data_18333 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of phosphorylated CRKL ; _BMRB_accession_number 18333 _BMRB_flat_file_name bmr18333.str _Entry_type original _Submission_date 2012-03-16 _Accession_date 2012-03-16 _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 Jankowski Wojciech . . 2 Saleh Tamjeed . . 3 Kalodimos Charalampos . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 837 "13C chemical shifts" 701 "15N chemical shifts" 235 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2012-08-29 original author . stop_ _Original_release_date 2012-08-29 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Domain organization differences explain Bcr-Abl's preference for CrkL over CrkII' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 22581121 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Jankowski Wojciech . . 2 Saleh Tamjeed . . 3 Pai Ming-Tao . . 4 Sriram Ganapathy . . 5 Birge Raymond . . 6 Kalodimos Charalampos . . stop_ _Journal_abbreviation 'Nat. Chem. Biol.' _Journal_volume 8 _Journal_issue 6 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 590 _Page_last 596 _Year 2012 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'phosphorylated CRKL' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'phosphorylated CRKL' $entity stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity _Molecular_mass 33897.184 _Mol_thiol_state . _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 303 _Mol_residue_sequence ; MSSARFDSSDRSAWYMGPVS RQEAQTRLQGQRHGMFLVRD SSTCPGDYVLSVSENSRVSH YIINSLPNRRFKIGDQEFDH LPALLEFYKIHYLDTTTLIE PAPRYPSPPMGSVSAPNLPT AEDNLEYVRTLYDFPGNDAE DLPFKKGEILVIIEKPEEQW WSARNKDGRVGMIPVPYVEK LVRSSPHGKHGNRNSNSYGI PEPAHAXAQPQTTTPLPAVS GSPGAAITPLPSTQNGPVFA KAIQKRVPCAYDKTALALEV GDIVKVTRMNINGQWEGEVN GRKGLFPFTHVKIFDPQNPD ENE ; loop_ _Residue_seq_code _Residue_label 1 MET 2 SER 3 SER 4 ALA 5 ARG 6 PHE 7 ASP 8 SER 9 SER 10 ASP 11 ARG 12 SER 13 ALA 14 TRP 15 TYR 16 MET 17 GLY 18 PRO 19 VAL 20 SER 21 ARG 22 GLN 23 GLU 24 ALA 25 GLN 26 THR 27 ARG 28 LEU 29 GLN 30 GLY 31 GLN 32 ARG 33 HIS 34 GLY 35 MET 36 PHE 37 LEU 38 VAL 39 ARG 40 ASP 41 SER 42 SER 43 THR 44 CYS 45 PRO 46 GLY 47 ASP 48 TYR 49 VAL 50 LEU 51 SER 52 VAL 53 SER 54 GLU 55 ASN 56 SER 57 ARG 58 VAL 59 SER 60 HIS 61 TYR 62 ILE 63 ILE 64 ASN 65 SER 66 LEU 67 PRO 68 ASN 69 ARG 70 ARG 71 PHE 72 LYS 73 ILE 74 GLY 75 ASP 76 GLN 77 GLU 78 PHE 79 ASP 80 HIS 81 LEU 82 PRO 83 ALA 84 LEU 85 LEU 86 GLU 87 PHE 88 TYR 89 LYS 90 ILE 91 HIS 92 TYR 93 LEU 94 ASP 95 THR 96 THR 97 THR 98 LEU 99 ILE 100 GLU 101 PRO 102 ALA 103 PRO 104 ARG 105 TYR 106 PRO 107 SER 108 PRO 109 PRO 110 MET 111 GLY 112 SER 113 VAL 114 SER 115 ALA 116 PRO 117 ASN 118 LEU 119 PRO 120 THR 121 ALA 122 GLU 123 ASP 124 ASN 125 LEU 126 GLU 127 TYR 128 VAL 129 ARG 130 THR 131 LEU 132 TYR 133 ASP 134 PHE 135 PRO 136 GLY 137 ASN 138 ASP 139 ALA 140 GLU 141 ASP 142 LEU 143 PRO 144 PHE 145 LYS 146 LYS 147 GLY 148 GLU 149 ILE 150 LEU 151 VAL 152 ILE 153 ILE 154 GLU 155 LYS 156 PRO 157 GLU 158 GLU 159 GLN 160 TRP 161 TRP 162 SER 163 ALA 164 ARG 165 ASN 166 LYS 167 ASP 168 GLY 169 ARG 170 VAL 171 GLY 172 MET 173 ILE 174 PRO 175 VAL 176 PRO 177 TYR 178 VAL 179 GLU 180 LYS 181 LEU 182 VAL 183 ARG 184 SER 185 SER 186 PRO 187 HIS 188 GLY 189 LYS 190 HIS 191 GLY 192 ASN 193 ARG 194 ASN 195 SER 196 ASN 197 SER 198 TYR 199 GLY 200 ILE 201 PRO 202 GLU 203 PRO 204 ALA 205 HIS 206 ALA 207 PTR 208 ALA 209 GLN 210 PRO 211 GLN 212 THR 213 THR 214 THR 215 PRO 216 LEU 217 PRO 218 ALA 219 VAL 220 SER 221 GLY 222 SER 223 PRO 224 GLY 225 ALA 226 ALA 227 ILE 228 THR 229 PRO 230 LEU 231 PRO 232 SER 233 THR 234 GLN 235 ASN 236 GLY 237 PRO 238 VAL 239 PHE 240 ALA 241 LYS 242 ALA 243 ILE 244 GLN 245 LYS 246 ARG 247 VAL 248 PRO 249 CYS 250 ALA 251 TYR 252 ASP 253 LYS 254 THR 255 ALA 256 LEU 257 ALA 258 LEU 259 GLU 260 VAL 261 GLY 262 ASP 263 ILE 264 VAL 265 LYS 266 VAL 267 THR 268 ARG 269 MET 270 ASN 271 ILE 272 ASN 273 GLY 274 GLN 275 TRP 276 GLU 277 GLY 278 GLU 279 VAL 280 ASN 281 GLY 282 ARG 283 LYS 284 GLY 285 LEU 286 PHE 287 PRO 288 PHE 289 THR 290 HIS 291 VAL 292 LYS 293 ILE 294 PHE 295 ASP 296 PRO 297 GLN 298 ASN 299 PRO 300 ASP 301 GLU 302 ASN 303 GLU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-07-22 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 18321 entity 100.00 303 99.67 99.67 0.00e+00 PDB 2LQN "Solution Structure Of Crkl" 100.00 303 99.67 99.67 0.00e+00 PDB 2LQW "Solution Structure Of Phosphorylated Crkl" 100.00 303 100.00 100.00 0.00e+00 DBJ BAF85598 "unnamed protein product [Homo sapiens]" 100.00 303 99.67 99.67 0.00e+00 DBJ BAG72855 "v-crk sarcoma virus CT10 oncogene homolog [synthetic construct]" 100.00 303 99.67 99.67 0.00e+00 EMBL CAA42199 "CRKL [Homo sapiens]" 100.00 303 99.67 99.67 0.00e+00 EMBL CAG30309 "CRKL [Homo sapiens]" 100.00 303 99.67 99.67 0.00e+00 EMBL CAK54415 "CRKL [synthetic construct]" 100.00 303 99.67 99.67 0.00e+00 EMBL CAK54714 "CRKL [synthetic construct]" 100.00 303 99.67 99.67 0.00e+00 GB AAH43500 "V-crk sarcoma virus CT10 oncogene homolog (avian)-like [Homo sapiens]" 100.00 303 99.67 99.67 0.00e+00 GB EAX02932 "v-crk sarcoma virus CT10 oncogene homolog (avian)-like, isoform CRA_a [Homo sapiens]" 100.00 303 99.67 99.67 0.00e+00 GB EAX02933 "v-crk sarcoma virus CT10 oncogene homolog (avian)-like, isoform CRA_a [Homo sapiens]" 100.00 303 99.67 99.67 0.00e+00 GB EAX02934 "v-crk sarcoma virus CT10 oncogene homolog (avian)-like, isoform CRA_a [Homo sapiens]" 100.00 303 99.67 99.67 0.00e+00 GB EFB28378 "hypothetical protein PANDA_015965, partial [Ailuropoda melanoleuca]" 100.00 303 97.69 98.68 0.00e+00 REF NP_001244412 "crk-like protein [Macaca mulatta]" 100.00 303 99.67 99.67 0.00e+00 REF NP_005198 "crk-like protein [Homo sapiens]" 100.00 303 99.67 99.67 0.00e+00 REF XP_002743611 "PREDICTED: crk-like protein [Callithrix jacchus]" 100.00 303 99.01 99.67 0.00e+00 REF XP_002834682 "PREDICTED: LOW QUALITY PROTEIN: crk-like protein [Pongo abelii]" 100.00 303 99.67 99.67 0.00e+00 REF XP_002926331 "PREDICTED: crk-like protein [Ailuropoda melanoleuca]" 100.00 303 97.69 98.68 0.00e+00 SP P46109 "RecName: Full=Crk-like protein" 100.00 303 99.67 99.67 0.00e+00 stop_ save_ ###################### # Polymer residues # ###################### save_chem_comp_PTR _Saveframe_category polymer_residue _Mol_type 'L-PEPTIDE LINKING' _Name_common O-PHOSPHOTYROSINE _BMRB_code PTR _PDB_code PTR _Standard_residue_derivative . _Molecular_mass 261.168 _Mol_paramagnetic . _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons N N N . 0 . ? CA CA C . 0 . ? C C C . 0 . ? O O O . 0 . ? OXT OXT O . 0 . ? CB CB C . 0 . ? CG CG C . 0 . ? CD1 CD1 C . 0 . ? CD2 CD2 C . 0 . ? CE1 CE1 C . 0 . ? CE2 CE2 C . 0 . ? CZ CZ C . 0 . ? OH OH O . 0 . ? P P P . 0 . ? O1P O1P O . 0 . ? O2P O2P O . 0 . ? O3P O3P O . 0 . ? H H H . 0 . ? HN2 HN2 H . 0 . ? HA HA H . 0 . ? HXT HXT H . 0 . ? HB2 HB2 H . 0 . ? HB3 HB3 H . 0 . ? HD1 HD1 H . 0 . ? HD2 HD2 H . 0 . ? HE1 HE1 H . 0 . ? HE2 HE2 H . 0 . ? HO2P HO2P H . 0 . ? HO3P HO3P H . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name SING N CA ? ? SING N H ? ? SING N HN2 ? ? SING CA C ? ? SING CA CB ? ? SING CA HA ? ? DOUB C O ? ? SING C OXT ? ? SING OXT HXT ? ? SING CB CG ? ? SING CB HB2 ? ? SING CB HB3 ? ? DOUB CG CD1 ? ? SING CG CD2 ? ? SING CD1 CE1 ? ? SING CD1 HD1 ? ? DOUB CD2 CE2 ? ? SING CD2 HD2 ? ? DOUB CE1 CZ ? ? SING CE1 HE1 ? ? SING CE2 CZ ? ? SING CE2 HE2 ? ? SING CZ OH ? ? SING OH P ? ? DOUB P O1P ? ? SING P O2P ? ? SING P O3P ? ? SING O2P HO2P ? ? SING O3P HO3P ? ? stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity 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 $entity 'recombinant technology' . Escherichia coli . pET42A stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling 'potassium phosphate' . mM 0.3 0.8 'natural abundance' 'potassium chloride' . mM 0.3 0.8 'natural abundance' beta-mercaptoethanol . mM 0.3 0.8 'natural abundance' H2O 90 % . . 'natural abundance' D2O 10 % . . 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_CNS _Saveframe_category software _Name CNS _Version . loop_ _Vendor _Address _Electronic_address 'Brunger A. T. et.al.' . . stop_ loop_ _Task refinement stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 700 _Details . save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ save_spectrometer_4 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.15 . M pH 6.8 . pH pressure 1 . atm temperature 305 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 DSS P 31 'methyl protons' ppm 0.00 na indirect . . . 0.404808636 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'phosphorylated CRKL' _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 1 1 MET HE H 10.2000 . 1 2 2 2 SER HA H 4.5213 . 1 3 2 2 SER HB2 H 3.8409 . 2 4 2 2 SER CA C 58.3260 . 1 5 2 2 SER CB C 64.0618 . 1 6 3 3 SER HA H 4.4652 . 1 7 3 3 SER CA C 58.3744 . 1 8 3 3 SER CB C 63.9201 . 1 9 4 4 ALA H H 8.2458 . 1 10 4 4 ALA HA H 4.5468 . 1 11 4 4 ALA HB H 1.4705 . 1 12 4 4 ALA CA C 52.7368 . 1 13 4 4 ALA CB C 19.7408 . 1 14 4 4 ALA N N 124.8414 . 1 15 5 5 ARG H H 8.6880 . 1 16 5 5 ARG HA H 4.5235 . 1 17 5 5 ARG HB2 H 1.8651 . 2 18 5 5 ARG HG2 H 1.7127 . 2 19 5 5 ARG HD2 H 3.2407 . 2 20 5 5 ARG CA C 56.0822 . 1 21 5 5 ARG CB C 30.6952 . 1 22 5 5 ARG CG C 27.0349 . 1 23 5 5 ARG CD C 43.6920 . 1 24 5 5 ARG N N 120.2878 . 1 25 6 6 PHE H H 7.5670 . 1 26 6 6 PHE HA H 4.7863 . 1 27 6 6 PHE HB2 H 3.1428 . 2 28 6 6 PHE HD2 H 7.1019 . 3 29 6 6 PHE CA C 56.6400 . 1 30 6 6 PHE CB C 39.5438 . 1 31 6 6 PHE N N 115.3823 . 1 32 7 7 ASP H H 9.0182 . 1 33 7 7 ASP HA H 4.8462 . 1 34 7 7 ASP HB2 H 2.6788 . 2 35 7 7 ASP CA C 52.3269 . 1 36 7 7 ASP CB C 41.2977 . 1 37 7 7 ASP N N 121.8221 . 1 38 8 8 SER HA H 3.9503 . 1 39 8 8 SER CA C 61.9365 . 1 40 9 9 SER H H 8.6926 . 1 41 9 9 SER HA H 4.5294 . 1 42 9 9 SER CA C 59.8510 . 1 43 9 9 SER CB C 64.2463 . 1 44 9 9 SER N N 114.6144 . 1 45 10 10 ASP H H 7.6024 . 1 46 10 10 ASP HA H 4.7302 . 1 47 10 10 ASP HB2 H 2.4838 . 2 48 10 10 ASP CA C 52.4322 . 1 49 10 10 ASP CB C 39.6072 . 1 50 10 10 ASP N N 121.7948 . 1 51 11 11 ARG H H 7.7414 . 1 52 11 11 ARG HG2 H 1.2144 . 2 53 11 11 ARG HD2 H 2.9368 . 2 54 11 11 ARG CA C 57.3838 . 1 55 11 11 ARG CB C 29.5549 . 1 56 11 11 ARG CG C 28.0205 . 1 57 11 11 ARG CD C 43.7023 . 1 58 11 11 ARG N N 125.2829 . 1 59 12 12 SER H H 7.9104 . 1 60 12 12 SER HA H 4.6948 . 1 61 12 12 SER CA C 60.7851 . 1 62 12 12 SER CB C 62.8889 . 1 63 12 12 SER N N 112.1653 . 1 64 13 13 ALA H H 7.4348 . 1 65 13 13 ALA HA H 4.2163 . 1 66 13 13 ALA HB H 1.5389 . 1 67 13 13 ALA CA C 53.5623 . 1 68 13 13 ALA CB C 19.4238 . 1 69 13 13 ALA N N 122.2117 . 1 70 14 14 TRP H H 6.3177 . 1 71 14 14 TRP HA H 4.7850 . 1 72 14 14 TRP HB2 H 3.5133 . 2 73 14 14 TRP CA C 55.2115 . 1 74 14 14 TRP CB C 32.7764 . 1 75 14 14 TRP N N 107.5113 . 1 76 15 15 TYR H H 8.2282 . 1 77 15 15 TYR HA H 5.4358 . 1 78 15 15 TYR HB2 H 2.7198 . 2 79 15 15 TYR CA C 56.6090 . 1 80 15 15 TYR CB C 36.9395 . 1 81 15 15 TYR N N 122.2953 . 1 82 16 16 MET H H 8.9686 . 1 83 16 16 MET HA H 4.4623 . 1 84 16 16 MET HB2 H 2.3580 . 2 85 16 16 MET CA C 53.4491 . 1 86 16 16 MET CB C 41.1145 . 1 87 16 16 MET CE C 19.0111 . 1 88 16 16 MET N N 125.8852 . 1 89 17 17 GLY H H 5.5155 . 1 90 17 17 GLY HA2 H 3.3241 . 2 91 17 17 GLY CA C 45.8027 . 1 92 17 17 GLY N N 105.2630 . 1 93 18 18 PRO HA H 4.6747 . 1 94 18 18 PRO HB2 H 1.9897 . 2 95 18 18 PRO HG2 H 1.8943 . 2 96 18 18 PRO HD2 H 3.7296 . 2 97 18 18 PRO CA C 63.6474 . 1 98 18 18 PRO CB C 29.2758 . 1 99 18 18 PRO CG C 26.9356 . 1 100 18 18 PRO CD C 50.6225 . 1 101 19 19 VAL H H 7.8263 . 1 102 19 19 VAL HA H 4.0106 . 1 103 19 19 VAL HB H 1.6802 . 1 104 19 19 VAL HG2 H 0.8490 . 2 105 19 19 VAL CA C 62.3547 . 1 106 19 19 VAL CB C 33.4675 . 1 107 19 19 VAL CG2 C 21.7820 . 2 108 19 19 VAL N N 125.3989 . 1 109 20 20 SER H H 8.8310 . 1 110 20 20 SER HA H 4.4531 . 1 111 20 20 SER HB2 H 4.0812 . 2 112 20 20 SER CA C 57.6312 . 1 113 20 20 SER CB C 65.9515 . 1 114 20 20 SER N N 123.6956 . 1 115 21 21 ARG H H 9.3608 . 1 116 21 21 ARG HB2 H 1.9886 . 2 117 21 21 ARG HG2 H 0.2420 . 2 118 21 21 ARG CA C 60.1112 . 1 119 21 21 ARG CB C 30.3338 . 1 120 21 21 ARG CG C 27.3156 . 1 121 21 21 ARG CD C 42.9893 . 1 122 21 21 ARG N N 122.6526 . 1 123 22 22 GLN H H 8.4907 . 1 124 22 22 GLN HA H 4.0081 . 1 125 22 22 GLN HB2 H 1.9356 . 2 126 22 22 GLN HG2 H 2.4098 . 2 127 22 22 GLN CA C 59.0954 . 1 128 22 22 GLN CB C 29.2488 . 1 129 22 22 GLN CG C 33.9551 . 1 130 22 22 GLN N N 116.8332 . 1 131 23 23 GLU H H 8.0977 . 1 132 23 23 GLU HA H 4.0373 . 1 133 23 23 GLU HB2 H 2.0736 . 2 134 23 23 GLU HG2 H 2.2892 . 2 135 23 23 GLU CA C 59.0809 . 1 136 23 23 GLU CB C 31.8960 . 1 137 23 23 GLU CG C 36.8860 . 1 138 23 23 GLU N N 122.0526 . 1 139 24 24 ALA H H 8.5877 . 1 140 24 24 ALA HA H 3.7622 . 1 141 24 24 ALA HB H 1.4735 . 1 142 24 24 ALA CA C 55.4797 . 1 143 24 24 ALA CB C 18.1626 . 1 144 24 24 ALA N N 121.6737 . 1 145 25 25 GLN H H 8.4863 . 1 146 25 25 GLN HA H 3.9501 . 1 147 25 25 GLN CA C 59.6513 . 1 148 25 25 GLN CB C 29.3081 . 1 149 25 25 GLN CG C 34.0708 . 1 150 25 25 GLN N N 116.1816 . 1 151 26 26 THR H H 8.2064 . 1 152 26 26 THR HA H 3.9199 . 1 153 26 26 THR HB H 4.2792 . 1 154 26 26 THR CA C 66.3351 . 1 155 26 26 THR CB C 68.8762 . 1 156 26 26 THR N N 115.4504 . 1 157 27 27 ARG H H 8.0926 . 1 158 27 27 ARG HA H 4.0471 . 1 159 27 27 ARG CA C 58.5281 . 1 160 27 27 ARG CB C 30.1845 . 1 161 27 27 ARG CG C 27.6066 . 1 162 27 27 ARG CD C 43.7556 . 1 163 27 27 ARG N N 119.0960 . 1 164 28 28 LEU H H 7.3881 . 1 165 28 28 LEU HA H 4.3254 . 1 166 28 28 LEU HB2 H 1.8186 . 2 167 28 28 LEU HG H 1.5236 . 1 168 28 28 LEU HD2 H 0.5822 . 2 169 28 28 LEU CA C 55.1432 . 1 170 28 28 LEU CB C 44.9020 . 1 171 28 28 LEU CG C 26.9790 . 1 172 28 28 LEU CD2 C 22.9871 . 2 173 28 28 LEU N N 114.4831 . 1 174 29 29 GLN H H 8.2504 . 1 175 29 29 GLN HA H 3.8562 . 1 176 29 29 GLN HB2 H 2.2755 . 2 177 29 29 GLN HG2 H 2.2759 . 2 178 29 29 GLN CA C 57.6914 . 1 179 29 29 GLN CB C 27.2926 . 1 180 29 29 GLN CG C 33.0312 . 1 181 29 29 GLN N N 121.3119 . 1 182 30 30 GLY H H 9.1149 . 1 183 30 30 GLY HA2 H 3.7281 . 2 184 30 30 GLY CA C 45.4910 . 1 185 30 30 GLY N N 116.6290 . 1 186 31 31 GLN H H 7.6669 . 1 187 31 31 GLN HA H 4.3287 . 1 188 31 31 GLN HG2 H 2.7819 . 2 189 31 31 GLN CA C 53.9104 . 1 190 31 31 GLN CB C 29.5741 . 1 191 31 31 GLN CG C 33.2938 . 1 192 31 31 GLN N N 117.9310 . 1 193 32 32 ARG H H 8.9918 . 1 194 32 32 ARG HA H 3.9398 . 1 195 32 32 ARG HB2 H 1.8618 . 2 196 32 32 ARG CA C 56.7697 . 1 197 32 32 ARG CB C 30.0743 . 1 198 32 32 ARG CD C 43.6887 . 1 199 32 32 ARG N N 124.1578 . 1 200 33 33 HIS H H 8.2955 . 1 201 33 33 HIS HA H 4.6274 . 1 202 33 33 HIS HB2 H 3.1382 . 2 203 33 33 HIS CA C 55.8578 . 1 204 33 33 HIS CB C 28.6484 . 1 205 33 33 HIS N N 122.0682 . 1 206 34 34 GLY H H 9.5214 . 1 207 34 34 GLY HA2 H 3.6745 . 2 208 34 34 GLY CA C 45.9672 . 1 209 34 34 GLY N N 109.3573 . 1 210 35 35 MET H H 8.2991 . 1 211 35 35 MET HA H 5.7496 . 1 212 35 35 MET HB2 H 2.1373 . 2 213 35 35 MET HG2 H 2.3354 . 2 214 35 35 MET CA C 55.7616 . 1 215 35 35 MET CB C 32.7061 . 1 216 35 35 MET CG C 31.9497 . 1 217 35 35 MET N N 125.1565 . 1 218 36 36 PHE H H 8.2608 . 1 219 36 36 PHE HA H 5.9853 . 1 220 36 36 PHE HB2 H 2.6056 . 2 221 36 36 PHE HD1 H 6.5049 . 3 222 36 36 PHE CA C 55.7546 . 1 223 36 36 PHE CB C 45.1969 . 1 224 36 36 PHE N N 123.3113 . 1 225 37 37 LEU H H 9.2953 . 1 226 37 37 LEU HA H 4.4895 . 1 227 37 37 LEU HB2 H 1.9719 . 2 228 37 37 LEU HD1 H 0.7932 . 2 229 37 37 LEU CA C 55.3817 . 1 230 37 37 LEU CB C 44.7910 . 1 231 37 37 LEU CD1 C 26.2502 . 2 232 37 37 LEU N N 114.7332 . 1 233 38 38 VAL H H 9.0624 . 1 234 38 38 VAL HA H 5.5044 . 1 235 38 38 VAL HB H 2.6068 . 1 236 38 38 VAL HG1 H 1.1485 . 2 237 38 38 VAL HG2 H 0.7959 . 2 238 38 38 VAL CA C 61.3156 . 1 239 38 38 VAL CB C 33.3016 . 1 240 38 38 VAL CG1 C 22.0644 . 2 241 38 38 VAL CG2 C 22.8545 . 2 242 38 38 VAL N N 121.1217 . 1 243 39 39 ARG H H 9.5444 . 1 244 39 39 ARG HA H 5.4437 . 1 245 39 39 ARG HB2 H 2.4093 . 2 246 39 39 ARG HG2 H 1.6552 . 2 247 39 39 ARG HD2 H 2.4338 . 2 248 39 39 ARG HH11 H 6.8155 . 9 249 39 39 ARG CA C 52.5578 . 1 250 39 39 ARG CB C 34.9797 . 1 251 39 39 ARG CG C 25.9293 . 1 252 39 39 ARG CD C 43.1887 . 1 253 39 39 ARG N N 123.9822 . 1 254 40 40 ASP H H 8.4129 . 1 255 40 40 ASP HA H 4.7850 . 1 256 40 40 ASP HB2 H 2.3129 . 2 257 40 40 ASP CA C 55.3345 . 1 258 40 40 ASP CB C 40.6503 . 1 259 40 40 ASP N N 122.3299 . 1 260 41 41 SER H H 7.9902 . 1 261 41 41 SER HA H 4.5056 . 1 262 41 41 SER HB2 H 3.4453 . 2 263 41 41 SER CA C 57.5250 . 1 264 41 41 SER CB C 63.7058 . 1 265 41 41 SER N N 114.3516 . 1 266 42 42 SER H H 10.5194 . 1 267 42 42 SER HA H 4.4105 . 1 268 42 42 SER HB2 H 3.9244 . 2 269 42 42 SER CA C 60.3619 . 1 270 42 42 SER CB C 63.7072 . 1 271 42 42 SER N N 126.9320 . 1 272 43 43 THR HA H 4.0972 . 1 273 43 43 THR HB H 4.0554 . 1 274 43 43 THR HG2 H 1.2120 . 1 275 43 43 THR CA C 64.7217 . 1 276 43 43 THR CB C 69.4390 . 1 277 44 44 CYS HA H 5.1000 . 1 278 44 44 CYS HB2 H 2.8923 . 2 279 44 44 CYS CA C 51.7787 . 1 280 44 44 CYS CB C 41.3140 . 1 281 45 45 PRO HA H 4.2779 . 1 282 45 45 PRO HB2 H 1.8784 . 2 283 45 45 PRO HG2 H 1.9908 . 2 284 45 45 PRO HD2 H 3.6072 . 2 285 45 45 PRO CA C 64.1507 . 1 286 45 45 PRO CB C 31.5956 . 1 287 45 45 PRO CG C 27.5737 . 1 288 45 45 PRO CD C 50.6017 . 1 289 46 46 GLY H H 8.8234 . 1 290 46 46 GLY HA2 H 3.5600 . 2 291 46 46 GLY CA C 45.2252 . 1 292 46 46 GLY N N 114.4580 . 1 293 47 47 ASP H H 7.9003 . 1 294 47 47 ASP HA H 5.2349 . 1 295 47 47 ASP HB2 H 3.0001 . 2 296 47 47 ASP CA C 53.5913 . 1 297 47 47 ASP CB C 41.7069 . 1 298 47 47 ASP N N 121.0153 . 1 299 48 48 TYR H H 8.8545 . 1 300 48 48 TYR HA H 5.4313 . 1 301 48 48 TYR HB2 H 2.6442 . 2 302 48 48 TYR HD2 H 7.0807 . 3 303 48 48 TYR CA C 56.8908 . 1 304 48 48 TYR CB C 43.2736 . 1 305 48 48 TYR N N 118.6435 . 1 306 49 49 VAL H H 9.6892 . 1 307 49 49 VAL HA H 4.8002 . 1 308 49 49 VAL HB H 1.7444 . 1 309 49 49 VAL HG1 H 0.9913 . 2 310 49 49 VAL HG2 H 0.9647 . 2 311 49 49 VAL CA C 61.4393 . 1 312 49 49 VAL CB C 35.3881 . 1 313 49 49 VAL CG1 C 22.8052 . 2 314 49 49 VAL CG2 C 21.5007 . 2 315 49 49 VAL N N 118.2552 . 1 316 50 50 LEU H H 9.2982 . 1 317 50 50 LEU HA H 5.0327 . 1 318 50 50 LEU HB2 H 1.2426 . 2 319 50 50 LEU HG H 1.3711 . 1 320 50 50 LEU HD1 H 0.5324 . 2 321 50 50 LEU HD2 H 0.3664 . 2 322 50 50 LEU CA C 53.3516 . 1 323 50 50 LEU CB C 44.0623 . 1 324 50 50 LEU CG C 27.2851 . 1 325 50 50 LEU CD1 C 24.7004 . 2 326 50 50 LEU CD2 C 25.9866 . 2 327 50 50 LEU N N 129.2740 . 1 328 51 51 SER H H 9.0849 . 1 329 51 51 SER HA H 5.7310 . 1 330 51 51 SER HB2 H 3.4048 . 2 331 51 51 SER CA C 58.8343 . 1 332 51 51 SER CB C 64.9769 . 1 333 51 51 SER N N 126.7887 . 1 334 52 52 VAL H H 8.8374 . 1 335 52 52 VAL HA H 5.0663 . 1 336 52 52 VAL HB H 1.8283 . 1 337 52 52 VAL HG1 H 0.8960 . 2 338 52 52 VAL HG2 H 0.8490 . 2 339 52 52 VAL CA C 59.5346 . 1 340 52 52 VAL CB C 36.8335 . 1 341 52 52 VAL CG1 C 20.3760 . 2 342 52 52 VAL CG2 C 21.7820 . 2 343 52 52 VAL N N 121.7769 . 1 344 53 53 SER H H 8.8067 . 1 345 53 53 SER HA H 4.8115 . 1 346 53 53 SER HB2 H 4.3835 . 2 347 53 53 SER CA C 57.4964 . 1 348 53 53 SER CB C 62.6231 . 1 349 53 53 SER N N 120.5435 . 1 350 54 54 GLU H H 8.5008 . 1 351 54 54 GLU HA H 4.2504 . 1 352 54 54 GLU HB2 H 1.9056 . 2 353 54 54 GLU HG2 H 2.1060 . 2 354 54 54 GLU CA C 56.9987 . 1 355 54 54 GLU CB C 32.5564 . 1 356 54 54 GLU CG C 37.5047 . 1 357 54 54 GLU N N 132.5145 . 1 358 55 55 ASN H H 8.8532 . 1 359 55 55 ASN HA H 4.2204 . 1 360 55 55 ASN HB2 H 2.7333 . 2 361 55 55 ASN CA C 54.7702 . 1 362 55 55 ASN CB C 37.3136 . 1 363 55 55 ASN N N 126.5173 . 1 364 56 56 SER H H 9.9392 . 1 365 56 56 SER HA H 4.3337 . 1 366 56 56 SER HB2 H 4.1483 . 2 367 56 56 SER CA C 59.9660 . 1 368 56 56 SER CB C 62.2419 . 1 369 56 56 SER N N 111.1826 . 1 370 57 57 ARG H H 8.0965 . 1 371 57 57 ARG HA H 5.1665 . 1 372 57 57 ARG HB2 H 2.0446 . 2 373 57 57 ARG HG2 H 1.6973 . 2 374 57 57 ARG CA C 54.5495 . 1 375 57 57 ARG CB C 31.8858 . 1 376 57 57 ARG CG C 26.5422 . 1 377 57 57 ARG CD C 43.6487 . 1 378 57 57 ARG N N 121.7638 . 1 379 58 58 VAL H H 8.0631 . 1 380 58 58 VAL HA H 4.7685 . 1 381 58 58 VAL HB H 1.9427 . 1 382 58 58 VAL HG1 H 0.9500 . 2 383 58 58 VAL HG2 H 0.3697 . 2 384 58 58 VAL CA C 61.8176 . 1 385 58 58 VAL CB C 34.1354 . 1 386 58 58 VAL CG1 C 22.2349 . 2 387 58 58 VAL CG2 C 21.7053 . 2 388 58 58 VAL N N 121.8004 . 1 389 59 59 SER H H 9.0349 . 1 390 59 59 SER HA H 4.4621 . 1 391 59 59 SER HB2 H 3.2895 . 2 392 59 59 SER CA C 56.6286 . 1 393 59 59 SER CB C 66.2180 . 1 394 59 59 SER N N 124.0467 . 1 395 60 60 HIS H H 8.3313 . 1 396 60 60 HIS HA H 4.8853 . 1 397 60 60 HIS HB2 H 2.5737 . 2 398 60 60 HIS HD2 H 7.0492 . 1 399 60 60 HIS HE1 H 7.2900 . 1 400 60 60 HIS CA C 54.9004 . 1 401 60 60 HIS CB C 32.3310 . 1 402 60 60 HIS N N 121.2240 . 1 403 61 61 TYR H H 9.2224 . 1 404 61 61 TYR HA H 4.6550 . 1 405 61 61 TYR HB2 H 2.7852 . 2 406 61 61 TYR HB3 H 2.6852 . 2 407 61 61 TYR HD2 H 7.0074 . 3 408 61 61 TYR HE1 H 6.7115 . 1 409 61 61 TYR CA C 57.4092 . 1 410 61 61 TYR CB C 39.7850 . 1 411 61 61 TYR N N 124.5536 . 1 412 62 62 ILE H H 8.6630 . 1 413 62 62 ILE HA H 4.2982 . 1 414 62 62 ILE HB H 1.9399 . 1 415 62 62 ILE HG12 H 1.3480 . 2 416 62 62 ILE HG13 H 1.6654 . 2 417 62 62 ILE HG2 H 1.0146 . 1 418 62 62 ILE HD1 H 0.9065 . 1 419 62 62 ILE CA C 61.9080 . 1 420 62 62 ILE CB C 38.3209 . 1 421 62 62 ILE CG1 C 29.0694 . 1 422 62 62 ILE CG2 C 17.9766 . 1 423 62 62 ILE CD1 C 13.0977 . 1 424 62 62 ILE N N 126.0122 . 1 425 63 63 ILE H H 8.9426 . 1 426 63 63 ILE HA H 4.7882 . 1 427 63 63 ILE HB H 1.8141 . 1 428 63 63 ILE HD1 H 0.6578 . 1 429 63 63 ILE CA C 59.6286 . 1 430 63 63 ILE CB C 39.7471 . 1 431 63 63 ILE CD1 C 14.8132 . 1 432 63 63 ILE N N 128.0578 . 1 433 64 64 ASN H H 9.3866 . 1 434 64 64 ASN HA H 4.8574 . 1 435 64 64 ASN HB2 H 2.4809 . 2 436 64 64 ASN CA C 53.7362 . 1 437 64 64 ASN CB C 41.5311 . 1 438 64 64 ASN N N 123.4592 . 1 439 65 65 SER H H 9.1952 . 1 440 65 65 SER HA H 4.5481 . 1 441 65 65 SER HB2 H 3.9036 . 2 442 65 65 SER CA C 58.3060 . 1 443 65 65 SER CB C 62.8777 . 1 444 65 65 SER N N 121.1573 . 1 445 66 66 LEU H H 8.1525 . 1 446 66 66 LEU HA H 4.6052 . 1 447 66 66 LEU HG H 1.4518 . 1 448 66 66 LEU HD1 H 0.7656 . 2 449 66 66 LEU HD2 H 0.7160 . 2 450 66 66 LEU CA C 52.8881 . 1 451 66 66 LEU CB C 41.7990 . 1 452 66 66 LEU CG C 26.8010 . 1 453 66 66 LEU CD1 C 22.0962 . 2 454 66 66 LEU CD2 C 25.6792 . 2 455 66 66 LEU N N 127.5501 . 1 456 68 68 ASN HA H 4.3864 . 1 457 68 68 ASN HB2 H 2.9754 . 2 458 68 68 ASN CA C 53.3652 . 1 459 68 68 ASN CB C 36.7779 . 1 460 69 69 ARG H H 8.1945 . 1 461 69 69 ARG HA H 3.8758 . 1 462 69 69 ARG HB2 H 2.1358 . 2 463 69 69 ARG CA C 57.3927 . 1 464 69 69 ARG CB C 26.6649 . 1 465 69 69 ARG N N 111.6261 . 1 466 70 70 ARG H H 6.6031 . 1 467 70 70 ARG HA H 4.5562 . 1 468 70 70 ARG HB2 H 1.9242 . 2 469 70 70 ARG HG2 H 1.5098 . 2 470 70 70 ARG HD2 H 3.1699 . 2 471 70 70 ARG CA C 55.5086 . 1 472 70 70 ARG CB C 31.7712 . 1 473 70 70 ARG CG C 29.6448 . 1 474 70 70 ARG CD C 43.5181 . 1 475 70 70 ARG N N 115.9237 . 1 476 71 71 PHE H H 8.6736 . 1 477 71 71 PHE HA H 5.3225 . 1 478 71 71 PHE HB2 H 2.3390 . 2 479 71 71 PHE CA C 57.5284 . 1 480 71 71 PHE CB C 44.1152 . 1 481 71 71 PHE N N 116.4642 . 1 482 72 72 LYS H H 9.2112 . 1 483 72 72 LYS HA H 5.4832 . 1 484 72 72 LYS HB2 H 1.8876 . 2 485 72 72 LYS HG2 H 1.3639 . 2 486 72 72 LYS HD2 H 1.7065 . 2 487 72 72 LYS HE2 H 2.9102 . 2 488 72 72 LYS CA C 54.8548 . 1 489 72 72 LYS CB C 37.7103 . 1 490 72 72 LYS CG C 24.9261 . 1 491 72 72 LYS CD C 30.0592 . 1 492 72 72 LYS CE C 42.2696 . 1 493 72 72 LYS N N 123.6280 . 1 494 73 73 ILE H H 8.8475 . 1 495 73 73 ILE HA H 4.9555 . 1 496 73 73 ILE HB H 1.7976 . 1 497 73 73 ILE HG12 H 1.6878 . 2 498 73 73 ILE HG13 H 0.9911 . 2 499 73 73 ILE HD1 H 0.4502 . 1 500 73 73 ILE CA C 58.9348 . 1 501 73 73 ILE CB C 40.9647 . 1 502 73 73 ILE CG1 C 27.6243 . 1 503 73 73 ILE CG2 C 16.6688 . 1 504 73 73 ILE CD1 C 13.5296 . 1 505 73 73 ILE N N 125.0999 . 1 506 74 74 GLY H H 9.3100 . 1 507 74 74 GLY HA2 H 3.7039 . 2 508 74 74 GLY CA C 47.4009 . 1 509 74 74 GLY N N 117.2610 . 1 510 75 75 ASP H H 8.5350 . 1 511 75 75 ASP HA H 4.7134 . 1 512 75 75 ASP HB2 H 2.7401 . 2 513 75 75 ASP CA C 53.8149 . 1 514 75 75 ASP CB C 41.2882 . 1 515 75 75 ASP N N 125.3772 . 1 516 76 76 GLN H H 8.2890 . 1 517 76 76 GLN HB2 H 2.0018 . 2 518 76 76 GLN HG2 H 2.0881 . 2 519 76 76 GLN CA C 54.2536 . 1 520 76 76 GLN CB C 31.2476 . 1 521 76 76 GLN CG C 33.2554 . 1 522 76 76 GLN N N 120.3677 . 1 523 77 77 GLU H H 7.7316 . 1 524 77 77 GLU HB2 H 1.6910 . 2 525 77 77 GLU HG2 H 2.0740 . 2 526 77 77 GLU CA C 54.2027 . 1 527 77 77 GLU CB C 33.1412 . 1 528 77 77 GLU CG C 36.7334 . 1 529 77 77 GLU N N 120.4348 . 1 530 78 78 PHE H H 9.2413 . 1 531 78 78 PHE HA H 4.6522 . 1 532 78 78 PHE HB2 H 2.3885 . 2 533 78 78 PHE HB3 H 3.1838 . 2 534 78 78 PHE HD1 H 6.9455 . 3 535 78 78 PHE CA C 57.1601 . 1 536 78 78 PHE CB C 45.4047 . 1 537 78 78 PHE N N 118.3023 . 1 538 79 79 ASP H H 9.2361 . 1 539 79 79 ASP HA H 4.4621 . 1 540 79 79 ASP HB2 H 2.2509 . 2 541 79 79 ASP CA C 56.6286 . 1 542 79 79 ASP CB C 41.6970 . 1 543 79 79 ASP N N 119.7381 . 1 544 80 80 HIS H H 7.2576 . 1 545 80 80 HIS HA H 5.0225 . 1 546 80 80 HIS HB2 H 3.2356 . 2 547 80 80 HIS HD2 H 7.0528 . 1 548 80 80 HIS CA C 54.2226 . 1 549 80 80 HIS CB C 32.2048 . 1 550 80 80 HIS N N 108.0929 . 1 551 81 81 LEU H H 8.8859 . 1 552 81 81 LEU HA H 3.8036 . 1 553 81 81 LEU HB2 H 1.0500 . 2 554 81 81 LEU HD1 H 0.0884 . 2 555 81 81 LEU HD2 H 0.1347 . 2 556 81 81 LEU CA C 58.7091 . 1 557 81 81 LEU CB C 39.6458 . 1 558 81 81 LEU CD1 C 23.3684 . 2 559 81 81 LEU CD2 C 24.1340 . 2 560 81 81 LEU N N 120.7103 . 1 561 82 82 PRO HA H 4.0196 . 1 562 82 82 PRO HB2 H 1.6822 . 2 563 82 82 PRO HG2 H 1.9633 . 2 564 82 82 PRO HD2 H 4.1356 . 2 565 82 82 PRO HD3 H 3.8076 . 2 566 82 82 PRO CA C 67.0252 . 1 567 82 82 PRO CB C 30.9625 . 1 568 82 82 PRO CG C 28.0990 . 1 569 82 82 PRO CD C 50.1660 . 1 570 83 83 ALA H H 8.5273 . 1 571 83 83 ALA HA H 4.0195 . 1 572 83 83 ALA HB H 1.3894 . 1 573 83 83 ALA CA C 54.9851 . 1 574 83 83 ALA CB C 18.5359 . 1 575 83 83 ALA N N 124.2809 . 1 576 84 84 LEU H H 6.8934 . 1 577 84 84 LEU HA H 1.9171 . 1 578 84 84 LEU HB2 H 0.6454 . 2 579 84 84 LEU HB3 H 0.8536 . 2 580 84 84 LEU HG H 1.1789 . 1 581 84 84 LEU HD1 H 0.4426 . 2 582 84 84 LEU HD2 H 0.6420 . 2 583 84 84 LEU CA C 58.2615 . 1 584 84 84 LEU CB C 42.5445 . 1 585 84 84 LEU CG C 27.5173 . 1 586 84 84 LEU CD1 C 23.5062 . 2 587 84 84 LEU CD2 C 28.9148 . 2 588 84 84 LEU N N 123.0697 . 1 589 85 85 LEU H H 7.7734 . 1 590 85 85 LEU HA H 3.4631 . 1 591 85 85 LEU HB2 H 0.8524 . 2 592 85 85 LEU HG H 1.0657 . 1 593 85 85 LEU HD1 H -0.1338 . 2 594 85 85 LEU HD2 H -0.7372 . 2 595 85 85 LEU CA C 57.5221 . 1 596 85 85 LEU CB C 41.2419 . 1 597 85 85 LEU CG C 25.8935 . 1 598 85 85 LEU CD1 C 22.0041 . 2 599 85 85 LEU CD2 C 23.6740 . 2 600 85 85 LEU N N 117.9404 . 1 601 86 86 GLU H H 8.2889 . 1 602 86 86 GLU HA H 3.5402 . 1 603 86 86 GLU HB2 H 1.9496 . 2 604 86 86 GLU CA C 58.9434 . 1 605 86 86 GLU CB C 29.5614 . 1 606 86 86 GLU N N 115.7824 . 1 607 87 87 PHE H H 7.6794 . 1 608 87 87 PHE HA H 4.1218 . 1 609 87 87 PHE HB2 H 2.9952 . 2 610 87 87 PHE HB3 H 2.8575 . 2 611 87 87 PHE HD2 H 6.8283 . 3 612 87 87 PHE CA C 62.0903 . 1 613 87 87 PHE CB C 39.3096 . 1 614 87 87 PHE N N 120.9657 . 1 615 88 88 TYR H H 7.4784 . 1 616 88 88 TYR HA H 4.9330 . 1 617 88 88 TYR HB2 H 2.2696 . 2 618 88 88 TYR CA C 61.3327 . 1 619 88 88 TYR CB C 36.5389 . 1 620 88 88 TYR N N 116.5785 . 1 621 89 89 LYS H H 7.5165 . 1 622 89 89 LYS HA H 4.4658 . 1 623 89 89 LYS HB2 H 1.7244 . 2 624 89 89 LYS HG2 H 1.0073 . 2 625 89 89 LYS HD2 H 1.4271 . 2 626 89 89 LYS CA C 59.4860 . 1 627 89 89 LYS CB C 34.5235 . 1 628 89 89 LYS CG C 26.2479 . 1 629 89 89 LYS CD C 30.5349 . 1 630 89 89 LYS N N 117.8445 . 1 631 90 90 ILE H H 6.7104 . 1 632 90 90 ILE HA H 4.1810 . 1 633 90 90 ILE HB H 1.5844 . 1 634 90 90 ILE HG12 H 0.9394 . 2 635 90 90 ILE HG2 H 0.9087 . 1 636 90 90 ILE HD1 H 0.6606 . 1 637 90 90 ILE CA C 60.5163 . 1 638 90 90 ILE CB C 39.9791 . 1 639 90 90 ILE CG1 C 26.5512 . 1 640 90 90 ILE CG2 C 16.9816 . 1 641 90 90 ILE CD1 C 12.7909 . 1 642 90 90 ILE N N 110.9715 . 1 643 91 91 HIS H H 7.3638 . 1 644 91 91 HIS HA H 4.3575 . 1 645 91 91 HIS CA C 55.0665 . 1 646 91 91 HIS CB C 29.7564 . 1 647 91 91 HIS N N 118.5551 . 1 648 92 92 TYR H H 8.1341 . 1 649 92 92 TYR HA H 4.1308 . 1 650 92 92 TYR HB2 H 2.9042 . 2 651 92 92 TYR CA C 58.6273 . 1 652 92 92 TYR CB C 39.4811 . 1 653 92 92 TYR N N 118.1346 . 1 654 93 93 LEU H H 7.9303 . 1 655 93 93 LEU HA H 4.1038 . 1 656 93 93 LEU HB2 H 1.6398 . 2 657 93 93 LEU HG H 1.1296 . 1 658 93 93 LEU HD1 H 0.3080 . 2 659 93 93 LEU HD2 H -0.6739 . 2 660 93 93 LEU CA C 56.3810 . 1 661 93 93 LEU CB C 38.8960 . 1 662 93 93 LEU CG C 26.9062 . 1 663 93 93 LEU CD1 C 26.2235 . 2 664 93 93 LEU CD2 C 21.5567 . 2 665 93 93 LEU N N 123.5719 . 1 666 94 94 ASP H H 8.6396 . 1 667 94 94 ASP HA H 4.9401 . 1 668 94 94 ASP HB2 H 2.8370 . 2 669 94 94 ASP CA C 56.2348 . 1 670 94 94 ASP CB C 42.0781 . 1 671 94 94 ASP N N 118.1944 . 1 672 95 95 THR H H 8.4904 . 1 673 95 95 THR HA H 4.3181 . 1 674 95 95 THR HB H 4.4051 . 1 675 95 95 THR CA C 60.7556 . 1 676 95 95 THR CB C 71.0578 . 1 677 95 95 THR CG2 C 21.5475 . 1 678 95 95 THR N N 104.8443 . 1 679 96 96 THR H H 8.1584 . 1 680 96 96 THR HA H 5.1291 . 1 681 96 96 THR HB H 4.0204 . 1 682 96 96 THR HG2 H 0.9182 . 1 683 96 96 THR CA C 60.7616 . 1 684 96 96 THR CB C 71.4252 . 1 685 96 96 THR CG2 C 21.5541 . 1 686 96 96 THR N N 116.7854 . 1 687 97 97 THR H H 7.1280 . 1 688 97 97 THR HB H 4.2435 . 1 689 97 97 THR CA C 60.3825 . 1 690 97 97 THR CB C 70.4154 . 1 691 97 97 THR CG2 C 20.7918 . 1 692 97 97 THR N N 114.3243 . 1 693 98 98 LEU H H 8.7479 . 1 694 98 98 LEU HA H 4.2502 . 1 695 98 98 LEU HB2 H 1.3359 . 2 696 98 98 LEU HD1 H 0.1266 . 2 697 98 98 LEU HD2 H 0.0222 . 2 698 98 98 LEU CA C 54.9136 . 1 699 98 98 LEU CB C 41.1723 . 1 700 98 98 LEU CD1 C 22.1632 . 2 701 98 98 LEU CD2 C 26.2299 . 2 702 98 98 LEU N N 116.6686 . 1 703 99 99 ILE H H 8.9889 . 1 704 99 99 ILE HA H 4.4150 . 1 705 99 99 ILE HB H 1.5644 . 1 706 99 99 ILE HG2 H 0.4892 . 1 707 99 99 ILE HD1 H 0.7930 . 1 708 99 99 ILE CA C 62.1826 . 1 709 99 99 ILE CB C 40.2522 . 1 710 99 99 ILE CG1 C 27.6631 . 1 711 99 99 ILE CG2 C 17.0301 . 1 712 99 99 ILE CD1 C 11.5306 . 1 713 99 99 ILE N N 122.9210 . 1 714 100 100 GLU H H 7.3240 . 1 715 100 100 GLU CA C 52.9095 . 1 716 100 100 GLU CB C 31.1548 . 1 717 100 100 GLU N N 114.1200 . 1 718 101 101 PRO HA H 4.9516 . 1 719 101 101 PRO HB2 H 1.4837 . 2 720 101 101 PRO HD2 H 3.2637 . 2 721 101 101 PRO CA C 53.3122 . 1 722 101 101 PRO CB C 31.5979 . 1 723 101 101 PRO CD C 53.9761 . 1 724 102 102 ALA H H 8.1506 . 1 725 102 102 ALA HA H 4.5164 . 1 726 102 102 ALA HB H 1.0730 . 1 727 102 102 ALA CA C 49.8525 . 1 728 102 102 ALA CB C 17.8295 . 1 729 102 102 ALA N N 125.8445 . 1 730 103 103 PRO HA H 4.2831 . 1 731 103 103 PRO HB2 H 2.1946 . 2 732 103 103 PRO HD2 H 3.5648 . 2 733 103 103 PRO CA C 62.4349 . 1 734 103 103 PRO CB C 32.1447 . 1 735 103 103 PRO CD C 50.2777 . 1 736 104 104 ARG HA H 4.0040 . 1 737 104 104 ARG HG2 H 1.4033 . 2 738 104 104 ARG CA C 56.6601 . 1 739 104 104 ARG CG C 27.5970 . 1 740 106 106 PRO CA C 57.8665 . 1 741 106 106 PRO CB C 31.9425 . 1 742 107 107 SER H H 8.1213 . 1 743 107 107 SER CA C 61.7720 . 1 744 107 107 SER CB C 63.2339 . 1 745 107 107 SER N N 121.1974 . 1 746 109 109 PRO CA C 62.6376 . 1 747 109 109 PRO CB C 30.9698 . 1 748 110 110 MET H H 8.4266 . 1 749 110 110 MET CA C 55.3103 . 1 750 110 110 MET CB C 32.2018 . 1 751 110 110 MET N N 120.7294 . 1 752 111 111 GLY H H 8.3858 . 1 753 111 111 GLY CA C 44.9512 . 1 754 111 111 GLY N N 110.1637 . 1 755 112 112 SER H H 8.1352 . 1 756 112 112 SER CA C 55.9479 . 1 757 112 112 SER CB C 62.7446 . 1 758 112 112 SER N N 116.7513 . 1 759 114 114 SER H H 8.3104 . 1 760 114 114 SER CA C 58.0046 . 1 761 114 114 SER CB C 63.1692 . 1 762 114 114 SER N N 119.0925 . 1 763 115 115 ALA H H 8.1726 . 1 764 115 115 ALA CA C 51.5614 . 1 765 115 115 ALA CB C 17.7140 . 1 766 115 115 ALA N N 126.8230 . 1 767 120 120 THR H H 8.1219 . 1 768 120 120 THR CA C 61.2148 . 1 769 120 120 THR CB C 69.5084 . 1 770 120 120 THR N N 113.8579 . 1 771 121 121 ALA H H 8.2627 . 1 772 121 121 ALA CA C 52.2805 . 1 773 121 121 ALA CB C 18.6232 . 1 774 121 121 ALA N N 125.8072 . 1 775 123 123 ASP H H 8.1771 . 1 776 123 123 ASP CA C 54.1667 . 1 777 123 123 ASP CB C 40.6948 . 1 778 123 123 ASP N N 120.4113 . 1 779 124 124 ASN H H 8.3002 . 1 780 124 124 ASN CA C 52.7711 . 1 781 124 124 ASN CB C 38.3041 . 1 782 124 124 ASN N N 118.1491 . 1 783 125 125 LEU H H 7.7626 . 1 784 125 125 LEU CA C 54.4281 . 1 785 125 125 LEU CB C 41.3504 . 1 786 125 125 LEU N N 121.3577 . 1 787 126 126 GLU H H 8.4312 . 1 788 126 126 GLU CA C 54.8547 . 1 789 126 126 GLU CB C 30.4720 . 1 790 126 126 GLU N N 122.4080 . 1 791 127 127 TYR H H 8.4955 . 1 792 127 127 TYR CA C 56.5279 . 1 793 127 127 TYR CB C 40.9820 . 1 794 127 127 TYR N N 122.7902 . 1 795 128 128 VAL H H 9.0754 . 1 796 128 128 VAL CA C 57.9401 . 1 797 128 128 VAL CB C 34.9350 . 1 798 128 128 VAL N N 112.4542 . 1 799 129 129 ARG H H 9.0050 . 1 800 129 129 ARG CA C 52.5342 . 1 801 129 129 ARG CB C 32.9422 . 1 802 129 129 ARG N N 120.3782 . 1 803 130 130 THR H H 9.0414 . 1 804 130 130 THR CA C 60.6185 . 1 805 130 130 THR CB C 69.1701 . 1 806 130 130 THR N N 116.6423 . 1 807 131 131 LEU H H 9.2130 . 1 808 131 131 LEU CA C 55.1216 . 1 809 131 131 LEU CB C 43.1076 . 1 810 131 131 LEU N N 122.9092 . 1 811 132 132 TYR H H 7.2823 . 1 812 132 132 TYR CA C 54.2303 . 1 813 132 132 TYR CB C 42.6719 . 1 814 132 132 TYR N N 112.9044 . 1 815 133 133 ASP H H 8.4086 . 1 816 133 133 ASP CA C 54.3506 . 1 817 133 133 ASP CB C 41.2407 . 1 818 133 133 ASP N N 118.0676 . 1 819 134 134 PHE H H 8.8023 . 1 820 134 134 PHE CA C 52.5522 . 1 821 134 134 PHE CB C 41.2170 . 1 822 134 134 PHE N N 121.0354 . 1 823 137 137 ASN H H 9.2479 . 1 824 137 137 ASN CA C 44.6701 . 1 825 137 137 ASN N N 119.1810 . 1 826 138 138 ASP H H 8.1929 . 1 827 138 138 ASP CA C 52.9922 . 1 828 138 138 ASP N N 120.7195 . 1 829 139 139 ALA H H 8.5364 . 1 830 139 139 ALA CA C 54.5134 . 1 831 139 139 ALA CB C 18.0452 . 1 832 139 139 ALA N N 124.2593 . 1 833 140 140 GLU H H 8.7025 . 1 834 140 140 GLU CA C 56.1813 . 1 835 140 140 GLU CB C 28.6188 . 1 836 140 140 GLU N N 115.4080 . 1 837 141 141 ASP H H 7.7154 . 1 838 141 141 ASP CA C 54.7360 . 1 839 141 141 ASP CB C 41.3053 . 1 840 141 141 ASP N N 121.8865 . 1 841 142 142 LEU H H 9.4492 . 1 842 142 142 LEU CA C 50.9545 . 1 843 142 142 LEU CB C 42.3427 . 1 844 142 142 LEU N N 127.6764 . 1 845 144 144 PHE H H 8.6240 . 1 846 144 144 PHE CA C 55.5427 . 1 847 144 144 PHE CB C 40.5805 . 1 848 144 144 PHE N N 114.4661 . 1 849 145 145 LYS H H 9.4164 . 1 850 145 145 LYS CA C 53.0432 . 1 851 145 145 LYS CB C 33.8042 . 1 852 145 145 LYS N N 121.3432 . 1 853 146 146 LYS H H 9.0057 . 1 854 146 146 LYS CA C 57.8832 . 1 855 146 146 LYS CB C 32.0079 . 1 856 146 146 LYS N N 123.3985 . 1 857 148 148 GLU H H 7.9355 . 1 858 148 148 GLU CA C 56.8668 . 1 859 148 148 GLU CB C 31.6491 . 1 860 148 148 GLU N N 121.3855 . 1 861 149 149 ILE H H 8.3432 . 1 862 149 149 ILE CA C 58.6214 . 1 863 149 149 ILE CB C 36.9518 . 1 864 149 149 ILE N N 120.1905 . 1 865 150 150 LEU H H 8.9793 . 1 866 150 150 LEU CA C 51.9667 . 1 867 150 150 LEU CB C 44.1823 . 1 868 150 150 LEU N N 126.8350 . 1 869 152 152 ILE H H 8.6780 . 1 870 152 152 ILE CA C 58.3315 . 1 871 152 152 ILE CB C 34.0927 . 1 872 152 152 ILE N N 125.0477 . 1 873 154 154 GLU H H 7.8148 . 1 874 154 154 GLU CA C 55.2888 . 1 875 154 154 GLU CB C 32.8419 . 1 876 154 154 GLU N N 117.3815 . 1 877 155 155 LYS H H 8.6642 . 1 878 155 155 LYS CA C 53.0219 . 1 879 155 155 LYS CB C 32.6626 . 1 880 155 155 LYS N N 121.2744 . 1 881 157 157 GLU CA C 53.7852 . 1 882 157 157 GLU CB C 32.6846 . 1 883 158 158 GLU H H 8.6844 . 1 884 158 158 GLU CA C 59.0437 . 1 885 158 158 GLU CB C 29.7059 . 1 886 158 158 GLU N N 117.5301 . 1 887 159 159 GLN H H 8.4821 . 1 888 159 159 GLN CA C 54.9417 . 1 889 159 159 GLN CB C 28.5719 . 1 890 159 159 GLN N N 110.9903 . 1 891 160 160 TRP H H 6.8191 . 1 892 160 160 TRP CA C 56.1745 . 1 893 160 160 TRP CB C 31.7955 . 1 894 160 160 TRP N N 120.0006 . 1 895 161 161 TRP H H 8.4813 . 1 896 161 161 TRP CA C 51.8889 . 1 897 161 161 TRP CB C 32.7724 . 1 898 161 161 TRP N N 120.7043 . 1 899 162 162 SER H H 8.8313 . 1 900 162 162 SER CA C 57.0110 . 1 901 162 162 SER CB C 63.9480 . 1 902 162 162 SER N N 115.7798 . 1 903 163 163 ALA H H 9.5754 . 1 904 163 163 ALA CA C 50.0294 . 1 905 163 163 ALA CB C 25.5002 . 1 906 163 163 ALA N N 130.6755 . 1 907 164 164 ARG H H 9.0880 . 1 908 164 164 ARG CA C 52.9746 . 1 909 164 164 ARG CB C 34.2598 . 1 910 164 164 ARG N N 117.5938 . 1 911 165 165 ASN H H 8.7467 . 1 912 165 165 ASN CA C 50.3316 . 1 913 165 165 ASN CB C 39.4867 . 1 914 165 165 ASN N N 123.8863 . 1 915 166 166 LYS H H 8.9297 . 1 916 166 166 LYS CA C 58.4299 . 1 917 166 166 LYS CB C 30.9177 . 1 918 166 166 LYS N N 118.4687 . 1 919 167 167 ASP H H 7.5169 . 1 920 167 167 ASP CA C 54.2116 . 1 921 167 167 ASP CB C 41.1785 . 1 922 167 167 ASP N N 118.1770 . 1 923 168 168 GLY H H 8.1762 . 1 924 168 168 GLY CA C 44.7833 . 1 925 168 168 GLY N N 107.9216 . 1 926 169 169 ARG H H 8.0008 . 1 927 169 169 ARG CA C 56.1061 . 1 928 169 169 ARG CB C 29.6480 . 1 929 169 169 ARG N N 124.2840 . 1 930 171 171 GLY H H 9.0111 . 1 931 171 171 GLY CA C 45.3609 . 1 932 171 171 GLY N N 112.4912 . 1 933 172 172 MET H H 8.8916 . 1 934 172 172 MET CA C 53.5364 . 1 935 172 172 MET CB C 30.8382 . 1 936 172 172 MET N N 117.2885 . 1 937 173 173 ILE H H 9.7321 . 1 938 173 173 ILE CA C 56.2844 . 1 939 173 173 ILE CB C 40.8703 . 1 940 173 173 ILE N N 113.3479 . 1 941 174 174 PRO CA C 66.2897 . 1 942 174 174 PRO CB C 28.9930 . 1 943 175 175 VAL H H 7.3036 . 1 944 175 175 VAL CA C 59.3563 . 1 945 175 175 VAL N N 127.9967 . 1 946 177 177 TYR H H 7.7792 . 1 947 177 177 TYR CA C 56.7556 . 1 948 177 177 TYR CB C 37.5069 . 1 949 177 177 TYR N N 115.8324 . 1 950 178 178 VAL H H 7.7858 . 1 951 178 178 VAL CA C 58.3071 . 1 952 178 178 VAL CB C 34.6020 . 1 953 178 178 VAL N N 111.4156 . 1 954 179 179 GLU H H 8.8072 . 1 955 179 179 GLU CA C 53.1139 . 1 956 179 179 GLU CB C 32.7116 . 1 957 179 179 GLU N N 118.6084 . 1 958 180 180 LYS H H 8.7708 . 1 959 180 180 LYS CA C 57.3175 . 1 960 180 180 LYS CB C 31.6752 . 1 961 180 180 LYS N N 124.2300 . 1 962 181 181 LEU H H 8.1006 . 1 963 181 181 LEU CA C 54.4696 . 1 964 181 181 LEU CB C 41.6253 . 1 965 181 181 LEU N N 125.2913 . 1 966 182 182 VAL H H 8.3535 . 1 967 182 182 VAL CA C 61.6130 . 1 968 182 182 VAL CB C 32.0852 . 1 969 182 182 VAL N N 123.3780 . 1 970 183 183 ARG H H 8.5252 . 1 971 183 183 ARG CA C 57.8008 . 1 972 183 183 ARG CB C 30.0910 . 1 973 183 183 ARG N N 125.8620 . 1 974 185 185 SER H H 7.9439 . 1 975 185 185 SER CA C 58.4278 . 1 976 185 185 SER CB C 69.7373 . 1 977 185 185 SER N N 116.5115 . 1 978 190 190 HIS CA C 54.2290 . 1 979 190 190 HIS CB C 35.1125 . 1 980 191 191 GLY H H 8.7249 . 1 981 191 191 GLY HA3 H 3.7985 . 2 982 191 191 GLY CA C 45.2273 . 1 983 191 191 GLY N N 109.5348 . 1 984 192 192 ASN H H 7.5347 . 1 985 192 192 ASN HA H 4.3117 . 1 986 192 192 ASN CA C 57.7870 . 1 987 192 192 ASN N N 118.8912 . 1 988 193 193 ARG H H 9.0253 . 1 989 193 193 ARG N N 120.7808 . 1 990 197 197 SER HA H 4.3819 . 1 991 197 197 SER CA C 58.6608 . 1 992 197 197 SER CB C 62.9658 . 1 993 198 198 TYR H H 8.0632 . 1 994 198 198 TYR HA H 4.5441 . 1 995 198 198 TYR HB2 H 3.0790 . 2 996 198 198 TYR HB3 H 2.9266 . 2 997 198 198 TYR CA C 58.0614 . 1 998 198 198 TYR CB C 38.7321 . 1 999 198 198 TYR N N 121.4590 . 1 1000 199 199 GLY H H 8.1596 . 1 1001 199 199 GLY HA3 H 3.8496 . 2 1002 199 199 GLY CA C 45.2181 . 1 1003 199 199 GLY N N 110.0719 . 1 1004 200 200 ILE H H 7.8187 . 1 1005 200 200 ILE CA C 58.1018 . 1 1006 200 200 ILE CB C 37.7604 . 1 1007 200 200 ILE N N 121.5393 . 1 1008 201 201 PRO HD2 H 3.8658 . 2 1009 201 201 PRO CA C 53.8931 . 1 1010 201 201 PRO CB C 29.0419 . 1 1011 201 201 PRO CD C 51.0343 . 1 1012 202 202 GLU H H 8.3330 . 1 1013 202 202 GLU CA C 62.4903 . 1 1014 202 202 GLU CB C 31.1699 . 1 1015 202 202 GLU N N 122.4611 . 1 1016 203 203 PRO CA C 62.8034 . 1 1017 203 203 PRO CB C 31.2197 . 1 1018 204 204 ALA H H 8.2923 . 1 1019 204 204 ALA HA H 4.1818 . 1 1020 204 204 ALA HB H 1.2958 . 1 1021 204 204 ALA CA C 52.6749 . 1 1022 204 204 ALA CB C 19.4508 . 1 1023 204 204 ALA N N 123.3139 . 1 1024 205 205 HIS H H 8.0451 . 1 1025 205 205 HIS N N 117.8737 . 1 1026 206 206 ALA H H 8.0672 . 1 1027 206 206 ALA HA H 4.2043 . 1 1028 206 206 ALA HB H 1.3622 . 1 1029 206 206 ALA CA C 40.1961 . 1 1030 206 206 ALA CB C 18.5395 . 1 1031 206 206 ALA N N 125.6795 . 1 1032 207 207 PTR CA C 53.0715 . 1 1033 207 207 PTR CB C 39.6681 . 1 1034 207 207 PTR H H 7.8960 . 1 1035 207 207 PTR HA H 4.5653 . 1 1036 207 207 PTR HB2 H 3.1227 . 2 1037 207 207 PTR HB3 H 2.9579 . 2 1038 207 207 PTR HD1 H 6.8593 . 3 1039 207 207 PTR HE2 H 6.7174 . 3 1040 207 207 PTR N N 120.1708 . 1 1041 208 208 ALA H H 8.0380 . 1 1042 208 208 ALA HA H 4.2808 . 1 1043 208 208 ALA HB H 1.3620 . 1 1044 208 208 ALA CA C 52.0845 . 1 1045 208 208 ALA CB C 19.0408 . 1 1046 208 208 ALA N N 124.1011 . 1 1047 209 209 GLN H H 8.1062 . 1 1048 209 209 GLN HG2 H 2.3214 . 2 1049 209 209 GLN HG3 H 2.3214 . 2 1050 209 209 GLN CA C 61.4738 . 1 1051 209 209 GLN CB C 32.0395 . 1 1052 209 209 GLN CG C 34.0120 . 1 1053 209 209 GLN N N 119.7852 . 1 1054 210 210 PRO HA H 4.3380 . 1 1055 210 210 PRO HG3 H 1.8498 . 2 1056 210 210 PRO HD2 H 3.6509 . 2 1057 210 210 PRO CA C 63.5384 . 1 1058 210 210 PRO CG C 27.1570 . 1 1059 210 210 PRO CD C 50.6672 . 1 1060 211 211 GLN H H 8.3670 . 1 1061 211 211 GLN HA H 4.3770 . 1 1062 211 211 GLN HB3 H 2.3694 . 2 1063 211 211 GLN HG2 H 2.3693 . 2 1064 211 211 GLN CA C 55.8588 . 1 1065 211 211 GLN CB C 29.5767 . 1 1066 211 211 GLN CG C 33.8640 . 1 1067 211 211 GLN N N 119.2838 . 1 1068 212 212 THR HB H 4.4090 . 1 1069 212 212 THR CB C 69.8898 . 1 1070 213 213 THR H H 8.2427 . 1 1071 213 213 THR CA C 61.2361 . 1 1072 213 213 THR CB C 69.0905 . 1 1073 213 213 THR N N 108.4872 . 1 1074 214 214 THR H H 8.1730 . 1 1075 214 214 THR CA C 59.4254 . 1 1076 214 214 THR CB C 69.2512 . 1 1077 214 214 THR N N 119.4323 . 1 1078 215 215 PRO HA H 4.3607 . 1 1079 215 215 PRO HB3 H 2.2094 . 2 1080 215 215 PRO HG2 H 1.9461 . 2 1081 215 215 PRO HD2 H 3.7543 . 2 1082 215 215 PRO CA C 63.3202 . 1 1083 215 215 PRO CB C 31.9177 . 1 1084 215 215 PRO CG C 26.9856 . 1 1085 215 215 PRO CD C 51.1073 . 1 1086 216 216 LEU H H 7.8999 . 1 1087 216 216 LEU CA C 52.2035 . 1 1088 216 216 LEU CB C 42.4506 . 1 1089 216 216 LEU N N 121.6049 . 1 1090 217 217 PRO HA H 4.3976 . 1 1091 217 217 PRO HB3 H 2.2844 . 2 1092 217 217 PRO HG3 H 1.9949 . 2 1093 217 217 PRO CA C 62.9844 . 1 1094 217 217 PRO CB C 31.9678 . 1 1095 217 217 PRO CG C 27.3905 . 1 1096 218 218 ALA H H 8.2494 . 1 1097 218 218 ALA HA H 4.3089 . 1 1098 218 218 ALA HB H 1.3537 . 1 1099 218 218 ALA CA C 52.3793 . 1 1100 218 218 ALA CB C 19.2449 . 1 1101 218 218 ALA N N 124.0439 . 1 1102 219 219 VAL H H 8.0354 . 1 1103 219 219 VAL HA H 4.1420 . 1 1104 219 219 VAL HB H 2.0800 . 1 1105 219 219 VAL HG2 H 0.9226 . 2 1106 219 219 VAL CA C 62.1022 . 1 1107 219 219 VAL CB C 32.9231 . 1 1108 219 219 VAL CG1 C 20.6836 . 2 1109 219 219 VAL CG2 C 20.6835 . 2 1110 219 219 VAL N N 118.8973 . 1 1111 220 220 SER H H 8.2602 . 1 1112 220 220 SER HA H 4.4350 . 1 1113 220 220 SER HB2 H 3.8330 . 2 1114 220 220 SER CA C 58.4363 . 1 1115 220 220 SER CB C 63.9383 . 1 1116 220 220 SER N N 119.0454 . 1 1117 221 221 GLY H H 8.3599 . 1 1118 221 221 GLY HA3 H 4.3028 . 2 1119 221 221 GLY CA C 45.2861 . 1 1120 221 221 GLY N N 110.9982 . 1 1121 222 222 SER H H 8.1552 . 1 1122 222 222 SER HA H 4.7632 . 1 1123 222 222 SER HB2 H 3.8072 . 2 1124 222 222 SER CA C 56.4071 . 1 1125 222 222 SER CB C 64.0900 . 1 1126 222 222 SER N N 115.5163 . 1 1127 223 223 PRO HA H 4.4173 . 1 1128 223 223 PRO HB2 H 2.2431 . 2 1129 223 223 PRO HG3 H 2.0010 . 2 1130 223 223 PRO HD2 H 3.8002 . 2 1131 223 223 PRO CA C 63.8049 . 1 1132 223 223 PRO CB C 32.0810 . 1 1133 223 223 PRO CG C 27.3813 . 1 1134 223 223 PRO CD C 50.7677 . 1 1135 224 224 GLY H H 8.3724 . 1 1136 224 224 GLY HA3 H 3.9750 . 2 1137 224 224 GLY CA C 45.1823 . 1 1138 224 224 GLY N N 109.1773 . 1 1139 225 225 ALA H H 7.9571 . 1 1140 225 225 ALA HB H 1.3791 . 1 1141 225 225 ALA CA C 51.8782 . 1 1142 225 225 ALA CB C 19.1686 . 1 1143 225 225 ALA N N 123.6245 . 1 1144 226 226 ALA H H 8.1662 . 1 1145 226 226 ALA HA H 4.3498 . 1 1146 226 226 ALA HB H 1.3548 . 1 1147 226 226 ALA CA C 52.5355 . 1 1148 226 226 ALA CB C 19.1709 . 1 1149 226 226 ALA N N 123.2087 . 1 1150 227 227 ILE H H 8.0335 . 1 1151 227 227 ILE HA H 4.1770 . 1 1152 227 227 ILE HB H 1.8362 . 1 1153 227 227 ILE HG12 H 1.4367 . 2 1154 227 227 ILE HD1 H 0.8333 . 1 1155 227 227 ILE CA C 61.0183 . 1 1156 227 227 ILE CB C 38.8716 . 1 1157 227 227 ILE CG1 C 27.2248 . 1 1158 227 227 ILE CD1 C 12.8868 . 1 1159 227 227 ILE N N 120.0823 . 1 1160 228 228 THR H H 7.7734 . 1 1161 228 228 THR HA H 4.1867 . 1 1162 228 228 THR HG2 H 1.1583 . 1 1163 228 228 THR CA C 57.6395 . 1 1164 228 228 THR CB C 69.9454 . 1 1165 228 228 THR CG2 C 26.7852 . 1 1166 228 228 THR N N 117.2009 . 1 1167 229 229 PRO HA H 4.4094 . 1 1168 229 229 PRO HB2 H 2.2580 . 2 1169 229 229 PRO HG2 H 1.9088 . 2 1170 229 229 PRO HD2 H 3.5899 . 2 1171 229 229 PRO CA C 62.8146 . 1 1172 229 229 PRO CB C 32.1794 . 1 1173 229 229 PRO CG C 27.3605 . 1 1174 229 229 PRO CD C 49.7929 . 1 1175 230 230 LEU H H 8.4585 . 1 1176 230 230 LEU HA H 4.5949 . 1 1177 230 230 LEU HB2 H 1.5900 . 2 1178 230 230 LEU HB3 H 1.5316 . 2 1179 230 230 LEU HG H 1.6981 . 1 1180 230 230 LEU HD1 H 0.9297 . 2 1181 230 230 LEU HD2 H 0.9057 . 2 1182 230 230 LEU CA C 53.0302 . 1 1183 230 230 LEU CB C 41.7250 . 1 1184 230 230 LEU CG C 27.0846 . 1 1185 230 230 LEU CD1 C 25.2388 . 2 1186 230 230 LEU CD2 C 23.4777 . 2 1187 230 230 LEU N N 123.5950 . 1 1188 231 231 PRO HA H 4.4244 . 1 1189 231 231 PRO HB2 H 2.2847 . 2 1190 231 231 PRO HB3 H 1.9031 . 2 1191 231 231 PRO HG2 H 2.0418 . 2 1192 231 231 PRO HD2 H 3.8157 . 2 1193 231 231 PRO HD3 H 3.6093 . 2 1194 231 231 PRO CA C 63.1438 . 1 1195 231 231 PRO CB C 32.0824 . 1 1196 231 231 PRO CG C 27.4094 . 1 1197 231 231 PRO CD C 42.8078 . 1 1198 232 232 SER H H 8.2730 . 1 1199 232 232 SER HA H 4.4918 . 1 1200 232 232 SER HB2 H 3.9133 . 2 1201 232 232 SER HB3 H 3.8021 . 2 1202 232 232 SER CA C 58.1524 . 1 1203 232 232 SER CB C 64.0171 . 1 1204 232 232 SER N N 115.1403 . 1 1205 233 233 THR H H 8.0934 . 1 1206 233 233 THR HA H 4.4028 . 1 1207 233 233 THR HB H 4.2642 . 1 1208 233 233 THR HG2 H 1.2152 . 1 1209 233 233 THR CA C 61.8895 . 1 1210 233 233 THR CB C 69.4507 . 1 1211 233 233 THR CG2 C 21.7268 . 1 1212 233 233 THR N N 115.1380 . 1 1213 234 234 GLN H H 8.2531 . 1 1214 234 234 GLN HA H 4.2951 . 1 1215 234 234 GLN HB3 H 1.9485 . 2 1216 234 234 GLN HG3 H 2.3020 . 2 1217 234 234 GLN CA C 56.3816 . 1 1218 234 234 GLN CB C 29.5055 . 1 1219 234 234 GLN CG C 33.7306 . 1 1220 234 234 GLN N N 122.0217 . 1 1221 235 235 ASN H H 8.3424 . 1 1222 235 235 ASN HA H 4.7751 . 1 1223 235 235 ASN HB2 H 2.8502 . 2 1224 235 235 ASN HB3 H 2.6861 . 2 1225 235 235 ASN CA C 53.1906 . 1 1226 235 235 ASN CB C 39.3071 . 1 1227 235 235 ASN N N 119.5896 . 1 1228 236 236 GLY H H 7.9327 . 1 1229 236 236 GLY HA2 H 4.1066 . 2 1230 236 236 GLY HA3 H 4.0527 . 2 1231 236 236 GLY CA C 44.7267 . 1 1232 236 236 GLY N N 109.4075 . 1 1233 237 237 PRO HA H 4.3978 . 1 1234 237 237 PRO HB2 H 1.9250 . 2 1235 237 237 PRO HB3 H 1.4304 . 2 1236 237 237 PRO HG3 H 1.9591 . 2 1237 237 237 PRO HD3 H 3.5875 . 2 1238 237 237 PRO CA C 62.8600 . 1 1239 237 237 PRO CB C 32.4171 . 1 1240 237 237 PRO CG C 27.1388 . 1 1241 238 238 VAL H H 7.9965 . 1 1242 238 238 VAL HA H 4.1950 . 1 1243 238 238 VAL HB H 1.9060 . 1 1244 238 238 VAL HG1 H 0.8713 . 2 1245 238 238 VAL HG2 H 0.8118 . 2 1246 238 238 VAL CA C 61.1728 . 1 1247 238 238 VAL CB C 34.3008 . 1 1248 238 238 VAL CG1 C 21.5727 . 2 1249 238 238 VAL CG2 C 21.4410 . 2 1250 238 238 VAL N N 120.5794 . 1 1251 239 239 PHE H H 8.9219 . 1 1252 239 239 PHE HA H 5.4877 . 1 1253 239 239 PHE HB2 H 2.7887 . 2 1254 239 239 PHE HB3 H 2.6453 . 2 1255 239 239 PHE CA C 57.0215 . 1 1256 239 239 PHE CB C 42.5091 . 1 1257 239 239 PHE N N 123.5412 . 1 1258 240 240 ALA H H 9.4007 . 1 1259 240 240 ALA HA H 5.2457 . 1 1260 240 240 ALA HB H 1.2228 . 1 1261 240 240 ALA CA C 50.2228 . 1 1262 240 240 ALA CB C 23.6723 . 1 1263 240 240 ALA N N 120.9096 . 1 1264 241 241 LYS H H 8.9345 . 1 1265 241 241 LYS HA H 5.3812 . 1 1266 241 241 LYS HB2 H 1.5465 . 2 1267 241 241 LYS HB3 H 1.3899 . 2 1268 241 241 LYS HG3 H 1.2783 . 2 1269 241 241 LYS HD2 H 1.4155 . 2 1270 241 241 LYS HD3 H 1.3684 . 2 1271 241 241 LYS HE2 H 2.5812 . 2 1272 241 241 LYS HE3 H 2.4089 . 2 1273 241 241 LYS CA C 53.6479 . 1 1274 241 241 LYS CB C 35.3872 . 1 1275 241 241 LYS CG C 24.8713 . 1 1276 241 241 LYS CD C 29.4877 . 1 1277 241 241 LYS CE C 41.6326 . 1 1278 241 241 LYS N N 121.2430 . 1 1279 242 242 ALA H H 9.3751 . 1 1280 242 242 ALA HA H 4.7769 . 1 1281 242 242 ALA HB H 1.4348 . 1 1282 242 242 ALA CA C 52.7217 . 1 1283 242 242 ALA CB C 19.2464 . 1 1284 242 242 ALA N N 126.8651 . 1 1285 243 243 ILE H H 8.9223 . 1 1286 243 243 ILE HA H 4.4539 . 1 1287 243 243 ILE HB H 2.1145 . 1 1288 243 243 ILE HG12 H 1.0088 . 2 1289 243 243 ILE HG13 H 0.6734 . 2 1290 243 243 ILE HG2 H 0.8524 . 1 1291 243 243 ILE HD1 H 0.7529 . 1 1292 243 243 ILE CA C 60.6129 . 1 1293 243 243 ILE CB C 39.2321 . 1 1294 243 243 ILE CG1 C 26.6841 . 1 1295 243 243 ILE CG2 C 19.1154 . 1 1296 243 243 ILE CD1 C 14.1557 . 1 1297 243 243 ILE N N 118.7871 . 1 1298 244 244 GLN H H 7.4385 . 1 1299 244 244 GLN HA H 4.2828 . 1 1300 244 244 GLN HB2 H 1.5070 . 2 1301 244 244 GLN HB3 H 1.4563 . 2 1302 244 244 GLN HG2 H 2.1372 . 2 1303 244 244 GLN CA C 54.7501 . 1 1304 244 244 GLN CB C 32.2624 . 1 1305 244 244 GLN CG C 33.4077 . 1 1306 244 244 GLN N N 121.6345 . 1 1307 245 245 LYS H H 8.3289 . 1 1308 245 245 LYS HA H 3.9621 . 1 1309 245 245 LYS HB2 H 1.8849 . 2 1310 245 245 LYS HB3 H 1.6901 . 2 1311 245 245 LYS HG2 H 1.6173 . 2 1312 245 245 LYS HG3 H 1.2810 . 2 1313 245 245 LYS HD3 H 1.7046 . 2 1314 245 245 LYS HE3 H 2.9712 . 2 1315 245 245 LYS CA C 56.4133 . 1 1316 245 245 LYS CB C 33.8215 . 1 1317 245 245 LYS CG C 24.9655 . 1 1318 245 245 LYS CD C 29.9141 . 1 1319 245 245 LYS CE C 41.9606 . 1 1320 245 245 LYS N N 124.3484 . 1 1321 246 246 ARG H H 9.2372 . 1 1322 246 246 ARG HA H 4.6618 . 1 1323 246 246 ARG HG2 H 1.4425 . 2 1324 246 246 ARG HG3 H 1.3705 . 2 1325 246 246 ARG HD3 H 2.7571 . 2 1326 246 246 ARG CA C 56.0061 . 1 1327 246 246 ARG CB C 32.9875 . 1 1328 246 246 ARG CG C 28.8598 . 1 1329 246 246 ARG CD C 42.3803 . 1 1330 246 246 ARG N N 127.1881 . 1 1331 247 247 VAL HA H 4.5185 . 1 1332 247 247 VAL HG1 H 0.9514 . 2 1333 247 247 VAL CA C 59.5588 . 1 1334 247 247 VAL CG1 C 20.7629 . 2 1335 248 248 PRO HA H 4.3292 . 1 1336 248 248 PRO HB3 H 1.9090 . 2 1337 248 248 PRO HG2 H 1.9840 . 2 1338 248 248 PRO HG3 H 1.4839 . 2 1339 248 248 PRO HD2 H 3.9064 . 2 1340 248 248 PRO HD3 H 3.7696 . 2 1341 248 248 PRO CA C 62.0637 . 1 1342 248 248 PRO CB C 33.0020 . 1 1343 248 248 PRO CG C 27.1695 . 1 1344 248 248 PRO CD C 51.0020 . 1 1345 249 249 CYS HA H 4.2599 . 1 1346 249 249 CYS HB2 H 2.3346 . 2 1347 249 249 CYS CA C 55.8865 . 1 1348 249 249 CYS CB C 34.1462 . 1 1349 250 250 ALA HA H 3.9271 . 1 1350 250 250 ALA HB H 1.2734 . 1 1351 250 250 ALA CA C 54.8812 . 1 1352 250 250 ALA CB C 18.4419 . 1 1353 251 251 TYR H H 7.0298 . 1 1354 251 251 TYR HA H 4.4905 . 1 1355 251 251 TYR HB2 H 3.1794 . 2 1356 251 251 TYR HB3 H 3.0860 . 2 1357 251 251 TYR CA C 56.7704 . 1 1358 251 251 TYR CB C 37.2076 . 1 1359 251 251 TYR N N 110.6805 . 1 1360 252 252 ASP H H 7.3341 . 1 1361 252 252 ASP HA H 4.7599 . 1 1362 252 252 ASP HB2 H 2.9251 . 2 1363 252 252 ASP HB3 H 2.1841 . 2 1364 252 252 ASP CA C 52.8070 . 1 1365 252 252 ASP CB C 40.4492 . 1 1366 252 252 ASP N N 121.8609 . 1 1367 253 253 LYS H H 8.3955 . 1 1368 253 253 LYS HA H 4.2652 . 1 1369 253 253 LYS HB3 H 1.8648 . 2 1370 253 253 LYS HG2 H 1.5712 . 2 1371 253 253 LYS HG3 H 1.5320 . 2 1372 253 253 LYS HD3 H 1.7146 . 2 1373 253 253 LYS HE3 H 3.0511 . 2 1374 253 253 LYS CA C 57.5980 . 1 1375 253 253 LYS CB C 32.1021 . 1 1376 253 253 LYS CG C 24.8997 . 1 1377 253 253 LYS CD C 28.7335 . 1 1378 253 253 LYS CE C 42.2672 . 1 1379 253 253 LYS N N 123.1657 . 1 1380 254 254 THR H H 8.2168 . 1 1381 254 254 THR HA H 4.5137 . 1 1382 254 254 THR HB H 4.4801 . 1 1383 254 254 THR HG2 H 1.2220 . 1 1384 254 254 THR CA C 61.5880 . 1 1385 254 254 THR CB C 69.8201 . 1 1386 254 254 THR CG2 C 21.9308 . 1 1387 254 254 THR N N 108.3586 . 1 1388 255 255 ALA H H 7.0978 . 1 1389 255 255 ALA HA H 4.5111 . 1 1390 255 255 ALA HB H 1.3135 . 1 1391 255 255 ALA CA C 51.9214 . 1 1392 255 255 ALA CB C 20.2959 . 1 1393 255 255 ALA N N 124.7727 . 1 1394 256 256 LEU H H 8.8933 . 1 1395 256 256 LEU HA H 4.3279 . 1 1396 256 256 LEU HB3 H 1.2710 . 2 1397 256 256 LEU HG H 1.4158 . 1 1398 256 256 LEU HD1 H 0.6338 . 2 1399 256 256 LEU HD2 H 0.9362 . 2 1400 256 256 LEU CA C 54.1024 . 1 1401 256 256 LEU CB C 44.6647 . 1 1402 256 256 LEU CG C 25.9395 . 1 1403 256 256 LEU CD1 C 25.6350 . 2 1404 256 256 LEU CD2 C 23.7211 . 2 1405 256 256 LEU N N 124.2911 . 1 1406 257 257 ALA H H 8.5324 . 1 1407 257 257 ALA HA H 4.4462 . 1 1408 257 257 ALA HB H 1.3813 . 1 1409 257 257 ALA CA C 51.7310 . 1 1410 257 257 ALA CB C 19.1396 . 1 1411 257 257 ALA N N 129.6048 . 1 1412 258 258 LEU H H 8.5020 . 1 1413 258 258 LEU HA H 4.7826 . 1 1414 258 258 LEU HB3 H 1.3712 . 2 1415 258 258 LEU HG H 1.3945 . 1 1416 258 258 LEU HD1 H 0.4848 . 2 1417 258 258 LEU HD2 H 0.5215 . 2 1418 258 258 LEU CA C 53.7476 . 1 1419 258 258 LEU CB C 46.4154 . 1 1420 258 258 LEU CG C 25.9672 . 1 1421 258 258 LEU CD1 C 25.3026 . 2 1422 258 258 LEU CD2 C 24.2401 . 2 1423 258 258 LEU N N 119.3140 . 1 1424 259 259 GLU H H 8.9470 . 1 1425 259 259 GLU HA H 4.4369 . 1 1426 259 259 GLU HB2 H 1.9168 . 2 1427 259 259 GLU HB3 H 1.7425 . 2 1428 259 259 GLU HG2 H 2.3352 . 2 1429 259 259 GLU HG3 H 2.1598 . 2 1430 259 259 GLU CA C 53.5555 . 1 1431 259 259 GLU CB C 31.1991 . 1 1432 259 259 GLU CG C 35.7450 . 1 1433 259 259 GLU N N 123.8401 . 1 1434 260 260 VAL H H 8.9501 . 1 1435 260 260 VAL HA H 2.9246 . 1 1436 260 260 VAL HB H 1.8138 . 1 1437 260 260 VAL HG1 H 0.7563 . 2 1438 260 260 VAL HG2 H 0.8298 . 2 1439 260 260 VAL CA C 65.9709 . 1 1440 260 260 VAL CB C 30.7883 . 1 1441 260 260 VAL CG1 C 22.8211 . 2 1442 260 260 VAL CG2 C 22.0302 . 2 1443 260 260 VAL N N 122.1423 . 1 1444 261 261 GLY H H 8.8000 . 1 1445 261 261 GLY HA2 H 4.4858 . 2 1446 261 261 GLY HA3 H 3.3863 . 2 1447 261 261 GLY CA C 44.6700 . 1 1448 261 261 GLY N N 116.0068 . 1 1449 262 262 ASP H H 8.1803 . 1 1450 262 262 ASP HA H 4.4097 . 1 1451 262 262 ASP HB2 H 2.6233 . 2 1452 262 262 ASP HB3 H 2.3362 . 2 1453 262 262 ASP CA C 55.9890 . 1 1454 262 262 ASP CB C 41.8192 . 1 1455 262 262 ASP N N 121.9622 . 1 1456 263 263 ILE H H 8.4612 . 1 1457 263 263 ILE HA H 4.6915 . 1 1458 263 263 ILE HB H 2.0129 . 1 1459 263 263 ILE HG12 H 1.6729 . 2 1460 263 263 ILE HG13 H 1.2953 . 2 1461 263 263 ILE HG2 H 1.0489 . 1 1462 263 263 ILE HD1 H 0.8237 . 1 1463 263 263 ILE CA C 60.1061 . 1 1464 263 263 ILE CB C 36.9870 . 1 1465 263 263 ILE CG1 C 27.5487 . 1 1466 263 263 ILE CG2 C 17.8260 . 1 1467 263 263 ILE CD1 C 11.7214 . 1 1468 263 263 ILE N N 121.4740 . 1 1469 264 264 VAL H H 9.4751 . 1 1470 264 264 VAL HA H 4.3378 . 1 1471 264 264 VAL HB H 1.7056 . 1 1472 264 264 VAL HG1 H 0.5011 . 2 1473 264 264 VAL HG2 H 0.4404 . 2 1474 264 264 VAL CA C 60.1193 . 1 1475 264 264 VAL CB C 34.5405 . 1 1476 264 264 VAL CG1 C 21.2102 . 2 1477 264 264 VAL CG2 C 20.9350 . 2 1478 264 264 VAL N N 128.7392 . 1 1479 265 265 LYS H H 8.7140 . 1 1480 265 265 LYS HA H 4.3431 . 1 1481 265 265 LYS HB2 H 1.8457 . 2 1482 265 265 LYS HB3 H 1.7925 . 2 1483 265 265 LYS HG3 H 0.8956 . 2 1484 265 265 LYS HD2 H 1.5845 . 2 1485 265 265 LYS HE3 H 2.8081 . 2 1486 265 265 LYS CA C 55.5493 . 1 1487 265 265 LYS CB C 33.1480 . 1 1488 265 265 LYS CG C 24.9950 . 1 1489 265 265 LYS CD C 29.5547 . 1 1490 265 265 LYS CE C 42.0044 . 1 1491 265 265 LYS N N 128.1276 . 1 1492 266 266 VAL H H 9.0766 . 1 1493 266 266 VAL HA H 4.3156 . 1 1494 266 266 VAL HB H 2.0262 . 1 1495 266 266 VAL HG1 H 1.0880 . 2 1496 266 266 VAL HG2 H 0.7324 . 2 1497 266 266 VAL CA C 63.6484 . 1 1498 266 266 VAL CB C 31.4990 . 1 1499 266 266 VAL CG1 C 22.0653 . 2 1500 266 266 VAL CG2 C 22.2839 . 2 1501 266 266 VAL N N 129.6024 . 1 1502 267 267 THR H H 9.1307 . 1 1503 267 267 THR HA H 4.2967 . 1 1504 267 267 THR HB H 4.1772 . 1 1505 267 267 THR HG2 H 1.0667 . 1 1506 267 267 THR CA C 62.5743 . 1 1507 267 267 THR CB C 68.7073 . 1 1508 267 267 THR CG2 C 22.5551 . 1 1509 267 267 THR N N 120.0143 . 1 1510 268 268 ARG H H 7.6368 . 1 1511 268 268 ARG HA H 4.2570 . 1 1512 268 268 ARG HB2 H 1.7239 . 2 1513 268 268 ARG HB3 H 1.6018 . 2 1514 268 268 ARG HG2 H 1.4799 . 2 1515 268 268 ARG HG3 H 1.4198 . 2 1516 268 268 ARG HD2 H 3.1556 . 2 1517 268 268 ARG HD3 H 3.1203 . 2 1518 268 268 ARG CA C 57.1167 . 1 1519 268 268 ARG CB C 33.8289 . 1 1520 268 268 ARG CG C 27.3924 . 1 1521 268 268 ARG CD C 43.5471 . 1 1522 268 268 ARG N N 120.8693 . 1 1523 269 269 MET H H 8.5324 . 1 1524 269 269 MET HA H 3.1955 . 1 1525 269 269 MET HB2 H 1.2990 . 2 1526 269 269 MET HG2 H 1.3796 . 2 1527 269 269 MET HG3 H 0.1429 . 2 1528 269 269 MET HE H 1.5354 . 1 1529 269 269 MET CA C 53.9702 . 1 1530 269 269 MET CB C 32.6762 . 1 1531 269 269 MET CG C 31.3788 . 1 1532 269 269 MET CE C 17.2285 . 1 1533 269 269 MET N N 125.4434 . 1 1534 270 270 ASN H H 6.6391 . 1 1535 270 270 ASN HA H 4.6340 . 1 1536 270 270 ASN HB2 H 2.9169 . 2 1537 270 270 ASN HB3 H 2.8082 . 2 1538 270 270 ASN CA C 53.6441 . 1 1539 270 270 ASN CB C 39.8447 . 1 1540 270 270 ASN N N 119.1182 . 1 1541 271 271 ILE H H 8.5425 . 1 1542 271 271 ILE HA H 4.1080 . 1 1543 271 271 ILE HB H 1.9207 . 1 1544 271 271 ILE HG12 H 1.3952 . 2 1545 271 271 ILE HG13 H 1.2520 . 2 1546 271 271 ILE HG2 H 0.9399 . 1 1547 271 271 ILE HD1 H 0.8325 . 1 1548 271 271 ILE CA C 62.6044 . 1 1549 271 271 ILE CB C 38.1980 . 1 1550 271 271 ILE CG1 C 27.5898 . 1 1551 271 271 ILE CG2 C 17.8026 . 1 1552 271 271 ILE CD1 C 13.6909 . 1 1553 271 271 ILE N N 122.5169 . 1 1554 272 272 ASN HA H 4.5265 . 1 1555 272 272 ASN HB2 H 3.0759 . 2 1556 272 272 ASN HB3 H 2.8382 . 2 1557 272 272 ASN CA C 53.2255 . 1 1558 272 272 ASN CB C 37.5653 . 1 1559 273 273 GLY H H 8.0866 . 1 1560 273 273 GLY HA2 H 4.2544 . 2 1561 273 273 GLY HA3 H 3.6706 . 2 1562 273 273 GLY CA C 45.6350 . 1 1563 273 273 GLY N N 107.0746 . 1 1564 274 274 GLN H H 8.0466 . 1 1565 274 274 GLN HA H 4.5506 . 1 1566 274 274 GLN HB3 H 1.9400 . 2 1567 274 274 GLN HG2 H 2.2193 . 2 1568 274 274 GLN HG3 H 1.9456 . 2 1569 274 274 GLN CA C 54.5557 . 1 1570 274 274 GLN CB C 28.5720 . 1 1571 274 274 GLN CG C 33.6980 . 1 1572 274 274 GLN N N 120.6889 . 1 1573 275 275 TRP H H 8.4787 . 1 1574 275 275 TRP HA H 4.8526 . 1 1575 275 275 TRP HB2 H 2.8281 . 2 1576 275 275 TRP CA C 54.4540 . 1 1577 275 275 TRP CB C 32.0686 . 1 1578 275 275 TRP N N 125.5268 . 1 1579 276 276 GLU H H 8.6473 . 1 1580 276 276 GLU HA H 5.1897 . 1 1581 276 276 GLU HB2 H 2.0290 . 2 1582 276 276 GLU HB3 H 1.7192 . 2 1583 276 276 GLU HG2 H 2.1724 . 2 1584 276 276 GLU HG3 H 2.0705 . 2 1585 276 276 GLU CA C 54.2878 . 1 1586 276 276 GLU CB C 33.6426 . 1 1587 276 276 GLU CG C 37.2718 . 1 1588 276 276 GLU N N 119.0521 . 1 1589 277 277 GLY H H 9.0757 . 1 1590 277 277 GLY HA2 H 5.1468 . 2 1591 277 277 GLY HA3 H 4.1082 . 2 1592 277 277 GLY CA C 46.7232 . 1 1593 277 277 GLY N N 111.4461 . 1 1594 278 278 GLU H H 8.8179 . 1 1595 278 278 GLU HA H 5.7610 . 1 1596 278 278 GLU HB2 H 1.9673 . 2 1597 278 278 GLU HB3 H 1.8637 . 2 1598 278 278 GLU HG2 H 2.1280 . 2 1599 278 278 GLU HG3 H 2.0756 . 2 1600 278 278 GLU CA C 54.1314 . 1 1601 278 278 GLU CB C 34.5340 . 1 1602 278 278 GLU CG C 36.2625 . 1 1603 278 278 GLU N N 117.7738 . 1 1604 279 279 VAL H H 8.8805 . 1 1605 279 279 VAL HA H 4.4566 . 1 1606 279 279 VAL HB H 1.9754 . 1 1607 279 279 VAL HG1 H 0.9183 . 2 1608 279 279 VAL HG2 H 0.9147 . 2 1609 279 279 VAL CA C 61.4001 . 1 1610 279 279 VAL CB C 34.6737 . 1 1611 279 279 VAL CG1 C 20.3996 . 2 1612 279 279 VAL CG2 C 22.5123 . 2 1613 279 279 VAL N N 123.8435 . 1 1614 280 280 ASN H H 9.3255 . 1 1615 280 280 ASN HA H 4.4264 . 1 1616 280 280 ASN HB2 H 3.1109 . 2 1617 280 280 ASN HB3 H 2.7662 . 2 1618 280 280 ASN CA C 54.4150 . 1 1619 280 280 ASN CB C 37.8881 . 1 1620 280 280 ASN N N 126.0592 . 1 1621 281 281 GLY H H 8.7651 . 1 1622 281 281 GLY HA2 H 4.1968 . 2 1623 281 281 GLY HA3 H 3.6440 . 2 1624 281 281 GLY CA C 45.6383 . 1 1625 281 281 GLY N N 104.6507 . 1 1626 282 282 ARG H H 8.1446 . 1 1627 282 282 ARG HA H 4.5873 . 1 1628 282 282 ARG HB2 H 1.9532 . 2 1629 282 282 ARG HB3 H 1.8081 . 2 1630 282 282 ARG HG2 H 1.6735 . 2 1631 282 282 ARG HG3 H 1.6252 . 2 1632 282 282 ARG HD2 H 3.3104 . 2 1633 282 282 ARG CA C 55.2713 . 1 1634 282 282 ARG CB C 31.7573 . 1 1635 282 282 ARG CG C 27.9159 . 1 1636 282 282 ARG CD C 43.4211 . 1 1637 282 282 ARG N N 122.5777 . 1 1638 283 283 LYS H H 8.4226 . 1 1639 283 283 LYS HA H 5.5639 . 1 1640 283 283 LYS HB2 H 1.8322 . 2 1641 283 283 LYS HB3 H 1.7012 . 2 1642 283 283 LYS HG2 H 1.3940 . 2 1643 283 283 LYS HG3 H 1.3795 . 2 1644 283 283 LYS HD3 H 1.6390 . 2 1645 283 283 LYS HE3 H 2.9033 . 2 1646 283 283 LYS CA C 54.6926 . 1 1647 283 283 LYS CB C 36.0401 . 1 1648 283 283 LYS CG C 24.8599 . 1 1649 283 283 LYS CD C 29.5749 . 1 1650 283 283 LYS CE C 42.0559 . 1 1651 283 283 LYS N N 121.6500 . 1 1652 284 284 GLY HA2 H 4.2358 . 2 1653 284 284 GLY HA3 H 4.1271 . 2 1654 284 284 GLY CA C 46.0108 . 1 1655 285 285 LEU H H 8.7231 . 1 1656 285 285 LEU HA H 5.7178 . 1 1657 285 285 LEU HB2 H 1.6590 . 2 1658 285 285 LEU HB3 H 1.3511 . 2 1659 285 285 LEU HG H 1.7129 . 1 1660 285 285 LEU HD1 H 0.8336 . 2 1661 285 285 LEU HD2 H 0.7326 . 2 1662 285 285 LEU CA C 53.6557 . 1 1663 285 285 LEU CB C 44.8132 . 1 1664 285 285 LEU CG C 27.7561 . 1 1665 285 285 LEU CD1 C 25.3785 . 2 1666 285 285 LEU CD2 C 23.7915 . 2 1667 285 285 LEU N N 119.6788 . 1 1668 286 286 PHE H H 9.1281 . 1 1669 286 286 PHE HA H 4.9908 . 1 1670 286 286 PHE HB2 H 3.0390 . 2 1671 286 286 PHE CA C 55.3625 . 1 1672 286 286 PHE CB C 38.7871 . 1 1673 286 286 PHE N N 118.8360 . 1 1674 287 287 PRO HA H 4.7568 . 1 1675 287 287 PRO HB2 H 1.9076 . 2 1676 287 287 PRO HG2 H 1.6029 . 2 1677 287 287 PRO HD2 H 3.5588 . 2 1678 287 287 PRO HD3 H 3.1434 . 2 1679 287 287 PRO CA C 61.4159 . 1 1680 287 287 PRO CB C 31.7175 . 1 1681 287 287 PRO CG C 27.0486 . 1 1682 287 287 PRO CD C 50.1930 . 1 1683 288 288 PHE HA H 3.3837 . 1 1684 288 288 PHE CA C 59.4745 . 1 1685 288 288 PHE CB C 34.9870 . 1 1686 289 289 THR H H 6.4731 . 1 1687 289 289 THR HA H 3.5893 . 1 1688 289 289 THR HB H 4.1466 . 1 1689 289 289 THR HG2 H 0.6703 . 1 1690 289 289 THR CA C 62.2426 . 1 1691 289 289 THR CB C 69.4848 . 1 1692 289 289 THR CG2 C 21.9356 . 1 1693 289 289 THR N N 107.9548 . 1 1694 290 290 HIS H H 7.8412 . 1 1695 290 290 HIS HA H 4.1960 . 1 1696 290 290 HIS HB2 H 3.5023 . 2 1697 290 290 HIS HB3 H 2.8785 . 2 1698 290 290 HIS CA C 57.6353 . 1 1699 290 290 HIS CB C 30.3291 . 1 1700 290 290 HIS N N 119.2281 . 1 1701 291 291 VAL H H 7.5748 . 1 1702 291 291 VAL HA H 5.4320 . 1 1703 291 291 VAL HB H 1.9156 . 1 1704 291 291 VAL HG1 H 0.9093 . 2 1705 291 291 VAL HG2 H 0.5055 . 2 1706 291 291 VAL CA C 58.3009 . 1 1707 291 291 VAL CB C 36.1236 . 1 1708 291 291 VAL CG1 C 18.8462 . 2 1709 291 291 VAL CG2 C 21.4477 . 2 1710 291 291 VAL N N 110.1797 . 1 1711 292 292 LYS H H 8.7432 . 1 1712 292 292 LYS HA H 4.8572 . 1 1713 292 292 LYS HB2 H 1.7145 . 2 1714 292 292 LYS HG3 H 1.4777 . 2 1715 292 292 LYS HD3 H 1.7425 . 2 1716 292 292 LYS HE3 H 2.9952 . 2 1717 292 292 LYS CA C 54.6474 . 1 1718 292 292 LYS CB C 36.0657 . 1 1719 292 292 LYS CG C 24.7059 . 1 1720 292 292 LYS CD C 29.3711 . 1 1721 292 292 LYS CE C 42.2900 . 1 1722 292 292 LYS N N 119.4257 . 1 1723 293 293 ILE H H 9.1078 . 1 1724 293 293 ILE HA H 4.5087 . 1 1725 293 293 ILE HB H 1.9658 . 1 1726 293 293 ILE HG12 H 1.9118 . 2 1727 293 293 ILE HG2 H 1.1120 . 1 1728 293 293 ILE HD1 H 1.0629 . 1 1729 293 293 ILE CA C 62.5634 . 1 1730 293 293 ILE CB C 38.0757 . 1 1731 293 293 ILE CG1 C 28.7876 . 1 1732 293 293 ILE CG2 C 17.5080 . 1 1733 293 293 ILE CD1 C 12.8948 . 1 1734 293 293 ILE N N 128.6896 . 1 1735 294 294 PHE H H 8.7172 . 1 1736 294 294 PHE HA H 4.8978 . 1 1737 294 294 PHE HB3 H 3.1434 . 2 1738 294 294 PHE CA C 56.3353 . 1 1739 294 294 PHE CB C 41.8716 . 1 1740 294 294 PHE N N 126.6394 . 1 1741 295 295 ASP H H 8.4130 . 1 1742 295 295 ASP HA H 4.9799 . 1 1743 295 295 ASP HB3 H 2.5521 . 2 1744 295 295 ASP CA C 51.1095 . 1 1745 295 295 ASP CB C 42.1565 . 1 1746 295 295 ASP N N 122.9719 . 1 1747 296 296 PRO HA H 4.4145 . 1 1748 296 296 PRO HB2 H 2.1050 . 2 1749 296 296 PRO HD2 H 3.8398 . 2 1750 296 296 PRO HD3 H 3.5651 . 2 1751 296 296 PRO CA C 63.5472 . 1 1752 296 296 PRO CB C 32.1181 . 1 1753 296 296 PRO CD C 50.9172 . 1 1754 297 297 GLN H H 8.5172 . 1 1755 297 297 GLN HA H 4.2735 . 1 1756 297 297 GLN HB3 H 2.0457 . 2 1757 297 297 GLN HG2 H 2.3390 . 2 1758 297 297 GLN CA C 56.4270 . 1 1759 297 297 GLN CB C 29.2924 . 1 1760 297 297 GLN CG C 33.8178 . 1 1761 297 297 GLN N N 120.7004 . 1 1762 298 298 ASN HA H 4.9869 . 1 1763 298 298 ASN CA C 50.9478 . 1 1764 299 299 PRO CA C 63.4056 . 1 1765 299 299 PRO CB C 31.4206 . 1 1766 300 300 ASP H H 8.2431 . 1 1767 300 300 ASP CA C 54.1780 . 1 1768 300 300 ASP CB C 40.6614 . 1 1769 300 300 ASP N N 119.5290 . 1 1770 301 301 GLU H H 8.0735 . 1 1771 301 301 GLU CA C 56.1876 . 1 1772 301 301 GLU CB C 29.5067 . 1 1773 301 301 GLU N N 120.4431 . 1 stop_ save_