 277 1749 29 ARG HG2 H 1.526 0.050 . 278 1749 29 ARG HG3 H 1.620 0.050 . 279 1749 29 ARG HD2 H 3.128 0.050 . 280 1749 29 ARG C C 175.039 0.500 . 281 1749 29 ARG CA C 54.583 0.500 . 282 1749 29 ARG CB C 29.987 0.500 . 283 1749 29 ARG CG C 26.826 0.500 . 284 1749 29 ARG CD C 43.102 0.500 . 285 1749 29 ARG N N 129.540 0.500 . 286 1750 30 ASN H H 7.846 0.050 . 287 1750 30 ASN HA H 4.804 0.050 . 288 1750 30 ASN HB2 H 2.812 0.050 . 289 1750 30 ASN HB3 H 2.932 0.050 . 290 1750 30 ASN HD21 H 7.892 0.050 . 291 1750 30 ASN HD22 H 7.074 0.050 . 292 1750 30 ASN C C 175.646 0.500 . 293 1750 30 ASN CA C 51.698 0.500 . 294 1750 30 ASN CB C 38.897 0.500 . 295 1750 30 ASN N N 120.185 0.500 . 296 1750 30 ASN ND2 N 111.410 0.500 . 297 1751 31 ALA H H 9.234 0.050 . 298 1751 31 ALA HA H 4.028 0.050 . 299 1751 31 ALA HB H 1.383 0.050 . 300 1751 31 ALA C C 177.992 0.500 . 301 1751 31 ALA CA C 54.345 0.500 . 302 1751 31 ALA CB C 18.377 0.500 . 303 1751 31 ALA N N 130.301 0.500 . 304 1752 32 ASN H H 8.044 0.050 . 305 1752 32 ASN HA H 4.808 0.050 . 306 1752 32 ASN HB2 H 2.913 0.050 . 307 1752 32 ASN HB3 H 2.558 0.050 . 308 1752 32 ASN HD21 H 6.945 0.050 . 309 1752 32 ASN HD22 H 7.690 0.050 . 310 1752 32 ASN C C 173.990 0.500 . 311 1752 32 ASN CA C 51.836 0.500 . 312 1752 32 ASN CB C 38.793 0.500 . 313 1752 32 ASN N N 113.888 0.500 . 314 1752 32 ASN ND2 N 113.372 0.500 . 315 1753 33 CYS H H 7.131 0.050 . 316 1753 33 CYS HA H 3.981 0.050 . 317 1753 33 CYS HB2 H 2.944 0.050 . 318 1753 33 CYS HB3 H 2.988 0.050 . 319 1753 33 CYS C C 176.814 0.500 . 320 1753 33 CYS CA C 61.655 0.500 . 321 1753 33 CYS CB C 29.971 0.500 . 322 1753 33 CYS N N 123.125 0.500 . 323 1754 34 SER H H 8.889 0.050 . 324 1754 34 SER HA H 4.559 0.050 . 325 1754 34 SER HB2 H 3.811 0.050 . 326 1754 34 SER HB3 H 4.084 0.050 . 327 1754 34 SER C C 174.727 0.500 . 328 1754 34 SER CA C 57.852 0.500 . 329 1754 34 SER CB C 63.957 0.500 . 330 1754 34 SER N N 124.513 0.500 . 331 1755 35 LEU H H 8.551 0.050 . 332 1755 35 LEU HA H 4.441 0.050 . 333 1755 35 LEU HB2 H 1.551 0.050 . 334 1755 35 LEU HB3 H 1.343 0.050 . 335 1755 35 LEU HG H 1.557 0.050 . 336 1755 35 LEU HD1 H 0.493 0.050 . 337 1755 35 LEU HD2 H 0.557 0.050 . 338 1755 35 LEU CA C 54.354 0.500 . 339 1755 35 LEU CB C 40.675 0.500 . 340 1755 35 LEU CG C 27.286 0.500 . 341 1755 35 LEU CD1 C 24.274 0.500 . 342 1755 35 LEU CD2 C 23.032 0.500 . 343 1755 35 LEU N N 128.963 0.500 . 344 1756 36 PRO HA H 4.278 0.050 . 345 1756 36 PRO HB2 H 2.339 0.050 . 346 1756 36 PRO HB3 H 1.930 0.050 . 347 1756 36 PRO HG2 H 2.121 0.050 . 348 1756 36 PRO HG3 H 2.022 0.050 . 349 1756 36 PRO HD2 H 3.681 0.050 . 350 1756 36 PRO HD3 H 4.143 0.050 . 351 1756 36 PRO C C 178.194 0.500 . 352 1756 36 PRO CA C 65.208 0.500 . 353 1756 36 PRO CB C 31.918 0.500 . 354 1756 36 PRO CG C 27.785 0.500 . 355 1756 36 PRO CD C 50.934 0.500 . 356 1757 37 SER H H 8.474 0.050 . 357 1757 37 SER HA H 4.258 0.050 . 358 1757 37 SER HB3 H 3.930 0.050 . 359 1757 37 SER C C 173.910 0.500 . 360 1757 37 SER CA C 60.626 0.500 . 361 1757 37 SER CB C 63.061 0.500 . 362 1757 37 SER N N 112.311 0.500 . 363 1758 38 CYS H H 7.521 0.050 . 364 1758 38 CYS HA H 4.186 0.050 . 365 1758 38 CYS HB2 H 2.719 0.050 . 366 1758 38 CYS HB3 H 3.139 0.050 . 367 1758 38 CYS C C 176.434 0.500 . 368 1758 38 CYS CA C 63.981 0.500 . 369 1758 38 CYS CB C 29.588 0.500 . 370 1758 38 CYS N N 125.441 0.500 . 371 1759 39 GLN H H 8.245 0.050 . 372 1759 39 GLN HA H 3.919 0.050 . 373 1759 39 GLN HB2 H 2.076 0.050 . 374 1759 39 GLN HB3 H 2.125 0.050 . 375 1759 39 GLN HG2 H 2.503 0.050 . 376 1759 39 GLN HG3 H 2.394 0.050 . 377 1759 39 GLN HE21 H 6.919 0.050 . 378 1759 39 GLN HE22 H 7.579 0.050 . 379 1759 39 GLN C C 179.440 0.500 . 380 1759 39 GLN CA C 59.864 0.500 . 381 1759 39 GLN CB C 28.114 0.500 . 382 1759 39 GLN CG C 34.071 0.500 . 383 1759 39 GLN N N 115.835 0.500 . 384 1759 39 GLN NE2 N 111.784 0.500 . 385 1760 40 LYS H H 8.006 0.050 . 386 1760 40 LYS HA H 3.946 0.050 . 387 1760 40 LYS HB2 H 1.672 0.050 . 388 1760 40 LYS HG2 H 1.460 0.050 . 389 1760 40 LYS HG3 H 1.276 0.050 . 390 1760 40 LYS HD2 H 1.553 0.050 . 391 1760 40 LYS HE2 H 2.833 0.050 . 392 1760 40 LYS C C 178.722 0.500 . 393 1760 40 LYS CA C 59.649 0.500 . 394 1760 40 LYS CB C 32.562 0.500 . 395 1760 40 LYS CG C 25.599 0.500 . 396 1760 40 LYS CD C 29.516 0.500 . 397 1760 40 LYS CE C 42.146 0.500 . 398 1760 40 LYS N N 117.181 0.500 . 399 1761 41 MET H H 8.354 0.050 . 400 1761 41 MET HA H 4.491 0.050 . 401 1761 41 MET HB2 H 2.289 0.050 . 402 1761 41 MET HB3 H 1.878 0.050 . 403 1761 41 MET HG2 H 2.507 0.050 . 404 1761 41 MET HG3 H 2.657 0.050 . 405 1761 41 MET HE H 1.923 0.050 . 406 1761 41 MET C C 179.294 0.500 . 407 1761 41 MET CA C 56.933 0.500 . 408 1761 41 MET CB C 31.673 0.500 . 409 1761 41 MET CG C 33.453 0.500 . 410 1761 41 MET CE C 17.191 0.500 . 411 1761 41 MET N N 118.256 0.500 . 412 1762 42 LYS H H 9.515 0.050 . 413 1762 42 LYS HA H 3.759 0.050 . 414 1762 42 LYS HB2 H 1.793 0.050 . 415 1762 42 LYS HB3 H 2.091 0.050 . 416 1762 42 LYS HG2 H 1.943 0.050 . 417 1762 42 LYS HG3 H 1.328 0.050 . 418 1762 42 LYS HD2 H 1.619 0.050 . 419 1762 42 LYS HE2 H 3.215 0.050 . 420 1762 42 LYS HE3 H 3.087 0.050 . 421 1762 42 LYS C C 179.776 0.500 . 422 1762 42 LYS CA C 61.378 0.500 . 423 1762 42 LYS CB C 32.757 0.500 . 424 1762 42 LYS CG C 27.420 0.500 . 425 1762 42 LYS CD C 30.100 0.500 . 426 1762 42 LYS CE C 42.878 0.500 . 427 1762 42 LYS N N 121.491 0.500 . 428 1763 43 ARG H H 7.517 0.050 . 429 1763 43 ARG HA H 4.115 0.050 . 430 1763 43 ARG HB2 H 2.114 0.050 . 431 1763 43 ARG HB3 H 1.949 0.050 . 432 1763 43 ARG HG2 H 1.948 0.050 . 433 1763 43 ARG HG3 H 1.668 0.050 . 434 1763 43 ARG HD2 H 3.204 0.050 . 435 1763 43 ARG C C 179.796 0.500 . 436 1763 43 ARG CA C 59.475 0.500 . 437 1763 43 ARG CB C 30.048 0.500 . 438 1763 43 ARG CG C 27.723 0.500 . 439 1763 43 ARG CD C 43.658 0.500 . 440 1763 43 ARG N N 118.194 0.500 . 441 1764 44 VAL H H 7.731 0.050 . 442 1764 44 VAL HA H 3.605 0.050 . 443 1764 44 VAL HB H 2.479 0.050 . 444 1764 44 VAL HG1 H 0.903 0.050 . 445 1764 44 VAL HG2 H 1.073 0.050 . 446 1764 44 VAL C C 177.407 0.500 . 447 1764 44 VAL CA C 66.932 0.500 . 448 1764 44 VAL CB C 31.400 0.500 . 449 1764 44 VAL CG1 C 22.840 0.500 . 450 1764 44 VAL CG2 C 23.349 0.500 . 451 1764 44 VAL N N 122.188 0.500 . 452 1765 45 VAL H H 8.447 0.050 . 453 1765 45 VAL HA H 3.437 0.050 . 454 1765 45 VAL HB H 2.170 0.050 . 455 1765 45 VAL HG1 H 0.892 0.050 . 456 1765 45 VAL HG2 H 0.917 0.050 . 457 1765 45 VAL C C 178.873 0.500 . 458 1765 45 VAL CA C 67.312 0.500 . 459 1765 45 VAL CB C 31.580 0.500 . 460 1765 45 VAL CG1 C 21.409 0.500 . 461 1765 45 VAL CG2 C 23.068 0.500 . 462 1765 45 VAL N N 120.287 0.500 . 463 1766 46 GLN H H 8.411 0.050 . 464 1766 46 GLN HA H 3.923 0.050 . 465 1766 46 GLN HB2 H 2.099 0.050 . 466 1766 46 GLN HB3 H 2.166 0.050 . 467 1766 46 GLN HG2 H 2.445 0.050 . 468 1766 46 GLN HE21 H 6.927 0.050 . 469 1766 46 GLN HE22 H 7.514 0.050 . 470 1766 46 GLN C C 178.801 0.500 . 471 1766 46 GLN CA C 58.803 0.500 . 472 1766 46 GLN CB C 28.047 0.500 . 473 1766 46 GLN CG C 33.590 0.500 . 474 1766 46 GLN N N 119.069 0.500 . 475 1766 46 GLN NE2 N 111.920 0.500 . 476 1767 47 HIS H H 8.129 0.050 . 477 1767 47 HIS HA H 4.198 0.050 . 478 1767 47 HIS HB2 H 3.856 0.050 . 479 1767 47 HIS HB3 H 3.252 0.050 . 480 1767 47 HIS HD2 H 6.875 0.050 . 481 1767 47 HIS HE1 H 8.041 0.050 . 482 1767 47 HIS C C 177.879 0.500 . 483 1767 47 HIS CA C 59.824 0.500 . 484 1767 47 HIS CB C 27.253 0.500 . 485 1767 47 HIS CD2 C 128.800 0.500 . 486 1767 47 HIS CE1 C 140.084 0.500 . 487 1767 47 HIS N N 118.924 0.500 . 488 1768 48 THR H H 7.855 0.050 . 489 1768 48 THR HA H 3.802 0.050 . 490 1768 48 THR HB H 4.155 0.050 . 491 1768 48 THR HG1 H 5.517 0.050 . 492 1768 48 THR HG2 H 1.606 0.050 . 493 1768 48 THR C C 175.773 0.500 . 494 1768 48 THR CA C 65.597 0.500 . 495 1768 48 THR CB C 69.533 0.500 . 496 1768 48 THR CG2 C 22.054 0.500 . 497 1768 48 THR N N 110.458 0.500 . 498 1769 49 LYS H H 7.303 0.050 . 499 1769 49 LYS HA H 4.013 0.050 . 500 1769 49 LYS HB2 H 1.822 0.050 . 501 1769 49 LYS HG2 H 1.538 0.050 . 502 1769 49 LYS HG3 H 1.371 0.050 . 503 1769 49 LYS HD2 H 1.595 0.050 . 504 1769 49 LYS HE2 H 2.822 0.050 . 505 1769 49 LYS C C 177.727 0.500 . 506 1769 49 LYS CA C 58.615 0.500 . 507 1769 49 LYS CB C 32.056 0.500 . 508 1769 49 LYS CG C 25.366 0.500 . 509 1769 49 LYS CD C 29.136 0.500 . 510 1769 49 LYS CE C 42.118 0.500 . 511 1769 49 LYS N N 120.264 0.500 . 512 1770 50 GLY H H 7.111 0.050 . 513 1770 50 GLY HA2 H 4.328 0.050 . 514 1770 50 GLY HA3 H 3.579 0.050 . 515 1770 50 GLY C C 173.732 0.500 . 516 1770 50 GLY CA C 44.603 0.500 . 517 1770 50 GLY N N 103.786 0.500 . 518 1771 51 CYS H H 6.872 0.050 . 519 1771 51 CYS HA H 3.906 0.050 . 520 1771 51 CYS HB2 H 1.996 0.050 . 521 1771 51 CYS HB3 H 2.669 0.050 . 522 1771 51 CYS C C 176.735 0.500 . 523 1771 51 CYS CA C 61.153 0.500 . 524 1771 51 CYS CB C 29.729 0.500 . 525 1771 51 CYS N N 123.205 0.500 . 526 1772 52 LYS H H 9.070 0.050 . 527 1772 52 LYS HA H 4.466 0.050 . 528 1772 52 LYS HB2 H 1.780 0.050 . 529 1772 52 LYS HB3 H 2.024 0.050 . 530 1772 52 LYS HG2 H 1.475 0.050 . 531 1772 52 LYS HG3 H 1.576 0.050 . 532 1772 52 LYS HD2 H 1.665 0.050 . 533 1772 52 LYS HE2 H 2.999 0.050 . 534 1772 52 LYS C C 177.546 0.500 . 535 1772 52 LYS CA C 56.499 0.500 . 536 1772 52 LYS CB C 32.753 0.500 . 537 1772 52 LYS CG C 24.932 0.500 . 538 1772 52 LYS CD C 28.773 0.500 . 539 1772 52 LYS CE C 42.212 0.500 . 540 1772 52 LYS N N 128.138 0.500 . 541 1773 53 ARG H H 8.479 0.050 . 542 1773 53 ARG HA H 4.354 0.050 . 543 1773 53 ARG HB2 H 1.813 0.050 . 544 1773 53 ARG HB3 H 1.736 0.050 . 545 1773 53 ARG HG2 H 1.800 0.050 . 546 1773 53 ARG HG3 H 1.652 0.050 . 547 1773 53 ARG HD2 H 3.244 0.050 . 548 1773 53 ARG C C 176.803 0.500 . 549 1773 53 ARG CA C 57.598 0.500 . 550 1773 53 ARG CB C 31.567 0.500 . 551 1773 53 ARG CG C 27.653 0.500 . 552 1773 53 ARG CD C 43.612 0.500 . 553 1773 53 ARG N N 122.385 0.500 . 554 1774 54 LYS H H 8.397 0.050 . 555 1774 54 LYS HA H 4.444 0.050 . 556 1774 54 LYS HB2 H 2.024 0.050 . 557 1774 54 LYS HB3 H 2.271 0.050 . 558 1774 54 LYS HG2 H 1.306 0.050 . 559 1774 54 LYS HG3 H 1.564 0.050 . 560 1774 54 LYS HD2 H 1.727 0.050 . 561 1774 54 LYS HD3 H 2.023 0.050 . 562 1774 54 LYS HE2 H 3.113 0.050 . 563 1774 54 LYS C C 177.271 0.500 . 564 1774 54 LYS CA C 57.728 0.500 . 565 1774 54 LYS CB C 32.173 0.500 . 566 1774 54 LYS CG C 24.711 0.500 . 567 1774 54 LYS CD C 29.712 0.500 . 568 1774 54 LYS CE C 42.611 0.500 . 569 1774 54 LYS N N 118.612 0.500 . 570 1775 55 THR H H 7.736 0.050 . 571 1775 55 THR HA H 4.096 0.050 . 572 1775 55 THR HB H 4.175 0.050 . 573 1775 55 THR HG2 H 1.163 0.050 . 574 1775 55 THR C C 175.636 0.500 . 575 1775 55 THR CA C 63.839 0.500 . 576 1775 55 THR CB C 68.812 0.500 . 577 1775 55 THR CG2 C 22.025 0.500 . 578 1775 55 THR N N 113.345 0.500 . 579 1776 56 ASN H H 8.315 0.050 . 580 1776 56 ASN HA H 4.698 0.050 . 581 1776 56 ASN HB3 H 2.831 0.050 . 582 1776 56 ASN HD21 H 6.839 0.050 . 583 1776 56 ASN HD22 H 7.643 0.050 . 584 1776 56 ASN C C 175.906 0.500 . 585 1776 56 ASN CA C 53.535 0.500 . 586 1776 56 ASN CB C 38.182 0.500 . 587 1776 56 ASN N N 119.574 0.500 . 588 1776 56 ASN ND2 N 112.133 0.500 . 589 1777 57 GLY H H 8.000 0.050 . 590 1777 57 GLY HA2 H 3.939 0.050 . 591 1777 57 GLY C C 175.206 0.500 . 592 1777 57 GLY CA C 45.845 0.500 . 593 1777 57 GLY N N 107.457 0.500 . 594 1778 58 GLY H H 7.766 0.050 . 595 1778 58 GLY HA2 H 3.940 0.050 . 596 1778 58 GLY HA3 H 3.853 0.050 . 597 1778 58 GLY C C 173.083 0.500 . 598 1778 58 GLY CA C 45.510 0.500 . 599 1778 58 GLY N N 106.945 0.500 . 600 1779 59 CYS H H 8.063 0.050 . 601 1779 59 CYS HA H 4.800 0.050 . 602 1779 59 CYS HB2 H 2.593 0.050 . 603 1779 59 CYS HB3 H 2.901 0.050 . 604 1779 59 CYS CA C 55.404 0.500 . 605 1779 59 CYS CB C 30.843 0.500 . 606 1779 59 CYS N N 122.464 0.500 . 607 1780 60 PRO HA H 4.293 0.050 . 608 1780 60 PRO HB2 H 2.351 0.050 . 609 1780 60 PRO HB3 H 1.946 0.050 . 610 1780 60 PRO HG2 H 2.026 0.050 . 611 1780 60 PRO HG3 H 2.100 0.050 . 612 1780 60 PRO HD2 H 4.015 0.050 . 613 1780 60 PRO C C 178.630 0.500 . 614 1780 60 PRO CA C 64.990 0.500 . 615 1780 60 PRO CB C 32.483 0.500 . 616 1780 60 PRO CG C 27.435 0.500 . 617 1780 60 PRO CD C 51.464 0.500 . 618 1781 61 ILE H H 7.825 0.050 . 619 1781 61 ILE HA H 3.724 0.050 . 620 1781 61 ILE HB H 1.531 0.050 . 621 1781 61 ILE HG12 H 0.844 0.050 . 622 1781 61 ILE HG13 H 1.375 0.050 . 623 1781 61 ILE HG2 H 0.672 0.050 . 624 1781 61 ILE HD1 H 0.437 0.050 . 625 1781 61 ILE C C 177.953 0.500 . 626 1781 61 ILE CA C 64.490 0.500 . 627 1781 61 ILE CB C 38.942 0.500 . 628 1781 61 ILE CG1 C 28.204 0.500 . 629 1781 61 ILE CG2 C 18.284 0.500 . 630 1781 61 ILE CD1 C 13.120 0.500 . 631 1781 61 ILE N N 121.048 0.500 . 632 1782 62 CYS H H 8.888 0.050 . 633 1782 62 CYS HA H 4.047 0.050 . 634 1782 62 CYS HB2 H 2.726 0.050 . 635 1782 62 CYS HB3 H 2.940 0.050 . 636 1782 62 CYS C C 177.402 0.500 . 637 1782 62 CYS CA C 66.266 0.500 . 638 1782 62 CYS CB C 29.149 0.500 . 639 1782 62 CYS N N 123.694 0.500 . 640 1783 63 LYS H H 8.030 0.050 . 641 1783 63 LYS HA H 3.827 0.050 . 642 1783 63 LYS HB2 H 1.718 0.050 . 643 1783 63 LYS HB3 H 1.820 0.050 . 644 1783 63 LYS HG2 H 1.310 0.050 . 645 1783 63 LYS HG3 H 1.464 0.050 . 646 1783 63 LYS HD2 H 1.585 0.050 . 647 1783 63 LYS HE2 H 2.862 0.050 . 648 1783 63 LYS C C 179.126 0.500 . 649 1783 63 LYS CA C 60.018 0.500 . 650 1783 63 LYS CB C 32.670 0.500 . 651 1783 63 LYS CG C 25.353 0.500 . 652 1783 63 LYS CD C 29.287 0.500 . 653 1783 63 LYS CE C 41.906 0.500 . 654 1783 63 LYS N N 116.948 0.500 . 655 1784 64 GLN H H 7.246 0.050 . 656 1784 64 GLN HA H 4.147 0.050 . 657 1784 64 GLN HB3 H 2.013 0.050 . 658 1784 64 GLN HG2 H 2.372 0.050 . 659 1784 64 GLN HG3 H 2.246 0.050 . 660 1784 64 GLN HE21 H 7.051 0.050 . 661 1784 64 GLN HE22 H 6.856 0.050 . 662 1784 64 GLN C C 178.058 0.500 . 663 1784 64 GLN CA C 58.305 0.500 . 664 1784 64 GLN CB C 29.553 0.500 . 665 1784 64 GLN CG C 34.193 0.500 . 666 1784 64 GLN N N 117.752 0.500 . 667 1784 64 GLN NE2 N 110.044 0.500 . 668 1785 65 LEU H H 8.091 0.050 . 669 1785 65 LEU HA H 4.140 0.050 . 670 1785 65 LEU HB2 H 1.946 0.050 . 671 1785 65 LEU HB3 H 1.855 0.050 . 672 1785 65 LEU HG H 1.861 0.050 . 673 1785 65 LEU HD1 H 0.995 0.050 . 674 1785 65 LEU HD2 H 0.980 0.050 . 675 1785 65 LEU C C 178.956 0.500 . 676 1785 65 LEU CA C 57.963 0.500 . 677 1785 65 LEU CB C 41.689 0.500 . 678 1785 65 LEU CG C 27.591 0.500 . 679 1785 65 LEU CD1 C 25.148 0.500 . 680 1785 65 LEU CD2 C 24.833 0.500 . 681 1785 65 LEU N N 120.116 0.500 . 682 1786 66 ILE H H 8.513 0.050 . 683 1786 66 ILE HA H 3.484 0.050 . 684 1786 66 ILE HB H 1.394 0.050 . 685 1786 66 ILE HG12 H 1.019 0.050 . 686 1786 66 ILE HG13 H 0.273 0.050 . 687 1786 66 ILE HG2 H 0.738 0.050 . 688 1786 66 ILE HD1 H 0.367 0.050 . 689 1786 66 ILE C C 177.160 0.500 . 690 1786 66 ILE CA C 65.482 0.500 . 691 1786 66 ILE CB C 37.532 0.500 . 692 1786 66 ILE CG1 C 29.957 0.500 . 693 1786 66 ILE CG2 C 16.967 0.500 . 694 1786 66 ILE CD1 C 13.462 0.500 . 695 1786 66 ILE N N 120.386 0.500 . 696 1787 67 ALA H H 7.272 0.050 . 697 1787 67 ALA HA H 4.108 0.050 . 698 1787 67 ALA HB H 1.475 0.050 . 699 1787 67 ALA C C 180.625 0.500 . 700 1787 67 ALA CA C 55.112 0.500 . 701 1787 67 ALA CB C 18.024 0.500 . 702 1787 67 ALA N N 122.337 0.500 . 703 1788 68 LEU H H 7.913 0.050 . 704 1788 68 LEU HA H 4.144 0.050 . 705 1788 68 LEU HB2 H 1.651 0.050 . 706 1788 68 LEU HB3 H 1.870 0.050 . 707 1788 68 LEU HG H 1.811 0.050 . 708 1788 68 LEU HD1 H 0.765 0.050 . 709 1788 68 LEU HD2 H 0.856 0.050 . 710 1788 68 LEU C C 178.823 0.500 . 711 1788 68 LEU CA C 57.940 0.500 . 712 1788 68 LEU CB C 42.291 0.500 . 713 1788 68 LEU CG C 26.819 0.500 . 714 1788 68 LEU CD1 C 24.683 0.500 . 715 1788 68 LEU CD2 C 25.382 0.500 . 716 1788 68 LEU N N 118.681 0.500 . 717 1789 69 ALA H H 8.869 0.050 . 718 1789 69 ALA HA H 3.894 0.050 . 719 1789 69 ALA HB H 1.629 0.050 . 720 1789 69 ALA C C 179.423 0.500 . 721 1789 69 ALA CA C 55.687 0.500 . 722 1789 69 ALA CB C 18.940 0.500 . 723 1789 69 ALA N N 121.466 0.500 . 724 1790 70 ALA H H 8.498 0.050 . 725 1790 70 ALA HA H 4.088 0.050 . 726 1790 70 ALA HB H 1.468 0.050 . 727 1790 70 ALA C C 180.108 0.500 . 728 1790 70 ALA CA C 55.335 0.500 . 729 1790 70 ALA CB C 17.985 0.500 . 730 1790 70 ALA N N 119.905 0.500 . 731 1791 71 TYR H H 7.663 0.050 . 732 1791 71 TYR HA H 4.180 0.050 . 733 1791 71 TYR HB2 H 3.211 0.050 . 734 1791 71 TYR HB3 H 3.153 0.050 . 735 1791 71 TYR HD1 H 7.156 0.050 . 736 1791 71 TYR HD2 H 7.156 0.050 . 737 1791 71 TYR HE1 H 6.778 0.050 . 738 1791 71 TYR HE2 H 6.778 0.050 . 739 1791 71 TYR C C 178.698 0.500 . 740 1791 71 TYR CA C 61.439 0.500 . 741 1791 71 TYR CB C 38.419 0.500 . 742 1791 71 TYR CD1 C 133.206 0.500 . 743 1791 71 TYR CD2 C 133.206 0.500 . 744 1791 71 TYR CE1 C 118.219 0.500 . 745 1791 71 TYR CE2 C 118.219 0.500 . 746 1791 71 TYR N N 118.450 0.500 . 747 1792 72 HIS H H 8.058 0.050 . 748 1792 72 HIS HA H 4.347 0.050 . 749 1792 72 HIS HB2 H 3.192 0.050 . 750 1792 72 HIS HB3 H 3.521 0.050 . 751 1792 72 HIS HD2 H 7.142 0.050 . 752 1792 72 HIS HE1 H 8.030 0.050 . 753 1792 72 HIS C C 176.692 0.500 . 754 1792 72 HIS CA C 58.770 0.500 . 755 1792 72 HIS CB C 27.819 0.500 . 756 1792 72 HIS CD2 C 129.481 0.500 . 757 1792 72 HIS CE1 C 140.145 0.500 . 758 1792 72 HIS N N 118.805 0.500 . 759 1793 73 ALA H H 9.155 0.050 . 760 1793 73 ALA HA H 3.898 0.050 . 761 1793 73 ALA HB H 1.560 0.050 . 762 1793 73 ALA C C 178.886 0.500 . 763 1793 73 ALA CA C 54.695 0.500 . 764 1793 73 ALA CB C 19.765 0.500 . 765 1793 73 ALA N N 121.865 0.500 . 766 1794 74 LYS H H 6.946 0.050 . 767 1794 74 LYS HA H 3.813 0.050 . 768 1794 74 LYS HB2 H 1.539 0.050 . 769 1794 74 LYS HB3 H 1.381 0.050 . 770 1794 74 LYS HG2 H 1.116 0.050 . 771 1794 74 LYS HG3 H 1.242 0.050 . 772 1794 74 LYS HD2 H 1.525 0.050 . 773 1794 74 LYS HE2 H 2.848 0.050 . 774 1794 74 LYS C C 176.598 0.500 . 775 1794 74 LYS CA C 58.086 0.500 . 776 1794 74 LYS CB C 32.421 0.500 . 777 1794 74 LYS CG C 24.476 0.500 . 778 1794 74 LYS CD C 28.902 0.500 . 779 1794 74 LYS CE C 41.995 0.500 . 780 1794 74 LYS N N 114.506 0.500 . 781 1795 75 HIS H H 7.054 0.050 . 782 1795 75 HIS HA H 4.753 0.050 . 783 1795 75 HIS HB2 H 3.351 0.050 . 784 1795 75 HIS HB3 H 2.816 0.050 . 785 1795 75 HIS HD2 H 6.979 0.050 . 786 1795 75 HIS HE1 H 7.890 0.050 . 787 1795 75 HIS C C 173.647 0.500 . 788 1795 75 HIS CA C 54.472 0.500 . 789 1795 75 HIS CB C 30.436 0.500 . 790 1795 75 HIS CD2 C 121.173 0.500 . 791 1795 75 HIS CE1 C 137.583 0.500 . 792 1795 75 HIS N N 112.933 0.500 . 793 1796 76 CYS H H 6.992 0.050 . 794 1796 76 CYS HA H 4.057 0.050 . 795 1796 76 CYS HB2 H 2.420 0.050 . 796 1796 76 CYS HB3 H 1.737 0.050 . 797 1796 76 CYS C C 175.998 0.500 . 798 1796 76 CYS CA C 60.186 0.500 . 799 1796 76 CYS CB C 30.030 0.500 . 800 1796 76 CYS N N 123.471 0.500 . 801 1797 77 GLN H H 9.150 0.050 . 802 1797 77 GLN HA H 4.629 0.050 . 803 1797 77 GLN HB2 H 2.384 0.050 . 804 1797 77 GLN HB3 H 1.781 0.050 . 805 1797 77 GLN HG2 H 2.294 0.050 . 806 1797 77 GLN HE21 H 7.414 0.050 . 807 1797 77 GLN HE22 H 6.814 0.050 . 808 1797 77 GLN C C 175.498 0.500 . 809 1797 77 GLN CA C 54.578 0.500 . 810 1797 77 GLN CB C 29.324 0.500 . 811 1797 77 GLN CG C 33.653 0.500 . 812 1797 77 GLN N N 128.412 0.500 . 813 1797 77 GLN NE2 N 112.494 0.500 . 814 1798 78 GLU H H 8.260 0.050 . 815 1798 78 GLU HA H 4.326 0.050 . 816 1798 78 GLU HB2 H 1.896 0.050 . 817 1798 78 GLU HB3 H 1.959 0.050 . 818 1798 78 GLU HG2 H 2.343 0.050 . 819 1798 78 GLU C C 176.553 0.500 . 820 1798 78 GLU CA C 55.835 0.500 . 821 1798 78 GLU CB C 30.326 0.500 . 822 1798 78 GLU CG C 35.798 0.500 . 823 1798 78 GLU N N 122.866 0.500 . 824 1799 79 ASN H H 8.951 0.050 . 825 1799 79 ASN HA H 4.458 0.050 . 826 1799 79 ASN HB2 H 2.806 0.050 . 827 1799 79 ASN HB3 H 2.751 0.050 . 828 1799 79 ASN HD21 H 6.992 0.050 . 829 1799 79 ASN HD22 H 7.642 0.050 . 830 1799 79 ASN C C 175.663 0.500 . 831 1799 79 ASN CA C 54.953 0.500 . 832 1799 79 ASN CB C 38.501 0.500 . 833 1799 79 ASN N N 125.605 0.500 . 834 1799 79 ASN ND2 N 112.472 0.500 . 835 1800 80 LYS H H 8.772 0.050 . 836 1800 80 LYS HA H 4.329 0.050 . 837 1800 80 LYS HB2 H 1.860 0.050 . 838 1800 80 LYS HB3 H 1.596 0.050 . 839 1800 80 LYS HG2 H 1.255 0.050 . 840 1800 80 LYS HG3 H 1.317 0.050 . 841 1800 80 LYS HD2 H 1.635 0.050 . 842 1800 80 LYS HD3 H 1.591 0.050 . 843 1800 80 LYS HE2 H 2.925 0.050 . 844 1800 80 LYS C C 174.878 0.500 . 845 1800 80 LYS CA C 54.628 0.500 . 846 1800 80 LYS CB C 30.812 0.500 . 847 1800 80 LYS CG C 24.692 0.500 . 848 1800 80 LYS CD C 29.091 0.500 . 849 1800 80 LYS CE C 42.100 0.500 . 850 1800 80 LYS N N 120.753 0.500 . 851 1801 81 CYS H H 7.072 0.050 . 852 1801 81 CYS HA H 4.221 0.050 . 853 1801 81 CYS HB2 H 2.791 0.050 . 854 1801 81 CYS HB3 H 2.923 0.050 . 855 1801 81 CYS CA C 57.864 0.500 . 856 1801 81 CYS CB C 30.595 0.500 . 857 1801 81 CYS N N 123.856 0.500 . 858 1802 82 PRO HA H 4.632 0.050 . 859 1802 82 PRO HB2 H 2.334 0.050 . 860 1802 82 PRO HB3 H 2.010 0.050 . 861 1802 82 PRO HG2 H 1.637 0.050 . 862 1802 82 PRO HG3 H 2.002 0.050 . 863 1802 82 PRO HD2 H 3.815 0.050 . 864 1802 82 PRO HD3 H 4.123 0.050 . 865 1802 82 PRO C C 176.736 0.500 . 866 1802 82 PRO CA C 62.869 0.500 . 867 1802 82 PRO CB C 32.074 0.500 . 868 1802 82 PRO CG C 26.569 0.500 . 869 1802 82 PRO CD C 51.291 0.500 . 870 1803 83 VAL H H 9.042 0.050 . 871 1803 83 VAL HA H 3.491 0.050 . 872 1803 83 VAL HB H 2.158 0.050 . 873 1803 83 VAL HG1 H 0.613 0.050 . 874 1803 83 VAL HG2 H 0.379 0.050 . 875 1803 83 VAL CA C 62.379 0.500 . 876 1803 83 VAL CB C 31.476 0.500 . 877 1803 83 VAL CG1 C 19.741 0.500 . 878 1803 83 VAL CG2 C 24.058 0.500 . 879 1803 83 VAL N N 128.026 0.500 . 880 1804 84 PRO HA H 3.917 0.050 . 881 1804 84 PRO HB2 H 1.844 0.050 . 882 1804 84 PRO HB3 H 1.647 0.050 . 883 1804 84 PRO HG3 H 1.904 0.050 . 884 1804 84 PRO HD2 H 3.976 0.050 . 885 1804 84 PRO HD3 H 3.363 0.050 . 886 1804 84 PRO CB C 31.605 0.500 . 887 1804 84 PRO CG C 28.446 0.500 . 888 1804 84 PRO CD C 50.419 0.500 . 889 1805 85 PHE HA H 4.163 0.050 . 890 1805 85 PHE HB2 H 3.198 0.050 . 891 1805 85 PHE HB3 H 3.479 0.050 . 892 1805 85 PHE HD1 H 7.042 0.050 . 893 1805 85 PHE HD2 H 7.042 0.050 . 894 1805 85 PHE HE1 H 7.289 0.050 . 895 1805 85 PHE HE2 H 7.289 0.050 . 896 1805 85 PHE HZ H 7.335 0.050 . 897 1805 85 PHE C C 175.241 0.500 . 898 1805 85 PHE CA C 60.352 0.500 . 899 1805 85 PHE CB C 37.130 0.500 . 900 1805 85 PHE CD1 C 131.898 0.500 . 901 1805 85 PHE CD2 C 131.898 0.500 . 902 1805 85 PHE CE1 C 131.159 0.500 . 903 1805 85 PHE CE2 C 131.159 0.500 . 904 1805 85 PHE CZ C 129.190 0.500 . 905 1806 86 CYS H H 7.740 0.050 . 906 1806 86 CYS HA H 3.992 0.050 . 907 1806 86 CYS HB2 H 3.174 0.050 . 908 1806 86 CYS HB3 H 2.708 0.050 . 909 1806 86 CYS CA C 64.445 0.500 . 910 1806 86 CYS CB C 29.662 0.500 . 911 1806 86 CYS N N 124.119 0.500 . 912 1807 87 LEU H H 8.137 0.050 . 913 1807 87 LEU HA H 4.046 0.050 . 914 1807 87 LEU HB2 H 1.505 0.050 . 915 1807 87 LEU HB3 H 1.693 0.050 . 916 1807 87 LEU HG H 1.709 0.050 . 917 1807 87 LEU HD1 H 0.881 0.050 . 918 1807 87 LEU HD2 H 0.895 0.050 . 919 1807 87 LEU C C 178.697 0.500 . 920 1807 87 LEU CA C 57.678 0.500 . 921 1807 87 LEU CB C 41.352 0.500 . 922 1807 87 LEU CG C 27.117 0.500 . 923 1807 87 LEU CD1 C 23.847 0.500 . 924 1807 87 LEU CD2 C 25.122 0.500 . 925 1807 87 LEU N N 116.071 0.500 . 926 1808 88 ASN H H 7.810 0.050 . 927 1808 88 ASN HA H 4.442 0.050 . 928 1808 88 ASN HB2 H 2.832 0.050 . 929 1808 88 ASN HB3 H 2.883 0.050 . 930 1808 88 ASN HD21 H 7.746 0.050 . 931 1808 88 ASN HD22 H 7.004 0.050 . 932 1808 88 ASN C C 177.013 0.500 . 933 1808 88 ASN CA C 55.740 0.500 . 934 1808 88 ASN CB C 38.864 0.500 . 935 1808 88 ASN N N 115.718 0.500 . 936 1808 88 ASN ND2 N 111.981 0.500 . 937 1809 89 ILE H H 8.212 0.050 . 938 1809 89 ILE HA H 3.845 0.050 . 939 1809 89 ILE HB H 1.942 0.050 . 940 1809 89 ILE HG12 H 1.662 0.050 . 941 1809 89 ILE HG13 H 1.159 0.050 . 942 1809 89 ILE HG2 H 0.853 0.050 . 943 1809 89 ILE HD1 H 0.766 0.050 . 944 1809 89 ILE C C 177.784 0.500 . 945 1809 89 ILE CA C 63.432 0.500 . 946 1809 89 ILE CB C 38.375 0.500 . 947 1809 89 ILE CG1 C 28.533 0.500 . 948 1809 89 ILE CG2 C 17.771 0.500 . 949 1809 89 ILE CD1 C 13.526 0.500 . 950 1809 89 ILE N N 120.413 0.500 . 951 1810 90 LYS H H 8.231 0.050 . 952 1810 90 LYS HA H 4.076 0.050 . 953 1810 90 LYS HB2 H 1.810 0.050 . 954 1810 90 LYS HG2 H 1.816 0.050 . 955 1810 90 LYS HG3 H 1.419 0.050 . 956 1810 90 LYS HD2 H 1.653 0.050 . 957 1810 90 LYS HD3 H 1.723 0.050 . 958 1810 90 LYS HE2 H 3.298 0.050 . 959 1810 90 LYS HE3 H 3.016 0.050 . 960 1810 90 LYS C C 176.991 0.500 . 961 1810 90 LYS CA C 58.364 0.500 . 962 1810 90 LYS CB C 32.967 0.500 . 963 1810 90 LYS CG C 25.448 0.500 . 964 1810 90 LYS CD C 30.133 0.500 . 965 1810 90 LYS CE C 42.238 0.500 . 966 1810 90 LYS N N 120.131 0.500 . 967 1811 91 GLN H H 7.847 0.050 . 968 1811 91 GLN HA H 4.234 0.050 . 969 1811 91 GLN HB2 H 2.058 0.050 . 970 1811 91 GLN HB3 H 2.137 0.050 . 971 1811 91 GLN HG2 H 2.433 0.050 . 972 1811 91 GLN HG3 H 2.385 0.050 . 973 1811 91 GLN HE21 H 7.612 0.050 . 974 1811 91 GLN HE22 H 6.859 0.050 . 975 1811 91 GLN C C 174.975 0.500 . 976 1811 91 GLN CA C 56.140 0.500 . 977 1811 91 GLN CB C 28.989 0.500 . 978 1811 91 GLN CG C 33.996 0.500 . 979 1811 91 GLN N N 118.978 0.500 . 980 1811 91 GLN NE2 N 112.075 0.500 . 981 1812 92 LYS H H 7.797 0.050 . 982 1812 92 LYS HA H 4.093 0.050 . 983 1812 92 LYS HB2 H 1.816 0.050 . 984 1812 92 LYS HB3 H 1.727 0.050 . 985 1812 92 LYS HG2 H 1.413 0.050 . 986 1812 92 LYS HD2 H 1.647 0.050 . 987 1812 92 LYS HE2 H 2.965 0.050 . 988 1812 92 LYS CA C 57.860 0.500 . 989 1812 92 LYS CB C 33.459 0.500 . 990 1812 92 LYS CG C 24.771 0.500 . 991 1812 92 LYS CD C 29.116 0.500 . 992 1812 92 LYS CE C 42.169 0.500 . 993 1812 92 LYS N N 127.489 0.500 . stop_ save_