data_18647 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 13C, and 15N backbone resonance assignments of the L124D mutant of StAR-related lipid transfer domain protein 4 (StARD4) ; _BMRB_accession_number 18647 _BMRB_flat_file_name bmr18647.str _Entry_type original _Submission_date 2012-08-07 _Accession_date 2012-08-07 _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 Dikiy Igor . . 2 Ramlall Trudy F. . 3 Eliezer David . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 506 "13C chemical shifts" 619 "15N chemical shifts" 200 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2014-02-19 update BMRB 'update entry citation' 2012-10-18 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title '1H, 13C, and 15N backbone resonance assignments of the L124D mutant of StAR-related lipid transfer domain protein 4 (StARD4).' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 22918595 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Dikiy Igor . . 2 Ramlall Trudy F. . 3 Eliezer David . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_name_full 'Biomolecular NMR assignments' _Journal_volume 7 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 245 _Page_last 248 _Year 2013 _Details . loop_ _Keyword cholesterol StARD4 'START domain' 'sterol transport' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name mStARD4L124D _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label mStARD4L124D $mStARD4L124D stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_mStARD4L124D _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common mStARD4L124D _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 224 _Mol_residue_sequence ; MADPESPWSQIGRKIKLEGL SDVASISTKLQNTLIQYHSI KEDEWRVAKKVKDVTVWRKP SEEFNGYLYKAQGVMDDVVN NVIDHIRPGPWRLDWDRLMT SLDVLEHFEENCCVMRYTTA GQLDNIISPREFVDFSYTVG YEEGLLSCGVSVEWSETRPE FVRGYNHPCGWFCVPLKDSP SQSLLTGYIQTDLRGMIPQS AVDTAMASTLANFYSDLRKG LRKA ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ALA 3 ASP 4 PRO 5 GLU 6 SER 7 PRO 8 TRP 9 SER 10 GLN 11 ILE 12 GLY 13 ARG 14 LYS 15 ILE 16 LYS 17 LEU 18 GLU 19 GLY 20 LEU 21 SER 22 ASP 23 VAL 24 ALA 25 SER 26 ILE 27 SER 28 THR 29 LYS 30 LEU 31 GLN 32 ASN 33 THR 34 LEU 35 ILE 36 GLN 37 TYR 38 HIS 39 SER 40 ILE 41 LYS 42 GLU 43 ASP 44 GLU 45 TRP 46 ARG 47 VAL 48 ALA 49 LYS 50 LYS 51 VAL 52 LYS 53 ASP 54 VAL 55 THR 56 VAL 57 TRP 58 ARG 59 LYS 60 PRO 61 SER 62 GLU 63 GLU 64 PHE 65 ASN 66 GLY 67 TYR 68 LEU 69 TYR 70 LYS 71 ALA 72 GLN 73 GLY 74 VAL 75 MET 76 ASP 77 ASP 78 VAL 79 VAL 80 ASN 81 ASN 82 VAL 83 ILE 84 ASP 85 HIS 86 ILE 87 ARG 88 PRO 89 GLY 90 PRO 91 TRP 92 ARG 93 LEU 94 ASP 95 TRP 96 ASP 97 ARG 98 LEU 99 MET 100 THR 101 SER 102 LEU 103 ASP 104 VAL 105 LEU 106 GLU 107 HIS 108 PHE 109 GLU 110 GLU 111 ASN 112 CYS 113 CYS 114 VAL 115 MET 116 ARG 117 TYR 118 THR 119 THR 120 ALA 121 GLY 122 GLN 123 LEU 124 ASP 125 ASN 126 ILE 127 ILE 128 SER 129 PRO 130 ARG 131 GLU 132 PHE 133 VAL 134 ASP 135 PHE 136 SER 137 TYR 138 THR 139 VAL 140 GLY 141 TYR 142 GLU 143 GLU 144 GLY 145 LEU 146 LEU 147 SER 148 CYS 149 GLY 150 VAL 151 SER 152 VAL 153 GLU 154 TRP 155 SER 156 GLU 157 THR 158 ARG 159 PRO 160 GLU 161 PHE 162 VAL 163 ARG 164 GLY 165 TYR 166 ASN 167 HIS 168 PRO 169 CYS 170 GLY 171 TRP 172 PHE 173 CYS 174 VAL 175 PRO 176 LEU 177 LYS 178 ASP 179 SER 180 PRO 181 SER 182 GLN 183 SER 184 LEU 185 LEU 186 THR 187 GLY 188 TYR 189 ILE 190 GLN 191 THR 192 ASP 193 LEU 194 ARG 195 GLY 196 MET 197 ILE 198 PRO 199 GLN 200 SER 201 ALA 202 VAL 203 ASP 204 THR 205 ALA 206 MET 207 ALA 208 SER 209 THR 210 LEU 211 ALA 212 ASN 213 PHE 214 TYR 215 SER 216 ASP 217 LEU 218 ARG 219 LYS 220 GLY 221 LEU 222 ARG 223 LYS 224 ALA stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-08-12 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 1JSS "Crystal Structure Of The Mus Musculus Cholesterol-Regulated Start Protein 4 (Stard4)." 100.00 224 98.66 99.11 3.68e-163 PDB 5BRL "Crystal Structure Of L124d Stard4" 93.75 210 100.00 100.00 2.54e-154 DBJ BAC31233 "unnamed protein product [Mus musculus]" 100.00 224 98.66 99.11 3.68e-163 DBJ BAC31335 "unnamed protein product [Mus musculus]" 100.00 224 98.66 99.11 3.68e-163 DBJ BAC35805 "unnamed protein product [Mus musculus]" 100.00 224 98.66 99.11 3.68e-163 DBJ BAC37423 "unnamed protein product [Mus musculus]" 100.00 224 98.66 99.11 3.68e-163 DBJ BAC39424 "unnamed protein product [Mus musculus]" 100.00 224 98.66 99.11 3.68e-163 GB AAH05642 "StAR-related lipid transfer (START) domain containing 4 [Mus musculus]" 100.00 224 99.55 99.55 2.61e-164 GB AAL87127 "StAR-related lipid transfer protein 4 [Mus musculus]" 100.00 224 98.66 99.11 3.68e-163 GB AAL87128 "StAR-related lipid transfer protein 4 [Mus musculus]" 100.00 224 99.55 99.55 2.61e-164 GB EDK97071 "StAR-related lipid transfer (START) domain containing 4 [Mus musculus]" 100.00 224 98.21 98.66 1.86e-162 REF NP_598535 "stAR-related lipid transfer protein 4 [Mus musculus]" 100.00 224 98.66 99.11 3.68e-163 SP Q99JV5 "RecName: Full=StAR-related lipid transfer protein 4; AltName: Full=START domain-containing protein 4; Short=StARD4" 100.00 224 99.55 99.55 2.61e-164 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $mStARD4L124D Mouse 10090 Eukaryota Metazoa Mus musculus stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Variant _Vector_name $mStARD4L124D 'recombinant technology' . Escherichia coli BL21 DE3 pET-SUMO-MSTR stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $mStARD4L124D . mM 0.5 1 '[U-99% 13C; U-99% 15N]' H2O 90 % . . 'natural abundance' D2O 10 % . . 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' 'peak picking' stop_ _Details . save_ save_VNMR _Saveframe_category software _Name VNMR _Version . loop_ _Vendor _Address _Electronic_address Varian . . stop_ loop_ _Task collection stop_ _Details . save_ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection stop_ _Details . save_ save_TALOS _Saveframe_category software _Name TALOS _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_3D_HBHA(CO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HN(COCA)CB_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(COCA)CB' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.04 . M pH 6.4 . pH pressure 1 . atm temperature 296 . 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 external indirect cylindrical 'separate tube (no insert) similar to the experimental sample tube' parallel 0.25144952 DSS H 1 'methyl protons' ppm 0 external direct cylindrical 'separate tube (no insert) similar to the experimental sample tube' parallel 1.0 DSS N 15 'methyl protons' ppm 0 external indirect cylindrical 'separate tube (no insert) similar to the experimental sample tube' parallel 0.10132905 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D HNCA' '3D HN(CO)CA' '3D HBHA(CO)NH' '3D HNCO' '3D HNCACB' '3D HN(COCA)CB' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name mStARD4L124D _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 2 2 ALA HA H 4.2953 0.0000 1 2 2 2 ALA HB H 1.3224 0.0000 1 3 2 2 ALA C C 176.7609 0.0000 1 4 2 2 ALA CA C 52.3594 0.0000 1 5 2 2 ALA CB C 18.6796 0.0000 1 6 3 3 ASP H H 8.4203 0.0000 1 7 3 3 ASP CA C 52.3594 0.0000 1 8 3 3 ASP CB C 40.4275 0.0000 1 9 3 3 ASP N N 121.9640 0.0000 1 10 4 4 PRO HA H 4.3589 0.0000 1 11 4 4 PRO C C 176.9329 0.0000 1 12 4 4 PRO CA C 63.2992 0.0000 1 13 4 4 PRO CB C 31.6394 0.0000 1 14 5 5 GLU H H 8.4191 0.0000 1 15 5 5 GLU HA H 4.2595 0.0000 1 16 5 5 GLU HB2 H 1.9673 0.0000 2 17 5 5 GLU C C 176.3849 0.0000 1 18 5 5 GLU CA C 56.2409 0.0000 1 19 5 5 GLU CB C 29.4847 0.0000 1 20 5 5 GLU N N 119.6968 0.0000 1 21 6 6 SER H H 8.2149 0.0000 1 22 6 6 SER CA C 56.2159 0.0000 1 23 6 6 SER CB C 62.9842 0.0000 1 24 6 6 SER N N 118.1986 0.0000 1 25 7 7 PRO CA C 63.5537 0.0000 1 26 7 7 PRO CB C 31.0557 0.0000 1 27 8 8 TRP CA C 57.1081 0.0000 1 28 8 8 TRP CB C 28.5215 0.0000 1 29 9 9 SER HA H 4.3720 0.0000 1 30 9 9 SER C C 176.4274 0.0000 1 31 9 9 SER CA C 58.3881 0.0000 1 32 9 9 SER CB C 63.6694 0.0000 1 33 10 10 GLN H H 8.0617 0.0000 1 34 10 10 GLN HA H 4.1458 0.0000 1 35 10 10 GLN C C 177.0096 0.0000 1 36 10 10 GLN CA C 56.1116 0.0000 1 37 10 10 GLN CB C 28.8266 0.0000 1 38 10 10 GLN N N 121.1946 0.0000 1 39 11 11 ILE H H 7.8267 0.0000 1 40 11 11 ILE HA H 3.9478 0.0000 1 41 11 11 ILE HB H 1.7800 0.0000 1 42 11 11 ILE C C 177.1622 0.0000 1 43 11 11 ILE CA C 61.4635 0.0000 1 44 11 11 ILE CB C 37.7928 0.0000 1 45 11 11 ILE N N 120.2378 0.0000 1 46 12 12 GLY H H 8.3318 0.0000 1 47 12 12 GLY HA2 H 3.8712 0.0000 2 48 12 12 GLY C C 174.5734 0.0000 1 49 12 12 GLY CA C 45.4681 0.0000 1 50 12 12 GLY N N 110.1260 0.0000 1 51 13 13 ARG H H 7.8977 0.0000 1 52 13 13 ARG CA C 56.3921 0.0000 1 53 13 13 ARG CB C 29.4321 0.0000 1 54 13 13 ARG N N 119.4864 0.0000 1 55 18 18 GLU HA H 4.3764 0.0000 1 56 18 18 GLU HB2 H 2.0383 0.0000 2 57 18 18 GLU C C 176.6791 0.0000 1 58 18 18 GLU CA C 56.6477 0.0000 1 59 18 18 GLU CB C 29.6396 0.0000 1 60 19 19 GLY H H 8.1106 0.0000 1 61 19 19 GLY HA2 H 4.0817 0.0000 2 62 19 19 GLY C C 173.9850 0.0000 1 63 19 19 GLY CA C 44.9593 0.0000 1 64 19 19 GLY N N 108.5517 0.0000 1 65 20 20 LEU H H 8.4315 0.0000 1 66 20 20 LEU CA C 56.4279 0.0000 1 67 20 20 LEU CB C 41.0348 0.0000 1 68 20 20 LEU N N 121.0501 0.0000 1 69 21 21 SER HA H 4.2880 0.0000 1 70 21 21 SER HB2 H 3.8600 0.0000 2 71 21 21 SER C C 175.4876 0.0000 1 72 21 21 SER CA C 60.3876 0.0000 1 73 21 21 SER CB C 62.2972 0.0000 1 74 22 22 ASP H H 7.8578 0.0000 1 75 22 22 ASP HA H 4.6102 0.0000 1 76 22 22 ASP C C 176.8624 0.0000 1 77 22 22 ASP CA C 55.6577 0.0000 1 78 22 22 ASP CB C 41.4106 0.0000 1 79 22 22 ASP N N 121.5719 0.0000 1 80 23 23 VAL H H 7.6812 0.0000 1 81 23 23 VAL HA H 3.2507 0.0000 1 82 23 23 VAL HB H 1.9428 0.0000 1 83 23 23 VAL C C 178.0807 0.0000 1 84 23 23 VAL CA C 65.6757 0.0000 1 85 23 23 VAL CB C 31.0374 0.0000 1 86 23 23 VAL N N 120.0631 0.0000 1 87 24 24 ALA H H 8.2815 0.0000 1 88 24 24 ALA HA H 4.0459 0.0000 1 89 24 24 ALA HB H 1.4141 0.0000 1 90 24 24 ALA C C 179.8505 0.0000 1 91 24 24 ALA CA C 55.1680 0.0000 1 92 24 24 ALA CB C 17.4621 0.0000 1 93 24 24 ALA N N 124.1676 0.0000 1 94 25 25 SER H H 7.7759 0.0000 1 95 25 25 SER HA H 4.1458 0.0000 1 96 25 25 SER C C 176.9714 0.0000 1 97 25 25 SER CA C 60.7202 0.0000 1 98 25 25 SER CB C 62.3022 0.0000 1 99 25 25 SER N N 113.2988 0.0000 1 100 26 26 ILE H H 7.7798 0.0000 1 101 26 26 ILE HA H 3.6963 0.0000 1 102 26 26 ILE C C 177.3644 0.0000 1 103 26 26 ILE CA C 63.9126 0.0000 1 104 26 26 ILE CB C 36.8390 0.0000 1 105 26 26 ILE N N 120.5607 0.0000 1 106 27 27 SER H H 8.0742 0.0000 1 107 27 27 SER HA H 3.6376 0.0000 1 108 27 27 SER HB2 H 2.8943 0.0000 2 109 27 27 SER C C 175.3245 0.0000 1 110 27 27 SER CA C 63.0904 0.0000 1 111 27 27 SER CB C 60.9109 0.0000 1 112 27 27 SER N N 116.5132 0.0000 1 113 28 28 THR H H 7.6510 0.0000 1 114 28 28 THR HA H 4.0506 0.0000 1 115 28 28 THR C C 176.0443 0.0000 1 116 28 28 THR CA C 66.5283 0.0000 1 117 28 28 THR CB C 68.6420 0.0000 1 118 28 28 THR N N 117.6718 0.0000 1 119 29 29 LYS H H 7.6872 0.0000 1 120 29 29 LYS C C 179.8855 0.0000 1 121 29 29 LYS CA C 59.4710 0.0000 1 122 29 29 LYS CB C 31.6025 0.0000 1 123 29 29 LYS N N 121.6870 0.0000 1 124 30 30 LEU H H 8.8040 0.0000 1 125 30 30 LEU C C 177.6961 0.0000 1 126 30 30 LEU CA C 58.7968 0.0000 1 127 30 30 LEU CB C 41.8966 0.0000 1 128 30 30 LEU N N 122.9288 0.0000 1 129 31 31 GLN H H 8.4157 0.0000 1 130 31 31 GLN HA H 3.9227 0.0000 1 131 31 31 GLN C C 177.1545 0.0000 1 132 31 31 GLN CA C 59.5246 0.0000 1 133 31 31 GLN CB C 27.8557 0.0000 1 134 31 31 GLN N N 119.5361 0.0000 1 135 32 32 ASN H H 8.2041 0.0000 1 136 32 32 ASN HA H 4.3916 0.0000 1 137 32 32 ASN HB2 H 2.9189 0.0000 2 138 32 32 ASN C C 178.3455 0.0000 1 139 32 32 ASN CA C 56.2313 0.0000 1 140 32 32 ASN CB C 37.5844 0.0000 1 141 32 32 ASN N N 115.6166 0.0000 1 142 33 33 THR H H 8.2082 0.0000 1 143 33 33 THR HA H 3.6894 0.0000 1 144 33 33 THR C C 173.9044 0.0000 1 145 33 33 THR CA C 66.8628 0.0000 1 146 33 33 THR CB C 68.4881 0.0000 1 147 33 33 THR N N 120.0587 0.0000 1 148 34 34 LEU H H 7.7958 0.0000 1 149 34 34 LEU HA H 3.4330 0.0000 1 150 34 34 LEU C C 179.2473 0.0000 1 151 34 34 LEU CA C 54.8844 0.0000 1 152 34 34 LEU CB C 37.6955 0.0000 1 153 34 34 LEU N N 124.8806 0.0000 1 154 35 35 ILE H H 8.1887 0.0000 1 155 35 35 ILE HA H 3.5588 0.0000 1 156 35 35 ILE C C 178.7962 0.0000 1 157 35 35 ILE CA C 66.6165 0.0000 1 158 35 35 ILE CB C 37.5034 0.0000 1 159 35 35 ILE N N 119.1632 0.0000 1 160 36 36 GLN H H 7.7181 0.0000 1 161 36 36 GLN HA H 4.0148 0.0000 1 162 36 36 GLN HB2 H 2.3208 0.0000 2 163 36 36 GLN C C 180.8329 0.0000 1 164 36 36 GLN CA C 59.4976 0.0000 1 165 36 36 GLN CB C 26.6500 0.0000 1 166 36 36 GLN N N 121.9447 0.0000 1 167 37 37 TYR H H 8.1919 0.0000 1 168 37 37 TYR HA H 4.5064 0.0000 1 169 37 37 TYR HB2 H 2.6551 0.0000 2 170 37 37 TYR C C 178.4523 0.0000 1 171 37 37 TYR CA C 56.9842 0.0000 1 172 37 37 TYR CB C 34.2694 0.0000 1 173 37 37 TYR N N 121.9977 0.0000 1 174 38 38 HIS H H 7.9728 0.0000 1 175 38 38 HIS HA H 5.2111 0.0000 1 176 38 38 HIS HB2 H 2.6602 0.0000 2 177 38 38 HIS C C 176.0756 0.0000 1 178 38 38 HIS CA C 55.1264 0.0000 1 179 38 38 HIS CB C 31.4250 0.0000 1 180 38 38 HIS N N 119.5992 0.0000 1 181 39 39 SER H H 7.6218 0.0000 1 182 39 39 SER HA H 4.3999 0.0000 1 183 39 39 SER HB2 H 3.9571 0.0000 2 184 39 39 SER C C 174.5827 0.0000 1 185 39 39 SER CA C 57.7307 0.0000 1 186 39 39 SER CB C 64.1404 0.0000 1 187 39 39 SER N N 112.3443 0.0000 1 188 40 40 ILE H H 7.4638 0.0000 1 189 40 40 ILE HA H 3.7536 0.0000 1 190 40 40 ILE HB H 2.0729 0.0000 1 191 40 40 ILE C C 177.4930 0.0000 1 192 40 40 ILE CA C 63.5002 0.0000 1 193 40 40 ILE CB C 36.8838 0.0000 1 194 40 40 ILE N N 125.0746 0.0000 1 195 41 41 LYS H H 8.7205 0.0000 1 196 41 41 LYS HA H 4.0905 0.0000 1 197 41 41 LYS HB2 H 1.9424 0.0000 2 198 41 41 LYS C C 177.0088 0.0000 1 199 41 41 LYS CA C 57.0629 0.0000 1 200 41 41 LYS CB C 32.4747 0.0000 1 201 41 41 LYS N N 130.0803 0.0000 1 202 42 42 GLU H H 8.4769 0.0000 1 203 42 42 GLU HA H 3.8796 0.0000 1 204 42 42 GLU HB2 H 1.9734 0.0000 2 205 42 42 GLU C C 177.8439 0.0000 1 206 42 42 GLU CA C 59.9804 0.0000 1 207 42 42 GLU CB C 29.2960 0.0000 1 208 42 42 GLU N N 119.6968 0.0000 1 209 43 43 ASP H H 8.2298 0.0000 1 210 43 43 ASP HA H 4.4496 0.0000 1 211 43 43 ASP HB2 H 2.6682 0.0000 2 212 43 43 ASP C C 177.0083 0.0000 1 213 43 43 ASP CA C 55.5079 0.0000 1 214 43 43 ASP CB C 39.6706 0.0000 1 215 43 43 ASP N N 113.5573 0.0000 1 216 44 44 GLU H H 7.6253 0.0000 1 217 44 44 GLU HA H 4.1111 0.0000 1 218 44 44 GLU HB2 H 1.6526 0.0000 2 219 44 44 GLU C C 175.8236 0.0000 1 220 44 44 GLU CA C 56.7968 0.0000 1 221 44 44 GLU CB C 28.9422 0.0000 1 222 44 44 GLU N N 117.2066 0.0000 1 223 45 45 TRP H H 7.3761 0.0000 1 224 45 45 TRP HA H 4.5606 0.0000 1 225 45 45 TRP C C 176.2444 0.0000 1 226 45 45 TRP CA C 55.7694 0.0000 1 227 45 45 TRP CB C 31.2288 0.0000 1 228 45 45 TRP N N 118.4706 0.0000 1 229 46 46 ARG H H 8.7013 0.0000 1 230 46 46 ARG HA H 5.0745 0.0000 1 231 46 46 ARG HB2 H 1.9160 0.0000 2 232 46 46 ARG C C 176.8530 0.0000 1 233 46 46 ARG CA C 53.7063 0.0000 1 234 46 46 ARG CB C 31.3382 0.0000 1 235 46 46 ARG N N 119.8580 0.0000 1 236 47 47 VAL H H 9.2131 0.0000 1 237 47 47 VAL HA H 3.7190 0.0000 1 238 47 47 VAL HB H 1.9481 0.0000 1 239 47 47 VAL C C 175.4404 0.0000 1 240 47 47 VAL CA C 65.2030 0.0000 1 241 47 47 VAL CB C 31.3496 0.0000 1 242 47 47 VAL N N 125.2999 0.0000 1 243 48 48 ALA H H 9.8758 0.0000 1 244 48 48 ALA HA H 4.5944 0.0000 1 245 48 48 ALA HB H 1.2362 0.0000 1 246 48 48 ALA C C 177.0029 0.0000 1 247 48 48 ALA CA C 52.1654 0.0000 1 248 48 48 ALA CB C 19.5968 0.0000 1 249 48 48 ALA N N 131.5046 0.0000 1 250 49 49 LYS H H 8.0580 0.0000 1 251 49 49 LYS HA H 4.2532 0.0000 1 252 49 49 LYS HB2 H 1.7418 0.0000 2 253 49 49 LYS HB3 H 1.3300 0.0000 2 254 49 49 LYS C C 172.6253 0.0000 1 255 49 49 LYS CA C 56.3045 0.0000 1 256 49 49 LYS CB C 35.2443 0.0000 1 257 49 49 LYS N N 118.3911 0.0000 1 258 50 50 LYS H H 8.6767 0.0000 1 259 50 50 LYS HA H 4.7506 0.0000 1 260 50 50 LYS HB2 H 1.7356 0.0000 2 261 50 50 LYS C C 175.1744 0.0000 1 262 50 50 LYS CA C 56.1639 0.0000 1 263 50 50 LYS CB C 33.9122 0.0000 1 264 50 50 LYS N N 127.0378 0.0000 1 265 51 51 VAL H H 8.2937 0.0000 1 266 51 51 VAL HA H 4.4154 0.0000 1 267 51 51 VAL HB H 2.2003 0.0000 1 268 51 51 VAL C C 175.3136 0.0000 1 269 51 51 VAL CA C 60.3090 0.0000 1 270 51 51 VAL CB C 32.9509 0.0000 1 271 51 51 VAL N N 122.4552 0.0000 1 272 52 52 LYS H H 8.7009 0.0000 1 273 52 52 LYS HA H 3.8002 0.0000 1 274 52 52 LYS HB2 H 1.8312 0.0000 2 275 52 52 LYS C C 176.3565 0.0000 1 276 52 52 LYS CA C 59.2836 0.0000 1 277 52 52 LYS CB C 30.4246 0.0000 1 278 52 52 LYS N N 123.2987 0.0000 1 279 53 53 ASP H H 8.3138 0.0000 1 280 53 53 ASP HA H 4.5374 0.0000 1 281 53 53 ASP HB2 H 2.8594 0.0000 2 282 53 53 ASP HB3 H 2.6657 0.0000 2 283 53 53 ASP C C 175.5886 0.0000 1 284 53 53 ASP CA C 54.7430 0.0000 1 285 53 53 ASP CB C 40.3943 0.0000 1 286 53 53 ASP N N 117.1699 0.0000 1 287 54 54 VAL H H 7.6028 0.0000 1 288 54 54 VAL HA H 4.3633 0.0000 1 289 54 54 VAL HB H 1.8021 0.0000 1 290 54 54 VAL C C 173.8198 0.0000 1 291 54 54 VAL CA C 61.8622 0.0000 1 292 54 54 VAL CB C 33.4310 0.0000 1 293 54 54 VAL N N 120.7523 0.0000 1 294 55 55 THR H H 7.5235 0.0000 1 295 55 55 THR HA H 4.3440 0.0000 1 296 55 55 THR HB H 2.9469 0.0000 1 297 55 55 THR C C 171.1497 0.0000 1 298 55 55 THR CA C 61.7733 0.0000 1 299 55 55 THR CB C 69.7473 0.0000 1 300 55 55 THR N N 122.2027 0.0000 1 301 56 56 VAL H H 8.4644 0.0000 1 302 56 56 VAL HA H 5.0569 0.0000 1 303 56 56 VAL HB H 2.0271 0.0000 1 304 56 56 VAL C C 175.1971 0.0000 1 305 56 56 VAL CA C 60.2950 0.0000 1 306 56 56 VAL CB C 33.4312 0.0000 1 307 56 56 VAL N N 123.9505 0.0000 1 308 57 57 TRP H H 10.5755 0.0000 1 309 57 57 TRP HA H 5.5764 0.0000 1 310 57 57 TRP HB2 H 2.8266 0.0000 2 311 57 57 TRP C C 174.9423 0.0000 1 312 57 57 TRP CA C 57.3860 0.0000 1 313 57 57 TRP CB C 35.3547 0.0000 1 314 57 57 TRP N N 129.1551 0.0000 1 315 58 58 ARG H H 9.7931 0.0000 1 316 58 58 ARG HA H 5.9134 0.0000 1 317 58 58 ARG C C 174.8725 0.0000 1 318 58 58 ARG CA C 54.6615 0.0000 1 319 58 58 ARG CB C 34.3091 0.0000 1 320 58 58 ARG N N 115.0256 0.0000 1 321 59 59 LYS H H 9.3521 0.0000 1 322 59 59 LYS CA C 54.5270 0.0000 1 323 59 59 LYS CB C 31.3068 0.0000 1 324 59 59 LYS N N 119.5596 0.0000 1 325 60 60 PRO HA H 3.8656 0.0000 1 326 60 60 PRO C C 176.1582 0.0000 1 327 60 60 PRO CA C 64.4819 0.0000 1 328 60 60 PRO CB C 31.0200 0.0000 1 329 61 61 SER H H 8.4701 0.0000 1 330 61 61 SER HA H 4.1915 0.0000 1 331 61 61 SER C C 175.7998 0.0000 1 332 61 61 SER CA C 57.9115 0.0000 1 333 61 61 SER CB C 62.9627 0.0000 1 334 61 61 SER N N 116.9941 0.0000 1 335 62 62 GLU H H 9.1598 0.0000 1 336 62 62 GLU HA H 4.4295 0.0000 1 337 62 62 GLU HB2 H 2.2628 0.0000 2 338 62 62 GLU C C 176.6734 0.0000 1 339 62 62 GLU CA C 56.8510 0.0000 1 340 62 62 GLU CB C 29.3539 0.0000 1 341 62 62 GLU N N 124.8983 0.0000 1 342 63 63 GLU H H 8.8283 0.0000 1 343 63 63 GLU HA H 4.3313 0.0000 1 344 63 63 GLU C C 175.0731 0.0000 1 345 63 63 GLU CA C 55.8219 0.0000 1 346 63 63 GLU CB C 30.2035 0.0000 1 347 63 63 GLU N N 116.0179 0.0000 1 348 64 64 PHE H H 7.3984 0.0000 1 349 64 64 PHE HA H 4.5893 0.0000 1 350 64 64 PHE HB2 H 3.0552 0.0000 2 351 64 64 PHE C C 172.5361 0.0000 1 352 64 64 PHE CA C 54.7250 0.0000 1 353 64 64 PHE CB C 38.3949 0.0000 1 354 64 64 PHE N N 115.6302 0.0000 1 355 65 65 ASN H H 8.4230 0.0000 1 356 65 65 ASN HA H 4.5208 0.0000 1 357 65 65 ASN HB2 H 2.7203 0.0000 2 358 65 65 ASN C C 173.4439 0.0000 1 359 65 65 ASN CA C 52.2730 0.0000 1 360 65 65 ASN CB C 36.0292 0.0000 1 361 65 65 ASN N N 117.5641 0.0000 1 362 66 66 GLY H H 6.4107 0.0000 1 363 66 66 GLY HA2 H 3.6061 0.0000 2 364 66 66 GLY HA3 H 3.0886 0.0000 2 365 66 66 GLY C C 171.7304 0.0000 1 366 66 66 GLY CA C 44.7406 0.0000 1 367 66 66 GLY N N 111.2723 0.0000 1 368 67 67 TYR H H 8.6051 0.0000 1 369 67 67 TYR HA H 4.3734 0.0000 1 370 67 67 TYR C C 174.0310 0.0000 1 371 67 67 TYR CA C 58.8382 0.0000 1 372 67 67 TYR CB C 40.8638 0.0000 1 373 67 67 TYR N N 120.0188 0.0000 1 374 68 68 LEU H H 8.9770 0.0000 1 375 68 68 LEU HA H 4.9695 0.0000 1 376 68 68 LEU C C 174.4993 0.0000 1 377 68 68 LEU CA C 54.7334 0.0000 1 378 68 68 LEU CB C 43.2724 0.0000 1 379 68 68 LEU N N 123.3678 0.0000 1 380 69 69 TYR H H 9.6662 0.0000 1 381 69 69 TYR HA H 5.4229 0.0000 1 382 69 69 TYR C C 174.2014 0.0000 1 383 69 69 TYR CA C 57.4795 0.0000 1 384 69 69 TYR CB C 44.6048 0.0000 1 385 69 69 TYR N N 125.3630 0.0000 1 386 70 70 LYS H H 8.6144 0.0000 1 387 70 70 LYS HA H 5.2344 0.0000 1 388 70 70 LYS C C 174.4486 0.0000 1 389 70 70 LYS CA C 52.8389 0.0000 1 390 70 70 LYS CB C 35.2815 0.0000 1 391 70 70 LYS N N 121.9086 0.0000 1 392 71 71 ALA H H 9.1689 0.0000 1 393 71 71 ALA HA H 5.8468 0.0000 1 394 71 71 ALA HB H 1.4101 0.0000 1 395 71 71 ALA C C 175.5582 0.0000 1 396 71 71 ALA CA C 49.4116 0.0000 1 397 71 71 ALA CB C 24.1417 0.0000 1 398 71 71 ALA N N 128.4353 0.0000 1 399 72 72 GLN H H 8.3754 0.0000 1 400 72 72 GLN HA H 5.7030 0.0000 1 401 72 72 GLN C C 174.0188 0.0000 1 402 72 72 GLN CA C 55.9570 0.0000 1 403 72 72 GLN CB C 35.5546 0.0000 1 404 72 72 GLN N N 117.5766 0.0000 1 405 73 73 GLY H H 8.4455 0.0000 1 406 73 73 GLY HA2 H 4.3831 0.0000 2 407 73 73 GLY HA3 H 3.8528 0.0000 2 408 73 73 GLY C C 171.0069 0.0000 1 409 73 73 GLY CA C 45.0836 0.0000 1 410 73 73 GLY N N 111.8529 0.0000 1 411 74 74 VAL H H 9.0138 0.0000 1 412 74 74 VAL HA H 4.6896 0.0000 1 413 74 74 VAL C C 176.5990 0.0000 1 414 74 74 VAL CA C 62.9964 0.0000 1 415 74 74 VAL CB C 32.6862 0.0000 1 416 74 74 VAL N N 122.5029 0.0000 1 417 75 75 MET H H 9.6454 0.0000 1 418 75 75 MET HA H 5.0708 0.0000 1 419 75 75 MET C C 176.0896 0.0000 1 420 75 75 MET CA C 51.5631 0.0000 1 421 75 75 MET CB C 32.3713 0.0000 1 422 75 75 MET N N 125.3661 0.0000 1 423 76 76 ASP H H 9.5212 0.0000 1 424 76 76 ASP HA H 4.9462 0.0000 1 425 76 76 ASP HB2 H 2.8128 0.0000 2 426 76 76 ASP HB3 H 2.4068 0.0000 2 427 76 76 ASP C C 175.0084 0.0000 1 428 76 76 ASP CA C 53.4512 0.0000 1 429 76 76 ASP CB C 38.7006 0.0000 1 430 76 76 ASP N N 128.5205 0.0000 1 431 77 77 ASP H H 8.0300 0.0000 1 432 77 77 ASP HA H 4.6251 0.0000 1 433 77 77 ASP HB2 H 2.3203 0.0000 2 434 77 77 ASP C C 174.8004 0.0000 1 435 77 77 ASP CA C 52.1524 0.0000 1 436 77 77 ASP CB C 44.3215 0.0000 1 437 77 77 ASP N N 118.3507 0.0000 1 438 78 78 VAL H H 9.5829 0.0000 1 439 78 78 VAL HA H 4.3407 0.0000 1 440 78 78 VAL C C 177.7274 0.0000 1 441 78 78 VAL CA C 60.1150 0.0000 1 442 78 78 VAL CB C 32.0345 0.0000 1 443 78 78 VAL N N 113.4154 0.0000 1 444 79 79 VAL H H 7.7582 0.0000 1 445 79 79 VAL HA H 3.6101 0.0000 1 446 79 79 VAL HB H 1.9957 0.0000 1 447 79 79 VAL C C 177.9572 0.0000 1 448 79 79 VAL CA C 65.6897 0.0000 1 449 79 79 VAL CB C 31.6736 0.0000 1 450 79 79 VAL N N 120.2263 0.0000 1 451 80 80 ASN H H 8.7672 0.0000 1 452 80 80 ASN HA H 4.0333 0.0000 1 453 80 80 ASN HB2 H 2.6920 0.0000 2 454 80 80 ASN C C 176.9882 0.0000 1 455 80 80 ASN CA C 56.9994 0.0000 1 456 80 80 ASN CB C 37.1088 0.0000 1 457 80 80 ASN N N 114.3193 0.0000 1 458 81 81 ASN H H 6.7650 0.0000 1 459 81 81 ASN HA H 4.5846 0.0000 1 460 81 81 ASN C C 178.3213 0.0000 1 461 81 81 ASN CA C 55.1550 0.0000 1 462 81 81 ASN CB C 37.3039 0.0000 1 463 81 81 ASN N N 115.2365 0.0000 1 464 82 82 VAL H H 7.6976 0.0000 1 465 82 82 VAL HA H 3.1507 0.0000 1 466 82 82 VAL C C 177.9080 0.0000 1 467 82 82 VAL CA C 67.0304 0.0000 1 468 82 82 VAL CB C 30.7818 0.0000 1 469 82 82 VAL N N 121.6739 0.0000 1 470 83 83 ILE H H 8.2839 0.0000 1 471 83 83 ILE HA H 3.7470 0.0000 1 472 83 83 ILE HB H 2.0742 0.0000 1 473 83 83 ILE C C 178.6154 0.0000 1 474 83 83 ILE CA C 61.2989 0.0000 1 475 83 83 ILE CB C 33.3835 0.0000 1 476 83 83 ILE N N 117.9606 0.0000 1 477 84 84 ASP H H 8.4859 0.0000 1 478 84 84 ASP HA H 4.2652 0.0000 1 479 84 84 ASP HB2 H 2.3404 0.0000 2 480 84 84 ASP C C 177.6772 0.0000 1 481 84 84 ASP CA C 57.3988 0.0000 1 482 84 84 ASP CB C 39.3425 0.0000 1 483 84 84 ASP N N 120.8782 0.0000 1 484 85 85 HIS H H 7.2962 0.0000 1 485 85 85 HIS HA H 4.2806 0.0000 1 486 85 85 HIS C C 174.6486 0.0000 1 487 85 85 HIS CA C 59.5822 0.0000 1 488 85 85 HIS CB C 27.9405 0.0000 1 489 85 85 HIS N N 112.8491 0.0000 1 490 86 86 ILE H H 7.4577 0.0000 1 491 86 86 ILE HA H 4.2880 0.0000 1 492 86 86 ILE HB H 1.3170 0.0000 1 493 86 86 ILE C C 175.5989 0.0000 1 494 86 86 ILE CA C 64.3883 0.0000 1 495 86 86 ILE CB C 39.8899 0.0000 1 496 86 86 ILE N N 120.8743 0.0000 1 497 87 87 ARG H H 8.0167 0.0000 1 498 87 87 ARG CA C 55.1467 0.0000 1 499 87 87 ARG CB C 28.4975 0.0000 1 500 87 87 ARG N N 119.2820 0.0000 1 501 88 88 PRO HA H 3.7819 0.0000 1 502 88 88 PRO C C 176.1460 0.0000 1 503 88 88 PRO CA C 64.4220 0.0000 1 504 88 88 PRO CB C 31.4062 0.0000 1 505 89 89 GLY H H 6.5680 0.0000 1 506 89 89 GLY CA C 43.7968 0.0000 1 507 89 89 GLY N N 110.0240 0.0000 1 508 90 90 PRO HA H 4.0346 0.0000 1 509 90 90 PRO C C 177.9845 0.0000 1 510 90 90 PRO CA C 64.5956 0.0000 1 511 90 90 PRO CB C 31.1184 0.0000 1 512 91 91 TRP H H 7.3842 0.0000 1 513 91 91 TRP HA H 4.6232 0.0000 1 514 91 91 TRP C C 177.7942 0.0000 1 515 91 91 TRP CA C 58.1987 0.0000 1 516 91 91 TRP CB C 27.5986 0.0000 1 517 91 91 TRP N N 116.4758 0.0000 1 518 92 92 ARG H H 7.1364 0.0000 1 519 92 92 ARG HA H 4.1338 0.0000 1 520 92 92 ARG C C 176.0873 0.0000 1 521 92 92 ARG CA C 57.4318 0.0000 1 522 92 92 ARG CB C 28.3585 0.0000 1 523 92 92 ARG N N 121.5604 0.0000 1 524 93 93 LEU H H 6.8543 0.0000 1 525 93 93 LEU HA H 3.6719 0.0000 1 526 93 93 LEU HB2 H 1.4865 0.0000 2 527 93 93 LEU C C 177.4353 0.0000 1 528 93 93 LEU CA C 56.2134 0.0000 1 529 93 93 LEU CB C 40.9484 0.0000 1 530 93 93 LEU N N 114.8610 0.0000 1 531 94 94 ASP H H 7.3357 0.0000 1 532 94 94 ASP HA H 4.3037 0.0000 1 533 94 94 ASP HB2 H 2.8121 0.0000 2 534 94 94 ASP C C 177.0013 0.0000 1 535 94 94 ASP CA C 57.0272 0.0000 1 536 94 94 ASP CB C 41.0797 0.0000 1 537 94 94 ASP N N 115.2156 0.0000 1 538 95 95 TRP H H 6.7322 0.0000 1 539 95 95 TRP HA H 4.8009 0.0000 1 540 95 95 TRP C C 175.8194 0.0000 1 541 95 95 TRP CA C 55.7056 0.0000 1 542 95 95 TRP CB C 30.4303 0.0000 1 543 95 95 TRP N N 110.7676 0.0000 1 544 96 96 ASP H H 6.5104 0.0000 1 545 96 96 ASP HA H 3.8625 0.0000 1 546 96 96 ASP C C 176.6561 0.0000 1 547 96 96 ASP CA C 54.7289 0.0000 1 548 96 96 ASP CB C 38.5920 0.0000 1 549 96 96 ASP N N 123.2458 0.0000 1 550 97 97 ARG H H 7.4010 0.0000 1 551 97 97 ARG C C 177.3156 0.0000 1 552 97 97 ARG CA C 57.1781 0.0000 1 553 97 97 ARG CB C 28.6260 0.0000 1 554 97 97 ARG N N 123.6732 0.0000 1 555 98 98 LEU H H 7.8995 0.0000 1 556 98 98 LEU HA H 4.2505 0.0000 1 557 98 98 LEU HB2 H 1.9902 0.0000 2 558 98 98 LEU C C 176.5699 0.0000 1 559 98 98 LEU CA C 55.7702 0.0000 1 560 98 98 LEU CB C 41.8388 0.0000 1 561 98 98 LEU N N 120.8789 0.0000 1 562 99 99 MET H H 7.0156 0.0000 1 563 99 99 MET HA H 4.7637 0.0000 1 564 99 99 MET HB2 H 1.7502 0.0000 2 565 99 99 MET C C 176.5506 0.0000 1 566 99 99 MET CA C 55.5643 0.0000 1 567 99 99 MET CB C 34.2966 0.0000 1 568 99 99 MET N N 116.8406 0.0000 1 569 100 100 THR H H 8.7962 0.0000 1 570 100 100 THR HA H 4.4327 0.0000 1 571 100 100 THR C C 175.2499 0.0000 1 572 100 100 THR CA C 60.8744 0.0000 1 573 100 100 THR CB C 69.5499 0.0000 1 574 100 100 THR N N 110.8812 0.0000 1 575 101 101 SER H H 7.6001 0.0000 1 576 101 101 SER HA H 4.2993 0.0000 1 577 101 101 SER C C 170.9891 0.0000 1 578 101 101 SER CA C 59.2142 0.0000 1 579 101 101 SER CB C 64.6574 0.0000 1 580 101 101 SER N N 115.0714 0.0000 1 581 102 102 LEU H H 8.3137 0.0000 1 582 102 102 LEU HA H 4.6896 0.0000 1 583 102 102 LEU C C 174.0863 0.0000 1 584 102 102 LEU CA C 56.8586 0.0000 1 585 102 102 LEU CB C 42.8261 0.0000 1 586 102 102 LEU N N 120.7248 0.0000 1 587 103 103 ASP H H 9.6523 0.0000 1 588 103 103 ASP HA H 4.9155 0.0000 1 589 103 103 ASP HB2 H 2.5105 0.0000 2 590 103 103 ASP C C 174.6195 0.0000 1 591 103 103 ASP CA C 52.6470 0.0000 1 592 103 103 ASP CB C 44.4262 0.0000 1 593 103 103 ASP N N 125.3580 0.0000 1 594 104 104 VAL H H 8.9946 0.0000 1 595 104 104 VAL HA H 3.8648 0.0000 1 596 104 104 VAL HB H 1.9062 0.0000 1 597 104 104 VAL C C 175.7817 0.0000 1 598 104 104 VAL CA C 63.5115 0.0000 1 599 104 104 VAL CB C 29.8315 0.0000 1 600 104 104 VAL N N 124.1650 0.0000 1 601 105 105 LEU H H 8.4803 0.0000 1 602 105 105 LEU HA H 4.0514 0.0000 1 603 105 105 LEU C C 177.2544 0.0000 1 604 105 105 LEU CA C 56.3199 0.0000 1 605 105 105 LEU CB C 41.6376 0.0000 1 606 105 105 LEU N N 129.0381 0.0000 1 607 106 106 GLU H H 7.1953 0.0000 1 608 106 106 GLU HA H 4.3734 0.0000 1 609 106 106 GLU C C 173.9513 0.0000 1 610 106 106 GLU CA C 55.2616 0.0000 1 611 106 106 GLU CB C 32.3287 0.0000 1 612 106 106 GLU N N 114.9129 0.0000 1 613 107 107 HIS H H 8.9770 0.0000 1 614 107 107 HIS HA H 4.4603 0.0000 1 615 107 107 HIS HB2 H 2.9394 0.0000 2 616 107 107 HIS C C 173.6887 0.0000 1 617 107 107 HIS CA C 55.3504 0.0000 1 618 107 107 HIS CB C 29.8963 0.0000 1 619 107 107 HIS N N 123.3678 0.0000 1 620 108 108 PHE H H 8.0352 0.0000 1 621 108 108 PHE HA H 4.8688 0.0000 1 622 108 108 PHE HB2 H 3.3870 0.0000 2 623 108 108 PHE HB3 H 2.7600 0.0000 2 624 108 108 PHE C C 175.4910 0.0000 1 625 108 108 PHE CA C 58.2086 0.0000 1 626 108 108 PHE CB C 39.4403 0.0000 1 627 108 108 PHE N N 122.7777 0.0000 1 628 109 109 GLU H H 8.4278 0.0000 1 629 109 109 GLU HA H 4.4647 0.0000 1 630 109 109 GLU HB2 H 2.3073 0.0000 2 631 109 109 GLU C C 176.2722 0.0000 1 632 109 109 GLU CA C 55.9767 0.0000 1 633 109 109 GLU CB C 31.1929 0.0000 1 634 109 109 GLU N N 116.2444 0.0000 1 635 110 110 GLU H H 9.1330 0.0000 1 636 110 110 GLU HA H 4.0757 0.0000 1 637 110 110 GLU HB2 H 2.0768 0.0000 2 638 110 110 GLU C C 176.8886 0.0000 1 639 110 110 GLU CA C 59.3823 0.0000 1 640 110 110 GLU CB C 28.5266 0.0000 1 641 110 110 GLU N N 120.3708 0.0000 1 642 111 111 ASN H H 8.5328 0.0000 1 643 111 111 ASN HA H 4.7435 0.0000 1 644 111 111 ASN HB2 H 3.3331 0.0000 2 645 111 111 ASN C C 175.3908 0.0000 1 646 111 111 ASN CA C 53.4925 0.0000 1 647 111 111 ASN CB C 38.2677 0.0000 1 648 111 111 ASN N N 112.5441 0.0000 1 649 112 112 CYS H H 7.6879 0.0000 1 650 112 112 CYS HA H 5.7558 0.0000 1 651 112 112 CYS HB2 H 3.0952 0.0000 2 652 112 112 CYS C C 173.3037 0.0000 1 653 112 112 CYS CA C 57.8429 0.0000 1 654 112 112 CYS CB C 30.0216 0.0000 1 655 112 112 CYS N N 119.0792 0.0000 1 656 113 113 CYS H H 8.9764 0.0000 1 657 113 113 CYS HA H 5.0664 0.0000 1 658 113 113 CYS C C 171.1199 0.0000 1 659 113 113 CYS CA C 56.1729 0.0000 1 660 113 113 CYS CB C 30.6787 0.0000 1 661 113 113 CYS N N 121.0707 0.0000 1 662 114 114 VAL H H 8.2149 0.0000 1 663 114 114 VAL HA H 4.9695 0.0000 1 664 114 114 VAL C C 174.4993 0.0000 1 665 114 114 VAL CA C 61.7125 0.0000 1 666 114 114 VAL CB C 33.3107 0.0000 1 667 114 114 VAL N N 116.9137 0.0000 1 668 115 115 MET H H 9.6662 0.0000 1 669 115 115 MET HA H 5.1397 0.0000 1 670 115 115 MET C C 181.0481 0.0000 1 671 115 115 MET CA C 52.7650 0.0000 1 672 115 115 MET CB C 35.1021 0.0000 1 673 115 115 MET N N 125.3630 0.0000 1 674 116 116 ARG H H 9.2026 0.0000 1 675 116 116 ARG HA H 5.7220 0.0000 1 676 116 116 ARG C C 173.8805 0.0000 1 677 116 116 ARG CA C 52.9992 0.0000 1 678 116 116 ARG CB C 33.9155 0.0000 1 679 116 116 ARG N N 121.7634 0.0000 1 680 117 117 TYR H H 8.8507 0.0000 1 681 117 117 TYR HA H 5.2098 0.0000 1 682 117 117 TYR C C 173.1617 0.0000 1 683 117 117 TYR CA C 55.9101 0.0000 1 684 117 117 TYR CB C 40.8494 0.0000 1 685 117 117 TYR N N 121.5381 0.0000 1 686 118 118 THR H H 7.5993 0.0000 1 687 118 118 THR HA H 5.5268 0.0000 1 688 118 118 THR HB H 3.8914 0.0000 1 689 118 118 THR C C 175.0894 0.0000 1 690 118 118 THR CA C 57.7238 0.0000 1 691 118 118 THR CB C 72.4788 0.0000 1 692 118 118 THR N N 107.4223 0.0000 1 693 119 119 THR H H 9.1022 0.0000 1 694 119 119 THR HA H 5.6668 0.0000 1 695 119 119 THR C C 175.8824 0.0000 1 696 119 119 THR CA C 58.7971 0.0000 1 697 119 119 THR CB C 71.5582 0.0000 1 698 119 119 THR N N 111.1512 0.0000 1 699 120 120 ALA H H 8.6656 0.0000 1 700 120 120 ALA HA H 4.3562 0.0000 1 701 120 120 ALA HB H 1.4334 0.0000 1 702 120 120 ALA C C 178.2119 0.0000 1 703 120 120 ALA CA C 51.2527 0.0000 1 704 120 120 ALA CB C 18.9679 0.0000 1 705 120 120 ALA N N 124.0165 0.0000 1 706 121 121 GLY H H 8.6764 0.0000 1 707 121 121 GLY HA2 H 3.8805 0.0000 2 708 121 121 GLY C C 173.8604 0.0000 1 709 121 121 GLY CA C 45.1166 0.0000 1 710 121 121 GLY N N 107.1680 0.0000 1 711 122 122 GLN H H 9.0859 0.0000 1 712 122 122 GLN HA H 4.7156 0.0000 1 713 122 122 GLN C C 175.1100 0.0000 1 714 122 122 GLN CA C 54.7994 0.0000 1 715 122 122 GLN CB C 33.9422 0.0000 1 716 122 122 GLN N N 119.5947 0.0000 1 717 123 123 LEU H H 9.0876 0.0000 1 718 123 123 LEU HA H 3.8809 0.0000 1 719 123 123 LEU HB2 H 1.7343 0.0000 2 720 123 123 LEU C C 177.0812 0.0000 1 721 123 123 LEU CA C 54.8652 0.0000 1 722 123 123 LEU CB C 38.6633 0.0000 1 723 123 123 LEU N N 119.7857 0.0000 1 724 124 124 ASP H H 8.6371 0.0000 1 725 124 124 ASP HA H 4.1154 0.0000 1 726 124 124 ASP HB2 H 2.8481 0.0000 2 727 124 124 ASP HB3 H 2.6082 0.0000 2 728 124 124 ASP C C 175.4184 0.0000 1 729 124 124 ASP CA C 55.9101 0.0000 1 730 124 124 ASP CB C 38.7412 0.0000 1 731 124 124 ASP N N 119.4776 0.0000 1 732 125 125 ASN H H 7.8030 0.0000 1 733 125 125 ASN HA H 3.9591 0.0000 1 734 125 125 ASN HB2 H 2.8374 0.0000 2 735 125 125 ASN C C 175.2430 0.0000 1 736 125 125 ASN CA C 54.8861 0.0000 1 737 125 125 ASN CB C 37.7751 0.0000 1 738 125 125 ASN N N 110.6639 0.0000 1 739 126 126 ILE H H 7.9084 0.0000 1 740 126 126 ILE HA H 3.9323 0.0000 1 741 126 126 ILE HB H 2.0632 0.0000 1 742 126 126 ILE C C 177.4547 0.0000 1 743 126 126 ILE CA C 64.1434 0.0000 1 744 126 126 ILE CB C 36.7367 0.0000 1 745 126 126 ILE N N 120.9630 0.0000 1 746 127 127 ILE H H 7.7431 0.0000 1 747 127 127 ILE HA H 4.1010 0.0000 1 748 127 127 ILE C C 174.5712 0.0000 1 749 127 127 ILE CA C 60.4943 0.0000 1 750 127 127 ILE CB C 37.0562 0.0000 1 751 127 127 ILE N N 118.9511 0.0000 1 752 128 128 SER H H 8.3053 0.0000 1 753 128 128 SER CA C 58.5465 0.0000 1 754 128 128 SER CB C 60.6924 0.0000 1 755 128 128 SER N N 123.4326 0.0000 1 756 129 129 PRO HA H 4.1965 0.0000 1 757 129 129 PRO C C 175.5288 0.0000 1 758 129 129 PRO CA C 66.1215 0.0000 1 759 129 129 PRO CB C 33.0357 0.0000 1 760 130 130 ARG H H 7.7388 0.0000 1 761 130 130 ARG HA H 5.4295 0.0000 1 762 130 130 ARG C C 175.2968 0.0000 1 763 130 130 ARG CA C 53.0757 0.0000 1 764 130 130 ARG CB C 35.1951 0.0000 1 765 130 130 ARG N N 126.0586 0.0000 1 766 131 131 GLU H H 8.3271 0.0000 1 767 131 131 GLU HA H 4.9429 0.0000 1 768 131 131 GLU HB2 H 2.4722 0.0000 2 769 131 131 GLU C C 172.7435 0.0000 1 770 131 131 GLU CA C 52.9622 0.0000 1 771 131 131 GLU CB C 33.9871 0.0000 1 772 131 131 GLU N N 116.0320 0.0000 1 773 132 132 PHE H H 8.4131 0.0000 1 774 132 132 PHE HA H 4.4732 0.0000 1 775 132 132 PHE C C 174.1541 0.0000 1 776 132 132 PHE CA C 55.9044 0.0000 1 777 132 132 PHE CB C 41.7508 0.0000 1 778 132 132 PHE N N 122.3693 0.0000 1 779 133 133 VAL H H 8.2361 0.0000 1 780 133 133 VAL HA H 4.5904 0.0000 1 781 133 133 VAL C C 174.0570 0.0000 1 782 133 133 VAL CA C 62.4814 0.0000 1 783 133 133 VAL CB C 31.3048 0.0000 1 784 133 133 VAL N N 121.3325 0.0000 1 785 134 134 ASP H H 8.8216 0.0000 1 786 134 134 ASP HA H 5.4786 0.0000 1 787 134 134 ASP C C 175.7098 0.0000 1 788 134 134 ASP CA C 52.9123 0.0000 1 789 134 134 ASP CB C 43.5458 0.0000 1 790 134 134 ASP N N 123.2329 0.0000 1 791 135 135 PHE H H 9.4178 0.0000 1 792 135 135 PHE HA H 4.3314 0.0000 1 793 135 135 PHE C C 173.6768 0.0000 1 794 135 135 PHE CA C 57.6371 0.0000 1 795 135 135 PHE CB C 40.9368 0.0000 1 796 135 135 PHE N N 122.8846 0.0000 1 797 136 136 SER H H 8.4400 0.0000 1 798 136 136 SER HA H 5.2687 0.0000 1 799 136 136 SER C C 172.4376 0.0000 1 800 136 136 SER CA C 56.1408 0.0000 1 801 136 136 SER CB C 64.2411 0.0000 1 802 136 136 SER N N 120.8028 0.0000 1 803 137 137 TYR H H 8.8515 0.0000 1 804 137 137 TYR HA H 5.5371 0.0000 1 805 137 137 TYR HB2 H 2.8752 0.0000 2 806 137 137 TYR C C 173.7657 0.0000 1 807 137 137 TYR CA C 55.2803 0.0000 1 808 137 137 TYR CB C 41.9950 0.0000 1 809 137 137 TYR N N 128.6833 0.0000 1 810 138 138 THR H H 7.8142 0.0000 1 811 138 138 THR HA H 5.4838 0.0000 1 812 138 138 THR HB H 3.7061 0.0000 1 813 138 138 THR C C 171.8393 0.0000 1 814 138 138 THR CA C 61.7452 0.0000 1 815 138 138 THR CB C 70.3743 0.0000 1 816 138 138 THR N N 125.0553 0.0000 1 817 139 139 VAL H H 9.2888 0.0000 1 818 139 139 VAL HA H 4.3396 0.0000 1 819 139 139 VAL HB H 1.2333 0.0000 1 820 139 139 VAL C C 172.2648 0.0000 1 821 139 139 VAL CA C 59.2712 0.0000 1 822 139 139 VAL CB C 35.3732 0.0000 1 823 139 139 VAL N N 126.4897 0.0000 1 824 140 140 GLY H H 8.2188 0.0000 1 825 140 140 GLY HA2 H 4.2817 0.0000 2 826 140 140 GLY HA3 H 3.7651 0.0000 2 827 140 140 GLY C C 173.5788 0.0000 1 828 140 140 GLY CA C 46.2253 0.0000 1 829 140 140 GLY N N 111.7588 0.0000 1 830 141 141 TYR H H 8.0130 0.0000 1 831 141 141 TYR HA H 4.4589 0.0000 1 832 141 141 TYR HB2 H 2.9684 0.0000 2 833 141 141 TYR HB3 H 2.5233 0.0000 2 834 141 141 TYR C C 172.5994 0.0000 1 835 141 141 TYR CA C 58.2124 0.0000 1 836 141 141 TYR CB C 40.2136 0.0000 1 837 141 141 TYR N N 124.6256 0.0000 1 838 142 142 GLU H H 8.8245 0.0000 1 839 142 142 GLU HA H 3.4591 0.0000 1 840 142 142 GLU C C 176.7043 0.0000 1 841 142 142 GLU CA C 58.0357 0.0000 1 842 142 142 GLU CB C 26.3032 0.0000 1 843 142 142 GLU N N 125.1511 0.0000 1 844 143 143 GLU H H 8.3136 0.0000 1 845 143 143 GLU HA H 4.5269 0.0000 1 846 143 143 GLU HB2 H 1.9756 0.0000 2 847 143 143 GLU HB3 H 2.4161 0.0000 2 848 143 143 GLU C C 175.7022 0.0000 1 849 143 143 GLU CA C 57.0328 0.0000 1 850 143 143 GLU CB C 28.9327 0.0000 1 851 143 143 GLU N N 120.7815 0.0000 1 852 144 144 GLY H H 9.1114 0.0000 1 853 144 144 GLY HA2 H 4.7880 0.0000 2 854 144 144 GLY HA3 H 4.7880 0.0000 2 855 144 144 GLY C C 174.0620 0.0000 1 856 144 144 GLY CA C 44.5640 0.0000 1 857 144 144 GLY N N 109.3954 0.0000 1 858 145 145 LEU H H 9.0848 0.0000 1 859 145 145 LEU HA H 5.1272 0.0000 1 860 145 145 LEU C C 173.0170 0.0000 1 861 145 145 LEU CA C 54.6448 0.0000 1 862 145 145 LEU CB C 49.7115 0.0000 1 863 145 145 LEU N N 126.0355 0.0000 1 864 146 146 LEU H H 9.0896 0.0000 1 865 146 146 LEU HA H 5.0402 0.0000 1 866 146 146 LEU C C 174.5383 0.0000 1 867 146 146 LEU CA C 53.0411 0.0000 1 868 146 146 LEU CB C 43.3595 0.0000 1 869 146 146 LEU N N 122.1716 0.0000 1 870 147 147 SER H H 8.9345 0.0000 1 871 147 147 SER HA H 5.4320 0.0000 1 872 147 147 SER C C 174.3960 0.0000 1 873 147 147 SER CA C 56.3962 0.0000 1 874 147 147 SER CB C 64.5745 0.0000 1 875 147 147 SER N N 120.3242 0.0000 1 876 148 148 CYS H H 5.8487 0.0000 1 877 148 148 CYS HB2 H 2.7700 0.0000 2 878 148 148 CYS C C 173.3114 0.0000 1 879 148 148 CYS CA C 55.4627 0.0000 1 880 148 148 CYS CB C 32.8227 0.0000 1 881 148 148 CYS N N 123.9020 0.0000 1 882 149 149 GLY H H 9.1177 0.0000 1 883 149 149 GLY HA2 H 4.0130 0.0000 2 884 149 149 GLY HA3 H 5.1196 0.0000 2 885 149 149 GLY C C 170.7506 0.0000 1 886 149 149 GLY CA C 46.4871 0.0000 1 887 149 149 GLY N N 108.1618 0.0000 1 888 150 150 VAL H H 7.9540 0.0000 1 889 150 150 VAL HA H 4.0398 0.0000 1 890 150 150 VAL HB H 2.3154 0.0000 1 891 150 150 VAL C C 172.3072 0.0000 1 892 150 150 VAL CA C 60.5973 0.0000 1 893 150 150 VAL CB C 32.6079 0.0000 1 894 150 150 VAL N N 114.4162 0.0000 1 895 151 151 SER H H 8.9776 0.0000 1 896 151 151 SER HA H 5.8817 0.0000 1 897 151 151 SER C C 172.4187 0.0000 1 898 151 151 SER CA C 59.8612 0.0000 1 899 151 151 SER CB C 64.3519 0.0000 1 900 151 151 SER N N 124.0220 0.0000 1 901 152 152 VAL H H 8.3532 0.0000 1 902 152 152 VAL HA H 4.9610 0.0000 1 903 152 152 VAL C C 175.1590 0.0000 1 904 152 152 VAL CA C 58.6516 0.0000 1 905 152 152 VAL CB C 34.9900 0.0000 1 906 152 152 VAL N N 110.5175 0.0000 1 907 153 153 GLU H H 8.4241 0.0000 1 908 153 153 GLU HA H 4.2858 0.0000 1 909 153 153 GLU HB2 H 1.9761 0.0000 2 910 153 153 GLU C C 176.2602 0.0000 1 911 153 153 GLU CA C 56.6460 0.0000 1 912 153 153 GLU CB C 29.5280 0.0000 1 913 153 153 GLU N N 120.5573 0.0000 1 914 154 154 TRP H H 8.6542 0.0000 1 915 154 154 TRP CA C 58.5560 0.0000 1 916 154 154 TRP CB C 31.7452 0.0000 1 917 154 154 TRP N N 123.9169 0.0000 1 918 156 156 GLU C C 176.0220 0.0000 1 919 156 156 GLU CA C 57.1747 0.0000 1 920 156 156 GLU CB C 29.2605 0.0000 1 921 157 157 THR H H 8.4242 0.0000 1 922 157 157 THR HA H 4.5490 0.0000 1 923 157 157 THR C C 173.9649 0.0000 1 924 157 157 THR CA C 60.8233 0.0000 1 925 157 157 THR CB C 70.4046 0.0000 1 926 157 157 THR N N 119.3413 0.0000 1 927 158 158 ARG H H 9.1719 0.0000 1 928 158 158 ARG CA C 53.7304 0.0000 1 929 158 158 ARG CB C 31.5216 0.0000 1 930 158 158 ARG N N 125.0962 0.0000 1 931 159 159 PRO HA H 4.2973 0.0000 1 932 159 159 PRO HB2 H 2.2520 0.0000 2 933 159 159 PRO HB3 H 1.9113 0.0000 2 934 159 159 PRO C C 177.0724 0.0000 1 935 159 159 PRO CA C 64.4491 0.0000 1 936 159 159 PRO CB C 31.3583 0.0000 1 937 160 160 GLU H H 9.1558 0.0000 1 938 160 160 GLU HA H 3.8559 0.0000 1 939 160 160 GLU HB2 H 1.4092 0.0000 2 940 160 160 GLU C C 175.1167 0.0000 1 941 160 160 GLU CA C 57.8501 0.0000 1 942 160 160 GLU CB C 27.2689 0.0000 1 943 160 160 GLU N N 117.9668 0.0000 1 944 161 161 PHE H H 7.7410 0.0000 1 945 161 161 PHE HA H 4.5578 0.0000 1 946 161 161 PHE C C 174.9681 0.0000 1 947 161 161 PHE CA C 56.3890 0.0000 1 948 161 161 PHE CB C 42.5834 0.0000 1 949 161 161 PHE N N 116.9704 0.0000 1 950 162 162 VAL H H 7.5498 0.0000 1 951 162 162 VAL HA H 3.8689 0.0000 1 952 162 162 VAL HB H 1.4904 0.0000 1 953 162 162 VAL C C 175.7376 0.0000 1 954 162 162 VAL CA C 62.3404 0.0000 1 955 162 162 VAL CB C 32.7379 0.0000 1 956 162 162 VAL N N 123.3372 0.0000 1 957 163 163 ARG H H 8.7764 0.0000 1 958 163 163 ARG HA H 4.7108 0.0000 1 959 163 163 ARG C C 176.3331 0.0000 1 960 163 163 ARG CA C 53.9269 0.0000 1 961 163 163 ARG CB C 26.6788 0.0000 1 962 163 163 ARG N N 129.2664 0.0000 1 963 164 164 GLY H H 8.0780 0.0000 1 964 164 164 GLY HA2 H 4.2612 0.0000 2 965 164 164 GLY C C 171.3536 0.0000 1 966 164 164 GLY CA C 43.7609 0.0000 1 967 164 164 GLY N N 116.5512 0.0000 1 968 165 165 TYR H H 9.1194 0.0000 1 969 165 165 TYR HA H 4.3540 0.0000 1 970 165 165 TYR C C 173.4206 0.0000 1 971 165 165 TYR CA C 59.3644 0.0000 1 972 165 165 TYR CB C 42.5129 0.0000 1 973 165 165 TYR N N 120.3964 0.0000 1 974 166 166 ASN H H 9.4129 0.0000 1 975 166 166 ASN HA H 4.9437 0.0000 1 976 166 166 ASN HB2 H 3.0042 0.0000 2 977 166 166 ASN C C 174.9023 0.0000 1 978 166 166 ASN CA C 53.4094 0.0000 1 979 166 166 ASN CB C 37.4737 0.0000 1 980 166 166 ASN N N 127.1599 0.0000 1 981 167 167 HIS H H 7.0722 0.0000 1 982 167 167 HIS CA C 58.1829 0.0000 1 983 167 167 HIS CB C 27.0501 0.0000 1 984 167 167 HIS N N 125.6134 0.0000 1 985 168 168 PRO C C 173.8610 0.0000 1 986 168 168 PRO CA C 66.1538 0.0000 1 987 168 168 PRO CB C 29.9679 0.0000 1 988 169 169 CYS H H 8.7116 0.0000 1 989 169 169 CYS HA H 5.1186 0.0000 1 990 169 169 CYS HB2 H 3.2640 0.0000 2 991 169 169 CYS C C 173.2125 0.0000 1 992 169 169 CYS CA C 54.8585 0.0000 1 993 169 169 CYS CB C 32.0742 0.0000 1 994 169 169 CYS N N 115.9798 0.0000 1 995 170 170 GLY H H 9.1005 0.0000 1 996 170 170 GLY C C 169.2273 0.0000 1 997 170 170 GLY CA C 46.8435 0.0000 1 998 170 170 GLY N N 107.0862 0.0000 1 999 171 171 TRP H H 8.6427 0.0000 1 1000 171 171 TRP HA H 5.2084 0.0000 1 1001 171 171 TRP C C 174.8714 0.0000 1 1002 171 171 TRP CA C 56.1250 0.0000 1 1003 171 171 TRP CB C 32.8702 0.0000 1 1004 171 171 TRP N N 117.1675 0.0000 1 1005 172 172 PHE H H 9.9890 0.0000 1 1006 172 172 PHE HA H 4.9292 0.0000 1 1007 172 172 PHE C C 176.2422 0.0000 1 1008 172 172 PHE CA C 57.1367 0.0000 1 1009 172 172 PHE CB C 41.7953 0.0000 1 1010 172 172 PHE N N 121.5623 0.0000 1 1011 173 173 CYS H H 9.4912 0.0000 1 1012 173 173 CYS CA C 57.7016 0.0000 1 1013 173 173 CYS CB C 28.7845 0.0000 1 1014 173 173 CYS N N 123.8294 0.0000 1 1015 175 175 PRO HA H 4.7195 0.0000 1 1016 175 175 PRO HB2 H 2.5268 0.0000 2 1017 175 175 PRO HB3 H 1.8601 0.0000 2 1018 175 175 PRO C C 177.0552 0.0000 1 1019 175 175 PRO CA C 62.8046 0.0000 1 1020 175 175 PRO CB C 31.3812 0.0000 1 1021 176 176 LEU H H 7.8357 0.0000 1 1022 176 176 LEU HA H 4.3161 0.0000 1 1023 176 176 LEU HB2 H 1.6484 0.0000 2 1024 176 176 LEU C C 177.9115 0.0000 1 1025 176 176 LEU CA C 54.8089 0.0000 1 1026 176 176 LEU CB C 40.9209 0.0000 1 1027 176 176 LEU N N 124.0671 0.0000 1 1028 177 177 LYS H H 8.5776 0.0000 1 1029 177 177 LYS HA H 3.9017 0.0000 1 1030 177 177 LYS HB2 H 1.7650 0.0000 2 1031 177 177 LYS C C 177.2328 0.0000 1 1032 177 177 LYS CA C 58.8321 0.0000 1 1033 177 177 LYS CB C 31.3509 0.0000 1 1034 177 177 LYS N N 127.0186 0.0000 1 1035 178 178 ASP H H 8.5583 0.0000 1 1036 178 178 ASP HA H 4.5244 0.0000 1 1037 178 178 ASP HB2 H 2.7608 0.0000 2 1038 178 178 ASP C C 175.7807 0.0000 1 1039 178 178 ASP CA C 54.8477 0.0000 1 1040 178 178 ASP CB C 40.0492 0.0000 1 1041 178 178 ASP N N 115.8166 0.0000 1 1042 179 179 SER H H 7.2934 0.0000 1 1043 179 179 SER CA C 54.8540 0.0000 1 1044 179 179 SER CB C 62.5142 0.0000 1 1045 179 179 SER N N 111.7717 0.0000 1 1046 180 180 PRO HA H 4.6090 0.0000 1 1047 180 180 PRO HB2 H 2.3606 0.0000 2 1048 180 180 PRO HB3 H 2.0591 0.0000 2 1049 180 180 PRO C C 177.4649 0.0000 1 1050 180 180 PRO CA C 64.6608 0.0000 1 1051 180 180 PRO CB C 31.3225 0.0000 1 1052 181 181 SER H H 8.1701 0.0000 1 1053 181 181 SER HA H 4.3434 0.0000 1 1054 181 181 SER HB2 H 3.8549 0.0000 2 1055 181 181 SER C C 172.5078 0.0000 1 1056 181 181 SER CA C 58.9307 0.0000 1 1057 181 181 SER CB C 62.7541 0.0000 1 1058 181 181 SER N N 114.6106 0.0000 1 1059 182 182 GLN H H 8.1280 0.0000 1 1060 182 182 GLN HA H 4.9621 0.0000 1 1061 182 182 GLN HB2 H 2.0072 0.0000 2 1062 182 182 GLN C C 175.7018 0.0000 1 1063 182 182 GLN CA C 54.7057 0.0000 1 1064 182 182 GLN CB C 33.8018 0.0000 1 1065 182 182 GLN N N 118.3657 0.0000 1 1066 183 183 SER H H 9.0176 0.0000 1 1067 183 183 SER HA H 5.1650 0.0000 1 1068 183 183 SER HB2 H 3.3976 0.0000 2 1069 183 183 SER C C 171.8630 0.0000 1 1070 183 183 SER CA C 57.9955 0.0000 1 1071 183 183 SER CB C 67.0126 0.0000 1 1072 183 183 SER N N 113.1209 0.0000 1 1073 184 184 LEU H H 9.4957 0.0000 1 1074 184 184 LEU HA H 4.7680 0.0000 1 1075 184 184 LEU HB2 H 1.2253 0.0000 2 1076 184 184 LEU C C 175.3042 0.0000 1 1077 184 184 LEU CA C 54.2373 0.0000 1 1078 184 184 LEU CB C 43.2113 0.0000 1 1079 184 184 LEU N N 124.8402 0.0000 1 1080 185 185 LEU H H 8.9256 0.0000 1 1081 185 185 LEU HA H 5.7460 0.0000 1 1082 185 185 LEU C C 176.5022 0.0000 1 1083 185 185 LEU CA C 53.9635 0.0000 1 1084 185 185 LEU CB C 44.8640 0.0000 1 1085 185 185 LEU N N 132.2638 0.0000 1 1086 186 186 THR H H 10.0054 0.0000 1 1087 186 186 THR HA H 5.7868 0.0000 1 1088 186 186 THR C C 172.5731 0.0000 1 1089 186 186 THR CA C 62.1085 0.0000 1 1090 186 186 THR CB C 69.9685 0.0000 1 1091 186 186 THR N N 100.8151 0.0000 1 1092 187 187 GLY H H 9.1504 0.0000 1 1093 187 187 GLY HA2 H 1.7459 0.0000 2 1094 187 187 GLY C C 170.7718 0.0000 1 1095 187 187 GLY CA C 43.8784 0.0000 1 1096 187 187 GLY N N 115.8230 0.0000 1 1097 188 188 TYR H H 8.3356 0.0000 1 1098 188 188 TYR HA H 5.5013 0.0000 1 1099 188 188 TYR C C 175.4895 0.0000 1 1100 188 188 TYR CA C 56.3100 0.0000 1 1101 188 188 TYR CB C 40.1523 0.0000 1 1102 188 188 TYR N N 117.0682 0.0000 1 1103 189 189 ILE H H 9.0277 0.0000 1 1104 189 189 ILE HA H 4.4505 0.0000 1 1105 189 189 ILE C C 174.3200 0.0000 1 1106 189 189 ILE CA C 59.6632 0.0000 1 1107 189 189 ILE CB C 40.2453 0.0000 1 1108 189 189 ILE N N 121.3362 0.0000 1 1109 190 190 GLN H H 8.9880 0.0000 1 1110 190 190 GLN HA H 5.2065 0.0000 1 1111 190 190 GLN C C 174.9387 0.0000 1 1112 190 190 GLN CA C 54.5950 0.0000 1 1113 190 190 GLN CB C 31.3598 0.0000 1 1114 190 190 GLN N N 134.1132 0.0000 1 1115 191 191 THR H H 7.5317 0.0000 1 1116 191 191 THR HA H 4.2842 0.0000 1 1117 191 191 THR C C 173.0906 0.0000 1 1118 191 191 THR CA C 64.4841 0.0000 1 1119 191 191 THR CB C 71.3393 0.0000 1 1120 191 191 THR N N 117.4177 0.0000 1 1121 192 192 ASP H H 9.3143 0.0000 1 1122 192 192 ASP HA H 5.1251 0.0000 1 1123 192 192 ASP C C 176.2821 0.0000 1 1124 192 192 ASP CA C 51.9938 0.0000 1 1125 192 192 ASP CB C 41.6482 0.0000 1 1126 192 192 ASP N N 125.2479 0.0000 1 1127 193 193 LEU H H 9.2158 0.0000 1 1128 193 193 LEU HA H 3.9694 0.0000 1 1129 193 193 LEU C C 177.0031 0.0000 1 1130 193 193 LEU CA C 56.5891 0.0000 1 1131 193 193 LEU CB C 41.8430 0.0000 1 1132 193 193 LEU N N 126.0740 0.0000 1 1133 194 194 ARG H H 8.5413 0.0000 1 1134 194 194 ARG HA H 3.9654 0.0000 1 1135 194 194 ARG C C 175.8344 0.0000 1 1136 194 194 ARG CA C 57.4326 0.0000 1 1137 194 194 ARG CB C 26.3836 0.0000 1 1138 194 194 ARG N N 111.4796 0.0000 1 1139 195 195 GLY H H 8.3208 0.0000 1 1140 195 195 GLY HA2 H 3.7868 0.0000 2 1141 195 195 GLY C C 173.3430 0.0000 1 1142 195 195 GLY CA C 45.4248 0.0000 1 1143 195 195 GLY N N 106.4684 0.0000 1 1144 196 196 MET H H 8.4852 0.0000 1 1145 196 196 MET HA H 4.6950 0.0000 1 1146 196 196 MET HB2 H 2.4986 0.0000 2 1147 196 196 MET C C 174.6444 0.0000 1 1148 196 196 MET CA C 54.7420 0.0000 1 1149 196 196 MET CB C 31.4643 0.0000 1 1150 196 196 MET N N 122.4142 0.0000 1 1151 197 197 ILE H H 7.9113 0.0000 1 1152 197 197 ILE CA C 57.7530 0.0000 1 1153 197 197 ILE CB C 40.0856 0.0000 1 1154 197 197 ILE N N 124.0730 0.0000 1 1155 198 198 PRO HA H 4.4729 0.0000 1 1156 198 198 PRO HB2 H 2.4610 0.0000 2 1157 198 198 PRO HB3 H 1.9875 0.0000 2 1158 198 198 PRO C C 178.0924 0.0000 1 1159 198 198 PRO CA C 63.2019 0.0000 1 1160 198 198 PRO CB C 31.5580 0.0000 1 1161 199 199 GLN H H 8.9880 0.0000 1 1162 199 199 GLN HA H 3.8640 0.0000 1 1163 199 199 GLN HB2 H 2.0879 0.0000 2 1164 199 199 GLN HB3 H 2.3220 0.0000 2 1165 199 199 GLN C C 177.3979 0.0000 1 1166 199 199 GLN CA C 59.1123 0.0000 1 1167 199 199 GLN CB C 27.8224 0.0000 1 1168 199 199 GLN N N 125.4498 0.0000 1 1169 200 200 SER H H 8.7233 0.0000 1 1170 200 200 SER HA H 4.2100 0.0000 1 1171 200 200 SER HB2 H 3.9284 0.0000 2 1172 200 200 SER C C 176.8407 0.0000 1 1173 200 200 SER CA C 60.2223 0.0000 1 1174 200 200 SER CB C 61.6179 0.0000 1 1175 200 200 SER N N 111.7516 0.0000 1 1176 201 201 ALA H H 7.1354 0.0000 1 1177 201 201 ALA HA H 4.2575 0.0000 1 1178 201 201 ALA HB H 1.4740 0.0000 1 1179 201 201 ALA C C 178.7963 0.0000 1 1180 201 201 ALA CA C 54.3625 0.0000 1 1181 201 201 ALA CB C 17.8225 0.0000 1 1182 201 201 ALA N N 124.9837 0.0000 1 1183 202 202 VAL H H 7.6248 0.0000 1 1184 202 202 VAL HA H 3.3192 0.0000 1 1185 202 202 VAL C C 177.8169 0.0000 1 1186 202 202 VAL CA C 67.5517 0.0000 1 1187 202 202 VAL CB C 30.9708 0.0000 1 1188 202 202 VAL N N 119.3898 0.0000 1 1189 203 203 ASP H H 8.5685 0.0000 1 1190 203 203 ASP HA H 4.4068 0.0000 1 1191 203 203 ASP HB2 H 2.7421 0.0000 2 1192 203 203 ASP C C 179.1937 0.0000 1 1193 203 203 ASP CA C 57.6580 0.0000 1 1194 203 203 ASP CB C 40.1879 0.0000 1 1195 203 203 ASP N N 118.4387 0.0000 1 1196 204 204 THR H H 7.7851 0.0000 1 1197 204 204 THR HA H 3.9556 0.0000 1 1198 204 204 THR C C 176.7102 0.0000 1 1199 204 204 THR CA C 66.1386 0.0000 1 1200 204 204 THR CB C 68.5133 0.0000 1 1201 204 204 THR N N 116.4697 0.0000 1 1202 205 205 ALA H H 8.6924 0.0000 1 1203 205 205 ALA HA H 4.0932 0.0000 1 1204 205 205 ALA HB H 1.4141 0.0000 1 1205 205 205 ALA C C 180.8916 0.0000 1 1206 205 205 ALA CA C 55.2954 0.0000 1 1207 205 205 ALA CB C 17.5663 0.0000 1 1208 205 205 ALA N N 125.1830 0.0000 1 1209 206 206 MET H H 9.0488 0.0000 1 1210 206 206 MET HA H 4.2388 0.0000 1 1211 206 206 MET C C 178.0692 0.0000 1 1212 206 206 MET CA C 56.4979 0.0000 1 1213 206 206 MET CB C 28.0576 0.0000 1 1214 206 206 MET N N 118.6720 0.0000 1 1215 207 207 ALA H H 7.4901 0.0000 1 1216 207 207 ALA HA H 3.9736 0.0000 1 1217 207 207 ALA HB H 2.6669 0.0000 1 1218 207 207 ALA C C 177.8392 0.0000 1 1219 207 207 ALA CA C 55.7321 0.0000 1 1220 207 207 ALA CB C 17.4162 0.0000 1 1221 207 207 ALA N N 119.0987 0.0000 1 1222 208 208 SER H H 8.3216 0.0000 1 1223 208 208 SER CA C 61.2022 0.0000 1 1224 208 208 SER CB C 62.6056 0.0000 1 1225 208 208 SER N N 115.5346 0.0000 1 1226 209 209 THR H H 8.6767 0.0000 1 1227 209 209 THR HA H 4.0166 0.0000 1 1228 209 209 THR C C 177.5370 0.0000 1 1229 209 209 THR CA C 66.5174 0.0000 1 1230 209 209 THR CB C 68.4129 0.0000 1 1231 209 209 THR N N 119.3346 0.0000 1 1232 210 210 LEU H H 7.5486 0.0000 1 1233 210 210 LEU HA H 4.3407 0.0000 1 1234 210 210 LEU C C 177.7274 0.0000 1 1235 210 210 LEU CA C 57.8287 0.0000 1 1236 210 210 LEU CB C 41.1355 0.0000 1 1237 210 210 LEU N N 121.9801 0.0000 1 1238 211 211 ALA H H 7.7582 0.0000 1 1239 211 211 ALA HA H 4.0274 0.0000 1 1240 211 211 ALA HB H 1.3937 0.0000 1 1241 211 211 ALA C C 180.7952 0.0000 1 1242 211 211 ALA CA C 56.0250 0.0000 1 1243 211 211 ALA CB C 17.1801 0.0000 1 1244 211 211 ALA N N 120.2263 0.0000 1 1245 212 212 ASN H H 8.8930 0.0000 1 1246 212 212 ASN HA H 4.4854 0.0000 1 1247 212 212 ASN C C 176.0562 0.0000 1 1248 212 212 ASN CA C 54.9844 0.0000 1 1249 212 212 ASN CB C 37.2177 0.0000 1 1250 212 212 ASN N N 117.2835 0.0000 1 1251 213 213 PHE H H 8.1601 0.0000 1 1252 213 213 PHE HA H 4.6879 0.0000 1 1253 213 213 PHE C C 177.1288 0.0000 1 1254 213 213 PHE CA C 61.2702 0.0000 1 1255 213 213 PHE CB C 38.6227 0.0000 1 1256 213 213 PHE N N 122.8343 0.0000 1 1257 214 214 TYR H H 7.5914 0.0000 1 1258 214 214 TYR HA H 3.6188 0.0000 1 1259 214 214 TYR C C 178.3428 0.0000 1 1260 214 214 TYR CA C 63.4821 0.0000 1 1261 214 214 TYR CB C 38.7000 0.0000 1 1262 214 214 TYR N N 115.4168 0.0000 1 1263 215 215 SER H H 7.6490 0.0000 1 1264 215 215 SER HA H 4.1589 0.0000 1 1265 215 215 SER C C 177.7079 0.0000 1 1266 215 215 SER CA C 60.9704 0.0000 1 1267 215 215 SER CB C 62.6713 0.0000 1 1268 215 215 SER N N 113.0579 0.0000 1 1269 216 216 ASP H H 9.2905 0.0000 1 1270 216 216 ASP HA H 4.5022 0.0000 1 1271 216 216 ASP HB2 H 3.5870 0.0000 2 1272 216 216 ASP C C 179.1269 0.0000 1 1273 216 216 ASP CA C 57.3413 0.0000 1 1274 216 216 ASP CB C 38.5897 0.0000 1 1275 216 216 ASP N N 123.1746 0.0000 1 1276 217 217 LEU H H 8.3936 0.0000 1 1277 217 217 LEU HA H 2.4873 0.0000 1 1278 217 217 LEU C C 177.7402 0.0000 1 1279 217 217 LEU CA C 57.3675 0.0000 1 1280 217 217 LEU CB C 38.5058 0.0000 1 1281 217 217 LEU N N 125.5126 0.0000 1 1282 218 218 ARG H H 7.8715 0.0000 1 1283 218 218 ARG HA H 3.5523 0.0000 1 1284 218 218 ARG C C 179.8132 0.0000 1 1285 218 218 ARG CA C 60.2850 0.0000 1 1286 218 218 ARG CB C 29.2117 0.0000 1 1287 218 218 ARG N N 116.8346 0.0000 1 1288 219 219 LYS H H 7.3374 0.0000 1 1289 219 219 LYS HA H 3.9594 0.0000 1 1290 219 219 LYS HB2 H 1.9126 0.0000 2 1291 219 219 LYS C C 178.9832 0.0000 1 1292 219 219 LYS CA C 59.0834 0.0000 1 1293 219 219 LYS CB C 31.6491 0.0000 1 1294 219 219 LYS N N 117.2564 0.0000 1 1295 220 220 GLY H H 8.0978 0.0000 1 1296 220 220 GLY HA2 H 3.9441 0.0000 2 1297 220 220 GLY HA3 H 3.2365 0.0000 2 1298 220 220 GLY C C 174.8626 0.0000 1 1299 220 220 GLY CA C 46.0444 0.0000 1 1300 220 220 GLY N N 108.1629 0.0000 1 1301 221 221 LEU H H 7.4260 0.0000 1 1302 221 221 LEU HA H 3.4579 0.0000 1 1303 221 221 LEU HB2 H 1.3070 0.0000 2 1304 221 221 LEU C C 177.2506 0.0000 1 1305 221 221 LEU CA C 55.3508 0.0000 1 1306 221 221 LEU CB C 40.6755 0.0000 1 1307 221 221 LEU N N 118.7189 0.0000 1 1308 222 222 ARG H H 7.1700 0.0000 1 1309 222 222 ARG HA H 4.1388 0.0000 1 1310 222 222 ARG HB2 H 1.8067 0.0000 2 1311 222 222 ARG C C 175.8366 0.0000 1 1312 222 222 ARG CA C 56.2302 0.0000 1 1313 222 222 ARG CB C 29.7835 0.0000 1 1314 222 222 ARG N N 118.4677 0.0000 1 1315 223 223 LYS H H 8.0395 0.0000 1 1316 223 223 LYS HA H 4.2427 0.0000 1 1317 223 223 LYS HB2 H 1.7805 0.0000 2 1318 223 223 LYS C C 175.3654 0.0000 1 1319 223 223 LYS CA C 56.2124 0.0000 1 1320 223 223 LYS CB C 32.0005 0.0000 1 1321 223 223 LYS N N 123.0765 0.0000 1 1322 224 224 ALA H H 7.9419 0.0000 1 1323 224 224 ALA CA C 53.6118 0.0000 1 1324 224 224 ALA CB C 19.5886 0.0000 1 1325 224 224 ALA N N 131.0633 0.0000 1 stop_ save_