data_5659 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 13C and 15N Backbone Assignments for the Human Rhinovirus-14 3C Protease ; _BMRB_accession_number 5659 _BMRB_flat_file_name bmr5659.str _Entry_type original _Submission_date 2003-01-13 _Accession_date 2003-01-14 _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 Bjorndahl Trent C. . 2 Monzavi Hassan . . 3 Wishart David S. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 939 "13C chemical shifts" 683 "15N chemical shifts" 159 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2006-07-21 update author 'update the chemical shift table' 2003-02-17 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Letter to the Editor: Backbone 1H, 15N and 13C assignments for the human rhinovirus 3C protease (serotype 14) ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Bjorndahl Trent C. . 2 Monzavi Hassan . . 3 Wishart David S. . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_volume 26 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 85 _Page_last 86 _Year 2003 _Details . save_ ################################## # Molecular system description # ################################## save_system_HAV3C _Saveframe_category molecular_system _Mol_system_name 'Human Rhinovirus-14 3C Protease monomer' _Abbreviation_common HRV14-3C _Enzyme_commission_number 3.4.22.28 loop_ _Mol_system_component_name _Mol_label 'Human Rhinovirus-14 3C Protease' $HRV14-3C stop_ _System_molecular_weight 19996.90 _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'all free' loop_ _Biological_function hydrolase stop_ _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_HRV14-3C _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common HRV14-3C _Abbreviation_common HRV14-3C _Molecular_mass 19996.90 _Mol_thiol_state 'all free' _Details 'Proteolytic processes the RNA translated polyprotein of Hepatitis A viruses' ############################## # Polymer residue sequence # ############################## _Residue_count 182 _Mol_residue_sequence ; GPNTEFALSLLRKNIMTITT SKGEFTGLGIHDRVCVIPTH AQPGDDVLVNGQKIRVKDKY KLVDPENINLELTVLTLDRN EKFRDIRGFISEDLEGVDAT LVVHSNNFTNTILEVGPVTM AGLINLSSTPTNRMIRYDYA TKTGQCGGVLCATGKIFGIH VGGNGRQGFSAQLKKQYFVE KQ ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 PRO 3 ASN 4 THR 5 GLU 6 PHE 7 ALA 8 LEU 9 SER 10 LEU 11 LEU 12 ARG 13 LYS 14 ASN 15 ILE 16 MET 17 THR 18 ILE 19 THR 20 THR 21 SER 22 LYS 23 GLY 24 GLU 25 PHE 26 THR 27 GLY 28 LEU 29 GLY 30 ILE 31 HIS 32 ASP 33 ARG 34 VAL 35 CYS 36 VAL 37 ILE 38 PRO 39 THR 40 HIS 41 ALA 42 GLN 43 PRO 44 GLY 45 ASP 46 ASP 47 VAL 48 LEU 49 VAL 50 ASN 51 GLY 52 GLN 53 LYS 54 ILE 55 ARG 56 VAL 57 LYS 58 ASP 59 LYS 60 TYR 61 LYS 62 LEU 63 VAL 64 ASP 65 PRO 66 GLU 67 ASN 68 ILE 69 ASN 70 LEU 71 GLU 72 LEU 73 THR 74 VAL 75 LEU 76 THR 77 LEU 78 ASP 79 ARG 80 ASN 81 GLU 82 LYS 83 PHE 84 ARG 85 ASP 86 ILE 87 ARG 88 GLY 89 PHE 90 ILE 91 SER 92 GLU 93 ASP 94 LEU 95 GLU 96 GLY 97 VAL 98 ASP 99 ALA 100 THR 101 LEU 102 VAL 103 VAL 104 HIS 105 SER 106 ASN 107 ASN 108 PHE 109 THR 110 ASN 111 THR 112 ILE 113 LEU 114 GLU 115 VAL 116 GLY 117 PRO 118 VAL 119 THR 120 MET 121 ALA 122 GLY 123 LEU 124 ILE 125 ASN 126 LEU 127 SER 128 SER 129 THR 130 PRO 131 THR 132 ASN 133 ARG 134 MET 135 ILE 136 ARG 137 TYR 138 ASP 139 TYR 140 ALA 141 THR 142 LYS 143 THR 144 GLY 145 GLN 146 CYS 147 GLY 148 GLY 149 VAL 150 LEU 151 CYS 152 ALA 153 THR 154 GLY 155 LYS 156 ILE 157 PHE 158 GLY 159 ILE 160 HIS 161 VAL 162 GLY 163 GLY 164 ASN 165 GLY 166 ARG 167 GLN 168 GLY 169 PHE 170 SER 171 ALA 172 GLN 173 LEU 174 LYS 175 LYS 176 GLN 177 TYR 178 PHE 179 VAL 180 GLU 181 LYS 182 GLN 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 2B0F "Nmr Structure Of The Human Rhinovirus 3c Protease (Serotype 14) With Covalently Bound Ace-Lealfq-Ethylpropionate Inhibitor" 100.00 182 100.00 100.00 2.34e-129 PDB 2IN2 "Nmr Structure Of The Apo Human Rhinovirus 3c Protease (Serotype 14)" 100.00 182 100.00 100.00 2.34e-129 EMBL CAA25565 "polyprotein [Human rhinovirus sp.]" 100.00 2179 100.00 100.00 6.44e-117 GB AAA45756 "polyprotein [Human rhinovirus B14]" 100.00 2179 100.00 100.00 5.96e-117 GB AAA45757 "protease precursor, partial [Human rhinovirus sp.]" 100.00 182 100.00 100.00 2.34e-129 GB AAA45758 "polyprotein [Human rhinovirus B14]" 100.00 2179 100.00 100.00 5.90e-117 REF NP_041009 "genome polyprotein [Human rhinovirus B14]" 100.00 2179 100.00 100.00 5.96e-117 REF NP_740524 "3C (protease) [Human rhinovirus B14]" 100.00 182 100.00 100.00 2.34e-129 SP P03303 "RecName: Full=Genome polyprotein; Contains: RecName: Full=P3; Contains: RecName: Full=Protein 3AB; Contains: RecName: Full=P2; " 100.00 2179 100.00 100.00 6.70e-117 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _Organism_acronym _ICTVdb_decimal_code _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Strain _Plasmid _Gene_mnemonic $HRV14-3C 'Human Rhinovirus-14' HRV 00.052.0.03.001 12131 Virus Picornaviridae Rhinovirus . 14 pET-3a lac 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 $HRV14-3C 'recombinant technology' 'E. coli' Escherichia coli 'BL21 (DE3) pLysS' plasmid pET-3a 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 _Isotopic_labeling $HRV14-3C 1 mM [U-15N] KH2PO4 20 mM . NaCl 0 mM . stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $HRV14-3C 1 mM '[U-15N; U-13C]' KH2PO4 20 mM . NaCl 0 mM . stop_ save_ ############################# # Purity of the molecules # ############################# save_mol_purity_list _Saveframe_category sample_mol_purity _Sample_label $sample_1 loop_ _Mol_label _Mol_purity_value _Mol_purity_value_units _Mol_purity_measurement_method $HRV14-3C 95 % 'SDS gel electrophoresis' stop_ save_ ############################ # Computer software used # ############################ save_NMRPIPE _Saveframe_category software _Name NMRPIPE _Version . loop_ _Task 'specta processing' stop_ _Details . save_ save_NMRVIEW _Saveframe_category software _Name NMRVIEW _Version . loop_ _Task 'peak picking' 'spectral analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model Unity _Field_strength 500 _Details . save_ ############################# # NMR applied experiments # ############################# save_HNCO_1 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _Sample_label . save_ save_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label . save_ save_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label . save_ save_CBCACONNH_4 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONNH _Sample_label . save_ save_HNHA_5 _Saveframe_category NMR_applied_experiment _Experiment_name HNHA _Sample_label . save_ save_15N-HSQC_6 _Saveframe_category NMR_applied_experiment _Experiment_name 15N-HSQC _Sample_label . save_ save_applied_experiment_1 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _BMRB_pulse_sequence_accession_number . _Details . save_ save_applied_experiment_2 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _BMRB_pulse_sequence_accession_number . _Details . save_ save_applied_experiment_3 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _BMRB_pulse_sequence_accession_number . _Details . save_ save_applied_experiment_4 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONNH _BMRB_pulse_sequence_accession_number . _Details . save_ save_applied_experiment_5 _Saveframe_category NMR_applied_experiment _Experiment_name HNHA _BMRB_pulse_sequence_accession_number . _Details . save_ save_applied_experiment_6 _Saveframe_category NMR_applied_experiment _Experiment_name 15N-HSQC _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.5 0.1 pH temperature 298 1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _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 H 1 'methyl protons' ppm 0 internal direct . . . 1.0 DSS C 13 'methyl protons' ppm 0 internal indirect . . . 0.25144954 DSS N 15 'methyl protons' ppm 0 internal indirect . . . 0.10132900 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_chemical_shifts _Saveframe_category assigned_chemical_shifts _Details . _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Human Rhinovirus-14 3C Protease' _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 PRO HA H 4.390 . 1 2 . 2 PRO HB2 H 2.450 . 2 3 . 2 PRO HG2 H 1.940 . 2 4 . 2 PRO HD2 H 3.550 . 2 5 . 2 PRO HD3 H 3.650 . 2 6 . 2 PRO C C 177.262 . 1 7 . 2 PRO CA C 64.567 . 1 8 . 2 PRO CB C 32.009 . 1 9 . 2 PRO CG C 27.090 . 1 10 . 2 PRO CD C 49.510 . 1 11 . 3 ASN H H 8.909 . 1 12 . 3 ASN HA H 5.010 . 1 13 . 3 ASN HB2 H 2.770 . 2 14 . 3 ASN HB3 H 3.000 . 2 15 . 3 ASN HD21 H 6.880 . 2 16 . 3 ASN HD22 H 7.590 . 2 17 . 3 ASN C C 176.492 . 1 18 . 3 ASN CA C 53.502 . 1 19 . 3 ASN CB C 39.010 . 1 20 . 3 ASN CG C 175.380 . 1 21 . 3 ASN N N 115.651 . 1 22 . 3 ASN ND2 N 112.990 . 1 23 . 4 THR H H 7.703 . 1 24 . 4 THR HA H 3.748 . 1 25 . 4 THR HB H 4.170 . 1 26 . 4 THR HG2 H 1.170 . 1 27 . 4 THR C C 174.750 . 1 28 . 4 THR CA C 67.167 . 1 29 . 4 THR CB C 68.720 . 1 30 . 4 THR CG2 C 21.940 . 1 31 . 4 THR N N 116.847 . 1 32 . 5 GLU H H 8.605 . 1 33 . 5 GLU HA H 3.910 . 1 34 . 5 GLU HB2 H 2.000 . 1 35 . 5 GLU HB3 H 2.050 . 1 36 . 5 GLU HG2 H 2.330 . 2 37 . 5 GLU HG3 H 2.280 . 2 38 . 5 GLU C C 179.200 . 1 39 . 5 GLU CA C 60.254 . 1 40 . 5 GLU CB C 28.827 . 1 41 . 5 GLU CG C 36.400 . 1 42 . 5 GLU N N 121.184 . 1 43 . 6 PHE H H 8.600 . 1 44 . 6 PHE HA H 4.210 . 1 45 . 6 PHE HB2 H 3.300 . 1 46 . 6 PHE HB3 H 2.810 . 1 47 . 6 PHE HD1 H 7.030 . 1 48 . 6 PHE HD2 H 7.030 . 1 49 . 6 PHE HE1 H 6.540 . 1 50 . 6 PHE HE2 H 6.540 . 1 51 . 6 PHE C C 177.400 . 1 52 . 6 PHE CA C 61.370 . 1 53 . 6 PHE CB C 39.546 . 1 54 . 6 PHE N N 121.180 . 1 55 . 7 ALA H H 8.320 . 1 56 . 7 ALA HA H 3.698 . 1 57 . 7 ALA HB H 1.320 . 1 58 . 7 ALA C C 179.118 . 1 59 . 7 ALA CA C 55.617 . 1 60 . 7 ALA CB C 18.711 . 1 61 . 7 ALA N N 122.724 . 1 62 . 8 LEU H H 8.597 . 1 63 . 8 LEU HA H 3.959 . 1 64 . 8 LEU HB2 H 1.320 . 2 65 . 8 LEU HB3 H 1.830 . 2 66 . 8 LEU HG H 1.660 . 1 67 . 8 LEU HD1 H 0.770 . 1 68 . 8 LEU HD2 H 0.770 . 1 69 . 8 LEU C C 179.597 . 1 70 . 8 LEU CA C 57.736 . 1 71 . 8 LEU CB C 41.526 . 1 72 . 8 LEU CG C 26.870 . 1 73 . 8 LEU CD1 C 25.510 . 1 74 . 8 LEU CD2 C 22.940 . 1 75 . 8 LEU N N 117.020 . 1 76 . 9 SER H H 7.786 . 1 77 . 9 SER HA H 4.154 . 1 78 . 9 SER HB2 H 3.920 . 2 79 . 9 SER C C 177.050 . 1 80 . 9 SER CA C 61.322 . 1 81 . 9 SER CB C 62.832 . 1 82 . 9 SER N N 115.528 . 1 83 . 10 LEU H H 7.679 . 1 84 . 10 LEU HA H 3.780 . 1 85 . 10 LEU HB2 H 1.080 . 1 86 . 10 LEU HB3 H 1.710 . 1 87 . 10 LEU HG H 1.140 . 1 88 . 10 LEU HD1 H 0.470 . 2 89 . 10 LEU HD2 H 0.530 . 2 90 . 10 LEU CA C 57.890 . 1 91 . 10 LEU CB C 41.920 . 1 92 . 10 LEU CG C 25.940 . 1 93 . 10 LEU CD1 C 23.250 . 1 94 . 10 LEU N N 121.333 . 1 95 . 11 LEU H H 8.148 . 1 96 . 11 LEU HA H 3.840 . 1 97 . 11 LEU HB2 H 1.650 . 2 98 . 11 LEU HG H 1.380 . 1 99 . 11 LEU HD1 H 0.670 . 2 100 . 11 LEU HD2 H 0.710 . 2 101 . 11 LEU C C 177.672 . 1 102 . 11 LEU CA C 57.893 . 1 103 . 11 LEU CB C 41.520 . 1 104 . 11 LEU CG C 27.320 . 1 105 . 11 LEU CD1 C 23.510 . 1 106 . 11 LEU CD2 C 24.510 . 1 107 . 11 LEU N N 120.156 . 1 108 . 12 ARG H H 7.745 . 1 109 . 12 ARG HA H 4.120 . 1 110 . 12 ARG HB2 H 1.850 . 2 111 . 12 ARG HG2 H 1.750 . 2 112 . 12 ARG HG3 H 1.650 . 2 113 . 12 ARG HD2 H 3.140 . 2 114 . 12 ARG C C 178.467 . 1 115 . 12 ARG CA C 58.736 . 1 116 . 12 ARG CB C 30.890 . 1 117 . 12 ARG CG C 27.940 . 1 118 . 12 ARG CD C 43.280 . 1 119 . 12 ARG N N 115.211 . 1 120 . 13 LYS H H 7.690 . 1 121 . 13 LYS HA H 4.685 . 1 122 . 13 LYS HG2 H 1.490 . 2 123 . 13 LYS HE2 H 2.940 . 2 124 . 13 LYS C C 177.810 . 1 125 . 13 LYS CA C 57.212 . 1 126 . 13 LYS CB C 35.256 . 1 127 . 13 LYS CG C 25.710 . 1 128 . 13 LYS CD C 29.020 . 1 129 . 13 LYS CE C 42.140 . 1 130 . 13 LYS N N 113.819 . 1 131 . 14 ASN H H 8.630 . 1 132 . 14 ASN HA H 5.050 . 1 133 . 14 ASN HB2 H 2.080 . 2 134 . 14 ASN HB3 H 3.150 . 2 135 . 14 ASN HD22 H 6.950 . 2 136 . 14 ASN C C 172.879 . 1 137 . 14 ASN CA C 56.098 . 1 138 . 14 ASN CB C 43.461 . 1 139 . 14 ASN N N 116.656 . 1 140 . 14 ASN ND2 N 112.430 . 1 141 . 15 ILE H H 7.434 . 1 142 . 15 ILE HA H 5.035 . 1 143 . 15 ILE HB H 1.810 . 1 144 . 15 ILE HG12 H 0.990 . 2 145 . 15 ILE HG13 H 1.350 . 2 146 . 15 ILE HG2 H 0.990 . 1 147 . 15 ILE HD1 H 0.640 . 1 148 . 15 ILE C C 174.338 . 1 149 . 15 ILE CA C 60.848 . 1 150 . 15 ILE CB C 39.113 . 1 151 . 15 ILE CG1 C 28.940 . 2 152 . 15 ILE CG2 C 18.850 . 1 153 . 15 ILE CD1 C 14.230 . 1 154 . 15 ILE N N 121.249 . 1 155 . 16 MET H H 8.644 . 1 156 . 16 MET HA H 4.920 . 1 157 . 16 MET HB2 H 1.800 . 2 158 . 16 MET HB3 H 2.110 . 2 159 . 16 MET HG2 H 2.300 . 2 160 . 16 MET HG3 H 2.370 . 2 161 . 16 MET C C 174.343 . 1 162 . 16 MET CA C 53.650 . 1 163 . 16 MET CB C 37.604 . 1 164 . 16 MET CG C 30.860 . 1 165 . 16 MET N N 124.180 . 1 166 . 17 THR H H 8.857 . 1 167 . 17 THR HA H 5.046 . 1 168 . 17 THR HB H 3.980 . 1 169 . 17 THR HG2 H 1.080 . 1 170 . 17 THR C C 174.909 . 1 171 . 17 THR CA C 62.859 . 1 172 . 17 THR CB C 69.206 . 1 173 . 17 THR CG2 C 23.040 . 1 174 . 17 THR N N 118.271 . 1 175 . 18 ILE H H 9.725 . 1 176 . 18 ILE HA H 5.485 . 1 177 . 18 ILE HB H 1.770 . 1 178 . 18 ILE HG12 H 1.470 . 1 179 . 18 ILE HG13 H 1.260 . 1 180 . 18 ILE HG2 H 0.790 . 1 181 . 18 ILE HD1 H 0.770 . 1 182 . 18 ILE C C 175.081 . 1 183 . 18 ILE CA C 58.536 . 1 184 . 18 ILE CB C 38.722 . 1 185 . 18 ILE CG1 C 27.450 . 2 186 . 18 ILE CG2 C 16.610 . 1 187 . 18 ILE CD1 C 12.650 . 1 188 . 18 ILE N N 131.072 . 1 189 . 19 THR H H 9.435 . 1 190 . 19 THR HA H 5.518 . 1 191 . 19 THR HB H 4.010 . 1 192 . 19 THR HG2 H 1.330 . 1 193 . 19 THR C C 176.002 . 1 194 . 19 THR CA C 61.764 . 1 195 . 19 THR CB C 69.680 . 1 196 . 19 THR CG2 C 21.920 . 1 197 . 19 THR N N 124.491 . 1 198 . 20 THR H H 9.391 . 1 199 . 20 THR HA H 5.330 . 1 200 . 20 THR HB H 4.780 . 1 201 . 20 THR HG2 H 0.980 . 1 202 . 20 THR C C 174.440 . 1 203 . 20 THR CA C 59.253 . 1 204 . 20 THR CB C 71.151 . 1 205 . 20 THR CG2 C 21.950 . 1 206 . 20 THR N N 120.130 . 1 207 . 21 SER HA H 4.420 . 1 208 . 21 SER HB2 H 4.080 . 1 209 . 21 SER HB3 H 4.080 . 1 210 . 21 SER C C 175.330 . 1 211 . 21 SER CA C 61.540 . 1 212 . 21 SER CB C 62.750 . 1 213 . 22 LYS H H 8.410 . 1 214 . 22 LYS HA H 4.530 . 1 215 . 22 LYS HB2 H 2.280 . 1 216 . 22 LYS HB3 H 2.280 . 1 217 . 22 LYS HG2 H 1.420 . 2 218 . 22 LYS HG3 H 1.630 . 2 219 . 22 LYS HD2 H 1.760 . 2 220 . 22 LYS HE2 H 2.970 . 2 221 . 22 LYS C C 176.000 . 1 222 . 22 LYS CA C 54.540 . 1 223 . 22 LYS CB C 32.130 . 1 224 . 22 LYS CG C 24.560 . 1 225 . 22 LYS CD C 27.510 . 1 226 . 22 LYS CE C 42.080 . 1 227 . 22 LYS N N 118.530 . 1 228 . 23 GLY H H 7.670 . 1 229 . 23 GLY HA2 H 4.490 . 2 230 . 23 GLY HA3 H 3.780 . 2 231 . 23 GLY C C 171.163 . 1 232 . 23 GLY CA C 44.100 . 1 233 . 23 GLY N N 108.150 . 1 234 . 24 GLU H H 8.225 . 1 235 . 24 GLU HA H 4.940 . 1 236 . 24 GLU HB2 H 1.840 . 2 237 . 24 GLU HB3 H 1.590 . 2 238 . 24 GLU HG2 H 2.150 . 2 239 . 24 GLU HG3 H 2.240 . 2 240 . 24 GLU C C 176.338 . 1 241 . 24 GLU CA C 55.909 . 1 242 . 24 GLU CB C 31.861 . 1 243 . 24 GLU CG C 36.400 . 1 244 . 24 GLU N N 117.741 . 1 245 . 25 PHE H H 9.426 . 1 246 . 25 PHE HA H 4.500 . 1 247 . 25 PHE HB2 H 2.920 . 2 248 . 25 PHE HB3 H 2.650 . 2 249 . 25 PHE HD1 H 7.250 . 1 250 . 25 PHE HD2 H 7.250 . 1 251 . 25 PHE HE1 H 7.110 . 1 252 . 25 PHE HE2 H 7.110 . 1 253 . 25 PHE C C 175.595 . 1 254 . 25 PHE CA C 57.077 . 1 255 . 25 PHE CB C 42.952 . 1 256 . 25 PHE N N 120.353 . 1 257 . 26 THR H H 8.433 . 1 258 . 26 THR HA H 4.740 . 1 259 . 26 THR HB H 3.860 . 1 260 . 26 THR HG2 H 1.340 . 1 261 . 26 THR C C 172.452 . 1 262 . 26 THR CA C 65.163 . 1 263 . 26 THR CB C 69.758 . 1 264 . 26 THR CG2 C 22.940 . 1 265 . 26 THR N N 120.159 . 1 266 . 27 GLY H H 9.102 . 1 267 . 27 GLY HA2 H 5.040 . 2 268 . 27 GLY HA3 H 3.210 . 2 269 . 27 GLY C C 171.293 . 1 270 . 27 GLY CA C 44.009 . 1 271 . 27 GLY N N 111.044 . 1 272 . 28 LEU H H 7.585 . 1 273 . 28 LEU HA H 4.950 . 1 274 . 28 LEU HB2 H 1.790 . 2 275 . 28 LEU HB3 H 1.200 . 2 276 . 28 LEU HG H 1.350 . 1 277 . 28 LEU HD1 H 0.800 . 2 278 . 28 LEU HD2 H 0.650 . 2 279 . 28 LEU C C 175.385 . 1 280 . 28 LEU CA C 52.728 . 1 281 . 28 LEU CB C 44.205 . 1 282 . 28 LEU CG C 26.590 . 1 283 . 28 LEU CD1 C 22.930 . 1 284 . 28 LEU CD2 C 26.590 . 1 285 . 28 LEU N N 121.014 . 1 286 . 29 GLY H H 9.286 . 1 287 . 29 GLY HA2 H 1.150 . 1 288 . 29 GLY HA3 H 3.160 . 1 289 . 29 GLY C C 172.262 . 1 290 . 29 GLY CA C 43.333 . 1 291 . 29 GLY N N 116.999 . 1 292 . 30 ILE H H 8.798 . 1 293 . 30 ILE HA H 3.907 . 1 294 . 30 ILE HB H 1.550 . 1 295 . 30 ILE HG12 H 1.400 . 1 296 . 30 ILE HG13 H 0.700 . 1 297 . 30 ILE HG2 H 0.130 . 1 298 . 30 ILE HD1 H 0.200 . 1 299 . 30 ILE C C 173.783 . 1 300 . 30 ILE CA C 59.879 . 1 301 . 30 ILE CB C 36.960 . 1 302 . 30 ILE CG1 C 25.190 . 2 303 . 30 ILE CG2 C 17.160 . 1 304 . 30 ILE CD1 C 8.740 . 1 305 . 30 ILE N N 126.875 . 1 306 . 31 HIS H H 7.340 . 1 307 . 31 HIS HA H 4.437 . 1 308 . 31 HIS HB2 H 3.020 . 2 309 . 31 HIS HB3 H 3.740 . 2 310 . 31 HIS C C 171.993 . 1 311 . 31 HIS CA C 54.741 . 1 312 . 31 HIS CB C 30.119 . 1 313 . 31 HIS N N 108.556 . 1 314 . 32 ASP H H 10.125 . 1 315 . 32 ASP HA H 4.030 . 1 316 . 32 ASP HB2 H 2.610 . 1 317 . 32 ASP HB3 H 2.610 . 1 318 . 32 ASP C C 174.151 . 1 319 . 32 ASP CA C 57.371 . 1 320 . 32 ASP CB C 40.773 . 1 321 . 32 ASP N N 122.894 . 1 322 . 33 ARG H H 8.342 . 1 323 . 33 ARG HA H 4.728 . 1 324 . 33 ARG HB2 H 2.060 . 2 325 . 33 ARG HG2 H 1.530 . 2 326 . 33 ARG HD2 H 3.090 . 2 327 . 33 ARG C C 175.110 . 1 328 . 33 ARG CA C 56.414 . 1 329 . 33 ARG CB C 29.109 . 1 330 . 33 ARG CG C 29.700 . 1 331 . 33 ARG CD C 43.700 . 1 332 . 33 ARG N N 125.839 . 1 333 . 34 VAL H H 8.990 . 1 334 . 34 VAL HA H 4.993 . 1 335 . 34 VAL HB H 1.950 . 1 336 . 34 VAL HG1 H 0.980 . 1 337 . 34 VAL HG2 H 0.980 . 1 338 . 34 VAL C C 175.366 . 1 339 . 34 VAL CA C 62.778 . 1 340 . 34 VAL CB C 33.271 . 1 341 . 34 VAL CG1 C 21.670 . 1 342 . 34 VAL CG2 C 21.670 . 1 343 . 34 VAL N N 121.973 . 1 344 . 35 CYS H H 9.650 . 1 345 . 35 CYS HA H 5.529 . 1 346 . 35 CYS HB2 H 2.470 . 2 347 . 35 CYS HB3 H 2.580 . 2 348 . 35 CYS CA C 55.012 . 1 349 . 35 CYS CB C 32.650 . 1 350 . 35 CYS N N 124.016 . 1 351 . 36 VAL H H 8.280 . 1 352 . 36 VAL HA H 5.550 . 1 353 . 36 VAL HB H 2.300 . 1 354 . 36 VAL HG1 H 1.110 . 1 355 . 36 VAL HG2 H 1.110 . 1 356 . 36 VAL C C 173.260 . 1 357 . 36 VAL CA C 59.000 . 1 358 . 36 VAL CB C 36.330 . 1 359 . 36 VAL CG1 C 21.950 . 1 360 . 36 VAL CG2 C 22.570 . 1 361 . 36 VAL N N 114.850 . 1 362 . 37 ILE H H 8.290 . 1 363 . 37 ILE HA H 4.980 . 1 364 . 37 ILE HB H 1.550 . 1 365 . 37 ILE HG12 H 1.300 . 1 366 . 37 ILE HG13 H 0.800 . 1 367 . 37 ILE HG2 H 0.790 . 1 368 . 37 ILE HD1 H 0.480 . 1 369 . 37 ILE CA C 58.200 . 1 370 . 37 ILE CG2 C 17.930 . 1 371 . 37 ILE CD1 C 14.870 . 1 372 . 37 ILE N N 116.390 . 1 373 . 38 PRO HA H 4.360 . 1 374 . 38 PRO HB2 H 2.370 . 2 375 . 38 PRO HB3 H 1.930 . 2 376 . 38 PRO HG2 H 2.010 . 2 377 . 38 PRO HD2 H 3.670 . 2 378 . 38 PRO HD3 H 3.610 . 2 379 . 38 PRO C C 175.290 . 1 380 . 38 PRO CA C 63.340 . 1 381 . 38 PRO CB C 32.112 . 1 382 . 38 PRO CG C 27.350 . 1 383 . 38 PRO CD C 51.110 . 1 384 . 39 THR H H 7.950 . 1 385 . 39 THR HG2 H 1.140 . 1 386 . 39 THR CA C 61.700 . 1 387 . 39 THR CB C 67.170 . 1 388 . 39 THR CG2 C 21.500 . 1 389 . 39 THR N N 130.270 . 1 390 . 40 HIS HA H 4.220 . 1 391 . 40 HIS HB2 H 2.940 . 2 392 . 40 HIS HB3 H 2.850 . 2 393 . 40 HIS HE1 H 7.200 . 3 394 . 40 HIS C C 174.780 . 1 395 . 40 HIS CA C 58.350 . 1 396 . 40 HIS CB C 27.560 . 1 397 . 41 ALA H H 7.200 . 1 398 . 41 ALA HA H 3.420 . 1 399 . 41 ALA HB H 0.080 . 1 400 . 41 ALA C C 177.420 . 1 401 . 41 ALA CA C 54.130 . 1 402 . 41 ALA CB C 17.950 . 1 403 . 41 ALA N N 120.990 . 1 404 . 42 GLN H H 8.040 . 1 405 . 42 GLN HA H 4.010 . 1 406 . 42 GLN HB2 H 1.630 . 2 407 . 42 GLN HB3 H 1.800 . 2 408 . 42 GLN HG2 H 2.090 . 2 409 . 42 GLN HG3 H 2.300 . 2 410 . 42 GLN HE21 H 7.380 . 1 411 . 42 GLN HE22 H 6.850 . 1 412 . 42 GLN CA C 56.160 . 1 413 . 42 GLN CB C 28.010 . 1 414 . 42 GLN CG C 34.060 . 1 415 . 42 GLN N N 110.280 . 1 416 . 42 GLN NE2 N 111.320 . 1 417 . 43 PRO HA H 4.270 . 1 418 . 43 PRO HB2 H 1.830 . 1 419 . 43 PRO HB3 H 1.640 . 1 420 . 43 PRO HG2 H 1.730 . 1 421 . 43 PRO HD2 H 2.930 . 2 422 . 43 PRO HD3 H 3.870 . 2 423 . 43 PRO C C 176.880 . 1 424 . 43 PRO CA C 62.870 . 1 425 . 43 PRO CB C 31.915 . 1 426 . 43 PRO CG C 27.960 . 1 427 . 43 PRO CD C 49.760 . 1 428 . 44 GLY H H 9.180 . 1 429 . 44 GLY HA2 H 3.730 . 2 430 . 44 GLY HA3 H 4.390 . 2 431 . 44 GLY C C 173.190 . 1 432 . 44 GLY CA C 43.990 . 1 433 . 44 GLY N N 112.680 . 1 434 . 45 ASP H H 8.430 . 1 435 . 45 ASP HA H 4.540 . 1 436 . 45 ASP HB2 H 2.480 . 2 437 . 45 ASP HB3 H 2.860 . 2 438 . 45 ASP C C 175.392 . 1 439 . 45 ASP CA C 56.148 . 1 440 . 45 ASP CB C 41.097 . 1 441 . 45 ASP N N 121.310 . 1 442 . 46 ASP H H 7.818 . 1 443 . 46 ASP HA H 5.190 . 1 444 . 46 ASP HB2 H 2.330 . 1 445 . 46 ASP HB3 H 2.560 . 1 446 . 46 ASP C C 173.828 . 1 447 . 46 ASP CA C 52.690 . 1 448 . 46 ASP CB C 44.398 . 1 449 . 46 ASP N N 114.848 . 1 450 . 47 VAL H H 8.802 . 1 451 . 47 VAL HA H 4.723 . 1 452 . 47 VAL HB H 2.070 . 1 453 . 47 VAL HG1 H 0.700 . 2 454 . 47 VAL HG2 H 0.500 . 2 455 . 47 VAL C C 174.645 . 1 456 . 47 VAL CA C 59.063 . 1 457 . 47 VAL CB C 35.910 . 1 458 . 47 VAL CG1 C 22.340 . 1 459 . 47 VAL CG2 C 17.920 . 1 460 . 47 VAL N N 111.664 . 1 461 . 48 LEU H H 7.961 . 1 462 . 48 LEU HA H 5.291 . 1 463 . 48 LEU HB2 H 1.930 . 1 464 . 48 LEU HB3 H 0.880 . 1 465 . 48 LEU HG H 1.570 . 1 466 . 48 LEU HD1 H 0.660 . 2 467 . 48 LEU HD2 H 0.830 . 2 468 . 48 LEU C C 177.262 . 1 469 . 48 LEU CA C 53.404 . 1 470 . 48 LEU CB C 42.376 . 1 471 . 48 LEU CG C 26.510 . 1 472 . 48 LEU CD1 C 22.030 . 1 473 . 48 LEU CD2 C 24.870 . 1 474 . 48 LEU N N 116.140 . 1 475 . 49 VAL H H 9.410 . 1 476 . 49 VAL HA H 4.582 . 1 477 . 49 VAL HB H 2.040 . 1 478 . 49 VAL HG1 H 0.810 . 1 479 . 49 VAL HG2 H 0.810 . 1 480 . 49 VAL C C 176.500 . 1 481 . 49 VAL CA C 61.311 . 1 482 . 49 VAL CB C 32.268 . 1 483 . 49 VAL CG1 C 21.620 . 1 484 . 49 VAL CG2 C 21.620 . 1 485 . 49 VAL N N 122.765 . 1 486 . 50 ASN H H 9.872 . 1 487 . 50 ASN HA H 4.489 . 1 488 . 50 ASN HB2 H 3.030 . 2 489 . 50 ASN HB3 H 3.170 . 2 490 . 50 ASN C C 175.739 . 1 491 . 50 ASN CA C 54.203 . 1 492 . 50 ASN CB C 37.027 . 1 493 . 50 ASN N N 129.044 . 1 494 . 51 GLY H H 8.346 . 1 495 . 51 GLY HA2 H 4.344 . 2 496 . 51 GLY HA3 H 3.518 . 2 497 . 51 GLY C C 173.161 . 1 498 . 51 GLY CA C 45.736 . 1 499 . 51 GLY N N 101.315 . 1 500 . 52 GLN H H 7.806 . 1 501 . 52 GLN HA H 4.614 . 1 502 . 52 GLN HB2 H 2.120 . 2 503 . 52 GLN HB3 H 2.010 . 2 504 . 52 GLN HG2 H 2.370 . 2 505 . 52 GLN HG3 H 2.270 . 2 506 . 52 GLN C C 175.231 . 1 507 . 52 GLN CA C 54.076 . 1 508 . 52 GLN CB C 30.373 . 1 509 . 52 GLN CG C 33.450 . 1 510 . 52 GLN N N 120.767 . 1 511 . 53 LYS H H 8.876 . 1 512 . 53 LYS HA H 4.462 . 1 513 . 53 LYS HB2 H 1.520 . 2 514 . 53 LYS HB3 H 1.770 . 2 515 . 53 LYS HG2 H 1.210 . 2 516 . 53 LYS HD2 H 1.570 . 2 517 . 53 LYS HE2 H 2.820 . 1 518 . 53 LYS HE3 H 2.820 . 1 519 . 53 LYS C C 175.501 . 1 520 . 53 LYS CA C 58.290 . 1 521 . 53 LYS CB C 32.053 . 1 522 . 53 LYS CG C 24.750 . 1 523 . 53 LYS CD C 29.260 . 1 524 . 53 LYS CE C 41.660 . 1 525 . 53 LYS N N 127.928 . 1 526 . 54 ILE H H 9.385 . 1 527 . 54 ILE HA H 4.496 . 1 528 . 54 ILE HB H 1.770 . 1 529 . 54 ILE HG12 H 1.290 . 1 530 . 54 ILE HG13 H 1.560 . 1 531 . 54 ILE HG2 H 0.930 . 1 532 . 54 ILE HD1 H 0.810 . 1 533 . 54 ILE C C 174.427 . 1 534 . 54 ILE CA C 58.420 . 1 535 . 54 ILE CB C 40.460 . 1 536 . 54 ILE CG1 C 27.130 . 2 537 . 54 ILE CG2 C 18.810 . 1 538 . 54 ILE CD1 C 10.880 . 1 539 . 54 ILE N N 130.967 . 1 540 . 55 ARG H H 8.904 . 1 541 . 55 ARG HA H 4.513 . 1 542 . 55 ARG HB2 H 2.120 . 2 543 . 55 ARG HB3 H 1.970 . 2 544 . 55 ARG HG2 H 1.800 . 2 545 . 55 ARG HG3 H 1.570 . 2 546 . 55 ARG HD2 H 3.340 . 2 547 . 55 ARG HD3 H 3.290 . 2 548 . 55 ARG C C 175.009 . 1 549 . 55 ARG CA C 56.934 . 1 550 . 55 ARG CB C 31.144 . 1 551 . 55 ARG CG C 27.840 . 1 552 . 55 ARG CD C 43.450 . 1 553 . 55 ARG N N 126.161 . 1 554 . 56 VAL H H 8.437 . 1 555 . 56 VAL HA H 4.032 . 1 556 . 56 VAL HB H 2.030 . 1 557 . 56 VAL HG1 H 0.800 . 1 558 . 56 VAL HG2 H 0.800 . 1 559 . 56 VAL C C 175.920 . 1 560 . 56 VAL CA C 62.228 . 1 561 . 56 VAL CB C 32.153 . 1 562 . 56 VAL CG1 C 22.260 . 1 563 . 56 VAL CG2 C 23.260 . 1 564 . 56 VAL N N 125.269 . 1 565 . 57 LYS H H 8.881 . 1 566 . 57 LYS HA H 4.192 . 1 567 . 57 LYS HB2 H 1.690 . 2 568 . 57 LYS HB3 H 1.450 . 2 569 . 57 LYS HG2 H 1.390 . 2 570 . 57 LYS HD2 H 1.580 . 2 571 . 57 LYS HE2 H 2.900 . 1 572 . 57 LYS HE3 H 2.900 . 1 573 . 57 LYS C C 175.857 . 1 574 . 57 LYS CA C 57.994 . 1 575 . 57 LYS CB C 33.317 . 1 576 . 57 LYS CG C 24.900 . 1 577 . 57 LYS CD C 29.150 . 1 578 . 57 LYS CE C 41.670 . 1 579 . 57 LYS N N 129.136 . 1 580 . 58 ASP H H 7.665 . 1 581 . 58 ASP HA H 4.823 . 1 582 . 58 ASP HB2 H 2.670 . 2 583 . 58 ASP HB3 H 2.530 . 2 584 . 58 ASP C C 172.992 . 1 585 . 58 ASP CA C 53.522 . 1 586 . 58 ASP CB C 44.355 . 1 587 . 58 ASP N N 114.718 . 1 588 . 59 LYS H H 8.196 . 1 589 . 59 LYS HA H 5.390 . 1 590 . 59 LYS HB2 H 1.400 . 1 591 . 59 LYS HB3 H 1.720 . 1 592 . 59 LYS HG2 H 1.290 . 2 593 . 59 LYS HG3 H 1.200 . 2 594 . 59 LYS HD2 H 1.290 . 2 595 . 59 LYS HD3 H 1.490 . 2 596 . 59 LYS HE2 H 2.930 . 2 597 . 59 LYS HE3 H 2.860 . 2 598 . 59 LYS C C 174.438 . 1 599 . 59 LYS CA C 55.035 . 1 600 . 59 LYS CB C 35.429 . 1 601 . 59 LYS CG C 22.880 . 1 602 . 59 LYS CD C 29.870 . 1 603 . 59 LYS CE C 41.770 . 1 604 . 59 LYS N N 118.107 . 1 605 . 60 TYR H H 8.450 . 1 606 . 60 TYR HA H 4.770 . 1 607 . 60 TYR HB2 H 3.140 . 2 608 . 60 TYR HB3 H 2.920 . 2 609 . 60 TYR HD1 H 6.920 . 1 610 . 60 TYR HD2 H 6.920 . 1 611 . 60 TYR HE1 H 6.720 . 1 612 . 60 TYR HE2 H 6.720 . 1 613 . 60 TYR CA C 56.636 . 1 614 . 60 TYR CB C 40.120 . 1 615 . 60 TYR N N 119.161 . 1 616 . 61 LYS H H 8.580 . 1 617 . 61 LYS HA H 4.610 . 1 618 . 61 LYS HB2 H 1.730 . 2 619 . 61 LYS HG2 H 1.370 . 2 620 . 61 LYS HE2 H 2.910 . 2 621 . 61 LYS CA C 55.550 . 1 622 . 61 LYS CB C 32.975 . 1 623 . 61 LYS CG C 24.560 . 1 624 . 61 LYS CD C 29.010 . 1 625 . 61 LYS CE C 42.360 . 1 626 . 61 LYS N N 123.170 . 1 627 . 62 LEU HA H 4.440 . 1 628 . 62 LEU HB2 H 1.560 . 2 629 . 62 LEU HB3 H 1.000 . 2 630 . 62 LEU HG H 1.300 . 1 631 . 62 LEU HD1 H 0.290 . 2 632 . 62 LEU HD2 H 0.530 . 2 633 . 62 LEU CA C 55.350 . 1 634 . 62 LEU CG C 27.230 . 1 635 . 62 LEU CD1 C 24.500 . 1 636 . 62 LEU CD2 C 23.200 . 1 637 . 63 VAL HA H 4.650 . 1 638 . 63 VAL HB H 1.800 . 1 639 . 63 VAL HG1 H 0.930 . 2 640 . 63 VAL HG2 H 0.820 . 2 641 . 63 VAL C C 174.990 . 1 642 . 63 VAL CA C 59.620 . 1 643 . 63 VAL CB C 35.810 . 1 644 . 63 VAL CG1 C 18.800 . 1 645 . 63 VAL CG2 C 21.660 . 1 646 . 64 ASP H H 8.940 . 1 647 . 64 ASP HA H 4.750 . 1 648 . 64 ASP HB2 H 3.350 . 2 649 . 64 ASP HB3 H 2.560 . 2 650 . 64 ASP CA C 52.950 . 1 651 . 64 ASP CB C 41.490 . 1 652 . 64 ASP N N 126.040 . 1 653 . 65 PRO HA H 4.410 . 1 654 . 65 PRO HB2 H 2.380 . 2 655 . 65 PRO HB3 H 2.480 . 2 656 . 65 PRO HG2 H 2.120 . 2 657 . 65 PRO HG3 H 1.950 . 2 658 . 65 PRO HD2 H 3.650 . 2 659 . 65 PRO HD3 H 3.560 . 2 660 . 65 PRO C C 177.371 . 1 661 . 65 PRO CA C 65.487 . 1 662 . 65 PRO CB C 31.668 . 1 663 . 65 PRO CG C 27.970 . 1 664 . 65 PRO CD C 51.560 . 1 665 . 66 GLU H H 8.277 . 1 666 . 66 GLU HA H 4.371 . 1 667 . 66 GLU HB2 H 2.280 . 2 668 . 66 GLU HG2 H 2.180 . 2 669 . 66 GLU CA C 55.830 . 1 670 . 66 GLU CB C 29.524 . 1 671 . 66 GLU CG C 37.370 . 1 672 . 66 GLU N N 116.797 . 1 673 . 67 ASN H H 8.620 . 1 674 . 67 ASN HA H 4.210 . 1 675 . 67 ASN HB2 H 3.110 . 2 676 . 67 ASN HB3 H 2.980 . 2 677 . 67 ASN HD21 H 6.920 . 2 678 . 67 ASN HD22 H 7.560 . 2 679 . 67 ASN C C 174.670 . 1 680 . 67 ASN CA C 54.460 . 1 681 . 67 ASN CB C 36.430 . 1 682 . 67 ASN ND2 N 112.070 . 1 683 . 68 ILE H H 8.470 . 1 684 . 68 ILE HA H 4.150 . 1 685 . 68 ILE HB H 1.850 . 1 686 . 68 ILE HG12 H 1.160 . 1 687 . 68 ILE HG13 H 1.430 . 1 688 . 68 ILE HG2 H 0.850 . 1 689 . 68 ILE HD1 H 0.770 . 1 690 . 68 ILE C C 175.837 . 1 691 . 68 ILE CA C 61.060 . 1 692 . 68 ILE CB C 38.700 . 1 693 . 68 ILE CG1 C 27.220 . 2 694 . 68 ILE CG2 C 17.570 . 1 695 . 68 ILE CD1 C 12.950 . 1 696 . 68 ILE N N 121.550 . 1 697 . 69 ASN H H 8.430 . 1 698 . 69 ASN HA H 4.250 . 1 699 . 69 ASN HB2 H 2.900 . 2 700 . 69 ASN CA C 56.600 . 1 701 . 69 ASN N N 124.700 . 1 702 . 71 GLU HA H 4.150 . 1 703 . 71 GLU HB2 H 2.060 . 2 704 . 71 GLU HG2 H 2.430 . 2 705 . 71 GLU HG3 H 2.310 . 2 706 . 71 GLU CG C 38.330 . 1 707 . 72 LEU HA H 4.810 . 1 708 . 72 LEU HB2 H 1.070 . 2 709 . 72 LEU HB3 H 1.400 . 2 710 . 72 LEU HG H 0.950 . 1 711 . 72 LEU HD1 H 0.810 . 1 712 . 72 LEU HD2 H 0.810 . 1 713 . 72 LEU C C 175.162 . 1 714 . 72 LEU CA C 53.225 . 1 715 . 72 LEU CB C 46.830 . 1 716 . 72 LEU CG C 26.300 . 1 717 . 72 LEU CD1 C 23.450 . 1 718 . 72 LEU CD2 C 23.450 . 1 719 . 73 THR H H 8.750 . 1 720 . 73 THR HA H 4.890 . 1 721 . 73 THR HB H 3.570 . 1 722 . 73 THR HG2 H 0.840 . 1 723 . 73 THR C C 171.360 . 1 724 . 73 THR CA C 62.058 . 1 725 . 73 THR CB C 72.300 . 1 726 . 73 THR CG2 C 20.710 . 1 727 . 73 THR N N 118.776 . 1 728 . 74 VAL H H 8.750 . 1 729 . 74 VAL HA H 4.528 . 1 730 . 74 VAL HB H 1.390 . 1 731 . 74 VAL HG1 H 0.980 . 2 732 . 74 VAL HG2 H 0.780 . 2 733 . 74 VAL C C 175.460 . 1 734 . 74 VAL CA C 61.293 . 1 735 . 74 VAL CB C 32.564 . 1 736 . 74 VAL CG1 C 22.430 . 1 737 . 74 VAL CG2 C 21.370 . 1 738 . 74 VAL N N 127.367 . 1 739 . 75 LEU H H 9.335 . 1 740 . 75 LEU HA H 5.050 . 1 741 . 75 LEU HB2 H 1.950 . 1 742 . 75 LEU HB3 H 1.280 . 1 743 . 75 LEU HG H 1.550 . 1 744 . 75 LEU HD1 H 0.680 . 1 745 . 75 LEU HD2 H 0.680 . 1 746 . 75 LEU C C 175.837 . 1 747 . 75 LEU CA C 53.399 . 1 748 . 75 LEU CB C 44.828 . 1 749 . 75 LEU CG C 26.570 . 1 750 . 75 LEU CD1 C 25.690 . 1 751 . 75 LEU CD2 C 24.840 . 1 752 . 75 LEU N N 126.315 . 1 753 . 76 THR H H 8.663 . 1 754 . 76 THR HA H 5.047 . 1 755 . 76 THR HB H 3.970 . 1 756 . 76 THR HG2 H 1.160 . 1 757 . 76 THR C C 174.981 . 1 758 . 76 THR CA C 61.853 . 1 759 . 76 THR CB C 69.023 . 1 760 . 76 THR CG2 C 21.660 . 1 761 . 76 THR N N 117.520 . 1 762 . 77 LEU H H 9.243 . 1 763 . 77 LEU HA H 4.616 . 1 764 . 77 LEU HB2 H 1.810 . 2 765 . 77 LEU HB3 H 1.210 . 2 766 . 77 LEU HG H 1.820 . 1 767 . 77 LEU HD1 H 0.610 . 2 768 . 77 LEU HD2 H 0.900 . 2 769 . 77 LEU C C 176.160 . 1 770 . 77 LEU CA C 53.999 . 1 771 . 77 LEU CB C 44.390 . 1 772 . 77 LEU CG C 26.900 . 1 773 . 77 LEU CD1 C 21.780 . 1 774 . 77 LEU CD2 C 26.900 . 1 775 . 77 LEU N N 126.352 . 1 776 . 78 ASP H H 8.587 . 1 777 . 78 ASP HA H 4.808 . 1 778 . 78 ASP HB2 H 2.050 . 2 779 . 78 ASP HB3 H 3.170 . 2 780 . 78 ASP C C 173.518 . 1 781 . 78 ASP CA C 52.474 . 1 782 . 78 ASP CB C 39.841 . 1 783 . 78 ASP N N 121.363 . 1 784 . 79 ARG H H 7.284 . 1 785 . 79 ARG HA H 4.727 . 1 786 . 79 ARG CA C 54.230 . 1 787 . 79 ARG CB C 33.557 . 1 788 . 79 ARG N N 119.344 . 1 789 . 80 ASN HA H 4.450 . 1 790 . 80 ASN HB2 H 3.100 . 2 791 . 80 ASN HB3 H 2.700 . 2 792 . 80 ASN C C 176.251 . 1 793 . 80 ASN CA C 55.550 . 1 794 . 80 ASN CB C 39.237 . 1 795 . 81 GLU H H 8.360 . 1 796 . 81 GLU HA H 3.984 . 1 797 . 81 GLU HB2 H 1.610 . 2 798 . 81 GLU HB3 H 1.670 . 2 799 . 81 GLU HG2 H 2.150 . 2 800 . 81 GLU C C 175.276 . 1 801 . 81 GLU CA C 57.595 . 1 802 . 81 GLU CB C 30.480 . 1 803 . 81 GLU CG C 36.580 . 1 804 . 81 GLU N N 120.079 . 1 805 . 82 LYS H H 8.380 . 1 806 . 82 LYS HA H 4.170 . 1 807 . 82 LYS HB2 H 1.640 . 2 808 . 82 LYS HB3 H 1.890 . 2 809 . 82 LYS HG2 H 1.460 . 2 810 . 82 LYS HD2 H 1.710 . 2 811 . 82 LYS HE2 H 2.990 . 1 812 . 82 LYS HE3 H 2.990 . 1 813 . 82 LYS C C 177.504 . 1 814 . 82 LYS CA C 54.857 . 1 815 . 82 LYS CB C 35.390 . 1 816 . 82 LYS CG C 25.780 . 1 817 . 82 LYS CD C 29.430 . 1 818 . 82 LYS CE C 42.000 . 1 819 . 82 LYS N N 121.357 . 1 820 . 83 PHE H H 9.252 . 1 821 . 83 PHE HA H 4.683 . 1 822 . 83 PHE HB2 H 2.070 . 2 823 . 83 PHE HB3 H 2.840 . 2 824 . 83 PHE HD1 H 7.270 . 1 825 . 83 PHE HD2 H 7.270 . 1 826 . 83 PHE HE1 H 7.140 . 1 827 . 83 PHE HE2 H 7.140 . 1 828 . 83 PHE C C 176.124 . 1 829 . 83 PHE CA C 57.506 . 1 830 . 83 PHE CB C 39.650 . 1 831 . 83 PHE N N 121.752 . 1 832 . 84 ARG H H 8.771 . 1 833 . 84 ARG HA H 4.110 . 1 834 . 84 ARG HB2 H 1.810 . 2 835 . 84 ARG HB3 H 1.910 . 2 836 . 84 ARG HG2 H 1.400 . 2 837 . 84 ARG HD2 H 3.160 . 1 838 . 84 ARG HD3 H 3.160 . 1 839 . 84 ARG C C 176.107 . 1 840 . 84 ARG CA C 56.562 . 1 841 . 84 ARG CB C 29.900 . 1 842 . 84 ARG CG C 26.680 . 1 843 . 84 ARG CD C 43.320 . 1 844 . 84 ARG N N 124.301 . 1 845 . 85 ASP H H 8.727 . 1 846 . 85 ASP HA H 5.144 . 1 847 . 85 ASP HB2 H 3.030 . 1 848 . 85 ASP HB3 H 3.030 . 1 849 . 85 ASP C C 178.760 . 1 850 . 85 ASP CA C 54.050 . 1 851 . 85 ASP CB C 40.420 . 1 852 . 85 ASP N N 126.063 . 1 853 . 86 ILE H H 8.957 . 1 854 . 86 ILE HA H 4.643 . 1 855 . 86 ILE HB H 2.610 . 1 856 . 86 ILE HG12 H 1.520 . 1 857 . 86 ILE HG13 H 1.450 . 1 858 . 86 ILE HG2 H 0.790 . 1 859 . 86 ILE HD1 H 0.830 . 1 860 . 86 ILE C C 177.716 . 1 861 . 86 ILE CA C 59.707 . 1 862 . 86 ILE CB C 38.446 . 1 863 . 86 ILE CG1 C 27.340 . 2 864 . 86 ILE CG2 C 19.910 . 1 865 . 86 ILE CD1 C 15.620 . 1 866 . 86 ILE N N 121.403 . 1 867 . 87 ARG H H 8.767 . 1 868 . 87 ARG HA H 3.642 . 1 869 . 87 ARG HB2 H 2.040 . 2 870 . 87 ARG HB3 H 1.720 . 2 871 . 87 ARG HG2 H 1.330 . 2 872 . 87 ARG HG3 H 1.220 . 2 873 . 87 ARG C C 178.527 . 1 874 . 87 ARG CA C 60.741 . 1 875 . 87 ARG CB C 30.150 . 1 876 . 87 ARG CG C 28.590 . 1 877 . 87 ARG CD C 43.320 . 1 878 . 87 ARG N N 121.573 . 1 879 . 88 GLY H H 8.634 . 1 880 . 88 GLY HA2 H 3.760 . 2 881 . 88 GLY HA3 H 3.404 . 2 882 . 88 GLY C C 174.910 . 1 883 . 88 GLY CA C 45.831 . 1 884 . 88 GLY N N 103.285 . 1 885 . 89 PHE H H 7.710 . 1 886 . 89 PHE HA H 4.795 . 1 887 . 89 PHE HB2 H 2.920 . 1 888 . 89 PHE HB3 H 3.290 . 1 889 . 89 PHE HD1 H 7.230 . 1 890 . 89 PHE HD2 H 7.230 . 1 891 . 89 PHE HE1 H 7.360 . 1 892 . 89 PHE HE2 H 7.360 . 1 893 . 89 PHE HZ H 7.100 . 1 894 . 89 PHE C C 176.403 . 1 895 . 89 PHE CA C 56.388 . 1 896 . 89 PHE CB C 39.740 . 1 897 . 89 PHE N N 115.651 . 1 898 . 90 ILE H H 7.470 . 1 899 . 90 ILE HA H 4.301 . 1 900 . 90 ILE HB H 1.870 . 1 901 . 90 ILE HG12 H 2.000 . 1 902 . 90 ILE HG2 H 0.730 . 1 903 . 90 ILE HD1 H 0.880 . 1 904 . 90 ILE C C 175.976 . 1 905 . 90 ILE CA C 63.808 . 1 906 . 90 ILE CB C 37.350 . 1 907 . 90 ILE CG1 C 28.600 . 2 908 . 90 ILE CG2 C 17.600 . 1 909 . 90 ILE CD1 C 14.350 . 1 910 . 90 ILE N N 122.165 . 1 911 . 91 SER H H 8.477 . 1 912 . 91 SER HA H 4.880 . 1 913 . 91 SER HB2 H 3.870 . 2 914 . 91 SER HB3 H 3.350 . 2 915 . 91 SER C C 173.942 . 1 916 . 91 SER CA C 56.714 . 1 917 . 91 SER CB C 65.650 . 1 918 . 91 SER N N 122.720 . 1 919 . 92 GLU H H 8.984 . 1 920 . 92 GLU HA H 4.596 . 1 921 . 92 GLU HB2 H 2.370 . 2 922 . 92 GLU HB3 H 1.880 . 2 923 . 92 GLU HG2 H 2.300 . 2 924 . 92 GLU HG3 H 2.340 . 2 925 . 92 GLU C C 175.578 . 1 926 . 92 GLU CA C 55.496 . 1 927 . 92 GLU CB C 30.331 . 1 928 . 92 GLU CG C 36.660 . 1 929 . 92 GLU N N 124.346 . 1 930 . 93 ASP H H 8.462 . 1 931 . 93 ASP HA H 4.860 . 1 932 . 93 ASP HB2 H 2.720 . 2 933 . 93 ASP HB3 H 2.500 . 2 934 . 93 ASP C C 174.326 . 1 935 . 93 ASP CA C 53.680 . 1 936 . 93 ASP CB C 39.687 . 1 937 . 93 ASP N N 123.041 . 1 938 . 94 LEU H H 7.724 . 1 939 . 94 LEU HA H 3.810 . 1 940 . 94 LEU HB2 H 0.820 . 1 941 . 94 LEU HB3 H 0.980 . 1 942 . 94 LEU HG H 1.350 . 1 943 . 94 LEU HD1 H 0.550 . 2 944 . 94 LEU HD2 H 0.480 . 2 945 . 94 LEU C C 176.619 . 1 946 . 94 LEU CA C 54.884 . 1 947 . 94 LEU CB C 42.630 . 1 948 . 94 LEU CG C 26.320 . 1 949 . 94 LEU CD1 C 25.460 . 1 950 . 94 LEU CD2 C 25.460 . 1 951 . 94 LEU N N 120.174 . 1 952 . 95 GLU H H 8.022 . 1 953 . 95 GLU HA H 3.960 . 1 954 . 95 GLU HB2 H 2.040 . 2 955 . 95 GLU HB3 H 1.960 . 2 956 . 95 GLU HG2 H 2.210 . 2 957 . 95 GLU HG3 H 2.270 . 2 958 . 95 GLU C C 178.709 . 1 959 . 95 GLU CA C 58.700 . 1 960 . 95 GLU CB C 29.068 . 1 961 . 95 GLU CG C 35.710 . 1 962 . 95 GLU N N 120.095 . 1 963 . 96 GLY H H 8.956 . 1 964 . 96 GLY HA2 H 4.067 . 2 965 . 96 GLY HA3 H 3.789 . 2 966 . 96 GLY C C 174.034 . 1 967 . 96 GLY CA C 46.081 . 1 968 . 96 GLY N N 113.957 . 1 969 . 97 VAL H H 7.500 . 1 970 . 97 VAL HA H 3.948 . 1 971 . 97 VAL HB H 1.860 . 1 972 . 97 VAL HG1 H 0.640 . 2 973 . 97 VAL HG2 H 0.790 . 2 974 . 97 VAL C C 175.200 . 1 975 . 97 VAL CA C 62.157 . 1 976 . 97 VAL CB C 33.328 . 1 977 . 97 VAL CG2 C 21.410 . 1 978 . 97 VAL N N 120.080 . 1 979 . 98 ASP H H 8.273 . 1 980 . 98 ASP HA H 4.407 . 1 981 . 98 ASP HB2 H 2.590 . 2 982 . 98 ASP HB3 H 2.480 . 2 983 . 98 ASP C C 175.082 . 1 984 . 98 ASP CA C 54.277 . 1 985 . 98 ASP CB C 41.147 . 1 986 . 98 ASP N N 126.521 . 1 987 . 99 ALA H H 8.190 . 1 988 . 99 ALA HA H 4.904 . 1 989 . 99 ALA HB H 1.300 . 1 990 . 99 ALA C C 176.203 . 1 991 . 99 ALA CA C 51.306 . 1 992 . 99 ALA CB C 23.438 . 1 993 . 99 ALA N N 127.385 . 1 994 . 100 THR H H 9.370 . 1 995 . 100 THR HA H 5.002 . 1 996 . 100 THR HB H 3.650 . 1 997 . 100 THR HG2 H 0.920 . 1 998 . 100 THR C C 171.991 . 1 999 . 100 THR CA C 61.014 . 1 1000 . 100 THR CB C 72.288 . 1 1001 . 100 THR CG2 C 22.940 . 1 1002 . 100 THR N N 117.614 . 1 1003 . 101 LEU H H 9.469 . 1 1004 . 101 LEU HA H 5.128 . 1 1005 . 101 LEU HB2 H 1.330 . 2 1006 . 101 LEU HB3 H 0.740 . 2 1007 . 101 LEU HD1 H 0.500 . 2 1008 . 101 LEU HD2 H 0.300 . 2 1009 . 101 LEU C C 174.980 . 1 1010 . 101 LEU CA C 53.050 . 1 1011 . 101 LEU CB C 46.545 . 1 1012 . 101 LEU CG C 27.050 . 1 1013 . 101 LEU CD1 C 24.540 . 1 1014 . 101 LEU CD2 C 23.540 . 1 1015 . 101 LEU N N 127.343 . 1 1016 . 102 VAL H H 9.050 . 1 1017 . 102 VAL HA H 4.734 . 1 1018 . 102 VAL HB H 2.060 . 1 1019 . 102 VAL HG1 H 0.920 . 1 1020 . 102 VAL HG2 H 0.920 . 1 1021 . 102 VAL CA C 61.458 . 1 1022 . 102 VAL CB C 32.670 . 1 1023 . 102 VAL CG1 C 20.420 . 1 1024 . 102 VAL CG2 C 21.080 . 1 1025 . 102 VAL N N 127.119 . 1 1026 . 103 VAL H H 7.910 . 1 1027 . 103 VAL HB H 1.980 . 1 1028 . 103 VAL HG2 H 0.660 . 2 1029 . 103 VAL C C 171.290 . 1 1030 . 103 VAL CA C 61.420 . 1 1031 . 103 VAL CB C 34.350 . 1 1032 . 103 VAL N N 130.270 . 1 1033 . 104 HIS H H 8.920 . 1 1034 . 104 HIS HA H 5.490 . 1 1035 . 104 HIS HB2 H 2.980 . 2 1036 . 104 HIS HB3 H 3.230 . 2 1037 . 104 HIS HD2 H 6.780 . 3 1038 . 104 HIS HE1 H 7.570 . 3 1039 . 104 HIS CA C 55.110 . 1 1040 . 104 HIS CB C 32.660 . 1 1041 . 104 HIS N N 127.120 . 1 1042 . 105 SER HA H 4.150 . 1 1043 . 105 SER HB2 H 3.900 . 2 1044 . 105 SER HB3 H 3.510 . 2 1045 . 105 SER C C 172.880 . 1 1046 . 105 SER CA C 57.920 . 1 1047 . 105 SER CB C 63.500 . 1 1048 . 106 ASN H H 9.280 . 1 1049 . 106 ASN HA H 4.020 . 1 1050 . 106 ASN HB2 H 2.750 . 2 1051 . 106 ASN HB3 H 3.020 . 2 1052 . 106 ASN C C 174.300 . 1 1053 . 106 ASN CA C 55.210 . 1 1054 . 106 ASN CB C 38.060 . 1 1055 . 106 ASN N N 116.990 . 1 1056 . 107 ASN H H 8.400 . 1 1057 . 107 ASN HA H 4.540 . 1 1058 . 107 ASN HB2 H 2.530 . 2 1059 . 107 ASN HB3 H 2.460 . 2 1060 . 107 ASN HD21 H 7.320 . 2 1061 . 107 ASN HD22 H 6.620 . 2 1062 . 107 ASN C C 173.970 . 1 1063 . 107 ASN CA C 53.550 . 1 1064 . 107 ASN CB C 37.040 . 1 1065 . 107 ASN N N 116.870 . 1 1066 . 107 ASN ND2 N 110.490 . 1 1067 . 108 PHE H H 8.110 . 1 1068 . 108 PHE HA H 4.690 . 1 1069 . 108 PHE HB2 H 3.070 . 2 1070 . 108 PHE HB3 H 2.930 . 2 1071 . 108 PHE HD1 H 7.260 . 1 1072 . 108 PHE HD2 H 7.260 . 1 1073 . 108 PHE HE1 H 7.570 . 1 1074 . 108 PHE HE2 H 7.570 . 1 1075 . 108 PHE C C 174.990 . 1 1076 . 108 PHE CA C 56.250 . 1 1077 . 108 PHE CB C 39.010 . 1 1078 . 108 PHE N N 121.950 . 1 1079 . 109 THR H H 7.100 . 1 1080 . 109 THR HA H 4.350 . 1 1081 . 109 THR HB H 4.100 . 1 1082 . 109 THR HG2 H 0.830 . 1 1083 . 109 THR CA C 60.500 . 1 1084 . 109 THR CB C 69.880 . 1 1085 . 109 THR CG2 C 22.000 . 1 1086 . 109 THR N N 108.350 . 1 1087 . 110 ASN HA H 4.360 . 1 1088 . 110 ASN HB2 H 2.730 . 1 1089 . 110 ASN HB3 H 2.730 . 1 1090 . 110 ASN C C 174.760 . 1 1091 . 110 ASN CA C 54.820 . 1 1092 . 110 ASN CB C 39.430 . 1 1093 . 111 THR H H 8.760 . 1 1094 . 111 THR HA H 4.400 . 1 1095 . 111 THR HB H 3.930 . 1 1096 . 111 THR HG2 H 1.130 . 1 1097 . 111 THR CA C 64.260 . 1 1098 . 111 THR CB C 71.070 . 1 1099 . 111 THR CG2 C 20.450 . 1 1100 . 111 THR N N 115.480 . 1 1101 . 112 ILE H H 8.020 . 1 1102 . 112 ILE HA H 4.490 . 1 1103 . 112 ILE HB H 1.670 . 1 1104 . 112 ILE HG12 H 0.760 . 1 1105 . 112 ILE HG13 H 1.490 . 1 1106 . 112 ILE HG2 H 0.650 . 1 1107 . 112 ILE HD1 H 0.760 . 1 1108 . 112 ILE C C 175.201 . 1 1109 . 112 ILE CA C 60.803 . 1 1110 . 112 ILE CB C 39.364 . 1 1111 . 112 ILE CG1 C 27.840 . 2 1112 . 112 ILE CG2 C 18.870 . 1 1113 . 112 ILE CD1 C 13.750 . 1 1114 . 112 ILE N N 127.700 . 1 1115 . 113 LEU H H 9.134 . 1 1116 . 113 LEU HA H 4.593 . 1 1117 . 113 LEU HB2 H 0.560 . 2 1118 . 113 LEU HB3 H 1.380 . 2 1119 . 113 LEU HG H 1.140 . 1 1120 . 113 LEU HD1 H 0.420 . 2 1121 . 113 LEU HD2 H 0.730 . 2 1122 . 113 LEU C C 175.744 . 1 1123 . 113 LEU CA C 52.946 . 1 1124 . 113 LEU CB C 43.853 . 1 1125 . 113 LEU CG C 26.320 . 1 1126 . 113 LEU CD1 C 24.830 . 1 1127 . 113 LEU CD2 C 22.880 . 1 1128 . 113 LEU N N 128.241 . 1 1129 . 114 GLU H H 8.600 . 1 1130 . 114 GLU HA H 4.644 . 1 1131 . 114 GLU HB2 H 1.930 . 2 1132 . 114 GLU HB3 H 1.920 . 2 1133 . 114 GLU HG2 H 2.190 . 2 1134 . 114 GLU HG3 H 2.290 . 2 1135 . 114 GLU C C 176.704 . 1 1136 . 114 GLU CA C 55.612 . 1 1137 . 114 GLU CB C 28.770 . 1 1138 . 114 GLU CG C 35.150 . 1 1139 . 114 GLU N N 123.407 . 1 1140 . 115 VAL H H 7.470 . 1 1141 . 115 VAL HA H 4.170 . 1 1142 . 115 VAL HB H 2.060 . 1 1143 . 115 VAL HG1 H -0.060 . 2 1144 . 115 VAL HG2 H 0.060 . 2 1145 . 115 VAL C C 175.826 . 1 1146 . 115 VAL CA C 61.276 . 1 1147 . 115 VAL CB C 32.400 . 1 1148 . 115 VAL CG1 C 21.350 . 1 1149 . 115 VAL CG2 C 17.840 . 1 1150 . 115 VAL N N 115.441 . 1 1151 . 116 GLY H H 7.949 . 1 1152 . 116 GLY HA2 H 4.480 . 2 1153 . 116 GLY HA3 H 3.881 . 2 1154 . 116 GLY CA C 44.737 . 1 1155 . 116 GLY N N 109.979 . 1 1156 . 117 PRO HA H 4.750 . 1 1157 . 117 PRO HB2 H 2.200 . 2 1158 . 117 PRO HB3 H 1.830 . 2 1159 . 117 PRO HG2 H 2.060 . 2 1160 . 117 PRO HG3 H 2.120 . 2 1161 . 117 PRO HD2 H 3.900 . 2 1162 . 117 PRO HD3 H 3.780 . 2 1163 . 117 PRO C C 178.306 . 1 1164 . 117 PRO CA C 62.585 . 1 1165 . 117 PRO CB C 32.419 . 1 1166 . 117 PRO CG C 27.410 . 1 1167 . 117 PRO CD C 49.740 . 1 1168 . 118 VAL H H 8.247 . 1 1169 . 118 VAL HA H 5.260 . 1 1170 . 118 VAL HB H 1.950 . 1 1171 . 118 VAL HG1 H 0.870 . 2 1172 . 118 VAL HG2 H 0.660 . 2 1173 . 118 VAL C C 174.698 . 1 1174 . 118 VAL CA C 58.638 . 1 1175 . 118 VAL CB C 34.242 . 1 1176 . 118 VAL CG1 C 23.840 . 1 1177 . 118 VAL CG2 C 19.070 . 1 1178 . 118 VAL N N 115.351 . 1 1179 . 119 THR H H 8.293 . 1 1180 . 119 THR HA H 4.632 . 1 1181 . 119 THR HB H 3.920 . 1 1182 . 119 THR HG2 H 1.050 . 1 1183 . 119 THR C C 172.458 . 1 1184 . 119 THR CA C 59.850 . 1 1185 . 119 THR CB C 71.370 . 1 1186 . 119 THR CG2 C 19.720 . 1 1187 . 119 THR N N 113.283 . 1 1188 . 120 MET H H 9.083 . 1 1189 . 120 MET HA H 4.772 . 1 1190 . 120 MET HB2 H 2.200 . 2 1191 . 120 MET HB3 H 1.920 . 2 1192 . 120 MET HG2 H 2.710 . 2 1193 . 120 MET HG3 H 2.360 . 2 1194 . 120 MET C C 174.200 . 1 1195 . 120 MET CA C 55.341 . 1 1196 . 120 MET CB C 30.900 . 1 1197 . 120 MET CG C 31.340 . 1 1198 . 120 MET N N 125.926 . 1 1199 . 121 ALA H H 8.310 . 1 1200 . 121 ALA HA H 4.440 . 1 1201 . 121 ALA HB H 1.320 . 1 1202 . 121 ALA C C 178.218 . 1 1203 . 121 ALA CA C 52.529 . 1 1204 . 121 ALA CB C 20.060 . 1 1205 . 121 ALA N N 125.200 . 1 1206 . 122 GLY H H 8.342 . 1 1207 . 122 GLY HA2 H 4.130 . 2 1208 . 122 GLY HA3 H 3.650 . 2 1209 . 122 GLY CA C 46.174 . 1 1210 . 122 GLY N N 107.499 . 1 1211 . 123 LEU HA H 4.990 . 1 1212 . 123 LEU HB2 H 1.400 . 2 1213 . 123 LEU HB3 H 1.680 . 2 1214 . 123 LEU HG H 1.300 . 1 1215 . 123 LEU HD1 H 0.770 . 2 1216 . 123 LEU HD2 H 0.730 . 2 1217 . 123 LEU CA C 56.170 . 1 1218 . 123 LEU CB C 42.760 . 1 1219 . 123 LEU CG C 27.340 . 1 1220 . 123 LEU CD1 C 25.180 . 1 1221 . 123 LEU CD2 C 24.680 . 1 1222 . 124 ILE H H 8.350 . 1 1223 . 124 ILE HA H 3.560 . 1 1224 . 124 ILE HB H 1.100 . 1 1225 . 124 ILE HG12 H 0.900 . 1 1226 . 124 ILE HG13 H 1.000 . 1 1227 . 124 ILE HG2 H 0.660 . 1 1228 . 124 ILE HD1 H -0.050 . 1 1229 . 124 ILE CA C 57.980 . 1 1230 . 124 ILE CB C 42.220 . 1 1231 . 124 ILE CG1 C 24.500 . 2 1232 . 124 ILE CD1 C 13.500 . 1 1233 . 124 ILE N N 124.630 . 1 1234 . 125 ASN H H 8.250 . 1 1235 . 125 ASN HA H 4.050 . 1 1236 . 125 ASN HB2 H 3.250 . 2 1237 . 125 ASN HB3 H 2.700 . 2 1238 . 125 ASN C C 173.500 . 1 1239 . 125 ASN CA C 53.270 . 1 1240 . 125 ASN CB C 39.410 . 1 1241 . 125 ASN N N 122.540 . 1 1242 . 126 LEU H H 7.920 . 1 1243 . 126 LEU HA H 4.180 . 1 1244 . 126 LEU HB2 H 1.770 . 2 1245 . 126 LEU HB3 H 0.900 . 2 1246 . 126 LEU HG H 1.160 . 1 1247 . 126 LEU HD1 H 0.800 . 1 1248 . 126 LEU HD2 H 0.800 . 1 1249 . 126 LEU CA C 56.850 . 1 1250 . 126 LEU CB C 39.410 . 1 1251 . 126 LEU N N 130.270 . 1 1252 . 127 SER HB2 H 3.890 . 2 1253 . 127 SER C C 174.992 . 1 1254 . 127 SER CB C 62.500 . 1 1255 . 128 SER HA H 3.960 . 1 1256 . 128 SER HB2 H 4.210 . 1 1257 . 128 SER HB3 H 4.210 . 1 1258 . 128 SER C C 173.800 . 1 1259 . 128 SER CA C 59.780 . 1 1260 . 128 SER CB C 62.630 . 1 1261 . 129 THR H H 7.895 . 1 1262 . 129 THR HA H 4.734 . 1 1263 . 129 THR HB H 4.110 . 1 1264 . 129 THR HG2 H 1.150 . 1 1265 . 129 THR CA C 59.849 . 1 1266 . 129 THR CB C 70.468 . 1 1267 . 129 THR CG2 C 21.000 . 1 1268 . 129 THR N N 118.267 . 1 1269 . 130 PRO HA H 4.450 . 1 1270 . 130 PRO HB2 H 2.200 . 1 1271 . 130 PRO HB3 H 1.820 . 1 1272 . 130 PRO HG2 H 2.110 . 2 1273 . 130 PRO HG3 H 2.040 . 2 1274 . 130 PRO HD2 H 3.670 . 2 1275 . 130 PRO HD3 H 3.830 . 2 1276 . 130 PRO CB C 31.810 . 1 1277 . 130 PRO CD C 49.750 . 1 1278 . 131 THR HG2 H 1.340 . 1 1279 . 131 THR C C 174.240 . 1 1280 . 131 THR CA C 61.830 . 1 1281 . 131 THR CB C 73.760 . 1 1282 . 131 THR CG2 C 21.490 . 1 1283 . 132 ASN H H 8.160 . 1 1284 . 132 ASN HA H 5.280 . 1 1285 . 132 ASN HB2 H 2.680 . 2 1286 . 132 ASN HB3 H 2.510 . 2 1287 . 132 ASN CA C 52.640 . 1 1288 . 132 ASN CB C 38.990 . 1 1289 . 132 ASN N N 123.190 . 1 1290 . 133 ARG H H 8.170 . 1 1291 . 133 ARG HA H 3.720 . 1 1292 . 133 ARG HB2 H 1.720 . 2 1293 . 133 ARG HB3 H 1.450 . 2 1294 . 133 ARG HD2 H 3.130 . 2 1295 . 133 ARG CA C 56.070 . 1 1296 . 133 ARG CD C 43.570 . 1 1297 . 134 MET H H 9.230 . 1 1298 . 134 MET HB2 H 1.680 . 2 1299 . 134 MET HG2 H 2.150 . 2 1300 . 134 MET HG3 H 2.330 . 2 1301 . 134 MET HE H 1.920 . 1 1302 . 134 MET C C 176.530 . 1 1303 . 134 MET CA C 54.360 . 1 1304 . 134 MET CG C 31.240 . 1 1305 . 135 ILE HA H 4.660 . 1 1306 . 135 ILE HB H 1.690 . 1 1307 . 135 ILE HG12 H 1.860 . 1 1308 . 135 ILE HG2 H 0.880 . 1 1309 . 135 ILE HD1 H 0.810 . 1 1310 . 135 ILE C C 174.600 . 1 1311 . 135 ILE CA C 60.720 . 1 1312 . 135 ILE CB C 41.108 . 1 1313 . 135 ILE CG1 C 27.740 . 2 1314 . 135 ILE CG2 C 18.790 . 1 1315 . 135 ILE CD1 C 15.660 . 1 1316 . 136 ARG H H 9.446 . 1 1317 . 136 ARG HA H 5.331 . 1 1318 . 136 ARG HB2 H 1.620 . 2 1319 . 136 ARG HB3 H 1.230 . 2 1320 . 136 ARG HG2 H 1.420 . 2 1321 . 136 ARG HG3 H 1.360 . 2 1322 . 136 ARG HD2 H 2.970 . 1 1323 . 136 ARG HD3 H 2.970 . 1 1324 . 136 ARG C C 174.719 . 1 1325 . 136 ARG CA C 54.082 . 1 1326 . 136 ARG CB C 35.576 . 1 1327 . 136 ARG CG C 27.060 . 1 1328 . 136 ARG CD C 43.990 . 1 1329 . 136 ARG N N 126.950 . 1 1330 . 137 TYR H H 7.360 . 1 1331 . 137 TYR HA H 4.904 . 1 1332 . 137 TYR HB2 H 3.200 . 2 1333 . 137 TYR HB3 H 2.650 . 2 1334 . 137 TYR HD1 H 6.620 . 1 1335 . 137 TYR HD2 H 6.620 . 1 1336 . 137 TYR HE1 H 6.470 . 1 1337 . 137 TYR HE2 H 6.470 . 1 1338 . 137 TYR C C 175.969 . 1 1339 . 137 TYR CA C 52.992 . 1 1340 . 137 TYR CB C 38.548 . 1 1341 . 137 TYR N N 120.080 . 1 1342 . 138 ASP H H 9.330 . 1 1343 . 138 ASP HA H 4.955 . 1 1344 . 138 ASP HB2 H 2.780 . 1 1345 . 138 ASP HB3 H 2.780 . 1 1346 . 138 ASP C C 174.213 . 1 1347 . 138 ASP CA C 54.202 . 1 1348 . 138 ASP CB C 39.870 . 1 1349 . 138 ASP N N 125.249 . 1 1350 . 139 TYR H H 7.785 . 1 1351 . 139 TYR HA H 4.372 . 1 1352 . 139 TYR HB2 H 3.190 . 2 1353 . 139 TYR HB3 H 2.610 . 2 1354 . 139 TYR HD1 H 6.960 . 1 1355 . 139 TYR HD2 H 6.960 . 1 1356 . 139 TYR HE1 H 6.640 . 1 1357 . 139 TYR HE2 H 6.640 . 1 1358 . 139 TYR C C 173.003 . 1 1359 . 139 TYR CA C 58.207 . 1 1360 . 139 TYR CB C 42.480 . 1 1361 . 139 TYR N N 123.485 . 1 1362 . 140 ALA H H 7.609 . 1 1363 . 140 ALA HA H 4.150 . 1 1364 . 140 ALA HB H 1.090 . 1 1365 . 140 ALA C C 175.955 . 1 1366 . 140 ALA CA C 51.066 . 1 1367 . 140 ALA CB C 17.464 . 1 1368 . 140 ALA N N 129.351 . 1 1369 . 141 THR H H 7.605 . 1 1370 . 141 THR HA H 4.220 . 1 1371 . 141 THR HB H 4.080 . 1 1372 . 141 THR HG2 H 1.090 . 1 1373 . 141 THR C C 175.239 . 1 1374 . 141 THR CA C 62.500 . 1 1375 . 141 THR CB C 70.050 . 1 1376 . 141 THR CG2 C 19.010 . 1 1377 . 141 THR N N 116.207 . 1 1378 . 142 LYS HA H 4.340 . 1 1379 . 142 LYS HB2 H 2.360 . 2 1380 . 142 LYS HE2 H 3.170 . 2 1381 . 142 LYS C C 176.110 . 1 1382 . 142 LYS CA C 55.480 . 1 1383 . 142 LYS CB C 33.850 . 1 1384 . 142 LYS CG C 24.640 . 1 1385 . 142 LYS CE C 45.100 . 1 1386 . 143 THR H H 8.220 . 1 1387 . 143 THR HA H 4.310 . 1 1388 . 143 THR HB H 4.160 . 1 1389 . 143 THR HG2 H 1.200 . 1 1390 . 143 THR C C 175.180 . 1 1391 . 143 THR CA C 61.890 . 1 1392 . 143 THR CB C 70.190 . 1 1393 . 143 THR CG2 C 21.450 . 1 1394 . 143 THR N N 116.770 . 1 1395 . 144 GLY H H 8.430 . 1 1396 . 144 GLY HA2 H 4.630 . 2 1397 . 144 GLY HA3 H 3.920 . 2 1398 . 144 GLY C C 173.760 . 1 1399 . 144 GLY CA C 45.490 . 1 1400 . 144 GLY N N 112.350 . 1 1401 . 145 GLN HA H 4.380 . 1 1402 . 145 GLN HB2 H 2.080 . 2 1403 . 145 GLN HG2 H 2.370 . 2 1404 . 145 GLN CA C 54.680 . 1 1405 . 145 GLN CB C 27.460 . 1 1406 . 145 GLN CG C 34.480 . 1 1407 . 146 CYS H H 8.510 . 1 1408 . 146 CYS HA H 3.960 . 1 1409 . 146 CYS HB2 H 3.520 . 2 1410 . 146 CYS HB3 H 3.090 . 2 1411 . 146 CYS CA C 63.730 . 1 1412 . 146 CYS CB C 27.570 . 1 1413 . 146 CYS N N 109.610 . 1 1414 . 147 GLY H H 8.470 . 1 1415 . 147 GLY HA2 H 3.650 . 2 1416 . 147 GLY HA3 H 5.500 . 2 1417 . 147 GLY C C 172.170 . 1 1418 . 147 GLY CA C 45.260 . 1 1419 . 147 GLY N N 109.810 . 1 1420 . 148 GLY H H 8.320 . 1 1421 . 148 GLY HA2 H 3.550 . 2 1422 . 148 GLY HA3 H 4.310 . 2 1423 . 148 GLY C C 171.440 . 1 1424 . 148 GLY CA C 46.220 . 1 1425 . 148 GLY N N 103.750 . 1 1426 . 149 VAL H H 9.266 . 1 1427 . 149 VAL HA H 4.328 . 1 1428 . 149 VAL HB H 2.000 . 1 1429 . 149 VAL HG1 H 0.840 . 2 1430 . 149 VAL HG2 H 1.040 . 2 1431 . 149 VAL C C 174.369 . 1 1432 . 149 VAL CA C 62.752 . 1 1433 . 149 VAL CB C 34.000 . 1 1434 . 149 VAL CG1 C 22.180 . 1 1435 . 149 VAL CG2 C 23.300 . 1 1436 . 149 VAL N N 123.198 . 1 1437 . 150 LEU H H 8.904 . 1 1438 . 150 LEU HA H 5.131 . 1 1439 . 150 LEU HB2 H 1.380 . 2 1440 . 150 LEU HB3 H 1.790 . 2 1441 . 150 LEU HG H 0.910 . 1 1442 . 150 LEU HD1 H 0.290 . 1 1443 . 150 LEU HD2 H 0.290 . 1 1444 . 150 LEU C C 176.480 . 1 1445 . 150 LEU CA C 53.984 . 1 1446 . 150 LEU CB C 42.986 . 1 1447 . 150 LEU CG C 26.840 . 1 1448 . 150 LEU CD1 C 23.560 . 1 1449 . 150 LEU CD2 C 23.560 . 1 1450 . 150 LEU N N 132.425 . 1 1451 . 151 CYS H H 10.026 . 1 1452 . 151 CYS HA H 5.087 . 1 1453 . 151 CYS HB2 H 3.220 . 2 1454 . 151 CYS HB3 H 2.860 . 2 1455 . 151 CYS C C 170.528 . 1 1456 . 151 CYS CA C 56.327 . 1 1457 . 151 CYS CB C 33.086 . 1 1458 . 151 CYS N N 124.414 . 1 1459 . 152 ALA H H 8.968 . 1 1460 . 152 ALA HA H 4.430 . 1 1461 . 152 ALA HB H 1.430 . 1 1462 . 152 ALA C C 176.039 . 1 1463 . 152 ALA CA C 51.441 . 1 1464 . 152 ALA CB C 22.278 . 1 1465 . 152 ALA N N 119.462 . 1 1466 . 153 THR H H 8.209 . 1 1467 . 153 THR HA H 3.160 . 1 1468 . 153 THR HB H 3.990 . 1 1469 . 153 THR HG2 H 1.120 . 1 1470 . 153 THR C C 175.421 . 1 1471 . 153 THR CA C 66.125 . 1 1472 . 153 THR CB C 68.374 . 1 1473 . 153 THR CG2 C 21.550 . 1 1474 . 153 THR N N 114.979 . 1 1475 . 154 GLY HA2 H 2.660 . 2 1476 . 154 GLY HA3 H 3.710 . 2 1477 . 154 GLY C C 172.180 . 1 1478 . 154 GLY CA C 46.230 . 1 1479 . 155 LYS H H 7.670 . 1 1480 . 155 LYS HA H 5.060 . 1 1481 . 155 LYS HB2 H 0.970 . 2 1482 . 155 LYS HB3 H 0.770 . 2 1483 . 155 LYS HG2 H 1.240 . 2 1484 . 155 LYS HD2 H 1.860 . 2 1485 . 155 LYS HD3 H 1.530 . 2 1486 . 155 LYS HE2 H 3.030 . 1 1487 . 155 LYS HE3 H 3.030 . 1 1488 . 155 LYS C C 177.360 . 1 1489 . 155 LYS CA C 55.170 . 1 1490 . 155 LYS CB C 39.010 . 1 1491 . 155 LYS CD C 30.120 . 1 1492 . 155 LYS CE C 41.380 . 1 1493 . 155 LYS N N 118.530 . 1 1494 . 156 ILE H H 8.350 . 1 1495 . 156 ILE HA H 3.970 . 1 1496 . 156 ILE HB H 1.360 . 1 1497 . 156 ILE HG12 H 1.460 . 1 1498 . 156 ILE HG13 H 1.630 . 1 1499 . 156 ILE HG2 H 0.740 . 1 1500 . 156 ILE HD1 H 0.980 . 1 1501 . 156 ILE C C 174.480 . 1 1502 . 156 ILE CA C 60.880 . 1 1503 . 156 ILE CB C 40.530 . 1 1504 . 156 ILE CG1 C 27.550 . 2 1505 . 156 ILE CG2 C 17.780 . 1 1506 . 156 ILE CD1 C 15.980 . 1 1507 . 156 ILE N N 120.790 . 1 1508 . 157 PHE H H 8.820 . 1 1509 . 157 PHE HA H 5.520 . 1 1510 . 157 PHE HB2 H 3.280 . 2 1511 . 157 PHE HB3 H 2.490 . 2 1512 . 157 PHE HD1 H 7.070 . 1 1513 . 157 PHE HD2 H 7.070 . 1 1514 . 157 PHE HE1 H 6.960 . 1 1515 . 157 PHE HE2 H 6.960 . 1 1516 . 157 PHE C C 177.640 . 1 1517 . 157 PHE CA C 56.820 . 1 1518 . 157 PHE CB C 42.300 . 1 1519 . 157 PHE N N 122.550 . 1 1520 . 158 GLY H H 7.820 . 1 1521 . 158 GLY HA2 H 4.730 . 2 1522 . 158 GLY HA3 H 4.160 . 2 1523 . 158 GLY C C 169.940 . 1 1524 . 158 GLY CA C 47.600 . 1 1525 . 158 GLY N N 103.110 . 1 1526 . 159 ILE H H 8.550 . 1 1527 . 159 ILE HA H 5.330 . 1 1528 . 159 ILE HB H 1.930 . 1 1529 . 159 ILE HG12 H 1.320 . 1 1530 . 159 ILE HG13 H 1.470 . 1 1531 . 159 ILE HG2 H 0.940 . 1 1532 . 159 ILE HD1 H 0.870 . 1 1533 . 159 ILE CA C 56.970 . 1 1534 . 159 ILE CB C 41.330 . 1 1535 . 159 ILE CG2 C 17.770 . 1 1536 . 159 ILE CD1 C 11.930 . 1 1537 . 159 ILE N N 117.630 . 1 1538 . 160 HIS H H 9.210 . 1 1539 . 160 HIS HA H 4.180 . 1 1540 . 160 HIS HB2 H 3.450 . 2 1541 . 160 HIS HB3 H 3.140 . 2 1542 . 160 HIS HD2 H 6.600 . 3 1543 . 161 VAL H H 9.260 . 1 1544 . 161 VAL HA H 5.220 . 1 1545 . 161 VAL HB H 2.610 . 1 1546 . 161 VAL HG1 H 0.790 . 2 1547 . 161 VAL HG2 H 1.210 . 2 1548 . 161 VAL C C 175.390 . 1 1549 . 161 VAL CA C 62.800 . 1 1550 . 161 VAL CG1 C 19.790 . 1 1551 . 161 VAL CG2 C 21.680 . 1 1552 . 161 VAL N N 118.550 . 1 1553 . 162 GLY H H 6.910 . 1 1554 . 162 GLY HA2 H 4.210 . 2 1555 . 162 GLY HA3 H 4.000 . 2 1556 . 162 GLY C C 169.940 . 1 1557 . 162 GLY CA C 45.570 . 1 1558 . 162 GLY N N 106.500 . 1 1559 . 163 GLY H H 8.320 . 1 1560 . 163 GLY HA2 H 4.330 . 2 1561 . 163 GLY HA3 H 4.580 . 2 1562 . 163 GLY C C 172.671 . 1 1563 . 163 GLY CA C 46.389 . 1 1564 . 163 GLY N N 104.960 . 1 1565 . 164 ASN H H 8.194 . 1 1566 . 164 ASN HA H 5.150 . 1 1567 . 164 ASN HB2 H 2.850 . 2 1568 . 164 ASN HB3 H 3.550 . 2 1569 . 164 ASN C C 176.396 . 1 1570 . 164 ASN CA C 51.733 . 1 1571 . 164 ASN CB C 39.545 . 1 1572 . 164 ASN N N 115.542 . 1 1573 . 165 GLY H H 8.941 . 1 1574 . 165 GLY HA2 H 3.630 . 2 1575 . 165 GLY HA3 H 4.540 . 2 1576 . 165 GLY C C 174.309 . 1 1577 . 165 GLY CA C 45.750 . 1 1578 . 165 GLY N N 111.919 . 1 1579 . 166 ARG H H 8.017 . 1 1580 . 166 ARG HA H 4.400 . 1 1581 . 166 ARG HB2 H 1.850 . 2 1582 . 166 ARG HB3 H 1.660 . 2 1583 . 166 ARG HG2 H 1.780 . 2 1584 . 166 ARG HG3 H 1.590 . 2 1585 . 166 ARG HD2 H 3.140 . 1 1586 . 166 ARG HD3 H 3.140 . 1 1587 . 166 ARG C C 174.694 . 1 1588 . 166 ARG CA C 56.424 . 1 1589 . 166 ARG CB C 32.103 . 1 1590 . 166 ARG CG C 27.280 . 1 1591 . 166 ARG CD C 43.050 . 1 1592 . 166 ARG N N 118.768 . 1 1593 . 167 GLN H H 8.461 . 1 1594 . 167 GLN HA H 4.970 . 1 1595 . 167 GLN HB2 H 1.990 . 2 1596 . 167 GLN HG2 H 2.120 . 2 1597 . 167 GLN HG3 H 2.370 . 2 1598 . 167 GLN CA C 54.747 . 1 1599 . 167 GLN CB C 32.120 . 1 1600 . 167 GLN CG C 34.300 . 1 1601 . 167 GLN N N 117.734 . 1 1602 . 168 GLY H H 8.560 . 1 1603 . 168 GLY HA2 H 3.420 . 2 1604 . 168 GLY HA3 H 4.730 . 2 1605 . 168 GLY C C 169.200 . 1 1606 . 168 GLY CA C 43.950 . 1 1607 . 168 GLY N N 109.590 . 1 1608 . 169 PHE H H 8.010 . 1 1609 . 169 PHE HA H 5.716 . 1 1610 . 169 PHE HB2 H 2.960 . 2 1611 . 169 PHE HB3 H 2.220 . 2 1612 . 169 PHE HD1 H 6.740 . 1 1613 . 169 PHE HD2 H 6.740 . 1 1614 . 169 PHE HE1 H 6.900 . 1 1615 . 169 PHE HE2 H 6.900 . 1 1616 . 169 PHE HZ H 7.020 . 1 1617 . 169 PHE C C 175.383 . 1 1618 . 169 PHE CA C 55.173 . 1 1619 . 169 PHE CB C 42.886 . 1 1620 . 169 PHE N N 113.909 . 1 1621 . 170 SER H H 9.782 . 1 1622 . 170 SER HA H 5.772 . 1 1623 . 170 SER HB2 H 3.850 . 2 1624 . 170 SER HB3 H 3.500 . 2 1625 . 170 SER C C 173.880 . 1 1626 . 170 SER CA C 58.299 . 1 1627 . 170 SER CB C 68.330 . 1 1628 . 170 SER N N 118.684 . 1 1629 . 171 ALA H H 9.300 . 1 1630 . 171 ALA HA H 3.980 . 1 1631 . 171 ALA HB H 1.340 . 1 1632 . 171 ALA CA C 51.370 . 1 1633 . 171 ALA CB C 21.470 . 1 1634 . 171 ALA N N 126.250 . 1 1635 . 172 GLN HA H 4.470 . 1 1636 . 172 GLN HB2 H 2.330 . 2 1637 . 172 GLN HG2 H 2.600 . 2 1638 . 172 GLN C C 174.870 . 1 1639 . 172 GLN CA C 55.420 . 1 1640 . 172 GLN CB C 32.020 . 1 1641 . 172 GLN CG C 33.910 . 1 1642 . 173 LEU H H 7.980 . 1 1643 . 173 LEU HA H 4.610 . 1 1644 . 173 LEU HB2 H 1.250 . 2 1645 . 173 LEU HB3 H 1.610 . 2 1646 . 173 LEU HG H 1.150 . 1 1647 . 173 LEU HD1 H 0.790 . 2 1648 . 173 LEU HD2 H 0.720 . 2 1649 . 173 LEU C C 172.917 . 1 1650 . 173 LEU CA C 54.140 . 1 1651 . 173 LEU CB C 44.784 . 1 1652 . 173 LEU CG C 25.000 . 1 1653 . 173 LEU CD1 C 25.930 . 1 1654 . 173 LEU CD2 C 24.220 . 1 1655 . 173 LEU N N 131.490 . 1 1656 . 174 LYS H H 5.729 . 1 1657 . 174 LYS HA H 4.483 . 1 1658 . 174 LYS HB2 H 1.490 . 2 1659 . 174 LYS HB3 H -0.300 . 2 1660 . 174 LYS HG2 H 1.030 . 2 1661 . 174 LYS HG3 H 0.940 . 2 1662 . 174 LYS HD2 H 1.500 . 2 1663 . 174 LYS HD3 H 1.310 . 2 1664 . 174 LYS HE2 H 2.750 . 1 1665 . 174 LYS HE3 H 2.750 . 1 1666 . 174 LYS C C 176.889 . 1 1667 . 174 LYS CA C 53.956 . 1 1668 . 174 LYS CB C 34.566 . 1 1669 . 174 LYS CG C 24.870 . 1 1670 . 174 LYS CD C 29.040 . 1 1671 . 174 LYS CE C 41.440 . 1 1672 . 174 LYS N N 114.987 . 1 1673 . 175 LYS H H 9.203 . 1 1674 . 175 LYS HA H 3.820 . 1 1675 . 175 LYS HB2 H 1.760 . 2 1676 . 175 LYS HB3 H 1.800 . 2 1677 . 175 LYS HG2 H 1.460 . 1 1678 . 175 LYS HG3 H 1.460 . 1 1679 . 175 LYS HD2 H 1.700 . 1 1680 . 175 LYS HD3 H 1.700 . 1 1681 . 175 LYS HE2 H 3.050 . 1 1682 . 175 LYS HE3 H 3.050 . 1 1683 . 175 LYS C C 179.371 . 1 1684 . 175 LYS CA C 60.778 . 1 1685 . 175 LYS CB C 32.672 . 1 1686 . 175 LYS CG C 26.150 . 1 1687 . 175 LYS CD C 29.860 . 1 1688 . 175 LYS CE C 41.970 . 1 1689 . 175 LYS N N 123.986 . 1 1690 . 176 GLN H H 8.633 . 1 1691 . 176 GLN HA H 4.018 . 1 1692 . 176 GLN HB2 H 2.050 . 2 1693 . 176 GLN HB3 H 1.970 . 2 1694 . 176 GLN HG2 H 2.210 . 1 1695 . 176 GLN HG3 H 2.210 . 1 1696 . 176 GLN HE21 H 7.050 . 2 1697 . 176 GLN HE22 H 7.550 . 2 1698 . 176 GLN C C 176.400 . 1 1699 . 176 GLN CA C 57.919 . 1 1700 . 176 GLN CB C 28.620 . 1 1701 . 176 GLN CG C 33.810 . 1 1702 . 176 GLN CD C 180.080 . 1 1703 . 176 GLN N N 114.323 . 1 1704 . 176 GLN NE2 N 111.440 . 1 1705 . 177 TYR H H 6.900 . 1 1706 . 177 TYR HA H 4.455 . 1 1707 . 177 TYR HB2 H 1.950 . 1 1708 . 177 TYR HB3 H 2.290 . 1 1709 . 177 TYR HD1 H 6.750 . 1 1710 . 177 TYR HD2 H 6.750 . 1 1711 . 177 TYR HE1 H 7.020 . 1 1712 . 177 TYR HE2 H 7.020 . 1 1713 . 177 TYR C C 176.533 . 1 1714 . 177 TYR CA C 55.437 . 1 1715 . 177 TYR CB C 35.258 . 1 1716 . 177 TYR N N 116.129 . 1 1717 . 178 PHE H H 7.567 . 1 1718 . 178 PHE HA H 5.100 . 1 1719 . 178 PHE HB2 H 3.460 . 1 1720 . 178 PHE HB3 H 2.550 . 1 1721 . 178 PHE HD1 H 7.330 . 1 1722 . 178 PHE HD2 H 7.330 . 1 1723 . 178 PHE HE1 H 7.190 . 1 1724 . 178 PHE HE2 H 7.190 . 1 1725 . 178 PHE HZ H 7.020 . 1 1726 . 178 PHE C C 174.602 . 1 1727 . 178 PHE CA C 56.088 . 1 1728 . 178 PHE CB C 40.638 . 1 1729 . 178 PHE N N 114.133 . 1 1730 . 179 VAL H H 7.281 . 1 1731 . 179 VAL HA H 4.133 . 1 1732 . 179 VAL HB H 2.050 . 1 1733 . 179 VAL HG1 H 0.920 . 1 1734 . 179 VAL HG2 H 0.920 . 1 1735 . 179 VAL C C 175.847 . 1 1736 . 179 VAL CA C 61.795 . 1 1737 . 179 VAL CB C 32.990 . 1 1738 . 179 VAL CG1 C 20.160 . 1 1739 . 179 VAL CG2 C 21.150 . 1 1740 . 179 VAL N N 117.671 . 1 1741 . 180 GLU H H 8.628 . 1 1742 . 180 GLU HA H 4.281 . 1 1743 . 180 GLU HB2 H 2.040 . 2 1744 . 180 GLU HB3 H 1.940 . 2 1745 . 180 GLU HG2 H 2.300 . 1 1746 . 180 GLU HG3 H 2.300 . 1 1747 . 180 GLU C C 176.289 . 1 1748 . 180 GLU CA C 56.621 . 1 1749 . 180 GLU CB C 30.344 . 1 1750 . 180 GLU CG C 36.590 . 1 1751 . 180 GLU N N 125.037 . 1 1752 . 181 LYS H H 8.474 . 1 1753 . 181 LYS HA H 4.294 . 1 1754 . 181 LYS HB2 H 1.820 . 2 1755 . 181 LYS HB3 H 1.720 . 2 1756 . 181 LYS HG2 H 1.430 . 1 1757 . 181 LYS HG3 H 1.430 . 1 1758 . 181 LYS HD2 H 1.650 . 1 1759 . 181 LYS HD3 H 1.650 . 1 1760 . 181 LYS HE2 H 2.940 . 1 1761 . 181 LYS HE3 H 2.940 . 1 1762 . 181 LYS C C 175.538 . 1 1763 . 181 LYS CA C 56.489 . 1 1764 . 181 LYS CB C 32.997 . 1 1765 . 181 LYS CG C 24.450 . 1 1766 . 181 LYS CD C 28.970 . 1 1767 . 181 LYS CE C 42.040 . 1 1768 . 181 LYS N N 123.652 . 1 1769 . 182 GLN H H 8.048 . 1 1770 . 182 GLN HA H 4.172 . 1 1771 . 182 GLN HB2 H 2.070 . 2 1772 . 182 GLN HB3 H 1.890 . 2 1773 . 182 GLN HG2 H 2.260 . 2 1774 . 182 GLN HE21 H 6.780 . 2 1775 . 182 GLN HE22 H 7.530 . 2 1776 . 182 GLN CA C 57.403 . 1 1777 . 182 GLN CB C 30.565 . 1 1778 . 182 GLN CG C 34.340 . 1 1779 . 182 GLN CD C 181.180 . 1 1780 . 182 GLN N N 127.533 . 1 1781 . 182 GLN NE2 N 111.870 . 1 stop_ save_