data_6949 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; domain 2 of receptor-associated protein ; _BMRB_accession_number 6949 _BMRB_flat_file_name bmr6949.str _Entry_type original _Submission_date 2006-01-24 _Accession_date 2006-01-25 _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 Lee Donghan . . 2 Walsh Joseph . . 3 Mikhailenko Irina . . 4 Migliorini Molly . . 5 Yu Ping . . 6 Wu Yibing . . 7 Locket Stephen . . 8 Strickland Dudley . . 9 Wang Yun-Xing . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 638 "13C chemical shifts" 488 "15N chemical shifts" 110 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2007-02-08 update BMRB 'complete entry citation' 2006-08-07 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'NMR assignment of domain 2 of the receptor-associated protein' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 16865416 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Walsh Joseph . . 2 Lee Donghan . . 3 Yu Ping . . 4 Migliorini Molly . . 5 Strickland Dudley . . 6 Wang Yun-Xing . . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_volume 36 _Journal_issue 'Suppl. 5' _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 54 _Page_last 54 _Year 2006 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'd2 of RAP' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'domain 2' $receptor-associated_protein stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_receptor-associated_protein _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'domain 2 of RAP' _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 116 _Mol_residue_sequence ; SNSLSGTQEDGLDDPRLEKL WHKAKTSGKFSGEELDKLWR EFLHHKEKVHEYNVLLETLS RTEEIHENVISPSDLSDIKG SVLHSRHTELKEKLRSINQG LDRLRRVSHQGYSTEA ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 101 SER 2 102 ASN 3 103 SER 4 104 LEU 5 105 SER 6 106 GLY 7 107 THR 8 108 GLN 9 109 GLU 10 110 ASP 11 111 GLY 12 112 LEU 13 113 ASP 14 114 ASP 15 115 PRO 16 116 ARG 17 117 LEU 18 118 GLU 19 119 LYS 20 120 LEU 21 121 TRP 22 122 HIS 23 123 LYS 24 124 ALA 25 125 LYS 26 126 THR 27 127 SER 28 128 GLY 29 129 LYS 30 130 PHE 31 131 SER 32 132 GLY 33 133 GLU 34 134 GLU 35 135 LEU 36 136 ASP 37 137 LYS 38 138 LEU 39 139 TRP 40 140 ARG 41 141 GLU 42 142 PHE 43 143 LEU 44 144 HIS 45 145 HIS 46 146 LYS 47 147 GLU 48 148 LYS 49 149 VAL 50 150 HIS 51 151 GLU 52 152 TYR 53 153 ASN 54 154 VAL 55 155 LEU 56 156 LEU 57 157 GLU 58 158 THR 59 159 LEU 60 160 SER 61 161 ARG 62 162 THR 63 163 GLU 64 164 GLU 65 165 ILE 66 166 HIS 67 167 GLU 68 168 ASN 69 169 VAL 70 170 ILE 71 171 SER 72 172 PRO 73 173 SER 74 174 ASP 75 175 LEU 76 176 SER 77 177 ASP 78 178 ILE 79 179 LYS 80 180 GLY 81 181 SER 82 182 VAL 83 183 LEU 84 184 HIS 85 185 SER 86 186 ARG 87 187 HIS 88 188 THR 89 189 GLU 90 190 LEU 91 191 LYS 92 192 GLU 93 193 LYS 94 194 LEU 95 195 ARG 96 196 SER 97 197 ILE 98 198 ASN 99 199 GLN 100 200 GLY 101 201 LEU 102 202 ASP 103 203 ARG 104 204 LEU 105 205 ARG 106 206 ARG 107 207 VAL 108 208 SER 109 209 HIS 110 210 GLN 111 211 GLY 112 212 TYR 113 213 SER 114 214 THR 115 215 GLU 116 216 ALA 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 BMRB 16454 RBD 100.00 357 100.00 100.00 1.58e-72 PDB 2P01 "The Structure Of Receptor-Associated Protein(Rap)" 100.00 323 100.00 100.00 2.32e-73 PDB 2P03 "The Structure Of Receptor-Associated Protein(Rap)" 100.00 323 100.00 100.00 2.32e-73 DBJ BAD96224 "low density lipoprotein receptor-related protein associated protein 1 variant [Homo sapiens]" 100.00 357 99.14 99.14 3.76e-72 DBJ BAD96247 "low density lipoprotein receptor-related protein associated protein 1 variant [Homo sapiens]" 100.00 357 100.00 100.00 9.64e-73 DBJ BAF85010 "unnamed protein product [Homo sapiens]" 100.00 357 100.00 100.00 1.05e-72 DBJ BAG35576 "unnamed protein product [Homo sapiens]" 100.00 357 100.00 100.00 1.15e-72 DBJ BAG73353 "low density lipoprotein receptor-related protein associated protein 1 [synthetic construct]" 100.00 357 100.00 100.00 1.20e-72 EMBL CAH90295 "hypothetical protein [Pongo abelii]" 100.00 358 98.28 99.14 2.81e-71 GB AAA51553 "alpha-2-macroglobulin receptor-associated protein [Homo sapiens]" 100.00 357 100.00 100.00 1.20e-72 GB AAC67373 "lipoprotein receptor associated protein [Homo sapiens]" 100.00 357 100.00 100.00 1.20e-72 GB AAI05075 "Low density lipoprotein receptor-related protein associated protein 1 [Homo sapiens]" 100.00 357 100.00 100.00 1.20e-72 GB AAI12068 "Low density lipoprotein receptor-related protein associated protein 1 [Homo sapiens]" 100.00 357 100.00 100.00 1.20e-72 GB AAY18903 "lipoprotein receptor associated protein; alpha-2-macroglobulin receptor-associated protein [synthetic construct]" 100.00 381 100.00 100.00 3.66e-72 REF NP_001125136 "alpha-2-macroglobulin receptor-associated protein precursor [Pongo abelii]" 100.00 358 98.28 99.14 2.81e-71 REF NP_001233320 "alpha-2-macroglobulin receptor-associated protein precursor [Pan troglodytes]" 100.00 357 98.28 99.14 1.82e-71 REF NP_002328 "alpha-2-macroglobulin receptor-associated protein precursor [Homo sapiens]" 100.00 357 100.00 100.00 1.20e-72 REF XP_003279069 "PREDICTED: alpha-2-macroglobulin receptor-associated protein [Nomascus leucogenys]" 100.00 460 98.28 99.14 5.35e-70 REF XP_003804417 "PREDICTED: alpha-2-macroglobulin receptor-associated protein isoform X1 [Pan paniscus]" 100.00 357 98.28 99.14 1.82e-71 SP P30533 "RecName: Full=Alpha-2-macroglobulin receptor-associated protein; Short=Alpha-2-MRAP; AltName: Full=Low density lipoprotein rece" 100.00 357 100.00 100.00 1.20e-72 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $receptor-associated_protein Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $receptor-associated_protein 'recombinant technology' . . . . . 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 $receptor-associated_protein 1 mM '[U-13C; U-15N]' stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model Inova _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_15N-HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name 15N-HSQC _Sample_label $sample_1 save_ save_13C-HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name 13C-HSQC _Sample_label $sample_1 save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_15N-resolved_NOESY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '15N-resolved NOESY' _Sample_label $sample_1 save_ save_13C-resolved_NOESYs_for_aliphatic_and_aromatic_carbons_6 _Saveframe_category NMR_applied_experiment _Experiment_name '13C-resolved NOESYs for aliphatic and aromatic carbons' _Sample_label $sample_1 save_ save_3D_HCCH-TOCSY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.25 . pH temperature 303 0.1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 $entry_citation $entry_citation DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 $entry_citation $entry_citation DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 $entry_citation $entry_citation stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name 'domain 2' _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 1 102 2 ASN HA H 4.400 0.020 1 2 102 2 ASN HB2 H 2.570 0.020 2 3 102 2 ASN HB3 H 2.670 0.020 2 4 102 2 ASN C C 175.980 0.400 1 5 102 2 ASN CA C 54.830 0.400 1 6 102 2 ASN CB C 40.700 0.400 1 7 103 3 SER H H 8.230 0.020 1 8 103 3 SER HA H 4.280 0.020 1 9 103 3 SER HB2 H 3.710 0.020 1 10 103 3 SER HB3 H 3.710 0.020 1 11 103 3 SER C C 175.040 0.400 1 12 103 3 SER CA C 58.420 0.400 1 13 103 3 SER CB C 63.650 0.400 1 14 103 3 SER N N 121.450 0.400 1 15 104 4 LEU H H 8.330 0.020 1 16 104 4 LEU HA H 4.270 0.020 1 17 104 4 LEU HB2 H 1.460 0.020 2 18 104 4 LEU HB3 H 1.530 0.020 2 19 104 4 LEU HG H 1.500 0.020 1 20 104 4 LEU HD1 H 0.750 0.020 2 21 104 4 LEU HD2 H 0.710 0.020 2 22 104 4 LEU C C 177.600 0.400 1 23 104 4 LEU CA C 55.250 0.400 1 24 104 4 LEU CB C 42.030 0.400 1 25 104 4 LEU CG C 26.880 0.400 1 26 104 4 LEU CD1 C 24.890 0.400 1 27 104 4 LEU CD2 C 23.200 0.400 1 28 104 4 LEU N N 123.780 0.400 1 29 105 5 SER H H 8.130 0.020 1 30 105 5 SER HA H 4.290 0.020 1 31 105 5 SER HB2 H 3.740 0.020 1 32 105 5 SER HB3 H 3.740 0.020 1 33 105 5 SER C C 175.080 0.400 1 34 105 5 SER CA C 58.500 0.400 1 35 105 5 SER CB C 63.680 0.400 1 36 105 5 SER N N 115.990 0.400 1 37 106 6 GLY H H 8.260 0.020 1 38 106 6 GLY HA2 H 3.900 0.020 1 39 106 6 GLY HA3 H 3.900 0.020 1 40 106 6 GLY C C 174.340 0.400 1 41 106 6 GLY CA C 45.320 0.400 1 42 106 6 GLY N N 110.980 0.400 1 43 107 7 THR H H 7.960 0.020 1 44 107 7 THR HA H 4.220 0.020 1 45 107 7 THR HB H 4.090 0.020 1 46 107 7 THR HG2 H 1.040 0.020 1 47 107 7 THR C C 174.710 0.400 1 48 107 7 THR CA C 61.860 0.400 1 49 107 7 THR CB C 69.830 0.400 1 50 107 7 THR CG2 C 21.280 0.400 1 51 107 7 THR N N 113.260 0.400 1 52 108 8 GLN H H 8.310 0.020 1 53 108 8 GLN HA H 4.040 0.020 1 54 108 8 GLN HB2 H 1.770 0.020 2 55 108 8 GLN HB3 H 1.840 0.020 2 56 108 8 GLN HG2 H 2.020 0.020 2 57 108 8 GLN HG3 H 1.970 0.020 2 58 108 8 GLN C C 176.070 0.400 1 59 108 8 GLN CA C 56.060 0.400 1 60 108 8 GLN CB C 28.890 0.400 1 61 108 8 GLN CG C 33.510 0.400 1 62 108 8 GLN N N 122.270 0.400 1 63 109 9 GLU H H 8.310 0.020 1 64 109 9 GLU HA H 4.110 0.020 1 65 109 9 GLU HB2 H 1.890 0.020 2 66 109 9 GLU HB3 H 1.800 0.020 2 67 109 9 GLU HG3 H 2.050 0.020 2 68 109 9 GLU C C 176.150 0.400 1 69 109 9 GLU CA C 56.730 0.400 1 70 109 9 GLU CB C 30.040 0.400 1 71 109 9 GLU CG C 36.200 0.400 1 72 109 9 GLU N N 121.710 0.400 1 73 110 10 ASP H H 8.140 0.020 1 74 110 10 ASP HA H 4.500 0.020 1 75 110 10 ASP HB2 H 2.580 0.020 1 76 110 10 ASP HB3 H 2.580 0.020 1 77 110 10 ASP C C 176.320 0.400 1 78 110 10 ASP CA C 54.460 0.400 1 79 110 10 ASP CB C 41.240 0.400 1 80 110 10 ASP N N 120.830 0.400 1 81 111 11 GLY H H 8.090 0.020 1 82 111 11 GLY HA2 H 4.050 0.020 2 83 111 11 GLY HA3 H 3.870 0.020 2 84 111 11 GLY C C 173.910 0.400 1 85 111 11 GLY CA C 45.080 0.400 1 86 111 11 GLY N N 107.460 0.400 1 87 112 12 LEU H H 8.600 0.020 1 88 112 12 LEU HA H 4.040 0.020 1 89 112 12 LEU HB2 H 1.570 0.020 2 90 112 12 LEU HB3 H 1.290 0.020 2 91 112 12 LEU HG H 1.400 0.020 1 92 112 12 LEU HD1 H 0.430 0.020 2 93 112 12 LEU HD2 H 0.160 0.020 2 94 112 12 LEU CA C 55.350 0.400 1 95 112 12 LEU CB C 42.720 0.400 1 96 112 12 LEU CG C 26.410 0.400 1 97 112 12 LEU CD1 C 25.940 0.400 1 98 112 12 LEU CD2 C 22.880 0.400 1 99 112 12 LEU N N 119.930 0.400 1 100 113 13 ASP HA H 4.160 0.020 1 101 113 13 ASP HB2 H 2.720 0.020 2 102 113 13 ASP HB3 H 2.470 0.020 2 103 113 13 ASP C C 175.000 0.400 1 104 113 13 ASP CA C 55.200 0.400 1 105 113 13 ASP CB C 39.960 0.400 1 106 114 14 ASP H H 7.500 0.020 1 107 114 14 ASP HA H 4.840 0.020 1 108 114 14 ASP HB2 H 2.510 0.020 2 109 114 14 ASP HB3 H 2.720 0.020 2 110 114 14 ASP CA C 51.800 0.400 1 111 114 14 ASP CB C 42.790 0.400 1 112 114 14 ASP N N 116.490 0.400 1 113 115 15 PRO HA H 4.320 0.020 1 114 115 15 PRO HB2 H 2.330 0.020 2 115 115 15 PRO HB3 H 1.910 0.020 2 116 115 15 PRO HG2 H 1.990 0.020 1 117 115 15 PRO HG3 H 1.990 0.020 1 118 115 15 PRO HD2 H 3.810 0.020 2 119 115 15 PRO HD3 H 3.850 0.020 2 120 115 15 PRO C C 179.070 0.400 1 121 115 15 PRO CA C 64.890 0.400 1 122 115 15 PRO CB C 32.420 0.400 1 123 115 15 PRO CG C 27.200 0.400 1 124 115 15 PRO CD C 51.260 0.400 1 125 116 16 ARG H H 8.190 0.020 1 126 116 16 ARG HA H 4.010 0.020 1 127 116 16 ARG HB2 H 1.850 0.020 1 128 116 16 ARG HB3 H 1.850 0.020 1 129 116 16 ARG HD2 H 3.210 0.020 1 130 116 16 ARG HD3 H 3.210 0.020 1 131 116 16 ARG C C 179.790 0.400 1 132 116 16 ARG CA C 59.230 0.400 1 133 116 16 ARG CB C 29.470 0.400 1 134 116 16 ARG N N 117.580 0.400 1 135 117 17 LEU H H 7.530 0.020 1 136 117 17 LEU HA H 4.100 0.020 1 137 117 17 LEU HB2 H 1.830 0.020 2 138 117 17 LEU HB3 H 1.540 0.020 2 139 117 17 LEU HG H 1.800 0.020 1 140 117 17 LEU HD1 H 0.710 0.020 2 141 117 17 LEU HD2 H 0.960 0.020 2 142 117 17 LEU C C 178.650 0.400 1 143 117 17 LEU CA C 56.840 0.400 1 144 117 17 LEU CB C 42.190 0.400 1 145 117 17 LEU CG C 26.810 0.400 1 146 117 17 LEU CD1 C 22.430 0.400 1 147 117 17 LEU CD2 C 25.650 0.400 1 148 117 17 LEU N N 118.370 0.400 1 149 118 18 GLU H H 8.300 0.020 1 150 118 18 GLU HA H 3.900 0.020 1 151 118 18 GLU HB2 H 2.040 0.020 1 152 118 18 GLU HB3 H 2.040 0.020 1 153 118 18 GLU HG3 H 2.270 0.020 2 154 118 18 GLU C C 178.880 0.400 1 155 118 18 GLU CA C 59.830 0.400 1 156 118 18 GLU CB C 29.290 0.400 1 157 118 18 GLU CG C 36.930 0.400 1 158 118 18 GLU N N 118.550 0.400 1 159 119 19 LYS H H 7.640 0.020 1 160 119 19 LYS HA H 4.060 0.020 1 161 119 19 LYS HB2 H 1.850 0.020 1 162 119 19 LYS HB3 H 1.850 0.020 1 163 119 19 LYS HG2 H 1.560 0.020 2 164 119 19 LYS HG3 H 1.390 0.020 2 165 119 19 LYS HD2 H 1.610 0.020 1 166 119 19 LYS HD3 H 1.610 0.020 1 167 119 19 LYS HE2 H 2.850 0.020 1 168 119 19 LYS HE3 H 2.850 0.020 1 169 119 19 LYS C C 179.450 0.400 1 170 119 19 LYS CA C 59.580 0.400 1 171 119 19 LYS CB C 32.490 0.400 1 172 119 19 LYS CG C 25.190 0.400 1 173 119 19 LYS CD C 29.220 0.400 1 174 119 19 LYS CE C 41.820 0.400 1 175 119 19 LYS N N 118.140 0.400 1 176 120 20 LEU H H 7.280 0.020 1 177 120 20 LEU HA H 4.060 0.020 1 178 120 20 LEU HB2 H 1.860 0.020 2 179 120 20 LEU HB3 H 2.120 0.020 2 180 120 20 LEU HG H 2.010 0.020 1 181 120 20 LEU HD1 H 0.800 0.020 2 182 120 20 LEU HD2 H 0.880 0.020 2 183 120 20 LEU C C 177.820 0.400 1 184 120 20 LEU CA C 57.710 0.400 1 185 120 20 LEU CB C 41.890 0.400 1 186 120 20 LEU CG C 26.260 0.400 1 187 120 20 LEU CD1 C 25.340 0.400 1 188 120 20 LEU CD2 C 23.510 0.400 1 189 120 20 LEU N N 119.900 0.400 1 190 121 21 TRP H H 8.220 0.020 1 191 121 21 TRP HA H 4.200 0.020 1 192 121 21 TRP HB2 H 2.910 0.020 2 193 121 21 TRP HB3 H 2.400 0.020 2 194 121 21 TRP HD1 H 6.950 0.020 1 195 121 21 TRP HE1 H 9.670 0.020 1 196 121 21 TRP C C 176.600 0.400 1 197 121 21 TRP CA C 59.040 0.400 1 198 121 21 TRP CB C 29.550 0.400 1 199 121 21 TRP CD1 C 126.300 0.400 1 200 121 21 TRP N N 120.710 0.400 1 201 121 21 TRP NE1 N 127.490 0.400 1 202 122 22 HIS H H 8.260 0.020 1 203 122 22 HIS HA H 3.650 0.020 1 204 122 22 HIS HB2 H 3.090 0.020 2 205 122 22 HIS HB3 H 3.010 0.020 2 206 122 22 HIS HD2 H 6.850 0.020 1 207 122 22 HIS C C 178.710 0.400 1 208 122 22 HIS CA C 60.330 0.400 1 209 122 22 HIS CB C 30.370 0.400 1 210 122 22 HIS CD2 C 118.930 0.400 1 211 122 22 HIS N N 116.560 0.400 1 212 123 23 LYS H H 7.740 0.020 1 213 123 23 LYS HA H 3.660 0.020 1 214 123 23 LYS HB2 H 1.830 0.020 1 215 123 23 LYS HB3 H 1.830 0.020 1 216 123 23 LYS HG2 H 1.070 0.020 2 217 123 23 LYS HG3 H 1.300 0.020 2 218 123 23 LYS HD2 H 1.460 0.020 2 219 123 23 LYS HD3 H 1.830 0.020 2 220 123 23 LYS HE2 H 2.770 0.020 1 221 123 23 LYS HE3 H 2.770 0.020 1 222 123 23 LYS C C 178.210 0.400 1 223 123 23 LYS CA C 58.830 0.400 1 224 123 23 LYS CB C 31.180 0.400 1 225 123 23 LYS CG C 24.070 0.400 1 226 123 23 LYS CD C 28.440 0.400 1 227 123 23 LYS CE C 41.520 0.400 1 228 123 23 LYS N N 120.330 0.400 1 229 124 24 ALA H H 8.010 0.020 1 230 124 24 ALA HA H 4.100 0.020 1 231 124 24 ALA HB H 0.950 0.020 1 232 124 24 ALA C C 181.300 0.400 1 233 124 24 ALA CA C 55.270 0.400 1 234 124 24 ALA CB C 18.350 0.400 1 235 124 24 ALA N N 122.110 0.400 1 236 125 25 LYS H H 8.190 0.020 1 237 125 25 LYS HA H 3.420 0.020 1 238 125 25 LYS HB3 H 0.950 0.020 1 239 125 25 LYS HG2 H 0.750 0.020 2 240 125 25 LYS HG3 H 0.620 0.020 2 241 125 25 LYS HD2 H 1.170 0.020 1 242 125 25 LYS HD3 H 1.170 0.020 1 243 125 25 LYS HE2 H 2.470 0.020 2 244 125 25 LYS HE3 H 2.600 0.020 2 245 125 25 LYS C C 178.100 0.400 1 246 125 25 LYS CA C 59.470 0.400 1 247 125 25 LYS CB C 31.670 0.400 1 248 125 25 LYS CG C 24.170 0.400 1 249 125 25 LYS CD C 28.980 0.400 1 250 125 25 LYS CE C 41.420 0.400 1 251 125 25 LYS N N 117.400 0.400 1 252 126 26 THR H H 7.370 0.020 1 253 126 26 THR HA H 4.190 0.020 1 254 126 26 THR HB H 4.160 0.020 1 255 126 26 THR HG2 H 0.840 0.020 1 256 126 26 THR C C 176.300 0.400 1 257 126 26 THR CA C 62.050 0.400 1 258 126 26 THR CB C 70.250 0.400 1 259 126 26 THR CG2 C 20.990 0.400 1 260 126 26 THR N N 106.640 0.400 1 261 127 27 SER H H 7.610 0.020 1 262 127 27 SER HA H 4.450 0.020 1 263 127 27 SER HB2 H 3.740 0.020 1 264 127 27 SER HB3 H 3.740 0.020 1 265 127 27 SER C C 176.120 0.400 1 266 127 27 SER CA C 60.900 0.400 1 267 127 27 SER CB C 64.500 0.400 1 268 127 27 SER N N 117.290 0.400 1 269 128 28 GLY H H 8.010 0.020 1 270 128 28 GLY HA2 H 4.090 0.020 2 271 128 28 GLY HA3 H 3.820 0.020 2 272 128 28 GLY C C 175.280 0.400 1 273 128 28 GLY CA C 45.930 0.400 1 274 128 28 GLY N N 111.030 0.400 1 275 129 29 LYS H H 8.050 0.020 1 276 129 29 LYS HA H 4.040 0.020 1 277 129 29 LYS HB2 H 1.270 0.020 1 278 129 29 LYS HB3 H 1.270 0.020 1 279 129 29 LYS HG2 H 1.030 0.020 1 280 129 29 LYS HG3 H 1.030 0.020 1 281 129 29 LYS HD2 H 1.280 0.020 1 282 129 29 LYS HD3 H 1.280 0.020 1 283 129 29 LYS HE2 H 2.790 0.020 2 284 129 29 LYS HE3 H 2.840 0.020 2 285 129 29 LYS C C 175.080 0.400 1 286 129 29 LYS CA C 56.190 0.400 1 287 129 29 LYS CB C 32.650 0.400 1 288 129 29 LYS CG C 25.070 0.400 1 289 129 29 LYS CD C 28.240 0.400 1 290 129 29 LYS CE C 42.120 0.400 1 291 129 29 LYS N N 117.600 0.400 1 292 130 30 PHE H H 7.780 0.020 1 293 130 30 PHE HA H 4.900 0.020 1 294 130 30 PHE HB2 H 3.040 0.020 2 295 130 30 PHE HB3 H 2.700 0.020 2 296 130 30 PHE HD1 H 7.070 0.020 1 297 130 30 PHE HE1 H 6.870 0.020 1 298 130 30 PHE HZ H 7.370 0.020 1 299 130 30 PHE C C 176.200 0.400 1 300 130 30 PHE CA C 56.500 0.400 1 301 130 30 PHE CB C 42.690 0.400 1 302 130 30 PHE CD1 C 132.220 0.400 1 303 130 30 PHE CE1 C 130.930 0.400 1 304 130 30 PHE CZ C 131.220 0.400 1 305 130 30 PHE N N 116.630 0.400 1 306 131 31 SER H H 9.380 0.020 1 307 131 31 SER HA H 4.570 0.020 1 308 131 31 SER HB2 H 3.280 0.020 2 309 131 31 SER HB3 H 3.940 0.020 2 310 131 31 SER C C 175.180 0.400 1 311 131 31 SER CA C 56.880 0.400 1 312 131 31 SER CB C 65.290 0.400 1 313 131 31 SER N N 120.190 0.400 1 314 132 32 GLY H H 8.960 0.020 1 315 132 32 GLY HA2 H 3.950 0.020 2 316 132 32 GLY HA3 H 3.710 0.020 2 317 132 32 GLY C C 176.850 0.400 1 318 132 32 GLY CA C 47.980 0.400 1 319 132 32 GLY N N 109.100 0.400 1 320 133 33 GLU H H 8.580 0.020 1 321 133 33 GLU HA H 4.150 0.020 1 322 133 33 GLU HB2 H 1.980 0.020 2 323 133 33 GLU HB3 H 1.910 0.020 2 324 133 33 GLU HG3 H 2.250 0.020 2 325 133 33 GLU C C 176.480 0.400 1 326 133 33 GLU CA C 59.470 0.400 1 327 133 33 GLU CB C 29.670 0.400 1 328 133 33 GLU CG C 36.650 0.400 1 329 133 33 GLU N N 121.360 0.400 1 330 134 34 GLU H H 7.850 0.020 1 331 134 34 GLU HA H 4.030 0.020 1 332 134 34 GLU HB2 H 2.530 0.020 2 333 134 34 GLU HB3 H 2.740 0.020 2 334 134 34 GLU HG3 H 2.200 0.020 2 335 134 34 GLU C C 178.880 0.400 1 336 134 34 GLU CA C 59.330 0.400 1 337 134 34 GLU CB C 31.430 0.400 1 338 134 34 GLU CG C 38.070 0.400 1 339 134 34 GLU N N 120.490 0.400 1 340 135 35 LEU H H 8.600 0.020 1 341 135 35 LEU HA H 4.120 0.020 1 342 135 35 LEU HB2 H 1.660 0.020 2 343 135 35 LEU HB3 H 1.910 0.020 2 344 135 35 LEU HG H 1.720 0.020 1 345 135 35 LEU HD1 H 0.610 0.020 2 346 135 35 LEU HD2 H 0.270 0.020 2 347 135 35 LEU C C 179.130 0.400 1 348 135 35 LEU CA C 57.860 0.400 1 349 135 35 LEU CB C 41.100 0.400 1 350 135 35 LEU CG C 26.900 0.400 1 351 135 35 LEU CD1 C 25.320 0.400 1 352 135 35 LEU CD2 C 23.290 0.400 1 353 135 35 LEU N N 120.740 0.400 1 354 136 36 ASP H H 7.660 0.020 1 355 136 36 ASP HA H 4.490 0.020 1 356 136 36 ASP HB2 H 2.700 0.020 2 357 136 36 ASP HB3 H 2.780 0.020 2 358 136 36 ASP C C 178.670 0.400 1 359 136 36 ASP CA C 57.690 0.400 1 360 136 36 ASP CB C 40.790 0.400 1 361 136 36 ASP N N 119.530 0.400 1 362 137 37 LYS H H 7.520 0.020 1 363 137 37 LYS HA H 3.910 0.020 1 364 137 37 LYS HB2 H 2.080 0.020 2 365 137 37 LYS HB3 H 1.870 0.020 2 366 137 37 LYS HG2 H 1.420 0.020 1 367 137 37 LYS HG3 H 1.420 0.020 1 368 137 37 LYS HD2 H 1.270 0.020 2 369 137 37 LYS HD3 H 1.420 0.020 2 370 137 37 LYS HE2 H 2.550 0.020 2 371 137 37 LYS HE3 H 2.490 0.020 2 372 137 37 LYS C C 178.980 0.400 1 373 137 37 LYS CA C 59.840 0.400 1 374 137 37 LYS CB C 32.520 0.400 1 375 137 37 LYS CG C 24.940 0.400 1 376 137 37 LYS CD C 29.600 0.400 1 377 137 37 LYS CE C 41.870 0.400 1 378 137 37 LYS N N 120.860 0.400 1 379 138 38 LEU H H 8.860 0.020 1 380 138 38 LEU HA H 4.300 0.020 1 381 138 38 LEU HB2 H 2.100 0.020 2 382 138 38 LEU HB3 H 1.680 0.020 2 383 138 38 LEU HG H 1.810 0.020 1 384 138 38 LEU HD1 H 0.370 0.020 2 385 138 38 LEU HD2 H 0.740 0.020 2 386 138 38 LEU C C 179.270 0.400 1 387 138 38 LEU CA C 58.040 0.400 1 388 138 38 LEU CB C 41.620 0.400 1 389 138 38 LEU CG C 26.860 0.400 1 390 138 38 LEU CD1 C 26.550 0.400 1 391 138 38 LEU CD2 C 22.680 0.400 1 392 138 38 LEU N N 123.540 0.400 1 393 139 39 TRP H H 9.040 0.020 1 394 139 39 TRP HA H 3.980 0.020 1 395 139 39 TRP HB2 H 3.200 0.020 2 396 139 39 TRP HB3 H 3.260 0.020 2 397 139 39 TRP HD1 H 6.870 0.020 1 398 139 39 TRP HE1 H 9.750 0.020 1 399 139 39 TRP C C 177.820 0.400 1 400 139 39 TRP CA C 59.880 0.400 1 401 139 39 TRP CB C 29.300 0.400 1 402 139 39 TRP CD1 C 125.770 0.400 1 403 139 39 TRP N N 121.380 0.400 1 404 139 39 TRP NE1 N 128.070 0.400 1 405 140 40 ARG H H 7.470 0.020 1 406 140 40 ARG HA H 3.620 0.020 1 407 140 40 ARG HB2 H 1.780 0.020 2 408 140 40 ARG HB3 H 1.980 0.020 2 409 140 40 ARG HG2 H 1.590 0.020 2 410 140 40 ARG HG3 H 1.920 0.020 2 411 140 40 ARG HD2 H 3.070 0.020 2 412 140 40 ARG HD3 H 3.190 0.020 2 413 140 40 ARG C C 179.720 0.400 1 414 140 40 ARG CA C 59.730 0.400 1 415 140 40 ARG CB C 29.400 0.400 1 416 140 40 ARG CG C 28.380 0.400 1 417 140 40 ARG CD C 43.270 0.400 1 418 140 40 ARG N N 114.730 0.400 1 419 141 41 GLU H H 7.980 0.020 1 420 141 41 GLU HA H 4.110 0.020 1 421 141 41 GLU HB2 H 2.400 0.020 1 422 141 41 GLU HB3 H 2.400 0.020 1 423 141 41 GLU HG3 H 2.050 0.020 2 424 141 41 GLU C C 180.720 0.400 1 425 141 41 GLU CA C 60.850 0.400 1 426 141 41 GLU CB C 29.220 0.400 1 427 141 41 GLU CG C 37.490 0.400 1 428 141 41 GLU N N 120.960 0.400 1 429 142 42 PHE H H 8.570 0.020 1 430 142 42 PHE HA H 3.870 0.020 1 431 142 42 PHE HB2 H 2.310 0.020 2 432 142 42 PHE HB3 H 2.920 0.020 2 433 142 42 PHE HD1 H 7.190 0.020 1 434 142 42 PHE HE1 H 7.270 0.020 1 435 142 42 PHE HZ H 7.110 0.020 1 436 142 42 PHE C C 178.260 0.400 1 437 142 42 PHE CA C 62.850 0.400 1 438 142 42 PHE CB C 38.800 0.400 1 439 142 42 PHE CD1 C 131.900 0.400 1 440 142 42 PHE CE1 C 131.270 0.400 1 441 142 42 PHE CZ C 129.200 0.400 1 442 142 42 PHE N N 123.400 0.400 1 443 143 43 LEU H H 8.010 0.020 1 444 143 43 LEU HA H 3.560 0.020 1 445 143 43 LEU HB2 H 1.460 0.020 2 446 143 43 LEU HB3 H 1.130 0.020 2 447 143 43 LEU HD1 H 0.480 0.020 2 448 143 43 LEU HD2 H 0.220 0.020 2 449 143 43 LEU C C 180.110 0.400 1 450 143 43 LEU CA C 57.740 0.400 1 451 143 43 LEU CB C 40.820 0.400 1 452 143 43 LEU CD1 C 25.160 0.400 1 453 143 43 LEU CD2 C 21.700 0.400 1 454 143 43 LEU N N 118.690 0.400 1 455 144 44 HIS H H 8.170 0.020 1 456 144 44 HIS HA H 4.270 0.020 1 457 144 44 HIS HB2 H 3.130 0.020 2 458 144 44 HIS HB3 H 3.150 0.020 2 459 144 44 HIS HD2 H 6.980 0.020 1 460 144 44 HIS C C 177.210 0.400 1 461 144 44 HIS CA C 58.670 0.400 1 462 144 44 HIS CB C 29.480 0.400 1 463 144 44 HIS CD2 C 121.000 0.400 1 464 144 44 HIS N N 119.720 0.400 1 465 145 45 HIS H H 7.840 0.020 1 466 145 45 HIS HA H 3.910 0.020 1 467 145 45 HIS HB2 H 2.860 0.020 2 468 145 45 HIS HB3 H 3.160 0.020 2 469 145 45 HIS HD2 H 6.560 0.020 1 470 145 45 HIS C C 176.820 0.400 1 471 145 45 HIS CA C 60.810 0.400 1 472 145 45 HIS CB C 31.060 0.400 1 473 145 45 HIS CD2 C 117.150 0.400 1 474 145 45 HIS N N 120.200 0.400 1 475 146 46 LYS H H 8.060 0.020 1 476 146 46 LYS HA H 3.710 0.020 1 477 146 46 LYS HB2 H 1.870 0.020 2 478 146 46 LYS HB3 H 1.730 0.020 2 479 146 46 LYS HG2 H 1.240 0.020 2 480 146 46 LYS HG3 H 1.530 0.020 2 481 146 46 LYS HD2 H 1.440 0.020 2 482 146 46 LYS HD3 H 1.580 0.020 2 483 146 46 LYS HE2 H 2.810 0.020 1 484 146 46 LYS HE3 H 2.810 0.020 1 485 146 46 LYS C C 179.290 0.400 1 486 146 46 LYS CA C 59.510 0.400 1 487 146 46 LYS CB C 31.650 0.400 1 488 146 46 LYS CG C 24.360 0.400 1 489 146 46 LYS CD C 29.220 0.400 1 490 146 46 LYS CE C 41.650 0.400 1 491 146 46 LYS N N 117.640 0.400 1 492 147 47 GLU H H 7.780 0.020 1 493 147 47 GLU HA H 4.000 0.020 1 494 147 47 GLU HB2 H 2.090 0.020 2 495 147 47 GLU HB3 H 1.990 0.020 2 496 147 47 GLU HG3 H 2.130 0.020 2 497 147 47 GLU C C 179.000 0.400 1 498 147 47 GLU CA C 59.270 0.400 1 499 147 47 GLU CB C 29.220 0.400 1 500 147 47 GLU CG C 36.120 0.400 1 501 147 47 GLU N N 120.020 0.400 1 502 148 48 LYS H H 7.760 0.020 1 503 148 48 LYS HA H 3.870 0.020 1 504 148 48 LYS HB2 H 1.710 0.020 2 505 148 48 LYS HB3 H 1.500 0.020 2 506 148 48 LYS HG2 H 1.290 0.020 2 507 148 48 LYS HG3 H 1.140 0.020 2 508 148 48 LYS HD2 H 1.380 0.020 1 509 148 48 LYS HD3 H 1.380 0.020 1 510 148 48 LYS HE2 H 2.640 0.020 2 511 148 48 LYS HE3 H 2.560 0.020 2 512 148 48 LYS C C 180.240 0.400 1 513 148 48 LYS CA C 58.900 0.400 1 514 148 48 LYS CB C 31.820 0.400 1 515 148 48 LYS CG C 24.110 0.400 1 516 148 48 LYS CD C 28.740 0.400 1 517 148 48 LYS N N 121.070 0.400 1 518 149 49 VAL H H 8.150 0.020 1 519 149 49 VAL HA H 3.380 0.020 1 520 149 49 VAL HB H 1.940 0.020 1 521 149 49 VAL HG1 H 0.870 0.020 2 522 149 49 VAL HG2 H 0.560 0.020 2 523 149 49 VAL C C 177.610 0.400 1 524 149 49 VAL CA C 66.960 0.400 1 525 149 49 VAL CB C 31.580 0.400 1 526 149 49 VAL CG1 C 21.280 0.400 1 527 149 49 VAL CG2 C 23.030 0.400 1 528 149 49 VAL N N 122.150 0.400 1 529 150 50 HIS H H 8.090 0.020 1 530 150 50 HIS HA H 4.290 0.020 1 531 150 50 HIS HB2 H 3.090 0.020 2 532 150 50 HIS HB3 H 3.230 0.020 2 533 150 50 HIS HD2 H 7.000 0.020 1 534 150 50 HIS C C 176.990 0.400 1 535 150 50 HIS CA C 60.010 0.400 1 536 150 50 HIS CB C 29.460 0.400 1 537 150 50 HIS CD2 C 119.650 0.400 1 538 150 50 HIS N N 119.720 0.400 1 539 151 51 GLU H H 8.120 0.020 1 540 151 51 GLU HA H 3.680 0.020 1 541 151 51 GLU HB2 H 1.940 0.020 2 542 151 51 GLU HB3 H 2.090 0.020 2 543 151 51 GLU HG3 H 2.040 0.020 2 544 151 51 GLU C C 179.160 0.400 1 545 151 51 GLU CA C 59.390 0.400 1 546 151 51 GLU CB C 29.690 0.400 1 547 151 51 GLU CG C 36.520 0.400 1 548 151 51 GLU N N 117.430 0.400 1 549 152 52 TYR H H 7.910 0.020 1 550 152 52 TYR HA H 3.770 0.020 1 551 152 52 TYR HB2 H 2.860 0.020 2 552 152 52 TYR HB3 H 3.080 0.020 2 553 152 52 TYR HD1 H 6.820 0.020 1 554 152 52 TYR HE1 H 6.720 0.020 1 555 152 52 TYR C C 175.430 0.400 1 556 152 52 TYR CA C 61.820 0.400 1 557 152 52 TYR CB C 38.960 0.400 1 558 152 52 TYR CD1 C 132.630 0.400 1 559 152 52 TYR CE1 C 118.490 0.400 1 560 152 52 TYR N N 120.930 0.400 1 561 153 53 ASN H H 8.390 0.020 1 562 153 53 ASN HA H 4.100 0.020 1 563 153 53 ASN HB2 H 2.580 0.020 2 564 153 53 ASN HB3 H 2.860 0.020 2 565 153 53 ASN C C 178.840 0.400 1 566 153 53 ASN CA C 56.120 0.400 1 567 153 53 ASN CB C 37.660 0.400 1 568 153 53 ASN N N 118.530 0.400 1 569 154 54 VAL H H 8.120 0.020 1 570 154 54 VAL HA H 3.500 0.020 1 571 154 54 VAL HB H 1.810 0.020 1 572 154 54 VAL HG1 H 0.700 0.020 2 573 154 54 VAL HG2 H 0.590 0.020 2 574 154 54 VAL C C 178.910 0.400 1 575 154 54 VAL CA C 66.390 0.400 1 576 154 54 VAL CB C 31.710 0.400 1 577 154 54 VAL CG1 C 21.070 0.400 1 578 154 54 VAL CG2 C 22.410 0.400 1 579 154 54 VAL N N 121.120 0.400 1 580 155 55 LEU H H 7.650 0.020 1 581 155 55 LEU HA H 3.910 0.020 1 582 155 55 LEU HB2 H 1.500 0.020 1 583 155 55 LEU HB3 H 1.500 0.020 1 584 155 55 LEU HG H 1.480 0.020 1 585 155 55 LEU HD1 H 0.720 0.020 2 586 155 55 LEU HD2 H 0.670 0.020 2 587 155 55 LEU C C 178.810 0.400 1 588 155 55 LEU CA C 57.820 0.400 1 589 155 55 LEU CB C 41.370 0.400 1 590 155 55 LEU CG C 26.690 0.400 1 591 155 55 LEU CD1 C 23.510 0.400 1 592 155 55 LEU CD2 C 24.540 0.400 1 593 155 55 LEU N N 123.420 0.400 1 594 156 56 LEU H H 8.350 0.020 1 595 156 56 LEU HA H 3.600 0.020 1 596 156 56 LEU HB2 H 1.400 0.020 2 597 156 56 LEU HB3 H 1.120 0.020 2 598 156 56 LEU HG H 1.210 0.020 1 599 156 56 LEU HD1 H 0.640 0.020 2 600 156 56 LEU HD2 H 0.680 0.020 2 601 156 56 LEU C C 179.750 0.400 1 602 156 56 LEU CA C 58.100 0.400 1 603 156 56 LEU CB C 41.620 0.400 1 604 156 56 LEU CG C 26.730 0.400 1 605 156 56 LEU CD1 C 24.300 0.400 1 606 156 56 LEU CD2 C 24.300 0.400 1 607 156 56 LEU N N 120.180 0.400 1 608 157 57 GLU H H 7.780 0.020 1 609 157 57 GLU HA H 3.830 0.020 1 610 157 57 GLU HB2 H 1.980 0.020 1 611 157 57 GLU HB3 H 1.980 0.020 1 612 157 57 GLU HG3 H 2.100 0.020 2 613 157 57 GLU C C 179.080 0.400 1 614 157 57 GLU CA C 59.260 0.400 1 615 157 57 GLU CB C 29.140 0.400 1 616 157 57 GLU CG C 36.180 0.400 1 617 157 57 GLU N N 119.300 0.400 1 618 158 58 THR H H 7.990 0.020 1 619 158 58 THR HA H 3.810 0.020 1 620 158 58 THR HB H 4.190 0.020 1 621 158 58 THR HG2 H 1.090 0.020 1 622 158 58 THR C C 176.780 0.400 1 623 158 58 THR CA C 65.970 0.400 1 624 158 58 THR CB C 69.300 0.400 1 625 158 58 THR CG2 C 21.250 0.400 1 626 158 58 THR N N 114.730 0.400 1 627 159 59 LEU H H 8.040 0.020 1 628 159 59 LEU HA H 4.000 0.020 1 629 159 59 LEU HB2 H 1.540 0.020 2 630 159 59 LEU HB3 H 1.260 0.020 2 631 159 59 LEU HG H 1.540 0.020 1 632 159 59 LEU HD1 H 0.490 0.020 2 633 159 59 LEU HD2 H 0.470 0.020 2 634 159 59 LEU C C 178.400 0.400 1 635 159 59 LEU CA C 56.820 0.400 1 636 159 59 LEU CB C 41.670 0.400 1 637 159 59 LEU CD1 C 22.900 0.400 1 638 159 59 LEU CD2 C 25.240 0.400 1 639 159 59 LEU N N 121.750 0.400 1 640 160 60 SER H H 7.850 0.020 1 641 160 60 SER HA H 4.200 0.020 1 642 160 60 SER HB2 H 3.850 0.020 2 643 160 60 SER HB3 H 3.800 0.020 2 644 160 60 SER C C 174.980 0.400 1 645 160 60 SER CA C 60.090 0.400 1 646 160 60 SER CB C 63.450 0.400 1 647 160 60 SER N N 114.180 0.400 1 648 161 61 ARG H H 7.560 0.020 1 649 161 61 ARG HA H 4.250 0.020 1 650 161 61 ARG HB2 H 1.750 0.020 2 651 161 61 ARG HB3 H 1.840 0.020 2 652 161 61 ARG HG2 H 1.540 0.020 2 653 161 61 ARG HG3 H 1.650 0.020 2 654 161 61 ARG HD2 H 3.080 0.020 1 655 161 61 ARG HD3 H 3.080 0.020 1 656 161 61 ARG C C 177.060 0.400 1 657 161 61 ARG CA C 56.950 0.400 1 658 161 61 ARG CB C 30.450 0.400 1 659 161 61 ARG CG C 27.200 0.400 1 660 161 61 ARG CD C 43.210 0.400 1 661 161 61 ARG N N 120.490 0.400 1 662 162 62 THR H H 7.810 0.020 1 663 162 62 THR HA H 4.180 0.020 1 664 162 62 THR HB H 4.160 0.020 1 665 162 62 THR HG2 H 1.120 0.020 1 666 162 62 THR C C 174.670 0.400 1 667 162 62 THR CA C 62.640 0.400 1 668 162 62 THR CB C 69.620 0.400 1 669 162 62 THR CG2 C 21.230 0.400 1 670 162 62 THR N N 113.140 0.400 1 671 163 63 GLU H H 8.170 0.020 1 672 163 63 GLU HA H 4.200 0.020 1 673 163 63 GLU HB2 H 1.980 0.020 2 674 163 63 GLU HB3 H 1.820 0.020 2 675 163 63 GLU HG3 H 2.140 0.020 2 676 163 63 GLU C C 176.200 0.400 1 677 163 63 GLU CA C 56.650 0.400 1 678 163 63 GLU CB C 30.290 0.400 1 679 163 63 GLU CG C 36.270 0.400 1 680 163 63 GLU N N 122.140 0.400 1 681 164 64 GLU H H 8.140 0.020 1 682 164 64 GLU HA H 4.100 0.020 1 683 164 64 GLU HB2 H 1.840 0.020 1 684 164 64 GLU HB3 H 1.840 0.020 1 685 164 64 GLU HG3 H 2.070 0.020 2 686 164 64 GLU C C 176.260 0.400 1 687 164 64 GLU CA C 56.650 0.400 1 688 164 64 GLU CB C 30.100 0.400 1 689 164 64 GLU CG C 36.240 0.400 1 690 164 64 GLU N N 120.960 0.400 1 691 165 65 ILE H H 7.890 0.020 1 692 165 65 ILE HA H 4.000 0.020 1 693 165 65 ILE HB H 1.690 0.020 1 694 165 65 ILE HG12 H 1.250 0.020 2 695 165 65 ILE HG13 H 0.990 0.020 2 696 165 65 ILE HG2 H 0.690 0.020 1 697 165 65 ILE HD1 H 0.670 0.020 1 698 165 65 ILE C C 175.860 0.400 1 699 165 65 ILE CA C 60.990 0.400 1 700 165 65 ILE CB C 38.550 0.400 1 701 165 65 ILE CG1 C 27.160 0.400 1 702 165 65 ILE CG2 C 17.270 0.400 1 703 165 65 ILE CD1 C 12.810 0.400 1 704 165 65 ILE N N 120.820 0.400 1 705 166 66 HIS H H 8.180 0.020 1 706 166 66 HIS HA H 4.520 0.020 1 707 166 66 HIS HB2 H 2.940 0.020 2 708 166 66 HIS HB3 H 3.030 0.020 2 709 166 66 HIS HD2 H 6.940 0.020 1 710 166 66 HIS C C 175.210 0.400 1 711 166 66 HIS CA C 55.960 0.400 1 712 166 66 HIS CB C 30.630 0.400 1 713 166 66 HIS CD2 C 119.780 0.400 1 714 166 66 HIS N N 123.270 0.400 1 715 167 67 GLU H H 8.250 0.020 1 716 167 67 GLU HA H 4.110 0.020 1 717 167 67 GLU HB2 H 1.910 0.020 2 718 167 67 GLU HB3 H 1.800 0.020 2 719 167 67 GLU HG3 H 2.070 0.020 2 720 167 67 GLU C C 175.980 0.400 1 721 167 67 GLU CA C 56.810 0.400 1 722 167 67 GLU CB C 30.120 0.400 1 723 167 67 GLU CG C 36.020 0.400 1 724 167 67 GLU N N 121.440 0.400 1 725 168 68 ASN H H 8.460 0.020 1 726 168 68 ASN HA H 4.030 0.020 1 727 168 68 ASN HB2 H 2.630 0.020 2 728 168 68 ASN HB3 H 2.720 0.020 2 729 168 68 ASN C C 174.840 0.400 1 730 168 68 ASN CA C 53.150 0.400 1 731 168 68 ASN CB C 38.780 0.400 1 732 168 68 ASN N N 118.890 0.400 1 733 169 69 VAL H H 7.890 0.020 1 734 169 69 VAL HA H 3.990 0.020 1 735 169 69 VAL HB H 1.960 0.020 1 736 169 69 VAL HG1 H 0.760 0.020 2 737 169 69 VAL HG2 H 0.770 0.020 2 738 169 69 VAL C C 175.830 0.400 1 739 169 69 VAL CA C 62.290 0.400 1 740 169 69 VAL CB C 32.650 0.400 1 741 169 69 VAL CG1 C 21.130 0.400 1 742 169 69 VAL CG2 C 20.440 0.400 1 743 169 69 VAL N N 119.640 0.400 1 744 170 70 ILE H H 8.070 0.020 1 745 170 70 ILE HA H 4.080 0.020 1 746 170 70 ILE HB H 1.720 0.020 1 747 170 70 ILE HG12 H 1.330 0.020 2 748 170 70 ILE HG13 H 1.040 0.020 2 749 170 70 ILE HG2 H 0.750 0.020 1 750 170 70 ILE HD1 H 0.690 0.020 1 751 170 70 ILE C C 175.890 0.400 1 752 170 70 ILE CA C 60.800 0.400 1 753 170 70 ILE CB C 38.590 0.400 1 754 170 70 ILE CG1 C 27.280 0.400 1 755 170 70 ILE CG2 C 17.490 0.400 1 756 170 70 ILE CD1 C 12.710 0.400 1 757 170 70 ILE N N 124.040 0.400 1 758 171 71 SER H H 8.320 0.020 1 759 171 71 SER HA H 4.660 0.020 1 760 171 71 SER CA C 55.850 0.400 1 761 171 71 SER CB C 63.430 0.400 1 762 171 71 SER N N 120.820 0.400 1 763 172 72 PRO HA H 4.290 0.020 1 764 172 72 PRO HB2 H 1.850 0.020 2 765 172 72 PRO HB3 H 2.180 0.020 2 766 172 72 PRO HG2 H 1.890 0.020 1 767 172 72 PRO HG3 H 1.890 0.020 1 768 172 72 PRO HD2 H 3.670 0.020 1 769 172 72 PRO HD3 H 3.670 0.020 1 770 172 72 PRO C C 177.330 0.400 1 771 172 72 PRO CA C 63.810 0.400 1 772 172 72 PRO CB C 31.940 0.400 1 773 172 72 PRO CG C 27.370 0.400 1 774 172 72 PRO CD C 50.720 0.400 1 775 173 73 SER H H 8.140 0.020 1 776 173 73 SER HA H 4.200 0.020 1 777 173 73 SER HB2 H 3.770 0.020 2 778 173 73 SER HB3 H 3.720 0.020 2 779 173 73 SER C C 174.460 0.400 1 780 173 73 SER CA C 59.170 0.400 1 781 173 73 SER CB C 63.560 0.400 1 782 173 73 SER N N 114.410 0.400 1 783 174 74 ASP H H 8.040 0.020 1 784 174 74 ASP HA H 4.490 0.020 1 785 174 74 ASP HB2 H 2.540 0.020 2 786 174 74 ASP HB3 H 2.640 0.020 2 787 174 74 ASP C C 176.420 0.400 1 788 174 74 ASP CA C 54.490 0.400 1 789 174 74 ASP CB C 41.150 0.400 1 790 174 74 ASP N N 121.670 0.400 1 791 175 75 LEU H H 7.970 0.020 1 792 175 75 LEU HA H 4.180 0.020 1 793 175 75 LEU HB2 H 1.530 0.020 1 794 175 75 LEU HB3 H 1.530 0.020 1 795 175 75 LEU HG H 1.500 0.020 1 796 175 75 LEU HD1 H 0.770 0.020 2 797 175 75 LEU HD2 H 0.710 0.020 2 798 175 75 LEU C C 177.580 0.400 1 799 175 75 LEU CA C 55.490 0.400 1 800 175 75 LEU CB C 41.840 0.400 1 801 175 75 LEU CG C 26.880 0.400 1 802 175 75 LEU CD1 C 25.000 0.400 1 803 175 75 LEU CD2 C 23.350 0.400 1 804 175 75 LEU N N 121.640 0.400 1 805 176 76 SER H H 8.090 0.020 1 806 176 76 SER HA H 4.200 0.020 1 807 176 76 SER HB2 H 3.740 0.020 1 808 176 76 SER HB3 H 3.740 0.020 1 809 176 76 SER C C 174.490 0.400 1 810 176 76 SER CA C 59.180 0.400 1 811 176 76 SER CB C 63.560 0.400 1 812 176 76 SER N N 115.310 0.400 1 813 177 77 ASP H H 8.080 0.020 1 814 177 77 ASP HA H 4.500 0.020 1 815 177 77 ASP HB2 H 2.530 0.020 2 816 177 77 ASP HB3 H 2.600 0.020 2 817 177 77 ASP C C 176.480 0.400 1 818 177 77 ASP CA C 54.370 0.400 1 819 177 77 ASP CB C 41.060 0.400 1 820 177 77 ASP N N 121.690 0.400 1 821 178 78 ILE H H 7.850 0.020 1 822 178 78 ILE HA H 3.990 0.020 1 823 178 78 ILE HB H 1.780 0.020 1 824 178 78 ILE HG12 H 1.310 0.020 2 825 178 78 ILE HG13 H 1.060 0.020 2 826 178 78 ILE HG2 H 0.740 0.020 1 827 178 78 ILE HD1 H 0.700 0.020 1 828 178 78 ILE C C 176.650 0.400 1 829 178 78 ILE CA C 61.630 0.400 1 830 178 78 ILE CB C 38.310 0.400 1 831 178 78 ILE CG1 C 27.430 0.400 1 832 178 78 ILE CG2 C 17.570 0.400 1 833 178 78 ILE CD1 C 12.990 0.400 1 834 178 78 ILE N N 120.580 0.400 1 835 179 79 LYS H H 8.170 0.020 1 836 179 79 LYS HA H 4.060 0.020 1 837 179 79 LYS HB2 H 1.690 0.020 1 838 179 79 LYS HB3 H 1.690 0.020 1 839 179 79 LYS HG2 H 1.260 0.020 2 840 179 79 LYS HG3 H 1.330 0.020 2 841 179 79 LYS HD2 H 1.540 0.020 1 842 179 79 LYS HD3 H 1.540 0.020 1 843 179 79 LYS HE2 H 2.850 0.020 1 844 179 79 LYS HE3 H 2.850 0.020 1 845 179 79 LYS C C 177.400 0.400 1 846 179 79 LYS CA C 56.920 0.400 1 847 179 79 LYS CB C 32.470 0.400 1 848 179 79 LYS CG C 24.810 0.400 1 849 179 79 LYS CD C 28.760 0.400 1 850 179 79 LYS CE C 41.820 0.400 1 851 179 79 LYS N N 123.730 0.400 1 852 180 80 GLY H H 8.220 0.020 1 853 180 80 GLY HA2 H 3.830 0.020 1 854 180 80 GLY HA3 H 3.830 0.020 1 855 180 80 GLY C C 174.510 0.400 1 856 180 80 GLY CA C 45.400 0.400 1 857 180 80 GLY N N 109.280 0.400 1 858 181 81 SER H H 8.050 0.020 1 859 181 81 SER HA H 3.860 0.020 1 860 181 81 SER HB2 H 3.780 0.020 1 861 181 81 SER HB3 H 3.780 0.020 1 862 181 81 SER C C 175.550 0.400 1 863 181 81 SER CA C 58.760 0.400 1 864 181 81 SER CB C 63.700 0.400 1 865 181 81 SER N N 115.950 0.400 1 866 182 82 VAL H H 8.190 0.020 1 867 182 82 VAL HA H 3.910 0.020 1 868 182 82 VAL HB H 2.000 0.020 1 869 182 82 VAL HG1 H 0.850 0.020 2 870 182 82 VAL HG2 H 0.780 0.020 2 871 182 82 VAL C C 177.080 0.400 1 872 182 82 VAL CA C 63.740 0.400 1 873 182 82 VAL CB C 32.190 0.400 1 874 182 82 VAL CG1 C 21.000 0.400 1 875 182 82 VAL CG2 C 21.000 0.400 1 876 182 82 VAL N N 122.760 0.400 1 877 183 83 LEU H H 8.090 0.020 1 878 183 83 LEU HA H 4.040 0.020 1 879 183 83 LEU HB2 H 1.350 0.020 2 880 183 83 LEU HB3 H 1.490 0.020 2 881 183 83 LEU HG H 1.410 0.020 1 882 183 83 LEU HD1 H 0.740 0.020 2 883 183 83 LEU HD2 H 0.680 0.020 2 884 183 83 LEU C C 177.820 0.400 1 885 183 83 LEU CA C 56.500 0.400 1 886 183 83 LEU CB C 41.960 0.400 1 887 183 83 LEU CG C 26.880 0.400 1 888 183 83 LEU CD1 C 24.740 0.400 1 889 183 83 LEU CD2 C 23.870 0.400 1 890 183 83 LEU N N 122.920 0.400 1 891 184 84 HIS H H 8.020 0.020 1 892 184 84 HIS HB2 H 3.010 0.020 1 893 184 84 HIS HB3 H 3.010 0.020 1 894 184 84 HIS HD2 H 6.880 0.020 1 895 184 84 HIS CA C 58.290 0.400 1 896 184 84 HIS CB C 30.670 0.400 1 897 184 84 HIS CD2 C 119.560 0.400 1 898 184 84 HIS N N 118.700 0.400 1 899 186 86 ARG HA H 4.220 0.020 1 900 186 86 ARG HB2 H 1.690 0.020 1 901 186 86 ARG HB3 H 1.690 0.020 1 902 186 86 ARG HG2 H 1.550 0.020 2 903 186 86 ARG HG3 H 1.490 0.020 2 904 186 86 ARG HD2 H 2.980 0.020 1 905 186 86 ARG HD3 H 2.980 0.020 1 906 186 86 ARG C C 177.340 0.400 1 907 186 86 ARG CA C 57.570 0.400 1 908 186 86 ARG CB C 30.350 0.400 1 909 186 86 ARG CG C 27.040 0.400 1 910 186 86 ARG CD C 43.080 0.400 1 911 187 87 HIS H H 7.990 0.020 1 912 187 87 HIS HD2 H 6.870 0.020 1 913 187 87 HIS CA C 58.690 0.400 1 914 187 87 HIS CB C 30.450 0.400 1 915 187 87 HIS CD2 C 119.260 0.400 1 916 187 87 HIS N N 119.050 0.400 1 917 188 88 THR HA H 3.810 0.020 1 918 188 88 THR HB H 4.140 0.020 1 919 188 88 THR HG2 H 1.140 0.020 1 920 188 88 THR C C 176.080 0.400 1 921 188 88 THR CA C 66.230 0.400 1 922 188 88 THR CB C 68.300 0.400 1 923 188 88 THR CG2 C 21.770 0.400 1 924 189 89 GLU H H 8.320 0.020 1 925 189 89 GLU HA H 4.030 0.020 1 926 189 89 GLU HB2 H 2.000 0.020 1 927 189 89 GLU HB3 H 2.000 0.020 1 928 189 89 GLU HG3 H 2.280 0.020 2 929 189 89 GLU C C 178.900 0.400 1 930 189 89 GLU CA C 59.190 0.400 1 931 189 89 GLU CB C 29.200 0.400 1 932 189 89 GLU CG C 36.200 0.400 1 933 189 89 GLU N N 122.610 0.400 1 934 190 90 LEU H H 7.840 0.020 1 935 190 90 LEU HA H 3.920 0.020 1 936 190 90 LEU HB2 H 1.670 0.020 1 937 190 90 LEU HB3 H 1.670 0.020 1 938 190 90 LEU HG H 1.550 0.020 1 939 190 90 LEU HD1 H 0.560 0.020 2 940 190 90 LEU HD2 H 0.550 0.020 2 941 190 90 LEU C C 178.550 0.400 1 942 190 90 LEU CA C 58.240 0.400 1 943 190 90 LEU CB C 41.940 0.400 1 944 190 90 LEU CG C 26.860 0.400 1 945 190 90 LEU CD1 C 25.720 0.400 1 946 190 90 LEU CD2 C 24.580 0.400 1 947 190 90 LEU N N 119.670 0.400 1 948 191 91 LYS H H 7.730 0.020 1 949 191 91 LYS HA H 3.940 0.020 1 950 191 91 LYS HB2 H 1.850 0.020 2 951 191 91 LYS HB3 H 1.920 0.020 2 952 191 91 LYS HG2 H 1.480 0.020 1 953 191 91 LYS HG3 H 1.480 0.020 1 954 191 91 LYS HD2 H 1.590 0.020 1 955 191 91 LYS HD3 H 1.590 0.020 1 956 191 91 LYS HE2 H 2.850 0.020 1 957 191 91 LYS HE3 H 2.850 0.020 1 958 191 91 LYS C C 179.730 0.400 1 959 191 91 LYS CA C 59.810 0.400 1 960 191 91 LYS CB C 32.160 0.400 1 961 191 91 LYS CG C 24.990 0.400 1 962 191 91 LYS CD C 29.140 0.400 1 963 191 91 LYS CE C 41.690 0.400 1 964 191 91 LYS N N 118.510 0.400 1 965 192 92 GLU H H 8.080 0.020 1 966 192 92 GLU HA H 4.030 0.020 1 967 192 92 GLU HB2 H 2.000 0.020 1 968 192 92 GLU HB3 H 2.000 0.020 1 969 192 92 GLU HG3 H 2.220 0.020 2 970 192 92 GLU C C 179.590 0.400 1 971 192 92 GLU CA C 58.760 0.400 1 972 192 92 GLU CB C 29.200 0.400 1 973 192 92 GLU CG C 36.170 0.400 1 974 192 92 GLU N N 119.800 0.400 1 975 193 93 LYS H H 8.250 0.020 1 976 193 93 LYS HA H 4.060 0.020 1 977 193 93 LYS HB2 H 2.090 0.020 2 978 193 93 LYS HB3 H 1.920 0.020 2 979 193 93 LYS HG2 H 1.480 0.020 2 980 193 93 LYS HG3 H 1.660 0.020 2 981 193 93 LYS HD2 H 1.650 0.020 2 982 193 93 LYS HD3 H 1.500 0.020 2 983 193 93 LYS HE2 H 2.840 0.020 1 984 193 93 LYS HE3 H 2.840 0.020 1 985 193 93 LYS C C 175.980 0.400 1 986 193 93 LYS CA C 59.470 0.400 1 987 193 93 LYS CB C 32.760 0.400 1 988 193 93 LYS CG C 26.450 0.400 1 989 193 93 LYS CD C 29.020 0.400 1 990 193 93 LYS CE C 42.120 0.400 1 991 193 93 LYS N N 120.860 0.400 1 992 194 94 LEU H H 8.240 0.020 1 993 194 94 LEU HA H 3.610 0.020 1 994 194 94 LEU HB2 H 1.750 0.020 2 995 194 94 LEU HB3 H 1.500 0.020 2 996 194 94 LEU HG H 1.340 0.020 1 997 194 94 LEU HD1 H 0.720 0.020 2 998 194 94 LEU HD2 H 0.460 0.020 2 999 194 94 LEU C C 174.840 0.400 1 1000 194 94 LEU CA C 57.460 0.400 1 1001 194 94 LEU CB C 41.110 0.400 1 1002 194 94 LEU CG C 26.540 0.400 1 1003 194 94 LEU CD1 C 24.890 0.400 1 1004 194 94 LEU CD2 C 25.010 0.400 1 1005 194 94 LEU N N 121.480 0.400 1 1006 195 95 ARG H H 7.890 0.020 1 1007 195 95 ARG HA H 3.950 0.020 1 1008 195 95 ARG HB2 H 1.840 0.020 1 1009 195 95 ARG HB3 H 1.840 0.020 1 1010 195 95 ARG HG2 H 1.440 0.020 2 1011 195 95 ARG HG3 H 1.660 0.020 2 1012 195 95 ARG HD2 H 3.100 0.020 1 1013 195 95 ARG HD3 H 3.100 0.020 1 1014 195 95 ARG C C 178.990 0.400 1 1015 195 95 ARG CA C 59.820 0.400 1 1016 195 95 ARG CB C 29.450 0.400 1 1017 195 95 ARG CG C 27.010 0.400 1 1018 195 95 ARG CD C 43.220 0.400 1 1019 195 95 ARG N N 119.680 0.400 1 1020 196 96 SER H H 7.720 0.020 1 1021 196 96 SER HA H 4.160 0.020 1 1022 196 96 SER HB2 H 3.890 0.020 2 1023 196 96 SER HB3 H 3.930 0.020 2 1024 196 96 SER C C 179.080 0.400 1 1025 196 96 SER CA C 61.110 0.400 1 1026 196 96 SER CB C 62.960 0.400 1 1027 196 96 SER N N 113.000 0.400 1 1028 197 97 ILE H H 7.950 0.020 1 1029 197 97 ILE HA H 3.580 0.020 1 1030 197 97 ILE HB H 1.790 0.020 1 1031 197 97 ILE HG12 H 1.510 0.020 1 1032 197 97 ILE HG13 H 1.510 0.020 1 1033 197 97 ILE HG2 H 0.690 0.020 1 1034 197 97 ILE HD1 H 0.380 0.020 1 1035 197 97 ILE C C 177.630 0.400 1 1036 197 97 ILE CA C 65.760 0.400 1 1037 197 97 ILE CB C 38.070 0.400 1 1038 197 97 ILE CG1 C 30.370 0.400 1 1039 197 97 ILE CG2 C 17.040 0.400 1 1040 197 97 ILE CD1 C 14.210 0.400 1 1041 197 97 ILE N N 124.290 0.400 1 1042 198 98 ASN H H 8.470 0.020 1 1043 198 98 ASN HA H 4.390 0.020 1 1044 198 98 ASN HB2 H 2.750 0.020 1 1045 198 98 ASN HB3 H 2.750 0.020 1 1046 198 98 ASN C C 178.580 0.400 1 1047 198 98 ASN CA C 56.310 0.400 1 1048 198 98 ASN CB C 37.480 0.400 1 1049 198 98 ASN N N 120.700 0.400 1 1050 199 99 GLN H H 8.520 0.020 1 1051 199 99 GLN HA H 4.070 0.020 1 1052 199 99 GLN HB2 H 1.990 0.020 2 1053 199 99 GLN HB3 H 2.100 0.020 2 1054 199 99 GLN HG2 H 2.310 0.020 2 1055 199 99 GLN HG3 H 2.500 0.020 2 1056 199 99 GLN C C 179.480 0.400 1 1057 199 99 GLN CA C 58.760 0.400 1 1058 199 99 GLN CB C 28.290 0.400 1 1059 199 99 GLN CG C 34.160 0.400 1 1060 199 99 GLN N N 120.210 0.400 1 1061 200 100 GLY H H 8.250 0.020 1 1062 200 100 GLY HA2 H 3.810 0.020 2 1063 200 100 GLY HA3 H 4.200 0.020 2 1064 200 100 GLY C C 176.110 0.400 1 1065 200 100 GLY CA C 47.050 0.400 1 1066 200 100 GLY N N 110.330 0.400 1 1067 201 101 LEU H H 8.390 0.020 1 1068 201 101 LEU HA H 3.570 0.020 1 1069 201 101 LEU HB2 H 1.430 0.020 2 1070 201 101 LEU HB3 H 1.750 0.020 2 1071 201 101 LEU HG H 1.400 0.020 1 1072 201 101 LEU HD1 H 0.730 0.020 2 1073 201 101 LEU HD2 H 0.580 0.020 2 1074 201 101 LEU C C 178.250 0.400 1 1075 201 101 LEU CA C 57.600 0.400 1 1076 201 101 LEU CB C 41.180 0.400 1 1077 201 101 LEU CG C 27.150 0.400 1 1078 201 101 LEU CD1 C 24.890 0.400 1 1079 201 101 LEU CD2 C 22.960 0.400 1 1080 201 101 LEU N N 123.780 0.400 1 1081 202 102 ASP H H 7.670 0.020 1 1082 202 102 ASP HA H 4.190 0.020 1 1083 202 102 ASP HB2 H 2.550 0.020 2 1084 202 102 ASP HB3 H 2.670 0.020 2 1085 202 102 ASP C C 178.800 0.400 1 1086 202 102 ASP CA C 57.680 0.400 1 1087 202 102 ASP CB C 40.670 0.400 1 1088 202 102 ASP N N 119.030 0.400 1 1089 203 103 ARG H H 7.670 0.020 1 1090 203 103 ARG HA H 3.950 0.020 1 1091 203 103 ARG HB2 H 1.590 0.020 1 1092 203 103 ARG HB3 H 1.590 0.020 1 1093 203 103 ARG HG2 H 1.230 0.020 2 1094 203 103 ARG HG3 H 1.610 0.020 2 1095 203 103 ARG HD2 H 3.060 0.020 2 1096 203 103 ARG HD3 H 3.160 0.020 2 1097 203 103 ARG C C 177.620 0.400 1 1098 203 103 ARG CA C 59.620 0.400 1 1099 203 103 ARG CB C 29.140 0.400 1 1100 203 103 ARG CG C 28.100 0.400 1 1101 203 103 ARG CD C 42.870 0.400 1 1102 203 103 ARG N N 119.640 0.400 1 1103 204 104 LEU H H 8.060 0.020 1 1104 204 104 LEU HA H 3.660 0.020 1 1105 204 104 LEU HB2 H 1.490 0.020 2 1106 204 104 LEU HB3 H 0.750 0.020 2 1107 204 104 LEU HG H 1.390 0.020 1 1108 204 104 LEU HD1 H -0.100 0.020 2 1109 204 104 LEU HD2 H -0.020 0.020 2 1110 204 104 LEU C C 180.420 0.400 1 1111 204 104 LEU CA C 58.010 0.400 1 1112 204 104 LEU CB C 41.100 0.400 1 1113 204 104 LEU CG C 25.830 0.400 1 1114 204 104 LEU CD1 C 24.340 0.400 1 1115 204 104 LEU CD2 C 21.300 0.400 1 1116 204 104 LEU N N 118.950 0.400 1 1117 205 105 ARG H H 8.650 0.020 1 1118 205 105 ARG HA H 3.870 0.020 1 1119 205 105 ARG HB2 H 1.830 0.020 1 1120 205 105 ARG HB3 H 1.830 0.020 1 1121 205 105 ARG HG2 H 1.450 0.020 2 1122 205 105 ARG HG3 H 1.620 0.020 2 1123 205 105 ARG HD2 H 3.080 0.020 1 1124 205 105 ARG HD3 H 3.080 0.020 1 1125 205 105 ARG C C 178.070 0.400 1 1126 205 105 ARG CA C 60.270 0.400 1 1127 205 105 ARG CB C 29.990 0.400 1 1128 205 105 ARG CG C 28.120 0.400 1 1129 205 105 ARG CD C 43.290 0.400 1 1130 205 105 ARG N N 120.610 0.400 1 1131 206 106 ARG H H 7.680 0.020 1 1132 206 106 ARG HA H 4.000 0.020 1 1133 206 106 ARG HB2 H 1.840 0.020 1 1134 206 106 ARG HB3 H 1.840 0.020 1 1135 206 106 ARG HG2 H 1.400 0.020 2 1136 206 106 ARG HG3 H 1.600 0.020 2 1137 206 106 ARG HD2 H 3.110 0.020 1 1138 206 106 ARG HD3 H 3.110 0.020 1 1139 206 106 ARG C C 178.910 0.400 1 1140 206 106 ARG CA C 59.840 0.400 1 1141 206 106 ARG CB C 30.060 0.400 1 1142 206 106 ARG CG C 27.620 0.400 1 1143 206 106 ARG CD C 43.240 0.400 1 1144 206 106 ARG N N 120.080 0.400 1 1145 207 107 VAL H H 8.860 0.020 1 1146 207 107 VAL HA H 3.570 0.020 1 1147 207 107 VAL HB H 1.740 0.020 1 1148 207 107 VAL HG1 H 0.830 0.020 2 1149 207 107 VAL HG2 H 0.460 0.020 2 1150 207 107 VAL C C 178.780 0.400 1 1151 207 107 VAL CA C 65.560 0.400 1 1152 207 107 VAL CB C 31.840 0.400 1 1153 207 107 VAL CG1 C 22.280 0.400 1 1154 207 107 VAL CG2 C 21.660 0.400 1 1155 207 107 VAL N N 118.520 0.400 1 1156 208 108 SER H H 8.090 0.020 1 1157 208 108 SER HA H 3.960 0.020 1 1158 208 108 SER HB2 H 3.820 0.020 1 1159 208 108 SER HB3 H 3.820 0.020 1 1160 208 108 SER C C 173.310 0.400 1 1161 208 108 SER CA C 63.250 0.400 1 1162 208 108 SER CB C 63.370 0.400 1 1163 208 108 SER N N 113.720 0.400 1 1164 209 109 HIS H H 7.110 0.020 1 1165 209 109 HIS HA H 4.410 0.020 1 1166 209 109 HIS HB2 H 3.100 0.020 2 1167 209 109 HIS HB3 H 3.040 0.020 2 1168 209 109 HIS HD2 H 6.980 0.020 1 1169 209 109 HIS C C 176.580 0.400 1 1170 209 109 HIS CA C 58.240 0.400 1 1171 209 109 HIS CB C 31.660 0.400 1 1172 209 109 HIS CD2 C 122.320 0.400 1 1173 209 109 HIS N N 113.410 0.400 1 1174 210 110 GLN H H 8.240 0.020 1 1175 210 110 GLN HA H 4.290 0.020 1 1176 210 110 GLN HB2 H 1.930 0.020 2 1177 210 110 GLN HB3 H 2.010 0.020 2 1178 210 110 GLN HG2 H 2.280 0.020 2 1179 210 110 GLN HG3 H 2.330 0.020 2 1180 210 110 GLN C C 177.520 0.400 1 1181 210 110 GLN CA C 56.420 0.400 1 1182 210 110 GLN CB C 30.890 0.400 1 1183 210 110 GLN CG C 33.870 0.400 1 1184 210 110 GLN N N 115.690 0.400 1 1185 211 111 GLY H H 8.680 0.020 1 1186 211 111 GLY HA2 H 3.780 0.020 2 1187 211 111 GLY HA3 H 3.000 0.020 2 1188 211 111 GLY C C 172.830 0.400 1 1189 211 111 GLY CA C 43.520 0.400 1 1190 211 111 GLY N N 109.570 0.400 1 1191 212 112 TYR H H 8.290 0.020 1 1192 212 112 TYR HA H 4.370 0.020 1 1193 212 112 TYR HB2 H 2.610 0.020 2 1194 212 112 TYR HB3 H 3.070 0.020 2 1195 212 112 TYR HD1 H 7.160 0.020 1 1196 212 112 TYR HE1 H 6.930 0.020 1 1197 212 112 TYR C C 177.480 0.400 1 1198 212 112 TYR CA C 60.080 0.400 1 1199 212 112 TYR CB C 39.080 0.400 1 1200 212 112 TYR CD1 C 132.620 0.400 1 1201 212 112 TYR CE1 C 118.080 0.400 1 1202 212 112 TYR N N 116.830 0.400 1 1203 213 113 SER H H 8.260 0.020 1 1204 213 113 SER HA H 4.410 0.020 1 1205 213 113 SER HB2 H 3.810 0.020 1 1206 213 113 SER HB3 H 3.810 0.020 1 1207 213 113 SER C C 174.980 0.400 1 1208 213 113 SER CA C 58.450 0.400 1 1209 213 113 SER CB C 63.580 0.400 1 1210 213 113 SER N N 115.880 0.400 1 1211 214 114 THR H H 8.060 0.020 1 1212 214 114 THR HA H 4.300 0.020 1 1213 214 114 THR HB H 4.160 0.020 1 1214 214 114 THR HG2 H 1.080 0.020 1 1215 214 114 THR C C 174.510 0.400 1 1216 214 114 THR CA C 61.780 0.400 1 1217 214 114 THR CB C 70.160 0.400 1 1218 214 114 THR CG2 C 21.230 0.400 1 1219 214 114 THR N N 115.040 0.400 1 1220 215 115 GLU H H 8.160 0.020 1 1221 215 115 GLU HA H 4.200 0.020 1 1222 215 115 GLU HB2 H 1.990 0.020 2 1223 215 115 GLU HB3 H 1.830 0.020 2 1224 215 115 GLU HG3 H 2.120 0.020 2 1225 215 115 GLU C C 175.050 0.400 1 1226 215 115 GLU CA C 56.330 0.400 1 1227 215 115 GLU CB C 30.290 0.400 1 1228 215 115 GLU CG C 36.270 0.400 1 1229 215 115 GLU N N 123.180 0.400 1 1230 216 116 ALA H H 7.800 0.020 1 1231 216 116 ALA HA H 3.970 0.020 1 1232 216 116 ALA HB H 1.190 0.020 1 1233 216 116 ALA C C 182.460 0.400 1 1234 216 116 ALA CA C 53.810 0.400 1 1235 216 116 ALA CB C 20.080 0.400 1 1236 216 116 ALA N N 130.710 0.400 1 stop_ save_