data_17686 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of the RMM-CTD domains of human LINE-1 ORF1p ; _BMRB_accession_number 17686 _BMRB_flat_file_name bmr17686.str _Entry_type original _Submission_date 2011-06-03 _Accession_date 2011-06-03 _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 Coles Murray . . 2 Truffault Vincent . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 1038 "13C chemical shifts" 697 "15N chemical shifts" 153 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2012-02-22 original author . stop_ _Original_release_date 2012-02-22 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Trimeric structure and flexibility of the L1ORF1 protein in human L1 retrotransposition.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 21822284 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Khazina Elena . . 2 Truffault Vincent . . 3 Buttner Regina . . 4 Schmidt Steffen . . 5 Coles Murray . . 6 Weichenrieder Oliver . . stop_ _Journal_abbreviation 'Nat. Struct. Mol. Biol.' _Journal_name_full 'Nature structural & molecular biology' _Journal_volume 18 _Journal_issue 9 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 1006 _Page_last 1014 _Year 2011 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name L1ORF1p _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label L1ORF1p $L1ORF1p 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_L1ORF1p _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common L1ORF1p _Molecular_mass 20688.154 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 182 _Mol_residue_sequence ; MGNLRLIGVPESDVENGTKL ENTLQDIIQENFPNLARQAN VQIQEIQRTPQRYSSRRATP RHIIVRFTKVEMKEKMLRAA REKGRVTLKGKPIRLTVDLS AETLQARREWGPIFNILKEK NFQPRISYPAKLSFISEGEI KYFIDKQMLRDFVTTRPALK ELLKEALNMERNNRYQHHHH HH ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 155 MET 2 156 GLY 3 157 ASN 4 158 LEU 5 159 ARG 6 160 LEU 7 161 ILE 8 162 GLY 9 163 VAL 10 164 PRO 11 165 GLU 12 166 SER 13 167 ASP 14 168 VAL 15 169 GLU 16 170 ASN 17 171 GLY 18 172 THR 19 173 LYS 20 174 LEU 21 175 GLU 22 176 ASN 23 177 THR 24 178 LEU 25 179 GLN 26 180 ASP 27 181 ILE 28 182 ILE 29 183 GLN 30 184 GLU 31 185 ASN 32 186 PHE 33 187 PRO 34 188 ASN 35 189 LEU 36 190 ALA 37 191 ARG 38 192 GLN 39 193 ALA 40 194 ASN 41 195 VAL 42 196 GLN 43 197 ILE 44 198 GLN 45 199 GLU 46 200 ILE 47 201 GLN 48 202 ARG 49 203 THR 50 204 PRO 51 205 GLN 52 206 ARG 53 207 TYR 54 208 SER 55 209 SER 56 210 ARG 57 211 ARG 58 212 ALA 59 213 THR 60 214 PRO 61 215 ARG 62 216 HIS 63 217 ILE 64 218 ILE 65 219 VAL 66 220 ARG 67 221 PHE 68 222 THR 69 223 LYS 70 224 VAL 71 225 GLU 72 226 MET 73 227 LYS 74 228 GLU 75 229 LYS 76 230 MET 77 231 LEU 78 232 ARG 79 233 ALA 80 234 ALA 81 235 ARG 82 236 GLU 83 237 LYS 84 238 GLY 85 239 ARG 86 240 VAL 87 241 THR 88 242 LEU 89 243 LYS 90 244 GLY 91 245 LYS 92 246 PRO 93 247 ILE 94 248 ARG 95 249 LEU 96 250 THR 97 251 VAL 98 252 ASP 99 253 LEU 100 254 SER 101 255 ALA 102 256 GLU 103 257 THR 104 258 LEU 105 259 GLN 106 260 ALA 107 261 ARG 108 262 ARG 109 263 GLU 110 264 TRP 111 265 GLY 112 266 PRO 113 267 ILE 114 268 PHE 115 269 ASN 116 270 ILE 117 271 LEU 118 272 LYS 119 273 GLU 120 274 LYS 121 275 ASN 122 276 PHE 123 277 GLN 124 278 PRO 125 279 ARG 126 280 ILE 127 281 SER 128 282 TYR 129 283 PRO 130 284 ALA 131 285 LYS 132 286 LEU 133 287 SER 134 288 PHE 135 289 ILE 136 290 SER 137 291 GLU 138 292 GLY 139 293 GLU 140 294 ILE 141 295 LYS 142 296 TYR 143 297 PHE 144 298 ILE 145 299 ASP 146 300 LYS 147 301 GLN 148 302 MET 149 303 LEU 150 304 ARG 151 305 ASP 152 306 PHE 153 307 VAL 154 308 THR 155 309 THR 156 310 ARG 157 311 PRO 158 312 ALA 159 313 LEU 160 314 LYS 161 315 GLU 162 316 LEU 163 317 LEU 164 318 LYS 165 319 GLU 166 320 ALA 167 321 LEU 168 322 ASN 169 323 MET 170 324 GLU 171 325 ARG 172 326 ASN 173 327 ASN 174 328 ARG 175 329 TYR 176 330 GLN 177 331 HIS 178 332 HIS 179 333 HIS 180 334 HIS 181 335 HIS 182 336 HIS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-08-26 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 2LDY "Solution Structure Of The Rmm-Ctd Domains Of Human Line-1 Orf1p" 100.00 182 100.00 100.00 7.33e-130 PDB 2W7A "Structure Of The Human Line-1 Orf1p Central Domain" 53.30 100 97.94 97.94 9.48e-59 PDB 2YKO "Structure Of The Human Line-1 Orf1p Trimer" 98.90 233 97.78 97.78 1.23e-123 PDB 2YKP "Structure Of The Human Line-1 Orf1p Trimer" 98.90 229 97.78 97.78 3.99e-122 PDB 2YKQ "Structure Of The Human Line-1 Orf1p Trimer" 93.41 229 97.65 97.65 1.19e-113 EMBL CJZ86355 "L1 transposable element [Streptococcus pneumoniae]" 95.60 262 98.28 98.28 1.03e-118 GB AAB59367 "ORF1 codes for a 40 kDa product [Homo sapiens]" 98.35 338 97.77 98.32 1.52e-121 GB AAC51262 "p40 [Homo sapiens]" 98.35 338 97.21 97.77 6.46e-121 GB AAC51278 "p40 [Homo sapiens]" 98.35 338 97.21 97.77 6.12e-121 GB AAD39214 "unknown [Homo sapiens]" 98.35 338 97.21 97.77 6.61e-121 GB AAL50636 "unknown [Homo sapiens]" 98.35 338 97.21 97.77 5.92e-121 PRF 1901303A "Leu zipper protein p40" 98.35 338 97.21 97.77 1.76e-120 SP Q9UN81 "RecName: Full=LINE-1 retrotransposable element ORF1 protein; Short=L1ORF1p; AltName: Full=LINE retrotransposable element 1; Alt" 98.35 338 97.21 97.77 6.61e-121 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $L1ORF1p 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 _Variant _Vector_name $L1ORF1p 'recombinant technology' . Escherichia coli BL21(DE3) Rosetta2 'pET 15b' stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_RMM_15N _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $L1ORF1p 0.6 mM '[U-100% 15N]' Tris 5 mM 'natural abundance' 'sodium chloride' 300 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_RMM_13C_15N _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $L1ORF1p 0.8 mM '[U-100% 13C; U-100% 15N]' Tris 5 mM 'natural abundance' 'sodium chloride' 300 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_CTD_15N _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $L1ORF1p 0.8 mM '[U-100% 15N]' Tris 5 mM 'natural abundance' 'sodium chloride' 300 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_CTD_13C_15N _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $L1ORF1p 0.8 mM '[U-100% 13C; U-100% 15N]' Tris 5 mM 'natural abundance' 'sodium chloride' 300 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_RMMCTD_15N _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $L1ORF1p 0.8 mM '[U-100% 15N]' Tris 5 mM 'natural abundance' 'sodium chloride' 300 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_RMMCTD_13C_15N _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $L1ORF1p 0.8 mM '[U-100% 13C; U-100% 15N]' Tris 5 mM 'natural abundance' 'sodium chloride' 300 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection processing stop_ _Details . save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version 3.113 loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' stop_ _Details . save_ save_X-PLOR_NIH _Saveframe_category software _Name 'X-PLOR NIH' _Version 2.21 loop_ _Vendor _Address _Electronic_address 'Schwieters, Kuszewski, Tjandra and Clore' . . stop_ loop_ _Task refinement 'structure solution' 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 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_1H-15N_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $RMM_15N save_ save_3D_1H-13C_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $RMM_13C_15N save_ save_3D_CNH-NOESY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CNH-NOESY' _Sample_label $RMM_13C_15N save_ save_3D_NNH-NOESY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D NNH-NOESY' _Sample_label $RMM_15N save_ save_3D_HNCACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $RMM_13C_15N save_ save_3D_HBHA(CO)NH_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $RMM_13C_15N save_ save_3D_C(CO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $RMM_13C_15N save_ save_3D_CCH-TOCSY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CCH-TOCSY' _Sample_label $RMM_13C_15N save_ save_3D_HNCO_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $RMM_13C_15N save_ save_2D_15N-filtered_1H-1H_NOESY_10 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 15N-filtered 1H-1H NOESY' _Sample_label $RMM_15N save_ save_3D_1H-15N_NOESY_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $CTD_15N save_ save_3D_1H-13C_NOESY_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $CTD_13C_15N save_ save_3D_CNH-NOESY_13 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CNH-NOESY' _Sample_label $CTD_13C_15N save_ save_3D_NNH-NOESY_14 _Saveframe_category NMR_applied_experiment _Experiment_name '3D NNH-NOESY' _Sample_label $CTD_15N save_ save_3D_CCH-NOESY_15 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CCH-NOESY' _Sample_label $CTD_13C_15N save_ save_3D_HNCACB_16 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $CTD_13C_15N save_ save_3D_CBCA(CO)NH_17 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $CTD_13C_15N save_ save_3D_C(CO)NH_18 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $CTD_13C_15N save_ save_3D_CCH-TOCSY_19 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CCH-TOCSY' _Sample_label $CTD_13C_15N save_ save_3D_HNCO_20 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $CTD_13C_15N save_ save_2D_15N-filtered_1H-1H_NOESY_21 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 15N-filtered 1H-1H NOESY' _Sample_label $CTD_15N save_ save_3D_1H-15N_NOESY_22 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $RMMCTD_15N save_ save_3D_1H-13C_NOESY_23 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $RMMCTD_13C_15N save_ save_3D_CNH-NOESY_24 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CNH-NOESY' _Sample_label $RMMCTD_13C_15N save_ save_3D_NNH-NOESY_25 _Saveframe_category NMR_applied_experiment _Experiment_name '3D NNH-NOESY' _Sample_label $RMMCTD_15N save_ save_3D_CCH-NOESY_26 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CCH-NOESY' _Sample_label $RMMCTD_13C_15N save_ save_3D_HNCACB_27 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $RMMCTD_13C_15N save_ save_3D_CBCA(CO)NH_28 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $RMMCTD_13C_15N save_ save_3D_C(CO)NH_29 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $RMMCTD_13C_15N save_ save_3D_CCH-TOCSY_30 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CCH-TOCSY' _Sample_label $RMMCTD_13C_15N save_ save_3D_HNCO_31 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $RMMCTD_13C_15N save_ save_2D_15N-filtered_1H-1H_NOESY_32 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 15N-filtered 1H-1H NOESY' _Sample_label $RMMCTD_15N 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' 300 . mM pH 8.0 . pH pressure 1 . atm temperature 291 . 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 2.6 na indirect . . . 0.25144953 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0 na indirect . . . 0.10132912 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D HNCACB' '3D CBCA(CO)NH' '3D C(CO)NH' '3D CCH-TOCSY' '3D HNCO' stop_ loop_ _Sample_label $RMMCTD_13C_15N stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name L1ORF1p _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 1 156 2 GLY HA2 H 3.83 0.02 2 2 156 2 GLY HA3 H 3.93 0.02 2 3 156 2 GLY CA C 45.27 0.05 1 4 157 3 ASN HA H 5.12 0.02 1 5 157 3 ASN HB2 H 2.47 0.02 2 6 157 3 ASN HB3 H 2.63 0.02 2 7 157 3 ASN C C 175.25 0.05 1 8 157 3 ASN CA C 52.68 0.05 1 9 157 3 ASN CB C 40.27 0.05 1 10 158 4 LEU H H 8.76 0.02 1 11 158 4 LEU HA H 4.63 0.02 1 12 158 4 LEU HB2 H 1.44 0.02 2 13 158 4 LEU HB3 H 1.70 0.02 2 14 158 4 LEU HG H 1.63 0.02 1 15 158 4 LEU HD1 H 0.86 0.02 1 16 158 4 LEU HD2 H 0.84 0.02 1 17 158 4 LEU CA C 54.78 0.05 1 18 158 4 LEU CB C 44.39 0.05 1 19 158 4 LEU CG C 26.89 0.05 1 20 158 4 LEU CD1 C 26.45 0.05 1 21 158 4 LEU CD2 C 25.38 0.05 1 22 158 4 LEU N N 120.76 0.05 1 23 159 5 ARG HA H 5.33 0.02 1 24 159 5 ARG HB2 H 1.41 0.02 1 25 159 5 ARG HB3 H 1.41 0.02 1 26 159 5 ARG HG2 H 1.01 0.02 2 27 159 5 ARG HG3 H 1.29 0.02 2 28 159 5 ARG HD2 H 2.84 0.02 2 29 159 5 ARG HD3 H 3.29 0.02 2 30 159 5 ARG C C 174.33 0.05 1 31 159 5 ARG CA C 54.02 0.05 1 32 159 5 ARG CB C 33.45 0.05 1 33 159 5 ARG CG C 28.06 0.05 1 34 159 5 ARG CD C 43.39 0.05 1 35 160 6 LEU H H 9.36 0.02 1 36 160 6 LEU HA H 5.05 0.02 1 37 160 6 LEU HB2 H 1.07 0.02 2 38 160 6 LEU HB3 H 1.65 0.02 2 39 160 6 LEU HG H 1.44 0.02 1 40 160 6 LEU HD1 H 0.60 0.02 2 41 160 6 LEU HD2 H 0.58 0.02 2 42 160 6 LEU C C 176.47 0.05 1 43 160 6 LEU CA C 52.99 0.05 1 44 160 6 LEU CB C 43.38 0.05 1 45 160 6 LEU CG C 27.19 0.05 1 46 160 6 LEU CD1 C 24.58 0.05 2 47 160 6 LEU CD2 C 24.96 0.05 2 48 160 6 LEU N N 122.55 0.05 1 49 161 7 ILE H H 9.24 0.02 1 50 161 7 ILE HA H 3.92 0.02 1 51 161 7 ILE HB H 1.37 0.02 1 52 161 7 ILE HG12 H -0.45 0.02 1 53 161 7 ILE HG13 H 0.76 0.02 1 54 161 7 ILE HG2 H 0.68 0.02 1 55 161 7 ILE HD1 H 0.31 0.02 1 56 161 7 ILE C C 175.32 0.05 1 57 161 7 ILE CA C 61.62 0.05 1 58 161 7 ILE CB C 40.41 0.05 1 59 161 7 ILE CG1 C 26.13 0.05 1 60 161 7 ILE CG2 C 16.49 0.05 1 61 161 7 ILE CD1 C 13.94 0.05 1 62 161 7 ILE N N 127.98 0.05 1 63 162 8 GLY H H 8.92 0.02 1 64 162 8 GLY HA2 H 4.31 0.02 1 65 162 8 GLY HA3 H 3.47 0.02 1 66 162 8 GLY C C 174.73 0.05 1 67 162 8 GLY CA C 44.59 0.05 1 68 162 8 GLY N N 115.56 0.05 1 69 163 9 VAL H H 8.84 0.02 1 70 163 9 VAL HA H 3.84 0.02 1 71 163 9 VAL HB H 2.15 0.02 1 72 163 9 VAL HG1 H 0.69 0.02 1 73 163 9 VAL HG2 H 0.57 0.02 1 74 163 9 VAL CA C 60.42 0.05 1 75 163 9 VAL CB C 30.81 0.05 1 76 163 9 VAL CG1 C 20.56 0.05 1 77 163 9 VAL CG2 C 21.76 0.05 1 78 163 9 VAL N N 125.95 0.05 1 79 164 10 PRO HA H 4.05 0.02 1 80 164 10 PRO HB2 H 2.21 0.02 2 81 164 10 PRO HB3 H 1.66 0.02 2 82 164 10 PRO HG2 H 1.84 0.02 2 83 164 10 PRO HG3 H 2.09 0.02 2 84 164 10 PRO HD2 H 4.17 0.02 2 85 164 10 PRO HD3 H 3.36 0.02 2 86 164 10 PRO CA C 63.60 0.05 1 87 164 10 PRO CB C 32.15 0.05 1 88 164 10 PRO CG C 27.68 0.05 1 89 164 10 PRO CD C 51.00 0.05 1 90 165 11 GLU H H 8.65 0.02 1 91 165 11 GLU HA H 4.27 0.02 1 92 165 11 GLU HB2 H 1.62 0.02 1 93 165 11 GLU HB3 H 1.96 0.02 1 94 165 11 GLU HG2 H 2.12 0.02 2 95 165 11 GLU HG3 H 2.35 0.02 2 96 165 11 GLU C C 176.19 0.05 1 97 165 11 GLU CA C 56.42 0.05 1 98 165 11 GLU CB C 29.98 0.05 1 99 165 11 GLU CG C 35.59 0.05 1 100 165 11 GLU N N 123.60 0.05 1 101 166 12 SER H H 8.57 0.02 1 102 166 12 SER HA H 4.52 0.02 1 103 166 12 SER HB2 H 3.54 0.02 1 104 166 12 SER HB3 H 3.71 0.02 1 105 166 12 SER CA C 57.08 0.05 1 106 166 12 SER CB C 64.54 0.05 1 107 166 12 SER N N 117.06 0.05 1 108 167 13 ASP HA H 4.24 0.02 1 109 167 13 ASP HB2 H 2.56 0.02 1 110 167 13 ASP HB3 H 2.56 0.02 1 111 167 13 ASP CA C 55.90 0.05 1 112 167 13 ASP CB C 40.35 0.05 1 113 168 14 VAL H H 7.67 0.02 1 114 168 14 VAL HA H 4.11 0.02 1 115 168 14 VAL HB H 2.07 0.02 1 116 168 14 VAL HG1 H 0.69 0.02 1 117 168 14 VAL HG2 H 0.76 0.02 1 118 168 14 VAL C C 175.33 0.05 1 119 168 14 VAL CA C 60.99 0.05 1 120 168 14 VAL CB C 31.92 0.05 1 121 168 14 VAL CG1 C 19.45 0.05 1 122 168 14 VAL CG2 C 21.09 0.05 1 123 168 14 VAL N N 114.67 0.05 1 124 169 15 GLU H H 7.90 0.02 1 125 169 15 GLU HA H 3.90 0.02 1 126 169 15 GLU HB2 H 1.90 0.02 2 127 169 15 GLU HB3 H 1.95 0.02 2 128 169 15 GLU HG2 H 1.94 0.02 2 129 169 15 GLU HG3 H 2.08 0.02 2 130 169 15 GLU C C 174.20 0.05 1 131 169 15 GLU CA C 57.70 0.05 1 132 169 15 GLU CB C 31.53 0.05 1 133 169 15 GLU CG C 37.98 0.05 1 134 169 15 GLU N N 124.45 0.05 1 135 170 16 ASN H H 7.23 0.02 1 136 170 16 ASN HA H 4.81 0.02 1 137 170 16 ASN HB2 H 3.12 0.02 1 138 170 16 ASN HB3 H 2.93 0.02 1 139 170 16 ASN CA C 51.39 0.05 1 140 170 16 ASN CB C 39.12 0.05 1 141 170 16 ASN N N 121.18 0.05 1 142 171 17 GLY HA2 H 3.94 0.02 1 143 171 17 GLY HA3 H 3.73 0.02 1 144 171 17 GLY CA C 47.64 0.05 1 145 172 18 THR H H 7.81 0.02 1 146 172 18 THR HA H 3.94 0.02 1 147 172 18 THR HB H 4.03 0.02 1 148 172 18 THR HG2 H 1.12 0.02 1 149 172 18 THR C C 175.87 0.05 1 150 172 18 THR CA C 65.44 0.05 1 151 172 18 THR CB C 68.69 0.05 1 152 172 18 THR CG2 C 21.68 0.05 1 153 172 18 THR N N 117.71 0.05 1 154 173 19 LYS H H 8.06 0.02 1 155 173 19 LYS HA H 4.09 0.02 1 156 173 19 LYS HB2 H 1.80 0.02 2 157 173 19 LYS HB3 H 1.92 0.02 2 158 173 19 LYS HG2 H 1.46 0.02 1 159 173 19 LYS HG3 H 1.46 0.02 1 160 173 19 LYS HD2 H 1.60 0.02 1 161 173 19 LYS HD3 H 1.60 0.02 1 162 173 19 LYS HE2 H 2.87 0.02 1 163 173 19 LYS HE3 H 2.87 0.02 1 164 173 19 LYS C C 179.55 0.05 1 165 173 19 LYS CA C 58.49 0.05 1 166 173 19 LYS CB C 32.34 0.05 1 167 173 19 LYS CG C 25.04 0.05 1 168 173 19 LYS CD C 28.74 0.05 1 169 173 19 LYS CE C 41.97 0.05 1 170 173 19 LYS N N 122.14 0.05 1 171 174 20 LEU H H 8.22 0.02 1 172 174 20 LEU HA H 3.88 0.02 1 173 174 20 LEU HB2 H 1.12 0.02 2 174 174 20 LEU HB3 H 1.84 0.02 2 175 174 20 LEU HG H 1.65 0.02 1 176 174 20 LEU HD1 H 0.72 0.02 1 177 174 20 LEU HD2 H 0.66 0.02 1 178 174 20 LEU C C 178.41 0.05 1 179 174 20 LEU CA C 58.16 0.05 1 180 174 20 LEU CB C 42.33 0.05 1 181 174 20 LEU CG C 27.26 0.05 1 182 174 20 LEU CD1 C 25.39 0.05 1 183 174 20 LEU CD2 C 23.55 0.05 1 184 174 20 LEU N N 121.14 0.05 1 185 175 21 GLU H H 8.44 0.02 1 186 175 21 GLU HA H 3.64 0.02 1 187 175 21 GLU HB2 H 2.02 0.02 1 188 175 21 GLU HB3 H 2.02 0.02 1 189 175 21 GLU HG2 H 2.05 0.02 2 190 175 21 GLU HG3 H 2.31 0.02 2 191 175 21 GLU C C 178.86 0.05 1 192 175 21 GLU CA C 60.41 0.05 1 193 175 21 GLU CB C 28.87 0.05 1 194 175 21 GLU CG C 36.76 0.05 1 195 175 21 GLU N N 119.87 0.05 1 196 176 22 ASN H H 8.10 0.02 1 197 176 22 ASN HA H 4.33 0.02 1 198 176 22 ASN HB2 H 2.84 0.02 2 199 176 22 ASN HB3 H 2.87 0.02 2 200 176 22 ASN HD21 H 6.84 0.02 1 201 176 22 ASN HD22 H 7.33 0.02 1 202 176 22 ASN C C 177.11 0.05 1 203 176 22 ASN CA C 55.81 0.05 1 204 176 22 ASN CB C 37.86 0.05 1 205 176 22 ASN N N 118.29 0.05 1 206 176 22 ASN ND2 N 111.82 0.05 1 207 177 23 THR H H 8.26 0.02 1 208 177 23 THR HA H 3.88 0.02 1 209 177 23 THR HB H 4.29 0.02 1 210 177 23 THR HG2 H 1.00 0.02 1 211 177 23 THR C C 175.58 0.05 1 212 177 23 THR CA C 66.79 0.05 1 213 177 23 THR CB C 67.95 0.05 1 214 177 23 THR CG2 C 21.54 0.05 1 215 177 23 THR N N 119.38 0.05 1 216 178 24 LEU H H 7.85 0.02 1 217 178 24 LEU HA H 3.90 0.02 1 218 178 24 LEU HB2 H 1.22 0.02 1 219 178 24 LEU HB3 H 2.02 0.02 1 220 178 24 LEU HG H 1.65 0.02 1 221 178 24 LEU HD1 H 0.85 0.02 1 222 178 24 LEU HD2 H 0.84 0.02 1 223 178 24 LEU CA C 57.64 0.05 1 224 178 24 LEU CB C 40.56 0.05 1 225 178 24 LEU CG C 27.57 0.05 1 226 178 24 LEU CD1 C 23.37 0.05 1 227 178 24 LEU CD2 C 25.96 0.05 1 228 178 24 LEU N N 121.97 0.05 1 229 179 25 GLN H H 7.93 0.02 1 230 179 25 GLN HA H 3.95 0.02 1 231 179 25 GLN HB2 H 2.17 0.02 1 232 179 25 GLN HB3 H 2.17 0.02 1 233 179 25 GLN HG2 H 2.46 0.02 1 234 179 25 GLN HG3 H 2.46 0.02 1 235 179 25 GLN C C 178.52 0.05 1 236 179 25 GLN CA C 58.96 0.05 1 237 179 25 GLN CB C 27.09 0.05 1 238 179 25 GLN CG C 33.03 0.05 1 239 179 25 GLN N N 118.29 0.05 1 240 180 26 ASP H H 8.45 0.02 1 241 180 26 ASP HA H 4.30 0.02 1 242 180 26 ASP HB2 H 2.50 0.02 1 243 180 26 ASP HB3 H 2.97 0.02 1 244 180 26 ASP C C 179.32 0.05 1 245 180 26 ASP CA C 57.47 0.05 1 246 180 26 ASP CB C 39.56 0.05 1 247 180 26 ASP N N 121.57 0.05 1 248 181 27 ILE H H 8.15 0.02 1 249 181 27 ILE HA H 3.34 0.02 1 250 181 27 ILE HB H 2.13 0.02 1 251 181 27 ILE HG12 H 0.66 0.02 2 252 181 27 ILE HG13 H 2.04 0.02 2 253 181 27 ILE HG2 H 0.61 0.02 1 254 181 27 ILE HD1 H 0.61 0.02 1 255 181 27 ILE C C 179.00 0.05 1 256 181 27 ILE CA C 65.76 0.05 1 257 181 27 ILE CB C 38.06 0.05 1 258 181 27 ILE CG1 C 30.89 0.05 1 259 181 27 ILE CG2 C 15.88 0.05 1 260 181 27 ILE CD1 C 14.92 0.05 1 261 181 27 ILE N N 121.28 0.05 1 262 182 28 ILE H H 8.33 0.02 1 263 182 28 ILE HA H 3.63 0.02 1 264 182 28 ILE HB H 2.02 0.02 1 265 182 28 ILE HG12 H 0.96 0.02 2 266 182 28 ILE HG13 H 1.90 0.02 2 267 182 28 ILE HG2 H 0.93 0.02 1 268 182 28 ILE HD1 H 0.82 0.02 1 269 182 28 ILE C C 177.36 0.05 1 270 182 28 ILE CA C 66.28 0.05 1 271 182 28 ILE CB C 37.65 0.05 1 272 182 28 ILE CG1 C 30.32 0.05 1 273 182 28 ILE CG2 C 17.72 0.05 1 274 182 28 ILE CD1 C 13.72 0.05 1 275 182 28 ILE N N 122.66 0.05 1 276 183 29 GLN H H 8.50 0.02 1 277 183 29 GLN HA H 3.70 0.02 1 278 183 29 GLN HB2 H 2.05 0.02 1 279 183 29 GLN HB3 H 2.05 0.02 1 280 183 29 GLN HG2 H 2.38 0.02 1 281 183 29 GLN HG3 H 2.38 0.02 1 282 183 29 GLN HE22 H 7.08 0.02 2 283 183 29 GLN C C 177.20 0.05 1 284 183 29 GLN CA C 58.80 0.05 1 285 183 29 GLN CB C 28.15 0.05 1 286 183 29 GLN CG C 33.62 0.05 1 287 183 29 GLN N N 118.28 0.05 1 288 184 30 GLU H H 8.04 0.02 1 289 184 30 GLU HA H 3.87 0.02 1 290 184 30 GLU HB2 H 1.69 0.02 1 291 184 30 GLU HB3 H 2.14 0.02 1 292 184 30 GLU HG2 H 1.71 0.02 2 293 184 30 GLU HG3 H 2.08 0.02 2 294 184 30 GLU C C 176.71 0.05 1 295 184 30 GLU CA C 58.08 0.05 1 296 184 30 GLU CB C 29.91 0.05 1 297 184 30 GLU CG C 35.79 0.05 1 298 184 30 GLU N N 116.24 0.05 1 299 185 31 ASN H H 7.11 0.02 1 300 185 31 ASN HA H 4.45 0.02 1 301 185 31 ASN HB2 H 1.31 0.02 1 302 185 31 ASN HB3 H 1.05 0.02 1 303 185 31 ASN HD21 H 9.50 0.02 1 304 185 31 ASN HD22 H 8.32 0.02 1 305 185 31 ASN C C 173.76 0.05 1 306 185 31 ASN CA C 54.80 0.05 1 307 185 31 ASN CB C 41.80 0.05 1 308 185 31 ASN N N 111.37 0.05 1 309 185 31 ASN ND2 N 122.17 0.05 1 310 186 32 PHE H H 8.49 0.02 1 311 186 32 PHE HA H 5.49 0.02 1 312 186 32 PHE HB2 H 3.27 0.02 1 313 186 32 PHE HB3 H 3.27 0.02 1 314 186 32 PHE HD1 H 7.16 0.02 1 315 186 32 PHE HD2 H 7.16 0.02 1 316 186 32 PHE HE1 H 6.84 0.02 1 317 186 32 PHE HE2 H 6.84 0.02 1 318 186 32 PHE HZ H 6.76 0.02 1 319 186 32 PHE CA C 52.53 0.05 1 320 186 32 PHE CB C 38.99 0.05 1 321 186 32 PHE N N 117.20 0.05 1 322 187 33 PRO HA H 4.14 0.02 1 323 187 33 PRO HB2 H 2.32 0.02 2 324 187 33 PRO HB3 H 1.89 0.02 2 325 187 33 PRO HG2 H 1.88 0.02 2 326 187 33 PRO HG3 H 1.97 0.02 2 327 187 33 PRO HD2 H 3.73 0.02 1 328 187 33 PRO HD3 H 3.30 0.02 1 329 187 33 PRO CA C 65.14 0.05 1 330 187 33 PRO CB C 31.47 0.05 1 331 187 33 PRO CG C 27.39 0.05 1 332 187 33 PRO CD C 50.30 0.05 1 333 188 34 ASN HA H 4.43 0.02 1 334 188 34 ASN HB2 H 2.70 0.02 2 335 188 34 ASN HB3 H 2.82 0.02 2 336 188 34 ASN CA C 55.45 0.05 1 337 188 34 ASN CB C 37.42 0.05 1 338 189 35 LEU H H 7.71 0.02 1 339 189 35 LEU HA H 4.06 0.02 1 340 189 35 LEU HB2 H 1.73 0.02 1 341 189 35 LEU HB3 H 1.51 0.02 1 342 189 35 LEU HG H 1.51 0.02 1 343 189 35 LEU HD1 H 0.53 0.02 2 344 189 35 LEU HD2 H 0.58 0.02 2 345 189 35 LEU C C 178.18 0.05 1 346 189 35 LEU CA C 56.85 0.05 1 347 189 35 LEU CB C 41.83 0.05 1 348 189 35 LEU CG C 27.07 0.05 1 349 189 35 LEU CD1 C 24.89 0.05 2 350 189 35 LEU CD2 C 24.09 0.05 2 351 189 35 LEU N N 121.26 0.05 1 352 190 36 ALA H H 7.79 0.02 1 353 190 36 ALA HA H 4.06 0.02 1 354 190 36 ALA HB H 1.34 0.02 1 355 190 36 ALA C C 178.27 0.05 1 356 190 36 ALA CA C 53.73 0.05 1 357 190 36 ALA CB C 18.65 0.05 1 358 190 36 ALA N N 120.06 0.05 1 359 191 37 ARG H H 7.49 0.02 1 360 191 37 ARG HA H 4.11 0.02 1 361 191 37 ARG HB2 H 1.80 0.02 1 362 191 37 ARG HB3 H 1.80 0.02 1 363 191 37 ARG HG2 H 1.56 0.02 2 364 191 37 ARG HG3 H 1.62 0.02 2 365 191 37 ARG HD2 H 3.13 0.02 1 366 191 37 ARG HD3 H 3.13 0.02 1 367 191 37 ARG C C 177.20 0.05 1 368 191 37 ARG CA C 57.28 0.05 1 369 191 37 ARG CB C 30.36 0.05 1 370 191 37 ARG CG C 27.25 0.05 1 371 191 37 ARG CD C 43.12 0.05 1 372 191 37 ARG N N 115.85 0.05 1 373 192 38 GLN H H 7.74 0.02 1 374 192 38 GLN HA H 4.11 0.02 1 375 192 38 GLN HB2 H 1.95 0.02 1 376 192 38 GLN HB3 H 1.95 0.02 1 377 192 38 GLN HG2 H 2.31 0.02 1 378 192 38 GLN HG3 H 2.31 0.02 1 379 192 38 GLN C C 175.68 0.05 1 380 192 38 GLN CA C 56.53 0.05 1 381 192 38 GLN CB C 29.28 0.05 1 382 192 38 GLN CG C 33.95 0.05 1 383 192 38 GLN N N 117.10 0.05 1 384 193 39 ALA H H 7.92 0.02 1 385 193 39 ALA HA H 4.16 0.02 1 386 193 39 ALA HB H 1.23 0.02 1 387 193 39 ALA CA C 52.54 0.05 1 388 193 39 ALA CB C 19.20 0.05 1 389 193 39 ALA N N 120.83 0.05 1 390 194 40 ASN HA H 4.56 0.02 1 391 194 40 ASN HB2 H 2.64 0.02 1 392 194 40 ASN HB3 H 2.64 0.02 1 393 194 40 ASN HD21 H 7.41 0.02 2 394 194 40 ASN HD22 H 6.70 0.02 2 395 194 40 ASN CA C 53.01 0.05 1 396 194 40 ASN CB C 38.28 0.05 1 397 194 40 ASN ND2 N 111.37 0.05 1 398 195 41 VAL H H 8.18 0.02 1 399 195 41 VAL HA H 3.89 0.02 1 400 195 41 VAL HB H 2.01 0.02 1 401 195 41 VAL HG1 H 0.81 0.02 2 402 195 41 VAL HG2 H 0.76 0.02 2 403 195 41 VAL C C 174.93 0.05 1 404 195 41 VAL CA C 62.62 0.05 1 405 195 41 VAL CB C 31.96 0.05 1 406 195 41 VAL CG1 C 20.60 0.05 2 407 195 41 VAL CG2 C 21.79 0.05 2 408 195 41 VAL N N 119.82 0.05 1 409 196 42 GLN H H 8.13 0.02 1 410 196 42 GLN HA H 4.47 0.02 1 411 196 42 GLN HB2 H 1.95 0.02 2 412 196 42 GLN HB3 H 2.03 0.02 2 413 196 42 GLN HG2 H 2.24 0.02 1 414 196 42 GLN HG3 H 2.24 0.02 1 415 196 42 GLN HE22 H 7.23 0.02 2 416 196 42 GLN C C 175.26 0.05 1 417 196 42 GLN CA C 55.15 0.05 1 418 196 42 GLN CB C 30.41 0.05 1 419 196 42 GLN CG C 33.72 0.05 1 420 196 42 GLN N N 124.94 0.05 1 421 197 43 ILE H H 8.90 0.02 1 422 197 43 ILE HA H 3.94 0.02 1 423 197 43 ILE HB H 1.62 0.02 1 424 197 43 ILE HG12 H 0.73 0.02 2 425 197 43 ILE HG13 H 1.37 0.02 2 426 197 43 ILE HG2 H 0.43 0.02 1 427 197 43 ILE HD1 H 0.62 0.02 1 428 197 43 ILE C C 175.05 0.05 1 429 197 43 ILE CA C 61.15 0.05 1 430 197 43 ILE CB C 39.65 0.05 1 431 197 43 ILE CG1 C 27.70 0.05 1 432 197 43 ILE CG2 C 18.26 0.05 1 433 197 43 ILE CD1 C 14.17 0.05 1 434 197 43 ILE N N 125.34 0.05 1 435 198 44 GLN H H 9.02 0.02 1 436 198 44 GLN HA H 4.18 0.02 1 437 198 44 GLN HB2 H 1.57 0.02 1 438 198 44 GLN HB3 H 1.57 0.02 1 439 198 44 GLN HG2 H 2.11 0.02 2 440 198 44 GLN HG3 H 2.14 0.02 2 441 198 44 GLN HE21 H 6.77 0.02 2 442 198 44 GLN HE22 H 7.44 0.02 2 443 198 44 GLN C C 175.36 0.05 1 444 198 44 GLN CA C 56.70 0.05 1 445 198 44 GLN CB C 30.36 0.05 1 446 198 44 GLN CG C 33.54 0.05 1 447 198 44 GLN N N 126.98 0.05 1 448 198 44 GLN NE2 N 112.14 0.05 1 449 199 45 GLU H H 7.57 0.02 1 450 199 45 GLU HA H 4.42 0.02 1 451 199 45 GLU HB2 H 1.76 0.02 1 452 199 45 GLU HB3 H 1.76 0.02 1 453 199 45 GLU HG2 H 1.99 0.02 1 454 199 45 GLU HG3 H 1.99 0.02 1 455 199 45 GLU C C 172.93 0.05 1 456 199 45 GLU CA C 55.47 0.05 1 457 199 45 GLU CB C 33.65 0.05 1 458 199 45 GLU CG C 36.24 0.05 1 459 199 45 GLU N N 116.65 0.05 1 460 200 46 ILE H H 8.46 0.02 1 461 200 46 ILE HA H 5.05 0.02 1 462 200 46 ILE HB H 1.53 0.02 1 463 200 46 ILE HG12 H 0.66 0.02 2 464 200 46 ILE HG13 H 1.38 0.02 2 465 200 46 ILE HG2 H 0.76 0.02 1 466 200 46 ILE HD1 H 0.54 0.02 1 467 200 46 ILE C C 172.54 0.05 1 468 200 46 ILE CA C 59.77 0.05 1 469 200 46 ILE CB C 40.76 0.05 1 470 200 46 ILE CG1 C 28.38 0.05 1 471 200 46 ILE CG2 C 15.03 0.05 1 472 200 46 ILE CD1 C 14.97 0.05 1 473 200 46 ILE N N 122.69 0.05 1 474 201 47 GLN H H 8.24 0.02 1 475 201 47 GLN HA H 4.55 0.02 1 476 201 47 GLN HB2 H 1.82 0.02 2 477 201 47 GLN HB3 H 2.10 0.02 2 478 201 47 GLN HG2 H 1.98 0.02 2 479 201 47 GLN HG3 H 2.11 0.02 2 480 201 47 GLN C C 174.83 0.05 1 481 201 47 GLN CA C 54.68 0.05 1 482 201 47 GLN CB C 32.48 0.05 1 483 201 47 GLN CG C 32.77 0.05 1 484 201 47 GLN N N 120.70 0.05 1 485 202 48 ARG H H 8.79 0.02 1 486 202 48 ARG HA H 4.89 0.02 1 487 202 48 ARG HB2 H 1.62 0.02 2 488 202 48 ARG HB3 H 1.79 0.02 2 489 202 48 ARG HG2 H 1.36 0.02 2 490 202 48 ARG HG3 H 1.42 0.02 2 491 202 48 ARG HD2 H 3.05 0.02 1 492 202 48 ARG HD3 H 3.05 0.02 1 493 202 48 ARG C C 175.65 0.05 1 494 202 48 ARG CA C 55.38 0.05 1 495 202 48 ARG CB C 30.70 0.05 1 496 202 48 ARG CG C 26.24 0.05 1 497 202 48 ARG CD C 43.13 0.05 1 498 202 48 ARG N N 121.29 0.05 1 499 203 49 THR H H 8.11 0.02 1 500 203 49 THR HA H 4.56 0.02 1 501 203 49 THR HB H 3.68 0.02 1 502 203 49 THR HG2 H 0.97 0.02 1 503 203 49 THR CA C 56.92 0.05 1 504 203 49 THR CB C 71.09 0.05 1 505 203 49 THR CG2 C 19.80 0.05 1 506 203 49 THR N N 115.26 0.05 1 507 204 50 PRO HA H 4.82 0.02 1 508 204 50 PRO HB2 H 2.31 0.02 2 509 204 50 PRO HB3 H 2.18 0.02 2 510 204 50 PRO HG2 H 1.69 0.02 2 511 204 50 PRO HG3 H 1.86 0.02 2 512 204 50 PRO HD2 H 3.51 0.02 2 513 204 50 PRO HD3 H 3.24 0.02 2 514 204 50 PRO CA C 62.93 0.05 1 515 204 50 PRO CB C 34.07 0.05 1 516 204 50 PRO CG C 24.74 0.05 1 517 204 50 PRO CD C 49.52 0.05 1 518 205 51 GLN HA H 3.87 0.02 1 519 205 51 GLN HB2 H 1.96 0.02 1 520 205 51 GLN HB3 H 1.96 0.02 1 521 205 51 GLN HG2 H 2.34 0.02 1 522 205 51 GLN HG3 H 2.34 0.02 1 523 205 51 GLN HE21 H 7.55 0.02 2 524 205 51 GLN HE22 H 6.85 0.02 2 525 205 51 GLN CA C 58.04 0.05 1 526 205 51 GLN CB C 28.94 0.05 1 527 205 51 GLN CG C 34.22 0.05 1 528 205 51 GLN NE2 N 113.10 0.05 1 529 206 52 ARG H H 7.64 0.02 1 530 206 52 ARG HA H 4.31 0.02 1 531 206 52 ARG HB2 H 1.59 0.02 1 532 206 52 ARG HB3 H 1.59 0.02 1 533 206 52 ARG HG2 H 1.46 0.02 1 534 206 52 ARG HG3 H 1.46 0.02 1 535 206 52 ARG HD2 H 3.05 0.02 1 536 206 52 ARG HD3 H 3.05 0.02 1 537 206 52 ARG CA C 55.11 0.05 1 538 206 52 ARG CB C 31.26 0.05 1 539 206 52 ARG CG C 26.94 0.05 1 540 206 52 ARG CD C 43.17 0.05 1 541 206 52 ARG N N 117.79 0.05 1 542 207 53 TYR HA H 4.29 0.02 1 543 207 53 TYR HB2 H 2.77 0.02 2 544 207 53 TYR HB3 H 2.84 0.02 2 545 207 53 TYR HD1 H 6.87 0.02 1 546 207 53 TYR HD2 H 6.87 0.02 1 547 207 53 TYR HE1 H 6.62 0.02 1 548 207 53 TYR HE2 H 6.62 0.02 1 549 207 53 TYR CA C 57.40 0.05 1 550 207 53 TYR CB C 38.95 0.05 1 551 207 53 TYR CE1 C 118.10 0.05 1 552 207 53 TYR CE2 C 118.10 0.05 1 553 210 56 ARG CA C 58.80 0.05 1 554 210 56 ARG CB C 29.77 0.05 1 555 210 56 ARG CG C 27.48 0.05 1 556 210 56 ARG CD C 43.32 0.05 1 557 211 57 ARG HG2 H 1.51 0.02 1 558 211 57 ARG HG3 H 1.51 0.02 1 559 211 57 ARG CA C 55.85 0.05 1 560 211 57 ARG CB C 30.96 0.05 1 561 211 57 ARG CG C 27.46 0.05 1 562 212 58 ALA HA H 4.18 0.02 1 563 212 58 ALA HB H 1.34 0.02 1 564 212 58 ALA CA C 53.28 0.05 1 565 212 58 ALA CB C 19.42 0.05 1 566 213 59 THR H H 7.39 0.02 1 567 213 59 THR HA H 4.59 0.02 1 568 213 59 THR HB H 4.13 0.02 1 569 213 59 THR HG2 H 1.13 0.02 1 570 213 59 THR CA C 58.41 0.05 1 571 213 59 THR CB C 69.58 0.05 1 572 213 59 THR CG2 C 21.65 0.05 1 573 213 59 THR N N 110.78 0.05 1 574 214 60 PRO HA H 4.43 0.02 1 575 214 60 PRO HB2 H 1.83 0.02 2 576 214 60 PRO HB3 H 1.38 0.02 2 577 214 60 PRO HG2 H 1.75 0.02 2 578 214 60 PRO HG3 H 2.17 0.02 2 579 214 60 PRO HD2 H 3.67 0.02 1 580 214 60 PRO HD3 H 3.67 0.02 1 581 214 60 PRO CA C 62.37 0.05 1 582 214 60 PRO CB C 32.86 0.05 1 583 214 60 PRO CG C 27.26 0.05 1 584 214 60 PRO CD C 50.47 0.05 1 585 215 61 ARG H H 9.08 0.02 1 586 215 61 ARG HA H 4.07 0.02 1 587 215 61 ARG HB2 H 2.10 0.02 1 588 215 61 ARG HB3 H 1.75 0.02 1 589 215 61 ARG HG2 H 1.53 0.02 2 590 215 61 ARG HG3 H 1.62 0.02 2 591 215 61 ARG HD2 H 2.91 0.02 1 592 215 61 ARG HD3 H 2.91 0.02 1 593 215 61 ARG HE H 8.67 0.02 1 594 215 61 ARG C C 178.15 0.05 1 595 215 61 ARG CA C 56.83 0.05 1 596 215 61 ARG CB C 31.13 0.05 1 597 215 61 ARG CG C 26.93 0.05 1 598 215 61 ARG CD C 43.38 0.05 1 599 215 61 ARG N N 123.37 0.05 1 600 215 61 ARG NE N 84.65 0.05 1 601 216 62 HIS H H 8.97 0.02 1 602 216 62 HIS HA H 4.68 0.02 1 603 216 62 HIS HB2 H 2.71 0.02 1 604 216 62 HIS HB3 H 2.93 0.02 1 605 216 62 HIS HD2 H 7.15 0.02 1 606 216 62 HIS HE1 H 7.59 0.02 1 607 216 62 HIS CA C 55.15 0.05 1 608 216 62 HIS CB C 32.35 0.05 1 609 216 62 HIS N N 122.77 0.05 1 610 217 63 ILE H H 8.24 0.02 1 611 217 63 ILE HA H 4.56 0.02 1 612 217 63 ILE HB H 1.45 0.02 1 613 217 63 ILE HG12 H 0.47 0.02 2 614 217 63 ILE HG13 H 1.71 0.02 2 615 217 63 ILE HG2 H 0.56 0.02 1 616 217 63 ILE HD1 H 0.60 0.02 1 617 217 63 ILE CA C 59.68 0.05 1 618 217 63 ILE CB C 41.33 0.05 1 619 217 63 ILE CG1 C 28.11 0.05 1 620 217 63 ILE CG2 C 18.19 0.05 1 621 217 63 ILE CD1 C 14.27 0.05 1 622 217 63 ILE N N 119.38 0.05 1 623 218 64 ILE H H 8.99 0.02 1 624 218 64 ILE HA H 4.89 0.02 1 625 218 64 ILE HB H 1.60 0.02 1 626 218 64 ILE HG12 H 0.97 0.02 2 627 218 64 ILE HG13 H 1.38 0.02 2 628 218 64 ILE HG2 H 0.68 0.02 1 629 218 64 ILE HD1 H 0.65 0.02 1 630 218 64 ILE C C 175.09 0.05 1 631 218 64 ILE CA C 58.82 0.05 1 632 218 64 ILE CB C 39.10 0.05 1 633 218 64 ILE CG1 C 26.89 0.05 1 634 218 64 ILE CG2 C 17.58 0.05 1 635 218 64 ILE CD1 C 11.88 0.05 1 636 218 64 ILE N N 124.61 0.05 1 637 219 65 VAL H H 8.79 0.02 1 638 219 65 VAL HA H 4.37 0.02 1 639 219 65 VAL HB H 1.58 0.02 1 640 219 65 VAL HG1 H 0.16 0.02 1 641 219 65 VAL HG2 H 0.51 0.02 1 642 219 65 VAL C C 173.23 0.05 1 643 219 65 VAL CA C 60.06 0.05 1 644 219 65 VAL CB C 34.56 0.05 1 645 219 65 VAL CG1 C 21.40 0.05 1 646 219 65 VAL CG2 C 21.30 0.05 1 647 219 65 VAL N N 125.66 0.05 1 648 220 66 ARG H H 8.64 0.02 1 649 220 66 ARG HA H 4.67 0.02 1 650 220 66 ARG HB2 H 1.52 0.02 2 651 220 66 ARG HB3 H 1.68 0.02 2 652 220 66 ARG HG2 H 1.38 0.02 2 653 220 66 ARG HG3 H 1.47 0.02 2 654 220 66 ARG HD2 H 3.03 0.02 2 655 220 66 ARG HD3 H 3.07 0.02 2 656 220 66 ARG C C 175.79 0.05 1 657 220 66 ARG CA C 54.39 0.05 1 658 220 66 ARG CB C 32.38 0.05 1 659 220 66 ARG CG C 27.60 0.05 1 660 220 66 ARG CD C 43.43 0.05 1 661 220 66 ARG N N 126.24 0.05 1 662 221 67 PHE H H 9.25 0.02 1 663 221 67 PHE HA H 4.79 0.02 1 664 221 67 PHE HB2 H 3.55 0.02 1 665 221 67 PHE HB3 H 2.78 0.02 1 666 221 67 PHE HD1 H 7.22 0.02 1 667 221 67 PHE HD2 H 7.22 0.02 1 668 221 67 PHE HE1 H 6.92 0.02 1 669 221 67 PHE HE2 H 6.92 0.02 1 670 221 67 PHE HZ H 6.92 0.02 1 671 221 67 PHE C C 175.59 0.05 1 672 221 67 PHE CA C 58.29 0.05 1 673 221 67 PHE CB C 40.76 0.05 1 674 221 67 PHE N N 126.56 0.05 1 675 222 68 THR H H 8.29 0.02 1 676 222 68 THR HA H 3.90 0.02 1 677 222 68 THR HB H 4.02 0.02 1 678 222 68 THR HG2 H 1.06 0.02 1 679 222 68 THR C C 174.91 0.05 1 680 222 68 THR CA C 65.61 0.05 1 681 222 68 THR CB C 68.39 0.05 1 682 222 68 THR CG2 C 22.49 0.05 1 683 222 68 THR N N 114.78 0.05 1 684 223 69 LYS H H 7.90 0.02 1 685 223 69 LYS HA H 4.74 0.02 1 686 223 69 LYS HB2 H 1.65 0.02 2 687 223 69 LYS HB3 H 1.95 0.02 2 688 223 69 LYS HG2 H 1.35 0.02 2 689 223 69 LYS HG3 H 1.44 0.02 2 690 223 69 LYS HD2 H 1.63 0.02 1 691 223 69 LYS HD3 H 1.63 0.02 1 692 223 69 LYS HE2 H 2.89 0.02 1 693 223 69 LYS HE3 H 2.89 0.02 1 694 223 69 LYS CA C 54.13 0.05 1 695 223 69 LYS CB C 33.91 0.05 1 696 223 69 LYS CG C 24.46 0.05 1 697 223 69 LYS CD C 28.81 0.05 1 698 223 69 LYS CE C 41.94 0.05 1 699 223 69 LYS N N 118.71 0.05 1 700 224 70 VAL HA H 3.80 0.02 1 701 224 70 VAL HB H 2.06 0.02 1 702 224 70 VAL HG1 H 1.00 0.02 2 703 224 70 VAL HG2 H 0.93 0.02 2 704 224 70 VAL CA C 65.40 0.05 1 705 224 70 VAL CB C 31.49 0.05 1 706 224 70 VAL CG1 C 21.79 0.05 2 707 224 70 VAL CG2 C 20.66 0.05 2 708 225 71 GLU H H 9.19 0.02 1 709 225 71 GLU HA H 4.06 0.02 1 710 225 71 GLU HB2 H 1.88 0.02 2 711 225 71 GLU HB3 H 1.92 0.02 2 712 225 71 GLU HG2 H 2.14 0.02 1 713 225 71 GLU HG3 H 2.14 0.02 1 714 225 71 GLU C C 178.15 0.05 1 715 225 71 GLU CA C 58.95 0.05 1 716 225 71 GLU CB C 28.64 0.05 1 717 225 71 GLU CG C 36.15 0.05 1 718 225 71 GLU N N 120.08 0.05 1 719 226 72 MET H H 7.47 0.02 1 720 226 72 MET HA H 3.90 0.02 1 721 226 72 MET HB2 H 1.84 0.02 1 722 226 72 MET HB3 H 1.38 0.02 1 723 226 72 MET HG2 H 2.05 0.02 2 724 226 72 MET HG3 H 2.39 0.02 2 725 226 72 MET HE H 1.85 0.02 1 726 226 72 MET C C 176.87 0.05 1 727 226 72 MET CA C 57.19 0.05 1 728 226 72 MET CB C 31.28 0.05 1 729 226 72 MET CG C 32.74 0.05 1 730 226 72 MET CE C 17.47 0.05 1 731 226 72 MET N N 118.13 0.05 1 732 227 73 LYS H H 6.98 0.02 1 733 227 73 LYS HA H 3.39 0.02 1 734 227 73 LYS HB2 H 2.08 0.02 1 735 227 73 LYS HB3 H 1.95 0.02 1 736 227 73 LYS HG2 H 1.17 0.02 2 737 227 73 LYS HG3 H 1.48 0.02 2 738 227 73 LYS HD2 H 1.68 0.02 1 739 227 73 LYS HD3 H 1.68 0.02 1 740 227 73 LYS HE2 H 2.83 0.02 2 741 227 73 LYS HE3 H 2.89 0.02 2 742 227 73 LYS C C 177.37 0.05 1 743 227 73 LYS CA C 59.48 0.05 1 744 227 73 LYS CB C 31.26 0.05 1 745 227 73 LYS CG C 24.24 0.05 1 746 227 73 LYS CD C 29.70 0.05 1 747 227 73 LYS CE C 41.75 0.05 1 748 227 73 LYS N N 119.37 0.05 1 749 228 74 GLU H H 7.66 0.02 1 750 228 74 GLU HA H 3.81 0.02 1 751 228 74 GLU HB2 H 1.94 0.02 1 752 228 74 GLU HB3 H 1.94 0.02 1 753 228 74 GLU HG2 H 2.14 0.02 2 754 228 74 GLU HG3 H 2.24 0.02 2 755 228 74 GLU C C 179.26 0.05 1 756 228 74 GLU CA C 58.96 0.05 1 757 228 74 GLU CB C 28.92 0.05 1 758 228 74 GLU CG C 36.02 0.05 1 759 228 74 GLU N N 116.64 0.05 1 760 229 75 LYS H H 7.93 0.02 1 761 229 75 LYS HA H 3.74 0.02 1 762 229 75 LYS HB2 H 1.53 0.02 2 763 229 75 LYS HB3 H 1.69 0.02 2 764 229 75 LYS HG2 H 1.24 0.02 2 765 229 75 LYS HG3 H 1.50 0.02 2 766 229 75 LYS HD2 H 1.41 0.02 1 767 229 75 LYS HD3 H 1.41 0.02 1 768 229 75 LYS HE2 H 2.71 0.02 1 769 229 75 LYS HE3 H 2.71 0.02 1 770 229 75 LYS C C 179.45 0.05 1 771 229 75 LYS CA C 59.73 0.05 1 772 229 75 LYS CB C 32.56 0.05 1 773 229 75 LYS CG C 25.76 0.05 1 774 229 75 LYS CD C 29.43 0.05 1 775 229 75 LYS CE C 41.81 0.05 1 776 229 75 LYS N N 118.92 0.05 1 777 230 76 MET H H 7.74 0.02 1 778 230 76 MET HA H 3.48 0.02 1 779 230 76 MET HB2 H 1.60 0.02 2 780 230 76 MET HB3 H 1.85 0.02 2 781 230 76 MET HG2 H 2.05 0.02 2 782 230 76 MET HG3 H 2.13 0.02 2 783 230 76 MET HE H 1.84 0.02 1 784 230 76 MET C C 176.88 0.05 1 785 230 76 MET CA C 58.52 0.05 1 786 230 76 MET CB C 31.59 0.05 1 787 230 76 MET CG C 32.87 0.05 1 788 230 76 MET CE C 16.92 0.05 1 789 230 76 MET N N 119.03 0.05 1 790 231 77 LEU H H 7.84 0.02 1 791 231 77 LEU HA H 3.76 0.02 1 792 231 77 LEU HB2 H 1.45 0.02 2 793 231 77 LEU HB3 H 1.55 0.02 2 794 231 77 LEU HG H 1.50 0.02 1 795 231 77 LEU HD1 H 0.73 0.02 1 796 231 77 LEU HD2 H 0.57 0.02 1 797 231 77 LEU C C 179.13 0.05 1 798 231 77 LEU CA C 57.71 0.05 1 799 231 77 LEU CB C 41.52 0.05 1 800 231 77 LEU CG C 26.90 0.05 1 801 231 77 LEU CD1 C 25.07 0.05 1 802 231 77 LEU CD2 C 23.26 0.05 1 803 231 77 LEU N N 118.88 0.05 1 804 232 78 ARG H H 8.08 0.02 1 805 232 78 ARG HA H 3.77 0.02 1 806 232 78 ARG HB2 H 1.67 0.02 2 807 232 78 ARG HB3 H 1.70 0.02 2 808 232 78 ARG HG2 H 1.39 0.02 1 809 232 78 ARG HG3 H 1.39 0.02 1 810 232 78 ARG HD2 H 3.05 0.02 1 811 232 78 ARG HD3 H 3.05 0.02 1 812 232 78 ARG C C 178.20 0.05 1 813 232 78 ARG CA C 59.36 0.05 1 814 232 78 ARG CB C 29.72 0.05 1 815 232 78 ARG CG C 27.27 0.05 1 816 232 78 ARG CD C 43.32 0.05 1 817 232 78 ARG N N 119.17 0.05 1 818 233 79 ALA H H 7.58 0.02 1 819 233 79 ALA HA H 3.89 0.02 1 820 233 79 ALA HB H 0.71 0.02 1 821 233 79 ALA C C 180.43 0.05 1 822 233 79 ALA CA C 54.56 0.05 1 823 233 79 ALA CB C 16.91 0.05 1 824 233 79 ALA N N 121.39 0.05 1 825 234 80 ALA H H 8.00 0.02 1 826 234 80 ALA HA H 3.95 0.02 1 827 234 80 ALA HB H 1.49 0.02 1 828 234 80 ALA C C 179.95 0.05 1 829 234 80 ALA CA C 55.42 0.05 1 830 234 80 ALA CB C 18.89 0.05 1 831 234 80 ALA N N 120.73 0.05 1 832 235 81 ARG H H 8.14 0.02 1 833 235 81 ARG HA H 3.97 0.02 1 834 235 81 ARG HB2 H 1.85 0.02 1 835 235 81 ARG HB3 H 1.85 0.02 1 836 235 81 ARG HG2 H 1.72 0.02 1 837 235 81 ARG HG3 H 1.72 0.02 1 838 235 81 ARG HD2 H 3.05 0.02 1 839 235 81 ARG HD3 H 3.05 0.02 1 840 235 81 ARG C C 178.90 0.05 1 841 235 81 ARG CA C 59.09 0.05 1 842 235 81 ARG CB C 29.50 0.05 1 843 235 81 ARG CG C 27.48 0.05 1 844 235 81 ARG CD C 43.30 0.05 1 845 235 81 ARG N N 120.08 0.05 1 846 236 82 GLU H H 8.04 0.02 1 847 236 82 GLU HA H 3.91 0.02 1 848 236 82 GLU HB2 H 1.97 0.02 1 849 236 82 GLU HB3 H 1.97 0.02 1 850 236 82 GLU HG2 H 2.35 0.02 1 851 236 82 GLU HG3 H 2.35 0.02 1 852 236 82 GLU C C 178.01 0.05 1 853 236 82 GLU CA C 58.49 0.05 1 854 236 82 GLU CB C 29.44 0.05 1 855 236 82 GLU CG C 36.47 0.05 1 856 236 82 GLU N N 118.41 0.05 1 857 237 83 LYS H H 7.82 0.02 1 858 237 83 LYS HA H 4.20 0.02 1 859 237 83 LYS HB2 H 1.94 0.02 1 860 237 83 LYS HB3 H 2.07 0.02 1 861 237 83 LYS HG2 H 1.60 0.02 2 862 237 83 LYS HG3 H 1.68 0.02 2 863 237 83 LYS HD2 H 1.79 0.02 2 864 237 83 LYS HD3 H 1.92 0.02 2 865 237 83 LYS HE2 H 3.19 0.02 2 866 237 83 LYS HE3 H 3.28 0.02 2 867 237 83 LYS C C 178.26 0.05 1 868 237 83 LYS CA C 57.78 0.05 1 869 237 83 LYS CB C 33.48 0.05 1 870 237 83 LYS CG C 25.43 0.05 1 871 237 83 LYS CD C 29.29 0.05 1 872 237 83 LYS CE C 42.39 0.05 1 873 237 83 LYS N N 118.72 0.05 1 874 238 84 GLY H H 8.00 0.02 1 875 238 84 GLY HA2 H 4.25 0.02 1 876 238 84 GLY HA3 H 3.47 0.02 1 877 238 84 GLY C C 172.95 0.05 1 878 238 84 GLY CA C 46.01 0.05 1 879 238 84 GLY N N 107.26 0.05 1 880 239 85 ARG H H 7.41 0.02 1 881 239 85 ARG HA H 4.32 0.02 1 882 239 85 ARG HB2 H 1.68 0.02 1 883 239 85 ARG HB3 H 1.68 0.02 1 884 239 85 ARG HG2 H 1.43 0.02 1 885 239 85 ARG HG3 H 1.43 0.02 1 886 239 85 ARG HD2 H 3.05 0.02 1 887 239 85 ARG HD3 H 3.05 0.02 1 888 239 85 ARG C C 173.52 0.05 1 889 239 85 ARG CA C 55.63 0.05 1 890 239 85 ARG CB C 31.42 0.05 1 891 239 85 ARG CG C 26.90 0.05 1 892 239 85 ARG CD C 43.38 0.05 1 893 239 85 ARG N N 121.76 0.05 1 894 240 86 VAL H H 8.80 0.02 1 895 240 86 VAL HA H 4.13 0.02 1 896 240 86 VAL HB H 1.79 0.02 1 897 240 86 VAL HG1 H 0.57 0.02 1 898 240 86 VAL HG2 H 0.90 0.02 1 899 240 86 VAL C C 175.12 0.05 1 900 240 86 VAL CA C 60.78 0.05 1 901 240 86 VAL CB C 33.57 0.05 1 902 240 86 VAL CG1 C 22.34 0.05 1 903 240 86 VAL CG2 C 21.72 0.05 1 904 240 86 VAL N N 126.49 0.05 1 905 241 87 THR H H 8.88 0.02 1 906 241 87 THR HA H 5.04 0.02 1 907 241 87 THR HB H 3.41 0.02 1 908 241 87 THR HG2 H 0.59 0.02 1 909 241 87 THR C C 173.64 0.05 1 910 241 87 THR CA C 59.29 0.05 1 911 241 87 THR CB C 72.63 0.05 1 912 241 87 THR CG2 C 20.42 0.05 1 913 241 87 THR N N 115.05 0.05 1 914 242 88 LEU H H 8.76 0.02 1 915 242 88 LEU HA H 4.50 0.02 1 916 242 88 LEU HB2 H 1.60 0.02 1 917 242 88 LEU HB3 H 0.94 0.02 1 918 242 88 LEU HG H 1.30 0.02 1 919 242 88 LEU HD1 H 0.85 0.02 1 920 242 88 LEU HD2 H 0.81 0.02 1 921 242 88 LEU CA C 53.80 0.05 1 922 242 88 LEU CB C 43.92 0.05 1 923 242 88 LEU CG C 27.74 0.05 1 924 242 88 LEU CD1 C 21.55 0.05 1 925 242 88 LEU CD2 C 27.82 0.05 1 926 242 88 LEU N N 118.61 0.05 1 927 243 89 LYS H H 11.73 0.02 1 928 243 89 LYS HA H 3.74 0.02 1 929 243 89 LYS HB2 H 1.80 0.02 2 930 243 89 LYS HB3 H 1.92 0.02 2 931 243 89 LYS HG2 H 1.19 0.02 2 932 243 89 LYS HG3 H 1.30 0.02 2 933 243 89 LYS HE2 H 2.88 0.02 1 934 243 89 LYS HE3 H 2.88 0.02 1 935 243 89 LYS CA C 55.99 0.05 1 936 243 89 LYS CB C 29.03 0.05 1 937 243 89 LYS CG C 25.00 0.05 1 938 243 89 LYS CD C 29.14 0.05 1 939 243 89 LYS CE C 42.36 0.05 1 940 244 90 GLY H H 9.02 0.02 1 941 244 90 GLY HA2 H 4.09 0.02 1 942 244 90 GLY HA3 H 3.31 0.02 1 943 244 90 GLY C C 173.22 0.05 1 944 244 90 GLY CA C 45.10 0.05 1 945 244 90 GLY N N 103.59 0.05 1 946 245 91 LYS H H 7.67 0.02 1 947 245 91 LYS HA H 4.70 0.02 1 948 245 91 LYS HB2 H 1.75 0.02 2 949 245 91 LYS HB3 H 1.82 0.02 2 950 245 91 LYS HG2 H 1.33 0.02 2 951 245 91 LYS HG3 H 1.40 0.02 2 952 245 91 LYS HD2 H 1.60 0.02 1 953 245 91 LYS HD3 H 1.60 0.02 1 954 245 91 LYS HE2 H 2.94 0.02 1 955 245 91 LYS HE3 H 2.94 0.02 1 956 245 91 LYS CA C 52.71 0.05 1 957 245 91 LYS CB C 32.51 0.05 1 958 245 91 LYS CG C 24.46 0.05 1 959 245 91 LYS CD C 28.70 0.05 1 960 245 91 LYS CE C 42.18 0.05 1 961 245 91 LYS N N 123.00 0.05 1 962 246 92 PRO HA H 4.54 0.02 1 963 246 92 PRO HB2 H 2.07 0.02 1 964 246 92 PRO HB3 H 1.83 0.02 1 965 246 92 PRO HD2 H 3.78 0.02 2 966 246 92 PRO HD3 H 3.60 0.02 2 967 246 92 PRO CA C 63.57 0.05 1 968 246 92 PRO CB C 32.18 0.05 1 969 246 92 PRO CG C 27.78 0.05 1 970 246 92 PRO CD C 50.49 0.05 1 971 247 93 ILE H H 8.42 0.02 1 972 247 93 ILE HA H 4.58 0.02 1 973 247 93 ILE HB H 1.75 0.02 1 974 247 93 ILE HG12 H 0.50 0.02 2 975 247 93 ILE HG13 H 0.73 0.02 2 976 247 93 ILE HG2 H 0.62 0.02 1 977 247 93 ILE HD1 H 0.45 0.02 1 978 247 93 ILE C C 173.71 0.05 1 979 247 93 ILE CA C 59.50 0.05 1 980 247 93 ILE CB C 41.63 0.05 1 981 247 93 ILE CG1 C 25.59 0.05 1 982 247 93 ILE CG2 C 18.53 0.05 1 983 247 93 ILE CD1 C 14.98 0.05 1 984 247 93 ILE N N 119.20 0.05 1 985 248 94 ARG H H 8.41 0.02 1 986 248 94 ARG HA H 4.69 0.02 1 987 248 94 ARG HB2 H 1.57 0.02 1 988 248 94 ARG HB3 H 1.57 0.02 1 989 248 94 ARG HG2 H 1.36 0.02 2 990 248 94 ARG HG3 H 1.48 0.02 2 991 248 94 ARG HD2 H 2.99 0.02 2 992 248 94 ARG HD3 H 3.09 0.02 2 993 248 94 ARG C C 173.68 0.05 1 994 248 94 ARG CA C 54.84 0.05 1 995 248 94 ARG CB C 34.00 0.05 1 996 248 94 ARG CG C 27.57 0.05 1 997 248 94 ARG CD C 43.48 0.05 1 998 248 94 ARG N N 117.12 0.05 1 999 249 95 LEU H H 8.66 0.02 1 1000 249 95 LEU HA H 5.24 0.02 1 1001 249 95 LEU HB2 H 1.35 0.02 2 1002 249 95 LEU HB3 H 1.40 0.02 2 1003 249 95 LEU HG H 1.59 0.02 1 1004 249 95 LEU HD1 H 0.73 0.02 1 1005 249 95 LEU HD2 H 0.77 0.02 1 1006 249 95 LEU C C 175.56 0.05 1 1007 249 95 LEU CA C 53.99 0.05 1 1008 249 95 LEU CB C 44.06 0.05 1 1009 249 95 LEU CG C 28.78 0.05 1 1010 249 95 LEU CD1 C 26.04 0.05 1 1011 249 95 LEU CD2 C 25.29 0.05 1 1012 249 95 LEU N N 125.16 0.05 1 1013 250 96 THR H H 8.86 0.02 1 1014 250 96 THR HA H 4.58 0.02 1 1015 250 96 THR HB H 4.04 0.02 1 1016 250 96 THR HG2 H 0.89 0.02 1 1017 250 96 THR C C 171.98 0.05 1 1018 250 96 THR CA C 59.37 0.05 1 1019 250 96 THR CB C 70.79 0.05 1 1020 250 96 THR CG2 C 19.97 0.05 1 1021 250 96 THR N N 116.47 0.05 1 1022 251 97 VAL H H 8.07 0.02 1 1023 251 97 VAL HA H 4.55 0.02 1 1024 251 97 VAL HB H 1.96 0.02 1 1025 251 97 VAL HG1 H 0.83 0.02 1 1026 251 97 VAL HG2 H 0.79 0.02 1 1027 251 97 VAL C C 174.77 0.05 1 1028 251 97 VAL CA C 60.91 0.05 1 1029 251 97 VAL CB C 33.87 0.05 1 1030 251 97 VAL CG1 C 21.47 0.05 1 1031 251 97 VAL CG2 C 20.08 0.05 1 1032 251 97 VAL N N 117.29 0.05 1 1033 252 98 ASP HA H 4.30 0.02 1 1034 252 98 ASP HB2 H 2.40 0.02 2 1035 252 98 ASP HB3 H 2.51 0.02 2 1036 252 98 ASP CA C 55.80 0.05 1 1037 252 98 ASP CB C 42.70 0.05 1 1038 254 100 SER HA H 4.28 0.02 1 1039 254 100 SER HB2 H 3.64 0.02 2 1040 254 100 SER HB3 H 3.73 0.02 2 1041 254 100 SER CA C 57.59 0.05 1 1042 254 100 SER CB C 63.81 0.05 1 1043 255 101 ALA HA H 4.00 0.02 1 1044 255 101 ALA HB H 1.34 0.02 1 1045 255 101 ALA CA C 55.22 0.05 1 1046 255 101 ALA CB C 18.00 0.05 1 1047 256 102 GLU H H 8.77 0.02 1 1048 256 102 GLU HA H 3.96 0.02 1 1049 256 102 GLU HB2 H 1.85 0.02 2 1050 256 102 GLU HB3 H 1.96 0.02 2 1051 256 102 GLU HG2 H 2.16 0.02 2 1052 256 102 GLU HG3 H 2.25 0.02 2 1053 256 102 GLU C C 179.05 0.05 1 1054 256 102 GLU CA C 59.69 0.05 1 1055 256 102 GLU CB C 28.92 0.05 1 1056 256 102 GLU CG C 36.81 0.05 1 1057 256 102 GLU N N 118.42 0.05 1 1058 257 103 THR H H 7.98 0.02 1 1059 257 103 THR HA H 3.90 0.02 1 1060 257 103 THR HB H 4.17 0.02 1 1061 257 103 THR HG2 H 1.04 0.02 1 1062 257 103 THR C C 175.99 0.05 1 1063 257 103 THR CA C 65.72 0.05 1 1064 257 103 THR CB C 67.97 0.05 1 1065 257 103 THR CG2 C 23.48 0.05 1 1066 257 103 THR N N 119.34 0.05 1 1067 258 104 LEU H H 8.27 0.02 1 1068 258 104 LEU HA H 3.79 0.02 1 1069 258 104 LEU HB2 H 1.71 0.02 1 1070 258 104 LEU HB3 H 1.46 0.02 1 1071 258 104 LEU HG H 1.51 0.02 1 1072 258 104 LEU HD1 H 0.79 0.02 1 1073 258 104 LEU HD2 H 0.78 0.02 1 1074 258 104 LEU CA C 58.31 0.05 1 1075 258 104 LEU CB C 41.48 0.05 1 1076 258 104 LEU CG C 26.58 0.05 1 1077 258 104 LEU CD1 C 24.75 0.05 1 1078 258 104 LEU CD2 C 23.36 0.05 1 1079 258 104 LEU N N 122.65 0.05 1 1080 259 105 GLN H H 8.08 0.02 1 1081 259 105 GLN HA H 3.92 0.02 1 1082 259 105 GLN HB2 H 1.97 0.02 2 1083 259 105 GLN HB3 H 2.05 0.02 2 1084 259 105 GLN HG2 H 2.28 0.02 1 1085 259 105 GLN HG3 H 2.28 0.02 1 1086 259 105 GLN HE21 H 6.78 0.02 1 1087 259 105 GLN HE22 H 7.65 0.02 1 1088 259 105 GLN C C 177.61 0.05 1 1089 259 105 GLN CA C 58.59 0.05 1 1090 259 105 GLN CB C 27.59 0.05 1 1091 259 105 GLN CG C 32.81 0.05 1 1092 259 105 GLN N N 119.29 0.05 1 1093 259 105 GLN NE2 N 112.43 0.05 1 1094 260 106 ALA H H 7.85 0.02 1 1095 260 106 ALA HA H 3.96 0.02 1 1096 260 106 ALA HB H 1.41 0.02 1 1097 260 106 ALA C C 180.38 0.05 1 1098 260 106 ALA CA C 54.92 0.05 1 1099 260 106 ALA CB C 18.15 0.05 1 1100 260 106 ALA N N 122.19 0.05 1 1101 261 107 ARG H H 8.16 0.02 1 1102 261 107 ARG HA H 3.84 0.02 1 1103 261 107 ARG HB2 H 1.84 0.02 1 1104 261 107 ARG HB3 H 1.96 0.02 1 1105 261 107 ARG HG2 H 1.32 0.02 2 1106 261 107 ARG HG3 H 1.50 0.02 2 1107 261 107 ARG HD2 H 3.04 0.02 1 1108 261 107 ARG HD3 H 3.04 0.02 1 1109 261 107 ARG C C 179.04 0.05 1 1110 261 107 ARG CA C 60.42 0.05 1 1111 261 107 ARG CB C 29.72 0.05 1 1112 261 107 ARG CG C 29.03 0.05 1 1113 261 107 ARG CD C 43.40 0.05 1 1114 261 107 ARG N N 116.96 0.05 1 1115 262 108 ARG H H 7.95 0.02 1 1116 262 108 ARG HA H 3.95 0.02 1 1117 262 108 ARG HB2 H 1.84 0.02 1 1118 262 108 ARG HB3 H 1.84 0.02 1 1119 262 108 ARG HG2 H 1.50 0.02 2 1120 262 108 ARG HG3 H 1.71 0.02 2 1121 262 108 ARG HD2 H 3.06 0.02 1 1122 262 108 ARG HD3 H 3.06 0.02 1 1123 262 108 ARG C C 179.88 0.05 1 1124 262 108 ARG CA C 59.21 0.05 1 1125 262 108 ARG CB C 29.95 0.05 1 1126 262 108 ARG CG C 27.87 0.05 1 1127 262 108 ARG CD C 43.55 0.05 1 1128 262 108 ARG N N 120.63 0.05 1 1129 263 109 GLU H H 8.03 0.02 1 1130 263 109 GLU HA H 3.92 0.02 1 1131 263 109 GLU HB2 H 1.61 0.02 2 1132 263 109 GLU HB3 H 1.80 0.02 2 1133 263 109 GLU HG2 H 2.07 0.02 1 1134 263 109 GLU HG3 H 2.07 0.02 1 1135 263 109 GLU C C 178.20 0.05 1 1136 263 109 GLU CA C 58.36 0.05 1 1137 263 109 GLU CB C 29.51 0.05 1 1138 263 109 GLU CG C 36.22 0.05 1 1139 263 109 GLU N N 119.35 0.05 1 1140 264 110 TRP H H 7.45 0.02 1 1141 264 110 TRP HA H 4.89 0.02 1 1142 264 110 TRP HB2 H 3.37 0.02 1 1143 264 110 TRP HB3 H 3.20 0.02 1 1144 264 110 TRP HD1 H 6.87 0.02 1 1145 264 110 TRP HE1 H 10.13 0.02 1 1146 264 110 TRP HE3 H 7.44 0.02 1 1147 264 110 TRP HZ2 H 7.07 0.02 1 1148 264 110 TRP HZ3 H 6.69 0.02 1 1149 264 110 TRP HH2 H 6.72 0.02 1 1150 264 110 TRP C C 177.05 0.05 1 1151 264 110 TRP CA C 57.26 0.05 1 1152 264 110 TRP CB C 31.87 0.05 1 1153 264 110 TRP CD1 C 127.9 0.05 1 1154 264 110 TRP CZ2 C 115.5 0.05 1 1155 264 110 TRP N N 115.54 0.05 1 1156 264 110 TRP NE1 N 128.57 0.05 1 1157 265 111 GLY H H 7.90 0.02 1 1158 265 111 GLY HA2 H 4.14 0.02 1 1159 265 111 GLY HA3 H 3.74 0.02 1 1160 265 111 GLY C C 172.76 0.05 1 1161 265 111 GLY CA C 49.14 0.05 1 1162 265 111 GLY N N 107.21 0.05 1 1163 266 112 PRO HA H 4.26 0.02 1 1164 266 112 PRO HB2 H 1.88 0.02 1 1165 266 112 PRO HB3 H 2.36 0.02 1 1166 266 112 PRO HG2 H 1.79 0.02 2 1167 266 112 PRO HG3 H 1.84 0.02 2 1168 266 112 PRO HD2 H 3.73 0.02 1 1169 266 112 PRO HD3 H 3.60 0.02 1 1170 266 112 PRO CA C 65.73 0.05 1 1171 266 112 PRO CB C 32.06 0.05 1 1172 266 112 PRO CG C 28.14 0.05 1 1173 266 112 PRO CD C 50.33 0.05 1 1174 267 113 ILE H H 7.61 0.02 1 1175 267 113 ILE HA H 3.38 0.02 1 1176 267 113 ILE HB H 2.11 0.02 1 1177 267 113 ILE HG12 H 0.85 0.02 2 1178 267 113 ILE HG13 H 1.69 0.02 2 1179 267 113 ILE HG2 H 0.68 0.02 1 1180 267 113 ILE HD1 H 0.98 0.02 1 1181 267 113 ILE C C 176.36 0.05 1 1182 267 113 ILE CA C 65.11 0.05 1 1183 267 113 ILE CB C 38.85 0.05 1 1184 267 113 ILE CG1 C 31.48 0.05 1 1185 267 113 ILE CG2 C 17.84 0.05 1 1186 267 113 ILE CD1 C 14.96 0.05 1 1187 267 113 ILE N N 117.34 0.05 1 1188 268 114 PHE H H 8.98 0.02 1 1189 268 114 PHE HA H 3.42 0.02 1 1190 268 114 PHE HB2 H 2.58 0.02 1 1191 268 114 PHE HB3 H 3.42 0.02 1 1192 268 114 PHE HD1 H 6.87 0.02 1 1193 268 114 PHE HD2 H 6.87 0.02 1 1194 268 114 PHE HE1 H 6.98 0.02 1 1195 268 114 PHE HE2 H 6.98 0.02 1 1196 268 114 PHE C C 176.54 0.05 1 1197 268 114 PHE CA C 62.42 0.05 1 1198 268 114 PHE CB C 39.86 0.05 1 1199 268 114 PHE N N 120.58 0.05 1 1200 269 115 ASN H H 8.61 0.02 1 1201 269 115 ASN HA H 4.30 0.02 1 1202 269 115 ASN HB2 H 2.77 0.02 1 1203 269 115 ASN HB3 H 2.77 0.02 1 1204 269 115 ASN HD21 H 7.54 0.02 2 1205 269 115 ASN HD22 H 6.78 0.02 2 1206 269 115 ASN C C 177.91 0.05 1 1207 269 115 ASN CA C 56.45 0.05 1 1208 269 115 ASN CB C 37.83 0.05 1 1209 269 115 ASN N N 115.76 0.05 1 1210 269 115 ASN ND2 N 111.79 0.05 1 1211 270 116 ILE H H 7.27 0.02 1 1212 270 116 ILE HA H 3.70 0.02 1 1213 270 116 ILE HB H 1.54 0.02 1 1214 270 116 ILE HG12 H 0.95 0.02 2 1215 270 116 ILE HG13 H 1.70 0.02 2 1216 270 116 ILE HG2 H 0.66 0.02 1 1217 270 116 ILE HD1 H 0.79 0.02 1 1218 270 116 ILE C C 177.42 0.05 1 1219 270 116 ILE CA C 64.80 0.05 1 1220 270 116 ILE CB C 38.77 0.05 1 1221 270 116 ILE CG1 C 29.00 0.05 1 1222 270 116 ILE CG2 C 17.50 0.05 1 1223 270 116 ILE CD1 C 14.33 0.05 1 1224 270 116 ILE N N 121.25 0.05 1 1225 271 117 LEU H H 7.72 0.02 1 1226 271 117 LEU HA H 3.60 0.02 1 1227 271 117 LEU HB2 H 0.55 0.02 1 1228 271 117 LEU HB3 H 1.42 0.02 1 1229 271 117 LEU HG H 1.29 0.02 1 1230 271 117 LEU HD1 H -0.11 0.02 1 1231 271 117 LEU HD2 H -0.59 0.02 1 1232 271 117 LEU C C 178.81 0.05 1 1233 271 117 LEU CA C 57.03 0.05 1 1234 271 117 LEU CB C 41.11 0.05 1 1235 271 117 LEU CG C 25.60 0.05 1 1236 271 117 LEU CD1 C 28.10 0.05 1 1237 271 117 LEU CD2 C 20.42 0.05 1 1238 271 117 LEU N N 116.96 0.05 1 1239 272 118 LYS H H 8.61 0.02 1 1240 272 118 LYS HA H 3.73 0.02 1 1241 272 118 LYS HB2 H 1.27 0.02 2 1242 272 118 LYS HB3 H 1.76 0.02 2 1243 272 118 LYS HG2 H 1.26 0.02 1 1244 272 118 LYS HG3 H 1.26 0.02 1 1245 272 118 LYS HD2 H 1.56 0.02 2 1246 272 118 LYS HD3 H 1.66 0.02 2 1247 272 118 LYS HE2 H 2.92 0.02 1 1248 272 118 LYS HE3 H 2.92 0.02 1 1249 272 118 LYS C C 180.55 0.05 1 1250 272 118 LYS CA C 58.46 0.05 1 1251 272 118 LYS CB C 32.09 0.05 1 1252 272 118 LYS CG C 24.55 0.05 1 1253 272 118 LYS CD C 29.59 0.05 1 1254 272 118 LYS CE C 42.10 0.05 1 1255 272 118 LYS N N 120.26 0.05 1 1256 273 119 GLU H H 7.81 0.02 1 1257 273 119 GLU HA H 3.98 0.02 1 1258 273 119 GLU HB2 H 1.77 0.02 2 1259 273 119 GLU HB3 H 1.93 0.02 2 1260 273 119 GLU HG2 H 2.09 0.02 2 1261 273 119 GLU HG3 H 2.30 0.02 2 1262 273 119 GLU C C 177.29 0.05 1 1263 273 119 GLU CA C 58.64 0.05 1 1264 273 119 GLU CB C 29.34 0.05 1 1265 273 119 GLU CG C 36.07 0.05 1 1266 273 119 GLU N N 120.80 0.05 1 1267 274 120 LYS H H 7.33 0.02 1 1268 274 120 LYS HA H 4.33 0.02 1 1269 274 120 LYS HB2 H 2.16 0.02 1 1270 274 120 LYS HB3 H 1.71 0.02 1 1271 274 120 LYS HG2 H 1.41 0.02 2 1272 274 120 LYS HG3 H 1.51 0.02 2 1273 274 120 LYS HD2 H 1.50 0.02 1 1274 274 120 LYS HD3 H 1.50 0.02 1 1275 274 120 LYS HE2 H 2.80 0.02 1 1276 274 120 LYS HE3 H 2.80 0.02 1 1277 274 120 LYS C C 174.79 0.05 1 1278 274 120 LYS CA C 53.88 0.05 1 1279 274 120 LYS CB C 30.63 0.05 1 1280 274 120 LYS CG C 24.83 0.05 1 1281 274 120 LYS CD C 27.70 0.05 1 1282 274 120 LYS CE C 42.18 0.05 1 1283 274 120 LYS N N 114.83 0.05 1 1284 275 121 ASN H H 7.54 0.02 1 1285 275 121 ASN HA H 4.67 0.02 1 1286 275 121 ASN HB2 H 2.90 0.02 1 1287 275 121 ASN HB3 H 2.61 0.02 1 1288 275 121 ASN HD21 H 7.49 0.02 2 1289 275 121 ASN HD22 H 6.71 0.02 2 1290 275 121 ASN C C 175.20 0.05 1 1291 275 121 ASN CA C 54.95 0.05 1 1292 275 121 ASN CB C 36.18 0.05 1 1293 275 121 ASN N N 111.20 0.05 1 1294 275 121 ASN ND2 N 112.65 0.05 1 1295 276 122 PHE H H 8.18 0.02 1 1296 276 122 PHE HA H 4.38 0.02 1 1297 276 122 PHE HB2 H 3.19 0.02 1 1298 276 122 PHE HB3 H 2.42 0.02 1 1299 276 122 PHE HD1 H 7.31 0.02 1 1300 276 122 PHE HD2 H 7.31 0.02 1 1301 276 122 PHE HE1 H 7.16 0.02 1 1302 276 122 PHE HE2 H 7.16 0.02 1 1303 276 122 PHE HZ H 6.61 0.02 1 1304 276 122 PHE C C 173.57 0.05 1 1305 276 122 PHE CA C 59.21 0.05 1 1306 276 122 PHE CB C 39.00 0.05 1 1307 276 122 PHE N N 114.50 0.05 1 1308 277 123 GLN H H 8.53 0.02 1 1309 277 123 GLN HA H 3.84 0.02 1 1310 277 123 GLN HB2 H 1.94 0.02 1 1311 277 123 GLN HB3 H 2.06 0.02 1 1312 277 123 GLN HG2 H 2.02 0.02 1 1313 277 123 GLN HG3 H 2.02 0.02 1 1314 277 123 GLN HE21 H 6.70 0.02 1 1315 277 123 GLN HE22 H 7.31 0.02 1 1316 277 123 GLN C C 171.83 0.05 1 1317 277 123 GLN CA C 55.61 0.05 1 1318 277 123 GLN CB C 26.72 0.05 1 1319 277 123 GLN CG C 33.66 0.05 1 1320 277 123 GLN N N 112.83 0.05 1 1321 277 123 GLN NE2 N 112.33 0.05 1 1322 278 124 PRO HA H 5.36 0.02 1 1323 278 124 PRO HB2 H 1.39 0.02 2 1324 278 124 PRO HB3 H 1.36 0.02 2 1325 278 124 PRO HG2 H 0.77 0.02 2 1326 278 124 PRO HG3 H 1.28 0.02 2 1327 278 124 PRO HD2 H 2.68 0.02 1 1328 278 124 PRO HD3 H 3.30 0.02 1 1329 278 124 PRO CA C 61.73 0.05 1 1330 278 124 PRO CB C 33.23 0.05 1 1331 278 124 PRO CG C 26.19 0.05 1 1332 278 124 PRO CD C 50.02 0.05 1 1333 279 125 ARG H H 8.75 0.02 1 1334 279 125 ARG HA H 4.64 0.02 1 1335 279 125 ARG HB2 H 1.54 0.02 2 1336 279 125 ARG HB3 H 1.57 0.02 2 1337 279 125 ARG HG2 H 1.38 0.02 2 1338 279 125 ARG HG3 H 1.42 0.02 2 1339 279 125 ARG HD2 H 3.00 0.02 1 1340 279 125 ARG HD3 H 3.00 0.02 1 1341 279 125 ARG C C 174.52 0.05 1 1342 279 125 ARG CA C 55.32 0.05 1 1343 279 125 ARG CB C 34.64 0.05 1 1344 279 125 ARG CG C 27.51 0.05 1 1345 279 125 ARG CD C 43.43 0.05 1 1346 279 125 ARG N N 118.07 0.05 1 1347 280 126 ILE H H 8.65 0.02 1 1348 280 126 ILE HA H 4.95 0.02 1 1349 280 126 ILE HB H 1.56 0.02 1 1350 280 126 ILE HG12 H 0.80 0.02 2 1351 280 126 ILE HG13 H 1.24 0.02 2 1352 280 126 ILE HG2 H 0.62 0.02 1 1353 280 126 ILE HD1 H 0.50 0.02 1 1354 280 126 ILE C C 175.55 0.05 1 1355 280 126 ILE CA C 58.94 0.05 1 1356 280 126 ILE CB C 38.19 0.05 1 1357 280 126 ILE CG1 C 27.68 0.05 1 1358 280 126 ILE CG2 C 17.36 0.05 1 1359 280 126 ILE CD1 C 12.37 0.05 1 1360 280 126 ILE N N 123.85 0.05 1 1361 281 127 SER H H 9.02 0.02 1 1362 281 127 SER HA H 4.72 0.02 1 1363 281 127 SER HB2 H 3.73 0.02 1 1364 281 127 SER HB3 H 3.73 0.02 1 1365 281 127 SER C C 172.57 0.05 1 1366 281 127 SER CA C 56.56 0.05 1 1367 281 127 SER CB C 65.42 0.05 1 1368 281 127 SER N N 122.92 0.05 1 1369 282 128 TYR H H 8.57 0.02 1 1370 282 128 TYR HA H 4.40 0.02 1 1371 282 128 TYR HB2 H 2.91 0.02 2 1372 282 128 TYR HB3 H 2.69 0.02 2 1373 282 128 TYR HD1 H 6.87 0.02 1 1374 282 128 TYR HD2 H 6.87 0.02 1 1375 282 128 TYR HE1 H 6.66 0.02 1 1376 282 128 TYR HE2 H 6.66 0.02 1 1377 282 128 TYR CA C 56.58 0.05 1 1378 282 128 TYR CB C 38.91 0.05 1 1379 282 128 TYR N N 122.55 0.05 1 1380 283 129 PRO HA H 3.34 0.02 1 1381 283 129 PRO HB2 H 1.73 0.02 1 1382 283 129 PRO HB3 H 1.57 0.02 1 1383 283 129 PRO HG2 H 1.33 0.02 2 1384 283 129 PRO HG3 H 1.82 0.02 2 1385 283 129 PRO HD2 H 3.53 0.02 1 1386 283 129 PRO HD3 H 3.20 0.02 1 1387 283 129 PRO CA C 64.28 0.05 1 1388 283 129 PRO CB C 32.32 0.05 1 1389 283 129 PRO CG C 24.99 0.05 1 1390 283 129 PRO CD C 49.85 0.05 1 1391 284 130 ALA H H 8.10 0.02 1 1392 284 130 ALA HA H 4.18 0.02 1 1393 284 130 ALA HB H 1.24 0.02 1 1394 284 130 ALA C C 175.25 0.05 1 1395 284 130 ALA CA C 51.42 0.05 1 1396 284 130 ALA CB C 19.18 0.05 1 1397 284 130 ALA N N 124.96 0.05 1 1398 285 131 LYS H H 8.73 0.02 1 1399 285 131 LYS HA H 4.69 0.02 1 1400 285 131 LYS HB2 H 1.52 0.02 1 1401 285 131 LYS HB3 H 1.45 0.02 1 1402 285 131 LYS HG2 H 1.15 0.02 2 1403 285 131 LYS HG3 H 1.19 0.02 2 1404 285 131 LYS HD2 H 1.36 0.02 1 1405 285 131 LYS HD3 H 1.36 0.02 1 1406 285 131 LYS HE2 H 2.67 0.02 1 1407 285 131 LYS HE3 H 2.67 0.02 1 1408 285 131 LYS C C 175.31 0.05 1 1409 285 131 LYS CA C 55.78 0.05 1 1410 285 131 LYS CB C 34.01 0.05 1 1411 285 131 LYS CG C 25.05 0.05 1 1412 285 131 LYS CD C 30.10 0.05 1 1413 285 131 LYS CE C 41.56 0.05 1 1414 285 131 LYS N N 121.79 0.05 1 1415 286 132 LEU H H 8.05 0.02 1 1416 286 132 LEU HA H 4.58 0.02 1 1417 286 132 LEU HB2 H -0.84 0.02 1 1418 286 132 LEU HB3 H 0.52 0.02 1 1419 286 132 LEU HG H 1.12 0.02 1 1420 286 132 LEU HD1 H 0.50 0.02 1 1421 286 132 LEU HD2 H 0.11 0.02 1 1422 286 132 LEU C C 174.70 0.05 1 1423 286 132 LEU CA C 53.48 0.05 1 1424 286 132 LEU CB C 42.57 0.05 1 1425 286 132 LEU CG C 26.96 0.05 1 1426 286 132 LEU CD1 C 23.21 0.05 1 1427 286 132 LEU CD2 C 26.68 0.05 1 1428 286 132 LEU N N 126.91 0.05 1 1429 287 133 SER H H 9.06 0.02 1 1430 287 133 SER HA H 5.56 0.02 1 1431 287 133 SER HB2 H 2.90 0.02 2 1432 287 133 SER HB3 H 2.98 0.02 2 1433 287 133 SER C C 173.68 0.05 1 1434 287 133 SER CA C 55.41 0.05 1 1435 287 133 SER CB C 67.21 0.05 1 1436 287 133 SER N N 120.46 0.05 1 1437 288 134 PHE H H 7.75 0.02 1 1438 288 134 PHE HA H 4.53 0.02 1 1439 288 134 PHE HB2 H 2.87 0.02 1 1440 288 134 PHE HB3 H 3.12 0.02 1 1441 288 134 PHE HD1 H 6.70 0.02 1 1442 288 134 PHE HD2 H 6.70 0.02 1 1443 288 134 PHE HE1 H 6.61 0.02 1 1444 288 134 PHE HE2 H 6.61 0.02 1 1445 288 134 PHE HZ H 6.43 0.02 1 1446 288 134 PHE C C 171.68 0.05 1 1447 288 134 PHE CA C 56.80 0.05 1 1448 288 134 PHE CB C 38.22 0.05 1 1449 288 134 PHE N N 111.78 0.05 1 1450 289 135 ILE H H 8.55 0.02 1 1451 289 135 ILE HA H 4.36 0.02 1 1452 289 135 ILE HB H 1.57 0.02 1 1453 289 135 ILE HG12 H 1.32 0.02 1 1454 289 135 ILE HG13 H 0.77 0.02 1 1455 289 135 ILE HG2 H 0.55 0.02 1 1456 289 135 ILE HD1 H 0.58 0.02 1 1457 289 135 ILE C C 175.55 0.05 1 1458 289 135 ILE CA C 60.32 0.05 1 1459 289 135 ILE CB C 38.14 0.05 1 1460 289 135 ILE CG1 C 27.93 0.05 1 1461 289 135 ILE CG2 C 16.68 0.05 1 1462 289 135 ILE CD1 C 12.66 0.05 1 1463 289 135 ILE N N 119.32 0.05 1 1464 290 136 SER H H 8.73 0.02 1 1465 290 136 SER HA H 4.76 0.02 1 1466 290 136 SER HB2 H 3.55 0.02 2 1467 290 136 SER HB3 H 3.69 0.02 2 1468 290 136 SER C C 174.61 0.05 1 1469 290 136 SER CA C 57.14 0.05 1 1470 290 136 SER CB C 64.89 0.05 1 1471 290 136 SER N N 121.44 0.05 1 1472 291 137 GLU H H 9.37 0.02 1 1473 291 137 GLU HA H 3.79 0.02 1 1474 291 137 GLU HB2 H 2.08 0.02 1 1475 291 137 GLU HB3 H 2.08 0.02 1 1476 291 137 GLU HG2 H 2.20 0.02 2 1477 291 137 GLU HG3 H 2.27 0.02 2 1478 291 137 GLU C C 176.83 0.05 1 1479 291 137 GLU CA C 57.19 0.05 1 1480 291 137 GLU CB C 26.81 0.05 1 1481 291 137 GLU CG C 36.57 0.05 1 1482 291 137 GLU N N 126.07 0.05 1 1483 292 138 GLY H H 8.38 0.02 1 1484 292 138 GLY HA2 H 4.01 0.02 1 1485 292 138 GLY HA3 H 3.40 0.02 1 1486 292 138 GLY CA C 45.34 0.05 1 1487 292 138 GLY N N 103.05 0.05 1 1488 293 139 GLU H H 7.67 0.02 1 1489 293 139 GLU HA H 4.58 0.02 1 1490 293 139 GLU HB2 H 1.74 0.02 2 1491 293 139 GLU HB3 H 1.85 0.02 2 1492 293 139 GLU HG2 H 2.08 0.02 1 1493 293 139 GLU HG3 H 2.08 0.02 1 1494 293 139 GLU C C 173.90 0.05 1 1495 293 139 GLU CA C 53.98 0.05 1 1496 293 139 GLU CB C 33.36 0.05 1 1497 293 139 GLU CG C 35.78 0.05 1 1498 293 139 GLU N N 119.97 0.05 1 1499 294 140 ILE H H 8.33 0.02 1 1500 294 140 ILE HA H 3.83 0.02 1 1501 294 140 ILE HB H 1.39 0.02 1 1502 294 140 ILE HG12 H 0.57 0.02 2 1503 294 140 ILE HG13 H 1.20 0.02 2 1504 294 140 ILE HG2 H 0.26 0.02 1 1505 294 140 ILE HD1 H 0.59 0.02 1 1506 294 140 ILE C C 174.75 0.05 1 1507 294 140 ILE CA C 61.49 0.05 1 1508 294 140 ILE CB C 37.70 0.05 1 1509 294 140 ILE CG1 C 28.12 0.05 1 1510 294 140 ILE CG2 C 17.46 0.05 1 1511 294 140 ILE CD1 C 13.27 0.05 1 1512 294 140 ILE N N 122.95 0.05 1 1513 295 141 LYS H H 8.05 0.02 1 1514 295 141 LYS HA H 4.09 0.02 1 1515 295 141 LYS HB2 H 0.70 0.02 1 1516 295 141 LYS HB3 H 0.77 0.02 1 1517 295 141 LYS HG2 H 0.90 0.02 2 1518 295 141 LYS HG3 H 1.07 0.02 2 1519 295 141 LYS HD2 H 1.21 0.02 2 1520 295 141 LYS HD3 H 1.36 0.02 2 1521 295 141 LYS HE2 H 2.69 0.02 2 1522 295 141 LYS HE3 H 2.74 0.02 2 1523 295 141 LYS C C 173.44 0.05 1 1524 295 141 LYS CA C 52.56 0.05 1 1525 295 141 LYS CB C 34.22 0.05 1 1526 295 141 LYS CG C 24.17 0.05 1 1527 295 141 LYS CD C 27.89 0.05 1 1528 295 141 LYS CE C 42.13 0.05 1 1529 295 141 LYS N N 127.81 0.05 1 1530 296 142 TYR H H 7.50 0.02 1 1531 296 142 TYR HA H 4.57 0.02 1 1532 296 142 TYR HB2 H 2.18 0.02 2 1533 296 142 TYR HB3 H 2.38 0.02 2 1534 296 142 TYR HD1 H 6.63 0.02 1 1535 296 142 TYR HD2 H 6.63 0.02 1 1536 296 142 TYR HE1 H 6.50 0.02 1 1537 296 142 TYR HE2 H 6.50 0.02 1 1538 296 142 TYR C C 175.32 0.05 1 1539 296 142 TYR CA C 56.59 0.05 1 1540 296 142 TYR CB C 41.95 0.05 1 1541 296 142 TYR N N 116.06 0.05 1 1542 297 143 PHE H H 9.21 0.02 1 1543 297 143 PHE HA H 4.60 0.02 1 1544 297 143 PHE HB2 H 3.00 0.02 1 1545 297 143 PHE HB3 H 2.58 0.02 1 1546 297 143 PHE HD1 H 6.56 0.02 1 1547 297 143 PHE HD2 H 6.56 0.02 1 1548 297 143 PHE HE1 H 6.18 0.02 1 1549 297 143 PHE HE2 H 6.18 0.02 1 1550 297 143 PHE HZ H 6.75 0.02 1 1551 297 143 PHE C C 175.14 0.05 1 1552 297 143 PHE CA C 57.20 0.05 1 1553 297 143 PHE CB C 41.89 0.05 1 1554 297 143 PHE N N 117.80 0.05 1 1555 298 144 ILE H H 8.07 0.02 1 1556 298 144 ILE HA H 4.23 0.02 1 1557 298 144 ILE HB H 1.94 0.02 1 1558 298 144 ILE HG12 H 1.21 0.02 2 1559 298 144 ILE HG13 H 1.44 0.02 2 1560 298 144 ILE HG2 H 0.90 0.02 1 1561 298 144 ILE HD1 H 0.79 0.02 1 1562 298 144 ILE C C 174.58 0.05 1 1563 298 144 ILE CA C 62.53 0.05 1 1564 298 144 ILE CB C 38.65 0.05 1 1565 298 144 ILE CG1 C 27.90 0.05 1 1566 298 144 ILE CG2 C 18.09 0.05 1 1567 298 144 ILE CD1 C 13.18 0.05 1 1568 298 144 ILE N N 120.69 0.05 1 1569 299 145 ASP H H 7.60 0.02 1 1570 299 145 ASP HA H 4.58 0.02 1 1571 299 145 ASP HB2 H 2.83 0.02 2 1572 299 145 ASP HB3 H 2.96 0.02 2 1573 299 145 ASP C C 175.88 0.05 1 1574 299 145 ASP CA C 52.64 0.05 1 1575 299 145 ASP CB C 42.55 0.05 1 1576 299 145 ASP N N 114.35 0.05 1 1577 300 146 LYS H H 8.44 0.02 1 1578 300 146 LYS HA H 3.80 0.02 1 1579 300 146 LYS HB2 H 1.45 0.02 2 1580 300 146 LYS HB3 H 1.52 0.02 2 1581 300 146 LYS HG2 H 0.82 0.02 2 1582 300 146 LYS HG3 H 0.93 0.02 2 1583 300 146 LYS HD2 H 1.37 0.02 2 1584 300 146 LYS HD3 H 1.42 0.02 2 1585 300 146 LYS HE2 H 2.48 0.02 2 1586 300 146 LYS HE3 H 2.64 0.02 2 1587 300 146 LYS C C 178.38 0.05 1 1588 300 146 LYS CA C 60.20 0.05 1 1589 300 146 LYS CB C 32.77 0.05 1 1590 300 146 LYS CG C 26.80 0.05 1 1591 300 146 LYS CD C 29.60 0.05 1 1592 300 146 LYS CE C 41.68 0.05 1 1593 300 146 LYS N N 118.01 0.05 1 1594 301 147 GLN H H 8.31 0.02 1 1595 301 147 GLN HA H 3.75 0.02 1 1596 301 147 GLN HB2 H 2.05 0.02 1 1597 301 147 GLN HB3 H 2.05 0.02 1 1598 301 147 GLN HG2 H 2.26 0.02 2 1599 301 147 GLN HG3 H 2.38 0.02 2 1600 301 147 GLN C C 177.53 0.05 1 1601 301 147 GLN CA C 59.01 0.05 1 1602 301 147 GLN CB C 27.19 0.05 1 1603 301 147 GLN CG C 33.41 0.05 1 1604 301 147 GLN N N 121.14 0.05 1 1605 302 148 MET H H 8.57 0.02 1 1606 302 148 MET HA H 4.36 0.02 1 1607 302 148 MET HB2 H 2.38 0.02 2 1608 302 148 MET HB3 H 2.53 0.02 2 1609 302 148 MET HG2 H 2.83 0.02 2 1610 302 148 MET HG3 H 3.05 0.02 2 1611 302 148 MET HE H 1.75 0.02 1 1612 302 148 MET C C 179.81 0.05 1 1613 302 148 MET CA C 59.07 0.05 1 1614 302 148 MET CB C 33.32 0.05 1 1615 302 148 MET CG C 32.87 0.05 1 1616 302 148 MET CE C 17.90 0.05 1 1617 302 148 MET N N 118.76 0.05 1 1618 303 149 LEU H H 7.45 0.02 1 1619 303 149 LEU HA H 4.02 0.02 1 1620 303 149 LEU HB2 H 0.96 0.02 1 1621 303 149 LEU HB3 H 2.08 0.02 1 1622 303 149 LEU HG H 1.32 0.02 1 1623 303 149 LEU HD1 H -0.02 0.02 1 1624 303 149 LEU HD2 H 0.73 0.02 1 1625 303 149 LEU CA C 57.17 0.05 1 1626 303 149 LEU CB C 41.06 0.05 1 1627 303 149 LEU CG C 26.30 0.05 1 1628 303 149 LEU CD1 C 21.88 0.05 1 1629 303 149 LEU CD2 C 27.65 0.05 1 1630 303 149 LEU N N 120.45 0.05 1 1631 304 150 ARG H H 8.80 0.02 1 1632 304 150 ARG HA H 3.77 0.02 1 1633 304 150 ARG HB2 H 1.78 0.02 2 1634 304 150 ARG HB3 H 1.91 0.02 2 1635 304 150 ARG HG2 H 1.78 0.02 2 1636 304 150 ARG HG3 H 2.00 0.02 2 1637 304 150 ARG HD2 H 3.08 0.02 2 1638 304 150 ARG HD3 H 3.19 0.02 2 1639 304 150 ARG C C 178.66 0.05 1 1640 304 150 ARG CA C 60.55 0.05 1 1641 304 150 ARG CB C 30.12 0.05 1 1642 304 150 ARG CG C 29.97 0.05 1 1643 304 150 ARG CD C 43.68 0.05 1 1644 304 150 ARG N N 121.48 0.05 1 1645 305 151 ASP H H 8.25 0.02 1 1646 305 151 ASP HA H 4.28 0.02 1 1647 305 151 ASP HB2 H 2.74 0.02 2 1648 305 151 ASP HB3 H 2.78 0.02 2 1649 305 151 ASP C C 178.25 0.05 1 1650 305 151 ASP CA C 57.36 0.05 1 1651 305 151 ASP CB C 40.25 0.05 1 1652 305 151 ASP N N 118.13 0.05 1 1653 306 152 PHE H H 7.68 0.02 1 1654 306 152 PHE HA H 4.33 0.02 1 1655 306 152 PHE HB2 H 3.55 0.02 1 1656 306 152 PHE HB3 H 3.26 0.02 1 1657 306 152 PHE HD1 H 7.12 0.02 1 1658 306 152 PHE HD2 H 7.12 0.02 1 1659 306 152 PHE HE1 H 6.18 0.02 1 1660 306 152 PHE HE2 H 6.18 0.02 1 1661 306 152 PHE HZ H 5.02 0.02 1 1662 306 152 PHE CA C 60.98 0.05 1 1663 306 152 PHE CB C 41.10 0.05 1 1664 306 152 PHE N N 121.25 0.05 1 1665 307 153 VAL H H 8.37 0.02 1 1666 307 153 VAL HA H 3.75 0.02 1 1667 307 153 VAL HB H 2.06 0.02 1 1668 307 153 VAL HG1 H 0.84 0.02 1 1669 307 153 VAL HG2 H 0.85 0.02 1 1670 307 153 VAL C C 176.94 0.05 1 1671 307 153 VAL CA C 63.94 0.05 1 1672 307 153 VAL CB C 31.17 0.05 1 1673 307 153 VAL CG1 C 22.10 0.05 1 1674 307 153 VAL CG2 C 20.39 0.05 1 1675 307 153 VAL N N 110.96 0.05 1 1676 308 154 THR H H 7.52 0.02 1 1677 308 154 THR HA H 3.67 0.02 1 1678 308 154 THR HB H 4.16 0.02 1 1679 308 154 THR HG2 H 1.25 0.02 1 1680 308 154 THR C C 175.24 0.05 1 1681 308 154 THR CA C 66.45 0.05 1 1682 308 154 THR CB C 69.14 0.05 1 1683 308 154 THR CG2 C 21.46 0.05 1 1684 308 154 THR N N 114.14 0.05 1 1685 309 155 THR H H 6.74 0.02 1 1686 309 155 THR HA H 4.38 0.02 1 1687 309 155 THR HB H 4.45 0.02 1 1688 309 155 THR HG2 H 1.06 0.02 1 1689 309 155 THR CA C 60.83 0.05 1 1690 309 155 THR CB C 68.58 0.05 1 1691 309 155 THR CG2 C 21.42 0.05 1 1692 309 155 THR N N 106.19 0.05 1 1693 310 156 ARG H H 7.29 0.02 1 1694 310 156 ARG HA H 4.73 0.02 1 1695 310 156 ARG HB2 H 1.72 0.02 2 1696 310 156 ARG HB3 H 1.76 0.02 2 1697 310 156 ARG HG2 H 1.10 0.02 2 1698 310 156 ARG HG3 H 1.27 0.02 2 1699 310 156 ARG HD2 H 2.14 0.02 1 1700 310 156 ARG HD3 H 2.54 0.02 1 1701 310 156 ARG HE H 7.19 0.02 1 1702 310 156 ARG C C 173.67 0.05 1 1703 310 156 ARG CA C 53.07 0.05 1 1704 310 156 ARG CB C 31.48 0.05 1 1705 310 156 ARG CG C 26.96 0.05 1 1706 310 156 ARG CD C 42.86 0.05 1 1707 310 156 ARG N N 123.09 0.05 1 1708 310 156 ARG NE N 86.93 0.05 1 1709 311 157 PRO HA H 4.01 0.02 1 1710 311 157 PRO HB2 H 2.26 0.02 2 1711 311 157 PRO HB3 H 1.88 0.02 2 1712 311 157 PRO HG2 H 1.86 0.02 2 1713 311 157 PRO HG3 H 2.02 0.02 2 1714 311 157 PRO HD2 H 3.72 0.02 2 1715 311 157 PRO HD3 H 3.50 0.02 2 1716 311 157 PRO CA C 65.90 0.05 1 1717 311 157 PRO CB C 32.26 0.05 1 1718 311 157 PRO CG C 27.08 0.05 1 1719 311 157 PRO CD C 50.32 0.05 1 1720 312 158 ALA HA H 3.95 0.02 1 1721 312 158 ALA HB H 1.40 0.02 1 1722 312 158 ALA CA C 55.08 0.05 1 1723 312 158 ALA CB C 17.89 0.05 1 1724 313 159 LEU H H 7.29 0.02 1 1725 313 159 LEU HA H 3.96 0.02 1 1726 313 159 LEU HB2 H 1.31 0.02 1 1727 313 159 LEU HB3 H 1.71 0.02 1 1728 313 159 LEU HG H 1.54 0.02 1 1729 313 159 LEU HD1 H 0.47 0.02 1 1730 313 159 LEU HD2 H 0.75 0.02 1 1731 313 159 LEU C C 178.17 0.05 1 1732 313 159 LEU CA C 56.67 0.05 1 1733 313 159 LEU CB C 42.86 0.05 1 1734 313 159 LEU CG C 26.87 0.05 1 1735 313 159 LEU CD1 C 24.10 0.05 1 1736 313 159 LEU CD2 C 25.28 0.05 1 1737 313 159 LEU N N 119.02 0.05 1 1738 314 160 LYS H H 8.42 0.02 1 1739 314 160 LYS HA H 3.35 0.02 1 1740 314 160 LYS HB2 H 1.79 0.02 2 1741 314 160 LYS HB3 H 1.85 0.02 2 1742 314 160 LYS HG2 H 1.10 0.02 2 1743 314 160 LYS HG3 H 1.17 0.02 2 1744 314 160 LYS HD2 H 1.51 0.02 1 1745 314 160 LYS HD3 H 1.51 0.02 1 1746 314 160 LYS HE2 H 2.80 0.02 1 1747 314 160 LYS HE3 H 2.80 0.02 1 1748 314 160 LYS C C 177.99 0.05 1 1749 314 160 LYS CA C 60.45 0.05 1 1750 314 160 LYS CB C 31.27 0.05 1 1751 314 160 LYS CG C 25.29 0.05 1 1752 314 160 LYS CD C 29.49 0.05 1 1753 314 160 LYS CE C 42.00 0.05 1 1754 314 160 LYS N N 120.94 0.05 1 1755 315 161 GLU H H 7.77 0.02 1 1756 315 161 GLU HA H 3.88 0.02 1 1757 315 161 GLU HB2 H 1.93 0.02 2 1758 315 161 GLU HB3 H 1.86 0.02 2 1759 315 161 GLU HG2 H 2.17 0.02 2 1760 315 161 GLU HG3 H 2.26 0.02 2 1761 315 161 GLU C C 178.49 0.05 1 1762 315 161 GLU CA C 58.77 0.05 1 1763 315 161 GLU CB C 29.20 0.05 1 1764 315 161 GLU CG C 35.54 0.05 1 1765 315 161 GLU N N 115.50 0.05 1 1766 316 162 LEU H H 7.14 0.02 1 1767 316 162 LEU HA H 4.06 0.02 1 1768 316 162 LEU HB2 H 1.42 0.02 1 1769 316 162 LEU HB3 H 1.72 0.02 1 1770 316 162 LEU HG H 1.60 0.02 1 1771 316 162 LEU HD1 H 0.71 0.02 1 1772 316 162 LEU HD2 H 0.81 0.02 1 1773 316 162 LEU C C 179.16 0.05 1 1774 316 162 LEU CA C 56.93 0.05 1 1775 316 162 LEU CB C 43.10 0.05 1 1776 316 162 LEU CG C 26.57 0.05 1 1777 316 162 LEU CD1 C 24.33 0.05 1 1778 316 162 LEU CD2 C 24.83 0.05 1 1779 316 162 LEU N N 116.93 0.05 1 1780 317 163 LEU H H 7.60 0.02 1 1781 317 163 LEU HA H 4.33 0.02 1 1782 317 163 LEU HB2 H 1.42 0.02 2 1783 317 163 LEU HB3 H 1.50 0.02 2 1784 317 163 LEU HG H 1.47 0.02 1 1785 317 163 LEU HD1 H 0.47 0.02 1 1786 317 163 LEU HD2 H 0.53 0.02 1 1787 317 163 LEU C C 176.93 0.05 1 1788 317 163 LEU CA C 54.36 0.05 1 1789 317 163 LEU CB C 43.06 0.05 1 1790 317 163 LEU CG C 26.25 0.05 1 1791 317 163 LEU CD1 C 25.79 0.05 1 1792 317 163 LEU CD2 C 23.24 0.05 1 1793 317 163 LEU N N 113.75 0.05 1 1794 318 164 LYS H H 7.75 0.02 1 1795 318 164 LYS HA H 3.79 0.02 1 1796 318 164 LYS HB2 H 1.77 0.02 2 1797 318 164 LYS HB3 H 1.85 0.02 2 1798 318 164 LYS HG2 H 1.18 0.02 2 1799 318 164 LYS HG3 H 1.41 0.02 2 1800 318 164 LYS HD2 H 1.50 0.02 1 1801 318 164 LYS HD3 H 1.50 0.02 1 1802 318 164 LYS HE2 H 2.78 0.02 1 1803 318 164 LYS HE3 H 2.78 0.02 1 1804 318 164 LYS C C 177.57 0.05 1 1805 318 164 LYS CA C 60.64 0.05 1 1806 318 164 LYS CB C 31.77 0.05 1 1807 318 164 LYS CG C 23.81 0.05 1 1808 318 164 LYS CD C 29.96 0.05 1 1809 318 164 LYS CE C 42.00 0.05 1 1810 318 164 LYS N N 119.88 0.05 1 1811 319 165 GLU H H 8.11 0.02 1 1812 319 165 GLU HA H 4.11 0.02 1 1813 319 165 GLU HB2 H 1.86 0.02 2 1814 319 165 GLU HB3 H 1.92 0.02 2 1815 319 165 GLU HG2 H 2.14 0.02 1 1816 319 165 GLU HG3 H 2.14 0.02 1 1817 319 165 GLU C C 179.24 0.05 1 1818 319 165 GLU CA C 58.86 0.05 1 1819 319 165 GLU CB C 28.88 0.05 1 1820 319 165 GLU CG C 36.51 0.05 1 1821 319 165 GLU N N 118.99 0.05 1 1822 320 166 ALA H H 8.08 0.02 1 1823 320 166 ALA HA H 4.08 0.02 1 1824 320 166 ALA HB H 1.21 0.02 1 1825 320 166 ALA C C 178.91 0.05 1 1826 320 166 ALA CA C 53.90 0.05 1 1827 320 166 ALA CB C 18.47 0.05 1 1828 320 166 ALA N N 122.96 0.05 1 1829 321 167 LEU H H 7.95 0.02 1 1830 321 167 LEU HA H 4.22 0.02 1 1831 321 167 LEU HB2 H 1.42 0.02 2 1832 321 167 LEU HB3 H 1.49 0.02 2 1833 321 167 LEU HG H 1.52 0.02 1 1834 321 167 LEU HD1 H 0.67 0.02 1 1835 321 167 LEU HD2 H 0.78 0.02 1 1836 321 167 LEU C C 175.96 0.05 1 1837 321 167 LEU CA C 54.11 0.05 1 1838 321 167 LEU CB C 42.89 0.05 1 1839 321 167 LEU CG C 26.72 0.05 1 1840 321 167 LEU CD1 C 26.39 0.05 1 1841 321 167 LEU CD2 C 23.35 0.05 1 1842 321 167 LEU N N 115.23 0.05 1 1843 322 168 ASN H H 7.79 0.02 1 1844 322 168 ASN HA H 4.45 0.02 1 1845 322 168 ASN HB2 H 2.63 0.02 2 1846 322 168 ASN HB3 H 2.89 0.02 2 1847 322 168 ASN HD21 H 6.81 0.02 1 1848 322 168 ASN HD22 H 7.54 0.02 1 1849 322 168 ASN CA C 53.94 0.05 1 1850 322 168 ASN CB C 37.72 0.05 1 1851 322 168 ASN N N 118.98 0.05 1 1852 322 168 ASN ND2 N 112.2 0.05 1 1853 323 169 MET CA C 56.30 0.05 1 1854 323 169 MET CB C 32.66 0.05 1 1855 323 169 MET CG C 33.61 0.05 1 1856 324 170 GLU H H 8.42 0.02 1 1857 324 170 GLU HA H 4.11 0.02 1 1858 324 170 GLU HB2 H 1.78 0.02 2 1859 324 170 GLU HB3 H 1.91 0.02 2 1860 324 170 GLU HG2 H 2.08 0.02 1 1861 324 170 GLU HG3 H 2.08 0.02 1 1862 324 170 GLU CA C 56.55 0.05 1 1863 324 170 GLU CB C 29.55 0.05 1 1864 324 170 GLU CG C 36.17 0.05 1 1865 324 170 GLU N N 120.68 0.05 1 1866 325 171 ARG CA C 55.77 0.05 1 1867 325 171 ARG CB C 30.93 0.05 1 1868 326 172 ASN H H 7.99 0.02 1 1869 326 172 ASN CA C 54.59 0.05 1 1870 326 172 ASN N N 124.77 0.05 1 1871 327 173 ASN HA H 4.58 0.02 1 1872 327 173 ASN HB2 H 2.61 0.02 2 1873 327 173 ASN HB3 H 2.70 0.02 2 1874 327 173 ASN CA C 53.39 0.05 1 1875 327 173 ASN CB C 38.72 0.05 1 1876 328 174 ARG H H 7.78 0.02 1 1877 328 174 ARG HA H 4.01 0.02 1 1878 328 174 ARG HB2 H 1.58 0.02 2 1879 328 174 ARG HB3 H 1.71 0.02 2 1880 328 174 ARG HG2 H 1.44 0.02 1 1881 328 174 ARG HG3 H 1.44 0.02 1 1882 328 174 ARG HD2 H 3.05 0.02 1 1883 328 174 ARG HD3 H 3.05 0.02 1 1884 328 174 ARG CA C 57.29 0.05 1 1885 328 174 ARG CB C 31.26 0.05 1 1886 328 174 ARG CG C 27.02 0.05 1 1887 328 174 ARG CD C 43.29 0.05 1 1888 328 174 ARG N N 125.77 0.05 1 stop_ save_