data_27235 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution NMR assignment of the C-terminal domain of chTOG ; _BMRB_accession_number 27235 _BMRB_flat_file_name bmr27235.str _Entry_type original _Submission_date 2017-08-25 _Accession_date 2017-08-25 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'This is a follow up work to define the C-terminus of chTOG and its ability to bind to TACC3' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Pfuhl Mark . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 845 "13C chemical shifts" 617 "15N chemical shifts" 142 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-08-28 update BMRB 'update entry citation' 2018-03-29 original author 'original release' stop_ _Original_release_date 2017-08-25 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Solution NMR assignment of the C-terminal domain of human chTOG ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 29582386 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Rostkova Elena . . 2 Burgess Selena . . 3 Bayliss Richard . . 4 Pfuhl Mark . . stop_ _Journal_abbreviation 'Biomol. NMR Assign.' _Journal_volume 12 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 221 _Page_last 224 _Year 2018 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'C-terminal domain of chTOG' _Enzyme_commission_number n.a. loop_ _Mol_system_component_name _Mol_label 'C-terminal domain of chTOG' $chTOG stop_ _System_molecular_weight 15.9 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details 'monomer of C-terminal domain (CTD) of chTOG' save_ ######################## # Monomeric polymers # ######################## save_chTOG _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common chTOG _Molecular_mass 15.9 _Mol_thiol_state 'all free' loop_ _Biological_function 'formation of k-fibres in mitosis' 'regulation microtubule polymerisation' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 141 _Mol_residue_sequence ; ASRIDEKSSKAKVNDFLAEI FKKIGSKENTKEGLAELYEY KKKYSDADIEPFLKNSSQFF QSYVERGLRVIEMEREGKGR ISTSTGISPQMEVTCVPTPT STVSSIGNTNGEEVGPSVYL ERLKILRQRCGLDNTKQDDR P ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1817 ALA 2 1818 SER 3 1819 ARG 4 1820 ILE 5 1821 ASP 6 1822 GLU 7 1823 LYS 8 1824 SER 9 1825 SER 10 1826 LYS 11 1827 ALA 12 1828 LYS 13 1829 VAL 14 1830 ASN 15 1831 ASP 16 1832 PHE 17 1833 LEU 18 1834 ALA 19 1835 GLU 20 1836 ILE 21 1837 PHE 22 1838 LYS 23 1839 LYS 24 1840 ILE 25 1841 GLY 26 1842 SER 27 1843 LYS 28 1844 GLU 29 1845 ASN 30 1846 THR 31 1847 LYS 32 1848 GLU 33 1849 GLY 34 1850 LEU 35 1851 ALA 36 1852 GLU 37 1853 LEU 38 1854 TYR 39 1855 GLU 40 1856 TYR 41 1857 LYS 42 1858 LYS 43 1859 LYS 44 1860 TYR 45 1861 SER 46 1862 ASP 47 1863 ALA 48 1864 ASP 49 1865 ILE 50 1866 GLU 51 1867 PRO 52 1868 PHE 53 1869 LEU 54 1870 LYS 55 1871 ASN 56 1872 SER 57 1873 SER 58 1874 GLN 59 1875 PHE 60 1876 PHE 61 1877 GLN 62 1878 SER 63 1879 TYR 64 1880 VAL 65 1881 GLU 66 1882 ARG 67 1883 GLY 68 1884 LEU 69 1885 ARG 70 1886 VAL 71 1887 ILE 72 1888 GLU 73 1889 MET 74 1890 GLU 75 1891 ARG 76 1892 GLU 77 1893 GLY 78 1894 LYS 79 1895 GLY 80 1896 ARG 81 1897 ILE 82 1898 SER 83 1899 THR 84 1900 SER 85 1901 THR 86 1902 GLY 87 1903 ILE 88 1904 SER 89 1905 PRO 90 1906 GLN 91 1907 MET 92 1908 GLU 93 1909 VAL 94 1910 THR 95 1911 CYS 96 1912 VAL 97 1913 PRO 98 1914 THR 99 1915 PRO 100 1916 THR 101 1917 SER 102 1918 THR 103 1919 VAL 104 1920 SER 105 1921 SER 106 1922 ILE 107 1923 GLY 108 1924 ASN 109 1925 THR 110 1926 ASN 111 1927 GLY 112 1928 GLU 113 1929 GLU 114 1930 VAL 115 1931 GLY 116 1932 PRO 117 1933 SER 118 1934 VAL 119 1935 TYR 120 1936 LEU 121 1937 GLU 122 1938 ARG 123 1939 LEU 124 1940 LYS 125 1941 ILE 126 1942 LEU 127 1943 ARG 128 1944 GLN 129 1945 ARG 130 1946 CYS 131 1947 GLY 132 1948 LEU 133 1949 ASP 134 1950 ASN 135 1951 THR 136 1952 LYS 137 1953 GLN 138 1954 ASP 139 1955 ASP 140 1956 ARG 141 1957 PRO stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . 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 SP Q14008 'CKAP5_HUMAN or chTOG' . . . . . stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Gene_mnemonic $chTOG Human 9606 Eukaryota Metazoa Homo sapiens chTOG 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 $chTOG 'recombinant technology' . Escherichia coli BL21 pET6a stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_CTD_15N _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $chTOG 200 uM '[U-98% 15N]' HEPES 20 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' DTT 2 mM 'natural abundance' stop_ save_ save_CTD_15N_13C _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $chTOG 200 uM '[U-95% 13C; U-95% 15N]' HEPES 20 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' DTT 2 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 3.5 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection processing stop_ _Details . save_ save_CCPN_Analysis _Saveframe_category software _Name CCPN_Analysis _Version 2.4 loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' 'peak picking' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_KCL700 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 700 _Details . save_ save_Crick800 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ save_Crick950 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 950 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $CTD_15N save_ save_3D_1H-15N_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $CTD_15N save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $CTD_15N_13C save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $CTD_15N_13C save_ save_3D_CBCA(CO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $CTD_15N_13C save_ save_3D_HBHA(CO)NH_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $CTD_15N_13C save_ save_3D_H(CCO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $CTD_15N_13C save_ save_3D_(H)C(CO)NH_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D (H)C(CO)NH' _Sample_label $CTD_15N_13C save_ save_2D_1H-13C_HSQC_aliphatic_9 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC aliphatic' _Sample_label $CTD_15N_13C save_ save_2D_1H-13C_TROSY_aromatic_10 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C TROSY aromatic' _Sample_label $CTD_15N_13C save_ save_3D_1H-13C_NOESY_aliphatic_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $CTD_15N_13C save_ save_3D_1H-13C_NOESY_aromatic_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aromatic' _Sample_label $CTD_15N_13C 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 1 mM pH 7.10 0.02 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 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D 1H-15N NOESY' '3D HNCO' '3D H(CCO)NH' '3D (H)C(CO)NH' '2D 1H-13C TROSY aromatic' '3D 1H-13C NOESY aliphatic' stop_ loop_ _Sample_label $CTD_15N $CTD_15N_13C stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'C-terminal domain of chTOG' _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 1817 1 ALA H H 8.371 0.007 1 2 1817 1 ALA HA H 4.327 0.022 1 3 1817 1 ALA HB H 1.394 0.007 1 4 1817 1 ALA C C 177.702 0.011 1 5 1817 1 ALA CA C 52.590 0.021 1 6 1817 1 ALA CB C 19.060 0.107 1 7 1817 1 ALA N N 126.925 0.148 1 8 1818 2 SER H H 8.267 0.011 1 9 1818 2 SER HA H 4.422 0.012 1 10 1818 2 SER HB2 H 3.855 0.011 1 11 1818 2 SER HB3 H 3.862 0.019 1 12 1818 2 SER C C 174.425 0.033 1 13 1818 2 SER CA C 58.270 0.024 1 14 1818 2 SER CB C 63.776 0.028 1 15 1818 2 SER N N 116.501 0.125 1 16 1819 3 ARG H H 8.340 0.008 1 17 1819 3 ARG HA H 4.384 0.016 1 18 1819 3 ARG HB2 H 1.759 0.009 1 19 1819 3 ARG HB3 H 1.854 0.002 1 20 1819 3 ARG HG2 H 1.614 0.005 1 21 1819 3 ARG HG3 H 1.576 0.000 1 22 1819 3 ARG HD2 H 3.198 0.006 1 23 1819 3 ARG HD3 H 3.196 0.005 1 24 1819 3 ARG C C 176.341 0.012 1 25 1819 3 ARG CA C 56.050 0.021 1 26 1819 3 ARG CB C 30.834 0.016 1 27 1819 3 ARG CG C 27.040 0.000 1 28 1819 3 ARG CD C 43.279 0.027 1 29 1819 3 ARG N N 124.265 0.108 1 30 1820 4 ILE H H 8.149 0.005 1 31 1820 4 ILE HA H 4.157 0.008 1 32 1820 4 ILE HB H 1.823 0.008 1 33 1820 4 ILE HG12 H 1.400 0.008 1 34 1820 4 ILE HG13 H 1.121 0.007 1 35 1820 4 ILE HG2 H 0.862 0.009 1 36 1820 4 ILE HD1 H 0.831 0.013 1 37 1820 4 ILE C C 175.762 0.029 1 38 1820 4 ILE CA C 60.969 0.017 1 39 1820 4 ILE CB C 38.889 0.098 1 40 1820 4 ILE CG1 C 27.244 0.051 1 41 1820 4 ILE CG2 C 17.566 0.027 1 42 1820 4 ILE CD1 C 12.978 0.017 1 43 1820 4 ILE N N 122.845 0.113 1 44 1821 5 ASP H H 8.394 0.007 1 45 1821 5 ASP HA H 4.619 0.013 1 46 1821 5 ASP HB2 H 2.718 0.013 1 47 1821 5 ASP HB3 H 2.675 0.010 1 48 1821 5 ASP C C 176.459 0.039 1 49 1821 5 ASP CA C 53.980 0.022 1 50 1821 5 ASP CB C 41.238 0.046 1 51 1821 5 ASP N N 125.243 0.101 1 52 1822 6 GLU H H 8.458 0.006 1 53 1822 6 GLU HA H 4.229 0.016 1 54 1822 6 GLU HB2 H 2.085 0.011 1 55 1822 6 GLU HB3 H 1.999 0.012 1 56 1822 6 GLU HG2 H 2.293 0.023 1 57 1822 6 GLU HG3 H 2.259 0.018 1 58 1822 6 GLU C C 176.413 0.000 1 59 1822 6 GLU CA C 57.358 0.035 1 60 1822 6 GLU CB C 30.061 0.070 1 61 1822 6 GLU CG C 36.267 0.015 1 62 1822 6 GLU N N 123.485 0.114 1 63 1823 7 LYS H H 8.375 0.005 1 64 1823 7 LYS HA H 4.253 0.010 1 65 1823 7 LYS HB2 H 1.870 0.006 1 66 1823 7 LYS HB3 H 1.785 0.010 1 67 1823 7 LYS HG2 H 1.494 0.016 1 68 1823 7 LYS HG3 H 1.444 0.023 1 69 1823 7 LYS HD2 H 1.677 0.008 1 70 1823 7 LYS HD3 H 1.680 0.002 1 71 1823 7 LYS HE2 H 2.992 0.011 1 72 1823 7 LYS HE3 H 2.992 0.011 1 73 1823 7 LYS C C 177.226 0.064 1 74 1823 7 LYS CA C 56.894 0.015 1 75 1823 7 LYS CB C 32.489 0.004 1 76 1823 7 LYS CG C 24.860 0.000 1 77 1823 7 LYS CD C 28.960 0.000 1 78 1823 7 LYS CE C 42.040 0.000 1 79 1823 7 LYS N N 122.449 0.079 1 80 1824 8 SER H H 8.163 0.011 1 81 1824 8 SER HA H 4.410 0.019 1 82 1824 8 SER HB2 H 3.883 0.015 1 83 1824 8 SER HB3 H 3.924 0.006 1 84 1824 8 SER C C 174.990 0.025 1 85 1824 8 SER CA C 58.844 0.012 1 86 1824 8 SER CB C 63.713 0.030 1 87 1824 8 SER N N 117.605 0.076 1 88 1825 9 SER H H 8.324 0.006 1 89 1825 9 SER HA H 4.419 0.023 1 90 1825 9 SER HB2 H 3.894 0.011 1 91 1825 9 SER HB3 H 3.974 0.008 1 92 1825 9 SER C C 175.077 0.001 1 93 1825 9 SER CA C 58.922 0.117 1 94 1825 9 SER CB C 63.597 0.035 1 95 1825 9 SER N N 119.460 0.083 1 96 1826 10 LYS H H 8.266 0.011 1 97 1826 10 LYS HA H 4.239 0.012 1 98 1826 10 LYS HB2 H 1.771 0.012 1 99 1826 10 LYS HB3 H 1.849 0.011 1 100 1826 10 LYS HG2 H 1.474 0.019 1 101 1826 10 LYS HG3 H 1.434 0.006 1 102 1826 10 LYS HD2 H 1.667 0.014 1 103 1826 10 LYS HD3 H 1.666 0.014 1 104 1826 10 LYS HE2 H 2.993 0.009 1 105 1826 10 LYS HE3 H 2.996 0.003 1 106 1826 10 LYS C C 176.846 0.008 1 107 1826 10 LYS CA C 56.893 0.014 1 108 1826 10 LYS CB C 32.618 0.068 1 109 1826 10 LYS CG C 24.684 0.029 1 110 1826 10 LYS CD C 28.800 0.000 1 111 1826 10 LYS CE C 42.040 0.000 1 112 1826 10 LYS N N 124.024 0.078 1 113 1827 11 ALA H H 8.085 0.009 1 114 1827 11 ALA HA H 4.240 0.013 1 115 1827 11 ALA HB H 1.404 0.009 1 116 1827 11 ALA C C 178.200 0.008 1 117 1827 11 ALA CA C 53.255 0.042 1 118 1827 11 ALA CB C 19.058 0.179 1 119 1827 11 ALA N N 124.977 0.097 1 120 1828 12 LYS H H 8.103 0.013 1 121 1828 12 LYS HA H 4.296 0.011 1 122 1828 12 LYS HB2 H 1.840 0.004 1 123 1828 12 LYS HB3 H 1.883 0.000 1 124 1828 12 LYS HG2 H 1.494 0.006 1 125 1828 12 LYS HG3 H 1.433 0.003 1 126 1828 12 LYS HD2 H 1.677 0.014 1 127 1828 12 LYS HD3 H 1.679 0.014 1 128 1828 12 LYS HE2 H 2.997 0.001 1 129 1828 12 LYS HE3 H 2.997 0.001 1 130 1828 12 LYS C C 177.664 0.006 1 131 1828 12 LYS CA C 56.899 0.107 1 132 1828 12 LYS CB C 32.728 0.079 1 133 1828 12 LYS CG C 24.850 0.000 1 134 1828 12 LYS CD C 29.030 0.000 1 135 1828 12 LYS CE C 41.878 0.000 1 136 1828 12 LYS N N 121.231 0.102 1 137 1829 13 VAL H H 8.048 0.007 1 138 1829 13 VAL HA H 3.987 0.023 1 139 1829 13 VAL HB H 2.094 0.013 1 140 1829 13 VAL HG1 H 0.923 0.011 1 141 1829 13 VAL HG2 H 0.932 0.006 1 142 1829 13 VAL C C 176.376 0.020 1 143 1829 13 VAL CA C 63.597 0.053 1 144 1829 13 VAL CB C 32.682 0.066 1 145 1829 13 VAL CG1 C 21.255 0.027 1 146 1829 13 VAL CG2 C 21.281 0.024 1 147 1829 13 VAL N N 122.381 0.100 1 148 1830 14 ASN H H 8.447 0.006 1 149 1830 14 ASN HA H 4.627 0.013 1 150 1830 14 ASN HB2 H 2.892 0.013 1 151 1830 14 ASN HB3 H 2.918 0.013 1 152 1830 14 ASN HD21 H 7.732 0.003 1 153 1830 14 ASN HD22 H 6.822 0.009 1 154 1830 14 ASN C C 176.010 0.031 1 155 1830 14 ASN CA C 54.560 0.029 1 156 1830 14 ASN CB C 38.436 0.032 1 157 1830 14 ASN N N 122.231 0.098 1 158 1830 14 ASN ND2 N 113.770 0.053 1 159 1831 15 ASP H H 8.301 0.010 1 160 1831 15 ASP HA H 4.477 0.014 1 161 1831 15 ASP HB2 H 2.705 0.024 1 162 1831 15 ASP HB3 H 2.725 0.025 1 163 1831 15 ASP C C 177.867 0.002 1 164 1831 15 ASP CA C 56.718 0.036 1 165 1831 15 ASP CB C 40.764 0.031 1 166 1831 15 ASP N N 122.893 0.056 1 167 1832 16 PHE H H 8.046 0.014 1 168 1832 16 PHE HA H 4.339 0.018 1 169 1832 16 PHE HB2 H 3.191 0.011 1 170 1832 16 PHE HB3 H 3.257 0.012 1 171 1832 16 PHE HD1 H 7.202 0.015 1 172 1832 16 PHE HD2 H 7.202 0.015 1 173 1832 16 PHE HE1 H 7.385 0.012 1 174 1832 16 PHE HE2 H 7.385 0.012 1 175 1832 16 PHE C C 178.275 0.010 1 176 1832 16 PHE CA C 60.503 0.021 1 177 1832 16 PHE CB C 39.132 0.069 1 178 1832 16 PHE CD1 C 131.565 0.062 1 179 1832 16 PHE CD2 C 131.565 0.062 1 180 1832 16 PHE CE1 C 131.597 0.012 1 181 1832 16 PHE CE2 C 131.597 0.012 1 182 1832 16 PHE N N 122.960 0.039 1 183 1833 17 LEU H H 8.189 0.014 1 184 1833 17 LEU HA H 3.591 0.015 1 185 1833 17 LEU HB2 H 1.387 0.013 1 186 1833 17 LEU HB3 H 0.918 0.013 1 187 1833 17 LEU HG H 1.190 0.010 1 188 1833 17 LEU HD1 H 0.452 0.009 1 189 1833 17 LEU HD2 H 0.303 0.019 1 190 1833 17 LEU C C 178.252 0.009 1 191 1833 17 LEU CA C 57.004 0.040 1 192 1833 17 LEU CB C 41.740 0.046 1 193 1833 17 LEU CG C 27.009 0.006 1 194 1833 17 LEU CD1 C 25.186 0.036 1 195 1833 17 LEU CD2 C 23.924 0.034 1 196 1833 17 LEU N N 121.233 0.097 1 197 1834 18 ALA H H 8.322 0.015 1 198 1834 18 ALA HA H 3.961 0.024 1 199 1834 18 ALA HB H 1.609 0.010 1 200 1834 18 ALA C C 181.213 0.004 1 201 1834 18 ALA CA C 55.573 0.035 1 202 1834 18 ALA CB C 17.884 0.036 1 203 1834 18 ALA N N 122.509 0.088 1 204 1835 19 GLU H H 7.583 0.007 1 205 1835 19 GLU HA H 4.042 0.014 1 206 1835 19 GLU HB2 H 2.075 0.010 1 207 1835 19 GLU HB3 H 2.086 0.017 1 208 1835 19 GLU HG2 H 2.354 0.017 1 209 1835 19 GLU HG3 H 2.351 0.014 1 210 1835 19 GLU C C 179.195 0.005 1 211 1835 19 GLU CA C 58.919 0.012 1 212 1835 19 GLU CB C 28.922 0.057 1 213 1835 19 GLU CG C 35.911 0.043 1 214 1835 19 GLU N N 119.453 0.084 1 215 1836 20 ILE H H 7.498 0.009 1 216 1836 20 ILE HA H 3.471 0.018 1 217 1836 20 ILE HB H 1.731 0.018 1 218 1836 20 ILE HG12 H 1.461 0.013 1 219 1836 20 ILE HG13 H 0.972 0.012 1 220 1836 20 ILE HG2 H 0.577 0.014 1 221 1836 20 ILE HD1 H 0.458 0.012 1 222 1836 20 ILE C C 178.540 0.015 1 223 1836 20 ILE CA C 66.194 0.056 1 224 1836 20 ILE CB C 37.471 0.074 1 225 1836 20 ILE CG1 C 28.418 0.023 1 226 1836 20 ILE CG2 C 17.965 0.021 1 227 1836 20 ILE CD1 C 13.663 0.016 1 228 1836 20 ILE N N 123.253 0.080 1 229 1837 21 PHE H H 8.400 0.014 1 230 1837 21 PHE HA H 4.073 0.011 1 231 1837 21 PHE HB2 H 3.133 0.014 1 232 1837 21 PHE HB3 H 2.844 0.009 1 233 1837 21 PHE HD1 H 7.076 0.010 1 234 1837 21 PHE HD2 H 7.076 0.010 1 235 1837 21 PHE HE1 H 6.996 0.022 1 236 1837 21 PHE HE2 H 6.996 0.022 1 237 1837 21 PHE HZ H 7.075 0.006 1 238 1837 21 PHE C C 179.424 0.036 1 239 1837 21 PHE CA C 63.403 0.032 1 240 1837 21 PHE CB C 38.146 0.048 1 241 1837 21 PHE CD1 C 131.300 0.065 1 242 1837 21 PHE CD2 C 131.300 0.065 1 243 1837 21 PHE CE1 C 130.497 0.046 1 244 1837 21 PHE CE2 C 130.497 0.046 1 245 1837 21 PHE CZ C 128.590 0.023 1 246 1837 21 PHE N N 118.961 0.094 1 247 1838 22 LYS H H 8.061 0.009 1 248 1838 22 LYS HA H 4.083 0.015 1 249 1838 22 LYS HB2 H 1.984 0.013 1 250 1838 22 LYS HB3 H 1.986 0.013 1 251 1838 22 LYS HG2 H 1.606 0.012 1 252 1838 22 LYS HG3 H 1.410 0.010 1 253 1838 22 LYS HD2 H 1.721 0.006 1 254 1838 22 LYS HD3 H 1.722 0.011 1 255 1838 22 LYS HE2 H 2.964 0.018 1 256 1838 22 LYS HE3 H 2.933 0.008 1 257 1838 22 LYS C C 179.482 0.022 1 258 1838 22 LYS CA C 59.709 0.032 1 259 1838 22 LYS CB C 32.128 0.081 1 260 1838 22 LYS CG C 25.160 0.015 1 261 1838 22 LYS CD C 29.418 0.116 1 262 1838 22 LYS CE C 41.787 0.036 1 263 1838 22 LYS N N 123.697 0.091 1 264 1839 23 LYS H H 7.774 0.014 1 265 1839 23 LYS HA H 4.098 0.019 1 266 1839 23 LYS HB2 H 1.790 0.016 1 267 1839 23 LYS HB3 H 2.116 0.003 1 268 1839 23 LYS HG2 H 1.728 0.019 1 269 1839 23 LYS HG3 H 1.320 0.017 1 270 1839 23 LYS HD2 H 1.553 0.010 1 271 1839 23 LYS HD3 H 1.592 0.010 1 272 1839 23 LYS HE2 H 2.907 0.007 1 273 1839 23 LYS HE3 H 2.826 0.012 1 274 1839 23 LYS C C 180.322 0.011 1 275 1839 23 LYS CA C 60.099 0.073 1 276 1839 23 LYS CB C 32.465 0.066 1 277 1839 23 LYS CG C 26.413 0.017 1 278 1839 23 LYS CD C 29.838 0.026 1 279 1839 23 LYS CE C 41.737 0.007 1 280 1839 23 LYS N N 121.018 0.091 1 281 1840 24 ILE H H 8.456 0.016 1 282 1840 24 ILE HA H 3.977 0.015 1 283 1840 24 ILE HB H 2.042 0.012 1 284 1840 24 ILE HG12 H 1.847 0.008 1 285 1840 24 ILE HG13 H 1.851 0.002 1 286 1840 24 ILE HG2 H 0.993 0.019 1 287 1840 24 ILE HD1 H 0.452 0.012 1 288 1840 24 ILE C C 178.158 0.000 1 289 1840 24 ILE CA C 65.802 0.041 1 290 1840 24 ILE CB C 37.980 0.043 1 291 1840 24 ILE CG1 C 27.380 0.010 1 292 1840 24 ILE CG2 C 18.549 0.018 1 293 1840 24 ILE CD1 C 15.711 0.040 1 294 1840 24 ILE N N 119.911 0.085 1 295 1841 25 GLY H H 7.937 0.010 1 296 1841 25 GLY HA2 H 3.946 0.006 1 297 1841 25 GLY HA3 H 4.275 0.012 1 298 1841 25 GLY C C 172.853 0.002 1 299 1841 25 GLY CA C 45.598 0.026 1 300 1841 25 GLY N N 105.929 0.128 1 301 1842 26 SER H H 7.542 0.013 1 302 1842 26 SER HA H 4.693 0.012 1 303 1842 26 SER HB2 H 4.182 0.014 1 304 1842 26 SER HB3 H 4.196 0.007 1 305 1842 26 SER C C 174.200 0.014 1 306 1842 26 SER CA C 57.156 0.076 1 307 1842 26 SER CB C 64.896 0.048 1 308 1842 26 SER N N 118.737 0.122 1 309 1843 27 LYS H H 8.760 0.009 1 310 1843 27 LYS HA H 4.147 0.017 1 311 1843 27 LYS HB2 H 1.923 0.009 1 312 1843 27 LYS HB3 H 1.859 0.012 1 313 1843 27 LYS HG2 H 1.548 0.012 1 314 1843 27 LYS HG3 H 1.469 0.010 1 315 1843 27 LYS HD2 H 1.737 0.010 1 316 1843 27 LYS HD3 H 1.737 0.010 1 317 1843 27 LYS HE2 H 3.026 0.009 1 318 1843 27 LYS HE3 H 3.027 0.009 1 319 1843 27 LYS C C 179.136 0.000 1 320 1843 27 LYS CA C 59.202 0.017 1 321 1843 27 LYS CB C 32.638 0.080 1 322 1843 27 LYS CG C 24.808 0.028 1 323 1843 27 LYS CD C 29.230 0.000 1 324 1843 27 LYS CE C 41.915 0.019 1 325 1843 27 LYS N N 124.881 0.134 1 326 1844 28 GLU H H 8.817 0.015 1 327 1844 28 GLU HA H 4.251 0.015 1 328 1844 28 GLU HB2 H 2.012 0.017 1 329 1844 28 GLU HB3 H 1.969 0.014 1 330 1844 28 GLU HG2 H 2.375 0.022 1 331 1844 28 GLU HG3 H 2.287 0.009 1 332 1844 28 GLU C C 177.704 0.001 1 333 1844 28 GLU CA C 58.758 0.088 1 334 1844 28 GLU CB C 30.112 0.109 1 335 1844 28 GLU CG C 36.445 0.070 1 336 1844 28 GLU N N 116.736 0.084 1 337 1845 29 ASN H H 7.735 0.009 1 338 1845 29 ASN HA H 5.411 0.010 1 339 1845 29 ASN HB2 H 3.005 0.015 1 340 1845 29 ASN HB3 H 2.570 0.013 1 341 1845 29 ASN HD21 H 7.788 0.001 1 342 1845 29 ASN HD22 H 7.042 0.001 1 343 1845 29 ASN C C 175.462 0.036 1 344 1845 29 ASN CA C 52.685 0.036 1 345 1845 29 ASN CB C 40.211 0.052 1 346 1845 29 ASN N N 115.074 0.080 1 347 1845 29 ASN ND2 N 115.243 0.043 1 348 1846 30 THR H H 7.104 0.015 1 349 1846 30 THR HA H 4.531 0.011 1 350 1846 30 THR HB H 4.821 0.002 1 351 1846 30 THR HG2 H 1.408 0.015 1 352 1846 30 THR C C 174.790 0.000 1 353 1846 30 THR CA C 65.415 0.052 1 354 1846 30 THR CB C 68.515 0.046 1 355 1846 30 THR CG2 C 19.286 0.122 1 356 1846 30 THR N N 117.286 0.136 1 357 1847 31 LYS H H 8.284 0.040 1 358 1847 31 LYS HA H 4.024 0.020 1 359 1847 31 LYS HB2 H 1.849 0.010 1 360 1847 31 LYS HB3 H 1.758 0.014 1 361 1847 31 LYS HG2 H 1.470 0.001 1 362 1847 31 LYS HG3 H 1.569 0.013 1 363 1847 31 LYS HD2 H 1.698 0.008 1 364 1847 31 LYS HD3 H 1.698 0.013 1 365 1847 31 LYS HE2 H 2.957 0.003 1 366 1847 31 LYS HE3 H 2.956 0.003 1 367 1847 31 LYS C C 176.959 0.000 1 368 1847 31 LYS CA C 59.892 0.104 1 369 1847 31 LYS CB C 31.542 0.264 1 370 1847 31 LYS CG C 25.765 0.012 1 371 1847 31 LYS CD C 29.089 0.020 1 372 1847 31 LYS CE C 41.827 0.009 1 373 1847 31 LYS N N 123.379 0.050 1 374 1848 32 GLU H H 8.007 0.024 1 375 1848 32 GLU HA H 4.085 0.019 1 376 1848 32 GLU HB2 H 2.166 0.017 1 377 1848 32 GLU HB3 H 2.051 0.011 1 378 1848 32 GLU HG2 H 2.325 0.023 1 379 1848 32 GLU HG3 H 2.177 0.014 1 380 1848 32 GLU C C 179.100 0.000 1 381 1848 32 GLU CA C 59.380 0.036 1 382 1848 32 GLU CB C 29.506 0.042 1 383 1848 32 GLU CG C 36.913 0.014 1 384 1848 32 GLU N N 122.300 0.091 1 385 1849 33 GLY H H 8.341 0.007 1 386 1849 33 GLY HA2 H 3.757 0.016 1 387 1849 33 GLY HA3 H 3.449 0.020 1 388 1849 33 GLY C C 174.970 0.016 1 389 1849 33 GLY CA C 48.002 0.035 1 390 1849 33 GLY N N 106.810 0.080 1 391 1850 34 LEU H H 8.386 0.008 1 392 1850 34 LEU HA H 3.829 0.012 1 393 1850 34 LEU HB2 H 1.995 0.010 1 394 1850 34 LEU HB3 H 1.128 0.013 1 395 1850 34 LEU HG H 1.853 0.027 1 396 1850 34 LEU HD1 H 0.729 0.012 1 397 1850 34 LEU HD2 H 0.740 0.016 1 398 1850 34 LEU C C 178.098 0.000 1 399 1850 34 LEU CA C 58.207 0.022 1 400 1850 34 LEU CB C 42.069 0.060 1 401 1850 34 LEU CG C 27.421 0.000 1 402 1850 34 LEU CD1 C 25.860 0.024 1 403 1850 34 LEU CD2 C 24.117 0.018 1 404 1850 34 LEU N N 124.120 0.074 1 405 1851 35 ALA H H 7.954 0.020 1 406 1851 35 ALA HA H 4.072 0.009 1 407 1851 35 ALA HB H 1.550 0.013 1 408 1851 35 ALA CA C 55.593 0.040 1 409 1851 35 ALA CB C 17.690 0.053 1 410 1851 35 ALA N N 122.788 0.109 1 411 1852 36 GLU H H 8.310 0.008 1 412 1852 36 GLU HA H 4.092 0.015 1 413 1852 36 GLU HB2 H 2.287 0.016 1 414 1852 36 GLU HB3 H 1.947 0.013 1 415 1852 36 GLU HG2 H 2.262 0.016 1 416 1852 36 GLU HG3 H 2.673 0.012 1 417 1852 36 GLU C C 180.315 0.000 1 418 1852 36 GLU CA C 59.524 0.048 1 419 1852 36 GLU CB C 29.770 0.028 1 420 1852 36 GLU CG C 37.017 0.036 1 421 1852 36 GLU N N 119.852 0.090 1 422 1853 37 LEU H H 8.510 0.004 1 423 1853 37 LEU HA H 4.087 0.013 1 424 1853 37 LEU HB2 H 1.351 0.012 1 425 1853 37 LEU HB3 H 2.067 0.012 1 426 1853 37 LEU HG H 1.927 0.011 1 427 1853 37 LEU HD1 H 0.755 0.012 1 428 1853 37 LEU HD2 H 0.802 0.010 1 429 1853 37 LEU C C 177.969 0.000 1 430 1853 37 LEU CA C 57.625 0.029 1 431 1853 37 LEU CB C 40.746 0.047 1 432 1853 37 LEU CG C 27.052 0.000 1 433 1853 37 LEU CD1 C 27.189 0.026 1 434 1853 37 LEU CD2 C 23.338 0.073 1 435 1853 37 LEU N N 124.010 0.101 1 436 1854 38 TYR H H 8.535 0.012 1 437 1854 38 TYR HA H 3.864 0.016 1 438 1854 38 TYR HB2 H 3.367 0.014 1 439 1854 38 TYR HB3 H 3.047 0.014 1 440 1854 38 TYR HD1 H 7.019 0.011 1 441 1854 38 TYR HD2 H 7.019 0.011 1 442 1854 38 TYR HE1 H 6.758 0.011 1 443 1854 38 TYR HE2 H 6.758 0.011 1 444 1854 38 TYR C C 177.640 0.000 1 445 1854 38 TYR CA C 62.318 0.029 1 446 1854 38 TYR CB C 38.443 0.070 1 447 1854 38 TYR CD1 C 133.076 0.055 1 448 1854 38 TYR CD2 C 133.076 0.055 1 449 1854 38 TYR CE1 C 117.856 0.016 1 450 1854 38 TYR CE2 C 117.856 0.016 1 451 1854 38 TYR N N 121.702 0.097 1 452 1855 39 GLU H H 8.067 0.010 1 453 1855 39 GLU HA H 3.901 0.024 1 454 1855 39 GLU HB2 H 2.161 0.015 1 455 1855 39 GLU HB3 H 2.165 0.011 1 456 1855 39 GLU HG2 H 2.578 0.010 1 457 1855 39 GLU HG3 H 2.574 0.012 1 458 1855 39 GLU C C 179.138 0.005 1 459 1855 39 GLU CA C 58.790 0.017 1 460 1855 39 GLU CB C 29.249 0.041 1 461 1855 39 GLU CG C 35.977 0.015 1 462 1855 39 GLU N N 118.490 0.077 1 463 1856 40 TYR H H 8.443 0.009 1 464 1856 40 TYR HA H 4.140 0.016 1 465 1856 40 TYR HB2 H 3.193 0.012 1 466 1856 40 TYR HB3 H 3.356 0.012 1 467 1856 40 TYR HD1 H 7.030 0.014 1 468 1856 40 TYR HD2 H 7.030 0.014 1 469 1856 40 TYR HE1 H 6.688 0.010 1 470 1856 40 TYR HE2 H 6.688 0.010 1 471 1856 40 TYR C C 177.545 0.007 1 472 1856 40 TYR CA C 62.156 0.096 1 473 1856 40 TYR CB C 39.021 0.054 1 474 1856 40 TYR CD1 C 132.885 0.045 1 475 1856 40 TYR CD2 C 132.885 0.045 1 476 1856 40 TYR CE1 C 118.547 0.013 1 477 1856 40 TYR CE2 C 118.547 0.013 1 478 1856 40 TYR N N 123.820 0.083 1 479 1857 41 LYS H H 8.638 0.012 1 480 1857 41 LYS HA H 3.942 0.017 1 481 1857 41 LYS HB2 H 1.735 0.014 1 482 1857 41 LYS HB3 H 1.919 0.012 1 483 1857 41 LYS HG2 H 1.570 0.006 1 484 1857 41 LYS HG3 H 1.431 0.011 1 485 1857 41 LYS HD2 H 1.607 0.011 1 486 1857 41 LYS HD3 H 1.707 0.001 1 487 1857 41 LYS HE2 H 2.959 0.003 1 488 1857 41 LYS HE3 H 2.965 0.014 1 489 1857 41 LYS C C 178.538 0.011 1 490 1857 41 LYS CA C 58.794 0.015 1 491 1857 41 LYS CB C 32.280 0.034 1 492 1857 41 LYS CG C 25.294 0.100 1 493 1857 41 LYS CD C 29.681 0.000 1 494 1857 41 LYS CE C 41.548 0.128 1 495 1857 41 LYS N N 119.880 0.104 1 496 1858 42 LYS H H 7.554 0.014 1 497 1858 42 LYS HA H 3.864 0.015 1 498 1858 42 LYS HB2 H 1.643 0.012 1 499 1858 42 LYS HB3 H 1.651 0.003 1 500 1858 42 LYS HG2 H 1.150 0.007 1 501 1858 42 LYS HG3 H 1.232 0.007 1 502 1858 42 LYS HD2 H 1.500 0.002 1 503 1858 42 LYS HD3 H 1.497 0.008 1 504 1858 42 LYS HE2 H 2.791 0.001 1 505 1858 42 LYS HE3 H 2.875 0.002 1 506 1858 42 LYS C C 177.803 0.012 1 507 1858 42 LYS CA C 57.929 0.018 1 508 1858 42 LYS CB C 31.947 0.017 1 509 1858 42 LYS CG C 24.233 0.064 1 510 1858 42 LYS CD C 28.621 0.021 1 511 1858 42 LYS CE C 41.629 0.016 1 512 1858 42 LYS N N 118.871 0.085 1 513 1859 43 LYS H H 7.273 0.008 1 514 1859 43 LYS HA H 3.927 0.008 1 515 1859 43 LYS HB2 H 1.021 0.010 1 516 1859 43 LYS HB3 H 1.277 0.011 1 517 1859 43 LYS HG2 H 0.532 0.004 1 518 1859 43 LYS HG3 H 0.969 0.005 1 519 1859 43 LYS HD2 H 1.384 0.017 1 520 1859 43 LYS HD3 H 1.399 0.016 1 521 1859 43 LYS HE2 H 2.781 0.005 1 522 1859 43 LYS HE3 H 2.778 0.009 1 523 1859 43 LYS C C 177.121 0.009 1 524 1859 43 LYS CA C 57.936 0.046 1 525 1859 43 LYS CB C 33.889 0.041 1 526 1859 43 LYS CG C 24.901 0.030 1 527 1859 43 LYS CD C 29.145 0.026 1 528 1859 43 LYS CE C 41.762 0.009 1 529 1859 43 LYS N N 119.141 0.073 1 530 1860 44 TYR H H 8.247 0.010 1 531 1860 44 TYR HA H 4.694 0.009 1 532 1860 44 TYR HB2 H 3.057 0.012 1 533 1860 44 TYR HB3 H 2.238 0.015 1 534 1860 44 TYR HD1 H 6.541 0.013 1 535 1860 44 TYR HD2 H 6.541 0.013 1 536 1860 44 TYR HE1 H 6.590 0.003 1 537 1860 44 TYR HE2 H 6.590 0.003 1 538 1860 44 TYR C C 176.072 0.005 1 539 1860 44 TYR CA C 57.056 0.006 1 540 1860 44 TYR CB C 38.429 0.055 1 541 1860 44 TYR CD1 C 133.730 0.033 1 542 1860 44 TYR CD2 C 133.730 0.033 1 543 1860 44 TYR CE1 C 117.146 0.021 1 544 1860 44 TYR CE2 C 117.146 0.021 1 545 1860 44 TYR N N 118.745 0.072 1 546 1861 45 SER H H 8.071 0.007 1 547 1861 45 SER HA H 4.482 0.013 1 548 1861 45 SER HB2 H 4.109 0.017 1 549 1861 45 SER HB3 H 4.137 0.020 1 550 1861 45 SER C C 174.673 0.004 1 551 1861 45 SER CA C 59.414 0.043 1 552 1861 45 SER CB C 63.940 0.006 1 553 1861 45 SER N N 117.572 0.112 1 554 1862 46 ASP H H 8.578 0.016 1 555 1862 46 ASP HA H 4.697 0.007 1 556 1862 46 ASP HB2 H 2.958 0.011 1 557 1862 46 ASP HB3 H 2.635 0.012 1 558 1862 46 ASP C C 177.805 0.044 1 559 1862 46 ASP CA C 54.367 0.021 1 560 1862 46 ASP CB C 40.890 0.080 1 561 1862 46 ASP N N 120.159 0.106 1 562 1863 47 ALA H H 8.246 0.009 1 563 1863 47 ALA HA H 4.174 0.012 1 564 1863 47 ALA HB H 1.513 0.012 1 565 1863 47 ALA C C 179.246 0.037 1 566 1863 47 ALA CA C 55.131 0.040 1 567 1863 47 ALA CB C 18.740 0.028 1 568 1863 47 ALA N N 125.668 0.107 1 569 1864 48 ASP H H 8.735 0.016 1 570 1864 48 ASP HA H 4.738 0.017 1 571 1864 48 ASP HB2 H 2.864 0.010 1 572 1864 48 ASP HB3 H 2.755 0.013 1 573 1864 48 ASP C C 176.723 0.000 1 574 1864 48 ASP CA C 55.112 0.033 1 575 1864 48 ASP CB C 41.414 0.091 1 576 1864 48 ASP N N 117.280 0.037 1 577 1865 49 ILE H H 7.695 0.008 1 578 1865 49 ILE HA H 4.189 0.010 1 579 1865 49 ILE HB H 2.156 0.012 1 580 1865 49 ILE HG12 H 1.828 0.003 1 581 1865 49 ILE HG13 H 1.251 0.008 1 582 1865 49 ILE HG2 H 1.200 0.011 1 583 1865 49 ILE HD1 H 1.083 0.011 1 584 1865 49 ILE C C 176.755 0.017 1 585 1865 49 ILE CA C 63.140 0.033 1 586 1865 49 ILE CB C 39.157 0.067 1 587 1865 49 ILE CG1 C 28.596 0.016 1 588 1865 49 ILE CG2 C 18.353 0.022 1 589 1865 49 ILE CD1 C 14.565 0.013 1 590 1865 49 ILE N N 118.685 0.141 1 591 1866 50 GLU H H 7.938 0.009 1 592 1866 50 GLU HA H 4.203 0.007 1 593 1866 50 GLU HB2 H 2.179 0.018 1 594 1866 50 GLU HB3 H 2.196 0.017 1 595 1866 50 GLU HG2 H 2.275 0.002 1 596 1866 50 GLU HG3 H 2.412 0.009 1 597 1866 50 GLU C C 174.923 0.000 1 598 1866 50 GLU CA C 61.421 0.030 1 599 1866 50 GLU CB C 27.541 0.031 1 600 1866 50 GLU CG C 36.416 0.000 1 601 1866 50 GLU N N 122.307 0.078 1 602 1867 51 PRO HA H 4.145 0.015 1 603 1867 51 PRO HB2 H 1.431 0.011 1 604 1867 51 PRO HB3 H 2.168 0.013 1 605 1867 51 PRO HG2 H 2.008 0.003 1 606 1867 51 PRO HG3 H 1.949 0.013 1 607 1867 51 PRO HD2 H 3.742 0.010 1 608 1867 51 PRO HD3 H 3.539 0.008 1 609 1867 51 PRO C C 178.577 0.000 1 610 1867 51 PRO CA C 66.086 0.058 1 611 1867 51 PRO CB C 30.942 0.054 1 612 1867 51 PRO CG C 28.405 0.029 1 613 1867 51 PRO CD C 50.365 0.023 1 614 1868 52 PHE H H 7.149 0.012 1 615 1868 52 PHE HA H 3.904 0.020 1 616 1868 52 PHE HB2 H 2.563 0.010 1 617 1868 52 PHE HB3 H 2.133 0.013 1 618 1868 52 PHE HD1 H 6.935 0.006 1 619 1868 52 PHE HD2 H 6.935 0.006 1 620 1868 52 PHE HE1 H 7.190 0.018 1 621 1868 52 PHE HE2 H 7.190 0.018 1 622 1868 52 PHE HZ H 7.253 0.012 1 623 1868 52 PHE C C 178.168 0.007 1 624 1868 52 PHE CA C 60.459 0.041 1 625 1868 52 PHE CB C 38.804 0.060 1 626 1868 52 PHE CD1 C 131.326 0.034 1 627 1868 52 PHE CD2 C 131.326 0.034 1 628 1868 52 PHE CE1 C 131.307 0.031 1 629 1868 52 PHE CE2 C 131.307 0.031 1 630 1868 52 PHE CZ C 129.549 0.058 1 631 1868 52 PHE N N 115.666 0.085 1 632 1869 53 LEU H H 7.724 0.007 1 633 1869 53 LEU HA H 4.208 0.016 1 634 1869 53 LEU HB2 H 1.589 0.004 1 635 1869 53 LEU HB3 H 1.932 0.013 1 636 1869 53 LEU HG H 1.821 0.010 1 637 1869 53 LEU HD1 H 1.039 0.011 1 638 1869 53 LEU HD2 H 1.051 0.010 1 639 1869 53 LEU C C 179.228 0.004 1 640 1869 53 LEU CA C 56.911 0.056 1 641 1869 53 LEU CB C 42.507 0.049 1 642 1869 53 LEU CG C 27.071 0.034 1 643 1869 53 LEU CD1 C 23.604 0.020 1 644 1869 53 LEU CD2 C 25.617 0.023 1 645 1869 53 LEU N N 120.372 0.093 1 646 1870 54 LYS H H 8.392 0.018 1 647 1870 54 LYS HA H 3.959 0.014 1 648 1870 54 LYS HB2 H 1.825 0.015 1 649 1870 54 LYS HB3 H 1.757 0.027 1 650 1870 54 LYS HG2 H 1.441 0.012 1 651 1870 54 LYS HG3 H 1.577 0.008 1 652 1870 54 LYS HD2 H 1.707 0.004 1 653 1870 54 LYS HD3 H 1.707 0.004 1 654 1870 54 LYS HE2 H 2.956 0.003 1 655 1870 54 LYS HE3 H 2.956 0.003 1 656 1870 54 LYS C C 177.147 0.002 1 657 1870 54 LYS CA C 58.626 0.058 1 658 1870 54 LYS CB C 32.143 0.058 1 659 1870 54 LYS CG C 25.502 0.017 1 660 1870 54 LYS CD C 28.971 0.001 1 661 1870 54 LYS CE C 42.109 0.000 1 662 1870 54 LYS N N 119.558 0.076 1 663 1871 55 ASN H H 7.338 0.012 1 664 1871 55 ASN HA H 4.827 0.033 1 665 1871 55 ASN HB2 H 2.879 0.014 1 666 1871 55 ASN HB3 H 2.561 0.015 1 667 1871 55 ASN HD21 H 7.533 0.001 1 668 1871 55 ASN HD22 H 6.825 0.002 1 669 1871 55 ASN C C 174.827 0.014 1 670 1871 55 ASN CA C 52.804 0.030 1 671 1871 55 ASN CB C 38.851 0.061 1 672 1871 55 ASN N N 116.352 0.079 1 673 1871 55 ASN ND2 N 114.713 0.040 1 674 1872 56 SER H H 7.576 0.013 1 675 1872 56 SER HA H 4.640 0.014 1 676 1872 56 SER HB2 H 4.133 0.022 1 677 1872 56 SER HB3 H 3.985 0.011 1 678 1872 56 SER C C 173.627 0.011 1 679 1872 56 SER CA C 58.123 0.042 1 680 1872 56 SER CB C 65.314 0.016 1 681 1872 56 SER N N 117.386 0.091 1 682 1873 57 SER H H 8.933 0.027 1 683 1873 57 SER HA H 4.436 0.013 1 684 1873 57 SER HB2 H 4.171 0.011 1 685 1873 57 SER HB3 H 4.431 0.007 1 686 1873 57 SER C C 175.005 0.016 1 687 1873 57 SER CA C 58.071 0.020 1 688 1873 57 SER CB C 64.649 0.045 1 689 1873 57 SER N N 119.584 0.099 1 690 1874 58 GLN H H 9.124 0.008 1 691 1874 58 GLN HA H 4.038 0.018 1 692 1874 58 GLN HB2 H 2.123 0.016 1 693 1874 58 GLN HB3 H 2.131 0.000 1 694 1874 58 GLN HG2 H 2.404 0.016 1 695 1874 58 GLN HG3 H 2.415 0.000 1 696 1874 58 GLN HE21 H 7.529 0.001 1 697 1874 58 GLN HE22 H 6.909 0.000 1 698 1874 58 GLN C C 178.771 0.000 1 699 1874 58 GLN CA C 59.331 0.039 1 700 1874 58 GLN CB C 28.130 0.045 1 701 1874 58 GLN CG C 34.063 0.000 1 702 1874 58 GLN N N 123.665 0.050 1 703 1874 58 GLN NE2 N 114.306 0.055 1 704 1875 59 PHE HA H 4.308 0.004 1 705 1875 59 PHE HB2 H 3.104 0.002 1 706 1875 59 PHE HB3 H 3.292 0.002 1 707 1875 59 PHE HD1 H 7.289 0.004 1 708 1875 59 PHE HD2 H 7.289 0.004 1 709 1875 59 PHE HE1 H 7.353 0.001 1 710 1875 59 PHE HE2 H 7.353 0.001 1 711 1875 59 PHE C C 177.631 0.000 1 712 1875 59 PHE CA C 60.914 0.099 1 713 1875 59 PHE CB C 38.907 0.101 1 714 1875 59 PHE CD1 C 131.845 0.021 1 715 1875 59 PHE CD2 C 131.845 0.021 1 716 1875 59 PHE CE1 C 131.622 0.200 1 717 1875 59 PHE CE2 C 131.622 0.200 1 718 1876 60 PHE H H 8.279 0.012 1 719 1876 60 PHE HA H 4.142 0.033 1 720 1876 60 PHE HB2 H 3.308 0.003 1 721 1876 60 PHE HB3 H 3.296 0.019 1 722 1876 60 PHE HD1 H 7.335 0.009 1 723 1876 60 PHE HD2 H 7.335 0.009 1 724 1876 60 PHE HE1 H 7.222 0.012 1 725 1876 60 PHE HE2 H 7.222 0.012 1 726 1876 60 PHE HZ H 7.398 0.028 1 727 1876 60 PHE C C 177.280 0.000 1 728 1876 60 PHE CA C 61.880 0.033 1 729 1876 60 PHE CB C 39.325 0.059 1 730 1876 60 PHE CD1 C 132.099 0.030 1 731 1876 60 PHE CD2 C 132.099 0.030 1 732 1876 60 PHE CE1 C 130.881 0.034 1 733 1876 60 PHE CE2 C 130.881 0.034 1 734 1876 60 PHE CZ C 130.061 0.009 1 735 1876 60 PHE N N 124.515 0.088 1 736 1877 61 GLN H H 8.625 0.008 1 737 1877 61 GLN HA H 3.795 0.016 1 738 1877 61 GLN HB2 H 2.180 0.013 1 739 1877 61 GLN HB3 H 2.186 0.013 1 740 1877 61 GLN HG2 H 2.708 0.007 1 741 1877 61 GLN HG3 H 2.200 0.016 1 742 1877 61 GLN HE21 H 7.054 0.003 1 743 1877 61 GLN HE22 H 6.750 0.002 1 744 1877 61 GLN C C 178.979 0.014 1 745 1877 61 GLN CA C 60.352 0.010 1 746 1877 61 GLN CB C 28.770 0.056 1 747 1877 61 GLN CG C 35.298 0.019 1 748 1877 61 GLN N N 118.838 0.087 1 749 1877 61 GLN NE2 N 113.889 0.034 1 750 1878 62 SER H H 8.234 0.009 1 751 1878 62 SER HA H 4.254 0.014 1 752 1878 62 SER HB2 H 3.967 0.014 1 753 1878 62 SER HB3 H 3.936 0.014 1 754 1878 62 SER C C 179.026 0.008 1 755 1878 62 SER CA C 61.435 0.026 1 756 1878 62 SER CB C 62.805 0.045 1 757 1878 62 SER N N 115.914 0.104 1 758 1879 63 TYR H H 8.080 0.027 1 759 1879 63 TYR HA H 3.947 0.004 1 760 1879 63 TYR HB2 H 2.961 0.010 1 761 1879 63 TYR HB3 H 2.758 0.007 1 762 1879 63 TYR HD1 H 6.787 0.013 1 763 1879 63 TYR HD2 H 6.787 0.013 1 764 1879 63 TYR HE1 H 6.678 0.007 1 765 1879 63 TYR HE2 H 6.678 0.007 1 766 1879 63 TYR C C 178.031 0.000 1 767 1879 63 TYR CA C 61.444 0.024 1 768 1879 63 TYR CB C 38.251 0.069 1 769 1879 63 TYR CD1 C 132.861 0.014 1 770 1879 63 TYR CD2 C 132.861 0.014 1 771 1879 63 TYR CE1 C 117.801 0.029 1 772 1879 63 TYR CE2 C 117.801 0.029 1 773 1879 63 TYR N N 125.357 0.101 1 774 1880 64 VAL H H 8.182 0.007 1 775 1880 64 VAL HA H 3.117 0.017 1 776 1880 64 VAL HB H 1.927 0.011 1 777 1880 64 VAL HG1 H 0.781 0.014 1 778 1880 64 VAL HG2 H 0.543 0.022 1 779 1880 64 VAL C C 176.855 0.000 1 780 1880 64 VAL CA C 66.735 0.029 1 781 1880 64 VAL CB C 31.350 0.118 1 782 1880 64 VAL CG1 C 22.022 0.019 1 783 1880 64 VAL CG2 C 24.214 0.035 1 784 1880 64 VAL N N 121.176 0.030 1 785 1881 65 GLU H H 7.945 0.005 1 786 1881 65 GLU HA H 3.889 0.011 1 787 1881 65 GLU HB2 H 2.159 0.008 1 788 1881 65 GLU HB3 H 2.074 0.010 1 789 1881 65 GLU HG2 H 2.397 0.015 1 790 1881 65 GLU HG3 H 2.199 0.008 1 791 1881 65 GLU C C 179.728 0.000 1 792 1881 65 GLU CA C 60.019 0.048 1 793 1881 65 GLU CB C 29.379 0.079 1 794 1881 65 GLU CG C 36.181 0.017 1 795 1881 65 GLU N N 120.190 0.097 1 796 1882 66 ARG H H 8.249 0.006 1 797 1882 66 ARG HA H 3.950 0.014 1 798 1882 66 ARG HB2 H 1.763 0.013 1 799 1882 66 ARG HB3 H 1.832 0.009 1 800 1882 66 ARG HG2 H 1.578 0.019 1 801 1882 66 ARG HG3 H 1.756 0.008 1 802 1882 66 ARG HD2 H 3.163 0.007 1 803 1882 66 ARG HD3 H 3.163 0.007 1 804 1882 66 ARG C C 178.921 0.000 1 805 1882 66 ARG CA C 59.045 0.056 1 806 1882 66 ARG CB C 29.969 0.055 1 807 1882 66 ARG CG C 27.610 0.018 1 808 1882 66 ARG CD C 43.439 0.003 1 809 1882 66 ARG N N 119.343 0.084 1 810 1883 67 GLY H H 8.151 0.014 1 811 1883 67 GLY HA2 H 3.639 0.020 1 812 1883 67 GLY HA3 H 3.424 0.016 1 813 1883 67 GLY C C 176.385 0.013 1 814 1883 67 GLY CA C 47.304 0.044 1 815 1883 67 GLY N N 109.924 0.126 1 816 1884 68 LEU H H 8.599 0.012 1 817 1884 68 LEU HA H 4.105 0.018 1 818 1884 68 LEU HB2 H 1.585 0.013 1 819 1884 68 LEU HB3 H 1.988 0.010 1 820 1884 68 LEU HG H 1.923 0.009 1 821 1884 68 LEU HD1 H 0.868 0.011 1 822 1884 68 LEU HD2 H 0.945 0.010 1 823 1884 68 LEU C C 179.211 0.019 1 824 1884 68 LEU CA C 57.790 0.040 1 825 1884 68 LEU CB C 41.677 0.052 1 826 1884 68 LEU CG C 26.997 0.003 1 827 1884 68 LEU CD1 C 25.742 0.111 1 828 1884 68 LEU CD2 C 23.344 0.047 1 829 1884 68 LEU N N 122.852 0.083 1 830 1885 69 ARG H H 7.517 0.008 1 831 1885 69 ARG HA H 4.145 0.023 1 832 1885 69 ARG HB2 H 1.992 0.007 1 833 1885 69 ARG HB3 H 2.021 0.012 1 834 1885 69 ARG HG2 H 1.791 0.003 1 835 1885 69 ARG HG3 H 1.750 0.004 1 836 1885 69 ARG HD2 H 3.221 0.010 1 837 1885 69 ARG HD3 H 3.272 0.001 1 838 1885 69 ARG C C 178.832 0.021 1 839 1885 69 ARG CA C 58.971 0.033 1 840 1885 69 ARG CB C 29.503 0.094 1 841 1885 69 ARG CG C 27.525 0.006 1 842 1885 69 ARG CD C 43.306 0.054 1 843 1885 69 ARG N N 121.057 0.080 1 844 1886 70 VAL H H 7.795 0.013 1 845 1886 70 VAL HA H 3.631 0.015 1 846 1886 70 VAL HB H 2.192 0.007 1 847 1886 70 VAL HG1 H 1.036 0.015 1 848 1886 70 VAL HG2 H 0.880 0.010 1 849 1886 70 VAL C C 178.479 0.007 1 850 1886 70 VAL CA C 66.620 0.042 1 851 1886 70 VAL CB C 31.589 0.015 1 852 1886 70 VAL CG1 C 22.742 0.038 1 853 1886 70 VAL CG2 C 21.288 0.007 1 854 1886 70 VAL N N 121.166 0.165 1 855 1887 71 ILE H H 7.387 0.024 1 856 1887 71 ILE HA H 3.597 0.011 1 857 1887 71 ILE HB H 1.628 0.007 1 858 1887 71 ILE HG12 H 1.410 0.016 1 859 1887 71 ILE HG13 H 1.188 0.017 1 860 1887 71 ILE HG2 H 0.198 0.006 1 861 1887 71 ILE HD1 H 0.697 0.012 1 862 1887 71 ILE C C 177.673 0.013 1 863 1887 71 ILE CA C 63.870 0.066 1 864 1887 71 ILE CB C 36.970 0.118 1 865 1887 71 ILE CG1 C 28.582 0.040 1 866 1887 71 ILE CG2 C 16.925 0.011 1 867 1887 71 ILE CD1 C 12.445 0.038 1 868 1887 71 ILE N N 121.180 0.068 1 869 1888 72 GLU H H 8.022 0.006 1 870 1888 72 GLU HA H 3.687 0.022 1 871 1888 72 GLU HB2 H 2.195 0.006 1 872 1888 72 GLU HB3 H 2.267 0.014 1 873 1888 72 GLU HG2 H 2.450 0.010 1 874 1888 72 GLU HG3 H 2.269 0.002 1 875 1888 72 GLU C C 178.766 0.006 1 876 1888 72 GLU CA C 59.640 0.057 1 877 1888 72 GLU CB C 30.025 0.084 1 878 1888 72 GLU CG C 36.146 0.004 1 879 1888 72 GLU N N 121.463 0.075 1 880 1889 73 MET H H 8.006 0.009 1 881 1889 73 MET HA H 4.137 0.020 1 882 1889 73 MET HB2 H 2.131 0.009 1 883 1889 73 MET HB3 H 2.209 0.021 1 884 1889 73 MET HG2 H 2.740 0.019 1 885 1889 73 MET HG3 H 2.555 0.015 1 886 1889 73 MET HE H 2.084 0.006 1 887 1889 73 MET C C 179.015 0.070 1 888 1889 73 MET CA C 58.570 0.041 1 889 1889 73 MET CB C 32.560 0.041 1 890 1889 73 MET CG C 32.270 0.067 1 891 1889 73 MET CE C 16.844 0.059 1 892 1889 73 MET N N 118.383 0.117 1 893 1890 74 GLU H H 8.042 0.019 1 894 1890 74 GLU HA H 4.033 0.018 1 895 1890 74 GLU HB2 H 2.172 0.009 1 896 1890 74 GLU HB3 H 2.022 0.021 1 897 1890 74 GLU HG2 H 2.179 0.008 1 898 1890 74 GLU HG3 H 2.457 0.015 1 899 1890 74 GLU C C 179.033 0.000 1 900 1890 74 GLU CA C 58.731 0.059 1 901 1890 74 GLU CB C 29.923 0.150 1 902 1890 74 GLU CG C 36.522 0.023 1 903 1890 74 GLU N N 121.316 0.115 1 904 1891 75 ARG H H 8.295 0.016 1 905 1891 75 ARG HA H 4.188 0.014 1 906 1891 75 ARG HB2 H 1.794 0.016 1 907 1891 75 ARG HB3 H 1.926 0.010 1 908 1891 75 ARG HG2 H 1.671 0.012 1 909 1891 75 ARG HG3 H 1.629 0.007 1 910 1891 75 ARG HD2 H 3.124 0.010 1 911 1891 75 ARG HD3 H 2.988 0.011 1 912 1891 75 ARG HE H 7.243 0.011 1 913 1891 75 ARG C C 178.071 0.025 1 914 1891 75 ARG CA C 57.511 0.042 1 915 1891 75 ARG CB C 30.542 0.068 1 916 1891 75 ARG CG C 27.560 0.000 1 917 1891 75 ARG CD C 42.873 0.024 1 918 1891 75 ARG N N 118.714 0.087 1 919 1891 75 ARG NE N 86.120 0.036 1 920 1892 76 GLU H H 8.133 0.012 1 921 1892 76 GLU HA H 4.382 0.026 1 922 1892 76 GLU HB2 H 2.066 0.015 1 923 1892 76 GLU HB3 H 2.179 0.010 1 924 1892 76 GLU HG2 H 2.336 0.011 1 925 1892 76 GLU HG3 H 2.425 0.008 1 926 1892 76 GLU C C 177.629 0.010 1 927 1892 76 GLU CA C 56.728 0.027 1 928 1892 76 GLU CB C 30.038 0.133 1 929 1892 76 GLU CG C 36.113 0.055 1 930 1892 76 GLU N N 119.035 0.086 1 931 1893 77 GLY H H 7.912 0.006 1 932 1893 77 GLY HA2 H 3.995 0.016 1 933 1893 77 GLY HA3 H 3.909 0.000 1 934 1893 77 GLY C C 174.737 0.008 1 935 1893 77 GLY CA C 45.957 0.033 1 936 1893 77 GLY N N 109.375 0.078 1 937 1894 78 LYS H H 8.044 0.009 1 938 1894 78 LYS HA H 4.326 0.010 1 939 1894 78 LYS HB2 H 1.911 0.011 1 940 1894 78 LYS HB3 H 1.775 0.012 1 941 1894 78 LYS HG2 H 1.475 0.007 1 942 1894 78 LYS HG3 H 1.409 0.009 1 943 1894 78 LYS HD2 H 1.675 0.017 1 944 1894 78 LYS HD3 H 1.684 0.002 1 945 1894 78 LYS HE2 H 3.000 0.014 1 946 1894 78 LYS HE3 H 2.993 0.006 1 947 1894 78 LYS C C 177.143 0.004 1 948 1894 78 LYS CA C 56.478 0.021 1 949 1894 78 LYS CB C 32.815 0.030 1 950 1894 78 LYS CG C 24.899 0.007 1 951 1894 78 LYS CD C 28.860 0.088 1 952 1894 78 LYS CE C 41.913 0.018 1 953 1894 78 LYS N N 121.290 0.078 1 954 1895 79 GLY H H 8.411 0.010 1 955 1895 79 GLY HA2 H 3.928 0.001 1 956 1895 79 GLY HA3 H 3.928 0.001 1 957 1895 79 GLY C C 174.001 0.008 1 958 1895 79 GLY CA C 45.297 0.051 1 959 1895 79 GLY N N 110.544 0.103 1 960 1896 80 ARG H H 8.039 0.011 1 961 1896 80 ARG HA H 4.348 0.024 1 962 1896 80 ARG HB2 H 1.768 0.012 1 963 1896 80 ARG HB3 H 1.878 0.014 1 964 1896 80 ARG HG2 H 1.594 0.013 1 965 1896 80 ARG HG3 H 1.558 0.000 1 966 1896 80 ARG HD2 H 3.192 0.017 1 967 1896 80 ARG HD3 H 3.195 0.013 1 968 1896 80 ARG C C 176.335 0.021 1 969 1896 80 ARG CA C 56.138 0.104 1 970 1896 80 ARG CB C 30.806 0.079 1 971 1896 80 ARG CG C 27.080 0.000 1 972 1896 80 ARG CD C 43.293 0.009 1 973 1896 80 ARG N N 121.662 0.094 1 974 1897 81 ILE H H 8.196 0.020 1 975 1897 81 ILE HA H 4.239 0.017 1 976 1897 81 ILE HB H 1.846 0.008 1 977 1897 81 ILE HG12 H 1.437 0.010 1 978 1897 81 ILE HG13 H 1.154 0.011 1 979 1897 81 ILE HG2 H 0.889 0.002 1 980 1897 81 ILE HD1 H 0.842 0.004 1 981 1897 81 ILE C C 176.320 0.014 1 982 1897 81 ILE CA C 60.850 0.078 1 983 1897 81 ILE CB C 38.844 0.120 1 984 1897 81 ILE CG1 C 27.217 0.026 1 985 1897 81 ILE CG2 C 17.661 0.026 1 986 1897 81 ILE CD1 C 13.133 0.030 1 987 1897 81 ILE N N 123.213 0.072 1 988 1898 82 SER H H 8.439 0.009 1 989 1898 82 SER HA H 4.558 0.007 1 990 1898 82 SER HB2 H 3.861 0.012 1 991 1898 82 SER HB3 H 3.907 0.008 1 992 1898 82 SER C C 174.971 0.031 1 993 1898 82 SER CA C 58.006 0.009 1 994 1898 82 SER CB C 63.822 0.019 1 995 1898 82 SER N N 121.339 0.079 1 996 1899 83 THR H H 8.215 0.010 1 997 1899 83 THR HA H 4.407 0.017 1 998 1899 83 THR HB H 4.307 0.006 1 999 1899 83 THR HG2 H 1.200 0.005 1 1000 1899 83 THR C C 174.737 0.030 1 1001 1899 83 THR CA C 61.800 0.073 1 1002 1899 83 THR CB C 69.712 0.083 1 1003 1899 83 THR CG2 C 21.534 0.026 1 1004 1899 83 THR N N 117.039 0.133 1 1005 1900 84 SER H H 8.341 0.013 1 1006 1900 84 SER HA H 4.521 0.014 1 1007 1900 84 SER HB2 H 3.901 0.006 1 1008 1900 84 SER HB3 H 3.850 0.001 1 1009 1900 84 SER C C 175.001 0.077 1 1010 1900 84 SER CA C 58.253 0.093 1 1011 1900 84 SER CB C 63.768 0.020 1 1012 1900 84 SER N N 119.175 0.131 1 1013 1901 85 THR H H 8.171 0.014 1 1014 1901 85 THR HA H 4.354 0.002 1 1015 1901 85 THR HB H 4.260 0.002 1 1016 1901 85 THR HG2 H 1.219 0.014 1 1017 1901 85 THR C C 175.132 0.000 1 1018 1901 85 THR CA C 62.061 0.010 1 1019 1901 85 THR CB C 69.706 0.009 1 1020 1901 85 THR CG2 C 21.500 0.000 1 1021 1901 85 THR N N 116.477 0.089 1 1022 1902 86 GLY H H 8.326 0.008 1 1023 1902 86 GLY HA2 H 3.959 0.005 1 1024 1902 86 GLY HA3 H 3.964 0.010 1 1025 1902 86 GLY C C 173.801 0.014 1 1026 1902 86 GLY CA C 45.194 0.011 1 1027 1902 86 GLY N N 112.322 0.088 1 1028 1903 87 ILE H H 7.958 0.006 1 1029 1903 87 ILE HA H 4.244 0.006 1 1030 1903 87 ILE HB H 1.843 0.013 1 1031 1903 87 ILE HG12 H 1.429 0.011 1 1032 1903 87 ILE HG13 H 1.144 0.013 1 1033 1903 87 ILE HG2 H 0.890 0.008 1 1034 1903 87 ILE HD1 H 0.848 0.023 1 1035 1903 87 ILE C C 176.166 0.000 1 1036 1903 87 ILE CA C 60.637 0.039 1 1037 1903 87 ILE CB C 38.730 0.052 1 1038 1903 87 ILE CG1 C 26.944 0.000 1 1039 1903 87 ILE CG2 C 17.500 0.000 1 1040 1903 87 ILE CD1 C 13.017 0.040 1 1041 1903 87 ILE N N 121.041 0.093 1 1042 1904 88 SER H H 8.394 0.008 1 1043 1904 88 SER HA H 4.777 0.002 1 1044 1904 88 SER HB2 H 3.865 0.006 1 1045 1904 88 SER HB3 H 3.863 0.005 1 1046 1904 88 SER CA C 56.299 0.015 1 1047 1904 88 SER CB C 63.319 0.011 1 1048 1904 88 SER N N 122.836 0.055 1 1049 1905 89 PRO HA H 4.433 0.012 1 1050 1905 89 PRO HB2 H 2.298 0.010 1 1051 1905 89 PRO HB3 H 1.922 0.011 1 1052 1905 89 PRO HG2 H 2.026 0.017 1 1053 1905 89 PRO HD2 H 3.745 0.011 1 1054 1905 89 PRO HD3 H 3.845 0.006 1 1055 1905 89 PRO C C 176.171 0.000 1 1056 1905 89 PRO CA C 63.471 0.097 1 1057 1905 89 PRO CB C 32.134 0.064 1 1058 1905 89 PRO CG C 27.423 0.034 1 1059 1905 89 PRO CD C 50.838 0.007 1 1060 1906 90 GLN H H 8.357 0.007 1 1061 1906 90 GLN HA H 4.285 0.014 1 1062 1906 90 GLN HB2 H 2.075 0.007 1 1063 1906 90 GLN HB3 H 1.980 0.010 1 1064 1906 90 GLN HG2 H 2.367 0.011 1 1065 1906 90 GLN HG3 H 2.372 0.009 1 1066 1906 90 GLN C C 176.024 0.000 1 1067 1906 90 GLN CA C 55.973 0.008 1 1068 1906 90 GLN CB C 29.124 0.091 1 1069 1906 90 GLN CG C 33.870 0.000 1 1070 1906 90 GLN N N 120.763 0.050 1 1071 1907 91 MET H H 8.252 0.008 1 1072 1907 91 MET HA H 4.465 0.021 1 1073 1907 91 MET HB2 H 2.011 0.010 1 1074 1907 91 MET HB3 H 2.085 0.000 1 1075 1907 91 MET HG2 H 2.504 0.015 1 1076 1907 91 MET HG3 H 2.576 0.022 1 1077 1907 91 MET C C 175.994 0.000 1 1078 1907 91 MET CA C 55.508 0.059 1 1079 1907 91 MET CB C 33.409 0.125 1 1080 1907 91 MET CG C 32.142 0.000 1 1081 1907 91 MET N N 122.477 0.102 1 1082 1908 92 GLU H H 8.363 0.008 1 1083 1908 92 GLU HA H 4.328 0.013 1 1084 1908 92 GLU HB2 H 2.034 0.011 1 1085 1908 92 GLU HB3 H 1.946 0.011 1 1086 1908 92 GLU HG2 H 2.267 0.024 1 1087 1908 92 GLU HG3 H 2.229 0.024 1 1088 1908 92 GLU CA C 56.456 0.022 1 1089 1908 92 GLU CB C 30.288 0.061 1 1090 1908 92 GLU CG C 36.248 0.000 1 1091 1908 92 GLU N N 123.515 0.070 1 1092 1909 93 VAL H H 8.195 0.010 1 1093 1909 93 VAL HA H 4.181 0.004 1 1094 1909 93 VAL HB H 2.092 0.012 1 1095 1909 93 VAL HG1 H 0.926 0.020 1 1096 1909 93 VAL HG2 H 0.935 0.015 1 1097 1909 93 VAL C C 176.047 0.000 1 1098 1909 93 VAL CA C 62.209 0.079 1 1099 1909 93 VAL CB C 32.793 0.009 1 1100 1909 93 VAL CG1 C 21.680 0.000 1 1101 1909 93 VAL CG2 C 20.580 0.086 1 1102 1909 93 VAL N N 122.128 0.076 1 1103 1910 94 THR H H 8.143 0.014 1 1104 1910 94 THR HA H 4.400 0.011 1 1105 1910 94 THR HB H 4.190 0.003 1 1106 1910 94 THR HG2 H 1.202 0.016 1 1107 1910 94 THR C C 174.193 0.000 1 1108 1910 94 THR CA C 61.775 0.140 1 1109 1910 94 THR CB C 69.863 0.045 1 1110 1910 94 THR CG2 C 21.602 0.086 1 1111 1910 94 THR N N 118.617 0.063 1 1112 1911 95 CYS H H 8.440 0.005 1 1113 1911 95 CYS HA H 4.820 0.001 1 1114 1911 95 CYS HB2 H 3.181 0.003 1 1115 1911 95 CYS HB3 H 3.016 0.017 1 1116 1911 95 CYS CA C 55.280 0.114 1 1117 1911 95 CYS CB C 41.566 0.000 1 1118 1911 95 CYS N N 122.519 0.074 1 1119 1912 96 VAL HA H 4.444 0.001 1 1120 1912 96 VAL HB H 2.067 0.002 1 1121 1912 96 VAL HG1 H 0.927 0.007 1 1122 1912 96 VAL HG2 H 0.960 0.016 1 1123 1912 96 VAL CA C 59.760 0.057 1 1124 1912 96 VAL CB C 32.836 0.000 1 1125 1912 96 VAL CG1 C 20.602 0.055 1 1126 1912 96 VAL CG2 C 21.148 0.000 1 1127 1913 97 PRO HA H 4.480 0.020 1 1128 1913 97 PRO HB2 H 2.235 0.014 1 1129 1913 97 PRO HB3 H 1.897 0.005 1 1130 1913 97 PRO HG2 H 2.039 0.006 1 1131 1913 97 PRO HG3 H 1.949 0.006 1 1132 1913 97 PRO HD2 H 3.841 0.002 1 1133 1913 97 PRO HD3 H 3.667 0.006 1 1134 1913 97 PRO C C 176.506 0.000 1 1135 1913 97 PRO CA C 63.001 0.018 1 1136 1913 97 PRO CB C 32.098 0.004 1 1137 1913 97 PRO CG C 27.482 0.003 1 1138 1913 97 PRO CD C 51.080 0.000 1 1139 1914 98 THR H H 8.191 0.007 1 1140 1914 98 THR HA H 4.575 0.003 1 1141 1914 98 THR HB H 4.152 0.009 1 1142 1914 98 THR HG2 H 1.264 0.014 1 1143 1914 98 THR CA C 59.902 0.073 1 1144 1914 98 THR CB C 69.761 0.057 1 1145 1914 98 THR CG2 C 21.592 0.042 1 1146 1914 98 THR N N 117.716 0.076 1 1147 1915 99 PRO HA H 4.443 0.009 1 1148 1915 99 PRO HB2 H 2.302 0.009 1 1149 1915 99 PRO HB3 H 1.958 0.016 1 1150 1915 99 PRO HG2 H 1.958 0.011 1 1151 1915 99 PRO HG3 H 2.050 0.003 1 1152 1915 99 PRO HD2 H 3.865 0.009 1 1153 1915 99 PRO HD3 H 3.736 0.003 1 1154 1915 99 PRO C C 177.186 0.000 1 1155 1915 99 PRO CA C 63.421 0.014 1 1156 1915 99 PRO CB C 32.391 0.053 1 1157 1915 99 PRO CG C 27.364 0.000 1 1158 1915 99 PRO CD C 51.102 0.032 1 1159 1916 100 THR H H 8.143 0.011 1 1160 1916 100 THR HA H 4.344 0.009 1 1161 1916 100 THR HB H 4.243 0.013 1 1162 1916 100 THR HG2 H 1.222 0.009 1 1163 1916 100 THR C C 174.720 0.000 1 1164 1916 100 THR CA C 61.846 0.120 1 1165 1916 100 THR CB C 69.694 0.043 1 1166 1916 100 THR CG2 C 21.684 0.007 1 1167 1916 100 THR N N 114.503 0.119 1 1168 1917 101 SER H H 8.250 0.034 1 1169 1917 101 SER HA H 4.511 0.004 1 1170 1917 101 SER HB2 H 3.901 0.001 1 1171 1917 101 SER HB3 H 3.851 0.003 1 1172 1917 101 SER C C 174.879 0.000 1 1173 1917 101 SER CA C 58.424 0.155 1 1174 1917 101 SER CB C 63.867 0.065 1 1175 1917 101 SER N N 119.073 0.052 1 1176 1918 102 THR H H 8.208 0.004 1 1177 1918 102 THR HA H 4.394 0.011 1 1178 1918 102 THR HB H 4.233 0.019 1 1179 1918 102 THR HG2 H 1.193 0.012 1 1180 1918 102 THR C C 174.622 0.000 1 1181 1918 102 THR CA C 62.027 0.047 1 1182 1918 102 THR CB C 69.711 0.019 1 1183 1918 102 THR CG2 C 21.680 0.000 1 1184 1918 102 THR N N 117.300 0.103 1 1185 1919 103 VAL H H 8.098 0.006 1 1186 1919 103 VAL HA H 4.167 0.016 1 1187 1919 103 VAL HB H 2.083 0.017 1 1188 1919 103 VAL HG1 H 0.927 0.013 1 1189 1919 103 VAL HG2 H 0.924 0.014 1 1190 1919 103 VAL C C 176.168 0.000 1 1191 1919 103 VAL CA C 62.316 0.078 1 1192 1919 103 VAL CB C 32.592 0.010 1 1193 1919 103 VAL CG1 C 21.100 0.000 1 1194 1919 103 VAL CG2 C 20.530 0.000 1 1195 1919 103 VAL N N 123.019 0.077 1 1196 1920 104 SER H H 8.333 0.009 1 1197 1920 104 SER HA H 4.479 0.018 1 1198 1920 104 SER HB2 H 3.821 0.006 1 1199 1920 104 SER HB3 H 3.859 0.007 1 1200 1920 104 SER C C 174.979 0.000 1 1201 1920 104 SER CA C 58.276 0.063 1 1202 1920 104 SER CB C 63.774 0.010 1 1203 1920 104 SER N N 120.312 0.085 1 1204 1921 105 SER H H 8.095 0.007 1 1205 1921 105 SER HA H 4.502 0.011 1 1206 1921 105 SER HB2 H 3.886 0.007 1 1207 1921 105 SER HB3 H 3.847 0.010 1 1208 1921 105 SER C C 174.673 0.000 1 1209 1921 105 SER CA C 58.355 0.015 1 1210 1921 105 SER CB C 63.680 0.032 1 1211 1921 105 SER N N 123.127 0.078 1 1212 1922 106 ILE H H 8.072 0.004 1 1213 1922 106 ILE HA H 4.202 0.018 1 1214 1922 106 ILE HB H 1.879 0.009 1 1215 1922 106 ILE HG12 H 1.473 0.013 1 1216 1922 106 ILE HG13 H 1.185 0.013 1 1217 1922 106 ILE HG2 H 0.909 0.011 1 1218 1922 106 ILE HD1 H 0.853 0.012 1 1219 1922 106 ILE C C 176.704 0.005 1 1220 1922 106 ILE CA C 61.441 0.038 1 1221 1922 106 ILE CB C 38.718 0.099 1 1222 1922 106 ILE CG1 C 27.345 0.041 1 1223 1922 106 ILE CG2 C 17.544 0.031 1 1224 1922 106 ILE CD1 C 13.110 0.023 1 1225 1922 106 ILE N N 122.996 0.145 1 1226 1923 107 GLY H H 8.376 0.008 1 1227 1923 107 GLY HA2 H 3.943 0.003 1 1228 1923 107 GLY HA3 H 3.943 0.003 1 1229 1923 107 GLY C C 173.788 0.004 1 1230 1923 107 GLY CA C 45.156 0.019 1 1231 1923 107 GLY N N 113.416 0.116 1 1232 1924 108 ASN H H 8.295 0.009 1 1233 1924 108 ASN HA H 4.810 0.020 1 1234 1924 108 ASN HB2 H 2.858 0.011 1 1235 1924 108 ASN HB3 H 2.771 0.013 1 1236 1924 108 ASN HD21 H 7.610 0.004 1 1237 1924 108 ASN HD22 H 6.915 0.002 1 1238 1924 108 ASN C C 175.691 0.046 1 1239 1924 108 ASN CA C 53.151 0.039 1 1240 1924 108 ASN CB C 39.003 0.037 1 1241 1924 108 ASN N N 120.180 0.092 1 1242 1924 108 ASN ND2 N 114.297 0.064 1 1243 1925 109 THR H H 8.238 0.032 1 1244 1925 109 THR HA H 4.367 0.014 1 1245 1925 109 THR HB H 4.284 0.003 1 1246 1925 109 THR HG2 H 1.184 0.016 1 1247 1925 109 THR C C 174.717 0.009 1 1248 1925 109 THR CA C 61.969 0.015 1 1249 1925 109 THR CB C 69.615 0.035 1 1250 1925 109 THR CG2 C 21.400 0.000 1 1251 1925 109 THR N N 115.480 0.073 1 1252 1926 110 ASN H H 8.544 0.007 1 1253 1926 110 ASN HA H 4.746 0.012 1 1254 1926 110 ASN HB2 H 2.861 0.018 1 1255 1926 110 ASN HB3 H 2.782 0.019 1 1256 1926 110 ASN HD21 H 6.889 0.018 1 1257 1926 110 ASN HD22 H 7.586 0.011 1 1258 1926 110 ASN C C 175.725 0.002 1 1259 1926 110 ASN CA C 53.354 0.020 1 1260 1926 110 ASN CB C 38.794 0.007 1 1261 1926 110 ASN N N 122.003 0.089 1 1262 1926 110 ASN ND2 N 113.895 0.041 1 1263 1927 111 GLY H H 8.361 0.006 1 1264 1927 111 GLY HA2 H 3.903 0.001 1 1265 1927 111 GLY HA3 H 3.960 0.001 1 1266 1927 111 GLY C C 174.212 0.000 1 1267 1927 111 GLY CA C 45.395 0.022 1 1268 1927 111 GLY N N 110.540 0.078 1 1269 1928 112 GLU H H 8.226 0.008 1 1270 1928 112 GLU HA H 4.297 0.013 1 1271 1928 112 GLU HB2 H 1.930 0.008 1 1272 1928 112 GLU HB3 H 2.051 0.008 1 1273 1928 112 GLU HG2 H 2.231 0.008 1 1274 1928 112 GLU HG3 H 2.233 0.007 1 1275 1928 112 GLU C C 176.514 0.000 1 1276 1928 112 GLU CA C 56.540 0.089 1 1277 1928 112 GLU CB C 30.298 0.005 1 1278 1928 112 GLU CG C 36.259 0.014 1 1279 1928 112 GLU N N 121.611 0.073 1 1280 1929 113 GLU H H 8.517 0.006 1 1281 1929 113 GLU HA H 4.317 0.000 1 1282 1929 113 GLU HB2 H 1.935 0.001 1 1283 1929 113 GLU HB3 H 2.031 0.003 1 1284 1929 113 GLU HG2 H 2.256 0.006 1 1285 1929 113 GLU HG3 H 2.214 0.001 1 1286 1929 113 GLU C C 176.319 0.000 1 1287 1929 113 GLU CA C 56.471 0.030 1 1288 1929 113 GLU CB C 30.150 0.051 1 1289 1929 113 GLU CG C 36.254 0.042 1 1290 1929 113 GLU N N 123.494 0.102 1 1291 1930 114 VAL H H 8.131 0.012 1 1292 1930 114 VAL HA H 4.225 0.011 1 1293 1930 114 VAL HB H 2.105 0.005 1 1294 1930 114 VAL HG1 H 0.935 0.013 1 1295 1930 114 VAL HG2 H 0.927 0.017 1 1296 1930 114 VAL C C 176.114 0.000 1 1297 1930 114 VAL CA C 61.990 0.117 1 1298 1930 114 VAL CB C 32.953 0.057 1 1299 1930 114 VAL CG1 C 21.414 0.000 1 1300 1930 114 VAL CG2 C 20.194 0.203 1 1301 1930 114 VAL N N 121.546 0.201 1 1302 1931 115 GLY H H 8.245 0.008 1 1303 1931 115 GLY HA2 H 4.195 0.002 1 1304 1931 115 GLY HA3 H 4.085 0.007 1 1305 1931 115 GLY CA C 44.635 0.009 1 1306 1931 115 GLY N N 113.043 0.090 1 1307 1932 116 PRO HA H 4.427 0.015 1 1308 1932 116 PRO HB2 H 2.007 0.013 1 1309 1932 116 PRO HB3 H 2.321 0.009 1 1310 1932 116 PRO HG2 H 2.014 0.019 1 1311 1932 116 PRO HG3 H 2.043 0.018 1 1312 1932 116 PRO HD2 H 3.688 0.008 1 1313 1932 116 PRO HD3 H 3.688 0.008 1 1314 1932 116 PRO C C 177.978 0.000 1 1315 1932 116 PRO CA C 63.931 0.099 1 1316 1932 116 PRO CB C 32.207 0.074 1 1317 1932 116 PRO CG C 27.571 0.115 1 1318 1932 116 PRO CD C 49.982 0.000 1 1319 1933 117 SER H H 8.427 0.011 1 1320 1933 117 SER HA H 4.364 0.013 1 1321 1933 117 SER HB2 H 3.907 0.007 1 1322 1933 117 SER HB3 H 3.939 0.021 1 1323 1933 117 SER C C 175.823 0.000 1 1324 1933 117 SER CA C 59.854 0.046 1 1325 1933 117 SER CB C 63.103 0.020 1 1326 1933 117 SER N N 116.119 0.076 1 1327 1934 118 VAL H H 7.876 0.012 1 1328 1934 118 VAL HA H 3.952 0.013 1 1329 1934 118 VAL HB H 2.064 0.006 1 1330 1934 118 VAL HG1 H 0.930 0.008 1 1331 1934 118 VAL HG2 H 0.871 0.016 1 1332 1934 118 VAL C C 178.147 0.000 1 1333 1934 118 VAL CA C 64.114 0.174 1 1334 1934 118 VAL CB C 32.021 0.062 1 1335 1934 118 VAL CG1 C 20.621 0.070 1 1336 1934 118 VAL CG2 C 20.750 0.000 1 1337 1934 118 VAL N N 123.546 0.122 1 1338 1935 119 TYR H H 7.960 0.017 1 1339 1935 119 TYR HA H 3.992 0.013 1 1340 1935 119 TYR HB2 H 3.023 0.021 1 1341 1935 119 TYR HB3 H 3.025 0.019 1 1342 1935 119 TYR HD1 H 7.066 0.019 1 1343 1935 119 TYR HD2 H 7.066 0.019 1 1344 1935 119 TYR HE1 H 6.810 0.013 1 1345 1935 119 TYR HE2 H 6.810 0.013 1 1346 1935 119 TYR C C 177.175 0.000 1 1347 1935 119 TYR CA C 60.304 0.000 1 1348 1935 119 TYR CB C 38.252 0.038 1 1349 1935 119 TYR CD1 C 132.944 0.078 1 1350 1935 119 TYR CD2 C 132.944 0.078 1 1351 1935 119 TYR CE1 C 118.186 0.026 1 1352 1935 119 TYR CE2 C 118.186 0.026 1 1353 1935 119 TYR N N 122.786 0.060 1 1354 1936 120 LEU H H 7.947 0.004 1 1355 1936 120 LEU HA H 4.057 0.011 1 1356 1936 120 LEU HB2 H 1.642 0.021 1 1357 1936 120 LEU HB3 H 1.562 0.027 1 1358 1936 120 LEU HG H 1.687 0.018 1 1359 1936 120 LEU HD1 H 0.934 0.013 1 1360 1936 120 LEU HD2 H 0.851 0.011 1 1361 1936 120 LEU C C 178.987 0.000 1 1362 1936 120 LEU CA C 57.166 0.059 1 1363 1936 120 LEU CB C 41.913 0.050 1 1364 1936 120 LEU CG C 27.221 0.141 1 1365 1936 120 LEU CD1 C 23.450 0.083 1 1366 1936 120 LEU CD2 C 24.881 0.007 1 1367 1936 120 LEU N N 121.043 0.037 1 1368 1937 121 GLU H H 7.992 0.012 1 1369 1937 121 GLU HA H 4.039 0.010 1 1370 1937 121 GLU HB2 H 2.087 0.006 1 1371 1937 121 GLU HB3 H 2.087 0.006 1 1372 1937 121 GLU HG2 H 2.327 0.013 1 1373 1937 121 GLU HG3 H 2.330 0.018 1 1374 1937 121 GLU C C 178.416 0.000 1 1375 1937 121 GLU CA C 58.787 0.064 1 1376 1937 121 GLU CB C 29.348 0.140 1 1377 1937 121 GLU CG C 35.829 0.089 1 1378 1937 121 GLU N N 121.222 0.051 1 1379 1938 122 ARG H H 8.017 0.005 1 1380 1938 122 ARG HA H 4.032 0.024 1 1381 1938 122 ARG HB2 H 1.878 0.024 1 1382 1938 122 ARG HB3 H 1.768 0.016 1 1383 1938 122 ARG HG2 H 1.636 0.010 1 1384 1938 122 ARG HG3 H 1.643 0.017 1 1385 1938 122 ARG HD2 H 3.141 0.007 1 1386 1938 122 ARG HD3 H 3.132 0.014 1 1387 1938 122 ARG C C 178.248 0.000 1 1388 1938 122 ARG CA C 58.706 0.153 1 1389 1938 122 ARG CB C 29.809 0.045 1 1390 1938 122 ARG CG C 28.445 0.000 1 1391 1938 122 ARG CD C 43.413 0.041 1 1392 1938 122 ARG N N 120.619 0.066 1 1393 1939 123 LEU H H 7.923 0.006 1 1394 1939 123 LEU HA H 4.051 0.024 1 1395 1939 123 LEU HB2 H 1.579 0.010 1 1396 1939 123 LEU HB3 H 1.787 0.006 1 1397 1939 123 LEU HG H 1.648 0.013 1 1398 1939 123 LEU HD1 H 0.838 0.021 1 1399 1939 123 LEU HD2 H 0.903 0.018 1 1400 1939 123 LEU C C 178.588 0.000 1 1401 1939 123 LEU CA C 57.064 0.007 1 1402 1939 123 LEU CB C 41.930 0.060 1 1403 1939 123 LEU CG C 27.180 0.001 1 1404 1939 123 LEU CD1 C 25.024 0.033 1 1405 1939 123 LEU CD2 C 25.277 0.112 1 1406 1939 123 LEU N N 121.199 0.063 1 1407 1940 124 LYS H H 7.821 0.007 1 1408 1940 124 LYS HA H 3.962 0.010 1 1409 1940 124 LYS HB2 H 1.858 0.018 1 1410 1940 124 LYS HB3 H 1.920 0.007 1 1411 1940 124 LYS HG2 H 1.438 0.001 1 1412 1940 124 LYS HG3 H 1.438 0.001 1 1413 1940 124 LYS HD2 H 1.607 0.001 1 1414 1940 124 LYS HD3 H 1.712 0.014 1 1415 1940 124 LYS HE2 H 2.994 0.001 1 1416 1940 124 LYS HE3 H 2.994 0.001 1 1417 1940 124 LYS C C 178.440 0.000 1 1418 1940 124 LYS CA C 58.953 0.016 1 1419 1940 124 LYS CB C 32.381 0.015 1 1420 1940 124 LYS CG C 25.058 0.000 1 1421 1940 124 LYS CD C 29.508 0.037 1 1422 1940 124 LYS CE C 41.086 0.000 1 1423 1940 124 LYS N N 120.756 0.065 1 1424 1941 125 ILE H H 7.698 0.017 1 1425 1941 125 ILE HA H 3.934 0.018 1 1426 1941 125 ILE HB H 1.944 0.008 1 1427 1941 125 ILE HG12 H 1.254 0.006 1 1428 1941 125 ILE HG13 H 1.612 0.006 1 1429 1941 125 ILE HG2 H 0.922 0.006 1 1430 1941 125 ILE HD1 H 0.855 0.013 1 1431 1941 125 ILE C C 179.373 0.000 1 1432 1941 125 ILE CA C 62.996 0.019 1 1433 1941 125 ILE CB C 38.163 0.071 1 1434 1941 125 ILE CG1 C 28.451 0.019 1 1435 1941 125 ILE CG2 C 17.480 0.000 1 1436 1941 125 ILE CD1 C 12.836 0.059 1 1437 1941 125 ILE N N 120.757 0.091 1 1438 1942 126 LEU H H 8.035 0.005 1 1439 1942 126 LEU HA H 4.078 0.014 1 1440 1942 126 LEU HB2 H 1.629 0.007 1 1441 1942 126 LEU HB3 H 1.772 0.008 1 1442 1942 126 LEU HG H 1.577 0.013 1 1443 1942 126 LEU HD1 H 0.853 0.011 1 1444 1942 126 LEU HD2 H 0.906 0.015 1 1445 1942 126 LEU C C 178.584 0.000 1 1446 1942 126 LEU CA C 57.016 0.042 1 1447 1942 126 LEU CB C 41.995 0.099 1 1448 1942 126 LEU CG C 27.072 0.079 1 1449 1942 126 LEU CD1 C 24.754 0.000 1 1450 1942 126 LEU CD2 C 25.207 0.074 1 1451 1942 126 LEU N N 123.598 0.072 1 1452 1943 127 ARG H H 8.191 0.011 1 1453 1943 127 ARG HA H 4.112 0.004 1 1454 1943 127 ARG HB2 H 1.903 0.020 1 1455 1943 127 ARG HG2 H 1.621 0.002 1 1456 1943 127 ARG HG3 H 1.621 0.002 1 1457 1943 127 ARG HD2 H 3.196 0.004 1 1458 1943 127 ARG HD3 H 3.200 0.004 1 1459 1943 127 ARG C C 177.668 0.000 1 1460 1943 127 ARG CA C 57.897 0.012 1 1461 1943 127 ARG CB C 30.384 0.091 1 1462 1943 127 ARG CG C 27.464 0.000 1 1463 1943 127 ARG CD C 43.322 0.032 1 1464 1943 127 ARG N N 120.082 0.079 1 1465 1944 128 GLN H H 7.970 0.004 1 1466 1944 128 GLN HA H 4.249 0.015 1 1467 1944 128 GLN HB2 H 2.166 0.007 1 1468 1944 128 GLN HB3 H 2.167 0.003 1 1469 1944 128 GLN HG2 H 2.505 0.007 1 1470 1944 128 GLN HG3 H 2.385 0.011 1 1471 1944 128 GLN HE21 H 7.456 0.002 1 1472 1944 128 GLN HE22 H 6.841 0.002 1 1473 1944 128 GLN C C 178.931 0.000 1 1474 1944 128 GLN CA C 57.357 0.022 1 1475 1944 128 GLN CB C 28.979 0.030 1 1476 1944 128 GLN CG C 33.938 0.000 1 1477 1944 128 GLN N N 120.539 0.061 1 1478 1944 128 GLN NE2 N 112.792 0.042 1 1479 1945 129 ARG HA H 4.305 0.000 1 1480 1945 129 ARG HB2 H 1.888 0.010 1 1481 1945 129 ARG C C 177.164 0.000 1 1482 1945 129 ARG CB C 32.344 0.000 1 1483 1946 130 CYS H H 8.230 0.009 1 1484 1946 130 CYS HA H 4.712 0.021 1 1485 1946 130 CYS HB2 H 3.247 0.000 1 1486 1946 130 CYS HB3 H 3.008 0.005 1 1487 1946 130 CYS C C 175.115 0.000 1 1488 1946 130 CYS CA C 55.368 0.004 1 1489 1946 130 CYS CB C 41.078 0.041 1 1490 1946 130 CYS N N 118.481 0.060 1 1491 1947 131 GLY H H 8.226 0.020 1 1492 1947 131 GLY HA2 H 3.973 0.001 1 1493 1947 131 GLY HA3 H 3.973 0.001 1 1494 1947 131 GLY C C 174.163 0.000 1 1495 1947 131 GLY CA C 45.687 0.012 1 1496 1947 131 GLY N N 111.141 0.147 1 1497 1948 132 LEU H H 8.008 0.009 1 1498 1948 132 LEU HA H 4.347 0.019 1 1499 1948 132 LEU HB2 H 1.580 0.015 1 1500 1948 132 LEU HB3 H 1.629 0.019 1 1501 1948 132 LEU HD1 H 0.857 0.009 1 1502 1948 132 LEU HD2 H 0.898 0.017 1 1503 1948 132 LEU C C 177.029 0.000 1 1504 1948 132 LEU CA C 55.169 0.080 1 1505 1948 132 LEU CB C 42.395 0.050 1 1506 1948 132 LEU CD1 C 23.436 0.000 1 1507 1948 132 LEU CD2 C 25.017 0.023 1 1508 1948 132 LEU N N 121.900 0.050 1 1509 1949 133 ASP H H 8.324 0.009 1 1510 1949 133 ASP HA H 4.617 0.007 1 1511 1949 133 ASP HB2 H 2.708 0.001 1 1512 1949 133 ASP HB3 H 2.599 0.013 1 1513 1949 133 ASP C C 176.076 0.000 1 1514 1949 133 ASP CA C 54.122 0.078 1 1515 1949 133 ASP CB C 41.106 0.012 1 1516 1949 133 ASP N N 121.379 0.141 1 1517 1950 134 ASN H H 8.364 0.010 1 1518 1950 134 ASN HA H 4.767 0.008 1 1519 1950 134 ASN HB2 H 2.776 0.017 1 1520 1950 134 ASN HB3 H 2.855 0.014 1 1521 1950 134 ASN HD21 H 7.582 0.002 1 1522 1950 134 ASN HD22 H 6.916 0.002 1 1523 1950 134 ASN C C 175.655 0.000 1 1524 1950 134 ASN CA C 53.293 0.055 1 1525 1950 134 ASN CB C 38.760 0.039 1 1526 1950 134 ASN N N 120.956 0.102 1 1527 1950 134 ASN ND2 N 114.168 0.042 1 1528 1951 135 THR H H 8.178 0.008 1 1529 1951 135 THR HA H 4.302 0.002 1 1530 1951 135 THR HB H 4.242 0.001 1 1531 1951 135 THR HG2 H 1.224 0.023 1 1532 1951 135 THR C C 174.743 0.000 1 1533 1951 135 THR CA C 62.410 0.024 1 1534 1951 135 THR CB C 69.691 0.048 1 1535 1951 135 THR CG2 C 21.727 0.109 1 1536 1951 135 THR N N 115.300 0.127 1 1537 1952 136 LYS H H 8.248 0.007 1 1538 1952 136 LYS HA H 4.346 0.011 1 1539 1952 136 LYS HB2 H 1.859 0.015 1 1540 1952 136 LYS HB3 H 1.769 0.012 1 1541 1952 136 LYS HG2 H 1.400 0.012 1 1542 1952 136 LYS HG3 H 1.400 0.011 1 1543 1952 136 LYS HD2 H 1.675 0.012 1 1544 1952 136 LYS HD3 H 1.671 0.016 1 1545 1952 136 LYS HE2 H 3.011 0.014 1 1546 1952 136 LYS HE3 H 3.003 0.000 1 1547 1952 136 LYS C C 176.419 0.000 1 1548 1952 136 LYS CA C 56.111 0.067 1 1549 1952 136 LYS CB C 32.812 0.016 1 1550 1952 136 LYS CG C 24.580 0.000 1 1551 1952 136 LYS CD C 28.630 0.131 1 1552 1952 136 LYS CE C 42.018 0.088 1 1553 1952 136 LYS N N 124.893 0.145 1 1554 1953 137 GLN H H 8.429 0.006 1 1555 1953 137 GLN HA H 4.309 0.006 1 1556 1953 137 GLN HB2 H 1.976 0.011 1 1557 1953 137 GLN HB3 H 2.101 0.005 1 1558 1953 137 GLN HG2 H 2.358 0.015 1 1559 1953 137 GLN HG3 H 2.353 0.019 1 1560 1953 137 GLN C C 175.691 0.000 1 1561 1953 137 GLN CA C 55.942 0.034 1 1562 1953 137 GLN CB C 29.421 0.040 1 1563 1953 137 GLN CG C 33.883 0.005 1 1564 1953 137 GLN N N 123.460 0.169 1 1565 1954 138 ASP H H 8.371 0.007 1 1566 1954 138 ASP HA H 4.586 0.013 1 1567 1954 138 ASP HB2 H 2.616 0.011 1 1568 1954 138 ASP HB3 H 2.708 0.015 1 1569 1954 138 ASP C C 175.749 0.000 1 1570 1954 138 ASP CA C 54.290 0.066 1 1571 1954 138 ASP CB C 41.097 0.042 1 1572 1954 138 ASP N N 122.732 0.080 1 1573 1955 139 ASP H H 8.269 0.006 1 1574 1955 139 ASP HA H 4.589 0.014 1 1575 1955 139 ASP HB2 H 2.625 0.006 1 1576 1955 139 ASP HB3 H 2.625 0.006 1 1577 1955 139 ASP C C 175.762 0.000 1 1578 1955 139 ASP CA C 54.190 0.014 1 1579 1955 139 ASP CB C 41.038 0.045 1 1580 1955 139 ASP N N 121.859 0.065 1 1581 1956 140 ARG H H 8.062 0.008 1 1582 1956 140 ARG HA H 4.610 0.010 1 1583 1956 140 ARG HB2 H 1.878 0.009 1 1584 1956 140 ARG HB3 H 1.775 0.009 1 1585 1956 140 ARG HG2 H 1.681 0.007 1 1586 1956 140 ARG HG3 H 1.678 0.003 1 1587 1956 140 ARG HD2 H 3.222 0.000 1 1588 1956 140 ARG HD3 H 3.222 0.000 1 1589 1956 140 ARG CA C 53.897 0.044 1 1590 1956 140 ARG CB C 30.177 0.043 1 1591 1956 140 ARG CG C 27.040 0.017 1 1592 1956 140 ARG CD C 42.922 0.000 1 1593 1956 140 ARG N N 123.526 0.120 1 1594 1957 141 PRO HA H 4.240 0.003 1 1595 1957 141 PRO HB2 H 2.223 0.002 1 1596 1957 141 PRO HB3 H 2.224 0.003 1 1597 1957 141 PRO HG2 H 1.995 0.014 1 1598 1957 141 PRO HG3 H 1.995 0.014 1 1599 1957 141 PRO HD2 H 3.619 0.002 1 1600 1957 141 PRO HD3 H 3.735 0.003 1 1601 1957 141 PRO CA C 64.790 0.081 1 1602 1957 141 PRO CB C 32.126 0.000 1 1603 1957 141 PRO CG C 27.265 0.000 1 1604 1957 141 PRO CD C 50.308 0.010 1 stop_ save_