data_7167 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 15N, 13C resonance assignments for regeneration-induced CNPase homolog (RICH) protein ; _BMRB_accession_number 7167 _BMRB_flat_file_name bmr7167.str _Entry_type original _Submission_date 2006-06-14 _Accession_date 2006-06-14 _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 Denisov Alexey . . 2 Kozlov Guennadi . . 3 Gehring Kalle . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 847 "13C chemical shifts" 633 "15N chemical shifts" 212 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2006-11-30 update author 'update citation' 2006-10-02 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title '1H, 13C and 15N resonance assignments of the catalytic domain of the goldfish RICH protein' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 17031527 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Denisov Alexey . . 2 Kozlov Guennadi . . 3 Gravel Michel . . 4 Sprules Tara . . 5 Braun Peter . . 6 Gehring Kalle . . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_volume 36 _Journal_issue 'suppl 5' _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 75 _Page_last 75 _Year 2006 _Details . loop_ _Keyword 'central nervous system' CNPase NMR 'RICH protein' RNA stop_ save_ ####################################### # Cited references within the entry # ####################################### save_citation_2 _Saveframe_category citation _Citation_full . _Citation_title 'Solution structure of regeneration-induced homolog (RICH)' _Citation_status submitted _Citation_type abstract _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Denisov Alexey . . 2 Kozlov Guennadi . . 3 Gravel Michel . . 4 Braun Peter . . 5 Gehring Kalle . . stop_ _Journal_abbreviation . _Journal_name_full . _Journal_volume . _Journal_issue . _Journal_CSD . _Book_title . _Book_chapter_title . _Book_volume . _Book_series . _Book_publisher . _Book_publisher_city . _Book_ISBN . _Conference_title 'Ribo-Club Opening Session' _Conference_site Orford _Conference_state_province Quebec _Conference_country Canada _Conference_start_date 2006-09-25 _Conference_end_date 2006-09-25 _Conference_abstract_number n/a _Thesis_institution . _Thesis_institution_city . _Thesis_institution_country . _Page_first . _Page_last . _Year 2006 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'RICH protein' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'RICH protein' $RICH_protein stop_ _System_molecular_weight 25000 _System_physical_state native _System_oligomer_state protein _System_paramagnetic no _System_thiol_state 'all free' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_RICH_protein _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'RICH protein' _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 222 _Mol_residue_sequence ; GSHMELPLFFGWFLLPEEEE RIKCATMDFLKTLDTLEAFK EHISEFTGEAEKEVDLEQYF QNPLQLHCTTKFCDYGKAEG AKEYAELQVVKESLTKSYEL SVTALIVTPRTFGARVALTE AQVKLWPEGADKEGVAPALL PSVEALPAGSRAHVTLGCSA GVETVQTGLDLLEILALQKE GKEGTQVEMDLGTLTYLSEG RWFLALREPINADTTFTSFS ED ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 SER 3 HIS 4 MET 5 GLU 6 LEU 7 PRO 8 LEU 9 PHE 10 PHE 11 GLY 12 TRP 13 PHE 14 LEU 15 LEU 16 PRO 17 GLU 18 GLU 19 GLU 20 GLU 21 ARG 22 ILE 23 LYS 24 CYS 25 ALA 26 THR 27 MET 28 ASP 29 PHE 30 LEU 31 LYS 32 THR 33 LEU 34 ASP 35 THR 36 LEU 37 GLU 38 ALA 39 PHE 40 LYS 41 GLU 42 HIS 43 ILE 44 SER 45 GLU 46 PHE 47 THR 48 GLY 49 GLU 50 ALA 51 GLU 52 LYS 53 GLU 54 VAL 55 ASP 56 LEU 57 GLU 58 GLN 59 TYR 60 PHE 61 GLN 62 ASN 63 PRO 64 LEU 65 GLN 66 LEU 67 HIS 68 CYS 69 THR 70 THR 71 LYS 72 PHE 73 CYS 74 ASP 75 TYR 76 GLY 77 LYS 78 ALA 79 GLU 80 GLY 81 ALA 82 LYS 83 GLU 84 TYR 85 ALA 86 GLU 87 LEU 88 GLN 89 VAL 90 VAL 91 LYS 92 GLU 93 SER 94 LEU 95 THR 96 LYS 97 SER 98 TYR 99 GLU 100 LEU 101 SER 102 VAL 103 THR 104 ALA 105 LEU 106 ILE 107 VAL 108 THR 109 PRO 110 ARG 111 THR 112 PHE 113 GLY 114 ALA 115 ARG 116 VAL 117 ALA 118 LEU 119 THR 120 GLU 121 ALA 122 GLN 123 VAL 124 LYS 125 LEU 126 TRP 127 PRO 128 GLU 129 GLY 130 ALA 131 ASP 132 LYS 133 GLU 134 GLY 135 VAL 136 ALA 137 PRO 138 ALA 139 LEU 140 LEU 141 PRO 142 SER 143 VAL 144 GLU 145 ALA 146 LEU 147 PRO 148 ALA 149 GLY 150 SER 151 ARG 152 ALA 153 HIS 154 VAL 155 THR 156 LEU 157 GLY 158 CYS 159 SER 160 ALA 161 GLY 162 VAL 163 GLU 164 THR 165 VAL 166 GLN 167 THR 168 GLY 169 LEU 170 ASP 171 LEU 172 LEU 173 GLU 174 ILE 175 LEU 176 ALA 177 LEU 178 GLN 179 LYS 180 GLU 181 GLY 182 LYS 183 GLU 184 GLY 185 THR 186 GLN 187 VAL 188 GLU 189 MET 190 ASP 191 LEU 192 GLY 193 THR 194 LEU 195 THR 196 TYR 197 LEU 198 SER 199 GLU 200 GLY 201 ARG 202 TRP 203 PHE 204 LEU 205 ALA 206 LEU 207 ARG 208 GLU 209 PRO 210 ILE 211 ASN 212 ALA 213 ASP 214 THR 215 THR 216 PHE 217 THR 218 SER 219 PHE 220 SER 221 GLU 222 ASP stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 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 2I3E "Solution Structure Of Catalytic Domain Of Goldfish Rich Protein" 100.00 222 100.00 100.00 6.61e-158 GB AAA84448 "g-RICH [Carassius auratus]" 98.20 411 100.00 100.00 7.10e-156 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $RICH_protein Goldfish 7957 Eukaryota Metazoa Carassius auratus stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $RICH_protein 'recombinant technology' 'E. coli' Escherichia coli BL21 plasmid pET15b stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '10%/90% D2O/H2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $RICH_protein 1 mM '[U-99% 13C; U-99% 15N]' 'MES buffer' 50 mM . NaCl 150 mM . D2O 10 % . H2O 90 % . stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name XEASY _Version 1.3.13 _Details . save_ save_software_2 _Saveframe_category software _Name NMRPipe _Version . _Details 'F.Delaglio et al.' save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_800MHz_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model 'Unity Inova' _Field_strength 800 _Details . save_ save_600MHz_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name HSQC _Sample_label $sample_1 save_ save_HNCACB_2 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label $sample_1 save_ save_3D-NOESY-HSQC_3 _Saveframe_category NMR_applied_experiment _Experiment_name 3D-NOESY-HSQC _Sample_label $sample_1 save_ save_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label $sample_1 save_ save_HNCO_5 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _Sample_label $sample_1 save_ save_CBCACOHN_6 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACOHN _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.0 0.1 pH temperature 307 0.5 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0.0 . 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_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label HSQC stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name 'RICH protein' _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 3 3 HIS C C 175.0 0.20 1 2 3 3 HIS CA C 55.7 0.20 1 3 3 3 HIS CB C 29.8 0.20 1 4 4 4 MET H H 8.28 0.01 1 5 4 4 MET HA H 4.40 0.01 1 6 4 4 MET HB2 H 1.99 0.01 2 7 4 4 MET HB3 H 1.88 0.01 2 8 4 4 MET HG2 H 2.36 0.01 2 9 4 4 MET C C 176.3 0.20 1 10 4 4 MET CA C 55.1 0.20 1 11 4 4 MET CB C 33.0 0.20 1 12 4 4 MET N N 121.6 0.25 1 13 5 5 GLU H H 8.42 0.01 1 14 5 5 GLU HA H 4.13 0.01 1 15 5 5 GLU HB2 H 2.21 0.01 2 16 5 5 GLU HB3 H 1.98 0.01 2 17 5 5 GLU HG2 H 1.85 0.01 2 18 5 5 GLU C C 176.6 0.20 1 19 5 5 GLU CA C 56.7 0.20 1 20 5 5 GLU CB C 30.1 0.20 1 21 5 5 GLU N N 122.1 0.25 1 22 6 6 LEU H H 7.97 0.01 1 23 6 6 LEU HA H 4.57 0.01 1 24 6 6 LEU HB2 H 1.63 0.01 2 25 6 6 LEU HG H 1.37 0.01 1 26 6 6 LEU HD1 H 0.99 0.01 2 27 6 6 LEU HD2 H 0.85 0.01 2 28 6 6 LEU CA C 51.6 0.20 1 29 6 6 LEU CB C 42.7 0.20 1 30 6 6 LEU N N 122.1 0.25 1 31 7 7 PRO HA H 4.61 0.01 1 32 7 7 PRO C C 176.3 0.20 1 33 7 7 PRO CA C 61.7 0.20 1 34 7 7 PRO CB C 31.7 0.20 1 35 8 8 LEU H H 8.42 0.01 1 36 8 8 LEU HA H 3.14 0.01 1 37 8 8 LEU HB2 H 1.87 0.01 2 38 8 8 LEU HB3 H 1.60 0.01 2 39 8 8 LEU HG H 1.44 0.01 1 40 8 8 LEU HD1 H 0.45 0.01 2 41 8 8 LEU C C 179.6 0.20 1 42 8 8 LEU CA C 58.8 0.20 1 43 8 8 LEU CB C 41.2 0.20 1 44 8 8 LEU N N 120.7 0.25 1 45 9 9 PHE H H 7.34 0.01 1 46 9 9 PHE HA H 4.84 0.01 1 47 9 9 PHE HB2 H 3.38 0.01 2 48 9 9 PHE HB3 H 3.22 0.01 2 49 9 9 PHE C C 172.5 0.20 1 50 9 9 PHE CA C 56.8 0.20 1 51 9 9 PHE CB C 41.1 0.20 1 52 9 9 PHE N N 108.5 0.25 1 53 10 10 PHE H H 8.28 0.01 1 54 10 10 PHE HA H 5.08 0.01 1 55 10 10 PHE HB2 H 3.03 0.01 2 56 10 10 PHE HB3 H 2.69 0.01 2 57 10 10 PHE C C 176.3 0.20 1 58 10 10 PHE CA C 56.9 0.20 1 59 10 10 PHE CB C 44.2 0.20 1 60 10 10 PHE N N 116.7 0.25 1 61 11 11 GLY H H 8.54 0.01 1 62 11 11 GLY HA2 H 4.36 0.01 2 63 11 11 GLY HA3 H 4.14 0.01 2 64 11 11 GLY C C 170.8 0.20 1 65 11 11 GLY CA C 46.3 0.20 1 66 11 11 GLY N N 105.6 0.25 1 67 12 12 TRP H H 9.04 0.01 1 68 12 12 TRP HA H 5.44 0.01 1 69 12 12 TRP HB2 H 3.29 0.01 2 70 12 12 TRP HB3 H 3.03 0.01 2 71 12 12 TRP HE1 H 10.08 0.01 1 72 12 12 TRP C C 177.3 0.20 1 73 12 12 TRP CA C 59.4 0.20 1 74 12 12 TRP CB C 29.8 0.20 1 75 12 12 TRP N N 119.2 0.25 1 76 12 12 TRP NE1 N 129.4 0.25 1 77 13 13 PHE H H 9.74 0.01 1 78 13 13 PHE HA H 4.67 0.01 1 79 13 13 PHE HB2 H 3.04 0.01 2 80 13 13 PHE C C 176.6 0.20 1 81 13 13 PHE CA C 57.5 0.20 1 82 13 13 PHE CB C 40.1 0.20 1 83 13 13 PHE N N 124.6 0.25 1 84 14 14 LEU H H 7.96 0.01 1 85 14 14 LEU HA H 4.37 0.01 1 86 14 14 LEU HB2 H 1.81 0.01 2 87 14 14 LEU HG H 1.49 0.01 1 88 14 14 LEU HD1 H 1.02 0.01 2 89 14 14 LEU HD2 H 0.59 0.01 2 90 14 14 LEU C C 174.5 0.20 1 91 14 14 LEU CA C 57.9 0.20 1 92 14 14 LEU CB C 41.6 0.20 1 93 14 14 LEU N N 126.5 0.25 1 94 15 15 LEU H H 7.68 0.01 1 95 15 15 LEU HA H 4.55 0.01 1 96 15 15 LEU HB2 H 1.71 0.01 2 97 15 15 LEU HG H 1.43 0.01 1 98 15 15 LEU HD1 H 1.02 0.01 2 99 15 15 LEU CA C 54.2 0.20 1 100 15 15 LEU CB C 40.4 0.20 1 101 15 15 LEU N N 122.6 0.25 1 102 16 16 PRO HA H 4.57 0.01 1 103 16 16 PRO C C 180.3 0.20 1 104 16 16 PRO CA C 66.7 0.20 1 105 16 16 PRO CB C 31.8 0.20 1 106 17 17 GLU H H 9.79 0.01 1 107 17 17 GLU HA H 4.20 0.01 1 108 17 17 GLU HB2 H 2.13 0.01 2 109 17 17 GLU HG2 H 2.05 0.01 2 110 17 17 GLU C C 180.2 0.20 1 111 17 17 GLU CA C 59.5 0.20 1 112 17 17 GLU CB C 28.7 0.20 1 113 17 17 GLU N N 117.2 0.25 1 114 18 18 GLU H H 7.37 0.01 1 115 18 18 GLU HA H 4.64 0.01 1 116 18 18 GLU HB2 H 2.44 0.01 2 117 18 18 GLU HG2 H 2.05 0.01 2 118 18 18 GLU C C 179.2 0.20 1 119 18 18 GLU CA C 57.0 0.20 1 120 18 18 GLU CB C 30.5 0.20 1 121 18 18 GLU N N 119.7 0.25 1 122 19 19 GLU H H 8.61 0.01 1 123 19 19 GLU HA H 3.75 0.01 1 124 19 19 GLU HB2 H 2.19 0.01 2 125 19 19 GLU HG2 H 1.84 0.01 2 126 19 19 GLU C C 178.6 0.20 1 127 19 19 GLU CA C 60.1 0.20 1 128 19 19 GLU CB C 29.7 0.20 1 129 19 19 GLU N N 120.2 0.25 1 130 20 20 GLU H H 7.71 0.01 1 131 20 20 GLU HA H 4.02 0.01 1 132 20 20 GLU HB2 H 2.11 0.01 2 133 20 20 GLU HG2 H 1.99 0.01 2 134 20 20 GLU C C 178.9 0.20 1 135 20 20 GLU CA C 59.7 0.20 1 136 20 20 GLU CB C 29.4 0.20 1 137 20 20 GLU N N 117.2 0.25 1 138 21 21 ARG H H 7.51 0.01 1 139 21 21 ARG HA H 4.11 0.01 1 140 21 21 ARG C C 180.1 0.20 1 141 21 21 ARG CA C 59.6 0.20 1 142 21 21 ARG CB C 30.6 0.20 1 143 21 21 ARG N N 119.3 0.25 1 144 22 22 ILE H H 8.55 0.01 1 145 22 22 ILE HA H 3.79 0.01 1 146 22 22 ILE HB H 1.85 0.01 1 147 22 22 ILE HG12 H 1.30 0.01 2 148 22 22 ILE HD1 H 0.61 0.01 1 149 22 22 ILE C C 179.8 0.20 1 150 22 22 ILE CA C 63.9 0.20 1 151 22 22 ILE CB C 36.5 0.20 1 152 22 22 ILE N N 120.2 0.25 1 153 23 23 LYS H H 8.84 0.01 1 154 23 23 LYS HA H 3.89 0.01 1 155 23 23 LYS HB2 H 1.92 0.01 2 156 23 23 LYS HG2 H 1.71 0.01 2 157 23 23 LYS C C 178.7 0.20 1 158 23 23 LYS CA C 60.8 0.20 1 159 23 23 LYS CB C 31.8 0.20 1 160 23 23 LYS N N 124.6 0.25 1 161 24 24 CYS H H 7.87 0.01 1 162 24 24 CYS HA H 4.13 0.01 1 163 24 24 CYS HB2 H 3.01 0.01 2 164 24 24 CYS C C 176.6 0.20 1 165 24 24 CYS CA C 63.3 0.20 1 166 24 24 CYS CB C 26.4 0.20 1 167 24 24 CYS N N 116.8 0.25 1 168 25 25 ALA H H 7.75 0.01 1 169 25 25 ALA HA H 4.31 0.01 1 170 25 25 ALA HB H 1.46 0.01 1 171 25 25 ALA C C 181.6 0.20 1 172 25 25 ALA CA C 55.0 0.20 1 173 25 25 ALA CB C 18.2 0.20 1 174 25 25 ALA N N 119.7 0.25 1 175 26 26 THR H H 8.41 0.01 1 176 26 26 THR HA H 4.10 0.01 1 177 26 26 THR HB H 4.43 0.01 1 178 26 26 THR HG2 H 1.13 0.01 1 179 26 26 THR C C 178.0 0.20 1 180 26 26 THR CA C 65.4 0.20 1 181 26 26 THR CB C 68.8 0.20 1 182 26 26 THR N N 108.0 0.25 1 183 27 27 MET H H 8.54 0.01 1 184 27 27 MET HA H 4.51 0.01 1 185 27 27 MET C C 179.3 0.20 1 186 27 27 MET CA C 57.8 0.20 1 187 27 27 MET CB C 30.6 0.20 1 188 27 27 MET N N 124.1 0.25 1 189 28 28 ASP H H 7.62 0.01 1 190 28 28 ASP HA H 4.40 0.01 1 191 28 28 ASP HB2 H 2.81 0.01 2 192 28 28 ASP HB3 H 2.63 0.01 2 193 28 28 ASP C C 179.8 0.20 1 194 28 28 ASP CA C 57.7 0.20 1 195 28 28 ASP CB C 40.7 0.20 1 196 28 28 ASP N N 119.2 0.25 1 197 29 29 PHE H H 7.36 0.01 1 198 29 29 PHE HA H 4.36 0.01 1 199 29 29 PHE HB2 H 3.24 0.01 2 200 29 29 PHE HB3 H 3.05 0.01 2 201 29 29 PHE C C 176.7 0.20 1 202 29 29 PHE CA C 60.2 0.20 1 203 29 29 PHE CB C 37.7 0.20 1 204 29 29 PHE N N 119.2 0.25 1 205 30 30 LEU H H 7.67 0.01 1 206 30 30 LEU HA H 3.04 0.01 1 207 30 30 LEU HB2 H 1.84 0.01 2 208 30 30 LEU HB3 H 1.51 0.01 2 209 30 30 LEU HG H 1.10 0.01 1 210 30 30 LEU HD1 H 0.55 0.01 2 211 30 30 LEU HD2 H -0.05 0.01 2 212 30 30 LEU C C 178.9 0.20 1 213 30 30 LEU CA C 57.8 0.20 1 214 30 30 LEU CB C 41.1 0.20 1 215 30 30 LEU N N 120.2 0.25 1 216 31 31 LYS H H 7.78 0.01 1 217 31 31 LYS HA H 3.80 0.01 1 218 31 31 LYS HB2 H 1.80 0.01 2 219 31 31 LYS C C 179.5 0.20 1 220 31 31 LYS CA C 58.7 0.20 1 221 31 31 LYS CB C 31.8 0.20 1 222 31 31 LYS N N 115.4 0.25 1 223 32 32 THR H H 7.50 0.01 1 224 32 32 THR HA H 3.76 0.01 1 225 32 32 THR HB H 4.07 0.01 1 226 32 32 THR HG2 H 1.06 0.01 1 227 32 32 THR C C 177.2 0.20 1 228 32 32 THR CA C 65.7 0.20 1 229 32 32 THR CB C 68.5 0.20 1 230 32 32 THR N N 115.8 0.25 1 231 33 33 LEU H H 8.13 0.01 1 232 33 33 LEU HA H 3.24 0.01 1 233 33 33 LEU HD1 H -0.08 0.01 2 234 33 33 LEU HD2 H -0.18 0.01 2 235 33 33 LEU C C 177.0 0.20 1 236 33 33 LEU CA C 57.5 0.20 1 237 33 33 LEU CB C 40.6 0.20 1 238 33 33 LEU N N 124.5 0.25 1 239 34 34 ASP H H 7.11 0.01 1 240 34 34 ASP HA H 3.72 0.01 1 241 34 34 ASP HB2 H 2.66 0.01 2 242 34 34 ASP HB3 H 2.38 0.01 2 243 34 34 ASP C C 176.9 0.20 1 244 34 34 ASP CA C 55.5 0.20 1 245 34 34 ASP CB C 40.8 0.20 1 246 34 34 ASP N N 111.0 0.25 1 247 35 35 THR H H 6.96 0.01 1 248 35 35 THR HA H 4.28 0.01 1 249 35 35 THR HB H 4.37 0.01 1 250 35 35 THR HG2 H 1.19 0.01 1 251 35 35 THR C C 175.3 0.20 1 252 35 35 THR CA C 60.6 0.20 1 253 35 35 THR CB C 70.2 0.20 1 254 35 35 THR N N 103.6 0.25 1 255 36 36 LEU H H 7.45 0.01 1 256 36 36 LEU HA H 4.23 0.01 1 257 36 36 LEU HB2 H 1.74 0.01 2 258 36 36 LEU HG H 1.66 0.01 1 259 36 36 LEU HD1 H 0.83 0.01 2 260 36 36 LEU C C 179.0 0.20 1 261 36 36 LEU CA C 54.9 0.20 1 262 36 36 LEU CB C 42.7 0.20 1 263 36 36 LEU N N 125.5 0.25 1 264 37 37 GLU H H 9.25 0.01 1 265 37 37 GLU HA H 3.86 0.01 1 266 37 37 GLU HB2 H 2.08 0.01 2 267 37 37 GLU HG2 H 1.75 0.01 2 268 37 37 GLU C C 179.3 0.20 1 269 37 37 GLU CA C 60.6 0.20 1 270 37 37 GLU CB C 28.8 0.20 1 271 37 37 GLU N N 129.5 0.25 1 272 38 38 ALA H H 8.69 0.01 1 273 38 38 ALA HA H 4.23 0.01 1 274 38 38 ALA HB H 1.47 0.01 1 275 38 38 ALA C C 179.7 0.20 1 276 38 38 ALA CA C 54.8 0.20 1 277 38 38 ALA CB C 18.4 0.20 1 278 38 38 ALA N N 118.3 0.25 1 279 39 39 PHE H H 6.82 0.01 1 280 39 39 PHE HA H 4.07 0.01 1 281 39 39 PHE HB2 H 3.10 0.01 2 282 39 39 PHE C C 180.0 0.20 1 283 39 39 PHE CA C 60.8 0.20 1 284 39 39 PHE CB C 40.6 0.20 1 285 39 39 PHE N N 115.4 0.25 1 286 40 40 LYS H H 8.17 0.01 1 287 40 40 LYS HA H 3.71 0.01 1 288 40 40 LYS HB2 H 1.80 0.01 2 289 40 40 LYS HB3 H 1.62 0.01 2 290 40 40 LYS HG2 H 1.46 0.01 2 291 40 40 LYS C C 180.1 0.20 1 292 40 40 LYS CA C 59.5 0.20 1 293 40 40 LYS CB C 31.5 0.20 1 294 40 40 LYS N N 121.2 0.25 1 295 41 41 GLU H H 8.21 0.01 1 296 41 41 GLU HA H 3.89 0.01 1 297 41 41 GLU HB2 H 2.09 0.01 2 298 41 41 GLU HG2 H 1.88 0.01 2 299 41 41 GLU C C 177.7 0.20 1 300 41 41 GLU CA C 58.2 0.20 1 301 41 41 GLU CB C 29.8 0.20 1 302 41 41 GLU N N 117.3 0.25 1 303 42 42 HIS H H 6.98 0.01 1 304 42 42 HIS HA H 4.95 0.01 1 305 42 42 HIS HB2 H 3.63 0.01 2 306 42 42 HIS HB3 H 2.56 0.01 2 307 42 42 HIS C C 175.9 0.20 1 308 42 42 HIS CA C 54.6 0.20 1 309 42 42 HIS CB C 29.2 0.20 1 310 42 42 HIS N N 113.3 0.25 1 311 43 43 ILE H H 7.08 0.01 1 312 43 43 ILE HA H 4.06 0.01 1 313 43 43 ILE HB H 1.80 0.01 1 314 43 43 ILE HG12 H 1.30 0.01 2 315 43 43 ILE HG2 H 0.95 0.01 1 316 43 43 ILE HD1 H 0.69 0.01 1 317 43 43 ILE C C 177.8 0.20 1 318 43 43 ILE CA C 62.9 0.20 1 319 43 43 ILE CB C 39.3 0.20 1 320 43 43 ILE N N 123.1 0.25 1 321 44 44 SER H H 8.73 0.01 1 322 44 44 SER HA H 4.33 0.01 1 323 44 44 SER HB2 H 3.79 0.01 2 324 44 44 SER CA C 61.1 0.20 1 325 44 44 SER CB C 62.1 0.20 1 326 44 44 SER N N 118.8 0.25 1 327 45 45 GLU HA H 4.06 0.01 1 328 45 45 GLU C C 176.3 0.20 1 329 45 45 GLU CA C 57.4 0.20 1 330 45 45 GLU CB C 28.8 0.20 1 331 45 45 GLU N N 119.7 0.25 1 332 46 46 PHE H H 8.05 0.01 1 333 46 46 PHE HA H 4.31 0.01 1 334 46 46 PHE HB2 H 3.18 0.01 2 335 46 46 PHE HB3 H 2.91 0.01 2 336 46 46 PHE C C 176.7 0.20 1 337 46 46 PHE CA C 60.2 0.20 1 338 46 46 PHE CB C 41.0 0.20 1 339 46 46 PHE N N 119.6 0.25 1 340 47 47 THR H H 8.12 0.01 1 341 47 47 THR HA H 4.33 0.01 1 342 47 47 THR HG2 H 1.16 0.01 1 343 47 47 THR C C 176.7 0.20 1 344 47 47 THR CA C 61.7 0.20 1 345 47 47 THR CB C 70.4 0.20 1 346 47 47 THR N N 107.0 0.25 1 347 48 48 GLY H H 7.91 0.01 1 348 48 48 GLY HA2 H 4.10 0.01 2 349 48 48 GLY HA3 H 3.87 0.01 2 350 48 48 GLY C C 174.8 0.20 1 351 48 48 GLY CA C 45.7 0.20 1 352 48 48 GLY N N 110.9 0.25 1 353 49 49 GLU H H 8.17 0.01 1 354 49 49 GLU HA H 4.37 0.01 1 355 49 49 GLU HB2 H 2.17 0.01 2 356 49 49 GLU HB3 H 2.04 0.01 2 357 49 49 GLU HG2 H 1.81 0.01 2 358 49 49 GLU C C 176.2 0.20 1 359 49 49 GLU CA C 55.9 0.20 1 360 49 49 GLU CB C 31.5 0.20 1 361 49 49 GLU N N 119.7 0.25 1 362 50 50 ALA H H 8.30 0.01 1 363 50 50 ALA HA H 4.13 0.01 1 364 50 50 ALA HB H 1.39 0.01 1 365 50 50 ALA C C 178.5 0.20 1 366 50 50 ALA CA C 53.2 0.20 1 367 50 50 ALA CB C 19.1 0.20 1 368 50 50 ALA N N 124.0 0.25 1 369 51 51 GLU H H 8.22 0.01 1 370 51 51 GLU HA H 4.15 0.01 1 371 51 51 GLU HB2 H 2.13 0.01 2 372 51 51 GLU HG2 H 1.92 0.01 2 373 51 51 GLU C C 176.2 0.20 1 374 51 51 GLU CA C 56.5 0.20 1 375 51 51 GLU CB C 29.5 0.20 1 376 51 51 GLU N N 116.2 0.25 1 377 52 52 LYS H H 7.62 0.01 1 378 52 52 LYS HA H 4.16 0.01 1 379 52 52 LYS HB2 H 2.18 0.01 2 380 52 52 LYS HB3 H 1.90 0.01 2 381 52 52 LYS HG2 H 1.62 0.01 2 382 52 52 LYS C C 176.2 0.20 1 383 52 52 LYS CA C 56.6 0.20 1 384 52 52 LYS CB C 34.0 0.20 1 385 52 52 LYS N N 120.6 0.25 1 386 53 53 GLU H H 8.20 0.01 1 387 53 53 GLU HA H 4.30 0.01 1 388 53 53 GLU HB2 H 2.16 0.01 2 389 53 53 GLU HG2 H 1.91 0.01 2 390 53 53 GLU C C 176.2 0.20 1 391 53 53 GLU CA C 55.7 0.20 1 392 53 53 GLU CB C 31.1 0.20 1 393 53 53 GLU N N 122.6 0.25 1 394 54 54 VAL H H 8.10 0.01 1 395 54 54 VAL HA H 4.13 0.01 1 396 54 54 VAL HB H 1.80 0.01 1 397 54 54 VAL HG1 H 0.71 0.01 2 398 54 54 VAL HG2 H 0.59 0.01 2 399 54 54 VAL C C 174.0 0.20 1 400 54 54 VAL CA C 61.0 0.20 1 401 54 54 VAL CB C 34.4 0.20 1 402 54 54 VAL N N 120.2 0.25 1 403 55 55 ASP H H 8.27 0.01 1 404 55 55 ASP HA H 4.71 0.01 1 405 55 55 ASP HB2 H 2.76 0.01 2 406 55 55 ASP HB3 H 2.45 0.01 2 407 55 55 ASP C C 178.3 0.20 1 408 55 55 ASP CA C 52.1 0.20 1 409 55 55 ASP CB C 40.6 0.20 1 410 55 55 ASP N N 125.6 0.25 1 411 56 56 LEU H H 8.90 0.01 1 412 56 56 LEU C C 176.4 0.20 1 413 56 56 LEU CA C 57.4 0.20 1 414 56 56 LEU CB C 42.2 0.20 1 415 56 56 LEU N N 126.0 0.25 1 416 57 57 GLU H H 8.56 0.01 1 417 57 57 GLU HA H 3.96 0.01 1 418 57 57 GLU HB2 H 2.08 0.01 2 419 57 57 GLU HG2 H 2.01 0.01 2 420 57 57 GLU C C 177.7 0.20 1 421 57 57 GLU CA C 59.3 0.20 1 422 57 57 GLU CB C 29.7 0.20 1 423 57 57 GLU N N 116.3 0.25 1 424 58 58 GLN H H 7.22 0.01 1 425 58 58 GLN HA H 4.44 0.01 1 426 58 58 GLN HB2 H 2.02 0.01 2 427 58 58 GLN HB3 H 1.82 0.01 2 428 58 58 GLN HG2 H 2.43 0.01 2 429 58 58 GLN HG3 H 2.22 0.01 2 430 58 58 GLN C C 176.8 0.20 1 431 58 58 GLN CA C 55.1 0.20 1 432 58 58 GLN CB C 29.6 0.20 1 433 58 58 GLN N N 114.3 0.25 1 434 59 59 TYR H H 7.70 0.01 1 435 59 59 TYR HA H 3.89 0.01 1 436 59 59 TYR HB2 H 2.88 0.01 2 437 59 59 TYR C C 175.6 0.20 1 438 59 59 TYR CA C 61.1 0.20 1 439 59 59 TYR CB C 41.4 0.20 1 440 59 59 TYR N N 122.0 0.25 1 441 60 60 PHE H H 7.61 0.01 1 442 60 60 PHE HA H 4.41 0.01 1 443 60 60 PHE HB2 H 3.04 0.01 2 444 60 60 PHE HB3 H 2.68 0.01 2 445 60 60 PHE C C 175.7 0.20 1 446 60 60 PHE CA C 56.6 0.20 1 447 60 60 PHE CB C 40.4 0.20 1 448 60 60 PHE N N 112.9 0.25 1 449 61 61 GLN H H 8.55 0.01 1 450 61 61 GLN HA H 4.57 0.01 1 451 61 61 GLN HB2 H 2.08 0.01 2 452 61 61 GLN HG2 H 2.35 0.01 2 453 61 61 GLN C C 177.3 0.20 1 454 61 61 GLN CA C 54.5 0.20 1 455 61 61 GLN CB C 30.4 0.20 1 456 61 61 GLN N N 119.7 0.25 1 457 62 62 ASN H H 9.00 0.01 1 458 62 62 ASN HA H 5.20 0.01 1 459 62 62 ASN HB2 H 2.97 0.01 2 460 62 62 ASN HB3 H 2.73 0.01 2 461 62 62 ASN CA C 51.4 0.20 1 462 62 62 ASN CB C 40.0 0.20 1 463 62 62 ASN N N 122.6 0.25 1 464 63 63 PRO HA H 4.64 0.01 1 465 63 63 PRO C C 176.6 0.20 1 466 63 63 PRO CA C 62.7 0.20 1 467 63 63 PRO CB C 32.5 0.20 1 468 64 64 LEU H H 7.97 0.01 1 469 64 64 LEU HA H 4.38 0.01 1 470 64 64 LEU HB2 H 1.78 0.01 2 471 64 64 LEU HG H 1.63 0.01 1 472 64 64 LEU HD1 H 0.88 0.01 2 473 64 64 LEU C C 177.7 0.20 1 474 64 64 LEU CA C 55.6 0.20 1 475 64 64 LEU CB C 43.9 0.20 1 476 64 64 LEU N N 119.7 0.25 1 477 65 65 GLN H H 8.21 0.01 1 478 65 65 GLN HA H 4.18 0.01 1 479 65 65 GLN HB2 H 1.84 0.01 2 480 65 65 GLN HG2 H 2.08 0.01 2 481 65 65 GLN C C 176.4 0.20 1 482 65 65 GLN CA C 55.4 0.20 1 483 65 65 GLN CB C 30.0 0.20 1 484 65 65 GLN N N 117.7 0.25 1 485 66 66 LEU H H 9.26 0.01 1 486 66 66 LEU HA H 4.62 0.01 1 487 66 66 LEU HB2 H 1.82 0.01 2 488 66 66 LEU HD1 H 0.96 0.01 2 489 66 66 LEU HD2 H 0.81 0.01 2 490 66 66 LEU C C 177.2 0.20 1 491 66 66 LEU CA C 55.0 0.20 1 492 66 66 LEU CB C 42.7 0.20 1 493 66 66 LEU N N 124.0 0.25 1 494 67 67 HIS H H 8.05 0.01 1 495 67 67 HIS HA H 5.13 0.01 1 496 67 67 HIS HB2 H 2.19 0.01 2 497 67 67 HIS HB3 H 1.71 0.01 2 498 67 67 HIS C C 171.7 0.20 1 499 67 67 HIS CA C 54.0 0.20 1 500 67 67 HIS CB C 30.6 0.20 1 501 67 67 HIS N N 116.3 0.25 1 502 68 68 CYS H H 9.37 0.01 1 503 68 68 CYS HA H 5.09 0.01 1 504 68 68 CYS HB2 H 3.01 0.01 2 505 68 68 CYS HB3 H 2.35 0.01 2 506 68 68 CYS C C 174.9 0.20 1 507 68 68 CYS CA C 56.0 0.20 1 508 68 68 CYS CB C 29.0 0.20 1 509 68 68 CYS N N 122.1 0.25 1 510 69 69 THR H H 9.38 0.01 1 511 69 69 THR HA H 4.18 0.01 1 512 69 69 THR HB H 3.86 0.01 1 513 69 69 THR HG2 H 1.00 0.01 1 514 69 69 THR C C 174.7 0.20 1 515 69 69 THR CA C 64.9 0.20 1 516 69 69 THR CB C 69.7 0.20 1 517 69 69 THR N N 128.4 0.25 1 518 70 70 THR H H 8.84 0.01 1 519 70 70 THR HA H 4.38 0.01 1 520 70 70 THR HG2 H 0.82 0.01 1 521 70 70 THR C C 173.3 0.20 1 522 70 70 THR CA C 60.2 0.20 1 523 70 70 THR CB C 69.0 0.20 1 524 70 70 THR N N 113.9 0.25 1 525 71 71 LYS H H 7.47 0.01 1 526 71 71 LYS HA H 4.26 0.01 1 527 71 71 LYS HB2 H 1.58 0.01 2 528 71 71 LYS HG2 H 1.22 0.01 2 529 71 71 LYS C C 175.7 0.20 1 530 71 71 LYS CA C 52.2 0.20 1 531 71 71 LYS CB C 34.8 0.20 1 532 71 71 LYS N N 120.1 0.25 1 533 72 72 PHE H H 9.42 0.01 1 534 72 72 PHE HA H 4.59 0.01 1 535 72 72 PHE HB2 H 3.07 0.01 2 536 72 72 PHE HB3 H 2.93 0.01 2 537 72 72 PHE C C 175.5 0.20 1 538 72 72 PHE CA C 58.9 0.20 1 539 72 72 PHE CB C 38.8 0.20 1 540 72 72 PHE N N 131.9 0.25 1 541 73 73 CYS H H 8.08 0.01 1 542 73 73 CYS HA H 4.31 0.01 1 543 73 73 CYS HB2 H 3.41 0.01 2 544 73 73 CYS HB3 H 2.84 0.01 2 545 73 73 CYS C C 176.7 0.20 1 546 73 73 CYS CA C 60.0 0.20 1 547 73 73 CYS CB C 29.1 0.20 1 548 73 73 CYS N N 123.5 0.25 1 549 74 74 ASP H H 8.31 0.01 1 550 74 74 ASP HA H 4.06 0.01 1 551 74 74 ASP HB2 H 3.01 0.01 2 552 74 74 ASP C C 176.6 0.20 1 553 74 74 ASP CA C 54.7 0.20 1 554 74 74 ASP CB C 41.0 0.20 1 555 74 74 ASP N N 124.1 0.25 1 556 75 75 TYR H H 7.46 0.01 1 557 75 75 TYR HA H 3.73 0.01 1 558 75 75 TYR HB2 H 3.18 0.01 2 559 75 75 TYR C C 176.6 0.20 1 560 75 75 TYR CA C 58.9 0.20 1 561 75 75 TYR CB C 35.0 0.20 1 562 75 75 TYR N N 109.1 0.25 1 563 76 76 GLY H H 7.50 0.01 1 564 76 76 GLY HA2 H 4.68 0.01 2 565 76 76 GLY HA3 H 3.24 0.01 2 566 76 76 GLY C C 174.2 0.20 1 567 76 76 GLY CA C 44.8 0.20 1 568 76 76 GLY N N 103.6 0.25 1 569 77 77 LYS H H 7.68 0.01 1 570 77 77 LYS HA H 4.16 0.01 1 571 77 77 LYS HB2 H 2.01 0.01 2 572 77 77 LYS HG2 H 1.54 0.01 2 573 77 77 LYS C C 177.9 0.20 1 574 77 77 LYS CA C 57.8 0.20 1 575 77 77 LYS CB C 32.9 0.20 1 576 77 77 LYS N N 119.3 0.25 1 577 78 78 ALA H H 7.17 0.01 1 578 78 78 ALA HA H 4.37 0.01 1 579 78 78 ALA HB H 1.26 0.01 1 580 78 78 ALA C C 178.3 0.20 1 581 78 78 ALA CA C 51.9 0.20 1 582 78 78 ALA CB C 19.8 0.20 1 583 78 78 ALA N N 119.2 0.25 1 584 79 79 GLU H H 8.71 0.01 1 585 79 79 GLU HA H 4.14 0.01 1 586 79 79 GLU HB2 H 2.07 0.01 2 587 79 79 GLU HG2 H 1.95 0.01 2 588 79 79 GLU C C 179.0 0.20 1 589 79 79 GLU CA C 57.8 0.20 1 590 79 79 GLU CB C 29.2 0.20 1 591 79 79 GLU N N 124.1 0.25 1 592 80 80 GLY H H 9.02 0.01 1 593 80 80 GLY HA2 H 4.16 0.01 2 594 80 80 GLY HA3 H 3.86 0.01 2 595 80 80 GLY C C 176.3 0.20 1 596 80 80 GLY CA C 45.9 0.20 1 597 80 80 GLY N N 114.3 0.25 1 598 81 81 ALA H H 7.90 0.01 1 599 81 81 ALA HA H 4.09 0.01 1 600 81 81 ALA HB H 1.54 0.01 1 601 81 81 ALA C C 178.1 0.20 1 602 81 81 ALA CA C 56.1 0.20 1 603 81 81 ALA CB C 20.5 0.20 1 604 81 81 ALA N N 124.1 0.25 1 605 82 82 LYS H H 8.46 0.01 1 606 82 82 LYS HA H 3.87 0.01 1 607 82 82 LYS HB2 H 1.78 0.01 2 608 82 82 LYS HB3 H 1.60 0.01 2 609 82 82 LYS C C 178.2 0.20 1 610 82 82 LYS CA C 59.8 0.20 1 611 82 82 LYS CB C 31.9 0.20 1 612 82 82 LYS N N 117.7 0.25 1 613 83 83 GLU H H 8.79 0.01 1 614 83 83 GLU HA H 3.85 0.01 1 615 83 83 GLU HB2 H 2.19 0.01 2 616 83 83 GLU HG2 H 1.95 0.01 2 617 83 83 GLU C C 179.6 0.20 1 618 83 83 GLU CA C 60.2 0.20 1 619 83 83 GLU CB C 28.5 0.20 1 620 83 83 GLU N N 117.2 0.25 1 621 84 84 TYR H H 7.68 0.01 1 622 84 84 TYR HA H 4.00 0.01 1 623 84 84 TYR HB2 H 3.03 0.01 2 624 84 84 TYR HB3 H 2.83 0.01 2 625 84 84 TYR C C 176.4 0.20 1 626 84 84 TYR CA C 61.2 0.20 1 627 84 84 TYR CB C 38.9 0.20 1 628 84 84 TYR N N 119.2 0.25 1 629 85 85 ALA H H 7.76 0.01 1 630 85 85 ALA HA H 3.55 0.01 1 631 85 85 ALA HB H 1.58 0.01 1 632 85 85 ALA C C 178.1 0.20 1 633 85 85 ALA CA C 53.9 0.20 1 634 85 85 ALA CB C 19.5 0.20 1 635 85 85 ALA N N 116.8 0.25 1 636 86 86 GLU H H 7.18 0.01 1 637 86 86 GLU HA H 4.07 0.01 1 638 86 86 GLU HB2 H 2.25 0.01 2 639 86 86 GLU HB3 H 2.11 0.01 2 640 86 86 GLU HG2 H 1.84 0.01 2 641 86 86 GLU C C 177.6 0.20 1 642 86 86 GLU CA C 55.3 0.20 1 643 86 86 GLU CB C 30.2 0.20 1 644 86 86 GLU N N 110.5 0.25 1 645 87 87 LEU H H 7.33 0.01 1 646 87 87 LEU HA H 4.02 0.01 1 647 87 87 LEU HB2 H 1.67 0.01 2 648 87 87 LEU HG H 1.19 0.01 1 649 87 87 LEU HD1 H 0.84 0.01 2 650 87 87 LEU HD2 H 0.72 0.01 2 651 87 87 LEU C C 179.1 0.20 1 652 87 87 LEU CA C 55.3 0.20 1 653 87 87 LEU CB C 42.4 0.20 1 654 87 87 LEU N N 122.6 0.25 1 655 88 88 GLN H H 8.70 0.01 1 656 88 88 GLN HA H 3.76 0.01 1 657 88 88 GLN HB2 H 2.12 0.01 2 658 88 88 GLN HG2 H 1.87 0.01 2 659 88 88 GLN C C 178.6 0.20 1 660 88 88 GLN CA C 59.5 0.20 1 661 88 88 GLN CB C 27.5 0.20 1 662 88 88 GLN N N 125.5 0.25 1 663 89 89 VAL H H 8.20 0.01 1 664 89 89 VAL HA H 3.96 0.01 1 665 89 89 VAL HB H 1.98 0.01 1 666 89 89 VAL HG1 H 1.20 0.01 2 667 89 89 VAL HG2 H 0.79 0.01 2 668 89 89 VAL C C 177.3 0.20 1 669 89 89 VAL CA C 64.3 0.20 1 670 89 89 VAL CB C 30.8 0.20 1 671 89 89 VAL N N 113.4 0.25 1 672 90 90 VAL H H 6.29 0.01 1 673 90 90 VAL HA H 3.17 0.01 1 674 90 90 VAL HB H 1.82 0.01 1 675 90 90 VAL HG1 H 0.23 0.01 2 676 90 90 VAL HG2 H -0.06 0.01 2 677 90 90 VAL C C 177.9 0.20 1 678 90 90 VAL CA C 66.5 0.20 1 679 90 90 VAL CB C 30.8 0.20 1 680 90 90 VAL N N 124.1 0.25 1 681 91 91 LYS H H 7.63 0.01 1 682 91 91 LYS HA H 3.79 0.01 1 683 91 91 LYS HB2 H 1.80 0.01 2 684 91 91 LYS HG2 H 1.54 0.01 2 685 91 91 LYS C C 181.0 0.20 1 686 91 91 LYS CA C 60.0 0.20 1 687 91 91 LYS CB C 32.1 0.20 1 688 91 91 LYS N N 117.3 0.25 1 689 92 92 GLU H H 8.33 0.01 1 690 92 92 GLU HA H 4.14 0.01 1 691 92 92 GLU HB2 H 2.02 0.01 2 692 92 92 GLU HG2 H 1.80 0.01 2 693 92 92 GLU C C 178.2 0.20 1 694 92 92 GLU CA C 57.8 0.20 1 695 92 92 GLU CB C 29.8 0.20 1 696 92 92 GLU N N 114.4 0.25 1 697 93 93 SER H H 7.48 0.01 1 698 93 93 SER HA H 4.64 0.01 1 699 93 93 SER HB2 H 3.68 0.01 2 700 93 93 SER HB3 H 4.13 0.01 2 701 93 93 SER C C 175.0 0.20 1 702 93 93 SER CA C 60.0 0.20 1 703 93 93 SER CB C 64.4 0.20 1 704 93 93 SER N N 114.4 0.25 1 705 94 94 LEU H H 7.35 0.01 1 706 94 94 LEU HA H 4.45 0.01 1 707 94 94 LEU HB2 H 1.90 0.01 2 708 94 94 LEU HG H 1.70 0.01 1 709 94 94 LEU HD1 H 1.05 0.01 2 710 94 94 LEU HD2 H 0.91 0.01 2 711 94 94 LEU C C 180.4 0.20 1 712 94 94 LEU CA C 57.1 0.20 1 713 94 94 LEU CB C 42.1 0.20 1 714 94 94 LEU N N 122.1 0.25 1 715 95 95 THR H H 9.97 0.01 1 716 95 95 THR HA H 4.07 0.01 1 717 95 95 THR HB H 4.57 0.01 1 718 95 95 THR HG2 H 1.26 0.01 1 719 95 95 THR C C 174.2 0.20 1 720 95 95 THR CA C 65.8 0.20 1 721 95 95 THR CB C 69.2 0.20 1 722 95 95 THR N N 116.2 0.25 1 723 96 96 LYS H H 8.59 0.01 1 724 96 96 LYS HA H 4.51 0.01 1 725 96 96 LYS HB2 H 2.45 0.01 2 726 96 96 LYS HB3 H 1.92 0.01 2 727 96 96 LYS HG2 H 1.66 0.01 2 728 96 96 LYS HG3 H 1.34 0.01 2 729 96 96 LYS C C 176.7 0.20 1 730 96 96 LYS CA C 56.7 0.20 1 731 96 96 LYS CB C 33.0 0.20 1 732 96 96 LYS N N 122.6 0.25 1 733 97 97 SER H H 8.19 0.01 1 734 97 97 SER HA H 5.43 0.01 1 735 97 97 SER HB2 H 3.96 0.01 2 736 97 97 SER HB3 H 3.82 0.01 2 737 97 97 SER C C 175.1 0.20 1 738 97 97 SER CA C 58.0 0.20 1 739 97 97 SER CB C 64.6 0.20 1 740 97 97 SER N N 115.8 0.25 1 741 98 98 TYR H H 8.44 0.01 1 742 98 98 TYR HA H 4.51 0.01 1 743 98 98 TYR HB2 H 3.54 0.01 2 744 98 98 TYR HB3 H 3.40 0.01 2 745 98 98 TYR C C 175.3 0.20 1 746 98 98 TYR CA C 57.5 0.20 1 747 98 98 TYR CB C 43.3 0.20 1 748 98 98 TYR N N 120.7 0.25 1 749 99 99 GLU H H 8.79 0.01 1 750 99 99 GLU HA H 4.89 0.01 1 751 99 99 GLU HB2 H 2.04 0.01 2 752 99 99 GLU HG2 H 1.92 0.01 2 753 99 99 GLU C C 175.8 0.20 1 754 99 99 GLU CA C 55.0 0.20 1 755 99 99 GLU CB C 30.5 0.20 1 756 99 99 GLU N N 126.1 0.25 1 757 100 100 LEU H H 9.10 0.01 1 758 100 100 LEU HA H 4.43 0.01 1 759 100 100 LEU HB2 H 1.29 0.01 2 760 100 100 LEU HG H 1.02 0.01 1 761 100 100 LEU HD1 H 0.23 0.01 2 762 100 100 LEU HD2 H -0.22 0.01 2 763 100 100 LEU C C 176.4 0.20 1 764 100 100 LEU CA C 53.1 0.20 1 765 100 100 LEU CB C 43.5 0.20 1 766 100 100 LEU N N 128.4 0.25 1 767 101 101 SER H H 8.54 0.01 1 768 101 101 SER HA H 4.76 0.01 1 769 101 101 SER HB2 H 3.69 0.01 2 770 101 101 SER HB3 H 3.54 0.01 2 771 101 101 SER C C 174.1 0.20 1 772 101 101 SER CA C 56.9 0.20 1 773 101 101 SER CB C 64.4 0.20 1 774 101 101 SER N N 116.3 0.25 1 775 102 102 VAL H H 9.16 0.01 1 776 102 102 VAL HA H 4.79 0.01 1 777 102 102 VAL HB H 2.16 0.01 1 778 102 102 VAL HG1 H 0.72 0.01 2 779 102 102 VAL HG2 H 0.57 0.01 2 780 102 102 VAL C C 177.3 0.20 1 781 102 102 VAL CA C 60.7 0.20 1 782 102 102 VAL CB C 32.3 0.20 1 783 102 102 VAL N N 128.4 0.25 1 784 103 103 THR H H 7.73 0.01 1 785 103 103 THR HA H 4.36 0.01 1 786 103 103 THR HB H 4.47 0.01 1 787 103 103 THR HG2 H 0.95 0.01 1 788 103 103 THR C C 176.2 0.20 1 789 103 103 THR CA C 61.1 0.20 1 790 103 103 THR CB C 69.7 0.20 1 791 103 103 THR N N 111.5 0.25 1 792 104 104 ALA H H 7.63 0.01 1 793 104 104 ALA HA H 4.96 0.01 1 794 104 104 ALA HB H 0.89 0.01 1 795 104 104 ALA C C 176.0 0.20 1 796 104 104 ALA CA C 51.6 0.20 1 797 104 104 ALA CB C 23.8 0.20 1 798 104 104 ALA N N 123.0 0.25 1 799 105 105 LEU H H 8.47 0.01 1 800 105 105 LEU HA H 5.26 0.01 1 801 105 105 LEU HB2 H 1.30 0.01 2 802 105 105 LEU HD1 H 0.62 0.01 2 803 105 105 LEU HD2 H 0.38 0.01 2 804 105 105 LEU C C 175.5 0.20 1 805 105 105 LEU CA C 52.7 0.20 1 806 105 105 LEU CB C 44.6 0.20 1 807 105 105 LEU N N 117.8 0.25 1 808 106 106 ILE H H 9.14 0.01 1 809 106 106 ILE HA H 5.42 0.01 1 810 106 106 ILE HB H 1.82 0.01 1 811 106 106 ILE HG12 H 1.60 0.01 2 812 106 106 ILE HG2 H 1.00 0.01 1 813 106 106 ILE HD1 H 0.79 0.01 1 814 106 106 ILE C C 175.7 0.20 1 815 106 106 ILE CA C 59.4 0.20 1 816 106 106 ILE CB C 41.7 0.20 1 817 106 106 ILE N N 115.8 0.25 1 818 107 107 VAL H H 9.17 0.01 1 819 107 107 VAL HA H 5.00 0.01 1 820 107 107 VAL HB H 2.18 0.01 1 821 107 107 VAL HG1 H 1.16 0.01 2 822 107 107 VAL HG2 H 0.89 0.01 2 823 107 107 VAL C C 174.7 0.20 1 824 107 107 VAL CA C 62.0 0.20 1 825 107 107 VAL CB C 35.7 0.20 1 826 107 107 VAL N N 125.5 0.25 1 827 108 108 THR H H 9.80 0.01 1 828 108 108 THR HA H 6.19 0.01 1 829 108 108 THR HB H 4.78 0.01 1 830 108 108 THR HG2 H 1.40 0.01 1 831 108 108 THR CA C 58.8 0.20 1 832 108 108 THR CB C 70.2 0.20 1 833 108 108 THR N N 120.2 0.25 1 834 109 109 PRO C C 178.8 0.20 1 835 109 109 PRO CA C 63.7 0.20 1 836 109 109 PRO CB C 32.3 0.20 1 837 110 110 ARG H H 8.50 0.01 1 838 110 110 ARG HA H 4.47 0.01 1 839 110 110 ARG HB2 H 2.32 0.01 2 840 110 110 ARG HB3 H 1.90 0.01 2 841 110 110 ARG HG2 H 1.56 0.01 2 842 110 110 ARG C C 176.8 0.20 1 843 110 110 ARG CA C 57.2 0.20 1 844 110 110 ARG CB C 32.2 0.20 1 845 110 110 ARG N N 115.3 0.25 1 846 111 111 THR H H 8.10 0.01 1 847 111 111 THR HA H 5.03 0.01 1 848 111 111 THR HB H 4.27 0.01 1 849 111 111 THR HG2 H 1.00 0.01 1 850 111 111 THR C C 170.2 0.20 1 851 111 111 THR CA C 61.4 0.20 1 852 111 111 THR CB C 73.9 0.20 1 853 111 111 THR N N 108.5 0.25 1 854 112 112 PHE H H 8.13 0.01 1 855 112 112 PHE HA H 5.74 0.01 1 856 112 112 PHE C C 176.4 0.20 1 857 112 112 PHE CA C 51.8 0.20 1 858 112 112 PHE CB C 39.7 0.20 1 859 112 112 PHE N N 119.1 0.25 1 860 113 113 GLY H H 9.27 0.01 1 861 113 113 GLY HA2 H 4.76 0.01 2 862 113 113 GLY HA3 H 3.46 0.01 2 863 113 113 GLY C C 170.3 0.20 1 864 113 113 GLY CA C 44.7 0.20 1 865 113 113 GLY N N 113.8 0.25 1 866 114 114 ALA H H 8.74 0.01 1 867 114 114 ALA HA H 5.10 0.01 1 868 114 114 ALA HB H 1.10 0.01 1 869 114 114 ALA C C 176.7 0.20 1 870 114 114 ALA CA C 49.0 0.20 1 871 114 114 ALA CB C 20.9 0.20 1 872 114 114 ALA N N 121.6 0.25 1 873 115 115 ARG H H 8.70 0.01 1 874 115 115 ARG HA H 4.16 0.01 1 875 115 115 ARG HB2 H 1.86 0.01 2 876 115 115 ARG HG2 H 1.49 0.01 2 877 115 115 ARG C C 174.7 0.20 1 878 115 115 ARG CA C 56.7 0.20 1 879 115 115 ARG CB C 32.2 0.20 1 880 115 115 ARG N N 125.5 0.25 1 881 116 116 VAL H H 7.66 0.01 1 882 116 116 VAL HA H 4.50 0.01 1 883 116 116 VAL HB H 1.81 0.01 1 884 116 116 VAL HG1 H 0.59 0.01 2 885 116 116 VAL C C 174.2 0.20 1 886 116 116 VAL CA C 60.5 0.20 1 887 116 116 VAL CB C 33.7 0.20 1 888 116 116 VAL N N 127.9 0.25 1 889 117 117 ALA H H 8.51 0.01 1 890 117 117 ALA HA H 4.50 0.01 1 891 117 117 ALA HB H 1.13 0.01 1 892 117 117 ALA C C 177.5 0.20 1 893 117 117 ALA CA C 49.4 0.20 1 894 117 117 ALA CB C 18.9 0.20 1 895 117 117 ALA N N 131.3 0.25 1 896 118 118 LEU H H 8.36 0.01 1 897 118 118 LEU HA H 4.12 0.01 1 898 118 118 LEU HB2 H 1.51 0.01 2 899 118 118 LEU HG H 1.33 0.01 1 900 118 118 LEU HD1 H 0.52 0.01 2 901 118 118 LEU HD2 H 0.28 0.01 2 902 118 118 LEU C C 178.8 0.20 1 903 118 118 LEU CA C 55.3 0.20 1 904 118 118 LEU CB C 42.7 0.20 1 905 118 118 LEU N N 125.5 0.25 1 906 119 119 THR H H 7.58 0.01 1 907 119 119 THR HA H 4.38 0.01 1 908 119 119 THR HB H 4.64 0.01 1 909 119 119 THR HG2 H 1.26 0.01 1 910 119 119 THR C C 175.7 0.20 1 911 119 119 THR CA C 60.3 0.20 1 912 119 119 THR CB C 71.2 0.20 1 913 119 119 THR N N 112.5 0.25 1 914 120 120 GLU H H 8.81 0.01 1 915 120 120 GLU HA H 3.94 0.01 1 916 120 120 GLU HB2 H 2.32 0.01 2 917 120 120 GLU HG2 H 2.04 0.01 2 918 120 120 GLU C C 179.3 0.20 1 919 120 120 GLU CA C 59.9 0.20 1 920 120 120 GLU CB C 29.2 0.20 1 921 120 120 GLU N N 120.2 0.25 1 922 121 121 ALA H H 8.07 0.01 1 923 121 121 ALA HA H 4.14 0.01 1 924 121 121 ALA HB H 1.46 0.01 1 925 121 121 ALA C C 181.4 0.20 1 926 121 121 ALA CA C 54.5 0.20 1 927 121 121 ALA CB C 18.8 0.20 1 928 121 121 ALA N N 118.8 0.25 1 929 122 122 GLN H H 7.42 0.01 1 930 122 122 GLN HA H 3.89 0.01 1 931 122 122 GLN HB2 H 2.06 0.01 2 932 122 122 GLN HB3 H 1.82 0.01 2 933 122 122 GLN HG2 H 2.35 0.01 2 934 122 122 GLN C C 179.3 0.20 1 935 122 122 GLN CA C 58.2 0.20 1 936 122 122 GLN CB C 28.0 0.20 1 937 122 122 GLN N N 117.3 0.25 1 938 123 123 VAL H H 8.44 0.01 1 939 123 123 VAL HA H 4.13 0.01 1 940 123 123 VAL HB H 2.09 0.01 1 941 123 123 VAL HG1 H 0.98 0.01 2 942 123 123 VAL HG2 H 0.92 0.01 2 943 123 123 VAL C C 178.7 0.20 1 944 123 123 VAL CA C 65.3 0.20 1 945 123 123 VAL CB C 31.6 0.20 1 946 123 123 VAL N N 119.2 0.25 1 947 124 124 LYS H H 7.11 0.01 1 948 124 124 LYS HA H 3.90 0.01 1 949 124 124 LYS HB2 H 1.87 0.01 2 950 124 124 LYS HB3 H 1.73 0.01 2 951 124 124 LYS HG2 H 1.58 0.01 2 952 124 124 LYS C C 177.8 0.20 1 953 124 124 LYS CA C 58.6 0.20 1 954 124 124 LYS CB C 32.0 0.20 1 955 124 124 LYS N N 119.2 0.25 1 956 125 125 LEU H H 7.52 0.01 1 957 125 125 LEU HA H 4.06 0.01 1 958 125 125 LEU HB2 H 1.81 0.01 2 959 125 125 LEU HB3 H 1.16 0.01 2 960 125 125 LEU HG H 0.99 0.01 1 961 125 125 LEU HD1 H 0.14 0.01 2 962 125 125 LEU HD2 H -0.10 0.01 2 963 125 125 LEU C C 177.0 0.20 1 964 125 125 LEU CA C 53.8 0.20 1 965 125 125 LEU CB C 41.7 0.20 1 966 125 125 LEU N N 114.8 0.25 1 967 126 126 TRP H H 8.18 0.01 1 968 126 126 TRP HA H 4.92 0.01 1 969 126 126 TRP HB2 H 3.73 0.01 2 970 126 126 TRP HB3 H 3.01 0.01 2 971 126 126 TRP HE1 H 10.18 0.01 1 972 126 126 TRP CA C 53.7 0.20 1 973 126 126 TRP CB C 31.2 0.20 1 974 126 126 TRP N N 126.5 0.25 1 975 126 126 TRP NE1 N 129.9 0.25 1 976 127 127 PRO HA H 4.37 0.01 1 977 127 127 PRO C C 177.5 0.20 1 978 127 127 PRO CA C 62.1 0.20 1 979 127 127 PRO CB C 30.9 0.20 1 980 128 128 GLU H H 8.71 0.01 1 981 128 128 GLU HA H 4.16 0.01 1 982 128 128 GLU HB2 H 2.31 0.01 2 983 128 128 GLU HB3 H 2.06 0.01 2 984 128 128 GLU HG2 H 1.97 0.01 2 985 128 128 GLU C C 178.7 0.20 1 986 128 128 GLU CA C 57.9 0.20 1 987 128 128 GLU CB C 29.2 0.20 1 988 128 128 GLU N N 124.5 0.25 1 989 129 129 GLY H H 9.19 0.01 1 990 129 129 GLY HA2 H 4.09 0.01 2 991 129 129 GLY HA3 H 4.06 0.01 2 992 129 129 GLY C C 176.8 0.20 1 993 129 129 GLY CA C 45.8 0.20 1 994 129 129 GLY N N 113.9 0.25 1 995 130 130 ALA H H 7.68 0.01 1 996 130 130 ALA HA H 3.94 0.01 1 997 130 130 ALA HB H 0.81 0.01 1 998 130 130 ALA C C 181.1 0.20 1 999 130 130 ALA CA C 54.8 0.20 1 1000 130 130 ALA CB C 18.2 0.20 1 1001 130 130 ALA N N 122.1 0.25 1 1002 131 131 ASP H H 8.43 0.01 1 1003 131 131 ASP HA H 4.43 0.01 1 1004 131 131 ASP HB2 H 2.66 0.01 2 1005 131 131 ASP HB3 H 2.56 0.01 2 1006 131 131 ASP C C 176.7 0.20 1 1007 131 131 ASP CA C 58.4 0.20 1 1008 131 131 ASP CB C 41.8 0.20 1 1009 131 131 ASP N N 114.3 0.25 1 1010 132 132 LYS H H 7.20 0.01 1 1011 132 132 LYS HA H 4.07 0.01 1 1012 132 132 LYS HB2 H 1.92 0.01 2 1013 132 132 LYS HB3 H 1.74 0.01 2 1014 132 132 LYS HG2 H 1.30 0.01 2 1015 132 132 LYS C C 177.7 0.20 1 1016 132 132 LYS CA C 56.4 0.20 1 1017 132 132 LYS CB C 33.0 0.20 1 1018 132 132 LYS N N 110.0 0.25 1 1019 133 133 GLU H H 6.91 0.01 1 1020 133 133 GLU HA H 3.99 0.01 1 1021 133 133 GLU HB2 H 1.98 0.01 2 1022 133 133 GLU HG2 H 1.87 0.01 2 1023 133 133 GLU C C 178.9 0.20 1 1024 133 133 GLU CA C 58.1 0.20 1 1025 133 133 GLU CB C 29.6 0.20 1 1026 133 133 GLU N N 121.6 0.25 1 1027 134 134 GLY H H 9.11 0.01 1 1028 134 134 GLY HA2 H 3.99 0.01 2 1029 134 134 GLY HA3 H 3.76 0.01 2 1030 134 134 GLY C C 174.3 0.20 1 1031 134 134 GLY CA C 46.2 0.20 1 1032 134 134 GLY N N 115.7 0.25 1 1033 135 135 VAL H H 7.14 0.01 1 1034 135 135 VAL HA H 3.77 0.01 1 1035 135 135 VAL HB H 1.88 0.01 1 1036 135 135 VAL HG1 H 0.95 0.01 2 1037 135 135 VAL HG2 H 0.79 0.01 2 1038 135 135 VAL C C 175.9 0.20 1 1039 135 135 VAL CA C 62.5 0.20 1 1040 135 135 VAL CB C 32.1 0.20 1 1041 135 135 VAL N N 119.7 0.25 1 1042 136 136 ALA H H 8.56 0.01 1 1043 136 136 ALA HA H 4.44 0.01 1 1044 136 136 ALA HB H 1.44 0.01 1 1045 136 136 ALA CA C 50.9 0.20 1 1046 136 136 ALA CB C 17.7 0.20 1 1047 136 136 ALA N N 130.8 0.25 1 1048 137 137 PRO HA H 4.16 0.01 1 1049 137 137 PRO C C 179.5 0.20 1 1050 137 137 PRO CA C 65.8 0.20 1 1051 137 137 PRO CB C 31.9 0.20 1 1052 138 138 ALA H H 8.24 0.01 1 1053 138 138 ALA HA H 4.12 0.01 1 1054 138 138 ALA C C 178.6 0.20 1 1055 138 138 ALA CA C 54.2 0.20 1 1056 138 138 ALA CB C 19.1 0.20 1 1057 138 138 ALA N N 116.3 0.25 1 1058 139 139 LEU H H 7.64 0.01 1 1059 139 139 LEU HA H 4.41 0.01 1 1060 139 139 LEU HB2 H 1.68 0.01 2 1061 139 139 LEU HG H 1.60 0.01 1 1062 139 139 LEU HD1 H 0.91 0.01 2 1063 139 139 LEU HD2 H 0.79 0.01 2 1064 139 139 LEU C C 178.1 0.20 1 1065 139 139 LEU CA C 54.1 0.20 1 1066 139 139 LEU CB C 43.8 0.20 1 1067 139 139 LEU N N 116.8 0.25 1 1068 140 140 LEU H H 7.46 0.01 1 1069 140 140 LEU HA H 3.98 0.01 1 1070 140 140 LEU HB2 H 1.67 0.01 2 1071 140 140 LEU HD1 H 0.92 0.01 2 1072 140 140 LEU CA C 59.9 0.20 1 1073 140 140 LEU CB C 39.5 0.20 1 1074 140 140 LEU N N 121.2 0.25 1 1075 141 141 PRO HA H 4.33 0.01 1 1076 141 141 PRO C C 180.3 0.20 1 1077 141 141 PRO CA C 66.3 0.20 1 1078 141 141 PRO CB C 30.4 0.20 1 1079 142 142 SER H H 7.45 0.01 1 1080 142 142 SER HA H 4.26 0.01 1 1081 142 142 SER HB2 H 3.96 0.01 2 1082 142 142 SER HB3 H 3.77 0.01 2 1083 142 142 SER C C 176.6 0.20 1 1084 142 142 SER CA C 61.7 0.20 1 1085 142 142 SER CB C 63.2 0.20 1 1086 142 142 SER N N 112.0 0.25 1 1087 143 143 VAL H H 7.85 0.01 1 1088 143 143 VAL HA H 3.66 0.01 1 1089 143 143 VAL HB H 2.09 0.01 1 1090 143 143 VAL HG1 H 0.99 0.01 2 1091 143 143 VAL HG2 H 0.88 0.01 2 1092 143 143 VAL C C 179.0 0.20 1 1093 143 143 VAL CA C 65.6 0.20 1 1094 143 143 VAL CB C 31.9 0.20 1 1095 143 143 VAL N N 120.7 0.25 1 1096 144 144 GLU H H 8.49 0.01 1 1097 144 144 GLU HA H 4.03 0.01 1 1098 144 144 GLU HB2 H 2.15 0.01 2 1099 144 144 GLU HG2 H 2.08 0.01 2 1100 144 144 GLU C C 177.2 0.20 1 1101 144 144 GLU CA C 58.8 0.20 1 1102 144 144 GLU CB C 29.7 0.20 1 1103 144 144 GLU N N 119.2 0.25 1 1104 145 145 ALA H H 6.99 0.01 1 1105 145 145 ALA HA H 4.37 0.01 1 1106 145 145 ALA HB H 1.43 0.01 1 1107 145 145 ALA C C 178.2 0.20 1 1108 145 145 ALA CA C 51.8 0.20 1 1109 145 145 ALA CB C 19.3 0.20 1 1110 145 145 ALA N N 117.8 0.25 1 1111 146 146 LEU H H 7.45 0.01 1 1112 146 146 LEU HA H 4.51 0.01 1 1113 146 146 LEU HB2 H 1.90 0.01 2 1114 146 146 LEU HD1 H 0.81 0.01 2 1115 146 146 LEU CA C 52.6 0.20 1 1116 146 146 LEU CB C 40.7 0.20 1 1117 146 146 LEU N N 121.1 0.25 1 1118 147 147 PRO HA H 4.34 0.01 1 1119 147 147 PRO C C 178.3 0.20 1 1120 147 147 PRO CA C 62.5 0.20 1 1121 147 147 PRO CB C 32.0 0.20 1 1122 148 148 ALA H H 8.72 0.01 1 1123 148 148 ALA HA H 4.33 0.01 1 1124 148 148 ALA HB H 1.47 0.01 1 1125 148 148 ALA C C 177.0 0.20 1 1126 148 148 ALA CA C 53.4 0.20 1 1127 148 148 ALA CB C 18.0 0.20 1 1128 148 148 ALA N N 127.5 0.25 1 1129 149 149 GLY H H 10.23 0.01 1 1130 149 149 GLY HA2 H 3.42 0.01 2 1131 149 149 GLY C C 177.7 0.20 1 1132 149 149 GLY CA C 43.4 0.20 1 1133 149 149 GLY N N 113.7 0.25 1 1134 150 150 SER H H 7.76 0.01 1 1135 150 150 SER HA H 4.01 0.01 1 1136 150 150 SER HB2 H 3.59 0.01 2 1137 150 150 SER C C 173.6 0.20 1 1138 150 150 SER CA C 63.0 0.20 1 1139 150 150 SER CB C 63.4 0.20 1 1140 150 150 SER N N 119.7 0.25 1 1141 151 151 ARG H H 8.54 0.01 1 1142 151 151 ARG HA H 4.00 0.01 1 1143 151 151 ARG HB2 H 2.22 0.01 2 1144 151 151 ARG HB3 H 2.05 0.01 2 1145 151 151 ARG C C 175.4 0.20 1 1146 151 151 ARG CA C 56.0 0.20 1 1147 151 151 ARG CB C 33.9 0.20 1 1148 151 151 ARG N N 117.8 0.25 1 1149 152 152 ALA H H 7.12 0.01 1 1150 152 152 ALA HA H 4.26 0.01 1 1151 152 152 ALA HB H 0.85 0.01 1 1152 152 152 ALA C C 176.9 0.20 1 1153 152 152 ALA CA C 54.2 0.20 1 1154 152 152 ALA CB C 17.7 0.20 1 1155 152 152 ALA N N 122.2 0.25 1 1156 153 153 HIS H H 7.60 0.01 1 1157 153 153 HIS HA H 5.52 0.01 1 1158 153 153 HIS HB2 H 3.14 0.01 2 1159 153 153 HIS HB3 H 2.71 0.01 2 1160 153 153 HIS C C 173.8 0.20 1 1161 153 153 HIS CA C 55.7 0.20 1 1162 153 153 HIS CB C 31.6 0.20 1 1163 153 153 HIS N N 116.3 0.25 1 1164 154 154 VAL H H 8.85 0.01 1 1165 154 154 VAL HA H 4.37 0.01 1 1166 154 154 VAL HB H 1.66 0.01 1 1167 154 154 VAL HG1 H 0.61 0.01 2 1168 154 154 VAL HG2 H 0.41 0.01 2 1169 154 154 VAL C C 177.2 0.20 1 1170 154 154 VAL CA C 60.4 0.20 1 1171 154 154 VAL CB C 35.7 0.20 1 1172 154 154 VAL N N 119.2 0.25 1 1173 155 155 THR H H 9.43 0.01 1 1174 155 155 THR HA H 4.12 0.01 1 1175 155 155 THR HB H 4.45 0.01 1 1176 155 155 THR HG2 H 1.20 0.01 1 1177 155 155 THR C C 173.4 0.20 1 1178 155 155 THR CA C 65.3 0.20 1 1179 155 155 THR CB C 68.9 0.20 1 1180 155 155 THR N N 127.0 0.25 1 1181 156 156 LEU H H 8.95 0.01 1 1182 156 156 LEU HA H 4.28 0.01 1 1183 156 156 LEU HD1 H 0.98 0.01 2 1184 156 156 LEU HD2 H 0.67 0.01 2 1185 156 156 LEU C C 178.6 0.20 1 1186 156 156 LEU CA C 54.5 0.20 1 1187 156 156 LEU CB C 42.5 0.20 1 1188 156 156 LEU N N 128.4 0.25 1 1189 157 157 GLY H H 8.22 0.01 1 1190 157 157 GLY HA2 H 4.48 0.01 2 1191 157 157 GLY HA3 H 3.86 0.01 2 1192 157 157 GLY C C 171.1 0.20 1 1193 157 157 GLY CA C 46.2 0.20 1 1194 157 157 GLY N N 106.1 0.25 1 1195 158 158 CYS H H 8.68 0.01 1 1196 158 158 CYS HA H 5.43 0.01 1 1197 158 158 CYS HB2 H 3.17 0.01 2 1198 158 158 CYS HB3 H 2.81 0.01 2 1199 158 158 CYS C C 175.4 0.20 1 1200 158 158 CYS CA C 57.7 0.20 1 1201 158 158 CYS CB C 32.2 0.20 1 1202 158 158 CYS N N 116.8 0.25 1 1203 159 159 SER H H 8.80 0.01 1 1204 159 159 SER HA H 4.50 0.01 1 1205 159 159 SER HB2 H 3.59 0.01 2 1206 159 159 SER HB3 H 3.44 0.01 2 1207 159 159 SER C C 174.3 0.20 1 1208 159 159 SER CA C 57.1 0.20 1 1209 159 159 SER CB C 64.1 0.20 1 1210 159 159 SER N N 120.7 0.25 1 1211 160 160 ALA H H 8.09 0.01 1 1212 160 160 ALA HA H 4.03 0.01 1 1213 160 160 ALA HB H 1.27 0.01 1 1214 160 160 ALA C C 179.8 0.20 1 1215 160 160 ALA CA C 54.1 0.20 1 1216 160 160 ALA CB C 18.2 0.20 1 1217 160 160 ALA N N 123.1 0.25 1 1218 161 161 GLY H H 8.68 0.01 1 1219 161 161 GLY HA2 H 4.06 0.01 2 1220 161 161 GLY HA3 H 3.65 0.01 2 1221 161 161 GLY C C 176.8 0.20 1 1222 161 161 GLY CA C 45.6 0.20 1 1223 161 161 GLY N N 110.9 0.25 1 1224 162 162 VAL H H 7.68 0.01 1 1225 162 162 VAL HA H 4.04 0.01 1 1226 162 162 VAL HG1 H 1.02 0.01 2 1227 162 162 VAL HG2 H 0.74 0.01 2 1228 162 162 VAL C C 176.3 0.20 1 1229 162 162 VAL CA C 62.2 0.20 1 1230 162 162 VAL CB C 33.2 0.20 1 1231 162 162 VAL N N 122.2 0.25 1 1232 163 163 GLU H H 8.63 0.01 1 1233 163 163 GLU HA H 4.50 0.01 1 1234 163 163 GLU HB2 H 2.31 0.01 2 1235 163 163 GLU HG2 H 1.92 0.01 2 1236 163 163 GLU C C 178.7 0.20 1 1237 163 163 GLU CA C 55.5 0.20 1 1238 163 163 GLU CB C 31.2 0.20 1 1239 163 163 GLU N N 126.1 0.25 1 1240 164 164 THR H H 8.57 0.01 1 1241 164 164 THR HA H 4.02 0.01 1 1242 164 164 THR HB H 4.27 0.01 1 1243 164 164 THR HG2 H 1.36 0.01 1 1244 164 164 THR C C 177.4 0.20 1 1245 164 164 THR CA C 65.6 0.20 1 1246 164 164 THR CB C 69.2 0.20 1 1247 164 164 THR N N 113.9 0.25 1 1248 165 165 VAL H H 7.53 0.01 1 1249 165 165 VAL HA H 4.03 0.01 1 1250 165 165 VAL HB H 2.08 0.01 1 1251 165 165 VAL HG1 H 0.81 0.01 2 1252 165 165 VAL C C 177.1 0.20 1 1253 165 165 VAL CA C 63.5 0.20 1 1254 165 165 VAL CB C 31.5 0.20 1 1255 165 165 VAL N N 118.7 0.25 1 1256 166 166 GLN H H 8.15 0.01 1 1257 166 166 GLN HA H 3.71 0.01 1 1258 166 166 GLN HB2 H 1.82 0.01 2 1259 166 166 GLN HG2 H 2.33 0.01 2 1260 166 166 GLN C C 176.8 0.20 1 1261 166 166 GLN CA C 56.7 0.20 1 1262 166 166 GLN CB C 28.4 0.20 1 1263 166 166 GLN N N 121.2 0.25 1 1264 167 167 THR H H 7.80 0.01 1 1265 167 167 THR HA H 3.83 0.01 1 1266 167 167 THR HB H 4.04 0.01 1 1267 167 167 THR HG2 H 0.99 0.01 1 1268 167 167 THR C C 177.3 0.20 1 1269 167 167 THR CA C 64.4 0.20 1 1270 167 167 THR CB C 67.0 0.20 1 1271 167 167 THR N N 117.2 0.25 1 1272 168 168 GLY H H 6.59 0.01 1 1273 168 168 GLY HA2 H 3.79 0.01 2 1274 168 168 GLY HA3 H 3.13 0.01 2 1275 168 168 GLY C C 175.1 0.20 1 1276 168 168 GLY CA C 47.0 0.20 1 1277 168 168 GLY N N 104.6 0.25 1 1278 169 169 LEU H H 6.56 0.01 1 1279 169 169 LEU HA H 4.00 0.01 1 1280 169 169 LEU HB2 H 1.85 0.01 2 1281 169 169 LEU HG H 1.54 0.01 1 1282 169 169 LEU HD1 H 1.00 0.01 2 1283 169 169 LEU HD2 H 0.81 0.01 2 1284 169 169 LEU C C 180.2 0.20 1 1285 169 169 LEU CA C 57.7 0.20 1 1286 169 169 LEU CB C 40.8 0.20 1 1287 169 169 LEU N N 120.7 0.25 1 1288 170 170 ASP H H 8.66 0.01 1 1289 170 170 ASP HA H 4.45 0.01 1 1290 170 170 ASP HB2 H 2.93 0.01 2 1291 170 170 ASP HB3 H 2.33 0.01 2 1292 170 170 ASP C C 180.0 0.20 1 1293 170 170 ASP CA C 57.0 0.20 1 1294 170 170 ASP CB C 40.7 0.20 1 1295 170 170 ASP N N 121.6 0.25 1 1296 171 171 LEU H H 7.90 0.01 1 1297 171 171 LEU HA H 3.97 0.01 1 1298 171 171 LEU HB2 H 1.98 0.01 2 1299 171 171 LEU HG H 1.40 0.01 1 1300 171 171 LEU HD1 H 1.00 0.01 2 1301 171 171 LEU HD2 H 0.81 0.01 2 1302 171 171 LEU C C 178.2 0.20 1 1303 171 171 LEU CA C 58.1 0.20 1 1304 171 171 LEU CB C 41.6 0.20 1 1305 171 171 LEU N N 120.2 0.25 1 1306 172 172 LEU H H 8.01 0.01 1 1307 172 172 LEU HA H 3.77 0.01 1 1308 172 172 LEU HB2 H 1.97 0.01 2 1309 172 172 LEU HG H 1.16 0.01 1 1310 172 172 LEU HD1 H 0.93 0.01 2 1311 172 172 LEU HD2 H 0.75 0.01 2 1312 172 172 LEU C C 178.8 0.20 1 1313 172 172 LEU CA C 58.1 0.20 1 1314 172 172 LEU CB C 43.0 0.20 1 1315 172 172 LEU N N 117.8 0.25 1 1316 173 173 GLU H H 7.85 0.01 1 1317 173 173 GLU HA H 3.77 0.01 1 1318 173 173 GLU HB2 H 2.13 0.01 2 1319 173 173 GLU HG2 H 1.94 0.01 2 1320 173 173 GLU C C 178.9 0.20 1 1321 173 173 GLU CA C 59.7 0.20 1 1322 173 173 GLU CB C 29.5 0.20 1 1323 173 173 GLU N N 117.2 0.25 1 1324 174 174 ILE H H 7.53 0.01 1 1325 174 174 ILE HA H 3.45 0.01 1 1326 174 174 ILE HB H 1.98 0.01 1 1327 174 174 ILE HG2 H 0.83 0.01 1 1328 174 174 ILE HD1 H 0.69 0.01 1 1329 174 174 ILE C C 177.8 0.20 1 1330 174 174 ILE CA C 66.0 0.20 1 1331 174 174 ILE CB C 38.1 0.20 1 1332 174 174 ILE N N 119.2 0.25 1 1333 175 175 LEU H H 8.81 0.01 1 1334 175 175 LEU HA H 3.96 0.01 1 1335 175 175 LEU HB2 H 1.85 0.01 2 1336 175 175 LEU HG H 1.27 0.01 1 1337 175 175 LEU HD1 H 0.85 0.01 2 1338 175 175 LEU HD2 H 0.71 0.01 2 1339 175 175 LEU C C 181.4 0.20 1 1340 175 175 LEU CA C 57.5 0.20 1 1341 175 175 LEU CB C 41.4 0.20 1 1342 175 175 LEU N N 119.7 0.25 1 1343 176 176 ALA H H 8.31 0.01 1 1344 176 176 ALA HA H 3.98 0.01 1 1345 176 176 ALA HB H 1.43 0.01 1 1346 176 176 ALA C C 180.3 0.20 1 1347 176 176 ALA CA C 55.2 0.20 1 1348 176 176 ALA CB C 18.1 0.20 1 1349 176 176 ALA N N 122.2 0.25 1 1350 177 177 LEU H H 7.87 0.01 1 1351 177 177 LEU HA H 3.97 0.01 1 1352 177 177 LEU HB2 H 1.90 0.01 2 1353 177 177 LEU HD1 H 0.75 0.01 2 1354 177 177 LEU C C 180.4 0.20 1 1355 177 177 LEU CA C 57.8 0.20 1 1356 177 177 LEU CB C 42.1 0.20 1 1357 177 177 LEU N N 119.7 0.25 1 1358 178 178 GLN H H 8.06 0.01 1 1359 178 178 GLN HA H 3.96 0.01 1 1360 178 178 GLN HB2 H 2.00 0.01 2 1361 178 178 GLN HG2 H 2.20 0.01 2 1362 178 178 GLN C C 180.4 0.20 1 1363 178 178 GLN CA C 58.7 0.20 1 1364 178 178 GLN CB C 28.8 0.20 1 1365 178 178 GLN N N 117.7 0.25 1 1366 179 179 LYS H H 7.83 0.01 1 1367 179 179 LYS HA H 3.97 0.01 1 1368 179 179 LYS HB2 H 1.92 0.01 2 1369 179 179 LYS C C 179.3 0.20 1 1370 179 179 LYS CA C 58.1 0.20 1 1371 179 179 LYS CB C 31.6 0.20 1 1372 179 179 LYS N N 121.2 0.25 1 1373 180 180 GLU H H 7.64 0.01 1 1374 180 180 GLU HA H 4.00 0.01 1 1375 180 180 GLU HB2 H 2.10 0.01 2 1376 180 180 GLU HG2 H 1.99 0.01 2 1377 180 180 GLU C C 177.5 0.20 1 1378 180 180 GLU CA C 56.5 0.20 1 1379 180 180 GLU CB C 29.8 0.20 1 1380 180 180 GLU N N 116.8 0.25 1 1381 181 181 GLY H H 7.69 0.01 1 1382 181 181 GLY HA2 H 4.18 0.01 2 1383 181 181 GLY HA3 H 3.79 0.01 2 1384 181 181 GLY C C 175.6 0.20 1 1385 181 181 GLY CA C 45.6 0.20 1 1386 181 181 GLY N N 107.1 0.25 1 1387 182 182 LYS H H 7.68 0.01 1 1388 182 182 LYS HA H 4.18 0.01 1 1389 182 182 LYS HB2 H 1.60 0.01 2 1390 182 182 LYS HG2 H 1.27 0.01 2 1391 182 182 LYS C C 176.1 0.20 1 1392 182 182 LYS CA C 55.8 0.20 1 1393 182 182 LYS CB C 33.9 0.20 1 1394 182 182 LYS N N 120.7 0.25 1 1395 183 183 GLU H H 8.20 0.01 1 1396 183 183 GLU HA H 4.15 0.01 1 1397 183 183 GLU HB2 H 2.15 0.01 2 1398 183 183 GLU HG2 H 1.93 0.01 2 1399 183 183 GLU C C 177.0 0.20 1 1400 183 183 GLU CA C 56.5 0.20 1 1401 183 183 GLU CB C 31.0 0.20 1 1402 183 183 GLU N N 122.1 0.25 1 1403 184 184 GLY H H 8.08 0.01 1 1404 184 184 GLY HA2 H 4.26 0.01 2 1405 184 184 GLY HA3 H 3.81 0.01 2 1406 184 184 GLY C C 174.0 0.20 1 1407 184 184 GLY CA C 44.6 0.20 1 1408 184 184 GLY N N 109.9 0.25 1 1409 185 185 THR H H 7.95 0.01 1 1410 185 185 THR HA H 4.27 0.01 1 1411 185 185 THR HB H 4.10 0.01 1 1412 185 185 THR HG2 H 1.26 0.01 1 1413 185 185 THR C C 173.9 0.20 1 1414 185 185 THR CA C 63.0 0.20 1 1415 185 185 THR CB C 70.7 0.20 1 1416 185 185 THR N N 116.3 0.25 1 1417 186 186 GLN H H 8.54 0.01 1 1418 186 186 GLN HA H 5.63 0.01 1 1419 186 186 GLN HB2 H 1.97 0.01 2 1420 186 186 GLN HB3 H 1.87 0.01 2 1421 186 186 GLN HG2 H 2.36 0.01 2 1422 186 186 GLN C C 176.5 0.20 1 1423 186 186 GLN CA C 54.6 0.20 1 1424 186 186 GLN CB C 32.4 0.20 1 1425 186 186 GLN N N 124.1 0.25 1 1426 187 187 VAL H H 9.51 0.01 1 1427 187 187 VAL HA H 4.38 0.01 1 1428 187 187 VAL HB H 2.12 0.01 1 1429 187 187 VAL HG1 H 1.00 0.01 2 1430 187 187 VAL C C 175.3 0.20 1 1431 187 187 VAL CA C 61.1 0.20 1 1432 187 187 VAL CB C 35.9 0.20 1 1433 187 187 VAL N N 123.1 0.25 1 1434 188 188 GLU H H 8.80 0.01 1 1435 188 188 GLU HA H 4.69 0.01 1 1436 188 188 GLU HB2 H 2.28 0.01 2 1437 188 188 GLU HG2 H 1.93 0.01 2 1438 188 188 GLU C C 176.4 0.20 1 1439 188 188 GLU CA C 56.1 0.20 1 1440 188 188 GLU CB C 29.8 0.20 1 1441 188 188 GLU N N 126.5 0.25 1 1442 189 189 MET H H 8.51 0.01 1 1443 189 189 MET HA H 4.80 0.01 1 1444 189 189 MET HB2 H 2.15 0.01 2 1445 189 189 MET HG2 H 2.49 0.01 2 1446 189 189 MET C C 177.0 0.20 1 1447 189 189 MET CA C 54.1 0.20 1 1448 189 189 MET CB C 36.0 0.20 1 1449 189 189 MET N N 122.6 0.25 1 1450 190 190 ASP H H 8.96 0.01 1 1451 190 190 ASP HA H 4.32 0.01 1 1452 190 190 ASP HB2 H 2.71 0.01 2 1453 190 190 ASP C C 179.9 0.20 1 1454 190 190 ASP CA C 58.1 0.20 1 1455 190 190 ASP CB C 39.8 0.20 1 1456 190 190 ASP N N 122.6 0.25 1 1457 191 191 LEU H H 8.05 0.01 1 1458 191 191 LEU HA H 4.27 0.01 1 1459 191 191 LEU HB2 H 1.72 0.01 2 1460 191 191 LEU HB3 H 1.59 0.01 2 1461 191 191 LEU HG H 1.45 0.01 1 1462 191 191 LEU HD1 H 0.81 0.01 2 1463 191 191 LEU C C 178.6 0.20 1 1464 191 191 LEU CA C 55.6 0.20 1 1465 191 191 LEU CB C 44.6 0.20 1 1466 191 191 LEU N N 114.4 0.25 1 1467 192 192 GLY H H 7.39 0.01 1 1468 192 192 GLY HA2 H 4.77 0.01 2 1469 192 192 GLY HA3 H 3.87 0.01 2 1470 192 192 GLY C C 171.3 0.20 1 1471 192 192 GLY CA C 45.5 0.20 1 1472 192 192 GLY N N 105.6 0.25 1 1473 193 193 THR H H 7.90 0.01 1 1474 193 193 THR HA H 4.56 0.01 1 1475 193 193 THR HG2 H 1.18 0.01 1 1476 193 193 THR C C 174.1 0.20 1 1477 193 193 THR CA C 63.3 0.20 1 1478 193 193 THR CB C 70.6 0.20 1 1479 193 193 THR N N 116.7 0.25 1 1480 194 194 LEU H H 9.58 0.01 1 1481 194 194 LEU HA H 5.36 0.01 1 1482 194 194 LEU HB2 H 2.40 0.01 2 1483 194 194 LEU HG H 1.43 0.01 1 1484 194 194 LEU HD1 H 0.93 0.01 2 1485 194 194 LEU C C 175.7 0.20 1 1486 194 194 LEU CA C 53.8 0.20 1 1487 194 194 LEU CB C 45.1 0.20 1 1488 194 194 LEU N N 135.7 0.25 1 1489 195 195 THR H H 10.03 0.01 1 1490 195 195 THR HA H 5.23 0.01 1 1491 195 195 THR HB H 4.03 0.01 1 1492 195 195 THR HG2 H 1.12 0.01 1 1493 195 195 THR C C 173.9 0.20 1 1494 195 195 THR CA C 61.5 0.20 1 1495 195 195 THR CB C 71.3 0.20 1 1496 195 195 THR N N 122.6 0.25 1 1497 196 196 TYR H H 8.67 0.01 1 1498 196 196 TYR HA H 4.48 0.01 1 1499 196 196 TYR HB2 H 3.35 0.01 2 1500 196 196 TYR C C 176.7 0.20 1 1501 196 196 TYR CA C 55.0 0.20 1 1502 196 196 TYR CB C 38.8 0.20 1 1503 196 196 TYR N N 125.0 0.25 1 1504 197 197 LEU H H 8.41 0.01 1 1505 197 197 LEU HA H 4.27 0.01 1 1506 197 197 LEU HB2 H 1.73 0.01 2 1507 197 197 LEU HG H 1.28 0.01 1 1508 197 197 LEU HD1 H 1.03 0.01 2 1509 197 197 LEU HD2 H 0.66 0.01 2 1510 197 197 LEU CA C 53.9 0.20 1 1511 197 197 LEU CB C 41.6 0.20 1 1512 197 197 LEU N N 128.5 0.25 1 1513 198 198 SER HA H 3.34 0.01 1 1514 198 198 SER C C 173.3 0.20 1 1515 198 198 SER CA C 61.6 0.20 1 1516 198 198 SER CB C 62.5 0.20 1 1517 199 199 GLU H H 9.12 0.01 1 1518 199 199 GLU HA H 3.83 0.01 1 1519 199 199 GLU HB2 H 2.07 0.01 2 1520 199 199 GLU C C 176.4 0.20 1 1521 199 199 GLU CA C 56.9 0.20 1 1522 199 199 GLU CB C 27.1 0.20 1 1523 199 199 GLU N N 119.2 0.25 1 1524 200 200 GLY H H 8.08 0.01 1 1525 200 200 GLY HA2 H 4.48 0.01 2 1526 200 200 GLY HA3 H 3.97 0.01 2 1527 200 200 GLY C C 172.8 0.20 1 1528 200 200 GLY CA C 46.2 0.20 1 1529 200 200 GLY N N 102.7 0.25 1 1530 201 201 ARG H H 6.99 0.01 1 1531 201 201 ARG HA H 4.94 0.01 1 1532 201 201 ARG HB2 H 1.81 0.01 2 1533 201 201 ARG C C 174.8 0.20 1 1534 201 201 ARG CA C 56.0 0.20 1 1535 201 201 ARG CB C 31.5 0.20 1 1536 201 201 ARG N N 117.3 0.25 1 1537 202 202 TRP H H 9.75 0.01 1 1538 202 202 TRP HA H 5.36 0.01 1 1539 202 202 TRP HB2 H 3.42 0.01 2 1540 202 202 TRP HB3 H 3.28 0.01 2 1541 202 202 TRP HE1 H 10.08 0.01 1 1542 202 202 TRP C C 175.2 0.20 1 1543 202 202 TRP CA C 56.1 0.20 1 1544 202 202 TRP CB C 31.3 0.20 1 1545 202 202 TRP N N 124.0 0.25 1 1546 202 202 TRP NE1 N 129.4 0.25 1 1547 203 203 PHE H H 9.22 0.01 1 1548 203 203 PHE HA H 5.23 0.01 1 1549 203 203 PHE HB2 H 3.11 0.01 2 1550 203 203 PHE HB3 H 2.60 0.01 2 1551 203 203 PHE C C 173.3 0.20 1 1552 203 203 PHE CA C 56.3 0.20 1 1553 203 203 PHE CB C 44.0 0.20 1 1554 203 203 PHE N N 123.5 0.25 1 1555 204 204 LEU H H 9.16 0.01 1 1556 204 204 LEU HA H 5.05 0.01 1 1557 204 204 LEU HB2 H 1.44 0.01 2 1558 204 204 LEU HG H 0.99 0.01 1 1559 204 204 LEU HD1 H 0.45 0.01 2 1560 204 204 LEU HD2 H 0.08 0.01 2 1561 204 204 LEU C C 174.7 0.20 1 1562 204 204 LEU CA C 52.5 0.20 1 1563 204 204 LEU CB C 44.1 0.20 1 1564 204 204 LEU N N 130.3 0.25 1 1565 205 205 ALA H H 8.48 0.01 1 1566 205 205 ALA HA H 4.36 0.01 1 1567 205 205 ALA HB H 1.50 0.01 1 1568 205 205 ALA C C 177.5 0.20 1 1569 205 205 ALA CA C 50.5 0.20 1 1570 205 205 ALA CB C 18.6 0.20 1 1571 205 205 ALA N N 129.9 0.25 1 1572 206 206 LEU H H 7.34 0.01 1 1573 206 206 LEU HA H 4.11 0.01 1 1574 206 206 LEU HD1 H 1.13 0.01 2 1575 206 206 LEU HD2 H 0.62 0.01 2 1576 206 206 LEU C C 178.3 0.20 1 1577 206 206 LEU CA C 55.5 0.20 1 1578 206 206 LEU CB C 41.6 0.20 1 1579 206 206 LEU N N 125.5 0.25 1 1580 207 207 ARG H H 8.53 0.01 1 1581 207 207 ARG HA H 4.02 0.01 1 1582 207 207 ARG HB2 H 1.72 0.01 2 1583 207 207 ARG C C 177.1 0.20 1 1584 207 207 ARG CA C 58.8 0.20 1 1585 207 207 ARG CB C 30.0 0.20 1 1586 207 207 ARG N N 124.6 0.25 1 1587 208 208 GLU H H 8.05 0.01 1 1588 208 208 GLU HA H 4.73 0.01 1 1589 208 208 GLU HB2 H 1.90 0.01 2 1590 208 208 GLU CA C 52.1 0.20 1 1591 208 208 GLU CB C 31.3 0.20 1 1592 208 208 GLU N N 117.7 0.25 1 1593 209 209 PRO HA H 4.33 0.01 1 1594 209 209 PRO C C 177.1 0.20 1 1595 209 209 PRO CA C 63.1 0.20 1 1596 209 209 PRO CB C 29.8 0.20 1 1597 210 210 ILE H H 8.32 0.01 1 1598 210 210 ILE HA H 3.95 0.01 1 1599 210 210 ILE HB H 1.61 0.01 1 1600 210 210 ILE HG2 H 0.89 0.01 1 1601 210 210 ILE HD1 H 0.63 0.01 1 1602 210 210 ILE C C 174.8 0.20 1 1603 210 210 ILE CA C 60.8 0.20 1 1604 210 210 ILE CB C 40.5 0.20 1 1605 210 210 ILE N N 122.1 0.25 1 1606 211 211 ASN H H 8.51 0.01 1 1607 211 211 ASN HA H 5.52 0.01 1 1608 211 211 ASN HB2 H 2.47 0.01 2 1609 211 211 ASN C C 174.9 0.20 1 1610 211 211 ASN CA C 51.7 0.20 1 1611 211 211 ASN CB C 40.3 0.20 1 1612 211 211 ASN N N 126.0 0.25 1 1613 212 212 ALA H H 8.95 0.01 1 1614 212 212 ALA HA H 4.74 0.01 1 1615 212 212 ALA HB H 0.96 0.01 1 1616 212 212 ALA C C 175.7 0.20 1 1617 212 212 ALA CA C 50.0 0.20 1 1618 212 212 ALA CB C 20.9 0.20 1 1619 212 212 ALA N N 124.5 0.25 1 1620 213 213 ASP H H 9.90 0.01 1 1621 213 213 ASP HA H 4.96 0.01 1 1622 213 213 ASP HB2 H 2.79 0.01 2 1623 213 213 ASP HB3 H 2.62 0.01 2 1624 213 213 ASP C C 177.1 0.20 1 1625 213 213 ASP CA C 55.4 0.20 1 1626 213 213 ASP CB C 41.8 0.20 1 1627 213 213 ASP N N 125.5 0.25 1 1628 214 214 THR H H 8.39 0.01 1 1629 214 214 THR HA H 5.47 0.01 1 1630 214 214 THR HB H 4.07 0.01 1 1631 214 214 THR HG2 H 1.03 0.01 1 1632 214 214 THR C C 176.0 0.20 1 1633 214 214 THR CA C 60.6 0.20 1 1634 214 214 THR CB C 74.4 0.20 1 1635 214 214 THR N N 113.4 0.25 1 1636 215 215 THR H H 8.70 0.01 1 1637 215 215 THR HA H 5.47 0.01 1 1638 215 215 THR HB H 3.99 0.01 1 1639 215 215 THR HG2 H 1.20 0.01 1 1640 215 215 THR C C 175.5 0.20 1 1641 215 215 THR CA C 60.9 0.20 1 1642 215 215 THR CB C 71.6 0.20 1 1643 215 215 THR N N 112.8 0.25 1 1644 216 216 PHE H H 9.07 0.01 1 1645 216 216 PHE HA H 5.22 0.01 1 1646 216 216 PHE HB2 H 3.54 0.01 2 1647 216 216 PHE HB3 H 2.94 0.01 2 1648 216 216 PHE C C 174.8 0.20 1 1649 216 216 PHE CA C 58.0 0.20 1 1650 216 216 PHE CB C 39.0 0.20 1 1651 216 216 PHE N N 127.0 0.25 1 1652 217 217 THR H H 8.84 0.01 1 1653 217 217 THR HA H 4.54 0.01 1 1654 217 217 THR HB H 4.24 0.01 1 1655 217 217 THR HG2 H 0.90 0.01 1 1656 217 217 THR C C 171.2 0.20 1 1657 217 217 THR CA C 59.6 0.20 1 1658 217 217 THR CB C 69.0 0.20 1 1659 217 217 THR N N 124.1 0.25 1 1660 218 218 SER H H 8.45 0.01 1 1661 218 218 SER HA H 4.64 0.01 1 1662 218 218 SER C C 172.6 0.20 1 1663 218 218 SER CA C 55.5 0.20 1 1664 218 218 SER CB C 66.5 0.20 1 1665 218 218 SER N N 114.4 0.25 1 1666 219 219 PHE H H 7.76 0.01 1 1667 219 219 PHE HA H 4.39 0.01 1 1668 219 219 PHE HB2 H 3.12 0.01 2 1669 219 219 PHE C C 174.1 0.20 1 1670 219 219 PHE CA C 56.8 0.20 1 1671 219 219 PHE CB C 42.5 0.20 1 1672 219 219 PHE N N 119.2 0.25 1 1673 220 220 SER H H 7.45 0.01 1 1674 220 220 SER HA H 4.20 0.01 1 1675 220 220 SER HB2 H 3.71 0.01 2 1676 220 220 SER HB3 H 3.41 0.01 2 1677 220 220 SER C C 171.7 0.20 1 1678 220 220 SER CA C 57.5 0.20 1 1679 220 220 SER CB C 65.9 0.20 1 1680 220 220 SER N N 122.6 0.25 1 1681 221 221 GLU H H 7.62 0.01 1 1682 221 221 GLU HA H 4.03 0.01 1 1683 221 221 GLU HB2 H 2.27 0.01 2 1684 221 221 GLU HG2 H 1.91 0.01 2 1685 221 221 GLU C C 176.1 0.20 1 1686 221 221 GLU CA C 56.2 0.20 1 1687 221 221 GLU CB C 30.6 0.20 1 1688 221 221 GLU N N 121.1 0.25 1 1689 222 222 ASP H H 8.27 0.01 1 1690 222 222 ASP CA C 53.0 0.20 1 1691 222 222 ASP CB C 41.1 0.20 1 1692 222 222 ASP N N 121.1 0.25 1 stop_ save_