data_7319 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Polymerase Beta and Double gap double hairpin DNA ; _BMRB_accession_number 7319 _BMRB_flat_file_name bmr7319.str _Entry_type new _Submission_date 2006-10-19 _Accession_date 2006-10-19 _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 Mueller Geoffrey A. . 2 DeRose Eugene F. . 3 Kirby Thomas W. . 4 London Robert E. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 268 "13C chemical shifts" 775 "15N chemical shifts" 268 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-07-14 update BMRB 'update DNA residue label to two-letter code' 2009-08-31 update BMRB 'complete entry citation' 2007-06-26 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'NMR assignment of polymerase beta labeled with 2H, 13C, and 15N in complex with substrate DNA' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 19421423 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Mueller Geoffrey A. . 2 DeRose Eugene F. . 3 Kirby Thomas W. . 4 London Robert E. . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_volume 1 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 33 _Page_last 35 _Year 2007 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'polyermase beta in complex with substrate DNA' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'polyermase beta' $pol_beta 'double gap double hairpin dna' $dgdhp stop_ _System_molecular_weight 46000 _System_physical_state native _System_oligomer_state 'protein-DNA complex' _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_pol_beta _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'pol beta' _Molecular_mass 39000 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 335 _Mol_residue_sequence ; MSKRKAPQETLNGGITDMLV ELANFEKNVSQAIHKYNAYR KAASVIAKYPHKIKSGAEAK KLPGVGTKIAEKIDEFLATG KLRKLEKIRQDDTSSSINFL TRVTGIGPSAARKLVDEGIK TLEDLRKNEDKLNHHQRIGL KYFEDFEKRIPREEMLQMQD IVLNEVKKLDPEYIATVCGS FRRGAESSGDMDVLLTHPNF TSESSKQPKLLHRVVEQLQK VRFITDTLSKGETKFMGVCQ LPSENDENEYPHRRIDIRLI PKDQYYCGVLYFTGSDIFNK NMRAHALEKGFTINEYTIRP LGVTGVAGEPLPVDSEQDIF DYIQWRYREPKDRSE ; loop_ _Residue_seq_code _Residue_label 1 MET 2 SER 3 LYS 4 ARG 5 LYS 6 ALA 7 PRO 8 GLN 9 GLU 10 THR 11 LEU 12 ASN 13 GLY 14 GLY 15 ILE 16 THR 17 ASP 18 MET 19 LEU 20 VAL 21 GLU 22 LEU 23 ALA 24 ASN 25 PHE 26 GLU 27 LYS 28 ASN 29 VAL 30 SER 31 GLN 32 ALA 33 ILE 34 HIS 35 LYS 36 TYR 37 ASN 38 ALA 39 TYR 40 ARG 41 LYS 42 ALA 43 ALA 44 SER 45 VAL 46 ILE 47 ALA 48 LYS 49 TYR 50 PRO 51 HIS 52 LYS 53 ILE 54 LYS 55 SER 56 GLY 57 ALA 58 GLU 59 ALA 60 LYS 61 LYS 62 LEU 63 PRO 64 GLY 65 VAL 66 GLY 67 THR 68 LYS 69 ILE 70 ALA 71 GLU 72 LYS 73 ILE 74 ASP 75 GLU 76 PHE 77 LEU 78 ALA 79 THR 80 GLY 81 LYS 82 LEU 83 ARG 84 LYS 85 LEU 86 GLU 87 LYS 88 ILE 89 ARG 90 GLN 91 ASP 92 ASP 93 THR 94 SER 95 SER 96 SER 97 ILE 98 ASN 99 PHE 100 LEU 101 THR 102 ARG 103 VAL 104 THR 105 GLY 106 ILE 107 GLY 108 PRO 109 SER 110 ALA 111 ALA 112 ARG 113 LYS 114 LEU 115 VAL 116 ASP 117 GLU 118 GLY 119 ILE 120 LYS 121 THR 122 LEU 123 GLU 124 ASP 125 LEU 126 ARG 127 LYS 128 ASN 129 GLU 130 ASP 131 LYS 132 LEU 133 ASN 134 HIS 135 HIS 136 GLN 137 ARG 138 ILE 139 GLY 140 LEU 141 LYS 142 TYR 143 PHE 144 GLU 145 ASP 146 PHE 147 GLU 148 LYS 149 ARG 150 ILE 151 PRO 152 ARG 153 GLU 154 GLU 155 MET 156 LEU 157 GLN 158 MET 159 GLN 160 ASP 161 ILE 162 VAL 163 LEU 164 ASN 165 GLU 166 VAL 167 LYS 168 LYS 169 LEU 170 ASP 171 PRO 172 GLU 173 TYR 174 ILE 175 ALA 176 THR 177 VAL 178 CYS 179 GLY 180 SER 181 PHE 182 ARG 183 ARG 184 GLY 185 ALA 186 GLU 187 SER 188 SER 189 GLY 190 ASP 191 MET 192 ASP 193 VAL 194 LEU 195 LEU 196 THR 197 HIS 198 PRO 199 ASN 200 PHE 201 THR 202 SER 203 GLU 204 SER 205 SER 206 LYS 207 GLN 208 PRO 209 LYS 210 LEU 211 LEU 212 HIS 213 ARG 214 VAL 215 VAL 216 GLU 217 GLN 218 LEU 219 GLN 220 LYS 221 VAL 222 ARG 223 PHE 224 ILE 225 THR 226 ASP 227 THR 228 LEU 229 SER 230 LYS 231 GLY 232 GLU 233 THR 234 LYS 235 PHE 236 MET 237 GLY 238 VAL 239 CYS 240 GLN 241 LEU 242 PRO 243 SER 244 GLU 245 ASN 246 ASP 247 GLU 248 ASN 249 GLU 250 TYR 251 PRO 252 HIS 253 ARG 254 ARG 255 ILE 256 ASP 257 ILE 258 ARG 259 LEU 260 ILE 261 PRO 262 LYS 263 ASP 264 GLN 265 TYR 266 TYR 267 CYS 268 GLY 269 VAL 270 LEU 271 TYR 272 PHE 273 THR 274 GLY 275 SER 276 ASP 277 ILE 278 PHE 279 ASN 280 LYS 281 ASN 282 MET 283 ARG 284 ALA 285 HIS 286 ALA 287 LEU 288 GLU 289 LYS 290 GLY 291 PHE 292 THR 293 ILE 294 ASN 295 GLU 296 TYR 297 THR 298 ILE 299 ARG 300 PRO 301 LEU 302 GLY 303 VAL 304 THR 305 GLY 306 VAL 307 ALA 308 GLY 309 GLU 310 PRO 311 LEU 312 PRO 313 VAL 314 ASP 315 SER 316 GLU 317 GLN 318 ASP 319 ILE 320 PHE 321 ASP 322 TYR 323 ILE 324 GLN 325 TRP 326 ARG 327 TYR 328 ARG 329 GLU 330 PRO 331 LYS 332 ASP 333 ARG 334 SER 335 GLU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 18267 DNA_Polymerase_beta_polypeptide 100.00 335 100.00 100.00 0.00e+00 BMRB 5208 B-Pol 56.12 190 100.00 100.00 1.98e-136 PDB 1BPB "Crystal Structure Of Rat Dna Polymerase Beta: Evidence For A Common Polymerase Mechanism" 74.03 248 100.00 100.00 0.00e+00 PDB 1BPD "Crystal Structure Of Rat Dna Polymerase Beta: Evidence For A Common Polymerase Mechanism" 100.00 335 100.00 100.00 0.00e+00 PDB 1BPE "Crystal Structure Of Rat Dna Polymerase Beta; Evidence For A Common Polymerase Mechanism" 100.00 335 99.70 100.00 0.00e+00 PDB 1HUO "Crystal Structure Of Dna Polymerase Beta Complexed With Dna And Cr-Tmppcp" 100.00 335 100.00 100.00 0.00e+00 PDB 1HUZ "Crystal Structure Of Dna Polymerase Complexed With Dna And Cr-Pcp" 100.00 335 100.00 100.00 0.00e+00 PDB 1JN3 "Fidelity Properties And Structure Of M282l Mutator Mutant Of Dna Polymerase: Subtle Structural Changes Influence The Mechanism " 74.93 251 99.60 100.00 0.00e+00 PDB 1NOM "Dna Polymerase Beta (pol B) (e.c.2.7.7.7), 31-kd Domain; Soaked In The Presence Of Mncl2 (5 Millimolar)" 74.03 248 100.00 100.00 0.00e+00 PDB 1RPL "2.3 Angstroms Crystal Structure Of The Catalytic Domain Of Dna Polymerase Beta" 74.93 251 100.00 100.00 0.00e+00 PDB 1ZQU "Dna Polymerase Beta (Pol B) (E.C.2.7.7.7), 31-Kd Domain; Soaked In The Presence Of Artificial Mother Liquor" 74.03 248 100.00 100.00 0.00e+00 PDB 1ZQV "Dna Polymerase Beta (Pol B) (E.C.2.7.7.7), 31-Kd Domain; Soaked In The Presence Of Cacl2 (150 Millimolar)" 74.03 248 100.00 100.00 0.00e+00 PDB 1ZQW "Dna Polymerase Beta (Pol B) (E.C.2.7.7.7), 31-Kd Domain; Soaked In The Presence Of Cscl (150 Millimolar)" 74.03 248 100.00 100.00 0.00e+00 PDB 1ZQX "Dna Polymerase Beta (Pol B) (E.C.2.7.7.7), 31-Kd Domain; Soaked In The Presence Of Kcl (150 Millimolar)" 74.03 248 100.00 100.00 0.00e+00 PDB 1ZQY "Dna Polymerase Beta (Pol B) (E.C.2.7.7.7), 31-Kd Domain; Soaked In The Presence Of Mgcl2 (50 Millimolar)" 74.03 248 100.00 100.00 0.00e+00 PDB 1ZQZ "Dna Polymerase Beta (Pol B) (E.C.2.7.7.7), 31-Kd Domain; Soaked In The Presence Of Mncl2 (50 Millimolar)" 74.03 248 100.00 100.00 0.00e+00 PDB 2BPC "Crystal Structure Of Rat Dna Polymerase Beta: Evidence For A Common Polymerase Mechanism" 74.03 248 100.00 100.00 0.00e+00 PDB 2BPF "Structures Of Ternary Complexes Of Rat Dna Polymerase Beta, A Dna Template-Primer, And Ddctp" 100.00 335 100.00 100.00 0.00e+00 PDB 2BPG "Structures Of Ternary Complexes Of Rat Dna Polymerase Beta, A Dna Template-Primer, And Ddctp" 100.00 335 100.00 100.00 0.00e+00 PDB 2VAN "Nucleotidyl Transfer Mechanism Of Mismatched Dntp Incorporation By Dna Polymerase B By Structural And Kinetic Analyses" 73.13 245 99.59 99.59 4.91e-180 PDB 3K75 "X-Ray Crystal Structure Of Reduced Xrcc1 Bound To Dna Pol Beta Catalytic Domain" 73.13 252 100.00 100.00 0.00e+00 PDB 3LQC "X-Ray Crystal Structure Of Oxidized Xrcc1 Bound To Dna Pol B Thumb Domain" 57.91 200 100.00 100.00 2.15e-141 PDB 3UXN "Crystal Structure Of Rat Dna Polymerase Beta, Wild Type Apoenzyme" 100.00 335 100.00 100.00 0.00e+00 PDB 3UXO "Crystal Structure Of Rat Dna Polymerase Beta Mutator I260q Apoenzyme" 100.00 335 99.70 99.70 0.00e+00 PDB 3UXP "Co-crystal Structure Of Rat Dna Polymerase Beta Mutator I260q: Enzyme- Dna-ddttp" 100.00 335 99.70 99.70 0.00e+00 PDB 3V72 "Crystal Structure Of Rat Dna Polymerase Beta Mutator E295k: Enzyme- Dsdna" 100.00 335 99.70 100.00 0.00e+00 PDB 3V7J "Co-crystal Structure Of Wild Type Rat Polymerase Beta: Enzyme-dna Binary Complex" 99.10 340 100.00 100.00 0.00e+00 PDB 3V7K "Co-crystal Structure Of K72e Variant Of Rat Polymerase Beta: Enzyme- Dna Binary Complex" 99.10 340 99.70 100.00 0.00e+00 PDB 3V7L "Apo Structure Of Rat Dna Polymerase Beta K72e Variant" 99.10 340 99.70 100.00 0.00e+00 DBJ BAC36630 "unnamed protein product [Mus musculus]" 100.00 335 97.61 98.21 0.00e+00 DBJ BAE27405 "unnamed protein product [Mus musculus]" 100.00 335 97.61 98.21 0.00e+00 DBJ BAE30399 "unnamed protein product [Mus musculus]" 100.00 335 97.61 98.21 0.00e+00 GB AAA41900 "polymerase beta [Rattus norvegicus]" 94.93 318 99.69 99.69 0.00e+00 GB AAA41901 "DNA polymerase beta [Rattus norvegicus]" 100.00 335 99.70 99.70 0.00e+00 GB AAB00389 "high molecular weight DNA polymerase beta [Rattus norvegicus]" 100.00 335 99.70 99.70 0.00e+00 GB AAH60998 "Polymerase (DNA directed), beta [Mus musculus]" 100.00 335 97.61 98.21 0.00e+00 GB AAH98668 "Polymerase (DNA directed), beta [Rattus norvegicus]" 100.00 335 100.00 100.00 0.00e+00 REF NP_035260 "DNA polymerase beta [Mus musculus]" 100.00 335 97.61 98.21 0.00e+00 REF NP_058837 "DNA polymerase beta [Rattus norvegicus]" 100.00 335 100.00 100.00 0.00e+00 REF XP_005066593 "PREDICTED: DNA polymerase beta [Mesocricetus auratus]" 100.00 335 97.01 98.51 0.00e+00 REF XP_005362476 "PREDICTED: DNA polymerase beta [Microtus ochrogaster]" 100.00 335 97.31 98.51 0.00e+00 SP P06766 "RecName: Full=DNA polymerase beta [Rattus norvegicus]" 100.00 335 100.00 100.00 0.00e+00 SP Q8K409 "RecName: Full=DNA polymerase beta [Mus musculus]" 100.00 335 97.61 98.21 0.00e+00 stop_ save_ save_dgdhp _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class DNA _Name_common 'double gap double hairpin dna' _Molecular_mass . _Mol_thiol_state 'not present' _Details . _Residue_count 22 _Mol_residue_sequence ; CAGCGAAGCTGGTCGCGAAG CG ; loop_ _Residue_seq_code _Residue_label 1 DC 2 DA 3 DG 4 DC 5 DG 6 DA 7 DA 8 DG 9 DC 10 DT 11 DG 12 DG 13 DT 14 DC 15 DG 16 DC 17 DG 18 DA 19 DA 20 DG 21 DC 22 DG stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $pol_beta Rat 10116 Eukaryota Metazoa Rattus norvegicus $dgdhp Rat 10116 Eukaryota Metazoa Rattus norvegicus 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 $pol_beta 'recombinant technology' . . . . . $dgdhp 'obtained from a vendor' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $pol_beta 0.5 mM '[U-2H; U-13C; U-15N]' $dgdhp 0.5 mM . KCl 150 mM . 'sodium azide' 3 mM . 'Tris buffer' 150 mM . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_TROSY_HNCO_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HNCO' _Sample_label $sample_1 save_ save_3D_TROSY_HN(CA)CO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HN(CA)CO' _Sample_label $sample_1 save_ save_3D_TROSY_HN(CO)CA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HN(CO)CA' _Sample_label $sample_1 save_ save_3D_TROSY_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HNCA' _Sample_label $sample_1 save_ save_3D_TROSY_HNCACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HNCACB' _Sample_label $sample_1 save_ save_3D_TROSY_HN(CO)CACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HN(CO)CACB' _Sample_label $sample_1 save_ save_3D_TROSY_HN(COCA)CB_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HN(COCA)CB' _Sample_label $sample_1 save_ save_15N_separated_NOE_8 _Saveframe_category NMR_applied_experiment _Experiment_name '15N separated NOE' _Sample_label $sample_1 save_ save_3D_TROSY_HNCO _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HNCO' _BMRB_pulse_sequence_accession_number . _Details . save_ save_3D_TROSY_HN(CA)CO _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HN(CA)CO' _BMRB_pulse_sequence_accession_number . _Details . save_ save_3D_TROSY_HN(CO)CA _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HN(CO)CA' _BMRB_pulse_sequence_accession_number . _Details . save_ save_3D_TROSY_HNCA _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HNCA' _BMRB_pulse_sequence_accession_number . _Details . save_ save_3D_TROSY_HNCACB _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HNCACB' _BMRB_pulse_sequence_accession_number . _Details . save_ save_3D_TROSY_HN(CO)CACB _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HN(CO)CACB' _BMRB_pulse_sequence_accession_number . _Details . save_ save_3D_TROSY_HN(COCA)CB _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY HN(COCA)CB' _BMRB_pulse_sequence_accession_number . _Details . save_ save_15N_separated_NOE _Saveframe_category NMR_applied_experiment _Experiment_name '15N separated NOE' _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units temperature 298 0.1 K pH 7.4 0.1 pH stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS H 1 'methyl protons' ppm 0.0 direct internal . . . 1.0 DSS C 13 'methyl protons' ppm 0.0 indirect internal . . . 0.251449530 DSS N 15 'methyl protons' ppm 0.0 indirect internal . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details ; All of the HN and N shifts are measured from TROSY experiments. They are not corrected since the J-NH's on a site by site basis are not available. ; loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name 'polyermase beta' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 2 2 SER C C 173.6 0.0 1 2 3 3 LYS H H 7.91 0.0 1 3 3 3 LYS CA C 57.86 0.0 1 4 3 3 LYS CB C 30.42 0.0 1 5 3 3 LYS N N 128.07 0.0 1 6 7 7 PRO C C 177.08 0.0 1 7 8 8 GLN H H 8.41 0.0 1 8 8 8 GLN C C 176.02 0.0 1 9 8 8 GLN CA C 55.74 0.0 1 10 8 8 GLN CB C 28.82 0.0 1 11 8 8 GLN N N 120.78 0.0 1 12 9 9 GLU H H 8.42 0.0 1 13 9 9 GLU CA C 56.3 0.0 1 14 9 9 GLU CB C 29.51 0.0 1 15 9 9 GLU N N 123.12 0.0 1 16 11 11 LEU C C 176.6 0.0 1 17 12 12 ASN H H 8.22 0.0 1 18 12 12 ASN CA C 54.46 0.0 1 19 12 12 ASN CB C 40.53 0.0 1 20 12 12 ASN N N 121.51 0.0 1 21 14 14 GLY C C 176.5 0.0 1 22 15 15 ILE H H 7.45 0.0 1 23 15 15 ILE C C 177.6 0.0 1 24 15 15 ILE CA C 64.13 0.0 1 25 15 15 ILE CB C 37.88 0.0 1 26 15 15 ILE N N 120.38 0.0 1 27 16 16 THR H H 8.16 0.0 1 28 16 16 THR C C 176.26 0.0 1 29 16 16 THR CA C 67.31 0.0 1 30 16 16 THR CB C 66.96 0.0 1 31 16 16 THR N N 114.91 0.0 1 32 17 17 ASP H H 8.46 0.0 1 33 17 17 ASP C C 179.11 0.0 1 34 17 17 ASP CA C 57.17 0.0 1 35 17 17 ASP CB C 39.44 0.0 1 36 17 17 ASP N N 121.53 0.0 1 37 18 18 MET H H 7.1 0.0 1 38 18 18 MET C C 176.96 0.0 1 39 18 18 MET CA C 58.34 0.0 1 40 18 18 MET CB C 30.51 0.0 1 41 18 18 MET N N 121.7 0.0 1 42 19 19 LEU H H 7.76 0.0 1 43 19 19 LEU C C 178.94 0.0 1 44 19 19 LEU CA C 57.3 0.0 1 45 19 19 LEU CB C 40.84 0.0 1 46 19 19 LEU N N 119.48 0.0 1 47 20 20 VAL H H 8.27 0.0 1 48 20 20 VAL C C 177.71 0.0 1 49 20 20 VAL CA C 66.34 0.0 1 50 20 20 VAL CB C 30.69 0.0 1 51 20 20 VAL N N 121.05 0.0 1 52 21 21 GLU H H 7.74 0.0 1 53 21 21 GLU C C 180.8 0.0 1 54 21 21 GLU CA C 59.81 0.0 1 55 21 21 GLU CB C 28.41 0.0 1 56 21 21 GLU N N 122.27 0.0 1 57 22 22 LEU H H 7.84 0.0 1 58 22 22 LEU C C 178.61 0.0 1 59 22 22 LEU CA C 57.71 0.0 1 60 22 22 LEU CB C 38.56 0.0 1 61 22 22 LEU N N 121.31 0.0 1 62 23 23 ALA H H 8.32 0.0 1 63 23 23 ALA C C 179.84 0.0 1 64 23 23 ALA CA C 55.68 0.0 1 65 23 23 ALA CB C 16.97 0.0 1 66 23 23 ALA N N 122.2 0.0 1 67 24 24 ASN H H 8.3 0.0 1 68 24 24 ASN C C 177.05 0.0 1 69 24 24 ASN CA C 56.13 0.0 1 70 24 24 ASN CB C 37.34 0.0 1 71 24 24 ASN N N 117.39 0.0 1 72 25 25 PHE H H 7.75 0.0 1 73 25 25 PHE C C 177.85 0.0 1 74 25 25 PHE CA C 61.56 0.0 1 75 25 25 PHE CB C 37.98 0.0 1 76 25 25 PHE N N 121.69 0.0 1 77 26 26 GLU H H 8.26 0.0 1 78 26 26 GLU C C 179.24 0.0 1 79 26 26 GLU CA C 57.12 0.0 1 80 26 26 GLU CB C 27.43 0.0 1 81 26 26 GLU N N 119.64 0.0 1 82 27 27 LYS H H 8.27 0.0 1 83 27 27 LYS C C 177.46 0.0 1 84 27 27 LYS CA C 59.46 0.0 1 85 27 27 LYS CB C 32.02 0.0 1 86 27 27 LYS N N 118.99 0.0 1 87 28 28 ASN H H 8.22 0.0 1 88 28 28 ASN C C 174.99 0.0 1 89 28 28 ASN CA C 55.01 0.0 1 90 28 28 ASN CB C 38.68 0.0 1 91 28 28 ASN N N 112.79 0.0 1 92 29 29 VAL H H 8.16 0.0 1 93 29 29 VAL C C 177.64 0.0 1 94 29 29 VAL CA C 63.9 0.0 1 95 29 29 VAL CB C 30.09 0.0 1 96 29 29 VAL N N 118.33 0.0 1 97 30 30 SER H H 6.92 0.0 1 98 30 30 SER C C 174.61 0.0 1 99 30 30 SER CA C 58.34 0.0 1 100 30 30 SER CB C 61.79 0.0 1 101 30 30 SER N N 112.43 0.0 1 102 31 31 GLN H H 7.0 0.0 1 103 31 31 GLN C C 174.51 0.0 1 104 31 31 GLN CA C 56.74 0.0 1 105 31 31 GLN CB C 25.78 0.0 1 106 31 31 GLN N N 114.24 0.0 1 107 32 32 ALA H H 8.14 0.0 1 108 32 32 ALA C C 177.51 0.0 1 109 32 32 ALA CA C 50.11 0.0 1 110 32 32 ALA CB C 16.98 0.0 1 111 32 32 ALA N N 125.43 0.0 1 112 33 33 ILE H H 7.84 0.0 1 113 33 33 ILE C C 176.21 0.0 1 114 33 33 ILE CA C 61.77 0.0 1 115 33 33 ILE CB C 36.87 0.0 1 116 33 33 ILE N N 123.99 0.0 1 117 34 34 HIS H H 7.95 0.0 1 118 34 34 HIS CA C 58.04 0.0 1 119 34 34 HIS CB C 28.46 0.0 1 120 34 34 HIS N N 120.46 0.0 1 121 35 35 LYS C C 177.78 0.0 1 122 36 36 TYR H H 7.75 0.0 1 123 36 36 TYR C C 176.48 0.0 1 124 36 36 TYR CA C 61.25 0.0 1 125 36 36 TYR CB C 35.7 0.0 1 126 36 36 TYR N N 120.57 0.0 1 127 37 37 ASN H H 8.16 0.0 1 128 37 37 ASN C C 177.36 0.0 1 129 37 37 ASN CA C 55.6 0.0 1 130 37 37 ASN CB C 37.53 0.0 1 131 37 37 ASN N N 117.02 0.0 1 132 38 38 ALA H H 7.72 0.0 1 133 38 38 ALA C C 181.82 0.0 1 134 38 38 ALA CA C 54.88 0.0 1 135 38 38 ALA CB C 17.51 0.0 1 136 38 38 ALA N N 124.73 0.0 1 137 39 39 TYR H H 8.44 0.0 1 138 39 39 TYR C C 178.27 0.0 1 139 39 39 TYR CA C 62.11 0.0 1 140 39 39 TYR CB C 38.13 0.0 1 141 39 39 TYR N N 119.01 0.0 1 142 40 40 ARG H H 8.19 0.0 1 143 40 40 ARG C C 179.32 0.0 1 144 40 40 ARG CA C 58.87 0.0 1 145 40 40 ARG CB C 28.59 0.0 1 146 40 40 ARG N N 118.72 0.0 1 147 41 41 LYS H H 8.29 0.0 1 148 41 41 LYS C C 179.21 0.0 1 149 41 41 LYS CA C 59.17 0.0 1 150 41 41 LYS CB C 30.8 0.0 1 151 41 41 LYS N N 122.41 0.0 1 152 42 42 ALA H H 7.72 0.0 1 153 42 42 ALA C C 178.58 0.0 1 154 42 42 ALA CA C 54.45 0.0 1 155 42 42 ALA CB C 18.37 0.0 1 156 42 42 ALA N N 121.83 0.0 1 157 43 43 ALA H H 8.3 0.0 1 158 43 43 ALA C C 179.11 0.0 1 159 43 43 ALA CA C 55.1 0.0 1 160 43 43 ALA CB C 17.39 0.0 1 161 43 43 ALA N N 119.18 0.0 1 162 44 44 SER H H 7.73 0.0 1 163 44 44 SER C C 176.86 0.0 1 164 44 44 SER CA C 61.01 0.0 1 165 44 44 SER CB C 62.14 0.0 1 166 44 44 SER N N 113.14 0.0 1 167 45 45 VAL H H 7.84 0.0 1 168 45 45 VAL C C 179.2 0.0 1 169 45 45 VAL CA C 65.02 0.0 1 170 45 45 VAL CB C 31.25 0.0 1 171 45 45 VAL N N 121.42 0.0 1 172 46 46 ILE H H 8.05 0.0 1 173 46 46 ILE C C 176.27 0.0 1 174 46 46 ILE CA C 64.72 0.0 1 175 46 46 ILE CB C 36.17 0.0 1 176 46 46 ILE N N 122.75 0.0 1 177 47 47 ALA H H 8.28 0.0 1 178 47 47 ALA C C 179.03 0.0 1 179 47 47 ALA CA C 54.58 0.0 1 180 47 47 ALA CB C 18.03 0.0 1 181 47 47 ALA N N 122.66 0.0 1 182 48 48 LYS H H 6.95 0.0 1 183 48 48 LYS C C 176.09 0.0 1 184 48 48 LYS CA C 55.22 0.0 1 185 48 48 LYS CB C 32.56 0.0 1 186 48 48 LYS N N 114.12 0.0 1 187 49 49 TYR H H 7.54 0.0 1 188 49 49 TYR CA C 55.09 0.0 1 189 49 49 TYR CB C 38.92 0.0 1 190 49 49 TYR N N 126.78 0.0 1 191 50 50 PRO C C 174.32 0.0 1 192 51 51 HIS H H 6.01 0.0 1 193 51 51 HIS C C 174.07 0.0 1 194 51 51 HIS CA C 53.25 0.0 1 195 51 51 HIS CB C 32.93 0.0 1 196 51 51 HIS N N 116.23 0.0 1 197 52 52 LYS H H 8.9 0.0 1 198 52 52 LYS C C 176.37 0.0 1 199 52 52 LYS CA C 56.47 0.0 1 200 52 52 LYS CB C 31.59 0.0 1 201 52 52 LYS N N 123.23 0.0 1 202 53 53 ILE H H 9.37 0.0 1 203 53 53 ILE C C 176.71 0.0 1 204 53 53 ILE CA C 61.93 0.0 1 205 53 53 ILE CB C 37.21 0.0 1 206 53 53 ILE N N 131.74 0.0 1 207 54 54 LYS H H 9.07 0.0 1 208 54 54 LYS C C 176.22 0.0 1 209 54 54 LYS CA C 56.03 0.0 1 210 54 54 LYS CB C 32.8 0.0 1 211 54 54 LYS N N 125.96 0.0 1 212 55 55 SER H H 7.38 0.0 1 213 55 55 SER C C 173.66 0.0 1 214 55 55 SER CA C 57.16 0.0 1 215 55 55 SER CB C 65.43 0.0 1 216 55 55 SER N N 111.58 0.0 1 217 56 56 GLY H H 9.9 0.0 1 218 56 56 GLY C C 175.51 0.0 1 219 56 56 GLY CA C 47.24 0.0 1 220 56 56 GLY N N 112.6 0.0 1 221 57 57 ALA H H 8.53 0.0 1 222 57 57 ALA C C 180.45 0.0 1 223 57 57 ALA CA C 54.75 0.0 1 224 57 57 ALA CB C 17.2 0.0 1 225 57 57 ALA N N 123.96 0.0 1 226 58 58 GLU H H 7.66 0.0 1 227 58 58 GLU C C 179.06 0.0 1 228 58 58 GLU CA C 58.32 0.0 1 229 58 58 GLU CB C 29.11 0.0 1 230 58 58 GLU N N 118.53 0.0 1 231 59 59 ALA H H 7.28 0.0 1 232 59 59 ALA C C 177.34 0.0 1 233 59 59 ALA CA C 53.84 0.0 1 234 59 59 ALA CB C 18.59 0.0 1 235 59 59 ALA N N 121.12 0.0 1 236 60 60 LYS H H 8.02 0.0 1 237 60 60 LYS C C 176.61 0.0 1 238 60 60 LYS CA C 56.58 0.0 1 239 60 60 LYS CB C 31.69 0.0 1 240 60 60 LYS N N 116.3 0.0 1 241 61 61 LYS H H 6.91 0.0 1 242 61 61 LYS C C 177.58 0.0 1 243 61 61 LYS CA C 56.86 0.0 1 244 61 61 LYS CB C 31.47 0.0 1 245 61 61 LYS N N 115.99 0.0 1 246 62 62 LEU H H 8.06 0.0 1 247 62 62 LEU CA C 52.34 0.0 1 248 62 62 LEU CB C 39.13 0.0 1 249 62 62 LEU N N 122.48 0.0 1 250 63 63 PRO C C 176.62 0.0 1 251 64 64 GLY H H 9.27 0.0 1 252 64 64 GLY C C 173.81 0.0 1 253 64 64 GLY CA C 43.74 0.0 1 254 64 64 GLY N N 111.43 0.0 1 255 65 65 VAL H H 7.33 0.0 1 256 65 65 VAL C C 174.36 0.0 1 257 65 65 VAL CA C 62.09 0.0 1 258 65 65 VAL CB C 30.07 0.0 1 259 65 65 VAL N N 121.68 0.0 1 260 66 66 GLY H H 7.29 0.0 1 261 66 66 GLY C C 173.95 0.0 1 262 66 66 GLY CA C 43.81 0.0 1 263 66 66 GLY N N 115.92 0.0 1 264 67 67 THR H H 8.74 0.0 1 265 67 67 THR C C 176.9 0.0 1 266 67 67 THR CA C 65.85 0.0 1 267 67 67 THR CB C 69.39 0.0 1 268 67 67 THR N N 115.32 0.0 1 269 68 68 LYS H H 8.25 0.0 1 270 68 68 LYS C C 180.72 0.0 1 271 68 68 LYS CA C 59.58 0.0 1 272 68 68 LYS CB C 30.2 0.0 1 273 68 68 LYS N N 119.63 0.0 1 274 69 69 ILE H H 9.44 0.0 1 275 69 69 ILE C C 178.33 0.0 1 276 69 69 ILE CA C 66.4 0.0 1 277 69 69 ILE CB C 36.15 0.0 1 278 69 69 ILE N N 123.77 0.0 1 279 70 70 ALA H H 8.28 0.0 1 280 70 70 ALA C C 178.94 0.0 1 281 70 70 ALA CA C 56.08 0.0 1 282 70 70 ALA CB C 17.7 0.0 1 283 70 70 ALA N N 122.89 0.0 1 284 71 71 GLU H H 7.67 0.0 1 285 71 71 GLU C C 180.42 0.0 1 286 71 71 GLU CA C 59.16 0.0 1 287 71 71 GLU CB C 29.11 0.0 1 288 71 71 GLU N N 117.36 0.0 1 289 72 72 LYS H H 7.59 0.0 1 290 72 72 LYS C C 178.51 0.0 1 291 72 72 LYS CA C 59.01 0.0 1 292 72 72 LYS CB C 31.65 0.0 1 293 72 72 LYS N N 121.55 0.0 1 294 73 73 ILE H H 8.5 0.0 1 295 73 73 ILE C C 176.68 0.0 1 296 73 73 ILE CA C 66.49 0.0 1 297 73 73 ILE CB C 36.74 0.0 1 298 73 73 ILE N N 120.8 0.0 1 299 74 74 ASP H H 8.24 0.0 1 300 74 74 ASP C C 179.12 0.0 1 301 74 74 ASP CA C 58.28 0.0 1 302 74 74 ASP CB C 39.98 0.0 1 303 74 74 ASP N N 119.87 0.0 1 304 75 75 GLU H H 7.83 0.0 1 305 75 75 GLU C C 179.64 0.0 1 306 75 75 GLU CA C 59.41 0.0 1 307 75 75 GLU CB C 28.13 0.0 1 308 75 75 GLU N N 122.41 0.0 1 309 76 76 PHE H H 8.83 0.0 1 310 76 76 PHE C C 179.6 0.0 1 311 76 76 PHE CA C 60.69 0.0 1 312 76 76 PHE CB C 39.76 0.0 1 313 76 76 PHE N N 125.25 0.0 1 314 77 77 LEU H H 9.12 0.0 1 315 77 77 LEU C C 179.19 0.0 1 316 77 77 LEU CA C 56.89 0.0 1 317 77 77 LEU CB C 40.76 0.0 1 318 77 77 LEU N N 121.17 0.0 1 319 78 78 ALA H H 7.91 0.0 1 320 78 78 ALA C C 180.07 0.0 1 321 78 78 ALA CA C 54.37 0.0 1 322 78 78 ALA CB C 18.89 0.0 1 323 78 78 ALA N N 119.4 0.0 1 324 79 79 THR H H 7.92 0.0 1 325 79 79 THR C C 175.77 0.0 1 326 79 79 THR CA C 61.65 0.0 1 327 79 79 THR CB C 72.4 0.0 1 328 79 79 THR N N 104.59 0.0 1 329 80 80 GLY H H 8.28 0.0 1 330 80 80 GLY C C 172.21 0.0 1 331 80 80 GLY CA C 44.99 0.0 1 332 80 80 GLY N N 113.59 0.0 1 333 81 81 LYS H H 7.96 0.0 1 334 81 81 LYS C C 172.25 0.0 1 335 81 81 LYS CA C 54.47 0.0 1 336 81 81 LYS CB C 35.2 0.0 1 337 81 81 LYS N N 118.75 0.0 1 338 82 82 LEU H H 8.42 0.0 1 339 82 82 LEU C C 177.88 0.0 1 340 82 82 LEU CA C 52.69 0.0 1 341 82 82 LEU CB C 44.15 0.0 1 342 82 82 LEU N N 116.21 0.0 1 343 83 83 ARG H H 9.59 0.0 1 344 83 83 ARG CA C 59.96 0.0 1 345 83 83 ARG CB C 28.28 0.0 1 346 83 83 ARG N N 131.47 0.0 1 347 84 84 LYS C C 178.65 0.0 1 348 85 85 LEU H H 6.54 0.0 1 349 85 85 LEU C C 178.17 0.0 1 350 85 85 LEU CA C 56.35 0.0 1 351 85 85 LEU CB C 41.53 0.0 1 352 85 85 LEU N N 115.4 0.0 1 353 86 86 GLU H H 8.01 0.0 1 354 86 86 GLU C C 177.54 0.0 1 355 86 86 GLU CA C 59.01 0.0 1 356 86 86 GLU CB C 28.65 0.0 1 357 86 86 GLU N N 119.77 0.0 1 358 87 87 LYS H H 7.42 0.0 1 359 87 87 LYS C C 179.45 0.0 1 360 87 87 LYS CA C 59.01 0.0 1 361 87 87 LYS CB C 31.53 0.0 1 362 87 87 LYS N N 118.86 0.0 1 363 88 88 ILE H H 7.47 0.0 1 364 88 88 ILE C C 178.71 0.0 1 365 88 88 ILE CA C 64.69 0.0 1 366 88 88 ILE CB C 37.72 0.0 1 367 88 88 ILE N N 120.65 0.0 1 368 89 89 ARG H H 8.13 0.0 1 369 89 89 ARG C C 178.04 0.0 1 370 89 89 ARG CA C 58.34 0.0 1 371 89 89 ARG N N 118.88 0.0 1 372 90 90 GLN H H 7.33 0.0 1 373 90 90 GLN C C 175.56 0.0 1 374 90 90 GLN CA C 55.78 0.0 1 375 90 90 GLN CB C 28.44 0.0 1 376 90 90 GLN N N 115.9 0.0 1 377 91 91 ASP H H 7.54 0.0 1 378 91 91 ASP CA C 53.98 0.0 1 379 91 91 ASP CB C 41.62 0.0 1 380 91 91 ASP N N 122.03 0.0 1 381 93 93 THR C C 178.45 0.0 1 382 94 94 SER H H 8.42 0.0 1 383 94 94 SER CA C 62.26 0.0 1 384 94 94 SER N N 118.24 0.0 1 385 96 96 SER C C 175.46 0.0 1 386 97 97 ILE H H 8.22 0.0 1 387 97 97 ILE C C 177.45 0.0 1 388 97 97 ILE CA C 65.7 0.0 1 389 97 97 ILE CB C 37.32 0.0 1 390 97 97 ILE N N 123.22 0.0 1 391 98 98 ASN H H 8.02 0.0 1 392 98 98 ASN C C 177.48 0.0 1 393 98 98 ASN CA C 55.67 0.0 1 394 98 98 ASN CB C 37.78 0.0 1 395 98 98 ASN N N 116.84 0.0 1 396 99 99 PHE H H 7.83 0.0 1 397 99 99 PHE C C 176.69 0.0 1 398 99 99 PHE CA C 61.17 0.0 1 399 99 99 PHE CB C 38.32 0.0 1 400 99 99 PHE N N 120.32 0.0 1 401 100 100 LEU H H 8.24 0.0 1 402 100 100 LEU CA C 57.79 0.0 1 403 100 100 LEU CB C 41.72 0.0 1 404 100 100 LEU N N 118.35 0.0 1 405 101 101 THR C C 176.26 0.0 1 406 102 102 ARG H H 7.85 0.0 1 407 102 102 ARG C C 176.27 0.0 1 408 102 102 ARG CA C 57.75 0.0 1 409 102 102 ARG CB C 29.91 0.0 1 410 102 102 ARG N N 121.47 0.0 1 411 103 103 VAL H H 7.74 0.0 1 412 103 103 VAL C C 177.54 0.0 1 413 103 103 VAL CA C 61.32 0.0 1 414 103 103 VAL CB C 30.33 0.0 1 415 103 103 VAL N N 122.86 0.0 1 416 104 104 THR H H 9.54 0.0 1 417 104 104 THR C C 178.72 0.0 1 418 104 104 THR CA C 64.09 0.0 1 419 104 104 THR N N 128.58 0.0 1 420 105 105 GLY H H 7.17 0.0 1 421 105 105 GLY C C 177.63 0.0 1 422 105 105 GLY CA C 44.57 0.0 1 423 105 105 GLY N N 108.31 0.0 1 424 106 106 ILE H H 8.08 0.0 1 425 106 106 ILE CA C 53.99 0.0 1 426 106 106 ILE CB C 39.12 0.0 1 427 106 106 ILE N N 122.43 0.0 1 428 111 111 ALA C C 176.27 0.0 1 429 112 112 ARG H H 8.6 0.0 1 430 112 112 ARG C C 178.28 0.0 1 431 112 112 ARG CA C 54.65 0.0 1 432 112 112 ARG CB C 28.49 0.0 1 433 112 112 ARG N N 118.8 0.0 1 434 113 113 LYS H H 7.51 0.0 1 435 113 113 LYS CA C 58.7 0.0 1 436 113 113 LYS N N 116.96 0.0 1 437 114 114 LEU C C 179.5 0.0 1 438 115 115 VAL H H 8.4 0.0 1 439 115 115 VAL C C 181.19 0.0 1 440 115 115 VAL CA C 66.0 0.0 1 441 115 115 VAL CB C 28.86 0.0 1 442 115 115 VAL N N 122.14 0.0 1 443 116 116 ASP H H 8.26 0.0 1 444 116 116 ASP C C 178.1 0.0 1 445 116 116 ASP CA C 56.95 0.0 1 446 116 116 ASP CB C 39.71 0.0 1 447 116 116 ASP N N 123.61 0.0 1 448 117 117 GLU H H 7.4 0.0 1 449 117 117 GLU C C 176.35 0.0 1 450 117 117 GLU CA C 55.74 0.0 1 451 117 117 GLU CB C 29.27 0.0 1 452 117 117 GLU N N 118.19 0.0 1 453 118 118 GLY H H 8.05 0.0 1 454 118 118 GLY C C 173.83 0.0 1 455 118 118 GLY CA C 45.22 0.0 1 456 118 118 GLY N N 108.54 0.0 1 457 119 119 ILE H H 8.11 0.0 1 458 119 119 ILE C C 173.0 0.0 1 459 119 119 ILE CA C 60.91 0.0 1 460 119 119 ILE CB C 35.9 0.0 1 461 119 119 ILE N N 126.29 0.0 1 462 120 120 LYS H H 8.67 0.0 1 463 120 120 LYS C C 175.75 0.0 1 464 120 120 LYS CA C 56.81 0.0 1 465 120 120 LYS CB C 35.73 0.0 1 466 120 120 LYS N N 121.89 0.0 1 467 121 121 THR H H 7.59 0.0 1 468 121 121 THR C C 174.99 0.0 1 469 121 121 THR CA C 58.37 0.0 1 470 121 121 THR CB C 72.61 0.0 1 471 121 121 THR N N 107.25 0.0 1 472 122 122 LEU H H 8.45 0.0 1 473 122 122 LEU C C 178.67 0.0 1 474 122 122 LEU CA C 57.93 0.0 1 475 122 122 LEU CB C 40.41 0.0 1 476 122 122 LEU N N 120.92 0.0 1 477 123 123 GLU H H 8.12 0.0 1 478 123 123 GLU C C 179.24 0.0 1 479 123 123 GLU CA C 59.47 0.0 1 480 123 123 GLU CB C 28.07 0.0 1 481 123 123 GLU N N 117.95 0.0 1 482 124 124 ASP H H 7.75 0.0 1 483 124 124 ASP C C 179.65 0.0 1 484 124 124 ASP CA C 56.76 0.0 1 485 124 124 ASP CB C 40.86 0.0 1 486 124 124 ASP N N 119.58 0.0 1 487 125 125 LEU H H 8.13 0.0 1 488 125 125 LEU C C 178.32 0.0 1 489 125 125 LEU CA C 58.03 0.0 1 490 125 125 LEU CB C 41.39 0.0 1 491 125 125 LEU N N 123.36 0.0 1 492 126 126 ARG H H 7.89 0.0 1 493 126 126 ARG C C 179.07 0.0 1 494 126 126 ARG CA C 59.09 0.0 1 495 126 126 ARG CB C 28.99 0.0 1 496 126 126 ARG N N 116.37 0.0 1 497 127 127 LYS H H 7.42 0.0 1 498 127 127 LYS C C 176.5 0.0 1 499 127 127 LYS CA C 56.98 0.0 1 500 127 127 LYS CB C 32.11 0.0 1 501 127 127 LYS N N 118.11 0.0 1 502 128 128 ASN H H 7.57 0.0 1 503 128 128 ASN C C 174.99 0.0 1 504 128 128 ASN CA C 52.81 0.0 1 505 128 128 ASN CB C 40.09 0.0 1 506 128 128 ASN N N 119.62 0.0 1 507 129 129 GLU H H 7.62 0.0 1 508 129 129 GLU C C 177.34 0.0 1 509 129 129 GLU CA C 59.98 0.0 1 510 129 129 GLU CB C 28.93 0.0 1 511 129 129 GLU N N 119.86 0.0 1 512 130 130 ASP H H 8.63 0.0 1 513 130 130 ASP C C 177.19 0.0 1 514 130 130 ASP CA C 55.37 0.0 1 515 130 130 ASP CB C 39.11 0.0 1 516 130 130 ASP N N 116.47 0.0 1 517 131 131 LYS H H 7.73 0.0 1 518 131 131 LYS C C 175.95 0.0 1 519 131 131 LYS CA C 56.12 0.0 1 520 131 131 LYS CB C 31.85 0.0 1 521 131 131 LYS N N 118.55 0.0 1 522 132 132 LEU H H 7.46 0.0 1 523 132 132 LEU C C 176.84 0.0 1 524 132 132 LEU CA C 53.16 0.0 1 525 132 132 LEU CB C 42.07 0.0 1 526 132 132 LEU N N 119.88 0.0 1 527 133 133 ASN H H 8.16 0.0 1 528 133 133 ASN C C 176.35 0.0 1 529 133 133 ASN CA C 50.98 0.0 1 530 133 133 ASN CB C 37.98 0.0 1 531 133 133 ASN N N 119.46 0.0 1 532 134 134 HIS H H 8.55 0.0 1 533 134 134 HIS C C 176.35 0.0 1 534 134 134 HIS CA C 60.97 0.0 1 535 134 134 HIS N N 117.04 0.0 1 536 135 135 HIS H H 8.11 0.0 1 537 135 135 HIS C C 178.13 0.0 1 538 135 135 HIS CA C 58.42 0.0 1 539 135 135 HIS CB C 30.22 0.0 1 540 135 135 HIS N N 119.05 0.0 1 541 136 136 GLN H H 8.54 0.0 1 542 136 136 GLN C C 178.26 0.0 1 543 136 136 GLN CA C 57.05 0.0 1 544 136 136 GLN CB C 27.95 0.0 1 545 136 136 GLN N N 116.79 0.0 1 546 137 137 ARG H H 8.57 0.0 1 547 137 137 ARG C C 180.22 0.0 1 548 137 137 ARG CA C 60.08 0.0 1 549 137 137 ARG CB C 29.35 0.0 1 550 137 137 ARG N N 118.53 0.0 1 551 138 138 ILE H H 7.78 0.0 1 552 138 138 ILE C C 177.47 0.0 1 553 138 138 ILE CA C 62.33 0.0 1 554 138 138 ILE CB C 34.19 0.0 1 555 138 138 ILE N N 122.97 0.0 1 556 139 139 GLY H H 8.7 0.0 1 557 139 139 GLY C C 176.77 0.0 1 558 139 139 GLY CA C 48.05 0.0 1 559 139 139 GLY N N 108.37 0.0 1 560 140 140 LEU H H 8.31 0.0 1 561 140 140 LEU C C 178.55 0.0 1 562 140 140 LEU CA C 56.71 0.0 1 563 140 140 LEU CB C 41.77 0.0 1 564 140 140 LEU N N 121.78 0.0 1 565 141 141 LYS H H 7.69 0.0 1 566 141 141 LYS C C 177.97 0.0 1 567 141 141 LYS CA C 58.75 0.0 1 568 141 141 LYS CB C 31.59 0.0 1 569 141 141 LYS N N 122.84 0.0 1 570 142 142 TYR H H 6.98 0.0 1 571 142 142 TYR C C 174.6 0.0 1 572 142 142 TYR CA C 54.31 0.0 1 573 142 142 TYR CB C 35.5 0.0 1 574 142 142 TYR N N 114.74 0.0 1 575 143 143 PHE H H 6.98 0.0 1 576 143 143 PHE C C 177.56 0.0 1 577 143 143 PHE CA C 62.33 0.0 1 578 143 143 PHE CB C 39.58 0.0 1 579 143 143 PHE N N 121.36 0.0 1 580 144 144 GLU H H 8.89 0.0 1 581 144 144 GLU C C 180.22 0.0 1 582 144 144 GLU CA C 59.19 0.0 1 583 144 144 GLU CB C 28.28 0.0 1 584 144 144 GLU N N 116.39 0.0 1 585 145 145 ASP H H 8.05 0.0 1 586 145 145 ASP C C 180.15 0.0 1 587 145 145 ASP CA C 57.43 0.0 1 588 145 145 ASP CB C 39.51 0.0 1 589 145 145 ASP N N 122.15 0.0 1 590 146 146 PHE H H 8.6 0.0 1 591 146 146 PHE C C 176.98 0.0 1 592 146 146 PHE CA C 55.26 0.0 1 593 146 146 PHE CB C 35.45 0.0 1 594 146 146 PHE N N 118.32 0.0 1 595 147 147 GLU H H 7.13 0.0 1 596 147 147 GLU C C 176.9 0.0 1 597 147 147 GLU CA C 57.05 0.0 1 598 147 147 GLU CB C 29.39 0.0 1 599 147 147 GLU N N 116.76 0.0 1 600 148 148 LYS H H 7.33 0.0 1 601 148 148 LYS C C 177.4 0.0 1 602 148 148 LYS CA C 56.03 0.0 1 603 148 148 LYS CB C 33.1 0.0 1 604 148 148 LYS N N 120.04 0.0 1 605 149 149 ARG H H 8.69 0.0 1 606 149 149 ARG C C 176.16 0.0 1 607 149 149 ARG CA C 54.72 0.0 1 608 149 149 ARG CB C 29.73 0.0 1 609 149 149 ARG N N 122.44 0.0 1 610 150 150 ILE H H 9.32 0.0 1 611 150 150 ILE CA C 58.35 0.0 1 612 150 150 ILE CB C 37.98 0.0 1 613 150 150 ILE N N 122.69 0.0 1 614 151 151 PRO C C 178.62 0.0 1 615 152 152 ARG H H 8.24 0.0 1 616 152 152 ARG C C 177.32 0.0 1 617 152 152 ARG CA C 60.2 0.0 1 618 152 152 ARG CB C 28.44 0.0 1 619 152 152 ARG N N 126.34 0.0 1 620 153 153 GLU H H 9.42 0.0 1 621 153 153 GLU CA C 60.08 0.0 1 622 153 153 GLU CB C 28.49 0.0 1 623 153 153 GLU N N 116.38 0.0 1 624 154 154 GLU C C 178.84 0.0 1 625 155 155 MET H H 7.75 0.0 1 626 155 155 MET C C 179.31 0.0 1 627 155 155 MET CA C 56.61 0.0 1 628 155 155 MET N N 121.36 0.0 1 629 156 156 LEU H H 8.63 0.0 1 630 156 156 LEU C C 179.72 0.0 1 631 156 156 LEU CA C 58.06 0.0 1 632 156 156 LEU CB C 40.69 0.0 1 633 156 156 LEU N N 119.45 0.0 1 634 157 157 GLN H H 7.0 0.0 1 635 157 157 GLN C C 179.09 0.0 1 636 157 157 GLN CA C 58.53 0.0 1 637 157 157 GLN CB C 29.34 0.0 1 638 157 157 GLN N N 119.64 0.0 1 639 158 158 MET H H 8.45 0.0 1 640 158 158 MET C C 176.27 0.0 1 641 158 158 MET CA C 59.2 0.0 1 642 158 158 MET CB C 34.04 0.0 1 643 158 158 MET N N 120.63 0.0 1 644 159 159 GLN H H 8.8 0.0 1 645 159 159 GLN C C 175.96 0.0 1 646 159 159 GLN CA C 59.18 0.0 1 647 159 159 GLN CB C 28.81 0.0 1 648 159 159 GLN N N 119.43 0.0 1 649 160 160 ASP H H 7.54 0.0 1 650 160 160 ASP C C 178.13 0.0 1 651 160 160 ASP CA C 57.51 0.0 1 652 160 160 ASP CB C 40.1 0.0 1 653 160 160 ASP N N 118.67 0.0 1 654 161 161 ILE H H 7.1 0.0 1 655 161 161 ILE CA C 65.02 0.0 1 656 161 161 ILE CB C 37.44 0.0 1 657 161 161 ILE N N 119.23 0.0 1 658 162 162 VAL C C 179.48 0.0 1 659 163 163 LEU H H 8.02 0.0 1 660 163 163 LEU C C 180.43 0.0 1 661 163 163 LEU CA C 58.01 0.0 1 662 163 163 LEU CB C 39.5 0.0 1 663 163 163 LEU N N 120.34 0.0 1 664 164 164 ASN H H 8.15 0.0 1 665 164 164 ASN C C 178.5 0.0 1 666 164 164 ASN CA C 56.0 0.0 1 667 164 164 ASN CB C 37.68 0.0 1 668 164 164 ASN N N 116.97 0.0 1 669 165 165 GLU H H 8.11 0.0 1 670 165 165 GLU CA C 58.17 0.0 1 671 165 165 GLU N N 118.06 0.0 1 672 166 166 VAL C C 176.62 0.0 1 673 167 167 LYS H H 7.51 0.0 1 674 167 167 LYS C C 178.49 0.0 1 675 167 167 LYS CA C 58.44 0.0 1 676 167 167 LYS CB C 31.21 0.0 1 677 167 167 LYS N N 118.55 0.0 1 678 168 168 LYS H H 7.24 0.0 1 679 168 168 LYS C C 178.75 0.0 1 680 168 168 LYS CA C 58.33 0.0 1 681 168 168 LYS CB C 31.81 0.0 1 682 168 168 LYS N N 116.69 0.0 1 683 169 169 LEU H H 7.28 0.0 1 684 169 169 LEU C C 178.04 0.0 1 685 169 169 LEU CA C 56.92 0.0 1 686 169 169 LEU CB C 42.5 0.0 1 687 169 169 LEU N N 119.74 0.0 1 688 170 170 ASP H H 7.74 0.0 1 689 170 170 ASP CA C 52.36 0.0 1 690 170 170 ASP CB C 42.25 0.0 1 691 170 170 ASP N N 115.48 0.0 1 692 171 171 PRO C C 177.0 0.0 1 693 172 172 GLU H H 8.52 0.0 1 694 172 172 GLU C C 178.69 0.0 1 695 172 172 GLU CA C 56.25 0.0 1 696 172 172 GLU CB C 28.55 0.0 1 697 172 172 GLU N N 116.37 0.0 1 698 173 173 TYR H H 7.49 0.0 1 699 173 173 TYR C C 177.53 0.0 1 700 173 173 TYR CA C 59.92 0.0 1 701 173 173 TYR CB C 40.18 0.0 1 702 173 173 TYR N N 116.46 0.0 1 703 174 174 ILE H H 8.07 0.0 1 704 174 174 ILE C C 173.98 0.0 1 705 174 174 ILE CA C 60.91 0.0 1 706 174 174 ILE CB C 39.12 0.0 1 707 174 174 ILE N N 120.37 0.0 1 708 175 175 ALA H H 8.55 0.0 1 709 175 175 ALA C C 175.55 0.0 1 710 175 175 ALA CA C 49.74 0.0 1 711 175 175 ALA CB C 21.16 0.0 1 712 175 175 ALA N N 128.45 0.0 1 713 176 176 THR H H 8.4 0.0 1 714 176 176 THR C C 173.36 0.0 1 715 176 176 THR CA C 61.67 0.0 1 716 176 176 THR CB C 71.37 0.0 1 717 176 176 THR N N 115.75 0.0 1 718 177 177 VAL H H 9.59 0.0 1 719 177 177 VAL C C 176.71 0.0 1 720 177 177 VAL CA C 62.46 0.0 1 721 177 177 VAL CB C 29.84 0.0 1 722 177 177 VAL N N 131.31 0.0 1 723 178 178 CYS H H 8.62 0.0 1 724 178 178 CYS C C 173.29 0.0 1 725 178 178 CYS CA C 58.94 0.0 1 726 178 178 CYS CB C 26.67 0.0 1 727 178 178 CYS N N 125.85 0.0 1 728 179 179 GLY H H 7.75 0.0 1 729 179 179 GLY CA C 44.88 0.0 1 730 179 179 GLY N N 108.93 0.0 1 731 180 180 SER H H 7.9 0.0 1 732 180 180 SER CA C 61.94 0.0 1 733 180 180 SER N N 119.59 0.0 1 734 181 181 PHE C C 179.28 0.0 1 735 182 182 ARG H H 7.4 0.0 1 736 182 182 ARG C C 175.97 0.0 1 737 182 182 ARG CA C 58.32 0.0 1 738 182 182 ARG CB C 27.59 0.0 1 739 182 182 ARG N N 123.53 0.0 1 740 183 183 ARG H H 6.92 0.0 1 741 183 183 ARG C C 175.11 0.0 1 742 183 183 ARG CA C 55.79 0.0 1 743 183 183 ARG CB C 28.98 0.0 1 744 183 183 ARG N N 113.52 0.0 1 745 184 184 GLY H H 7.33 0.0 1 746 184 184 GLY C C 174.59 0.0 1 747 184 184 GLY CA C 44.6 0.0 1 748 184 184 GLY N N 105.24 0.0 1 749 185 185 ALA H H 7.4 0.0 1 750 185 185 ALA CA C 52.99 0.0 1 751 185 185 ALA CB C 19.04 0.0 1 752 185 185 ALA N N 122.11 0.0 1 753 186 186 GLU C C 175.72 0.0 1 754 187 187 SER H H 7.61 0.0 1 755 187 187 SER C C 173.02 0.0 1 756 187 187 SER CA C 57.29 0.0 1 757 187 187 SER CB C 65.55 0.0 1 758 187 187 SER N N 113.15 0.0 1 759 188 188 SER H H 8.92 0.0 1 760 188 188 SER CA C 58.17 0.0 1 761 188 188 SER CB C 67.58 0.0 1 762 188 188 SER N N 116.97 0.0 1 763 189 189 GLY C C 172.77 0.0 1 764 190 190 ASP H H 7.62 0.0 1 765 190 190 ASP C C 172.4 0.0 1 766 190 190 ASP CA C 52.47 0.0 1 767 190 190 ASP CB C 41.13 0.0 1 768 190 190 ASP N N 117.78 0.0 1 769 191 191 MET H H 8.0 0.0 1 770 191 191 MET C C 172.5 0.0 1 771 191 191 MET CA C 54.61 0.0 1 772 191 191 MET CB C 34.53 0.0 1 773 191 191 MET N N 117.88 0.0 1 774 192 192 ASP H H 9.17 0.0 1 775 192 192 ASP CA C 52.87 0.0 1 776 192 192 ASP CB C 42.38 0.0 1 777 192 192 ASP N N 130.49 0.0 1 778 193 193 VAL C C 174.34 0.0 1 779 194 194 LEU H H 8.87 0.0 1 780 194 194 LEU CA C 54.41 0.0 1 781 194 194 LEU CB C 41.78 0.0 1 782 194 194 LEU N N 129.65 0.0 1 783 196 196 THR C C 171.59 0.0 1 784 197 197 HIS H H 8.69 0.0 1 785 197 197 HIS CA C 55.06 0.0 1 786 197 197 HIS CB C 36.05 0.0 1 787 197 197 HIS N N 123.57 0.0 1 788 198 198 PRO C C 176.88 0.0 1 789 199 199 ASN H H 10.93 0.0 1 790 199 199 ASN C C 175.05 0.0 1 791 199 199 ASN CA C 53.62 0.0 1 792 199 199 ASN CB C 37.41 0.0 1 793 199 199 ASN N N 119.02 0.0 1 794 200 200 PHE H H 8.41 0.0 1 795 200 200 PHE C C 172.57 0.0 1 796 200 200 PHE CA C 54.57 0.0 1 797 200 200 PHE CB C 39.23 0.0 1 798 200 200 PHE N N 123.15 0.0 1 799 201 201 THR H H 8.28 0.0 1 800 201 201 THR C C 175.59 0.0 1 801 201 201 THR CA C 59.93 0.0 1 802 201 201 THR CB C 71.53 0.0 1 803 201 201 THR N N 117.13 0.0 1 804 202 202 SER H H 10.03 0.0 1 805 202 202 SER C C 175.17 0.0 1 806 202 202 SER CA C 60.91 0.0 1 807 202 202 SER N N 118.27 0.0 1 808 203 203 GLU H H 7.96 0.0 1 809 203 203 GLU C C 176.57 0.0 1 810 203 203 GLU CA C 56.26 0.0 1 811 203 203 GLU CB C 29.4 0.0 1 812 203 203 GLU N N 119.99 0.0 1 813 204 204 SER H H 7.61 0.0 1 814 204 204 SER CA C 58.02 0.0 1 815 204 204 SER CB C 64.12 0.0 1 816 204 204 SER N N 116.85 0.0 1 817 205 205 SER C C 174.65 0.0 1 818 206 206 LYS H H 8.41 0.0 1 819 206 206 LYS C C 176.27 0.0 1 820 206 206 LYS CA C 56.75 0.0 1 821 206 206 LYS CB C 32.05 0.0 1 822 206 206 LYS N N 122.3 0.0 1 823 207 207 GLN H H 7.93 0.0 1 824 207 207 GLN CA C 52.8 0.0 1 825 207 207 GLN CB C 29.26 0.0 1 826 207 207 GLN N N 121.78 0.0 1 827 209 209 LYS C C 177.89 0.0 1 828 210 210 LEU H H 7.48 0.0 1 829 210 210 LEU C C 175.94 0.0 1 830 210 210 LEU CA C 56.88 0.0 1 831 210 210 LEU CB C 42.33 0.0 1 832 210 210 LEU N N 117.2 0.0 1 833 211 211 LEU H H 8.43 0.0 1 834 211 211 LEU N N 118.25 0.0 1 835 212 212 HIS C C 176.27 0.0 1 836 213 213 ARG H H 8.41 0.0 1 837 213 213 ARG C C 179.14 0.0 1 838 213 213 ARG CA C 59.12 0.0 1 839 213 213 ARG CB C 29.67 0.0 1 840 213 213 ARG N N 116.22 0.0 1 841 214 214 VAL H H 6.58 0.0 1 842 214 214 VAL C C 176.73 0.0 1 843 214 214 VAL CA C 65.68 0.0 1 844 214 214 VAL CB C 30.73 0.0 1 845 214 214 VAL N N 119.01 0.0 1 846 215 215 VAL H H 7.38 0.0 1 847 215 215 VAL CA C 66.2 0.0 1 848 215 215 VAL CB C 30.17 0.0 1 849 215 215 VAL N N 119.94 0.0 1 850 218 218 LEU C C 180.28 0.0 1 851 219 219 GLN H H 8.4 0.0 1 852 219 219 GLN C C 180.02 0.0 1 853 219 219 GLN CA C 58.48 0.0 1 854 219 219 GLN CB C 28.05 0.0 1 855 219 219 GLN N N 122.22 0.0 1 856 220 220 LYS H H 8.35 0.0 1 857 220 220 LYS C C 179.24 0.0 1 858 220 220 LYS CA C 59.83 0.0 1 859 220 220 LYS CB C 31.35 0.0 1 860 220 220 LYS N N 125.93 0.0 1 861 221 221 VAL H H 7.33 0.0 1 862 221 221 VAL C C 175.12 0.0 1 863 221 221 VAL CA C 60.81 0.0 1 864 221 221 VAL CB C 29.43 0.0 1 865 221 221 VAL N N 108.87 0.0 1 866 222 222 ARG H H 7.78 0.0 1 867 222 222 ARG CA C 57.0 0.0 1 868 222 222 ARG CB C 25.31 0.0 1 869 222 222 ARG N N 115.72 0.0 1 870 223 223 PHE C C 175.8 0.0 1 871 224 224 ILE H H 6.68 0.0 1 872 224 224 ILE C C 176.34 0.0 1 873 224 224 ILE CA C 59.95 0.0 1 874 224 224 ILE CB C 37.53 0.0 1 875 224 224 ILE N N 115.34 0.0 1 876 225 225 THR H H 8.84 0.0 1 877 225 225 THR C C 174.85 0.0 1 878 225 225 THR CA C 62.17 0.0 1 879 225 225 THR CB C 68.65 0.0 1 880 225 225 THR N N 119.83 0.0 1 881 226 226 ASP H H 7.46 0.0 1 882 226 226 ASP CA C 53.67 0.0 1 883 226 226 ASP CB C 45.2 0.0 1 884 226 226 ASP N N 118.04 0.0 1 885 228 228 LEU C C 175.79 0.0 1 886 229 229 SER H H 7.84 0.0 1 887 229 229 SER CA C 57.23 0.0 1 888 229 229 SER CB C 64.02 0.0 1 889 229 229 SER N N 111.7 0.0 1 890 230 230 LYS C C 173.97 0.0 1 891 231 231 GLY H H 7.96 0.0 1 892 231 231 GLY C C 173.71 0.0 1 893 231 231 GLY CA C 44.35 0.0 1 894 231 231 GLY N N 115.0 0.0 1 895 232 232 GLU H H 8.68 0.0 1 896 232 232 GLU CA C 58.3 0.0 1 897 232 232 GLU N N 119.68 0.0 1 898 234 234 LYS C C 173.99 0.0 1 899 235 235 PHE H H 9.38 0.0 1 900 235 235 PHE C C 173.19 0.0 1 901 235 235 PHE CA C 55.78 0.0 1 902 235 235 PHE CB C 41.78 0.0 1 903 235 235 PHE N N 128.81 0.0 1 904 236 236 MET H H 8.28 0.0 1 905 236 236 MET CA C 53.66 0.0 1 906 236 236 MET CB C 35.8 0.0 1 907 236 236 MET N N 126.0 0.0 1 908 237 237 GLY C C 171.04 0.0 1 909 238 238 VAL H H 8.45 0.0 1 910 238 238 VAL C C 174.04 0.0 1 911 238 238 VAL CA C 59.84 0.0 1 912 238 238 VAL CB C 33.88 0.0 1 913 238 238 VAL N N 125.17 0.0 1 914 239 239 CYS H H 9.67 0.0 1 915 239 239 CYS C C 171.53 0.0 1 916 239 239 CYS CA C 54.27 0.0 1 917 239 239 CYS CB C 32.7 0.0 1 918 239 239 CYS N N 123.56 0.0 1 919 240 240 GLN H H 7.97 0.0 1 920 240 240 GLN C C 174.43 0.0 1 921 240 240 GLN CA C 54.5 0.0 1 922 240 240 GLN CB C 32.28 0.0 1 923 240 240 GLN N N 119.18 0.0 1 924 241 241 LEU H H 9.3 0.0 1 925 241 241 LEU CA C 52.79 0.0 1 926 241 241 LEU CB C 40.64 0.0 1 927 241 241 LEU N N 129.83 0.0 1 928 242 242 PRO C C 176.51 0.0 1 929 243 243 SER H H 8.32 0.0 1 930 243 243 SER C C 175.19 0.0 1 931 243 243 SER CA C 56.76 0.0 1 932 243 243 SER CB C 64.23 0.0 1 933 243 243 SER N N 114.87 0.0 1 934 244 244 GLU H H 8.87 0.0 1 935 244 244 GLU C C 176.54 0.0 1 936 244 244 GLU CA C 56.55 0.0 1 937 244 244 GLU CB C 29.65 0.0 1 938 244 244 GLU N N 124.44 0.0 1 939 245 245 ASN H H 8.4 0.0 1 940 245 245 ASN C C 174.85 0.0 1 941 245 245 ASN CA C 53.14 0.0 1 942 245 245 ASN CB C 38.89 0.0 1 943 245 245 ASN N N 118.17 0.0 1 944 246 246 ASP H H 8.33 0.0 1 945 246 246 ASP C C 176.19 0.0 1 946 246 246 ASP CA C 55.26 0.0 1 947 246 246 ASP CB C 40.23 0.0 1 948 246 246 ASP N N 119.63 0.0 1 949 247 247 GLU H H 8.01 0.0 1 950 247 247 GLU C C 175.87 0.0 1 951 247 247 GLU CA C 56.21 0.0 1 952 247 247 GLU CB C 29.71 0.0 1 953 247 247 GLU N N 119.12 0.0 1 954 248 248 ASN H H 8.12 0.0 1 955 248 248 ASN C C 174.49 0.0 1 956 248 248 ASN CA C 52.75 0.0 1 957 248 248 ASN CB C 39.04 0.0 1 958 248 248 ASN N N 119.89 0.0 1 959 249 249 GLU H H 8.39 0.0 1 960 249 249 GLU C C 176.83 0.0 1 961 249 249 GLU CA C 56.06 0.0 1 962 249 249 GLU CB C 29.81 0.0 1 963 249 249 GLU N N 123.0 0.0 1 964 250 250 TYR H H 8.95 0.0 1 965 250 250 TYR CA C 57.42 0.0 1 966 250 250 TYR CB C 37.67 0.0 1 967 250 250 TYR N N 124.31 0.0 1 968 251 251 PRO C C 176.08 0.0 1 969 252 252 HIS H H 9.07 0.0 1 970 252 252 HIS C C 174.23 0.0 1 971 252 252 HIS CA C 57.05 0.0 1 972 252 252 HIS CB C 27.67 0.0 1 973 252 252 HIS N N 120.23 0.0 1 974 253 253 ARG H H 9.11 0.0 1 975 253 253 ARG C C 176.33 0.0 1 976 253 253 ARG CA C 51.5 0.0 1 977 253 253 ARG CB C 32.44 0.0 1 978 253 253 ARG N N 115.96 0.0 1 979 254 254 ARG H H 8.7 0.0 1 980 254 254 ARG CA C 53.12 0.0 1 981 254 254 ARG CB C 28.24 0.0 1 982 254 254 ARG N N 123.64 0.0 1 983 255 255 ILE C C 171.61 0.0 1 984 256 256 ASP H H 8.74 0.0 1 985 256 256 ASP CA C 52.07 0.0 1 986 256 256 ASP CB C 42.79 0.0 1 987 256 256 ASP N N 129.16 0.0 1 988 258 258 ARG C C 173.75 0.0 1 989 259 259 LEU H H 9.17 0.0 1 990 259 259 LEU CA C 53.67 0.0 1 991 259 259 LEU CB C 43.66 0.0 1 992 259 259 LEU N N 127.44 0.0 1 993 261 261 PRO C C 178.61 0.0 1 994 262 262 LYS H H 9.35 0.0 1 995 262 262 LYS C C 178.47 0.0 1 996 262 262 LYS CA C 59.94 0.0 1 997 262 262 LYS CB C 31.06 0.0 1 998 262 262 LYS N N 126.62 0.0 1 999 263 263 ASP H H 9.33 0.0 1 1000 263 263 ASP C C 176.56 0.0 1 1001 263 263 ASP CA C 54.63 0.0 1 1002 263 263 ASP CB C 38.16 0.0 1 1003 263 263 ASP N N 113.36 0.0 1 1004 264 264 GLN H H 7.91 0.0 1 1005 264 264 GLN C C 176.77 0.0 1 1006 264 264 GLN CA C 55.81 0.0 1 1007 264 264 GLN CB C 28.71 0.0 1 1008 264 264 GLN N N 119.06 0.0 1 1009 265 265 TYR H H 7.43 0.0 1 1010 265 265 TYR C C 176.35 0.0 1 1011 265 265 TYR CA C 61.98 0.0 1 1012 265 265 TYR CB C 39.16 0.0 1 1013 265 265 TYR N N 121.54 0.0 1 1014 266 266 TYR H H 7.62 0.0 1 1015 266 266 TYR C C 178.23 0.0 1 1016 266 266 TYR CA C 63.7 0.0 1 1017 266 266 TYR CB C 36.45 0.0 1 1018 266 266 TYR N N 115.85 0.0 1 1019 267 267 CYS H H 9.14 0.0 1 1020 267 267 CYS C C 177.89 0.0 1 1021 267 267 CYS CA C 64.41 0.0 1 1022 267 267 CYS CB C 25.68 0.0 1 1023 267 267 CYS N N 121.06 0.0 1 1024 268 268 GLY H H 7.52 0.0 1 1025 268 268 GLY C C 174.78 0.0 1 1026 268 268 GLY CA C 47.46 0.0 1 1027 268 268 GLY N N 111.62 0.0 1 1028 269 269 VAL H H 8.75 0.0 1 1029 269 269 VAL C C 179.12 0.0 1 1030 269 269 VAL CA C 65.7 0.0 1 1031 269 269 VAL CB C 31.44 0.0 1 1032 269 269 VAL N N 124.93 0.0 1 1033 270 270 LEU H H 8.35 0.0 1 1034 270 270 LEU C C 180.22 0.0 1 1035 270 270 LEU CA C 58.87 0.0 1 1036 270 270 LEU CB C 41.95 0.0 1 1037 270 270 LEU N N 123.93 0.0 1 1038 271 271 TYR H H 8.06 0.0 1 1039 271 271 TYR C C 179.46 0.0 1 1040 271 271 TYR CA C 61.4 0.0 1 1041 271 271 TYR CB C 37.61 0.0 1 1042 271 271 TYR N N 121.68 0.0 1 1043 272 272 PHE H H 9.13 0.0 1 1044 272 272 PHE C C 178.26 0.0 1 1045 272 272 PHE CA C 61.02 0.0 1 1046 272 272 PHE CB C 36.36 0.0 1 1047 272 272 PHE N N 114.5 0.0 1 1048 273 273 THR H H 7.85 0.0 1 1049 273 273 THR C C 172.88 0.0 1 1050 273 273 THR CA C 66.3 0.0 1 1051 273 273 THR CB C 68.03 0.0 1 1052 273 273 THR N N 120.84 0.0 1 1053 274 274 GLY H H 6.96 0.0 1 1054 274 274 GLY C C 175.17 0.0 1 1055 274 274 GLY CA C 42.93 0.0 1 1056 274 274 GLY N N 107.84 0.0 1 1057 275 275 SER H H 7.4 0.0 1 1058 275 275 SER CA C 59.2 0.0 1 1059 275 275 SER CB C 65.9 0.0 1 1060 275 275 SER N N 115.91 0.0 1 1061 276 276 ASP C C 180.86 0.0 1 1062 277 277 ILE H H 7.83 0.0 1 1063 277 277 ILE C C 177.5 0.0 1 1064 277 277 ILE CA C 63.34 0.0 1 1065 277 277 ILE CB C 36.88 0.0 1 1066 277 277 ILE N N 121.34 0.0 1 1067 278 278 PHE H H 7.64 0.0 1 1068 278 278 PHE C C 177.05 0.0 1 1069 278 278 PHE CA C 61.6 0.0 1 1070 278 278 PHE CB C 38.32 0.0 1 1071 278 278 PHE N N 123.34 0.0 1 1072 279 279 ASN H H 8.45 0.0 1 1073 279 279 ASN C C 178.29 0.0 1 1074 279 279 ASN CA C 55.68 0.0 1 1075 279 279 ASN CB C 37.33 0.0 1 1076 279 279 ASN N N 118.16 0.0 1 1077 280 280 LYS H H 7.68 0.0 1 1078 280 280 LYS C C 179.51 0.0 1 1079 280 280 LYS CA C 59.53 0.0 1 1080 280 280 LYS CB C 31.21 0.0 1 1081 280 280 LYS N N 121.16 0.0 1 1082 281 281 ASN H H 8.38 0.0 1 1083 281 281 ASN C C 178.44 0.0 1 1084 281 281 ASN CA C 55.36 0.0 1 1085 281 281 ASN CB C 36.68 0.0 1 1086 281 281 ASN N N 121.4 0.0 1 1087 282 282 MET H H 9.0 0.0 1 1088 282 282 MET C C 177.66 0.0 1 1089 282 282 MET CA C 58.92 0.0 1 1090 282 282 MET CB C 30.14 0.0 1 1091 282 282 MET N N 124.66 0.0 1 1092 283 283 ARG H H 8.13 0.0 1 1093 283 283 ARG C C 179.1 0.0 1 1094 283 283 ARG CA C 59.74 0.0 1 1095 283 283 ARG CB C 30.19 0.0 1 1096 283 283 ARG N N 118.88 0.0 1 1097 284 284 ALA H H 7.76 0.0 1 1098 284 284 ALA C C 180.44 0.0 1 1099 284 284 ALA CA C 54.74 0.0 1 1100 284 284 ALA CB C 17.2 0.0 1 1101 284 284 ALA N N 122.11 0.0 1 1102 285 285 HIS H H 7.69 0.0 1 1103 285 285 HIS C C 176.97 0.0 1 1104 285 285 HIS CA C 59.48 0.0 1 1105 285 285 HIS CB C 29.32 0.0 1 1106 285 285 HIS N N 120.16 0.0 1 1107 286 286 ALA H H 8.34 0.0 1 1108 286 286 ALA C C 179.62 0.0 1 1109 286 286 ALA CA C 55.24 0.0 1 1110 286 286 ALA CB C 17.4 0.0 1 1111 286 286 ALA N N 119.63 0.0 1 1112 287 287 LEU H H 7.67 0.0 1 1113 287 287 LEU C C 181.64 0.0 1 1114 287 287 LEU CA C 57.89 0.0 1 1115 287 287 LEU CB C 41.33 0.0 1 1116 287 287 LEU N N 119.34 0.0 1 1117 288 288 GLU H H 7.34 0.0 1 1118 288 288 GLU C C 178.46 0.0 1 1119 288 288 GLU CA C 58.54 0.0 1 1120 288 288 GLU CB C 28.36 0.0 1 1121 288 288 GLU N N 120.85 0.0 1 1122 289 289 LYS H H 7.4 0.0 1 1123 289 289 LYS C C 175.7 0.0 1 1124 289 289 LYS CA C 53.83 0.0 1 1125 289 289 LYS CB C 30.6 0.0 1 1126 289 289 LYS N N 116.53 0.0 1 1127 290 290 GLY H H 7.74 0.0 1 1128 290 290 GLY C C 173.5 0.0 1 1129 290 290 GLY CA C 45.37 0.0 1 1130 290 290 GLY N N 106.78 0.0 1 1131 291 291 PHE H H 8.59 0.0 1 1132 291 291 PHE C C 173.52 0.0 1 1133 291 291 PHE CA C 56.52 0.0 1 1134 291 291 PHE CB C 42.55 0.0 1 1135 291 291 PHE N N 120.76 0.0 1 1136 292 292 THR H H 8.97 0.0 1 1137 292 292 THR C C 173.45 0.0 1 1138 292 292 THR CA C 58.26 0.0 1 1139 292 292 THR CB C 69.62 0.0 1 1140 292 292 THR N N 113.21 0.0 1 1141 293 293 ILE H H 8.11 0.0 1 1142 293 293 ILE C C 174.21 0.0 1 1143 293 293 ILE CA C 59.5 0.0 1 1144 293 293 ILE CB C 40.92 0.0 1 1145 293 293 ILE N N 130.29 0.0 1 1146 294 294 ASN H H 8.49 0.0 1 1147 294 294 ASN C C 173.87 0.0 1 1148 294 294 ASN CA C 51.03 0.0 1 1149 294 294 ASN CB C 37.98 0.0 1 1150 294 294 ASN N N 127.33 0.0 1 1151 295 295 GLU H H 9.07 0.0 1 1152 295 295 GLU C C 173.37 0.0 1 1153 295 295 GLU CA C 58.11 0.0 1 1154 295 295 GLU CB C 27.56 0.0 1 1155 295 295 GLU N N 117.1 0.0 1 1156 296 296 TYR H H 7.67 0.0 1 1157 296 296 TYR C C 176.39 0.0 1 1158 296 296 TYR CA C 58.08 0.0 1 1159 296 296 TYR CB C 41.13 0.0 1 1160 296 296 TYR N N 113.87 0.0 1 1161 297 297 THR H H 8.31 0.0 1 1162 297 297 THR C C 172.81 0.0 1 1163 297 297 THR CA C 60.22 0.0 1 1164 297 297 THR CB C 69.63 0.0 1 1165 297 297 THR N N 107.93 0.0 1 1166 298 298 ILE H H 9.42 0.0 1 1167 298 298 ILE C C 173.03 0.0 1 1168 298 298 ILE CA C 58.6 0.0 1 1169 298 298 ILE CB C 39.96 0.0 1 1170 298 298 ILE N N 119.29 0.0 1 1171 299 299 ARG H H 8.32 0.0 1 1172 299 299 ARG CA C 51.5 0.0 1 1173 299 299 ARG CB C 32.33 0.0 1 1174 299 299 ARG N N 125.02 0.0 1 1175 300 300 PRO C C 175.8 0.0 1 1176 301 301 LEU H H 7.98 0.0 1 1177 301 301 LEU C C 177.35 0.0 1 1178 301 301 LEU CA C 53.67 0.0 1 1179 301 301 LEU CB C 42.56 0.0 1 1180 301 301 LEU N N 123.07 0.0 1 1181 302 302 GLY H H 8.06 0.0 1 1182 302 302 GLY C C 175.54 0.0 1 1183 302 302 GLY CA C 43.91 0.0 1 1184 302 302 GLY N N 110.74 0.0 1 1185 303 303 VAL H H 8.14 0.0 1 1186 303 303 VAL CA C 62.47 0.0 1 1187 303 303 VAL CB C 34.76 0.0 1 1188 303 303 VAL N N 124.77 0.0 1 1189 304 304 THR C C 175.32 0.0 1 1190 305 305 GLY H H 7.91 0.0 1 1191 305 305 GLY C C 173.31 0.0 1 1192 305 305 GLY CA C 45.15 0.0 1 1193 305 305 GLY N N 109.68 0.0 1 1194 306 306 VAL H H 7.4 0.0 1 1195 306 306 VAL C C 176.27 0.0 1 1196 306 306 VAL CA C 61.43 0.0 1 1197 306 306 VAL CB C 31.75 0.0 1 1198 306 306 VAL N N 120.53 0.0 1 1199 307 307 ALA H H 8.66 0.0 1 1200 307 307 ALA C C 178.27 0.0 1 1201 307 307 ALA CA C 51.96 0.0 1 1202 307 307 ALA CB C 18.57 0.0 1 1203 307 307 ALA N N 132.39 0.0 1 1204 308 308 GLY H H 8.58 0.0 1 1205 308 308 GLY C C 172.68 0.0 1 1206 308 308 GLY CA C 43.12 0.0 1 1207 308 308 GLY N N 109.7 0.0 1 1208 309 309 GLU H H 8.17 0.0 1 1209 309 309 GLU CA C 54.68 0.0 1 1210 309 309 GLU CB C 28.02 0.0 1 1211 309 309 GLU N N 120.47 0.0 1 1212 310 310 PRO C C 177.14 0.0 1 1213 311 311 LEU H H 8.38 0.0 1 1214 311 311 LEU CA C 52.48 0.0 1 1215 311 311 LEU CB C 39.85 0.0 1 1216 311 311 LEU N N 126.33 0.0 1 1217 312 312 PRO C C 177.78 0.0 1 1218 313 313 VAL H H 9.25 0.0 1 1219 313 313 VAL C C 175.39 0.0 1 1220 313 313 VAL CA C 62.45 0.0 1 1221 313 313 VAL CB C 35.0 0.0 1 1222 313 313 VAL N N 127.04 0.0 1 1223 314 314 ASP H H 9.96 0.0 1 1224 314 314 ASP C C 173.63 0.0 1 1225 314 314 ASP CA C 53.86 0.0 1 1226 314 314 ASP CB C 42.55 0.0 1 1227 314 314 ASP N N 130.1 0.0 1 1228 315 315 SER H H 7.38 0.0 1 1229 315 315 SER C C 174.16 0.0 1 1230 315 315 SER CA C 56.73 0.0 1 1231 315 315 SER CB C 63.6 0.0 1 1232 315 315 SER N N 111.32 0.0 1 1233 316 316 GLU H H 8.97 0.0 1 1234 316 316 GLU C C 179.41 0.0 1 1235 316 316 GLU CA C 60.27 0.0 1 1236 316 316 GLU CB C 30.82 0.0 1 1237 316 316 GLU N N 119.49 0.0 1 1238 317 317 GLN H H 8.52 0.0 1 1239 317 317 GLN C C 179.69 0.0 1 1240 317 317 GLN CA C 59.86 0.0 1 1241 317 317 GLN CB C 26.54 0.0 1 1242 317 317 GLN N N 118.97 0.0 1 1243 318 318 ASP H H 7.59 0.0 1 1244 318 318 ASP C C 177.51 0.0 1 1245 318 318 ASP CA C 57.27 0.0 1 1246 318 318 ASP CB C 40.13 0.0 1 1247 318 318 ASP N N 112.27 0.0 1 1248 319 319 ILE H H 7.34 0.0 1 1249 319 319 ILE C C 177.26 0.0 1 1250 319 319 ILE CA C 65.7 0.0 1 1251 319 319 ILE CB C 37.14 0.0 1 1252 319 319 ILE N N 117.37 0.0 1 1253 320 320 PHE H H 7.01 0.0 1 1254 320 320 PHE C C 177.53 0.0 1 1255 320 320 PHE CA C 62.18 0.0 1 1256 320 320 PHE CB C 36.82 0.0 1 1257 320 320 PHE N N 115.68 0.0 1 1258 321 321 ASP H H 8.45 0.0 1 1259 321 321 ASP C C 180.7 0.0 1 1260 321 321 ASP CA C 57.09 0.0 1 1261 321 321 ASP CB C 39.31 0.0 1 1262 321 321 ASP N N 118.71 0.0 1 1263 322 322 TYR H H 7.98 0.0 1 1264 322 322 TYR C C 177.26 0.0 1 1265 322 322 TYR CA C 61.46 0.0 1 1266 322 322 TYR CB C 37.01 0.0 1 1267 322 322 TYR N N 120.1 0.0 1 1268 323 323 ILE H H 6.72 0.0 1 1269 323 323 ILE C C 173.25 0.0 1 1270 323 323 ILE CA C 60.08 0.0 1 1271 323 323 ILE CB C 36.78 0.0 1 1272 323 323 ILE N N 105.83 0.0 1 1273 324 324 GLN H H 7.79 0.0 1 1274 324 324 GLN C C 175.17 0.0 1 1275 324 324 GLN CA C 56.56 0.0 1 1276 324 324 GLN CB C 25.42 0.0 1 1277 324 324 GLN N N 116.95 0.0 1 1278 325 325 TRP H H 8.45 0.0 1 1279 325 325 TRP C C 176.35 0.0 1 1280 325 325 TRP CA C 53.23 0.0 1 1281 325 325 TRP CB C 33.2 0.0 1 1282 325 325 TRP N N 121.94 0.0 1 1283 326 326 ARG H H 8.18 0.0 1 1284 326 326 ARG C C 176.03 0.0 1 1285 326 326 ARG CA C 56.03 0.0 1 1286 326 326 ARG CB C 29.21 0.0 1 1287 326 326 ARG N N 124.14 0.0 1 1288 327 327 TYR H H 8.64 0.0 1 1289 327 327 TYR CA C 60.03 0.0 1 1290 327 327 TYR CB C 37.2 0.0 1 1291 327 327 TYR N N 125.42 0.0 1 1292 330 330 PRO C C 176.74 0.0 1 1293 331 331 LYS H H 8.15 0.0 1 1294 331 331 LYS C C 176.6 0.0 1 1295 331 331 LYS CA C 57.42 0.0 1 1296 331 331 LYS CB C 30.13 0.0 1 1297 331 331 LYS N N 113.22 0.0 1 1298 332 332 ASP H H 7.84 0.0 1 1299 332 332 ASP C C 176.12 0.0 1 1300 332 332 ASP CA C 53.87 0.0 1 1301 332 332 ASP CB C 40.64 0.0 1 1302 332 332 ASP N N 120.18 0.0 1 1303 333 333 ARG H H 7.14 0.0 1 1304 333 333 ARG CA C 55.2 0.0 1 1305 333 333 ARG CB C 28.5 0.0 1 1306 333 333 ARG N N 120.41 0.0 1 1307 334 334 SER C C 175.56 0.0 1 1308 335 335 GLU H H 7.75 0.0 1 1309 335 335 GLU CA C 57.26 0.0 1 1310 335 335 GLU CB C 31.21 0.0 1 1311 335 335 GLU N N 126.9 0.0 1 stop_ save_