data_15625 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR Structure of the VBS3 domain (residues 1815-1973) of Talin ; _BMRB_accession_number 15625 _BMRB_flat_file_name bmr15625.str _Entry_type original _Submission_date 2008-01-10 _Accession_date 2008-01-10 _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 Goult Benjamin T. . 2 Gingras Alexandre R. . 3 Critchley David R. . 4 Barsukov Igor L. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 899 "13C chemical shifts" 521 "15N chemical shifts" 171 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-07-22 update BMRB 'update related entry loop' 2010-05-24 update BMRB 'complete entry citation' 2008-09-19 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 15457 'domain, 1655-1822' 15458 'F0 domain (residues 1-85)' 15615 'F0F1 double domain' 15616 F1 16930 'F2 domain (residues 196-309)' 16932 'F2F3 domain (residues 196-405)' 16959 'F1F2 double domain (residues 86-303)' 17070 'domain C' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'The domain structure of talin: Residues 1815-1973 form a five-helix bundle containing a cryptic vinculin-binding site.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 20399778 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Goult Benjamin T. . 2 Gingras Alexandre R. . 3 Bate Neil . . 4 Barsukov Igor L. . 5 Critchley David R. . 6 Roberts Gordon C.K. . stop_ _Journal_abbreviation 'FEBS Lett' _Journal_name_full 'FEBS letters' _Journal_volume 584 _Journal_issue 11 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 2237 _Page_last 2241 _Year 2010 _Details . loop_ _Keyword NMR Talin VBS3 Vinculin stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name VBS3 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label VBS3 $VBS3 stop_ _System_molecular_weight 17263.3 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_VBS3 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common VBS3 _Molecular_mass 17263.3 _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 165 _Mol_residue_sequence ; GIDPFTNEAASAAGVVGGMV DSITQAINQLDEGPMGDPEG SFVDYQTTMVRTAKAIAVTV QEMVTKSNTSPEELGPLANQ LTSDYGRLASQAKPAAVAAE NEEIGAHIKHRVQELGHGCS ALVTKAGALQCSPSDVYTKK ELIECARRVSEKVSHVLAAL QAGNR ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1809 GLY 2 1810 ILE 3 1811 ASP 4 1812 PRO 5 1813 PHE 6 1814 THR 7 1815 ASN 8 1816 GLU 9 1817 ALA 10 1818 ALA 11 1819 SER 12 1820 ALA 13 1821 ALA 14 1822 GLY 15 1823 VAL 16 1824 VAL 17 1825 GLY 18 1826 GLY 19 1827 MET 20 1828 VAL 21 1829 ASP 22 1830 SER 23 1831 ILE 24 1832 THR 25 1833 GLN 26 1834 ALA 27 1835 ILE 28 1836 ASN 29 1837 GLN 30 1838 LEU 31 1839 ASP 32 1840 GLU 33 1841 GLY 34 1842 PRO 35 1843 MET 36 1844 GLY 37 1845 ASP 38 1846 PRO 39 1847 GLU 40 1848 GLY 41 1849 SER 42 1850 PHE 43 1851 VAL 44 1852 ASP 45 1853 TYR 46 1854 GLN 47 1855 THR 48 1856 THR 49 1857 MET 50 1858 VAL 51 1859 ARG 52 1860 THR 53 1861 ALA 54 1862 LYS 55 1863 ALA 56 1864 ILE 57 1865 ALA 58 1866 VAL 59 1867 THR 60 1868 VAL 61 1869 GLN 62 1870 GLU 63 1871 MET 64 1872 VAL 65 1873 THR 66 1874 LYS 67 1875 SER 68 1876 ASN 69 1877 THR 70 1878 SER 71 1879 PRO 72 1880 GLU 73 1881 GLU 74 1882 LEU 75 1883 GLY 76 1884 PRO 77 1885 LEU 78 1886 ALA 79 1887 ASN 80 1888 GLN 81 1889 LEU 82 1890 THR 83 1891 SER 84 1892 ASP 85 1893 TYR 86 1894 GLY 87 1895 ARG 88 1896 LEU 89 1897 ALA 90 1898 SER 91 1899 GLN 92 1900 ALA 93 1901 LYS 94 1902 PRO 95 1903 ALA 96 1904 ALA 97 1905 VAL 98 1906 ALA 99 1907 ALA 100 1908 GLU 101 1909 ASN 102 1910 GLU 103 1911 GLU 104 1912 ILE 105 1913 GLY 106 1914 ALA 107 1915 HIS 108 1916 ILE 109 1917 LYS 110 1918 HIS 111 1919 ARG 112 1920 VAL 113 1921 GLN 114 1922 GLU 115 1923 LEU 116 1924 GLY 117 1925 HIS 118 1926 GLY 119 1927 CYS 120 1928 SER 121 1929 ALA 122 1930 LEU 123 1931 VAL 124 1932 THR 125 1933 LYS 126 1934 ALA 127 1935 GLY 128 1936 ALA 129 1937 LEU 130 1938 GLN 131 1939 CYS 132 1940 SER 133 1941 PRO 134 1942 SER 135 1943 ASP 136 1944 VAL 137 1945 TYR 138 1946 THR 139 1947 LYS 140 1948 LYS 141 1949 GLU 142 1950 LEU 143 1951 ILE 144 1952 GLU 145 1953 CYS 146 1954 ALA 147 1955 ARG 148 1956 ARG 149 1957 VAL 150 1958 SER 151 1959 GLU 152 1960 LYS 153 1961 VAL 154 1962 SER 155 1963 HIS 156 1964 VAL 157 1965 LEU 158 1966 ALA 159 1967 ALA 160 1968 LEU 161 1969 GLN 162 1970 ALA 163 1971 GLY 164 1972 ASN 165 1973 ARG 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 PDB 2B0H "Solution Structure Of Vbs3 Fragment Of Talin" 82.42 137 97.06 97.79 1.13e-89 PDB 2KVP "Nmr Structure Of The Talin Vbs3 Domain, 1815-1973" 100.00 165 100.00 100.00 2.72e-116 DBJ BAC65702 "mKIAA1027 protein [Mus musculus]" 96.36 2564 100.00 100.00 1.09e-99 DBJ BAE27781 "unnamed protein product [Mus musculus]" 96.36 2541 100.00 100.00 1.05e-99 DBJ BAE41923 "unnamed protein product, partial [Mus musculus]" 96.36 1051 100.00 100.00 6.99e-103 DBJ BAE42391 "unnamed protein product [Mus musculus]" 96.36 1051 100.00 100.00 6.99e-103 EMBL CAA39588 "talin [Mus musculus]" 96.36 2541 100.00 100.00 1.05e-99 GB AAH18557 "Tln1 protein, partial [Mus musculus]" 96.36 939 100.00 100.00 1.20e-103 GB AAI00263 "Tln1 protein [Rattus norvegicus]" 96.36 1552 99.37 100.00 3.45e-100 GB AAI21788 "Tln1 protein [Mus musculus]" 96.36 1190 100.00 100.00 9.12e-102 GB AAI50811 "Talin 1 [Mus musculus]" 96.36 2541 100.00 100.00 1.05e-99 GB EDL02465 "talin 1, isoform CRA_a [Mus musculus]" 96.36 2123 100.00 100.00 2.54e-100 PRF 1617167A talin 96.36 2541 100.00 100.00 1.05e-99 REF NP_001034114 "talin-1 [Rattus norvegicus]" 96.36 2541 99.37 100.00 4.94e-99 REF NP_001192357 "talin-1 [Bos taurus]" 96.36 2541 98.11 99.37 5.79e-98 REF NP_035732 "talin-1 [Mus musculus]" 96.36 2541 100.00 100.00 1.05e-99 REF XP_001504543 "PREDICTED: talin-1 isoform X1 [Equus caballus]" 96.36 2541 97.48 98.74 3.80e-97 REF XP_002918927 "PREDICTED: talin-1 [Ailuropoda melanoleuca]" 96.36 2541 98.11 99.37 5.91e-98 SP P26039 "RecName: Full=Talin-1" 96.36 2541 100.00 100.00 1.05e-99 TPG DAA26829 "TPA: talin 1 [Bos taurus]" 96.36 2541 98.11 99.37 5.11e-98 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $VBS3 . 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 $VBS3 'recombinant technology' . Escherichia coli BL21(DE3) PET-151 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_unlabelled _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $VBS3 1 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' DTT 2 mM 'natural abundance' 'sodium phosphate' 20 mM 'natural abundance' H2O 90 % . D2O 10 % . stop_ save_ save_15n _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $VBS3 1 mM '[U-100% 15N]' 'sodium chloride' 50 mM 'natural abundance' DTT 2 mM 'natural abundance' H2O 90 % . D2O 10 % . stop_ save_ save_double _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $VBS3 1 mM '[U-100% 13C; U-100% 15N]' 'sodium chloride' 50 mM 'natural abundance' DTT 2 mM 'natural abundance' H2O 90 % . D2O 10 % . stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 2.0 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection processing stop_ _Details . save_ save_Analysis _Saveframe_category software _Name Analysis _Version 1.015 loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' '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_ARIA _Saveframe_category software _Name ARIA _Version 1.2 loop_ _Vendor _Address _Electronic_address 'Linge, O'Donoghue and Nilges' . . stop_ loop_ _Task refinement stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details 'with cryoprobe' save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 800 _Details 'with cryoprobe' save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $15n save_ save_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $double save_ save_3D_CBCA(CO)NH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $double save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $double save_ save_3D_HNCA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $double save_ save_3D_HNCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $double save_ save_3D_HCCH-TOCSY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $double save_ save_3D_1H-13C_NOESY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $double save_ save_3D_1H-15N_NOESY_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $15n 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' 50 0.1 mM pH 6.5 0.1 pH pressure 1 . atm temperature 298 0.1 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_ _Software_label $TOPSPIN stop_ loop_ _Experiment_label '2D 1H-15N HSQC' stop_ loop_ _Sample_label $15n stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name VBS3 _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 1809 1 GLY HA2 H 3.785 0.015 1 2 1809 1 GLY HA3 H 3.785 0.015 1 3 1809 1 GLY CA C 43.559 0.25 1 4 1810 2 ILE HA H 4.147 0.015 1 5 1810 2 ILE HB H 1.756 0.015 1 6 1810 2 ILE HD1 H 0.787 0.015 1 7 1810 2 ILE HG12 H 1.363 0.015 1 8 1810 2 ILE HG13 H 1.096 0.015 1 9 1810 2 ILE HG2 H 0.808 0.015 1 10 1810 2 ILE CA C 61.106 0.25 1 11 1810 2 ILE CB C 39.116 0.25 1 12 1810 2 ILE CD1 C 13.153 0.25 1 13 1810 2 ILE CG1 C 27.220 0.25 1 14 1810 2 ILE CG2 C 17.578 0.25 1 15 1811 3 ASP H H 8.361 0.015 1 16 1811 3 ASP HA H 4.824 0.015 1 17 1811 3 ASP HB2 H 2.721 0.015 1 18 1811 3 ASP HB3 H 2.489 0.015 1 19 1811 3 ASP CA C 52.223 0.25 1 20 1811 3 ASP CB C 41.543 0.25 1 21 1811 3 ASP N N 126.174 0.25 1 22 1812 4 PRO HA H 4.284 0.015 1 23 1812 4 PRO HB2 H 2.088 0.015 1 24 1812 4 PRO HB3 H 1.566 0.015 1 25 1812 4 PRO HD2 H 3.805 0.015 1 26 1812 4 PRO HD3 H 3.676 0.015 1 27 1812 4 PRO HG2 H 1.851 0.015 1 28 1812 4 PRO HG3 H 1.677 0.015 1 29 1812 4 PRO CA C 63.602 0.25 1 30 1812 4 PRO CB C 32.025 0.25 1 31 1812 4 PRO CD C 50.891 0.25 1 32 1812 4 PRO CG C 26.993 0.25 1 33 1813 5 PHE H H 8.201 0.015 1 34 1813 5 PHE HA H 4.593 0.015 1 35 1813 5 PHE HB2 H 3.170 0.015 1 36 1813 5 PHE HB3 H 3.041 0.015 1 37 1813 5 PHE HD1 H 7.262 0.015 3 38 1813 5 PHE HD2 H 7.262 0.015 3 39 1813 5 PHE HE1 H 7.357 0.015 3 40 1813 5 PHE HE2 H 7.357 0.015 3 41 1813 5 PHE HZ H 7.311 0.015 1 42 1813 5 PHE CA C 58.081 0.25 1 43 1813 5 PHE CB C 39.107 0.25 1 44 1813 5 PHE CD1 C 131.886 0.25 3 45 1813 5 PHE CD2 C 131.886 0.25 3 46 1813 5 PHE CE1 C 131.976 0.25 3 47 1813 5 PHE CE2 C 131.976 0.25 3 48 1813 5 PHE CZ C 130.343 0.25 1 49 1813 5 PHE N N 118.584 0.25 1 50 1814 6 THR H H 7.760 0.015 1 51 1814 6 THR HA H 4.267 0.015 1 52 1814 6 THR HB H 4.154 0.015 1 53 1814 6 THR HG2 H 1.133 0.015 1 54 1814 6 THR CA C 61.933 0.25 1 55 1814 6 THR CB C 70.054 0.25 1 56 1814 6 THR CG2 C 21.560 0.25 1 57 1814 6 THR N N 114.288 0.25 1 58 1815 7 ASN H H 8.310 0.015 1 59 1815 7 ASN HA H 4.618 0.015 1 60 1815 7 ASN HB2 H 2.701 0.015 1 61 1815 7 ASN HB3 H 2.814 0.015 1 62 1815 7 ASN HD21 H 7.554 0.015 1 63 1815 7 ASN HD22 H 6.827 0.015 1 64 1815 7 ASN CA C 53.555 0.25 1 65 1815 7 ASN CB C 39.102 0.25 1 66 1815 7 ASN N N 120.894 0.25 1 67 1815 7 ASN ND2 N 112.565 0.25 1 68 1816 8 GLU H H 8.395 0.015 1 69 1816 8 GLU HA H 4.165 0.015 1 70 1816 8 GLU HB2 H 1.998 0.015 1 71 1816 8 GLU HB3 H 1.899 0.015 1 72 1816 8 GLU HG2 H 2.219 0.015 1 73 1816 8 GLU HG3 H 2.219 0.015 1 74 1816 8 GLU CA C 57.425 0.25 1 75 1816 8 GLU CB C 30.182 0.25 1 76 1816 8 GLU CG C 36.421 0.25 1 77 1816 8 GLU N N 121.791 0.25 1 78 1817 9 ALA H H 8.195 0.015 1 79 1817 9 ALA HA H 4.220 0.015 1 80 1817 9 ALA HB H 1.346 0.015 1 81 1817 9 ALA CA C 53.171 0.25 1 82 1817 9 ALA CB C 19.123 0.25 1 83 1817 9 ALA N N 124.225 0.25 1 84 1818 10 ALA H H 8.067 0.015 1 85 1818 10 ALA HA H 4.220 0.015 1 86 1818 10 ALA HB H 1.357 0.015 1 87 1818 10 ALA CA C 53.138 0.25 1 88 1818 10 ALA CB C 19.196 0.25 1 89 1818 10 ALA N N 122.414 0.25 1 90 1819 11 SER H H 8.064 0.015 1 91 1819 11 SER HA H 4.354 0.015 1 92 1819 11 SER HB2 H 3.905 0.015 1 93 1819 11 SER HB3 H 3.828 0.015 1 94 1819 11 SER CA C 58.815 0.25 1 95 1819 11 SER CB C 64.031 0.25 1 96 1819 11 SER N N 114.441 0.25 1 97 1820 12 ALA H H 8.227 0.015 1 98 1820 12 ALA HA H 4.204 0.015 1 99 1820 12 ALA HB H 1.356 0.015 1 100 1820 12 ALA CA C 53.538 0.25 1 101 1820 12 ALA CB C 19.044 0.25 1 102 1820 12 ALA N N 125.743 0.25 1 103 1821 13 ALA H H 8.060 0.015 1 104 1821 13 ALA HA H 4.177 0.015 1 105 1821 13 ALA HB H 1.354 0.015 1 106 1821 13 ALA CA C 53.531 0.25 1 107 1821 13 ALA CB C 18.987 0.25 1 108 1821 13 ALA N N 121.402 0.25 1 109 1822 14 GLY H H 8.123 0.015 1 110 1822 14 GLY HA2 H 3.959 0.015 1 111 1822 14 GLY HA3 H 3.893 0.015 1 112 1822 14 GLY CA C 45.788 0.25 1 113 1822 14 GLY N N 107.129 0.25 1 114 1823 15 VAL H H 7.932 0.015 1 115 1823 15 VAL HA H 3.991 0.015 1 116 1823 15 VAL HB H 2.126 0.015 1 117 1823 15 VAL HG1 H 0.922 0.015 1 118 1823 15 VAL HG2 H 0.925 0.015 1 119 1823 15 VAL CA C 64.328 0.25 1 120 1823 15 VAL CB C 32.227 0.25 1 121 1823 15 VAL CG1 C 21.377 0.25 1 122 1823 15 VAL CG2 C 21.348 0.25 1 123 1823 15 VAL N N 120.195 0.25 1 124 1824 16 VAL H H 8.051 0.015 1 125 1824 16 VAL HA H 4.020 0.015 1 126 1824 16 VAL HB H 2.174 0.015 1 127 1824 16 VAL HG1 H 0.886 0.015 1 128 1824 16 VAL HG2 H 0.933 0.015 1 129 1824 16 VAL CA C 64.106 0.25 1 130 1824 16 VAL CB C 32.230 0.25 1 131 1824 16 VAL CG1 C 21.550 0.25 1 132 1824 16 VAL CG2 C 21.029 0.25 1 133 1824 16 VAL N N 118.792 0.25 1 134 1825 17 GLY H H 8.174 0.015 1 135 1825 17 GLY HA2 H 3.730 0.015 1 136 1825 17 GLY HA3 H 3.864 0.015 1 137 1825 17 GLY CA C 47.348 0.25 1 138 1825 17 GLY N N 109.254 0.25 1 139 1826 18 GLY H H 8.106 0.015 1 140 1826 18 GLY HA2 H 3.945 0.015 1 141 1826 18 GLY HA3 H 3.882 0.015 1 142 1826 18 GLY CA C 46.759 0.25 1 143 1826 18 GLY N N 108.234 0.25 1 144 1827 19 MET H H 7.673 0.015 1 145 1827 19 MET HA H 4.173 0.015 1 146 1827 19 MET HB2 H 2.198 0.015 1 147 1827 19 MET HB3 H 2.324 0.015 1 148 1827 19 MET HE H 2.010 0.015 1 149 1827 19 MET HG2 H 2.615 0.015 1 150 1827 19 MET HG3 H 2.615 0.015 1 151 1827 19 MET CA C 59.671 0.25 1 152 1827 19 MET CB C 33.313 0.25 1 153 1827 19 MET CE C 18.171 0.25 1 154 1827 19 MET CG C 33.320 0.25 1 155 1827 19 MET N N 122.420 0.25 1 156 1828 20 VAL H H 8.154 0.015 1 157 1828 20 VAL HA H 3.432 0.015 1 158 1828 20 VAL HB H 2.070 0.015 1 159 1828 20 VAL HG1 H 0.936 0.015 1 160 1828 20 VAL HG2 H 0.850 0.015 1 161 1828 20 VAL CA C 67.284 0.25 1 162 1828 20 VAL CB C 31.594 0.25 1 163 1828 20 VAL CG1 C 22.941 0.25 1 164 1828 20 VAL CG2 C 21.000 0.25 1 165 1828 20 VAL N N 119.354 0.25 1 166 1829 21 ASP H H 8.378 0.015 1 167 1829 21 ASP HA H 4.366 0.015 1 168 1829 21 ASP HB2 H 2.628 0.015 1 169 1829 21 ASP HB3 H 2.733 0.015 1 170 1829 21 ASP CA C 57.740 0.25 1 171 1829 21 ASP CB C 40.472 0.25 1 172 1829 21 ASP N N 121.719 0.25 1 173 1830 22 SER H H 7.846 0.015 1 174 1830 22 SER HA H 4.150 0.015 1 175 1830 22 SER HB2 H 4.020 0.015 1 176 1830 22 SER HB3 H 3.970 0.015 1 177 1830 22 SER CA C 62.273 0.25 1 178 1830 22 SER CB C 63.117 0.25 1 179 1830 22 SER N N 116.064 0.25 1 180 1831 23 ILE H H 8.306 0.015 1 181 1831 23 ILE HA H 3.807 0.015 1 182 1831 23 ILE HB H 1.781 0.015 1 183 1831 23 ILE HD1 H 0.645 0.015 1 184 1831 23 ILE HG12 H 2.078 0.015 1 185 1831 23 ILE HG13 H 2.078 0.015 1 186 1831 23 ILE HG2 H 0.600 0.015 1 187 1831 23 ILE CA C 66.272 0.25 1 188 1831 23 ILE CB C 38.598 0.25 1 189 1831 23 ILE CD1 C 13.449 0.25 1 190 1831 23 ILE CG1 C 30.326 0.25 1 191 1831 23 ILE CG2 C 18.090 0.25 1 192 1831 23 ILE N N 123.999 0.25 1 193 1832 24 THR H H 8.611 0.015 1 194 1832 24 THR HA H 3.660 0.015 1 195 1832 24 THR HB H 4.329 0.015 1 196 1832 24 THR HG2 H 1.179 0.015 1 197 1832 24 THR CA C 67.405 0.25 1 198 1832 24 THR CB C 68.894 0.25 1 199 1832 24 THR CG2 C 21.612 0.25 1 200 1832 24 THR N N 116.450 0.25 1 201 1833 25 GLN H H 8.202 0.015 1 202 1833 25 GLN HA H 4.028 0.015 1 203 1833 25 GLN HB2 H 2.112 0.015 1 204 1833 25 GLN HB3 H 2.112 0.015 1 205 1833 25 GLN HE21 H 6.761 0.015 1 206 1833 25 GLN HE22 H 7.418 0.015 1 207 1833 25 GLN HG2 H 2.468 0.015 1 208 1833 25 GLN HG3 H 2.365 0.015 1 209 1833 25 GLN CA C 59.283 0.25 1 210 1833 25 GLN CB C 28.320 0.25 1 211 1833 25 GLN CG C 33.969 0.25 1 212 1833 25 GLN N N 120.021 0.25 1 213 1833 25 GLN NE2 N 112.085 0.25 1 214 1834 26 ALA H H 7.772 0.015 1 215 1834 26 ALA HA H 4.108 0.015 1 216 1834 26 ALA HB H 1.593 0.015 1 217 1834 26 ALA CA C 55.164 0.25 1 218 1834 26 ALA CB C 18.526 0.25 1 219 1834 26 ALA N N 122.869 0.25 1 220 1835 27 ILE H H 8.448 0.015 1 221 1835 27 ILE HA H 3.591 0.015 1 222 1835 27 ILE HB H 1.934 0.015 1 223 1835 27 ILE HD1 H 0.109 0.015 1 224 1835 27 ILE HG12 H 0.937 0.015 1 225 1835 27 ILE HG13 H 2.053 0.015 1 226 1835 27 ILE HG2 H 0.790 0.015 1 227 1835 27 ILE CA C 66.139 0.25 1 228 1835 27 ILE CB C 39.593 0.25 1 229 1835 27 ILE CD1 C 14.115 0.25 1 230 1835 27 ILE CG1 C 28.926 0.25 1 231 1835 27 ILE CG2 C 17.916 0.25 1 232 1835 27 ILE N N 118.265 0.25 1 233 1836 28 ASN H H 8.283 0.015 1 234 1836 28 ASN HA H 4.436 0.015 1 235 1836 28 ASN HB2 H 2.844 0.015 1 236 1836 28 ASN HB3 H 2.844 0.015 1 237 1836 28 ASN HD21 H 7.468 0.015 1 238 1836 28 ASN HD22 H 6.794 0.015 1 239 1836 28 ASN CA C 55.819 0.25 1 240 1836 28 ASN CB C 37.905 0.25 1 241 1836 28 ASN N N 118.549 0.25 1 242 1836 28 ASN ND2 N 114.346 0.25 1 243 1837 29 GLN H H 8.225 0.015 1 244 1837 29 GLN HA H 4.125 0.015 1 245 1837 29 GLN HB2 H 2.069 0.015 1 246 1837 29 GLN HB3 H 2.249 0.015 1 247 1837 29 GLN HE21 H 7.435 0.015 1 248 1837 29 GLN HE22 H 6.678 0.015 1 249 1837 29 GLN HG2 H 2.462 0.015 1 250 1837 29 GLN HG3 H 2.568 0.015 1 251 1837 29 GLN CA C 58.182 0.25 1 252 1837 29 GLN CB C 28.131 0.25 1 253 1837 29 GLN CG C 34.360 0.25 1 254 1837 29 GLN N N 119.321 0.25 1 255 1837 29 GLN NE2 N 111.287 0.25 1 256 1838 30 LEU H H 7.394 0.015 1 257 1838 30 LEU HA H 4.115 0.015 1 258 1838 30 LEU HB2 H 2.008 0.015 1 259 1838 30 LEU HB3 H 1.463 0.015 1 260 1838 30 LEU HD1 H 0.977 0.015 1 261 1838 30 LEU HD2 H 0.939 0.015 1 262 1838 30 LEU HG H 1.879 0.015 1 263 1838 30 LEU CA C 56.945 0.25 1 264 1838 30 LEU CB C 41.850 0.25 1 265 1838 30 LEU CD1 C 25.953 0.25 1 266 1838 30 LEU CD2 C 24.594 0.25 1 267 1838 30 LEU CG C 27.361 0.25 1 268 1838 30 LEU N N 118.989 0.25 1 269 1839 31 ASP H H 7.508 0.015 1 270 1839 31 ASP HA H 4.725 0.015 1 271 1839 31 ASP HB2 H 2.816 0.015 1 272 1839 31 ASP HB3 H 2.629 0.015 1 273 1839 31 ASP CA C 55.363 0.25 1 274 1839 31 ASP CB C 42.098 0.25 1 275 1839 31 ASP N N 117.176 0.25 1 276 1840 32 GLU H H 7.337 0.015 1 277 1840 32 GLU HA H 4.342 0.015 1 278 1840 32 GLU HB2 H 2.040 0.015 1 279 1840 32 GLU HB3 H 1.901 0.015 1 280 1840 32 GLU HG2 H 2.274 0.015 1 281 1840 32 GLU HG3 H 2.210 0.015 1 282 1840 32 GLU CA C 56.098 0.25 1 283 1840 32 GLU CB C 31.513 0.25 1 284 1840 32 GLU CG C 36.310 0.25 1 285 1840 32 GLU N N 118.961 0.25 1 286 1841 33 GLY H H 8.355 0.015 1 287 1841 33 GLY HA2 H 4.102 0.015 1 288 1841 33 GLY HA3 H 3.948 0.015 1 289 1841 33 GLY CA C 44.780 0.25 1 290 1841 33 GLY N N 109.291 0.25 1 291 1842 34 PRO HA H 4.365 0.015 1 292 1842 34 PRO HB2 H 2.156 0.015 1 293 1842 34 PRO HB3 H 1.932 0.015 1 294 1842 34 PRO HD2 H 3.580 0.015 1 295 1842 34 PRO HD3 H 3.580 0.015 1 296 1842 34 PRO HG2 H 1.985 0.015 1 297 1842 34 PRO HG3 H 1.932 0.015 1 298 1842 34 PRO CA C 63.055 0.25 1 299 1842 34 PRO CB C 32.451 0.25 1 300 1842 34 PRO CD C 49.985 0.25 1 301 1842 34 PRO CG C 27.211 0.25 1 302 1843 35 MET H H 8.489 0.015 1 303 1843 35 MET HA H 4.464 0.015 1 304 1843 35 MET HB2 H 2.025 0.015 1 305 1843 35 MET HB3 H 1.933 0.015 1 306 1843 35 MET HE H 2.035 0.015 1 307 1843 35 MET HG2 H 2.564 0.015 1 308 1843 35 MET HG3 H 2.501 0.015 1 309 1843 35 MET CA C 55.482 0.25 1 310 1843 35 MET CB C 33.648 0.25 1 311 1843 35 MET CE C 17.137 0.25 1 312 1843 35 MET CG C 32.017 0.25 1 313 1843 35 MET N N 120.913 0.25 1 314 1844 36 GLY H H 8.048 0.015 1 315 1844 36 GLY HA2 H 3.935 0.015 1 316 1844 36 GLY HA3 H 3.863 0.015 1 317 1844 36 GLY CA C 44.643 0.25 1 318 1844 36 GLY N N 109.378 0.25 1 319 1845 37 ASP H H 8.262 0.015 1 320 1845 37 ASP HA H 4.887 0.015 1 321 1845 37 ASP HB2 H 2.652 0.015 1 322 1845 37 ASP HB3 H 2.393 0.015 1 323 1845 37 ASP CA C 52.649 0.25 1 324 1845 37 ASP CB C 40.857 0.25 1 325 1845 37 ASP N N 120.762 0.25 1 326 1846 38 PRO HA H 4.422 0.015 1 327 1846 38 PRO HB2 H 2.254 0.015 1 328 1846 38 PRO HB3 H 2.132 0.015 1 329 1846 38 PRO HD2 H 3.741 0.015 1 330 1846 38 PRO HD3 H 3.799 0.015 1 331 1846 38 PRO HG2 H 2.122 0.015 1 332 1846 38 PRO HG3 H 1.951 0.015 1 333 1846 38 PRO CA C 63.378 0.25 1 334 1846 38 PRO CB C 32.372 0.25 1 335 1846 38 PRO CD C 50.660 0.25 1 336 1846 38 PRO CG C 27.616 0.25 1 337 1847 39 GLU H H 8.558 0.015 1 338 1847 39 GLU HA H 4.361 0.015 1 339 1847 39 GLU HB2 H 2.079 0.015 1 340 1847 39 GLU HB3 H 1.890 0.015 1 341 1847 39 GLU HG2 H 2.253 0.015 1 342 1847 39 GLU HG3 H 2.196 0.015 1 343 1847 39 GLU CA C 56.479 0.25 1 344 1847 39 GLU CB C 30.812 0.25 1 345 1847 39 GLU CG C 36.480 0.25 1 346 1847 39 GLU N N 121.803 0.25 1 347 1848 40 GLY H H 7.893 0.015 1 348 1848 40 GLY HA2 H 4.065 0.015 1 349 1848 40 GLY HA3 H 3.808 0.015 1 350 1848 40 GLY CA C 44.667 0.25 1 351 1848 40 GLY N N 108.383 0.25 1 352 1849 41 SER H H 8.614 0.015 1 353 1849 41 SER HA H 4.727 0.015 1 354 1849 41 SER HB2 H 4.075 0.015 1 355 1849 41 SER HB3 H 3.920 0.015 1 356 1849 41 SER CA C 57.055 0.25 1 357 1849 41 SER CB C 65.305 0.25 1 358 1849 41 SER N N 115.258 0.25 1 359 1850 42 PHE H H 9.297 0.015 1 360 1850 42 PHE HA H 4.170 0.015 1 361 1850 42 PHE HB2 H 3.257 0.015 1 362 1850 42 PHE HB3 H 3.002 0.015 1 363 1850 42 PHE HD1 H 7.243 0.015 3 364 1850 42 PHE HD2 H 7.243 0.015 3 365 1850 42 PHE HE1 H 7.162 0.015 3 366 1850 42 PHE HE2 H 7.162 0.015 3 367 1850 42 PHE HZ H 7.208 0.015 1 368 1850 42 PHE CA C 63.448 0.25 1 369 1850 42 PHE CB C 38.775 0.25 1 370 1850 42 PHE CD1 C 132.382 0.25 3 371 1850 42 PHE CD2 C 132.382 0.25 3 372 1850 42 PHE CE1 C 131.060 0.25 3 373 1850 42 PHE CE2 C 131.060 0.25 3 374 1850 42 PHE CZ C 128.821 0.25 1 375 1850 42 PHE N N 122.735 0.25 1 376 1851 43 VAL H H 8.211 0.015 1 377 1851 43 VAL HA H 3.732 0.015 1 378 1851 43 VAL HB H 2.017 0.015 1 379 1851 43 VAL HG1 H 1.031 0.015 1 380 1851 43 VAL HG2 H 0.913 0.015 1 381 1851 43 VAL CA C 65.449 0.25 1 382 1851 43 VAL CB C 31.657 0.25 1 383 1851 43 VAL CG1 C 22.041 0.25 1 384 1851 43 VAL CG2 C 20.773 0.25 1 385 1851 43 VAL N N 115.823 0.25 1 386 1852 44 ASP H H 7.325 0.015 1 387 1852 44 ASP HA H 4.244 0.015 1 388 1852 44 ASP HB2 H 2.538 0.015 1 389 1852 44 ASP HB3 H 2.346 0.015 1 390 1852 44 ASP CA C 57.657 0.25 1 391 1852 44 ASP CB C 40.116 0.25 1 392 1852 44 ASP N N 122.377 0.25 1 393 1853 45 TYR H H 7.187 0.015 1 394 1853 45 TYR HA H 4.105 0.015 1 395 1853 45 TYR HB2 H 2.819 0.015 1 396 1853 45 TYR HB3 H 2.537 0.015 1 397 1853 45 TYR HD1 H 6.963 0.015 3 398 1853 45 TYR HD2 H 6.963 0.015 3 399 1853 45 TYR HE1 H 6.673 0.015 3 400 1853 45 TYR HE2 H 6.673 0.015 3 401 1853 45 TYR CA C 61.773 0.25 1 402 1853 45 TYR CB C 38.973 0.25 1 403 1853 45 TYR CD1 C 132.954 0.25 3 404 1853 45 TYR CD2 C 132.954 0.25 3 405 1853 45 TYR CE1 C 118.110 0.25 3 406 1853 45 TYR CE2 C 118.110 0.25 3 407 1853 45 TYR N N 117.916 0.25 1 408 1854 46 GLN H H 8.839 0.015 1 409 1854 46 GLN HA H 3.451 0.015 1 410 1854 46 GLN HB2 H 1.311 0.015 1 411 1854 46 GLN HB3 H 2.043 0.015 1 412 1854 46 GLN HE21 H 6.949 0.015 1 413 1854 46 GLN HE22 H 7.525 0.015 1 414 1854 46 GLN HG2 H 2.065 0.015 1 415 1854 46 GLN HG3 H 1.931 0.015 1 416 1854 46 GLN CA C 60.163 0.25 1 417 1854 46 GLN CB C 29.289 0.25 1 418 1854 46 GLN CG C 33.824 0.25 1 419 1854 46 GLN N N 120.298 0.25 1 420 1854 46 GLN NE2 N 111.662 0.25 1 421 1855 47 THR H H 8.111 0.015 1 422 1855 47 THR HA H 3.746 0.015 1 423 1855 47 THR HB H 4.215 0.015 1 424 1855 47 THR HG2 H 1.168 0.015 1 425 1855 47 THR CA C 66.755 0.25 1 426 1855 47 THR CB C 69.096 0.25 1 427 1855 47 THR CG2 C 21.466 0.25 1 428 1855 47 THR N N 112.982 0.25 1 429 1856 48 THR H H 7.459 0.015 1 430 1856 48 THR HA H 3.892 0.015 1 431 1856 48 THR HB H 4.171 0.015 1 432 1856 48 THR HG2 H 1.147 0.015 1 433 1856 48 THR CA C 66.006 0.25 1 434 1856 48 THR CB C 68.392 0.25 1 435 1856 48 THR CG2 C 21.988 0.25 1 436 1856 48 THR N N 116.048 0.25 1 437 1857 49 MET H H 8.840 0.015 1 438 1857 49 MET HA H 3.903 0.015 1 439 1857 49 MET HB2 H 1.876 0.015 1 440 1857 49 MET HB3 H 2.034 0.015 1 441 1857 49 MET HE H 1.785 0.015 1 442 1857 49 MET HG2 H 2.336 0.015 1 443 1857 49 MET HG3 H 2.878 0.015 1 444 1857 49 MET CA C 60.432 0.25 1 445 1857 49 MET CB C 34.214 0.25 1 446 1857 49 MET CE C 16.739 0.25 1 447 1857 49 MET CG C 34.220 0.25 1 448 1857 49 MET N N 123.309 0.25 1 449 1858 50 VAL H H 8.524 0.015 1 450 1858 50 VAL HA H 3.384 0.015 1 451 1858 50 VAL HB H 2.113 0.015 1 452 1858 50 VAL HG1 H 1.023 0.015 1 453 1858 50 VAL HG2 H 0.848 0.015 1 454 1858 50 VAL CA C 67.262 0.25 1 455 1858 50 VAL CB C 31.709 0.25 1 456 1858 50 VAL CG1 C 24.281 0.25 1 457 1858 50 VAL CG2 C 21.066 0.25 1 458 1858 50 VAL N N 119.929 0.25 1 459 1859 51 ARG H H 7.196 0.015 1 460 1859 51 ARG HA H 3.906 0.015 1 461 1859 51 ARG HB2 H 1.909 0.015 1 462 1859 51 ARG HB3 H 1.909 0.015 1 463 1859 51 ARG HD2 H 3.137 0.015 1 464 1859 51 ARG HD3 H 3.137 0.015 1 465 1859 51 ARG HG2 H 1.564 0.015 1 466 1859 51 ARG HG3 H 1.761 0.015 1 467 1859 51 ARG CA C 60.087 0.25 1 468 1859 51 ARG CB C 30.145 0.25 1 469 1859 51 ARG CD C 43.574 0.25 1 470 1859 51 ARG CG C 27.705 0.25 1 471 1859 51 ARG N N 117.688 0.25 1 472 1860 52 THR H H 8.198 0.015 1 473 1860 52 THR HA H 3.876 0.015 1 474 1860 52 THR HB H 4.090 0.015 1 475 1860 52 THR HG2 H 1.157 0.015 1 476 1860 52 THR CA C 66.921 0.25 1 477 1860 52 THR CB C 68.167 0.25 1 478 1860 52 THR CG2 C 24.105 0.25 1 479 1860 52 THR N N 117.680 0.25 1 480 1861 53 ALA H H 8.930 0.015 1 481 1861 53 ALA HA H 3.914 0.015 1 482 1861 53 ALA HB H 1.378 0.015 1 483 1861 53 ALA CA C 55.996 0.25 1 484 1861 53 ALA CB C 17.147 0.25 1 485 1861 53 ALA N N 124.151 0.25 1 486 1862 54 LYS H H 8.268 0.015 1 487 1862 54 LYS HA H 3.903 0.015 1 488 1862 54 LYS HB2 H 1.820 0.015 1 489 1862 54 LYS HB3 H 1.857 0.015 1 490 1862 54 LYS HD2 H 1.571 0.015 1 491 1862 54 LYS HD3 H 1.571 0.015 1 492 1862 54 LYS HE2 H 2.778 0.015 1 493 1862 54 LYS HE3 H 2.834 0.015 1 494 1862 54 LYS HG2 H 1.341 0.015 1 495 1862 54 LYS HG3 H 1.732 0.015 1 496 1862 54 LYS CA C 60.419 0.25 1 497 1862 54 LYS CB C 32.289 0.25 1 498 1862 54 LYS CD C 29.706 0.25 1 499 1862 54 LYS CE C 42.189 0.25 1 500 1862 54 LYS CG C 26.953 0.25 1 501 1862 54 LYS N N 116.064 0.25 1 502 1863 55 ALA H H 7.648 0.015 1 503 1863 55 ALA HA H 4.117 0.015 1 504 1863 55 ALA HB H 1.522 0.015 1 505 1863 55 ALA CA C 55.249 0.25 1 506 1863 55 ALA CB C 17.696 0.25 1 507 1863 55 ALA N N 122.663 0.25 1 508 1864 56 ILE H H 8.018 0.015 1 509 1864 56 ILE HA H 3.908 0.015 1 510 1864 56 ILE HB H 2.229 0.015 1 511 1864 56 ILE HD1 H 0.719 0.015 1 512 1864 56 ILE HG12 H 1.091 0.015 1 513 1864 56 ILE HG13 H 2.024 0.015 1 514 1864 56 ILE HG2 H 0.814 0.015 1 515 1864 56 ILE CA C 65.731 0.25 1 516 1864 56 ILE CB C 37.944 0.25 1 517 1864 56 ILE CD1 C 16.312 0.25 1 518 1864 56 ILE CG1 C 30.394 0.25 1 519 1864 56 ILE CG2 C 14.626 0.25 1 520 1864 56 ILE N N 121.360 0.25 1 521 1865 57 ALA H H 7.797 0.015 1 522 1865 57 ALA HA H 3.892 0.015 1 523 1865 57 ALA HB H 1.559 0.015 1 524 1865 57 ALA CA C 55.826 0.25 1 525 1865 57 ALA CB C 18.001 0.25 1 526 1865 57 ALA N N 120.511 0.25 1 527 1866 58 VAL H H 7.830 0.015 1 528 1866 58 VAL HA H 3.669 0.015 1 529 1866 58 VAL HB H 2.199 0.015 1 530 1866 58 VAL HG1 H 1.053 0.015 1 531 1866 58 VAL HG2 H 0.927 0.015 1 532 1866 58 VAL CA C 66.882 0.25 1 533 1866 58 VAL CB C 31.877 0.25 1 534 1866 58 VAL CG1 C 23.015 0.25 1 535 1866 58 VAL CG2 C 21.468 0.25 1 536 1866 58 VAL N N 119.411 0.25 1 537 1867 59 THR H H 8.217 0.015 1 538 1867 59 THR HA H 3.795 0.015 1 539 1867 59 THR HB H 4.280 0.015 1 540 1867 59 THR HG2 H 1.183 0.015 1 541 1867 59 THR CA C 67.086 0.25 1 542 1867 59 THR CB C 67.939 0.25 1 543 1867 59 THR CG2 C 24.506 0.25 1 544 1867 59 THR N N 120.497 0.25 1 545 1868 60 VAL H H 8.455 0.015 1 546 1868 60 VAL HA H 3.439 0.015 1 547 1868 60 VAL HB H 2.079 0.015 1 548 1868 60 VAL HG1 H 0.945 0.015 1 549 1868 60 VAL HG2 H 0.908 0.015 1 550 1868 60 VAL CA C 67.694 0.25 1 551 1868 60 VAL CB C 31.530 0.25 1 552 1868 60 VAL CG1 C 24.057 0.25 1 553 1868 60 VAL CG2 C 22.794 0.25 1 554 1868 60 VAL N N 120.567 0.25 1 555 1869 61 GLN H H 7.537 0.015 1 556 1869 61 GLN HA H 3.993 0.015 1 557 1869 61 GLN HB2 H 2.194 0.015 1 558 1869 61 GLN HB3 H 2.194 0.015 1 559 1869 61 GLN HE21 H 7.290 0.015 1 560 1869 61 GLN HE22 H 6.788 0.015 1 561 1869 61 GLN HG2 H 2.424 0.015 1 562 1869 61 GLN HG3 H 2.424 0.015 1 563 1869 61 GLN CA C 58.872 0.25 1 564 1869 61 GLN CB C 27.978 0.25 1 565 1869 61 GLN CG C 33.883 0.25 1 566 1869 61 GLN N N 118.224 0.25 1 567 1869 61 GLN NE2 N 111.814 0.25 1 568 1870 62 GLU H H 8.340 0.015 1 569 1870 62 GLU HA H 4.083 0.015 1 570 1870 62 GLU HB2 H 2.055 0.015 1 571 1870 62 GLU HB3 H 2.246 0.015 1 572 1870 62 GLU HG2 H 2.340 0.015 1 573 1870 62 GLU HG3 H 2.252 0.015 1 574 1870 62 GLU CA C 59.393 0.25 1 575 1870 62 GLU CB C 29.691 0.25 1 576 1870 62 GLU CG C 36.698 0.25 1 577 1870 62 GLU N N 121.018 0.25 1 578 1871 63 MET H H 8.463 0.015 1 579 1871 63 MET HA H 3.679 0.015 1 580 1871 63 MET HB2 H 2.422 0.015 1 581 1871 63 MET HB3 H 1.837 0.015 1 582 1871 63 MET HE H 1.804 0.015 1 583 1871 63 MET HG2 H 2.111 0.015 1 584 1871 63 MET HG3 H 3.032 0.015 1 585 1871 63 MET CA C 60.187 0.25 1 586 1871 63 MET CB C 33.360 0.25 1 587 1871 63 MET CE C 17.472 0.25 1 588 1871 63 MET CG C 34.969 0.25 1 589 1871 63 MET N N 118.944 0.25 1 590 1872 64 VAL H H 7.829 0.015 1 591 1872 64 VAL HA H 3.234 0.015 1 592 1872 64 VAL HB H 2.267 0.015 1 593 1872 64 VAL HG1 H 0.931 0.015 1 594 1872 64 VAL HG2 H 0.844 0.015 1 595 1872 64 VAL CA C 67.686 0.25 1 596 1872 64 VAL CB C 31.411 0.25 1 597 1872 64 VAL CG1 C 23.672 0.25 1 598 1872 64 VAL CG2 C 21.170 0.25 1 599 1872 64 VAL N N 119.524 0.25 1 600 1873 65 THR H H 8.182 0.015 1 601 1873 65 THR HA H 3.918 0.015 1 602 1873 65 THR HB H 4.204 0.015 1 603 1873 65 THR HG2 H 1.198 0.015 1 604 1873 65 THR CA C 66.750 0.25 1 605 1873 65 THR CB C 68.837 0.25 1 606 1873 65 THR CG2 C 22.140 0.25 1 607 1873 65 THR N N 117.674 0.25 1 608 1874 66 LYS H H 8.841 0.015 1 609 1874 66 LYS HA H 4.219 0.015 1 610 1874 66 LYS HB2 H 1.694 0.015 1 611 1874 66 LYS HB3 H 1.694 0.015 1 612 1874 66 LYS HD2 H 1.466 0.015 1 613 1874 66 LYS HD3 H 1.544 0.015 1 614 1874 66 LYS HE2 H 2.880 0.015 1 615 1874 66 LYS HE3 H 2.946 0.015 1 616 1874 66 LYS HG2 H 1.428 0.015 1 617 1874 66 LYS HG3 H 1.428 0.015 1 618 1874 66 LYS CA C 57.821 0.25 1 619 1874 66 LYS CB C 30.996 0.25 1 620 1874 66 LYS CD C 28.521 0.25 1 621 1874 66 LYS CE C 42.441 0.25 1 622 1874 66 LYS CG C 26.137 0.25 1 623 1874 66 LYS N N 120.262 0.25 1 624 1875 67 SER H H 8.123 0.015 1 625 1875 67 SER HA H 3.726 0.015 1 626 1875 67 SER HB2 H 4.025 0.015 1 627 1875 67 SER HB3 H 4.025 0.015 1 628 1875 67 SER CA C 62.876 0.25 1 629 1875 67 SER CB C 62.979 0.25 1 630 1875 67 SER N N 115.268 0.25 1 631 1876 68 ASN H H 7.094 0.015 1 632 1876 68 ASN HA H 4.717 0.015 1 633 1876 68 ASN HB2 H 2.849 0.015 1 634 1876 68 ASN HB3 H 2.883 0.015 1 635 1876 68 ASN HD21 H 7.470 0.015 1 636 1876 68 ASN HD22 H 6.783 0.015 1 637 1876 68 ASN CA C 54.670 0.25 1 638 1876 68 ASN CB C 40.714 0.25 1 639 1876 68 ASN N N 115.333 0.25 1 640 1876 68 ASN ND2 N 110.645 0.25 1 641 1877 69 THR H H 7.604 0.015 1 642 1877 69 THR HA H 4.420 0.015 1 643 1877 69 THR HB H 4.173 0.015 1 644 1877 69 THR HG2 H 1.147 0.015 1 645 1877 69 THR CA C 63.132 0.25 1 646 1877 69 THR CB C 70.628 0.25 1 647 1877 69 THR CG2 C 22.051 0.25 1 648 1877 69 THR N N 107.921 0.25 1 649 1878 70 SER H H 8.697 0.015 1 650 1878 70 SER HA H 4.891 0.015 1 651 1878 70 SER HB2 H 3.904 0.015 1 652 1878 70 SER HB3 H 3.674 0.015 1 653 1878 70 SER CA C 55.763 0.25 1 654 1878 70 SER CB C 63.330 0.25 1 655 1878 70 SER N N 116.408 0.25 1 656 1879 71 PRO HA H 3.924 0.015 1 657 1879 71 PRO HB2 H 2.173 0.015 1 658 1879 71 PRO HB3 H 1.898 0.015 1 659 1879 71 PRO HD2 H 3.749 0.015 1 660 1879 71 PRO HD3 H 3.403 0.015 1 661 1879 71 PRO HG2 H 2.062 0.015 1 662 1879 71 PRO HG3 H 2.062 0.015 1 663 1879 71 PRO CA C 64.906 0.25 1 664 1879 71 PRO CB C 31.641 0.25 1 665 1879 71 PRO CD C 50.152 0.25 1 666 1879 71 PRO CG C 27.697 0.25 1 667 1880 72 GLU H H 9.461 0.015 1 668 1880 72 GLU HA H 4.254 0.015 1 669 1880 72 GLU HB2 H 2.079 0.015 1 670 1880 72 GLU HB3 H 2.032 0.015 1 671 1880 72 GLU HG2 H 2.347 0.015 1 672 1880 72 GLU HG3 H 2.270 0.015 1 673 1880 72 GLU CA C 59.068 0.25 1 674 1880 72 GLU CB C 28.437 0.25 1 675 1880 72 GLU CG C 36.295 0.25 1 676 1880 72 GLU N N 117.503 0.25 1 677 1881 73 GLU H H 8.069 0.015 1 678 1881 73 GLU HA H 4.259 0.015 1 679 1881 73 GLU HB2 H 2.330 0.015 1 680 1881 73 GLU HB3 H 1.882 0.015 1 681 1881 73 GLU HG2 H 2.311 0.015 1 682 1881 73 GLU HG3 H 2.207 0.015 1 683 1881 73 GLU CA C 57.259 0.25 1 684 1881 73 GLU CB C 29.685 0.25 1 685 1881 73 GLU CG C 37.566 0.25 1 686 1881 73 GLU N N 118.429 0.25 1 687 1882 74 LEU H H 7.834 0.015 1 688 1882 74 LEU HA H 3.962 0.015 1 689 1882 74 LEU HB2 H 1.279 0.015 1 690 1882 74 LEU HB3 H 1.966 0.015 1 691 1882 74 LEU HD1 H 0.890 0.015 1 692 1882 74 LEU HD2 H 0.947 0.015 1 693 1882 74 LEU HG H 1.709 0.015 1 694 1882 74 LEU CA C 57.994 0.25 1 695 1882 74 LEU CB C 42.092 0.25 1 696 1882 74 LEU CD1 C 24.201 0.25 1 697 1882 74 LEU CD2 C 26.675 0.25 1 698 1882 74 LEU CG C 28.423 0.25 1 699 1882 74 LEU N N 118.373 0.25 1 700 1883 75 GLY H H 7.795 0.015 1 701 1883 75 GLY HA2 H 3.722 0.015 1 702 1883 75 GLY HA3 H 4.089 0.015 1 703 1883 75 GLY CA C 48.740 0.25 1 704 1883 75 GLY N N 106.140 0.25 1 705 1884 76 PRO HA H 4.284 0.015 1 706 1884 76 PRO HB2 H 1.929 0.015 1 707 1884 76 PRO HB3 H 2.373 0.015 1 708 1884 76 PRO HD2 H 3.655 0.015 1 709 1884 76 PRO HD3 H 3.611 0.015 1 710 1884 76 PRO HG2 H 2.140 0.015 1 711 1884 76 PRO HG3 H 1.909 0.015 1 712 1884 76 PRO CA C 65.374 0.25 1 713 1884 76 PRO CB C 32.127 0.25 1 714 1884 76 PRO CD C 50.723 0.25 1 715 1884 76 PRO CG C 28.091 0.25 1 716 1885 77 LEU H H 7.239 0.015 1 717 1885 77 LEU HA H 4.124 0.015 1 718 1885 77 LEU HB2 H 1.865 0.015 1 719 1885 77 LEU HB3 H 1.279 0.015 1 720 1885 77 LEU HD1 H 0.756 0.015 1 721 1885 77 LEU HD2 H 0.938 0.015 1 722 1885 77 LEU HG H 1.866 0.015 1 723 1885 77 LEU CA C 58.106 0.25 1 724 1885 77 LEU CB C 42.439 0.25 1 725 1885 77 LEU CD1 C 26.457 0.25 1 726 1885 77 LEU CD2 C 23.149 0.25 1 727 1885 77 LEU CG C 27.500 0.25 1 728 1885 77 LEU N N 117.331 0.25 1 729 1886 78 ALA H H 8.459 0.015 1 730 1886 78 ALA HA H 3.863 0.015 1 731 1886 78 ALA HB H 1.466 0.015 1 732 1886 78 ALA CA C 55.448 0.25 1 733 1886 78 ALA CB C 17.627 0.25 1 734 1886 78 ALA N N 122.549 0.25 1 735 1887 79 ASN H H 8.236 0.015 1 736 1887 79 ASN HA H 4.410 0.015 1 737 1887 79 ASN HB2 H 2.767 0.015 1 738 1887 79 ASN HB3 H 2.877 0.015 1 739 1887 79 ASN HD21 H 7.508 0.015 1 740 1887 79 ASN HD22 H 6.835 0.015 1 741 1887 79 ASN CA C 57.141 0.25 1 742 1887 79 ASN CB C 39.271 0.25 1 743 1887 79 ASN N N 119.503 0.25 1 744 1887 79 ASN ND2 N 113.192 0.25 1 745 1888 80 GLN H H 7.984 0.015 1 746 1888 80 GLN HA H 3.931 0.015 1 747 1888 80 GLN HB2 H 2.235 0.015 1 748 1888 80 GLN HB3 H 2.235 0.015 1 749 1888 80 GLN HE21 H 7.679 0.015 1 750 1888 80 GLN HE22 H 6.747 0.015 1 751 1888 80 GLN HG2 H 2.376 0.015 1 752 1888 80 GLN HG3 H 2.376 0.015 1 753 1888 80 GLN CA C 59.009 0.25 1 754 1888 80 GLN CB C 28.805 0.25 1 755 1888 80 GLN CG C 33.371 0.25 1 756 1888 80 GLN N N 122.389 0.25 1 757 1888 80 GLN NE2 N 114.670 0.25 1 758 1889 81 LEU H H 8.604 0.015 1 759 1889 81 LEU HA H 4.283 0.015 1 760 1889 81 LEU HB2 H 1.586 0.015 1 761 1889 81 LEU HB3 H 1.952 0.015 1 762 1889 81 LEU HD1 H 1.013 0.015 1 763 1889 81 LEU HD2 H 0.856 0.015 1 764 1889 81 LEU HG H 1.547 0.015 1 765 1889 81 LEU CA C 58.312 0.25 1 766 1889 81 LEU CB C 42.486 0.25 1 767 1889 81 LEU CD1 C 26.623 0.25 1 768 1889 81 LEU CD2 C 27.124 0.25 1 769 1889 81 LEU CG C 26.929 0.25 1 770 1889 81 LEU N N 121.265 0.25 1 771 1890 82 THR H H 8.039 0.015 1 772 1890 82 THR HA H 3.544 0.015 1 773 1890 82 THR HB H 4.379 0.015 1 774 1890 82 THR HG2 H 1.265 0.015 1 775 1890 82 THR CA C 68.294 0.25 1 776 1890 82 THR CB C 68.661 0.25 1 777 1890 82 THR CG2 C 21.881 0.25 1 778 1890 82 THR N N 115.758 0.25 1 779 1891 83 SER H H 8.128 0.015 1 780 1891 83 SER HA H 4.174 0.015 1 781 1891 83 SER HB2 H 3.897 0.015 1 782 1891 83 SER HB3 H 3.949 0.015 1 783 1891 83 SER CA C 61.704 0.25 1 784 1891 83 SER CB C 62.977 0.25 1 785 1891 83 SER N N 117.993 0.25 1 786 1892 84 ASP H H 8.754 0.015 1 787 1892 84 ASP HA H 4.527 0.015 1 788 1892 84 ASP HB2 H 2.771 0.015 1 789 1892 84 ASP HB3 H 2.349 0.015 1 790 1892 84 ASP CA C 58.234 0.25 1 791 1892 84 ASP CB C 40.138 0.25 1 792 1892 84 ASP N N 122.933 0.25 1 793 1893 85 TYR H H 9.132 0.015 1 794 1893 85 TYR HA H 3.814 0.015 1 795 1893 85 TYR HB2 H 3.062 0.015 1 796 1893 85 TYR HB3 H 2.856 0.015 1 797 1893 85 TYR HD1 H 6.792 0.015 3 798 1893 85 TYR HD2 H 6.792 0.015 3 799 1893 85 TYR HE1 H 6.645 0.015 3 800 1893 85 TYR HE2 H 6.645 0.015 3 801 1893 85 TYR CA C 64.165 0.25 1 802 1893 85 TYR CB C 37.687 0.25 1 803 1893 85 TYR CD1 C 133.299 0.25 3 804 1893 85 TYR CD2 C 133.299 0.25 3 805 1893 85 TYR CE1 C 116.482 0.25 3 806 1893 85 TYR CE2 C 116.482 0.25 3 807 1893 85 TYR N N 121.179 0.25 1 808 1894 86 GLY H H 8.061 0.015 1 809 1894 86 GLY HA2 H 3.381 0.015 1 810 1894 86 GLY HA3 H 3.906 0.015 1 811 1894 86 GLY CA C 47.716 0.25 1 812 1894 86 GLY N N 105.475 0.25 1 813 1895 87 ARG H H 7.706 0.015 1 814 1895 87 ARG HA H 4.021 0.015 1 815 1895 87 ARG HB2 H 1.877 0.015 1 816 1895 87 ARG HB3 H 1.984 0.015 1 817 1895 87 ARG HD2 H 3.177 0.015 1 818 1895 87 ARG HD3 H 3.177 0.015 1 819 1895 87 ARG HG2 H 1.770 0.015 1 820 1895 87 ARG HG3 H 1.551 0.015 1 821 1895 87 ARG CA C 59.613 0.25 1 822 1895 87 ARG CB C 30.172 0.25 1 823 1895 87 ARG CD C 43.504 0.25 1 824 1895 87 ARG CG C 28.245 0.25 1 825 1895 87 ARG N N 122.183 0.25 1 826 1896 88 LEU H H 8.098 0.015 1 827 1896 88 LEU HA H 3.957 0.015 1 828 1896 88 LEU HB2 H 1.357 0.015 1 829 1896 88 LEU HB3 H 1.800 0.015 1 830 1896 88 LEU HD1 H 0.856 0.015 1 831 1896 88 LEU HD2 H 0.890 0.015 1 832 1896 88 LEU HG H 1.383 0.015 1 833 1896 88 LEU CA C 58.013 0.25 1 834 1896 88 LEU CB C 42.142 0.25 1 835 1896 88 LEU CD1 C 28.672 0.25 1 836 1896 88 LEU CD2 C 25.301 0.25 1 837 1896 88 LEU CG C 26.468 0.25 1 838 1896 88 LEU N N 122.511 0.25 1 839 1897 89 ALA H H 8.486 0.015 1 840 1897 89 ALA HA H 3.681 0.015 1 841 1897 89 ALA HB H 0.991 0.015 1 842 1897 89 ALA CA C 55.305 0.25 1 843 1897 89 ALA CB C 17.868 0.25 1 844 1897 89 ALA N N 119.314 0.25 1 845 1898 90 SER H H 7.848 0.015 1 846 1898 90 SER HA H 4.164 0.015 1 847 1898 90 SER HB2 H 3.994 0.015 1 848 1898 90 SER HB3 H 3.994 0.015 1 849 1898 90 SER CA C 61.631 0.25 1 850 1898 90 SER CB C 63.120 0.25 1 851 1898 90 SER N N 112.410 0.25 1 852 1899 91 GLN H H 7.619 0.015 1 853 1899 91 GLN HA H 4.124 0.015 1 854 1899 91 GLN HB2 H 2.177 0.015 1 855 1899 91 GLN HB3 H 2.086 0.015 1 856 1899 91 GLN HE21 H 7.175 0.015 1 857 1899 91 GLN HE22 H 6.288 0.015 1 858 1899 91 GLN HG2 H 2.423 0.015 1 859 1899 91 GLN HG3 H 2.459 0.015 1 860 1899 91 GLN CA C 57.776 0.25 1 861 1899 91 GLN CB C 29.753 0.25 1 862 1899 91 GLN CG C 34.458 0.25 1 863 1899 91 GLN N N 119.987 0.25 1 864 1899 91 GLN NE2 N 108.670 0.25 1 865 1900 92 ALA H H 7.836 0.015 1 866 1900 92 ALA HA H 3.854 0.015 1 867 1900 92 ALA HB H 1.389 0.015 1 868 1900 92 ALA CA C 54.913 0.25 1 869 1900 92 ALA CB C 19.335 0.25 1 870 1900 92 ALA N N 118.996 0.25 1 871 1901 93 LYS H H 7.031 0.015 1 872 1901 93 LYS HA H 4.055 0.015 1 873 1901 93 LYS HB2 H 1.962 0.015 1 874 1901 93 LYS HB3 H 1.821 0.015 1 875 1901 93 LYS HD2 H 1.730 0.015 1 876 1901 93 LYS HD3 H 1.730 0.015 1 877 1901 93 LYS HE2 H 2.977 0.015 1 878 1901 93 LYS HE3 H 2.977 0.015 1 879 1901 93 LYS HG2 H 1.536 0.015 1 880 1901 93 LYS HG3 H 1.373 0.015 1 881 1901 93 LYS CA C 61.559 0.25 1 882 1901 93 LYS CB C 29.573 0.25 1 883 1901 93 LYS CD C 29.564 0.25 1 884 1901 93 LYS CE C 42.224 0.25 1 885 1901 93 LYS CG C 25.366 0.25 1 886 1901 93 LYS N N 113.598 0.25 1 887 1902 94 PRO HA H 4.183 0.015 1 888 1902 94 PRO HB2 H 1.931 0.015 1 889 1902 94 PRO HB3 H 1.321 0.015 1 890 1902 94 PRO HD2 H 4.011 0.015 1 891 1902 94 PRO HD3 H 3.292 0.015 1 892 1902 94 PRO HG2 H 1.845 0.015 1 893 1902 94 PRO HG3 H 1.845 0.015 1 894 1902 94 PRO CA C 65.075 0.25 1 895 1902 94 PRO CB C 30.048 0.25 1 896 1902 94 PRO CD C 49.976 0.25 1 897 1902 94 PRO CG C 27.508 0.25 1 898 1903 95 ALA H H 7.377 0.015 1 899 1903 95 ALA HA H 3.458 0.015 1 900 1903 95 ALA HB H 1.257 0.015 1 901 1903 95 ALA CA C 55.984 0.25 1 902 1903 95 ALA CB C 19.988 0.25 1 903 1903 95 ALA N N 120.766 0.25 1 904 1904 96 ALA H H 7.791 0.015 1 905 1904 96 ALA HA H 3.898 0.015 1 906 1904 96 ALA HB H 1.456 0.015 1 907 1904 96 ALA CA C 55.081 0.25 1 908 1904 96 ALA CB C 18.687 0.25 1 909 1904 96 ALA N N 115.849 0.25 1 910 1905 97 VAL H H 7.095 0.015 1 911 1905 97 VAL HA H 3.748 0.015 1 912 1905 97 VAL HB H 2.050 0.015 1 913 1905 97 VAL HG1 H 1.034 0.015 1 914 1905 97 VAL HG2 H 0.936 0.015 1 915 1905 97 VAL CA C 64.953 0.25 1 916 1905 97 VAL CB C 32.158 0.25 1 917 1905 97 VAL CG1 C 22.139 0.25 1 918 1905 97 VAL CG2 C 21.805 0.25 1 919 1905 97 VAL N N 116.187 0.25 1 920 1906 98 ALA H H 8.009 0.015 1 921 1906 98 ALA HA H 4.341 0.015 1 922 1906 98 ALA HB H 1.572 0.015 1 923 1906 98 ALA CA C 52.977 0.25 1 924 1906 98 ALA CB C 18.601 0.25 1 925 1906 98 ALA N N 121.358 0.25 1 926 1907 99 ALA H H 7.312 0.015 1 927 1907 99 ALA HA H 3.402 0.015 1 928 1907 99 ALA HB H 1.136 0.015 1 929 1907 99 ALA CA C 52.945 0.25 1 930 1907 99 ALA CB C 18.326 0.25 1 931 1907 99 ALA N N 119.860 0.25 1 932 1908 100 GLU H H 8.064 0.015 1 933 1908 100 GLU HA H 3.824 0.015 1 934 1908 100 GLU HB2 H 1.967 0.015 1 935 1908 100 GLU HB3 H 1.967 0.015 1 936 1908 100 GLU HG2 H 2.250 0.015 1 937 1908 100 GLU HG3 H 2.180 0.015 1 938 1908 100 GLU CA C 58.503 0.25 1 939 1908 100 GLU CB C 29.292 0.25 1 940 1908 100 GLU CG C 36.529 0.25 1 941 1908 100 GLU N N 116.214 0.25 1 942 1909 101 ASN H H 7.407 0.015 1 943 1909 101 ASN HA H 4.606 0.015 1 944 1909 101 ASN HB2 H 2.683 0.015 1 945 1909 101 ASN HB3 H 2.899 0.015 1 946 1909 101 ASN HD21 H 6.964 0.015 1 947 1909 101 ASN HD22 H 7.706 0.015 1 948 1909 101 ASN CA C 53.099 0.25 1 949 1909 101 ASN CB C 40.186 0.25 1 950 1909 101 ASN N N 112.077 0.25 1 951 1909 101 ASN ND2 N 114.084 0.25 1 952 1910 102 GLU H H 8.948 0.015 1 953 1910 102 GLU HA H 4.102 0.015 1 954 1910 102 GLU HB2 H 2.003 0.015 1 955 1910 102 GLU HB3 H 2.003 0.015 1 956 1910 102 GLU HG2 H 2.305 0.015 1 957 1910 102 GLU HG3 H 2.267 0.015 1 958 1910 102 GLU CA C 59.305 0.25 1 959 1910 102 GLU CB C 29.881 0.25 1 960 1910 102 GLU CG C 36.468 0.25 1 961 1910 102 GLU N N 123.149 0.25 1 962 1911 103 GLU H H 8.243 0.015 1 963 1911 103 GLU HA H 3.998 0.015 1 964 1911 103 GLU HB2 H 1.981 0.015 1 965 1911 103 GLU HB3 H 2.040 0.015 1 966 1911 103 GLU HG2 H 2.103 0.015 1 967 1911 103 GLU HG3 H 2.184 0.015 1 968 1911 103 GLU CA C 59.627 0.25 1 969 1911 103 GLU CB C 29.311 0.25 1 970 1911 103 GLU CG C 36.775 0.25 1 971 1911 103 GLU N N 121.444 0.25 1 972 1912 104 ILE H H 7.940 0.015 1 973 1912 104 ILE HA H 3.805 0.015 1 974 1912 104 ILE HB H 1.658 0.015 1 975 1912 104 ILE HD1 H 0.758 0.015 1 976 1912 104 ILE HG12 H 1.141 0.015 1 977 1912 104 ILE HG13 H 1.602 0.015 1 978 1912 104 ILE HG2 H 0.839 0.015 1 979 1912 104 ILE CA C 64.243 0.25 1 980 1912 104 ILE CB C 38.130 0.25 1 981 1912 104 ILE CD1 C 12.929 0.25 1 982 1912 104 ILE CG1 C 28.934 0.25 1 983 1912 104 ILE CG2 C 17.111 0.25 1 984 1912 104 ILE N N 120.234 0.25 1 985 1913 105 GLY H H 8.098 0.015 1 986 1913 105 GLY HA2 H 3.583 0.015 1 987 1913 105 GLY HA3 H 4.076 0.015 1 988 1913 105 GLY CA C 48.633 0.25 1 989 1913 105 GLY N N 105.887 0.25 1 990 1914 106 ALA H H 8.213 0.015 1 991 1914 106 ALA HA H 3.963 0.015 1 992 1914 106 ALA HB H 1.410 0.015 1 993 1914 106 ALA CA C 55.209 0.25 1 994 1914 106 ALA CB C 18.228 0.25 1 995 1914 106 ALA N N 123.200 0.25 1 996 1915 107 HIS H H 7.969 0.015 1 997 1915 107 HIS HA H 4.592 0.015 1 998 1915 107 HIS HB2 H 3.349 0.015 1 999 1915 107 HIS HB3 H 3.274 0.015 1 1000 1915 107 HIS HD2 H 7.021 0.015 1 1001 1915 107 HIS HE1 H 7.804 0.015 1 1002 1915 107 HIS CA C 59.052 0.25 1 1003 1915 107 HIS CB C 30.288 0.25 1 1004 1915 107 HIS CD2 C 120.617 0.25 1 1005 1915 107 HIS CE1 C 138.287 0.25 1 1006 1915 107 HIS N N 117.946 0.25 1 1007 1916 108 ILE H H 8.068 0.015 1 1008 1916 108 ILE HA H 3.358 0.015 1 1009 1916 108 ILE HB H 2.037 0.015 1 1010 1916 108 ILE HD1 H 0.990 0.015 1 1011 1916 108 ILE HG12 H 0.686 0.015 1 1012 1916 108 ILE HG13 H 0.686 0.015 1 1013 1916 108 ILE HG2 H 0.768 0.015 1 1014 1916 108 ILE CA C 66.957 0.25 1 1015 1916 108 ILE CB C 38.657 0.25 1 1016 1916 108 ILE CD1 C 14.928 0.25 1 1017 1916 108 ILE CG1 C 30.258 0.25 1 1018 1916 108 ILE CG2 C 16.863 0.25 1 1019 1916 108 ILE N N 118.231 0.25 1 1020 1917 109 LYS H H 7.887 0.015 1 1021 1917 109 LYS HA H 3.609 0.015 1 1022 1917 109 LYS HB2 H 1.761 0.015 1 1023 1917 109 LYS HB3 H 1.855 0.015 1 1024 1917 109 LYS HD2 H 1.645 0.015 1 1025 1917 109 LYS HD3 H 1.696 0.015 1 1026 1917 109 LYS HE2 H 2.756 0.015 1 1027 1917 109 LYS HE3 H 2.862 0.015 1 1028 1917 109 LYS HG2 H 1.134 0.015 1 1029 1917 109 LYS HG3 H 1.596 0.015 1 1030 1917 109 LYS CA C 61.771 0.25 1 1031 1917 109 LYS CB C 32.161 0.25 1 1032 1917 109 LYS CD C 29.506 0.25 1 1033 1917 109 LYS CE C 41.915 0.25 1 1034 1917 109 LYS CG C 26.132 0.25 1 1035 1917 109 LYS N N 117.379 0.25 1 1036 1918 110 HIS H H 8.669 0.015 1 1037 1918 110 HIS HA H 4.608 0.015 1 1038 1918 110 HIS HB2 H 3.284 0.015 1 1039 1918 110 HIS HB3 H 3.284 0.015 1 1040 1918 110 HIS HD2 H 7.039 0.015 1 1041 1918 110 HIS HE1 H 7.996 0.015 1 1042 1918 110 HIS CA C 59.033 0.25 1 1043 1918 110 HIS CB C 30.166 0.25 1 1044 1918 110 HIS CD2 C 119.538 0.25 1 1045 1918 110 HIS CE1 C 137.743 0.25 1 1046 1918 110 HIS N N 117.192 0.25 1 1047 1919 111 ARG H H 8.616 0.015 1 1048 1919 111 ARG HA H 4.126 0.015 1 1049 1919 111 ARG HB2 H 1.773 0.015 1 1050 1919 111 ARG HB3 H 1.969 0.015 1 1051 1919 111 ARG HD2 H 3.056 0.015 1 1052 1919 111 ARG HD3 H 2.991 0.015 1 1053 1919 111 ARG HG2 H 2.015 0.015 1 1054 1919 111 ARG HG3 H 1.473 0.015 1 1055 1919 111 ARG CA C 58.159 0.25 1 1056 1919 111 ARG CB C 30.364 0.25 1 1057 1919 111 ARG CD C 43.358 0.25 1 1058 1919 111 ARG CG C 25.972 0.25 1 1059 1919 111 ARG N N 116.091 0.25 1 1060 1920 112 VAL H H 8.526 0.015 1 1061 1920 112 VAL HA H 3.607 0.015 1 1062 1920 112 VAL HB H 2.266 0.015 1 1063 1920 112 VAL HG1 H 0.811 0.015 1 1064 1920 112 VAL HG2 H 0.970 0.015 1 1065 1920 112 VAL CA C 67.727 0.25 1 1066 1920 112 VAL CB C 31.367 0.25 1 1067 1920 112 VAL CG1 C 21.511 0.25 1 1068 1920 112 VAL CG2 C 24.581 0.25 1 1069 1920 112 VAL N N 120.432 0.25 1 1070 1921 113 GLN H H 9.017 0.015 1 1071 1921 113 GLN HA H 3.855 0.015 1 1072 1921 113 GLN HB2 H 2.570 0.015 1 1073 1921 113 GLN HB3 H 2.139 0.015 1 1074 1921 113 GLN HE21 H 7.259 0.015 1 1075 1921 113 GLN HE22 H 7.302 0.015 1 1076 1921 113 GLN HG2 H 2.131 0.015 1 1077 1921 113 GLN HG3 H 2.742 0.015 1 1078 1921 113 GLN CA C 61.622 0.25 1 1079 1921 113 GLN CB C 28.917 0.25 1 1080 1921 113 GLN CG C 36.680 0.25 1 1081 1921 113 GLN N N 126.983 0.25 1 1082 1921 113 GLN NE2 N 114.204 0.25 1 1083 1922 114 GLU H H 8.442 0.015 1 1084 1922 114 GLU HA H 4.083 0.015 1 1085 1922 114 GLU HB2 H 1.941 0.015 1 1086 1922 114 GLU HB3 H 2.297 0.015 1 1087 1922 114 GLU HG2 H 2.429 0.015 1 1088 1922 114 GLU HG3 H 2.226 0.015 1 1089 1922 114 GLU CA C 59.771 0.25 1 1090 1922 114 GLU CB C 30.390 0.25 1 1091 1922 114 GLU CG C 36.657 0.25 1 1092 1922 114 GLU N N 118.227 0.25 1 1093 1923 115 LEU H H 8.156 0.015 1 1094 1923 115 LEU HA H 4.086 0.015 1 1095 1923 115 LEU HB2 H 2.405 0.015 1 1096 1923 115 LEU HB3 H 1.472 0.015 1 1097 1923 115 LEU HD1 H 1.013 0.015 1 1098 1923 115 LEU HD2 H 0.986 0.015 1 1099 1923 115 LEU HG H 1.661 0.015 1 1100 1923 115 LEU CA C 57.879 0.25 1 1101 1923 115 LEU CB C 41.380 0.25 1 1102 1923 115 LEU CD1 C 27.594 0.25 1 1103 1923 115 LEU CD2 C 26.100 0.25 1 1104 1923 115 LEU CG C 27.268 0.25 1 1105 1923 115 LEU N N 119.454 0.25 1 1106 1924 116 GLY H H 7.858 0.015 1 1107 1924 116 GLY HA2 H 2.234 0.015 1 1108 1924 116 GLY HA3 H 3.356 0.015 1 1109 1924 116 GLY CA C 47.266 0.25 1 1110 1924 116 GLY N N 110.486 0.25 1 1111 1925 117 HIS H H 7.584 0.015 1 1112 1925 117 HIS HA H 4.220 0.015 1 1113 1925 117 HIS HB2 H 3.042 0.015 1 1114 1925 117 HIS HB3 H 3.042 0.015 1 1115 1925 117 HIS HD2 H 6.946 0.015 1 1116 1925 117 HIS HE1 H 7.766 0.015 1 1117 1925 117 HIS CA C 60.056 0.25 1 1118 1925 117 HIS CB C 30.392 0.25 1 1119 1925 117 HIS CD2 C 119.865 0.25 1 1120 1925 117 HIS CE1 C 138.853 0.25 1 1121 1925 117 HIS N N 121.157 0.25 1 1122 1926 118 GLY H H 7.784 0.015 1 1123 1926 118 GLY HA2 H 3.568 0.015 1 1124 1926 118 GLY HA3 H 3.939 0.015 1 1125 1926 118 GLY CA C 47.504 0.25 1 1126 1926 118 GLY N N 106.665 0.25 1 1127 1927 119 CYS H H 8.701 0.015 1 1128 1927 119 CYS HA H 3.923 0.015 1 1129 1927 119 CYS HB2 H 2.832 0.015 1 1130 1927 119 CYS HB3 H 2.235 0.015 1 1131 1927 119 CYS CA C 65.363 0.25 1 1132 1927 119 CYS CB C 26.460 0.25 1 1133 1927 119 CYS N N 121.524 0.25 1 1134 1928 120 SER H H 8.481 0.015 1 1135 1928 120 SER HA H 3.870 0.015 1 1136 1928 120 SER HB2 H 3.844 0.015 1 1137 1928 120 SER HB3 H 3.894 0.015 1 1138 1928 120 SER CA C 61.710 0.25 1 1139 1928 120 SER CB C 62.715 0.25 1 1140 1928 120 SER N N 115.303 0.25 1 1141 1929 121 ALA H H 7.254 0.015 1 1142 1929 121 ALA HA H 4.125 0.015 1 1143 1929 121 ALA HB H 1.496 0.015 1 1144 1929 121 ALA CA C 55.283 0.25 1 1145 1929 121 ALA CB C 18.322 0.25 1 1146 1929 121 ALA N N 123.086 0.25 1 1147 1930 122 LEU H H 7.946 0.015 1 1148 1930 122 LEU HA H 4.041 0.015 1 1149 1930 122 LEU HB2 H 1.936 0.015 1 1150 1930 122 LEU HB3 H 1.405 0.015 1 1151 1930 122 LEU HD1 H 0.947 0.015 1 1152 1930 122 LEU HD2 H 0.910 0.015 1 1153 1930 122 LEU HG H 1.411 0.015 1 1154 1930 122 LEU CA C 58.456 0.25 1 1155 1930 122 LEU CB C 42.108 0.25 1 1156 1930 122 LEU CD1 C 28.578 0.25 1 1157 1930 122 LEU CD2 C 24.000 0.25 1 1158 1930 122 LEU CG C 27.585 0.25 1 1159 1930 122 LEU N N 119.059 0.25 1 1160 1931 123 VAL H H 8.581 0.015 1 1161 1931 123 VAL HA H 3.506 0.015 1 1162 1931 123 VAL HB H 2.148 0.015 1 1163 1931 123 VAL HG1 H 0.996 0.015 1 1164 1931 123 VAL HG2 H 0.945 0.015 1 1165 1931 123 VAL CA C 67.457 0.25 1 1166 1931 123 VAL CB C 31.447 0.25 1 1167 1931 123 VAL CG1 C 22.592 0.25 1 1168 1931 123 VAL CG2 C 22.793 0.25 1 1169 1931 123 VAL N N 117.254 0.25 1 1170 1932 124 THR H H 7.716 0.015 1 1171 1932 124 THR HA H 3.821 0.015 1 1172 1932 124 THR HB H 4.338 0.015 1 1173 1932 124 THR HG2 H 1.173 0.015 1 1174 1932 124 THR CA C 67.561 0.25 1 1175 1932 124 THR CB C 68.528 0.25 1 1176 1932 124 THR CG2 C 21.329 0.25 1 1177 1932 124 THR N N 116.554 0.25 1 1178 1933 125 LYS H H 8.015 0.015 1 1179 1933 125 LYS HA H 4.101 0.015 1 1180 1933 125 LYS HB2 H 1.717 0.015 1 1181 1933 125 LYS HB3 H 2.017 0.015 1 1182 1933 125 LYS HD2 H 1.652 0.015 1 1183 1933 125 LYS HD3 H 1.585 0.015 1 1184 1933 125 LYS HE2 H 2.886 0.015 1 1185 1933 125 LYS HE3 H 2.847 0.015 1 1186 1933 125 LYS HG2 H 1.647 0.015 1 1187 1933 125 LYS HG3 H 1.452 0.015 1 1188 1933 125 LYS CA C 57.814 0.25 1 1189 1933 125 LYS CB C 31.126 0.25 1 1190 1933 125 LYS CD C 27.470 0.25 1 1191 1933 125 LYS CE C 42.276 0.25 1 1192 1933 125 LYS CG C 25.042 0.25 1 1193 1933 125 LYS N N 121.312 0.25 1 1194 1934 126 ALA H H 8.772 0.015 1 1195 1934 126 ALA HA H 3.927 0.015 1 1196 1934 126 ALA HB H 1.348 0.015 1 1197 1934 126 ALA CA C 55.191 0.25 1 1198 1934 126 ALA CB C 17.775 0.25 1 1199 1934 126 ALA N N 122.366 0.25 1 1200 1935 127 GLY H H 8.211 0.015 1 1201 1935 127 GLY HA2 H 3.745 0.015 1 1202 1935 127 GLY HA3 H 3.660 0.015 1 1203 1935 127 GLY CA C 47.370 0.25 1 1204 1935 127 GLY N N 104.882 0.25 1 1205 1936 128 ALA H H 7.658 0.015 1 1206 1936 128 ALA HA H 4.123 0.015 1 1207 1936 128 ALA HB H 1.509 0.015 1 1208 1936 128 ALA CA C 55.148 0.25 1 1209 1936 128 ALA CB C 18.464 0.25 1 1210 1936 128 ALA N N 123.650 0.25 1 1211 1937 129 LEU H H 8.206 0.015 1 1212 1937 129 LEU HA H 4.052 0.015 1 1213 1937 129 LEU HB2 H 1.252 0.015 1 1214 1937 129 LEU HB3 H 1.766 0.015 1 1215 1937 129 LEU HD1 H 0.934 0.015 1 1216 1937 129 LEU HD2 H 0.971 0.015 1 1217 1937 129 LEU HG H 1.633 0.015 1 1218 1937 129 LEU CA C 56.854 0.25 1 1219 1937 129 LEU CB C 41.559 0.25 1 1220 1937 129 LEU CD1 C 27.734 0.25 1 1221 1937 129 LEU CD2 C 24.705 0.25 1 1222 1937 129 LEU CG C 27.236 0.25 1 1223 1937 129 LEU N N 120.491 0.25 1 1224 1938 130 GLN H H 7.923 0.015 1 1225 1938 130 GLN HA H 3.749 0.015 1 1226 1938 130 GLN HB2 H 2.200 0.015 1 1227 1938 130 GLN HB3 H 2.125 0.015 1 1228 1938 130 GLN HE21 H 7.065 0.015 1 1229 1938 130 GLN HE22 H 6.669 0.015 1 1230 1938 130 GLN HG2 H 2.341 0.015 1 1231 1938 130 GLN HG3 H 2.520 0.015 1 1232 1938 130 GLN CA C 59.587 0.25 1 1233 1938 130 GLN CB C 29.211 0.25 1 1234 1938 130 GLN CG C 34.951 0.25 1 1235 1938 130 GLN N N 115.869 0.25 1 1236 1938 130 GLN NE2 N 108.734 0.25 1 1237 1939 131 CYS H H 7.184 0.015 1 1238 1939 131 CYS HA H 4.314 0.015 1 1239 1939 131 CYS HB2 H 3.000 0.015 1 1240 1939 131 CYS HB3 H 3.000 0.015 1 1241 1939 131 CYS CA C 61.203 0.25 1 1242 1939 131 CYS CB C 27.948 0.25 1 1243 1939 131 CYS N N 112.438 0.25 1 1244 1940 132 SER H H 7.455 0.015 1 1245 1940 132 SER HA H 4.834 0.015 1 1246 1940 132 SER HB2 H 3.747 0.015 1 1247 1940 132 SER HB3 H 4.022 0.015 1 1248 1940 132 SER CA C 55.243 0.25 1 1249 1940 132 SER CB C 63.627 0.25 1 1250 1940 132 SER N N 114.640 0.25 1 1251 1941 133 PRO HA H 4.545 0.015 1 1252 1941 133 PRO HB2 H 1.992 0.015 1 1253 1941 133 PRO HB3 H 2.147 0.015 1 1254 1941 133 PRO HD2 H 3.625 0.015 1 1255 1941 133 PRO HD3 H 3.412 0.015 1 1256 1941 133 PRO HG2 H 1.937 0.015 1 1257 1941 133 PRO HG3 H 1.987 0.015 1 1258 1941 133 PRO CA C 65.174 0.25 1 1259 1941 133 PRO CB C 32.522 0.25 1 1260 1941 133 PRO CD C 50.188 0.25 1 1261 1941 133 PRO CG C 27.250 0.25 1 1262 1942 134 SER H H 8.119 0.015 1 1263 1942 134 SER HA H 4.527 0.015 1 1264 1942 134 SER HB2 H 3.985 0.015 1 1265 1942 134 SER HB3 H 3.887 0.015 1 1266 1942 134 SER CA C 57.806 0.25 1 1267 1942 134 SER CB C 63.854 0.25 1 1268 1942 134 SER N N 111.984 0.25 1 1269 1943 135 ASP H H 7.678 0.015 1 1270 1943 135 ASP HA H 4.593 0.015 1 1271 1943 135 ASP HB2 H 2.669 0.015 1 1272 1943 135 ASP HB3 H 3.035 0.015 1 1273 1943 135 ASP CA C 54.763 0.25 1 1274 1943 135 ASP CB C 41.822 0.25 1 1275 1943 135 ASP N N 122.892 0.25 1 1276 1944 136 VAL H H 8.291 0.015 1 1277 1944 136 VAL HA H 3.646 0.015 1 1278 1944 136 VAL HB H 1.996 0.015 1 1279 1944 136 VAL HG1 H 0.891 0.015 1 1280 1944 136 VAL HG2 H 0.891 0.015 1 1281 1944 136 VAL CA C 65.592 0.25 1 1282 1944 136 VAL CB C 31.916 0.25 1 1283 1944 136 VAL CG1 C 20.955 0.25 1 1284 1944 136 VAL CG2 C 20.955 0.25 1 1285 1944 136 VAL N N 127.358 0.25 1 1286 1945 137 TYR H H 8.107 0.015 1 1287 1945 137 TYR HA H 4.159 0.015 1 1288 1945 137 TYR HB2 H 3.144 0.015 1 1289 1945 137 TYR HB3 H 3.144 0.015 1 1290 1945 137 TYR HD1 H 7.166 0.015 3 1291 1945 137 TYR HD2 H 7.166 0.015 3 1292 1945 137 TYR HE1 H 6.794 0.015 3 1293 1945 137 TYR HE2 H 6.794 0.015 3 1294 1945 137 TYR CA C 61.629 0.25 1 1295 1945 137 TYR CB C 37.372 0.25 1 1296 1945 137 TYR CD1 C 133.084 0.25 3 1297 1945 137 TYR CD2 C 133.084 0.25 3 1298 1945 137 TYR CE1 C 118.431 0.25 3 1299 1945 137 TYR CE2 C 118.431 0.25 3 1300 1945 137 TYR N N 122.100 0.25 1 1301 1946 138 THR H H 8.141 0.015 1 1302 1946 138 THR HA H 3.855 0.015 1 1303 1946 138 THR HB H 4.063 0.015 1 1304 1946 138 THR HG2 H 1.134 0.015 1 1305 1946 138 THR CA C 66.989 0.25 1 1306 1946 138 THR CB C 67.788 0.25 1 1307 1946 138 THR CG2 C 23.042 0.25 1 1308 1946 138 THR N N 118.001 0.25 1 1309 1947 139 LYS H H 7.810 0.015 1 1310 1947 139 LYS HA H 3.783 0.015 1 1311 1947 139 LYS HB2 H 1.844 0.015 1 1312 1947 139 LYS HB3 H 1.904 0.015 1 1313 1947 139 LYS HD2 H 1.665 0.015 1 1314 1947 139 LYS HD3 H 1.665 0.015 1 1315 1947 139 LYS HE2 H 2.934 0.015 1 1316 1947 139 LYS HE3 H 2.934 0.015 1 1317 1947 139 LYS HG2 H 1.366 0.015 1 1318 1947 139 LYS HG3 H 1.411 0.015 1 1319 1947 139 LYS CA C 61.041 0.25 1 1320 1947 139 LYS CB C 31.901 0.25 1 1321 1947 139 LYS CD C 29.452 0.25 1 1322 1947 139 LYS CE C 42.176 0.25 1 1323 1947 139 LYS CG C 25.491 0.25 1 1324 1947 139 LYS N N 122.166 0.25 1 1325 1948 140 LYS H H 7.803 0.015 1 1326 1948 140 LYS HA H 3.901 0.015 1 1327 1948 140 LYS HB2 H 1.902 0.015 1 1328 1948 140 LYS HB3 H 1.902 0.015 1 1329 1948 140 LYS HD2 H 1.610 0.015 1 1330 1948 140 LYS HD3 H 1.610 0.015 1 1331 1948 140 LYS HE2 H 2.889 0.015 1 1332 1948 140 LYS HE3 H 2.889 0.015 1 1333 1948 140 LYS HG2 H 1.558 0.015 1 1334 1948 140 LYS HG3 H 1.360 0.015 1 1335 1948 140 LYS CA C 60.082 0.25 1 1336 1948 140 LYS CB C 32.169 0.25 1 1337 1948 140 LYS CD C 29.643 0.25 1 1338 1948 140 LYS CE C 42.187 0.25 1 1339 1948 140 LYS CG C 25.325 0.25 1 1340 1948 140 LYS N N 118.772 0.25 1 1341 1949 141 GLU H H 8.041 0.015 1 1342 1949 141 GLU HA H 3.991 0.015 1 1343 1949 141 GLU HB2 H 2.196 0.015 1 1344 1949 141 GLU HB3 H 1.809 0.015 1 1345 1949 141 GLU HG2 H 1.995 0.015 1 1346 1949 141 GLU HG3 H 2.315 0.015 1 1347 1949 141 GLU CA C 59.464 0.25 1 1348 1949 141 GLU CB C 30.185 0.25 1 1349 1949 141 GLU CG C 37.053 0.25 1 1350 1949 141 GLU N N 118.418 0.25 1 1351 1950 142 LEU H H 8.398 0.015 1 1352 1950 142 LEU HA H 3.682 0.015 1 1353 1950 142 LEU HB2 H 2.134 0.015 1 1354 1950 142 LEU HB3 H 1.563 0.015 1 1355 1950 142 LEU HD1 H 0.795 0.015 1 1356 1950 142 LEU HD2 H 0.748 0.015 1 1357 1950 142 LEU HG H 1.564 0.015 1 1358 1950 142 LEU CA C 60.249 0.25 1 1359 1950 142 LEU CB C 41.491 0.25 1 1360 1950 142 LEU CD1 C 27.007 0.25 1 1361 1950 142 LEU CD2 C 25.011 0.25 1 1362 1950 142 LEU CG C 28.033 0.25 1 1363 1950 142 LEU N N 122.779 0.25 1 1364 1951 143 ILE H H 8.087 0.015 1 1365 1951 143 ILE HA H 3.454 0.015 1 1366 1951 143 ILE HB H 1.970 0.015 1 1367 1951 143 ILE HD1 H 0.812 0.015 1 1368 1951 143 ILE HG12 H 1.165 0.015 1 1369 1951 143 ILE HG13 H 1.753 0.015 1 1370 1951 143 ILE HG2 H 0.890 0.015 1 1371 1951 143 ILE CA C 65.714 0.25 1 1372 1951 143 ILE CB C 37.634 0.25 1 1373 1951 143 ILE CD1 C 13.035 0.25 1 1374 1951 143 ILE CG1 C 29.682 0.25 1 1375 1951 143 ILE CG2 C 17.283 0.25 1 1376 1951 143 ILE N N 120.359 0.25 1 1377 1952 144 GLU H H 7.991 0.015 1 1378 1952 144 GLU HA H 4.156 0.015 1 1379 1952 144 GLU HB2 H 2.085 0.015 1 1380 1952 144 GLU HB3 H 1.999 0.015 1 1381 1952 144 GLU HG2 H 2.323 0.015 1 1382 1952 144 GLU HG3 H 2.323 0.015 1 1383 1952 144 GLU CA C 59.310 0.25 1 1384 1952 144 GLU CB C 29.101 0.25 1 1385 1952 144 GLU CG C 35.865 0.25 1 1386 1952 144 GLU N N 120.630 0.25 1 1387 1953 145 CYS H H 8.412 0.015 1 1388 1953 145 CYS HA H 4.021 0.015 1 1389 1953 145 CYS HB2 H 3.088 0.015 1 1390 1953 145 CYS HB3 H 2.743 0.015 1 1391 1953 145 CYS CA C 63.632 0.25 1 1392 1953 145 CYS CB C 27.009 0.25 1 1393 1953 145 CYS N N 119.004 0.25 1 1394 1954 146 ALA H H 8.965 0.015 1 1395 1954 146 ALA HA H 3.835 0.015 1 1396 1954 146 ALA HB H 1.312 0.015 1 1397 1954 146 ALA CA C 55.696 0.25 1 1398 1954 146 ALA CB C 18.449 0.25 1 1399 1954 146 ALA N N 123.464 0.25 1 1400 1955 147 ARG H H 8.082 0.015 1 1401 1955 147 ARG HA H 3.955 0.015 1 1402 1955 147 ARG HB2 H 1.993 0.015 1 1403 1955 147 ARG HB3 H 1.993 0.015 1 1404 1955 147 ARG HD2 H 3.206 0.015 1 1405 1955 147 ARG HD3 H 3.114 0.015 1 1406 1955 147 ARG HG2 H 1.744 0.015 1 1407 1955 147 ARG HG3 H 1.572 0.015 1 1408 1955 147 ARG CA C 59.890 0.25 1 1409 1955 147 ARG CB C 29.749 0.25 1 1410 1955 147 ARG CD C 43.347 0.25 1 1411 1955 147 ARG CG C 27.346 0.25 1 1412 1955 147 ARG N N 120.300 0.25 1 1413 1956 148 ARG H H 7.719 0.015 1 1414 1956 148 ARG HA H 4.113 0.015 1 1415 1956 148 ARG HB2 H 2.054 0.015 1 1416 1956 148 ARG HB3 H 1.886 0.015 1 1417 1956 148 ARG HD2 H 3.236 0.015 1 1418 1956 148 ARG HD3 H 3.165 0.015 1 1419 1956 148 ARG HG2 H 1.626 0.015 1 1420 1956 148 ARG HG3 H 1.869 0.015 1 1421 1956 148 ARG CA C 59.495 0.25 1 1422 1956 148 ARG CB C 30.286 0.25 1 1423 1956 148 ARG CD C 43.771 0.25 1 1424 1956 148 ARG CG C 27.919 0.25 1 1425 1956 148 ARG N N 118.520 0.25 1 1426 1957 149 VAL H H 8.291 0.015 1 1427 1957 149 VAL HA H 3.458 0.015 1 1428 1957 149 VAL HB H 2.147 0.015 1 1429 1957 149 VAL HG1 H 0.797 0.015 1 1430 1957 149 VAL HG2 H 0.918 0.015 1 1431 1957 149 VAL CA C 67.889 0.25 1 1432 1957 149 VAL CB C 30.921 0.25 1 1433 1957 149 VAL CG1 C 23.448 0.25 1 1434 1957 149 VAL CG2 C 25.089 0.25 1 1435 1957 149 VAL N N 120.866 0.25 1 1436 1958 150 SER H H 8.761 0.015 1 1437 1958 150 SER HA H 3.914 0.015 1 1438 1958 150 SER HB2 H 3.922 0.015 1 1439 1958 150 SER HB3 H 3.985 0.015 1 1440 1958 150 SER CA C 63.454 0.25 1 1441 1958 150 SER CB C 62.482 0.25 1 1442 1958 150 SER N N 116.909 0.25 1 1443 1959 151 GLU H H 7.866 0.015 1 1444 1959 151 GLU HA H 3.964 0.015 1 1445 1959 151 GLU HB2 H 2.124 0.015 1 1446 1959 151 GLU HB3 H 1.999 0.015 1 1447 1959 151 GLU HG2 H 2.283 0.015 1 1448 1959 151 GLU HG3 H 1.985 0.015 1 1449 1959 151 GLU CA C 59.392 0.25 1 1450 1959 151 GLU CB C 29.666 0.25 1 1451 1959 151 GLU CG C 36.428 0.25 1 1452 1959 151 GLU N N 121.814 0.25 1 1453 1960 152 LYS H H 7.977 0.015 1 1454 1960 152 LYS HA H 4.030 0.015 1 1455 1960 152 LYS HB2 H 2.123 0.015 1 1456 1960 152 LYS HB3 H 1.949 0.015 1 1457 1960 152 LYS HD2 H 1.736 0.015 1 1458 1960 152 LYS HD3 H 1.912 0.015 1 1459 1960 152 LYS HE2 H 2.984 0.015 1 1460 1960 152 LYS HE3 H 2.984 0.015 1 1461 1960 152 LYS HG2 H 1.615 0.015 1 1462 1960 152 LYS HG3 H 1.685 0.015 1 1463 1960 152 LYS CA C 57.824 0.25 1 1464 1960 152 LYS CB C 31.053 0.25 1 1465 1960 152 LYS CD C 27.701 0.25 1 1466 1960 152 LYS CE C 41.864 0.25 1 1467 1960 152 LYS CG C 24.879 0.25 1 1468 1960 152 LYS N N 119.037 0.25 1 1469 1961 153 VAL H H 8.877 0.015 1 1470 1961 153 VAL HA H 3.475 0.015 1 1471 1961 153 VAL HB H 2.360 0.015 1 1472 1961 153 VAL HG1 H 0.915 0.015 1 1473 1961 153 VAL HG2 H 1.003 0.015 1 1474 1961 153 VAL CA C 68.010 0.25 1 1475 1961 153 VAL CB C 31.096 0.25 1 1476 1961 153 VAL CG1 C 22.307 0.25 1 1477 1961 153 VAL CG2 C 24.768 0.25 1 1478 1961 153 VAL N N 122.362 0.25 1 1479 1962 154 SER H H 7.582 0.015 1 1480 1962 154 SER HA H 4.156 0.015 1 1481 1962 154 SER HB2 H 4.049 0.015 1 1482 1962 154 SER HB3 H 4.002 0.015 1 1483 1962 154 SER CA C 62.770 0.25 1 1484 1962 154 SER CB C 62.347 0.25 1 1485 1962 154 SER N N 116.696 0.25 1 1486 1963 155 HIS H H 7.905 0.015 1 1487 1963 155 HIS HA H 4.673 0.015 1 1488 1963 155 HIS HB2 H 3.464 0.015 1 1489 1963 155 HIS HB3 H 3.034 0.015 1 1490 1963 155 HIS HD2 H 6.934 0.015 1 1491 1963 155 HIS HE1 H 7.692 0.015 1 1492 1963 155 HIS CA C 58.265 0.25 1 1493 1963 155 HIS CB C 31.285 0.25 1 1494 1963 155 HIS CD2 C 118.291 0.25 1 1495 1963 155 HIS CE1 C 138.651 0.25 1 1496 1963 155 HIS N N 121.261 0.25 1 1497 1964 156 VAL H H 8.175 0.015 1 1498 1964 156 VAL HA H 3.484 0.015 1 1499 1964 156 VAL HB H 2.501 0.015 1 1500 1964 156 VAL HG1 H 0.829 0.015 1 1501 1964 156 VAL HG2 H 1.020 0.015 1 1502 1964 156 VAL CA C 67.562 0.25 1 1503 1964 156 VAL CB C 31.602 0.25 1 1504 1964 156 VAL CG1 C 21.450 0.25 1 1505 1964 156 VAL CG2 C 24.963 0.25 1 1506 1964 156 VAL N N 122.426 0.25 1 1507 1965 157 LEU H H 8.384 0.015 1 1508 1965 157 LEU HA H 3.897 0.015 1 1509 1965 157 LEU HB2 H 1.977 0.015 1 1510 1965 157 LEU HB3 H 1.446 0.015 1 1511 1965 157 LEU HD1 H 0.840 0.015 1 1512 1965 157 LEU HD2 H 0.932 0.015 1 1513 1965 157 LEU HG H 1.701 0.015 1 1514 1965 157 LEU CA C 58.802 0.25 1 1515 1965 157 LEU CB C 41.191 0.25 1 1516 1965 157 LEU CD1 C 25.999 0.25 1 1517 1965 157 LEU CD2 C 24.934 0.25 1 1518 1965 157 LEU CG C 27.457 0.25 1 1519 1965 157 LEU N N 119.030 0.25 1 1520 1966 158 ALA H H 8.061 0.015 1 1521 1966 158 ALA HA H 4.168 0.015 1 1522 1966 158 ALA HB H 1.529 0.015 1 1523 1966 158 ALA CA C 55.127 0.25 1 1524 1966 158 ALA CB C 18.301 0.25 1 1525 1966 158 ALA N N 120.404 0.25 1 1526 1967 159 ALA H H 7.808 0.015 1 1527 1967 159 ALA HA H 4.216 0.015 1 1528 1967 159 ALA HB H 1.390 0.015 1 1529 1967 159 ALA CA C 54.630 0.25 1 1530 1967 159 ALA CB C 17.865 0.25 1 1531 1967 159 ALA N N 121.416 0.25 1 1532 1968 160 LEU H H 7.883 0.015 1 1533 1968 160 LEU HA H 4.164 0.015 1 1534 1968 160 LEU HB2 H 2.016 0.015 1 1535 1968 160 LEU HB3 H 1.421 0.015 1 1536 1968 160 LEU HD1 H 0.926 0.015 1 1537 1968 160 LEU HD2 H 0.925 0.015 1 1538 1968 160 LEU HG H 0.789 0.015 1 1539 1968 160 LEU CA C 56.521 0.25 1 1540 1968 160 LEU CB C 43.284 0.25 1 1541 1968 160 LEU CD1 C 23.666 0.25 1 1542 1968 160 LEU CD2 C 23.674 0.25 1 1543 1968 160 LEU CG C 27.194 0.25 1 1544 1968 160 LEU N N 115.691 0.25 1 1545 1969 161 GLN H H 7.782 0.015 1 1546 1969 161 GLN HA H 4.179 0.015 1 1547 1969 161 GLN HB2 H 2.119 0.015 1 1548 1969 161 GLN HB3 H 2.203 0.015 1 1549 1969 161 GLN HE21 H 7.288 0.015 1 1550 1969 161 GLN HE22 H 6.781 0.015 1 1551 1969 161 GLN HG2 H 2.424 0.015 1 1552 1969 161 GLN HG3 H 2.312 0.015 1 1553 1969 161 GLN CA C 56.449 0.25 1 1554 1969 161 GLN CB C 28.589 0.25 1 1555 1969 161 GLN CG C 34.275 0.25 1 1556 1969 161 GLN N N 116.442 0.25 1 1557 1969 161 GLN NE2 N 110.999 0.25 1 1558 1970 162 ALA H H 7.645 0.015 1 1559 1970 162 ALA HA H 4.249 0.015 1 1560 1970 162 ALA HB H 1.431 0.015 1 1561 1970 162 ALA CA C 53.311 0.25 1 1562 1970 162 ALA CB C 19.460 0.25 1 1563 1970 162 ALA N N 121.973 0.25 1 1564 1971 163 GLY H H 8.189 0.015 1 1565 1971 163 GLY HA2 H 3.926 0.015 1 1566 1971 163 GLY HA3 H 3.724 0.015 1 1567 1971 163 GLY CA C 45.470 0.25 1 1568 1971 163 GLY N N 105.764 0.25 1 1569 1972 164 ASN H H 8.089 0.015 1 1570 1972 164 ASN HA H 4.688 0.015 1 1571 1972 164 ASN HB2 H 2.803 0.015 1 1572 1972 164 ASN HB3 H 2.735 0.015 1 1573 1972 164 ASN HD21 H 7.552 0.015 1 1574 1972 164 ASN HD22 H 6.857 0.015 1 1575 1972 164 ASN CA C 53.531 0.25 1 1576 1972 164 ASN CB C 39.085 0.25 1 1577 1972 164 ASN N N 118.840 0.25 1 1578 1972 164 ASN ND2 N 112.219 0.25 1 1579 1973 165 ARG H H 7.843 0.015 1 1580 1973 165 ARG HA H 4.136 0.015 1 1581 1973 165 ARG HB2 H 1.812 0.015 1 1582 1973 165 ARG HB3 H 1.679 0.015 1 1583 1973 165 ARG HD2 H 3.141 0.015 1 1584 1973 165 ARG HD3 H 3.141 0.015 1 1585 1973 165 ARG HG2 H 1.547 0.015 1 1586 1973 165 ARG HG3 H 1.547 0.015 1 1587 1973 165 ARG CA C 57.599 0.25 1 1588 1973 165 ARG CB C 31.639 0.25 1 1589 1973 165 ARG CD C 43.647 0.25 1 1590 1973 165 ARG CG C 27.209 0.25 1 1591 1973 165 ARG N N 126.181 0.25 1 stop_ save_