data_6759 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NEAT NMR Resonance Assignments ; _BMRB_accession_number 6759 _BMRB_flat_file_name bmr6759.str _Entry_type original _Submission_date 2005-08-03 _Accession_date 2005-08-03 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Resonance assignments for NEAT domain I (D1) of IsdH' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Pilpa Rosemarie M. . 2 Clubb Robert T. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 682 "13C chemical shifts" 565 "15N chemical shifts" 123 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2005-11-07 original BMRB . stop_ _Original_release_date 2005-08-03 save_ ############################# # Citation for this entry # ############################# save_NEAT_NMR_Resonance_assignments _Saveframe_category entry_citation _Citation_full . _Citation_title ; NMR Resonance Assignments of the NEAT (NEAr Transporter) Domain from the Staphylococcus aureus IsdH Protein ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 16258836 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Pilpa Rosemarie M. . 2 Clubb Robert T. . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_volume 33 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 137 _Page_last 137 _Year 2005 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'NEAT domain' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'NEAT domain' $NEAT_domain_polypeptide 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_NEAT_domain_polypeptide _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'NEAT domain' _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 145 _Mol_residue_sequence ; MADESLKDAIKDPALENKEH DIGPREQVNFQLLDKNNETQ YYHFFSIKDPADVYYTKKKA EVELDINTASTWKKFEVYEN NQKLPVRLVSYSPVPEDHAY IRFPVSDGTQELKIVSSTQI DDGEETNYDYTKLVFAKPIY NDPSL ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 85 MET 2 86 ALA 3 87 ASP 4 88 GLU 5 89 SER 6 90 LEU 7 91 LYS 8 92 ASP 9 93 ALA 10 94 ILE 11 95 LYS 12 96 ASP 13 97 PRO 14 98 ALA 15 99 LEU 16 100 GLU 17 101 ASN 18 102 LYS 19 103 GLU 20 104 HIS 21 105 ASP 22 106 ILE 23 107 GLY 24 108 PRO 25 109 ARG 26 110 GLU 27 111 GLN 28 112 VAL 29 113 ASN 30 114 PHE 31 115 GLN 32 116 LEU 33 117 LEU 34 118 ASP 35 119 LYS 36 120 ASN 37 121 ASN 38 122 GLU 39 123 THR 40 124 GLN 41 125 TYR 42 126 TYR 43 127 HIS 44 128 PHE 45 129 PHE 46 130 SER 47 131 ILE 48 132 LYS 49 133 ASP 50 134 PRO 51 135 ALA 52 136 ASP 53 137 VAL 54 138 TYR 55 139 TYR 56 140 THR 57 141 LYS 58 142 LYS 59 143 LYS 60 144 ALA 61 145 GLU 62 146 VAL 63 147 GLU 64 148 LEU 65 149 ASP 66 150 ILE 67 151 ASN 68 152 THR 69 153 ALA 70 154 SER 71 155 THR 72 156 TRP 73 157 LYS 74 158 LYS 75 159 PHE 76 160 GLU 77 161 VAL 78 162 TYR 79 163 GLU 80 164 ASN 81 165 ASN 82 166 GLN 83 167 LYS 84 168 LEU 85 169 PRO 86 170 VAL 87 171 ARG 88 172 LEU 89 173 VAL 90 174 SER 91 175 TYR 92 176 SER 93 177 PRO 94 178 VAL 95 179 PRO 96 180 GLU 97 181 ASP 98 182 HIS 99 183 ALA 100 184 TYR 101 185 ILE 102 186 ARG 103 187 PHE 104 188 PRO 105 189 VAL 106 190 SER 107 191 ASP 108 192 GLY 109 193 THR 110 194 GLN 111 195 GLU 112 196 LEU 113 197 LYS 114 198 ILE 115 199 VAL 116 200 SER 117 201 SER 118 202 THR 119 203 GLN 120 204 ILE 121 205 ASP 122 206 ASP 123 207 GLY 124 208 GLU 125 209 GLU 126 210 THR 127 211 ASN 128 212 TYR 129 213 ASP 130 214 TYR 131 215 THR 132 216 LYS 133 217 LEU 134 218 VAL 135 219 PHE 136 220 ALA 137 221 LYS 138 222 PRO 139 223 ILE 140 224 TYR 141 225 ASN 142 226 ASP 143 227 PRO 144 228 SER 145 229 LEU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $NEAT_domain_polypeptide polypeptide 1280 Bacteria . Staphylococcus aureus 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 $NEAT_domain_polypeptide 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_NEAT_domain _Saveframe_category sample _Sample_type solution _Details ; The NEAT protein was at 1mM concentration in 50mM sodium phospate buffer pH 6, 100mM NaCl, and 0.01% sodium azide ; loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $NEAT_domain_polypeptide 1 mM '[U-13C; U-15N]' 'sodium phospate' 50 mM . NaCl 100 mM . 'sodium azide' 0.01 % . stop_ save_ ############################ # Computer software used # ############################ save_nmrview _Saveframe_category software _Name NMRView _Version . _Details 'Blevins, B. A. J. a. R. A. (1994) J. Biomol. NMR 4, 603-614' save_ save_Pipp _Saveframe_category software _Name PIPP _Version . _Details 'Garrett , P. R., Gronenborn A.M., and Clore G.M. (1991) J. Magn. Reson 95, 214-220' save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_500MHz_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DMX _Field_strength 500 _Details 'cryoprobe equipped' save_ save_600MHz_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DMX _Field_strength 600 _Details 'cryoprobe equipped' save_ save_800MHz_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DMX _Field_strength 800 _Details 'cryoprobe equipped' save_ ############################# # NMR applied experiments # ############################# save_1H15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name 1H15N_HSQC _Sample_label $NEAT_domain save_ save_1H13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name 1H13C_HSQC _Sample_label $NEAT_domain save_ save_15N-edited_NOESY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '15N-edited NOESY' _Sample_label $NEAT_domain save_ save_HNHA_4 _Saveframe_category NMR_applied_experiment _Experiment_name HNHA _Sample_label $NEAT_domain save_ save_HNHB_5 _Saveframe_category NMR_applied_experiment _Experiment_name HNHB _Sample_label $NEAT_domain save_ save_HNCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label $NEAT_domain save_ save_CBCACONH_7 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONH _Sample_label $NEAT_domain save_ save_CCCONH_8 _Saveframe_category NMR_applied_experiment _Experiment_name CCCONH _Sample_label $NEAT_domain save_ save_HNCA_9 _Saveframe_category NMR_applied_experiment _Experiment_name HNCA _Sample_label $NEAT_domain save_ save_HNCO_10 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _Sample_label $NEAT_domain save_ save_HNCACO_11 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACO _Sample_label $NEAT_domain save_ save_HBHACONH_12 _Saveframe_category NMR_applied_experiment _Experiment_name HBHACONH _Sample_label $NEAT_domain save_ save_15N-edited_TOCSY_13 _Saveframe_category NMR_applied_experiment _Experiment_name '15N-edited TOCSY' _Sample_label $NEAT_domain save_ save_13C-edited_NOESY_in_D2O_14 _Saveframe_category NMR_applied_experiment _Experiment_name '13C-edited NOESY in D2O' _Sample_label $NEAT_domain save_ save_HCCH-TOCSY_15 _Saveframe_category NMR_applied_experiment _Experiment_name HCCH-TOCSY _Sample_label $NEAT_domain save_ save_HCCH-COSY_16 _Saveframe_category NMR_applied_experiment _Experiment_name HCCH-COSY _Sample_label $NEAT_domain save_ save_HNHN_17 _Saveframe_category NMR_applied_experiment _Experiment_name HNHN _Sample_label $NEAT_domain save_ save_13C-edited_NOESY_in_H2O_18 _Saveframe_category NMR_applied_experiment _Experiment_name '13C-edited NOESY in H2O' _Sample_label $NEAT_domain save_ ####################### # Sample conditions # ####################### save_NMR_conditions _Saveframe_category sample_conditions _Details '50mM sodium phosphate pH 6, 100mM NaCl, 0.01% sodium azide' loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6 0.2 pH temperature 295 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 DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_neatassign3.htm _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label 1H15N_HSQC stop_ loop_ _Sample_label $NEAT_domain stop_ _Sample_conditions_label $NMR_conditions _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name 'NEAT domain' _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 86 2 ALA HA H 4.0510 . . 2 86 2 ALA HB H 1.4810 . . 3 86 2 ALA C C 173.6590 . . 4 86 2 ALA CA C 51.5630 . . 5 86 2 ALA CB C 18.7700 . . 6 87 3 ASP H H 8.7000 . . 7 87 3 ASP HA H 4.5240 . . 8 87 3 ASP HB2 H 2.6820 . . 9 87 3 ASP HB3 H 2.5840 . . 10 87 3 ASP C C 175.6250 . . 11 87 3 ASP CA C 54.2300 . . 12 87 3 ASP CB C 40.4340 . . 13 87 3 ASP N N 119.6900 . . 14 88 4 GLU H H 8.6030 . . 15 88 4 GLU HA H 4.2700 . . 16 88 4 GLU HB2 H 2.0200 . . 17 88 4 GLU HB3 H 1.9050 . . 18 88 4 GLU HG2 H 2.2660 . . 19 88 4 GLU C C 176.8250 . . 20 88 4 GLU CA C 56.4530 . . 21 88 4 GLU CB C 29.7900 . . 22 88 4 GLU CG C 36.0200 . . 23 88 4 GLU N N 120.7680 . . 24 89 5 SER H H 8.4430 . . 25 89 5 SER HA H 4.5690 . . 26 89 5 SER HB2 H 3.8220 . . 27 89 5 SER C C 176.0570 . . 28 89 5 SER CA C 56.1470 . . 29 89 5 SER CB C 63.0490 . . 30 89 5 SER N N 117.6420 . . 31 90 6 LEU H H 9.6340 . . 32 90 6 LEU HA H 4.0110 . . 33 90 6 LEU HB2 H 1.6730 . . 34 90 6 LEU HB3 H 1.5160 . . 35 90 6 LEU HG H 1.5380 . . 36 90 6 LEU HD1 H 0.5670 . . 37 90 6 LEU HD2 H 0.5310 . . 38 90 6 LEU C C 178.6120 . . 39 90 6 LEU CA C 58.9980 . . 40 90 6 LEU CB C 40.4340 . . 41 90 6 LEU CG C 27.0770 . . 42 90 6 LEU CD1 C 24.2650 . . 43 90 6 LEU CD2 C 24.2650 . . 44 90 6 LEU N N 111.6130 . . 45 91 7 LYS H H 8.1480 . . 46 91 7 LYS HA H 3.9460 . . 47 91 7 LYS HB2 H 1.9800 . . 48 91 7 LYS HB3 H 1.7870 . . 49 91 7 LYS HG2 H 1.4730 . . 50 91 7 LYS HG3 H 1.1260 . . 51 91 7 LYS HD2 H 1.9770 . . 52 91 7 LYS HD3 H 1.7890 . . 53 91 7 LYS HE2 H 2.9450 . . 54 91 7 LYS C C 176.5180 . . 55 91 7 LYS CA C 57.9320 . . 56 91 7 LYS CB C 30.6640 . . 57 91 7 LYS CG C 22.9450 . . 58 91 7 LYS CD C 30.9100 . . 59 91 7 LYS CE C 41.1700 . . 60 91 7 LYS N N 112.1940 . . 61 92 8 ASP H H 7.1720 . . 62 92 8 ASP HA H 4.6610 . . 63 92 8 ASP HB2 H 2.6050 . . 64 92 8 ASP C C 178.2800 . . 65 92 8 ASP CA C 55.6650 . . 66 92 8 ASP CB C 41.2000 . . 67 92 8 ASP N N 118.3120 . . 68 93 9 ALA H H 8.2710 . . 69 93 9 ALA HA H 4.0230 . . 70 93 9 ALA HB H 1.4330 . . 71 93 9 ALA C C 179.9910 . . 72 93 9 ALA CA C 55.0440 . . 73 93 9 ALA CB C 18.6010 . . 74 93 9 ALA N N 127.0890 . . 75 94 10 ILE H H 7.5050 . . 76 94 10 ILE HA H 3.5210 . . 77 94 10 ILE HB H 0.5620 . . 78 94 10 ILE HG12 H 1.0490 . . 79 94 10 ILE HG2 H 0.5100 . . 80 94 10 ILE HD1 H 0.3610 . . 81 94 10 ILE C C 174.9350 . . 82 94 10 ILE CA C 62.5060 . . 83 94 10 ILE CB C 35.2830 . . 84 94 10 ILE CG1 C 23.4110 . . 85 94 10 ILE CG2 C 17.4100 . . 86 94 10 ILE CD1 C 13.5900 . . 87 94 10 ILE N N 128.2930 . . 88 95 11 LYS H H 6.9630 . . 89 95 11 LYS HA H 4.0400 . . 90 95 11 LYS HB2 H 1.9280 . . 91 95 11 LYS HB3 H 1.7140 . . 92 95 11 LYS HG2 H 1.5320 . . 93 95 11 LYS HG3 H 1.3170 . . 94 95 11 LYS HD2 H 1.8260 . . 95 95 11 LYS HD3 H 1.7740 . . 96 95 11 LYS HE2 H 3.0600 . . 97 95 11 LYS HE3 H 3.0340 . . 98 95 11 LYS C C 176.6460 . . 99 95 11 LYS CA C 56.1570 . . 100 95 11 LYS CB C 31.5900 . . 101 95 11 LYS CG C 25.4340 . . 102 95 11 LYS CD C 28.6840 . . 103 95 11 LYS CE C 42.1700 . . 104 95 11 LYS N N 118.1780 . . 105 96 12 ASP H H 6.8360 . . 106 96 12 ASP HA H 4.7010 . . 107 96 12 ASP HB2 H 2.8120 . . 108 96 12 ASP HB3 H 2.6590 . . 109 96 12 ASP C C 176.6500 . . 110 96 12 ASP CA C 51.4070 . . 111 96 12 ASP CB C 40.7940 . . 112 96 12 ASP N N 119.9200 . . 113 97 13 PRO HA H 4.3620 . . 114 97 13 PRO HB2 H 2.4230 . . 115 97 13 PRO HB3 H 2.0060 . . 116 97 13 PRO HG2 H 2.0510 . . 117 97 13 PRO HD2 H 4.2490 . . 118 97 13 PRO HD3 H 3.9690 . . 119 97 13 PRO C C 176.2950 . . 120 97 13 PRO CA C 64.2780 . . 121 97 13 PRO CB C 32.0990 . . 122 97 13 PRO CG C 27.1763 . . 123 97 13 PRO CD C 51.0900 . . 124 98 14 ALA H H 8.3800 . . 125 98 14 ALA HA H 4.1440 . . 126 98 14 ALA HB H 1.3880 . . 127 98 14 ALA C C 179.3490 . . 128 98 14 ALA CA C 53.8570 . . 129 98 14 ALA CB C 18.0070 . . 130 98 14 ALA N N 119.9860 . . 131 99 15 LEU H H 7.4270 . . 132 99 15 LEU HA H 4.2340 . . 133 99 15 LEU HB2 H 1.8590 . . 134 99 15 LEU HB3 H 1.3870 . . 135 99 15 LEU HG H 1.5210 . . 136 99 15 LEU HD1 H 0.6380 . . 137 99 15 LEU HD2 H 0.8330 . . 138 99 15 LEU C C 177.9180 . . 139 99 15 LEU CA C 54.0300 . . 140 99 15 LEU CB C 42.8260 . . 141 99 15 LEU CG C 26.1810 . . 142 99 15 LEU CD1 C 22.4830 . . 143 99 15 LEU CD2 C 26.1810 . . 144 99 15 LEU N N 115.2060 . . 145 100 16 GLU H H 7.2380 . . 146 100 16 GLU HA H 4.3820 . . 147 100 16 GLU HB2 H 2.1110 . . 148 100 16 GLU HB3 H 2.0460 . . 149 100 16 GLU HG2 H 2.2390 . . 150 100 16 GLU HG3 H 2.1230 . . 151 100 16 GLU C C 177.2590 . . 152 100 16 GLU CA C 57.5340 . . 153 100 16 GLU CB C 29.5680 . . 154 100 16 GLU CG C 37.3810 . . 155 100 16 GLU N N 121.6260 . . 156 101 17 ASN H H 9.7200 . . 157 101 17 ASN HA H 4.4680 . . 158 101 17 ASN HB2 H 2.9640 . . 159 101 17 ASN HB3 H 2.8040 . . 160 101 17 ASN C C 174.4500 . . 161 101 17 ASN CA C 54.1180 . . 162 101 17 ASN CB C 37.1220 . . 163 101 17 ASN N N 122.1630 . . 164 102 18 LYS H H 7.3267 . . 165 102 18 LYS HA H 4.0640 . . 166 102 18 LYS HB2 H 1.9300 . . 167 102 18 LYS HB3 H 1.7010 . . 168 102 18 LYS HG2 H 1.5250 . . 169 102 18 LYS HE2 H 3.0450 . . 170 102 18 LYS C C 177.8700 . . 171 102 18 LYS CA C 56.4660 . . 172 102 18 LYS CB C 33.0640 . . 173 102 18 LYS CG C 24.9710 . . 174 102 18 LYS CE C 41.7920 . . 175 102 18 LYS N N 120.5700 . . 176 103 19 GLU H H 9.0540 . . 177 103 19 GLU HA H 4.0770 . . 178 103 19 GLU HB2 H 1.9610 . . 179 103 19 GLU HG2 H 2.2670 . . 180 103 19 GLU HG3 H 2.1810 . . 181 103 19 GLU C C 175.8800 . . 182 103 19 GLU CA C 57.5680 . . 183 103 19 GLU CB C 29.2710 . . 184 103 19 GLU CG C 35.7850 . . 185 103 19 GLU N N 128.7730 . . 186 104 20 HIS H H 8.8310 . . 187 104 20 HIS HA H 4.6500 . . 188 104 20 HIS HB2 H 3.0810 . . 189 104 20 HIS HB3 H 2.4720 . . 190 104 20 HIS C C 178.4840 . . 191 104 20 HIS CA C 54.0500 . . 192 104 20 HIS CB C 28.0270 . . 193 104 20 HIS N N 119.9680 . . 194 105 21 ASP H H 7.8200 . . 195 105 21 ASP HA H 4.9510 . . 196 105 21 ASP HB2 H 1.9530 . . 197 105 21 ASP HB3 H 2.4730 . . 198 105 21 ASP C C 175.9130 . . 199 105 21 ASP CA C 52.2980 . . 200 105 21 ASP CB C 39.8290 . . 201 105 21 ASP N N 119.8300 . . 202 106 22 ILE H H 7.3370 . . 203 106 22 ILE HA H 4.1370 . . 204 106 22 ILE HB H 1.6700 . . 205 106 22 ILE HG12 H 1.2850 . . 206 106 22 ILE HG13 H 0.9960 . . 207 106 22 ILE HG2 H 0.7810 . . 208 106 22 ILE HD1 H 0.6850 . . 209 106 22 ILE C C 176.2120 . . 210 106 22 ILE CA C 60.4230 . . 211 106 22 ILE CB C 38.5100 . . 212 106 22 ILE CG1 C 26.9300 . . 213 106 22 ILE CG2 C 16.9710 . . 214 106 22 ILE CD1 C 12.2600 . . 215 106 22 ILE N N 120.0640 . . 216 107 23 GLY H H 8.3690 . . 217 107 23 GLY HA2 H 4.5290 . . 218 107 23 GLY HA3 H 3.9110 . . 219 107 23 GLY C C 171.1160 . . 220 107 23 GLY CA C 43.6340 . . 221 107 23 GLY N N 114.3500 . . 222 108 24 PRO HA H 4.5950 . . 223 108 24 PRO HB2 H 2.2710 . . 224 108 24 PRO HB3 H 2.0800 . . 225 108 24 PRO HD2 H 3.5500 . . 226 108 24 PRO CA C 63.1680 . . 227 108 24 PRO CB C 32.3650 . . 228 108 24 PRO CD C 49.5120 . . 229 109 25 ARG H H 8.0980 . . 230 109 25 ARG HA H 4.7740 . . 231 109 25 ARG HB2 H 1.9150 . . 232 109 25 ARG C C 174.7920 . . 233 109 25 ARG CA C 53.7820 . . 234 109 25 ARG CB C 31.8870 . . 235 109 25 ARG N N 118.7520 . . 236 110 26 GLU H H 8.4340 . . 237 110 26 GLU HA H 4.5610 . . 238 110 26 GLU HB2 H 1.9380 . . 239 110 26 GLU HG2 H 2.0800 . . 240 110 26 GLU HG3 H 1.9390 . . 241 110 26 GLU C C 174.0160 . . 242 110 26 GLU CA C 53.6340 . . 243 110 26 GLU CB C 32.7030 . . 244 110 26 GLU CG C 34.5370 . . 245 110 26 GLU N N 118.1480 . . 246 111 27 GLN H H 8.4370 . . 247 111 27 GLN HA H 5.4570 . . 248 111 27 GLN HB2 H 1.9700 . . 249 111 27 GLN HB3 H 1.5320 . . 250 111 27 GLN HG2 H 2.3850 . . 251 111 27 GLN HG3 H 2.2120 . . 252 111 27 GLN C C 176.4620 . . 253 111 27 GLN CA C 55.1180 . . 254 111 27 GLN CB C 30.4020 . . 255 111 27 GLN CG C 34.0520 . . 256 111 27 GLN N N 119.7080 . . 257 112 28 VAL H H 8.9190 . . 258 112 28 VAL HA H 4.4210 . . 259 112 28 VAL HB H 1.8180 . . 260 112 28 VAL HG1 H 1.2900 . . 261 112 28 VAL HG2 H 0.7760 . . 262 112 28 VAL C C 174.5780 . . 263 112 28 VAL CA C 61.4770 . . 264 112 28 VAL CB C 35.1270 . . 265 112 28 VAL CG1 C 21.5970 . . 266 112 28 VAL CG2 C 21.1830 . . 267 112 28 VAL N N 123.0320 . . 268 113 29 ASN H H 8.7410 . . 269 113 29 ASN HA H 5.1640 . . 270 113 29 ASN HB2 H 3.1550 . . 271 113 29 ASN HB3 H 2.3540 . . 272 113 29 ASN C C 174.2670 . . 273 113 29 ASN CA C 54.3700 . . 274 113 29 ASN CB C 40.6820 . . 275 113 29 ASN N N 125.8970 . . 276 114 30 PHE H H 8.1080 . . 277 114 30 PHE HA H 5.4150 . . 278 114 30 PHE HB2 H 2.8330 . . 279 114 30 PHE HB3 H 2.4730 . . 280 114 30 PHE HD1 H 6.9000 . . 281 114 30 PHE HE1 H 7.4240 . . 282 114 30 PHE CA C 56.0830 . . 283 114 30 PHE CB C 42.4260 . . 284 114 30 PHE CD1 C 131.4300 . . 285 114 30 PHE CE1 C 130.6120 . . 286 114 30 PHE N N 114.2600 . . 287 115 31 GLN H H 8.4850 . . 288 115 31 GLN HA H 4.7959 . . 289 115 31 GLN HB2 H 1.9510 . . 290 115 31 GLN HB3 H 1.6870 . . 291 115 31 GLN HG2 H 2.8570 . . 292 115 31 GLN HG3 H 2.2390 . . 293 115 31 GLN C C 174.8870 . . 294 115 31 GLN CA C 53.4850 . . 295 115 31 GLN CB C 33.5200 . . 296 115 31 GLN CG C 34.1600 . . 297 115 31 GLN N N 116.8520 . . 298 116 32 LEU H H 8.9190 . . 299 116 32 LEU HA H 5.2650 . . 300 116 32 LEU HB2 H 1.8520 . . 301 116 32 LEU HB3 H 0.9660 . . 302 116 32 LEU HG H 1.7180 . . 303 116 32 LEU HD1 H 1.0550 . . 304 116 32 LEU HD2 H 0.6830 . . 305 116 32 LEU C C 175.4360 . . 306 116 32 LEU CA C 53.1890 . . 307 116 32 LEU CB C 44.3560 . . 308 116 32 LEU CG C 25.9320 . . 309 116 32 LEU CD1 C 28.1410 . . 310 116 32 LEU CD2 C 24.4140 . . 311 116 32 LEU N N 123.1300 . . 312 117 33 LEU H H 9.1640 . . 313 117 33 LEU HA H 5.1150 . . 314 117 33 LEU HB2 H 1.6750 . . 315 117 33 LEU HB3 H 1.3880 . . 316 117 33 LEU HG H 1.3140 . . 317 117 33 LEU HD1 H 0.7130 . . 318 117 33 LEU HD2 H 0.5050 . . 319 117 33 LEU CA C 52.4460 . . 320 117 33 LEU CB C 46.3600 . . 321 117 33 LEU CG C 26.6220 . . 322 117 33 LEU CD1 C 25.1490 . . 323 117 33 LEU CD2 C 22.3790 . . 324 117 33 LEU N N 123.4830 . . 325 118 34 ASP H H 9.3320 . . 326 118 34 ASP HA H 4.8440 . . 327 118 34 ASP HB2 H 3.5900 . . 328 118 34 ASP HB3 H 2.3820 . . 329 118 34 ASP C C 178.5140 . . 330 118 34 ASP CA C 51.1850 . . 331 118 34 ASP CB C 41.4620 . . 332 118 34 ASP N N 121.1850 . . 333 119 35 LYS H H 8.7210 . . 334 119 35 LYS HA H 3.8150 . . 335 119 35 LYS HB2 H 1.6050 . . 336 119 35 LYS HB3 H 1.5160 . . 337 119 35 LYS HG2 H 1.2380 . . 338 119 35 LYS HG3 H 1.0260 . . 339 119 35 LYS HD2 H 1.4360 . . 340 119 35 LYS HE2 H 2.8080 . . 341 119 35 LYS HE3 H 2.6930 . . 342 119 35 LYS C C 176.4140 . . 343 119 35 LYS CA C 58.0870 . . 344 119 35 LYS CB C 31.4420 . . 345 119 35 LYS CG C 23.3600 . . 346 119 35 LYS CD C 28.4210 . . 347 119 35 LYS CE C 43.1070 . . 348 119 35 LYS N N 116.4500 . . 349 120 36 ASN H H 8.3290 . . 350 120 36 ASN HA H 4.8310 . . 351 120 36 ASN HB2 H 2.9740 . . 352 120 36 ASN HB3 H 2.7880 . . 353 120 36 ASN C C 174.7200 . . 354 120 36 ASN CA C 52.1490 . . 355 120 36 ASN CB C 38.5670 . . 356 120 36 ASN N N 118.0000 . . 357 121 37 ASN H H 8.2900 . . 358 121 37 ASN HA H 4.3050 . . 359 121 37 ASN HB2 H 3.0310 . . 360 121 37 ASN HB3 H 2.8480 . . 361 121 37 ASN CA C 55.2670 . . 362 121 37 ASN CB C 36.6370 . . 363 121 37 ASN N N 113.5230 . . 364 122 38 GLU H H 8.1890 . . 365 122 38 GLU HA H 4.4940 . . 366 122 38 GLU HB2 H 2.0070 . . 367 122 38 GLU HG2 H 2.2860 . . 368 122 38 GLU HG3 H 2.1450 . . 369 122 38 GLU CA C 53.9310 . . 370 122 38 GLU CB C 30.6990 . . 371 122 38 GLU CG C 36.4870 . . 372 122 38 GLU N N 118.8920 . . 373 123 39 THR H H 8.3840 . . 374 123 39 THR HA H 3.8130 . . 375 123 39 THR HB H 3.0330 . . 376 123 39 THR HG2 H 0.2210 . . 377 123 39 THR C C 173.2650 . . 378 123 39 THR CA C 64.6190 . . 379 123 39 THR CB C 68.6270 . . 380 123 39 THR CG2 C 20.9580 . . 381 123 39 THR N N 118.5260 . . 382 124 40 GLN H H 8.0640 . . 383 124 40 GLN HG2 H 2.2750 . . 384 124 40 GLN C C 171.3610 . . 385 124 40 GLN CA C 61.0840 . . 386 124 40 GLN CB C 32.1600 . . 387 124 40 GLN N N 127.9970 . . 388 125 41 TYR HA H 4.3660 . . 389 125 41 TYR HB2 H 2.6620 . . 390 125 41 TYR CA C 57.0700 . . 391 125 41 TYR CB C 40.1060 . . 392 126 42 TYR H H 7.9590 . . 393 126 42 TYR HA H 4.2840 . . 394 126 42 TYR HB2 H 2.7960 . . 395 126 42 TYR HD1 H 6.8310 . . 396 126 42 TYR HE1 H 6.5620 . . 397 126 42 TYR CA C 59.6460 . . 398 126 42 TYR CB C 39.9030 . . 399 126 42 TYR CD1 C 131.8880 . . 400 126 42 TYR CE1 C 118.0750 . . 401 126 42 TYR N N 116.7650 . . 402 130 46 SER HA H 4.6120 . . 403 130 46 SER HB2 H 3.7780 . . 404 130 46 SER C C 173.4800 . . 405 130 46 SER CA C 58.1120 . . 406 130 46 SER CB C 65.0490 . . 407 131 47 ILE H H 7.8590 . . 408 131 47 ILE HA H 4.7610 . . 409 131 47 ILE HB H 1.7760 . . 410 131 47 ILE HG12 H 1.8760 . . 411 131 47 ILE HG2 H 0.8700 . . 412 131 47 ILE C C 175.2930 . . 413 131 47 ILE CA C 60.3310 . . 414 131 47 ILE CB C 38.1230 . . 415 131 47 ILE CG1 C 28.1110 . . 416 131 47 ILE CG2 C 18.2360 . . 417 131 47 ILE N N 121.3300 . . 418 132 48 LYS H H 8.1660 . . 419 132 48 LYS HA H 3.8820 . . 420 132 48 LYS HB2 H 2.2750 . . 421 132 48 LYS HB3 H 1.8520 . . 422 132 48 LYS HG2 H 1.4580 . . 423 132 48 LYS HG3 H 1.2510 . . 424 132 48 LYS HD2 H 1.7020 . . 425 132 48 LYS HE2 H 3.0430 . . 426 132 48 LYS C C 174.0760 . . 427 132 48 LYS CA C 58.0070 . . 428 132 48 LYS CB C 33.0740 . . 429 132 48 LYS CG C 23.5790 . . 430 132 48 LYS CD C 28.6700 . . 431 132 48 LYS CE C 41.8620 . . 432 132 48 LYS N N 108.8100 . . 433 133 49 ASP H H 8.0180 . . 434 133 49 ASP HA H 4.7930 . . 435 133 49 ASP HB2 H 2.2960 . . 436 133 49 ASP HB3 H 1.8320 . . 437 133 49 ASP C C 175.6710 . . 438 133 49 ASP CA C 49.6260 . . 439 133 49 ASP CB C 43.4650 . . 440 133 49 ASP N N 126.0720 . . 441 134 50 PRO HA H 5.4580 . . 442 134 50 PRO HB2 H 2.0340 . . 443 134 50 PRO HB3 H 1.9000 . . 444 134 50 PRO C C 176.0330 . . 445 134 50 PRO CA C 62.6150 . . 446 134 50 PRO CB C 33.9650 . . 447 134 50 PRO CD C 49.6670 . . 448 135 51 ALA H H 8.4060 . . 449 135 51 ALA HA H 5.0010 . . 450 135 51 ALA HB H 1.6570 . . 451 135 51 ALA C C 176.1520 . . 452 135 51 ALA CA C 50.8700 . . 453 135 51 ALA CB C 19.7480 . . 454 135 51 ALA N N 118.8940 . . 455 136 52 ASP H H 8.0000 . . 456 136 52 ASP HA H 5.0300 . . 457 136 52 ASP HB2 H 2.0900 . . 458 136 52 ASP HB3 H 2.6100 . . 459 136 52 ASP C C 173.5990 . . 460 136 52 ASP CA C 54.0630 . . 461 136 52 ASP CB C 43.9590 . . 462 136 52 ASP N N 120.5000 . . 463 137 53 VAL H H 8.8320 . . 464 137 53 VAL HA H 4.3430 . . 465 137 53 VAL HB H 1.6850 . . 466 137 53 VAL HG1 H 0.4770 . . 467 137 53 VAL HG2 H 0.5940 . . 468 137 53 VAL C C 174.0170 . . 469 137 53 VAL CA C 60.8780 . . 470 137 53 VAL CB C 32.3670 . . 471 137 53 VAL CG1 C 21.2030 . . 472 137 53 VAL CG2 C 20.7050 . . 473 137 53 VAL N N 122.9120 . . 474 138 54 TYR H H 9.2900 . . 475 138 54 TYR HA H 4.2250 . . 476 138 54 TYR HB2 H 2.8750 . . 477 138 54 TYR HB3 H 2.6280 . . 478 138 54 TYR HD1 H 6.7820 . . 479 138 54 TYR HE1 H 6.2940 . . 480 138 54 TYR C C 174.0290 . . 481 138 54 TYR CA C 57.4910 . . 482 138 54 TYR CB C 39.6650 . . 483 138 54 TYR CD1 C 132.1530 . . 484 138 54 TYR CE1 C 117.4830 . . 485 138 54 TYR N N 125.1000 . . 486 139 55 TYR H H 7.3050 . . 487 139 55 TYR HA H 5.2980 . . 488 139 55 TYR HB2 H 3.3230 . . 489 139 55 TYR HB3 H 2.5390 . . 490 139 55 TYR HD1 H 7.0680 . . 491 139 55 TYR HE1 H 6.7100 . . 492 139 55 TYR C C 177.6040 . . 493 139 55 TYR CA C 55.1930 . . 494 139 55 TYR CB C 38.1960 . . 495 139 55 TYR CD1 C 131.2280 . . 496 139 55 TYR CE1 C 117.9250 . . 497 139 55 TYR N N 121.0070 . . 498 140 56 THR H H 8.3580 . . 499 140 56 THR HA H 4.9240 . . 500 140 56 THR HB H 4.4750 . . 501 140 56 THR HG2 H 1.1690 . . 502 140 56 THR C C 174.6970 . . 503 140 56 THR CA C 60.0910 . . 504 140 56 THR CB C 71.5210 . . 505 140 56 THR CG2 C 19.3040 . . 506 140 56 THR N N 112.5880 . . 507 141 57 LYS H H 8.3750 . . 508 141 57 LYS HA H 4.2870 . . 509 141 57 LYS HB2 H 1.9830 . . 510 141 57 LYS HB3 H 1.7720 . . 511 141 57 LYS HE2 H 2.9820 . . 512 141 57 LYS HE3 H 2.9450 . . 513 141 57 LYS C C 177.3690 . . 514 141 57 LYS CA C 56.7390 . . 515 141 57 LYS CB C 31.5620 . . 516 141 57 LYS CE C 41.6130 . . 517 141 57 LYS N N 116.5580 . . 518 142 58 LYS H H 8.3600 . . 519 142 58 LYS HA H 4.3940 . . 520 142 58 LYS HB2 H 1.8060 . . 521 142 58 LYS C C 174.0760 . . 522 142 58 LYS CA C 56.8190 . . 523 142 58 LYS CB C 32.7530 . . 524 142 58 LYS CG C 25.0290 . . 525 142 58 LYS CD C 28.9300 . . 526 142 58 LYS CE C 42.1760 . . 527 142 58 LYS N N 120.1200 . . 528 143 59 LYS H H 7.1070 . . 529 143 59 LYS HA H 4.6750 . . 530 143 59 LYS HB2 H 2.1190 . . 531 143 59 LYS HB3 H 1.4920 . . 532 143 59 LYS HG2 H 1.3950 . . 533 143 59 LYS HG3 H 1.3460 . . 534 143 59 LYS HD2 H 1.5150 . . 535 143 59 LYS HD3 H 1.4270 . . 536 143 59 LYS HE2 H 2.9450 . . 537 143 59 LYS HE3 H 2.9020 . . 538 143 59 LYS C C 176.9390 . . 539 143 59 LYS CA C 54.9330 . . 540 143 59 LYS CB C 35.5240 . . 541 143 59 LYS CG C 25.6250 . . 542 143 59 LYS CD C 29.6610 . . 543 143 59 LYS CE C 41.7930 . . 544 143 59 LYS N N 118.0500 . . 545 144 60 ALA H H 9.0480 . . 546 144 60 ALA HA H 4.4900 . . 547 144 60 ALA HB H 1.0670 . . 548 144 60 ALA C C 176.9300 . . 549 144 60 ALA CA C 52.3870 . . 550 144 60 ALA CB C 17.8210 . . 551 144 60 ALA N N 128.2610 . . 552 145 61 GLU H H 8.9380 . . 553 145 61 GLU HA H 4.9520 . . 554 145 61 GLU HB2 H 1.7200 . . 555 145 61 GLU HB3 H 1.5120 . . 556 145 61 GLU HG2 H 2.2140 . . 557 145 61 GLU HG3 H 1.7580 . . 558 145 61 GLU C C 175.2430 . . 559 145 61 GLU CA C 53.7080 . . 560 145 61 GLU CB C 32.0350 . . 561 145 61 GLU CG C 36.8120 . . 562 145 61 GLU N N 117.5420 . . 563 146 62 VAL H H 8.0870 . . 564 146 62 VAL HA H 4.0220 . . 565 146 62 VAL HB H 0.9690 . . 566 146 62 VAL HG1 H 0.7240 . . 567 146 62 VAL HG2 H 0.5930 . . 568 146 62 VAL C C 175.2460 . . 569 146 62 VAL CA C 61.5760 . . 570 146 62 VAL CB C 32.1100 . . 571 146 62 VAL CG1 C 22.1980 . . 572 146 62 VAL CG2 C 21.5660 . . 573 146 62 VAL N N 124.8420 . . 574 147 63 GLU H H 9.1810 . . 575 147 63 GLU HA H 5.7730 . . 576 147 63 GLU HB2 H 1.7780 . . 577 147 63 GLU HG2 H 2.1720 . . 578 147 63 GLU HG3 H 2.0980 . . 579 147 63 GLU CA C 53.1890 . . 580 147 63 GLU CB C 34.2620 . . 581 147 63 GLU CG C 38.6650 . . 582 147 63 GLU N N 125.7200 . . 583 148 64 LEU H H 8.5850 . . 584 148 64 LEU HA H 5.3140 . . 585 148 64 LEU HB2 H 1.4660 . . 586 148 64 LEU HB3 H 1.0300 . . 587 148 64 LEU HG H 1.5790 . . 588 148 64 LEU HD1 H 0.7630 . . 589 148 64 LEU HD2 H 0.6400 . . 590 148 64 LEU C C 174.2190 . . 591 148 64 LEU CA C 52.0010 . . 592 148 64 LEU CB C 43.4650 . . 593 148 64 LEU CG C 26.1370 . . 594 148 64 LEU CD1 C 24.7300 . . 595 148 64 LEU CD2 C 21.8350 . . 596 148 64 LEU N N 125.1800 . . 597 149 65 ASP H H 9.1620 . . 598 149 65 ASP HA H 4.5260 . . 599 149 65 ASP HB2 H 3.1360 . . 600 149 65 ASP HB3 H 2.8100 . . 601 149 65 ASP C C 175.6010 . . 602 149 65 ASP CA C 52.0010 . . 603 149 65 ASP CB C 41.4620 . . 604 149 65 ASP N N 123.3400 . . 605 150 66 ILE H H 8.6390 . . 606 150 66 ILE HA H 4.0050 . . 607 150 66 ILE HB H 1.1960 . . 608 150 66 ILE HG12 H 0.2270 . . 609 150 66 ILE HG2 H 0.0250 . . 610 150 66 ILE HD1 H -0.4830 . . 611 150 66 ILE CA C 59.9430 . . 612 150 66 ILE CB C 39.3830 . . 613 150 66 ILE CG1 C 26.6840 . . 614 150 66 ILE CG2 C 16.1570 . . 615 150 66 ILE CD1 C 12.6800 . . 616 150 66 ILE N N 125.4280 . . 617 151 67 ASN HA H 4.2510 . . 618 151 67 ASN HB2 H 2.8340 . . 619 151 67 ASN HB3 H 2.2610 . . 620 151 67 ASN C C 174.9830 . . 621 151 67 ASN CA C 51.2300 . . 622 151 67 ASN CB C 37.9260 . . 623 152 68 THR H H 8.7450 . . 624 152 68 THR HA H 4.0770 . . 625 152 68 THR HB H 4.3480 . . 626 152 68 THR HG2 H 1.2020 . . 627 152 68 THR C C 176.9870 . . 628 152 68 THR CA C 61.1900 . . 629 152 68 THR CB C 68.1790 . . 630 152 68 THR CG2 C 22.4190 . . 631 152 68 THR N N 114.4130 . . 632 153 69 ALA H H 8.0620 . . 633 153 69 ALA HA H 3.9380 . . 634 153 69 ALA HB H 1.3330 . . 635 153 69 ALA C C 175.3740 . . 636 153 69 ALA CA C 55.8460 . . 637 153 69 ALA CB C 19.9040 . . 638 153 69 ALA N N 122.1680 . . 639 154 70 SER H H 8.8790 . . 640 154 70 SER HA H 3.9720 . . 641 154 70 SER HB2 H 3.8020 . . 642 154 70 SER C C 175.0540 . . 643 154 70 SER CA C 60.5090 . . 644 154 70 SER CB C 65.0980 . . 645 154 70 SER N N 108.9220 . . 646 155 71 THR H H 8.2770 . . 647 155 71 THR HA H 4.6910 . . 648 155 71 THR HB H 4.1480 . . 649 155 71 THR HG2 H 1.1120 . . 650 155 71 THR C C 174.1960 . . 651 155 71 THR CA C 60.6970 . . 652 155 71 THR CB C 69.6020 . . 653 155 71 THR CG2 C 21.9460 . . 654 155 71 THR N N 111.1260 . . 655 156 72 TRP H H 7.9120 . . 656 156 72 TRP HA H 4.6220 . . 657 156 72 TRP HB2 H 3.2780 . . 658 156 72 TRP HB3 H 3.0400 . . 659 156 72 TRP HD1 H 7.3440 . . 660 156 72 TRP HE1 H 9.2970 . . 661 156 72 TRP HE3 H 6.7070 . . 662 156 72 TRP HZ2 H 6.9790 . . 663 156 72 TRP HZ3 H 6.2160 . . 664 156 72 TRP HH2 H 6.4840 . . 665 156 72 TRP C C 174.3630 . . 666 156 72 TRP CA C 57.8620 . . 667 156 72 TRP CB C 30.7310 . . 668 156 72 TRP CD1 C 128.2700 . . 669 156 72 TRP CE3 C 131.0430 . . 670 156 72 TRP CZ2 C 113.1300 . . 671 156 72 TRP CZ3 C 129.8500 . . 672 156 72 TRP CH2 C 127.2040 . . 673 156 72 TRP N N 123.6640 . . 674 156 72 TRP NE1 N 127.4500 . . 675 157 73 LYS H H 9.0040 . . 676 157 73 LYS HA H 4.7530 . . 677 157 73 LYS HB2 H 2.0670 . . 678 157 73 LYS HB3 H 1.3060 . . 679 157 73 LYS HE2 H 2.8630 . . 680 157 73 LYS C C 174.4340 . . 681 157 73 LYS CA C 55.8610 . . 682 157 73 LYS CB C 32.7780 . . 683 157 73 LYS CE C 42.0130 . . 684 157 73 LYS N N 124.6980 . . 685 158 74 LYS H H 8.2200 . . 686 158 74 LYS HA H 4.2940 . . 687 158 74 LYS HB2 H 1.7930 . . 688 158 74 LYS C C 176.3910 . . 689 158 74 LYS CA C 56.0830 . . 690 158 74 LYS CB C 32.8520 . . 691 158 74 LYS CE C 42.0130 . . 692 158 74 LYS N N 122.6420 . . 693 159 75 PHE H H 9.0030 . . 694 159 75 PHE HA H 4.0920 . . 695 159 75 PHE HB2 H 1.6800 . . 696 159 75 PHE HB3 H 1.5330 . . 697 159 75 PHE CA C 60.2580 . . 698 159 75 PHE CB C 39.6800 . . 699 159 75 PHE N N 127.8090 . . 700 160 76 GLU H H 8.6610 . . 701 160 76 GLU HA H 4.5590 . . 702 160 76 GLU HB2 H 1.7240 . . 703 160 76 GLU C C 174.9590 . . 704 160 76 GLU CA C 53.4850 . . 705 160 76 GLU CB C 33.8910 . . 706 160 76 GLU N N 125.4040 . . 707 161 77 VAL H H 8.6610 . . 708 161 77 VAL HA H 4.4960 . . 709 161 77 VAL HB H 0.9180 . . 710 161 77 VAL HG1 H 0.2230 . . 711 161 77 VAL HG2 H 0.0490 . . 712 161 77 VAL C C 173.2550 . . 713 161 77 VAL CA C 60.5370 . . 714 161 77 VAL CB C 33.5200 . . 715 161 77 VAL CG1 C 20.2700 . . 716 161 77 VAL CG2 C 22.1550 . . 717 161 77 VAL N N 121.4840 . . 718 162 78 TYR H H 9.4430 . . 719 162 78 TYR HA H 5.0490 . . 720 162 78 TYR HB2 H 2.8240 . . 721 162 78 TYR HB3 H 2.3460 . . 722 162 78 TYR HD1 H 6.6390 . . 723 162 78 TYR HE1 H 6.1270 . . 724 162 78 TYR C C 175.1480 . . 725 162 78 TYR CA C 56.0090 . . 726 162 78 TYR CB C 41.6100 . . 727 162 78 TYR CD1 C 131.9480 . . 728 162 78 TYR CE1 C 117.5300 . . 729 162 78 TYR N N 123.1920 . . 730 163 79 GLU H H 8.6420 . . 731 163 79 GLU HB2 H 2.1330 . . 732 163 79 GLU HB3 H 1.9370 . . 733 163 79 GLU CA C 54.0040 . . 734 163 79 GLU CB C 33.8060 . . 735 163 79 GLU N N 122.6750 . . 736 164 80 ASN H H 9.6560 . . 737 164 80 ASN HA H 4.3010 . . 738 164 80 ASN HB2 H 3.0410 . . 739 164 80 ASN CA C 54.6730 . . 740 164 80 ASN CB C 36.7860 . . 741 164 80 ASN N N 128.8240 . . 742 165 81 ASN H H 9.1390 . . 743 165 81 ASN HA H 4.2810 . . 744 165 81 ASN HB2 H 2.9460 . . 745 165 81 ASN CA C 54.5600 . . 746 165 81 ASN CB C 36.9850 . . 747 165 81 ASN N N 110.7950 . . 748 166 82 GLN H H 8.1520 . . 749 166 82 GLN HA H 4.6340 . . 750 166 82 GLN HB2 H 2.1560 . . 751 166 82 GLN HG2 H 2.3480 . . 752 166 82 GLN C C 174.6490 . . 753 166 82 GLN CA C 53.6340 . . 754 166 82 GLN CB C 29.4380 . . 755 166 82 GLN CG C 33.0550 . . 756 166 82 GLN N N 120.3440 . . 757 167 83 LYS H H 8.7090 . . 758 167 83 LYS HA H 3.2390 . . 759 167 83 LYS HB2 H 1.5520 . . 760 167 83 LYS HB3 H 1.3850 . . 761 167 83 LYS HG2 H 1.0530 . . 762 167 83 LYS HG3 H 0.6520 . . 763 167 83 LYS HD2 H 1.5500 . . 764 167 83 LYS HD3 H 1.4720 . . 765 167 83 LYS HE2 H 2.8550 . . 766 167 83 LYS HE3 H 2.8040 . . 767 167 83 LYS C C 176.8920 . . 768 167 83 LYS CA C 57.3450 . . 769 167 83 LYS CB C 32.6290 . . 770 167 83 LYS CG C 25.0630 . . 771 167 83 LYS CD C 29.2280 . . 772 167 83 LYS CE C 41.4230 . . 773 167 83 LYS N N 127.4230 . . 774 168 84 LEU H H 8.9920 . . 775 168 84 LEU HA H 4.6140 . . 776 168 84 LEU HB2 H 1.4670 . . 777 168 84 LEU HB3 H 1.0680 . . 778 168 84 LEU HG H 1.5950 . . 779 168 84 LEU HD1 H 0.8770 . . 780 168 84 LEU HD2 H 0.9370 . . 781 168 84 LEU C C 175.5980 . . 782 168 84 LEU CA C 52.0010 . . 783 168 84 LEU CB C 42.0550 . . 784 168 84 LEU CG C 25.9530 . . 785 168 84 LEU CD1 C 25.1780 . . 786 168 84 LEU CD2 C 21.7000 . . 787 168 84 LEU N N 129.4770 . . 788 169 85 PRO HA H 4.6290 . . 789 169 85 PRO HB2 H 2.1570 . . 790 169 85 PRO C C 175.1500 . . 791 169 85 PRO CA C 61.7590 . . 792 169 85 PRO CB C 29.4180 . . 793 169 85 PRO CD C 49.9770 . . 794 170 86 VAL H H 7.9590 . . 795 170 86 VAL HA H 4.5200 . . 796 170 86 VAL HB H 2.0360 . . 797 170 86 VAL HG1 H 0.9350 . . 798 170 86 VAL HG2 H 0.9290 . . 799 170 86 VAL C C 176.0570 . . 800 170 86 VAL CA C 61.8410 . . 801 170 86 VAL CB C 32.9930 . . 802 170 86 VAL CG1 C 21.9490 . . 803 170 86 VAL CG2 C 21.7000 . . 804 170 86 VAL N N 126.9770 . . 805 171 87 ARG H H 9.1220 . . 806 171 87 ARG HA H 4.9100 . . 807 171 87 ARG HB2 H 1.7050 . . 808 171 87 ARG HB3 H 1.5800 . . 809 171 87 ARG HG2 H 1.5750 . . 810 171 87 ARG HG3 H 1.2850 . . 811 171 87 ARG HD2 H 3.0910 . . 812 171 87 ARG HD3 H 3.0300 . . 813 171 87 ARG C C 174.3150 . . 814 171 87 ARG CA C 53.2450 . . 815 171 87 ARG CB C 32.9120 . . 816 171 87 ARG CG C 26.6910 . . 817 171 87 ARG CD C 42.8050 . . 818 171 87 ARG N N 126.9770 . . 819 172 88 LEU H H 8.8050 . . 820 172 88 LEU HA H 4.6190 . . 821 172 88 LEU HB2 H 1.7190 . . 822 172 88 LEU HB3 H 1.2870 . . 823 172 88 LEU HG H 1.3980 . . 824 172 88 LEU HD1 H 1.3990 . . 825 172 88 LEU HD2 H 0.7080 . . 826 172 88 LEU C C 176.6270 . . 827 172 88 LEU CA C 54.5160 . . 828 172 88 LEU CB C 42.2050 . . 829 172 88 LEU CG C 27.9880 . . 830 172 88 LEU CD1 C 27.7450 . . 831 172 88 LEU CD2 C 27.2440 . . 832 172 88 LEU N N 125.9530 . . 833 173 89 VAL H H 8.8020 . . 834 173 89 VAL HA H 4.4660 . . 835 173 89 VAL HB H 2.1390 . . 836 173 89 VAL HG1 H 0.7240 . . 837 173 89 VAL HG2 H 0.5700 . . 838 173 89 VAL C C 175.8420 . . 839 173 89 VAL CA C 60.8690 . . 840 173 89 VAL CB C 32.1180 . . 841 173 89 VAL CG1 C 21.2030 . . 842 173 89 VAL CG2 C 18.9620 . . 843 173 89 VAL N N 117.0180 . . 844 174 90 SER H H 7.3050 . . 845 174 90 SER HA H 4.6890 . . 846 174 90 SER HB2 H 3.7560 . . 847 174 90 SER HB3 H 2.6690 . . 848 174 90 SER C C 171.6460 . . 849 174 90 SER CA C 57.8650 . . 850 174 90 SER CB C 61.4270 . . 851 174 90 SER N N 110.7510 . . 852 175 91 TYR H H 8.2930 . . 853 175 91 TYR HA H 5.5180 . . 854 175 91 TYR HB2 H 2.9070 . . 855 175 91 TYR HB3 H 2.7510 . . 856 175 91 TYR HD1 H 6.9700 . . 857 175 91 TYR HE1 H 6.6790 . . 858 175 91 TYR C C 173.8420 . . 859 175 91 TYR CA C 55.9450 . . 860 175 91 TYR CB C 41.4110 . . 861 175 91 TYR CD1 C 132.7590 . . 862 175 91 TYR CE1 C 117.3000 . . 863 175 91 TYR N N 125.1150 . . 864 176 92 SER H H 9.0850 . . 865 176 92 SER HA H 5.0610 . . 866 176 92 SER HB2 H 3.9410 . . 867 176 92 SER HB3 H 3.7530 . . 868 176 92 SER CA C 53.3000 . . 869 176 92 SER CB C 63.9520 . . 870 176 92 SER N N 126.3250 . . 871 177 93 PRO HA H 4.2700 . . 872 177 93 PRO HB2 H 2.4190 . . 873 177 93 PRO HB3 H 2.0710 . . 874 177 93 PRO HG2 H 1.9070 . . 875 177 93 PRO HD2 H 3.7140 . . 876 177 93 PRO HD3 H 3.7680 . . 877 177 93 PRO C C 178.3230 . . 878 177 93 PRO CA C 62.0030 . . 879 177 93 PRO CB C 33.2370 . . 880 177 93 PRO CG C 27.2230 . . 881 177 93 PRO CD C 51.9580 . . 882 178 94 VAL H H 8.3740 . . 883 178 94 VAL HA H 3.6190 . . 884 178 94 VAL HB H 2.0820 . . 885 178 94 VAL HG1 H 1.0570 . . 886 178 94 VAL HG2 H 0.9980 . . 887 178 94 VAL CA C 62.6210 . . 888 178 94 VAL CB C 32.6350 . . 889 178 94 VAL CG1 C 20.2960 . . 890 178 94 VAL CG2 C 19.7090 . . 891 178 94 VAL N N 122.5710 . . 892 179 95 PRO HA H 4.5960 . . 893 179 95 PRO HB2 H 2.3060 . . 894 179 95 PRO HB3 H 2.2210 . . 895 179 95 PRO HG2 H 1.9410 . . 896 179 95 PRO HG3 H 1.7410 . . 897 179 95 PRO HD2 H 3.5000 . . 898 179 95 PRO HD3 H 3.5750 . . 899 179 95 PRO CA C 63.7520 . . 900 179 95 PRO CB C 33.8390 . . 901 179 95 PRO CG C 24.1670 . . 902 179 95 PRO CD C 50.2210 . . 903 180 96 GLU H H 8.5510 . . 904 180 96 GLU HA H 4.2880 . . 905 180 96 GLU HB2 H 1.8900 . . 906 180 96 GLU HG2 H 2.2220 . . 907 180 96 GLU HG3 H 2.1400 . . 908 180 96 GLU C C 176.2240 . . 909 180 96 GLU CA C 59.1220 . . 910 180 96 GLU CB C 28.7030 . . 911 180 96 GLU CG C 36.1620 . . 912 180 96 GLU N N 126.9390 . . 913 181 97 ASP H H 7.3020 . . 914 181 97 ASP HA H 4.4270 . . 915 181 97 ASP HB2 H 3.4910 . . 916 181 97 ASP HB3 H 2.0270 . . 917 181 97 ASP C C 175.7700 . . 918 181 97 ASP CA C 54.7540 . . 919 181 97 ASP CB C 39.9010 . . 920 181 97 ASP N N 119.2230 . . 921 182 98 HIS H H 7.5580 . . 922 182 98 HIS HA H 5.6110 . . 923 182 98 HIS HB2 H 2.8250 . . 924 182 98 HIS HB3 H 2.3560 . . 925 182 98 HIS C C 173.2800 . . 926 182 98 HIS CA C 53.5840 . . 927 182 98 HIS CB C 31.2400 . . 928 182 98 HIS N N 113.7640 . . 929 183 99 ALA H H 9.0670 . . 930 183 99 ALA HA H 4.8900 . . 931 183 99 ALA HB H 1.1150 . . 932 183 99 ALA C C 173.5100 . . 933 183 99 ALA CA C 49.3640 . . 934 183 99 ALA CB C 22.4190 . . 935 183 99 ALA N N 122.6890 . . 936 184 100 TYR H H 7.8960 . . 937 184 100 TYR HA H 5.4330 . . 938 184 100 TYR HB2 H 2.1440 . . 939 184 100 TYR HB3 H 2.1060 . . 940 184 100 TYR HD1 H 6.6590 . . 941 184 100 TYR HE1 H 6.1040 . . 942 184 100 TYR C C 175.6550 . . 943 184 100 TYR CA C 55.6300 . . 944 184 100 TYR CB C 38.0060 . . 945 184 100 TYR CD1 C 131.8000 . . 946 184 100 TYR CE1 C 117.3200 . . 947 184 100 TYR N N 117.7230 . . 948 185 101 ILE H H 8.5610 . . 949 185 101 ILE HA H 5.5160 . . 950 185 101 ILE HB H 1.6750 . . 951 185 101 ILE HG12 H 1.4410 . . 952 185 101 ILE HG13 H 0.7960 . . 953 185 101 ILE HG2 H 0.5690 . . 954 185 101 ILE HD1 H 0.4960 . . 955 185 101 ILE C C 174.6480 . . 956 185 101 ILE CA C 57.5100 . . 957 185 101 ILE CB C 40.7480 . . 958 185 101 ILE CG1 C 25.4050 . . 959 185 101 ILE CG2 C 17.1380 . . 960 185 101 ILE CD1 C 14.2300 . . 961 185 101 ILE N N 118.0440 . . 962 186 102 ARG H H 9.0990 . . 963 186 102 ARG HA H 6.0650 . . 964 186 102 ARG HB2 H 1.3800 . . 965 186 102 ARG HG2 H 1.5800 . . 966 186 102 ARG HG3 H 1.4680 . . 967 186 102 ARG HD2 H 2.8170 . . 968 186 102 ARG HD3 H 2.6920 . . 969 186 102 ARG C C 176.0800 . . 970 186 102 ARG CA C 53.4370 . . 971 186 102 ARG CB C 36.3610 . . 972 186 102 ARG CG C 27.9200 . . 973 186 102 ARG CD C 43.3600 . . 974 186 102 ARG N N 118.0890 . . 975 187 103 PHE H H 7.4310 . . 976 187 103 PHE HA H 5.1440 . . 977 187 103 PHE HB2 H 3.1930 . . 978 187 103 PHE HB3 H 2.7370 . . 979 187 103 PHE HD1 H 6.7940 . . 980 187 103 PHE HE1 H 6.3110 . . 981 187 103 PHE C C 171.4160 . . 982 187 103 PHE CA C 53.0450 . . 983 187 103 PHE CB C 38.1630 . . 984 187 103 PHE CD1 C 133.2090 . . 985 187 103 PHE CE1 C 117.3380 . . 986 187 103 PHE N N 114.1140 . . 987 188 104 PRO HA H 5.3540 . . 988 188 104 PRO HB2 H 2.2060 . . 989 188 104 PRO HB3 H 1.7010 . . 990 188 104 PRO HG2 H 2.2680 . . 991 188 104 PRO HG3 H 2.1430 . . 992 188 104 PRO HD2 H 3.7910 . . 993 188 104 PRO HD3 H 3.4840 . . 994 188 104 PRO C C 171.4160 . . 995 188 104 PRO CA C 61.0740 . . 996 188 104 PRO CB C 32.3430 . . 997 188 104 PRO CG C 26.2700 . . 998 188 104 PRO CD C 49.5600 . . 999 189 105 VAL H H 8.4580 . . 1000 189 105 VAL HA H 4.6350 . . 1001 189 105 VAL HB H 1.8530 . . 1002 189 105 VAL HG1 H 1.0050 . . 1003 189 105 VAL HG2 H 0.7980 . . 1004 189 105 VAL C C 174.8400 . . 1005 189 105 VAL CA C 59.4670 . . 1006 189 105 VAL CB C 35.3320 . . 1007 189 105 VAL CG1 C 22.5540 . . 1008 189 105 VAL CG2 C 20.9750 . . 1009 189 105 VAL N N 115.1290 . . 1010 190 106 SER H H 9.9470 . . 1011 190 106 SER HA H 4.3300 . . 1012 190 106 SER HB2 H 3.7850 . . 1013 190 106 SER HB3 H 3.6620 . . 1014 190 106 SER C C 173.7900 . . 1015 190 106 SER CA C 59.1260 . . 1016 190 106 SER CB C 62.6890 . . 1017 190 106 SER N N 122.3050 . . 1018 191 107 ASP H H 8.8750 . . 1019 191 107 ASP HA H 4.6190 . . 1020 191 107 ASP HB2 H 2.6390 . . 1021 191 107 ASP C C 178.5910 . . 1022 191 107 ASP CA C 54.8210 . . 1023 191 107 ASP CB C 39.3860 . . 1024 191 107 ASP N N 123.9980 . . 1025 192 108 GLY H H 8.7140 . . 1026 192 108 GLY HA2 H 4.2000 . . 1027 192 108 GLY HA3 H 2.8890 . . 1028 192 108 GLY C C 174.2500 . . 1029 192 108 GLY CA C 44.1570 . . 1030 192 108 GLY N N 112.3450 . . 1031 193 109 THR H H 7.8120 . . 1032 193 109 THR HA H 3.8940 . . 1033 193 109 THR HB H 4.1530 . . 1034 193 109 THR HG2 H 1.3390 . . 1035 193 109 THR C C 172.9740 . . 1036 193 109 THR CA C 64.9110 . . 1037 193 109 THR CB C 68.9110 . . 1038 193 109 THR CG2 C 22.2380 . . 1039 193 109 THR N N 120.6570 . . 1040 194 110 GLN H H 9.3760 . . 1041 194 110 GLN HA H 4.7620 . . 1042 194 110 GLN HB2 H 2.0730 . . 1043 194 110 GLN HB3 H 1.6590 . . 1044 194 110 GLN HG2 H 2.8610 . . 1045 194 110 GLN HG3 H 2.2570 . . 1046 194 110 GLN C C 173.3580 . . 1047 194 110 GLN CA C 55.4480 . . 1048 194 110 GLN CB C 32.0700 . . 1049 194 110 GLN CG C 34.4190 . . 1050 194 110 GLN N N 126.3440 . . 1051 195 111 GLU H H 8.0670 . . 1052 195 111 GLU HA H 5.7240 . . 1053 195 111 GLU HB2 H 1.9550 . . 1054 195 111 GLU HG2 H 2.1610 . . 1055 195 111 GLU C C 174.6840 . . 1056 195 111 GLU CA C 53.7260 . . 1057 195 111 GLU CB C 33.1240 . . 1058 195 111 GLU CG C 35.9440 . . 1059 195 111 GLU N N 118.2730 . . 1060 196 112 LEU H H 9.0780 . . 1061 196 112 LEU HA H 4.9480 . . 1062 196 112 LEU HB2 H 1.3430 . . 1063 196 112 LEU HG H 1.5550 . . 1064 196 112 LEU HD1 H 0.9560 . . 1065 196 112 LEU HD2 H 1.0540 . . 1066 196 112 LEU C C 175.2210 . . 1067 196 112 LEU CA C 52.5210 . . 1068 196 112 LEU CB C 46.2860 . . 1069 196 112 LEU CG C 26.6460 . . 1070 196 112 LEU CD1 C 27.2540 . . 1071 196 112 LEU CD2 C 24.1310 . . 1072 196 112 LEU N N 122.0190 . . 1073 197 113 LYS H H 8.4200 . . 1074 197 113 LYS HA H 4.8110 . . 1075 197 113 LYS HB2 H 1.6690 . . 1076 197 113 LYS HB3 H 1.6010 . . 1077 197 113 LYS HG2 H 1.0270 . . 1078 197 113 LYS HG3 H 0.7990 . . 1079 197 113 LYS HE2 H 2.8360 . . 1080 197 113 LYS C C 174.4800 . . 1081 197 113 LYS CA C 54.3020 . . 1082 197 113 LYS CB C 34.6330 . . 1083 197 113 LYS CG C 24.7500 . . 1084 197 113 LYS CE C 40.6800 . . 1085 197 113 LYS N N 121.9300 . . 1086 198 114 ILE H H 9.1780 . . 1087 198 114 ILE HA H 5.0730 . . 1088 198 114 ILE HB H 1.0250 . . 1089 198 114 ILE HG12 H 1.1390 . . 1090 198 114 ILE HG13 H 0.5670 . . 1091 198 114 ILE HG2 H -0.0110 . . 1092 198 114 ILE HD1 H 0.4400 . . 1093 198 114 ILE CA C 58.7550 . . 1094 198 114 ILE CB C 40.9400 . . 1095 198 114 ILE CG1 C 26.9230 . . 1096 198 114 ILE CG2 C 15.4620 . . 1097 198 114 ILE CD1 C 13.6300 . . 1098 198 114 ILE N N 125.7430 . . 1099 199 115 VAL H H 8.9350 . . 1100 199 115 VAL HA H 4.1360 . . 1101 199 115 VAL HB H 2.1500 . . 1102 199 115 VAL HG1 H 0.9910 . . 1103 199 115 VAL HG2 H 0.8310 . . 1104 199 115 VAL CA C 62.3180 . . 1105 199 115 VAL CB C 33.2230 . . 1106 199 115 VAL CG1 C 20.9370 . . 1107 199 115 VAL CG2 C 20.2560 . . 1108 199 115 VAL N N 112.0010 . . 1109 200 116 SER HA H 5.2190 . . 1110 200 116 SER HB2 H 4.5650 . . 1111 200 116 SER HB3 H 3.5650 . . 1112 200 116 SER C C 173.2650 . . 1113 200 116 SER CA C 56.3940 . . 1114 200 116 SER CB C 68.6530 . . 1115 201 117 SER H H 9.7870 . . 1116 201 117 SER HA H 5.6630 . . 1117 201 117 SER HB2 H 3.9900 . . 1118 201 117 SER C C 172.7640 . . 1119 201 117 SER CA C 57.1970 . . 1120 201 117 SER CB C 66.7710 . . 1121 201 117 SER N N 116.5000 . . 1122 202 118 THR H H 8.8520 . . 1123 202 118 THR HA H 5.0930 . . 1124 202 118 THR C C 173.7900 . . 1125 202 118 THR CA C 58.4110 . . 1126 202 118 THR CB C 71.5920 . . 1127 202 118 THR CG2 C 21.2100 . . 1128 202 118 THR N N 109.5310 . . 1129 203 119 GLN H H 8.8630 . . 1130 203 119 GLN HA H 4.2110 . . 1131 203 119 GLN HB2 H 1.6340 . . 1132 203 119 GLN CA C 56.5010 . . 1133 203 119 GLN CB C 31.4820 . . 1134 203 119 GLN N N 120.0680 . . 1135 204 120 ILE H H 8.8760 . . 1136 204 120 ILE HA H 4.0310 . . 1137 204 120 ILE HB H 1.6690 . . 1138 204 120 ILE HG12 H 1.3980 . . 1139 204 120 ILE HG13 H 1.0080 . . 1140 204 120 ILE HG2 H 0.8060 . . 1141 204 120 ILE HD1 H 0.7790 . . 1142 204 120 ILE CA C 60.5140 . . 1143 204 120 ILE CB C 37.5390 . . 1144 204 120 ILE CG1 C 26.6790 . . 1145 204 120 ILE CG2 C 17.1180 . . 1146 204 120 ILE CD1 C 12.4500 . . 1147 204 120 ILE N N 108.7990 . . 1148 205 121 ASP CA C 54.9330 . . 1149 205 121 ASP CB C 37.9500 . . 1150 206 122 ASP H H 8.1520 . . 1151 206 122 ASP HA H 4.5660 . . 1152 206 122 ASP HB2 H 2.0800 . . 1153 206 122 ASP C C 176.9010 . . 1154 206 122 ASP CA C 53.4110 . . 1155 206 122 ASP CB C 39.5320 . . 1156 206 122 ASP N N 120.4450 . . 1157 207 123 GLY H H 8.0120 . . 1158 207 123 GLY HA2 H 3.7630 . . 1159 207 123 GLY HA3 H 4.1990 . . 1160 207 123 GLY C C 175.8440 . . 1161 207 123 GLY CA C 44.1900 . . 1162 207 123 GLY N N 128.5170 . . 1163 208 124 GLU H H 8.3270 . . 1164 208 124 GLU HA H 4.0920 . . 1165 208 124 GLU HB2 H 1.3270 . . 1166 208 124 GLU C C 176.6770 . . 1167 208 124 GLU CA C 56.3800 . . 1168 208 124 GLU CB C 29.7340 . . 1169 208 124 GLU CG C 35.8390 . . 1170 208 124 GLU N N 119.5570 . . 1171 209 125 GLU H H 8.7160 . . 1172 209 125 GLU HA H 4.8220 . . 1173 209 125 GLU HB2 H 1.8910 . . 1174 209 125 GLU HB3 H 1.7710 . . 1175 209 125 GLU HG2 H 2.0830 . . 1176 209 125 GLU HG3 H 2.0050 . . 1177 209 125 GLU C C 176.3910 . . 1178 209 125 GLU CA C 55.0440 . . 1179 209 125 GLU CB C 30.4770 . . 1180 209 125 GLU CG C 35.8880 . . 1181 209 125 GLU N N 126.3120 . . 1182 210 126 THR H H 8.9630 . . 1183 210 126 THR HA H 4.1500 . . 1184 210 126 THR HB H 3.8450 . . 1185 210 126 THR HG2 H 0.5910 . . 1186 210 126 THR C C 173.0460 . . 1187 210 126 THR CA C 61.7980 . . 1188 210 126 THR CB C 68.4780 . . 1189 210 126 THR CG2 C 20.2060 . . 1190 210 126 THR N N 123.9720 . . 1191 211 127 ASN H H 8.6820 . . 1192 211 127 ASN HA H 4.5370 . . 1193 211 127 ASN HB2 H 2.5650 . . 1194 211 127 ASN CA C 53.7080 . . 1195 211 127 ASN CB C 39.9300 . . 1196 211 127 ASN N N 124.4190 . . 1197 214 130 TYR HA H 4.2730 . . 1198 214 130 TYR HB2 H 2.8960 . . 1199 214 130 TYR HB3 H 2.7990 . . 1200 214 130 TYR HD1 H 6.8610 . . 1201 214 130 TYR HE1 H 6.5850 . . 1202 214 130 TYR C C 173.7180 . . 1203 214 130 TYR CA C 59.3850 . . 1204 214 130 TYR CB C 40.0130 . . 1205 214 130 TYR CD1 C 131.8310 . . 1206 214 130 TYR CE1 C 117.7800 . . 1207 215 131 THR H H 7.3510 . . 1208 215 131 THR HA H 4.2740 . . 1209 215 131 THR HB H 3.1840 . . 1210 215 131 THR C C 171.3350 . . 1211 215 131 THR CA C 58.9690 . . 1212 215 131 THR CB C 70.4310 . . 1213 215 131 THR CG2 C 20.0000 . . 1214 215 131 THR N N 125.9410 . . 1215 216 132 LYS H H 9.7200 . . 1216 216 132 LYS HA H 4.6260 . . 1217 216 132 LYS HB2 H 1.5730 . . 1218 216 132 LYS HG2 H 0.8640 . . 1219 216 132 LYS HG3 H 1.1290 . . 1220 216 132 LYS HD2 H 0.7580 . . 1221 216 132 LYS HD3 H 0.6150 . . 1222 216 132 LYS HE2 H 2.6600 . . 1223 216 132 LYS HE3 H 2.5190 . . 1224 216 132 LYS C C 173.6330 . . 1225 216 132 LYS CA C 54.3840 . . 1226 216 132 LYS CB C 33.7650 . . 1227 216 132 LYS CG C 24.6780 . . 1228 216 132 LYS CD C 31.8380 . . 1229 216 132 LYS CE C 42.9580 . . 1230 216 132 LYS N N 128.6890 . . 1231 217 133 LEU H H 8.5780 . . 1232 217 133 LEU HA H 5.0460 . . 1233 217 133 LEU HB2 H 1.2140 . . 1234 217 133 LEU HB3 H 0.9490 . . 1235 217 133 LEU HG H 0.9070 . . 1236 217 133 LEU HD1 H -0.0600 . . 1237 217 133 LEU HD2 H -0.2610 . . 1238 217 133 LEU C C 173.7860 . . 1239 217 133 LEU CA C 53.7080 . . 1240 217 133 LEU CB C 43.4650 . . 1241 217 133 LEU CG C 27.2610 . . 1242 217 133 LEU CD1 C 24.9750 . . 1243 217 133 LEU CD2 C 23.7350 . . 1244 217 133 LEU N N 108.8160 . . 1245 218 134 VAL H H 8.7910 . . 1246 218 134 VAL HA H 4.7640 . . 1247 218 134 VAL HB H 1.8680 . . 1248 218 134 VAL HG1 H 0.9320 . . 1249 218 134 VAL HG2 H 0.8560 . . 1250 218 134 VAL C C 177.4120 . . 1251 218 134 VAL CA C 59.7940 . . 1252 218 134 VAL CB C 33.5200 . . 1253 218 134 VAL CG1 C 20.4910 . . 1254 218 134 VAL CG2 C 18.3130 . . 1255 218 134 VAL N N 124.6570 . . 1256 219 135 PHE H H 9.3270 . . 1257 219 135 PHE HA H 5.0100 . . 1258 219 135 PHE HB2 H 3.0810 . . 1259 219 135 PHE HB3 H 3.5810 . . 1260 219 135 PHE HD1 H 7.1710 . . 1261 219 135 PHE HE1 H 6.8950 . . 1262 219 135 PHE C C 176.9780 . . 1263 219 135 PHE CA C 58.8500 . . 1264 219 135 PHE CB C 41.1650 . . 1265 219 135 PHE CD1 C 131.7280 . . 1266 219 135 PHE CE1 C 129.7780 . . 1267 219 135 PHE N N 129.0630 . . 1268 220 136 ALA H H 8.9800 . . 1269 220 136 ALA HA H 4.0620 . . 1270 220 136 ALA HB H 1.4850 . . 1271 220 136 ALA C C 176.8680 . . 1272 220 136 ALA CA C 53.5930 . . 1273 220 136 ALA CB C 19.3290 . . 1274 220 136 ALA N N 121.6530 . . 1275 221 137 LYS H H 7.5250 . . 1276 221 137 LYS HA H 4.7030 . . 1277 221 137 LYS HB2 H 1.8810 . . 1278 221 137 LYS HB3 H 1.7000 . . 1279 221 137 LYS HG2 H 1.3050 . . 1280 221 137 LYS HG3 H 1.2020 . . 1281 221 137 LYS HD2 H 1.6910 . . 1282 221 137 LYS HE2 H 3.0990 . . 1283 221 137 LYS HE3 H 3.0320 . . 1284 221 137 LYS CA C 52.6690 . . 1285 221 137 LYS CB C 32.6290 . . 1286 221 137 LYS CG C 22.5180 . . 1287 221 137 LYS CD C 29.1270 . . 1288 221 137 LYS CE C 42.9200 . . 1289 221 137 LYS N N 112.2720 . . 1290 222 138 PRO HA H 4.1710 . . 1291 222 138 PRO HB2 H 1.9270 . . 1292 222 138 PRO HB3 H 1.5420 . . 1293 222 138 PRO HG2 H 2.1680 . . 1294 222 138 PRO HG3 H 1.9250 . . 1295 222 138 PRO HD2 H 3.6050 . . 1296 222 138 PRO C C 175.8290 . . 1297 222 138 PRO CA C 61.5780 . . 1298 222 138 PRO CB C 31.4910 . . 1299 222 138 PRO CG C 27.3970 . . 1300 222 138 PRO CD C 49.6100 . . 1301 223 139 ILE H H 8.0080 . . 1302 223 139 ILE HA H 3.6890 . . 1303 223 139 ILE HB H 1.5930 . . 1304 223 139 ILE HG12 H 1.0490 . . 1305 223 139 ILE HG13 H 0.5950 . . 1306 223 139 ILE HG2 H 0.3800 . . 1307 223 139 ILE HD1 H -0.2070 . . 1308 223 139 ILE C C 174.6840 . . 1309 223 139 ILE CA C 59.0520 . . 1310 223 139 ILE CB C 36.1920 . . 1311 223 139 ILE CG1 C 27.2460 . . 1312 223 139 ILE CG2 C 17.5700 . . 1313 223 139 ILE CD1 C 9.0700 . . 1314 223 139 ILE N N 122.5190 . . 1315 224 140 TYR H H 7.9930 . . 1316 224 140 TYR HA H 4.5980 . . 1317 224 140 TYR HB2 H 2.7650 . . 1318 224 140 TYR HB3 H 2.5500 . . 1319 224 140 TYR HD1 H 6.9730 . . 1320 224 140 TYR HE1 H 6.6520 . . 1321 224 140 TYR C C 175.4760 . . 1322 224 140 TYR CA C 57.2710 . . 1323 224 140 TYR CB C 41.6840 . . 1324 224 140 TYR CD1 C 132.8820 . . 1325 224 140 TYR CE1 C 117.3000 . . 1326 224 140 TYR N N 123.1410 . . 1327 225 141 ASN H H 9.2770 . . 1328 225 141 ASN HA H 4.5150 . . 1329 225 141 ASN HB2 H 2.9370 . . 1330 225 141 ASN HB3 H 2.8760 . . 1331 225 141 ASN C C 175.0290 . . 1332 225 141 ASN CA C 52.5950 . . 1333 225 141 ASN CB C 39.2350 . . 1334 225 141 ASN N N 120.7590 . . 1335 226 142 ASP HA H 4.7530 . . 1336 226 142 ASP HB2 H 2.0670 . . 1337 226 142 ASP HB3 H 1.7240 . . 1338 226 142 ASP CA C 49.9500 . . 1339 226 142 ASP CB C 40.2100 . . 1340 227 143 PRO HA H 4.5020 . . 1341 227 143 PRO HB2 H 2.0260 . . 1342 227 143 PRO HG2 H 1.8910 . . 1343 227 143 PRO HG3 H 1.7880 . . 1344 227 143 PRO HD2 H 3.7500 . . 1345 227 143 PRO HD3 H 3.3640 . . 1346 227 143 PRO C C 176.8760 . . 1347 227 143 PRO CA C 63.2000 . . 1348 227 143 PRO CB C 32.0130 . . 1349 227 143 PRO CG C 25.9300 . . 1350 227 143 PRO CD C 50.0700 . . 1351 228 144 SER H H 8.1990 . . 1352 228 144 SER HA H 4.2730 . . 1353 228 144 SER HB2 H 3.8170 . . 1354 228 144 SER HB3 H 3.7230 . . 1355 228 144 SER C C 176.5920 . . 1356 228 144 SER CA C 58.8840 . . 1357 228 144 SER CB C 63.7290 . . 1358 228 144 SER N N 117.0810 . . 1359 229 145 LEU H H 6.9900 . . 1360 229 145 LEU HA H 4.0130 . . 1361 229 145 LEU HB2 H 1.4740 . . 1362 229 145 LEU HG H 1.3870 . . 1363 229 145 LEU HD1 H 0.8000 . . 1364 229 145 LEU HD2 H 0.7240 . . 1365 229 145 LEU CA C 56.3420 . . 1366 229 145 LEU CB C 42.6810 . . 1367 229 145 LEU CG C 26.7070 . . 1368 229 145 LEU CD1 C 25.3840 . . 1369 229 145 LEU CD2 C 22.8280 . . 1370 229 145 LEU N N 128.6210 . . stop_ save_