data_27528 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone Assignments for human WDR5 ; _BMRB_accession_number 27528 _BMRB_flat_file_name bmr27528.str _Entry_type original _Submission_date 2018-06-26 _Accession_date 2018-06-26 _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 Lemak Alexander . . 2 Kaustov Lilia . . 3 Houliston Scott . . 4 Arrowsmith Cheryl H. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 256 "13C chemical shifts" 838 "15N chemical shifts" 256 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2019-10-16 update BMRB 'update entry citation' 2019-08-27 original author 'original release' stop_ _Original_release_date 2018-06-26 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; The MLL1 trimeric catalytic complex is a dynamic conformational ensemble stabilized by multiple weak interactions ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 31400120 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kaustov Lilia . . 2 Lemak Alexander . . 3 Wu Hong . . 4 Faini Marco . . 5 Fan Lixin . . 6 Fang Xianyang . . 7 Zeng Hong . . 8 Duan Shili . . 9 Allali-Hassani Abdellah . . 10 Li Fengling . . 11 Wei Yong . . 12 Vedadi Masoud . . 13 Aebersold Ruedi . . 14 Wang Yunxing . . 15 Houliston Scott . . 16 Arrowsmith Cheryl H. . stop_ _Journal_abbreviation 'Nucleic Acids Res.' _Journal_name_full 'Nucleic acids research' _Journal_volume 47 _Journal_issue 17 _Journal_ISSN 1362-4962 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 9433 _Page_last 9447 _Year 2019 _Details . loop_ _Keyword NMR SAXS 'catalytic complex' 'dynamic ensemble' epigenetics stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name WDR5 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label WDR5 $WDR5 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_WDR5 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common WDR5 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 314 _Mol_residue_sequence ; SSATQSKPTPVKPNYALKFT LAGHTKAVSSVKFSPNGEWL ASSSADKLIKIWGAYDGKFE KTISGHKLGISDVAWSSDSN LLVSASDDKTLKIWDVSSGK CLKTLKGHSNYVFCCNFNPQ SNLIVSGSFDESVRIWDVKT GKCLKTLPAHSDPVSAVHFN RDGSLIVSSSYDGLCRIWDT ASGQCLKTLIDDDNPPVSFV KFSPNGKYILAATLDNTLKL WDYSKGKCLKTYTGHKNEKY CIFANFSVTGGKWIVSGSED NLVYIWNLQTKEIVQKLQGH TDVVISTACHPTENIIASAA LENDKTIKLWKSDC ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 21 SER 2 22 SER 3 23 ALA 4 24 THR 5 25 GLN 6 26 SER 7 27 LYS 8 28 PRO 9 29 THR 10 30 PRO 11 31 VAL 12 32 LYS 13 33 PRO 14 34 ASN 15 35 TYR 16 36 ALA 17 37 LEU 18 38 LYS 19 39 PHE 20 40 THR 21 41 LEU 22 42 ALA 23 43 GLY 24 44 HIS 25 45 THR 26 46 LYS 27 47 ALA 28 48 VAL 29 49 SER 30 50 SER 31 51 VAL 32 52 LYS 33 53 PHE 34 54 SER 35 55 PRO 36 56 ASN 37 57 GLY 38 58 GLU 39 59 TRP 40 60 LEU 41 61 ALA 42 62 SER 43 63 SER 44 64 SER 45 65 ALA 46 66 ASP 47 67 LYS 48 68 LEU 49 69 ILE 50 70 LYS 51 71 ILE 52 72 TRP 53 73 GLY 54 74 ALA 55 75 TYR 56 76 ASP 57 77 GLY 58 78 LYS 59 79 PHE 60 80 GLU 61 81 LYS 62 82 THR 63 83 ILE 64 84 SER 65 85 GLY 66 86 HIS 67 87 LYS 68 88 LEU 69 89 GLY 70 90 ILE 71 91 SER 72 92 ASP 73 93 VAL 74 94 ALA 75 95 TRP 76 96 SER 77 97 SER 78 98 ASP 79 99 SER 80 100 ASN 81 101 LEU 82 102 LEU 83 103 VAL 84 104 SER 85 105 ALA 86 106 SER 87 107 ASP 88 108 ASP 89 109 LYS 90 110 THR 91 111 LEU 92 112 LYS 93 113 ILE 94 114 TRP 95 115 ASP 96 116 VAL 97 117 SER 98 118 SER 99 119 GLY 100 120 LYS 101 121 CYS 102 122 LEU 103 123 LYS 104 124 THR 105 125 LEU 106 126 LYS 107 127 GLY 108 128 HIS 109 129 SER 110 130 ASN 111 131 TYR 112 132 VAL 113 133 PHE 114 134 CYS 115 135 CYS 116 136 ASN 117 137 PHE 118 138 ASN 119 139 PRO 120 140 GLN 121 141 SER 122 142 ASN 123 143 LEU 124 144 ILE 125 145 VAL 126 146 SER 127 147 GLY 128 148 SER 129 149 PHE 130 150 ASP 131 151 GLU 132 152 SER 133 153 VAL 134 154 ARG 135 155 ILE 136 156 TRP 137 157 ASP 138 158 VAL 139 159 LYS 140 160 THR 141 161 GLY 142 162 LYS 143 163 CYS 144 164 LEU 145 165 LYS 146 166 THR 147 167 LEU 148 168 PRO 149 169 ALA 150 170 HIS 151 171 SER 152 172 ASP 153 173 PRO 154 174 VAL 155 175 SER 156 176 ALA 157 177 VAL 158 178 HIS 159 179 PHE 160 180 ASN 161 181 ARG 162 182 ASP 163 183 GLY 164 184 SER 165 185 LEU 166 186 ILE 167 187 VAL 168 188 SER 169 189 SER 170 190 SER 171 191 TYR 172 192 ASP 173 193 GLY 174 194 LEU 175 195 CYS 176 196 ARG 177 197 ILE 178 198 TRP 179 199 ASP 180 200 THR 181 201 ALA 182 202 SER 183 203 GLY 184 204 GLN 185 205 CYS 186 206 LEU 187 207 LYS 188 208 THR 189 209 LEU 190 210 ILE 191 211 ASP 192 212 ASP 193 213 ASP 194 214 ASN 195 215 PRO 196 216 PRO 197 217 VAL 198 218 SER 199 219 PHE 200 220 VAL 201 221 LYS 202 222 PHE 203 223 SER 204 224 PRO 205 225 ASN 206 226 GLY 207 227 LYS 208 228 TYR 209 229 ILE 210 230 LEU 211 231 ALA 212 232 ALA 213 233 THR 214 234 LEU 215 235 ASP 216 236 ASN 217 237 THR 218 238 LEU 219 239 LYS 220 240 LEU 221 241 TRP 222 242 ASP 223 243 TYR 224 244 SER 225 245 LYS 226 246 GLY 227 247 LYS 228 248 CYS 229 249 LEU 230 250 LYS 231 251 THR 232 252 TYR 233 253 THR 234 254 GLY 235 255 HIS 236 256 LYS 237 257 ASN 238 258 GLU 239 259 LYS 240 260 TYR 241 261 CYS 242 262 ILE 243 263 PHE 244 264 ALA 245 265 ASN 246 266 PHE 247 267 SER 248 268 VAL 249 269 THR 250 270 GLY 251 271 GLY 252 272 LYS 253 273 TRP 254 274 ILE 255 275 VAL 256 276 SER 257 277 GLY 258 278 SER 259 279 GLU 260 280 ASP 261 281 ASN 262 282 LEU 263 283 VAL 264 284 TYR 265 285 ILE 266 286 TRP 267 287 ASN 268 288 LEU 269 289 GLN 270 290 THR 271 291 LYS 272 292 GLU 273 293 ILE 274 294 VAL 275 295 GLN 276 296 LYS 277 297 LEU 278 298 GLN 279 299 GLY 280 300 HIS 281 301 THR 282 302 ASP 283 303 VAL 284 304 VAL 285 305 ILE 286 306 SER 287 307 THR 288 308 ALA 289 309 CYS 290 310 HIS 291 311 PRO 292 312 THR 293 313 GLU 294 314 ASN 295 315 ILE 296 316 ILE 297 317 ALA 298 318 SER 299 319 ALA 300 320 ALA 301 321 LEU 302 322 GLU 303 323 ASN 304 324 ASP 305 325 LYS 306 326 THR 307 327 ILE 308 328 LYS 309 329 LEU 310 330 TRP 311 331 LYS 312 332 SER 313 333 ASP 314 334 CYS 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 $WDR5 Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $WDR5 'recombinant technology' . Escherichia coli . pET28-MHL 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 $WDR5 200 uM '[U-100% 13C; U-100% 15N; U-80% 2H]' PMSF 1 mM 'natural abundance' TRIS 20 mM 'natural abundance' beta-mercaptoethanol 2 mM 'natural abundance' DTT 2 mM 'natural abundance' 'sodium chloride' 250 mM '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 stop_ _Details . save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'peak picking' stop_ _Details . save_ save_FMCGUI _Saveframe_category software _Name FMCGUI _Version . loop_ _Vendor _Address _Electronic_address 'Lemak et al., University Health Network, Toronto' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCO_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_3D_HNCACO_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACO' _Sample_label $sample_1 save_ save_3D_HNCB_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCB' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 250 . mM pH 7.7 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 external indirect . . . 0.25145 DSS H 1 'methyl protons' ppm 0.00 external direct . . . 1 DSS N 15 'methyl protons' ppm 0.00 external indirect . . . 0.1013 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_ _Software_label $FMCGUI stop_ loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCA' '3D HNCO' '3D HNCACB' '3D HN(CO)CA' '3D HNCACO' '3D HNCB' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name WDR5 _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 30 10 PRO C C 176.754 0.40 1 2 30 10 PRO CA C 62.846 0.40 1 3 30 10 PRO CB C 31.681 0.40 1 4 31 11 VAL H H 8.315 0.04 1 5 31 11 VAL C C 175.432 0.40 1 6 31 11 VAL CA C 62.890 0.40 1 7 31 11 VAL CB C 32.153 0.40 1 8 31 11 VAL N N 120.227 0.40 1 9 32 12 LYS H H 7.688 0.04 1 10 32 12 LYS C C 172.714 0.40 1 11 32 12 LYS CA C 53.220 0.40 1 12 32 12 LYS CB C 32.855 0.40 1 13 32 12 LYS N N 119.808 0.40 1 14 33 13 PRO C C 173.128 0.40 1 15 33 13 PRO CA C 61.970 0.40 1 16 33 13 PRO CB C 30.629 0.40 1 17 34 14 ASN H H 7.947 0.04 1 18 34 14 ASN C C 175.362 0.40 1 19 34 14 ASN CA C 51.166 0.40 1 20 34 14 ASN CB C 37.203 0.40 1 21 34 14 ASN N N 118.721 0.40 1 22 35 15 TYR H H 8.942 0.04 1 23 35 15 TYR C C 176.764 0.40 1 24 35 15 TYR CA C 61.686 0.40 1 25 35 15 TYR CB C 38.816 0.40 1 26 35 15 TYR N N 119.973 0.40 1 27 36 16 ALA H H 8.439 0.04 1 28 36 16 ALA C C 176.694 0.40 1 29 36 16 ALA CA C 50.180 0.40 1 30 36 16 ALA CB C 21.808 0.40 1 31 36 16 ALA N N 124.263 0.40 1 32 37 17 LEU H H 8.900 0.04 1 33 37 17 LEU C C 176.607 0.40 1 34 37 17 LEU CA C 56.089 0.40 1 35 37 17 LEU CB C 40.394 0.40 1 36 37 17 LEU N N 125.252 0.40 1 37 38 18 LYS H H 9.169 0.04 1 38 38 18 LYS C C 175.642 0.40 1 39 38 18 LYS CA C 54.954 0.40 1 40 38 18 LYS CB C 33.170 0.40 1 41 38 18 LYS N N 126.747 0.40 1 42 39 19 PHE H H 7.156 0.04 1 43 39 19 PHE C C 173.643 0.40 1 44 39 19 PHE CA C 56.380 0.40 1 45 39 19 PHE CB C 43.761 0.40 1 46 39 19 PHE N N 112.838 0.40 1 47 40 20 THR H H 8.447 0.04 1 48 40 20 THR C C 173.047 0.40 1 49 40 20 THR CA C 62.361 0.40 1 50 40 20 THR CB C 69.676 0.40 1 51 40 20 THR N N 117.488 0.40 1 52 41 21 LEU H H 9.998 0.04 1 53 41 21 LEU C C 175.151 0.40 1 54 41 21 LEU CA C 53.738 0.40 1 55 41 21 LEU CB C 38.746 0.40 1 56 41 21 LEU N N 131.994 0.40 1 57 42 22 ALA H H 8.510 0.04 1 58 42 22 ALA C C 176.870 0.40 1 59 42 22 ALA CA C 50.196 0.40 1 60 42 22 ALA CB C 19.915 0.40 1 61 42 22 ALA N N 127.765 0.40 1 62 43 23 GLY H H 8.634 0.04 1 63 43 23 GLY C C 174.608 0.40 1 64 43 23 GLY CA C 45.886 0.40 1 65 43 23 GLY N N 107.416 0.40 1 66 44 24 HIS H H 8.346 0.04 1 67 44 24 HIS C C 176.957 0.40 1 68 44 24 HIS CA C 57.908 0.40 1 69 44 24 HIS CB C 29.488 0.40 1 70 44 24 HIS N N 121.235 0.40 1 71 45 25 THR H H 9.417 0.04 1 72 45 25 THR C C 174.818 0.40 1 73 45 25 THR CA C 61.937 0.40 1 74 45 25 THR CB C 68.904 0.40 1 75 45 25 THR N N 111.426 0.40 1 76 46 26 LYS H H 7.348 0.04 1 77 46 26 LYS C C 173.415 0.40 1 78 46 26 LYS CA C 53.695 0.40 1 79 46 26 LYS CB C 37.308 0.40 1 80 46 26 LYS N N 119.281 0.40 1 81 47 27 ALA H H 8.552 0.04 1 82 47 27 ALA C C 176.922 0.40 1 83 47 27 ALA CA C 53.492 0.40 1 84 47 27 ALA CB C 19.950 0.40 1 85 47 27 ALA N N 118.123 0.40 1 86 48 28 VAL H H 7.492 0.04 1 87 48 28 VAL C C 173.187 0.40 1 88 48 28 VAL CA C 62.645 0.40 1 89 48 28 VAL CB C 30.821 0.40 1 90 48 28 VAL N N 127.678 0.40 1 91 49 29 SER H H 8.661 0.04 1 92 49 29 SER C C 173.012 0.40 1 93 49 29 SER CA C 57.164 0.40 1 94 49 29 SER CB C 65.573 0.40 1 95 49 29 SER N N 117.626 0.40 1 96 50 30 SER H H 6.651 0.04 1 97 50 30 SER C C 172.959 0.40 1 98 50 30 SER CA C 57.551 0.40 1 99 50 30 SER CB C 65.082 0.40 1 100 50 30 SER N N 113.482 0.40 1 101 51 31 VAL H H 7.183 0.04 1 102 51 31 VAL C C 175.046 0.40 1 103 51 31 VAL CA C 58.068 0.40 1 104 51 31 VAL CB C 34.363 0.40 1 105 51 31 VAL N N 115.479 0.40 1 106 52 32 LYS C C 178.933 0.40 1 107 52 32 LYS CA C 53.553 0.40 1 108 52 32 LYS CB C 37.467 0.40 1 109 53 33 PHE H H 9.241 0.04 1 110 53 33 PHE C C 175.817 0.40 1 111 53 33 PHE CA C 58.586 0.40 1 112 53 33 PHE CB C 39.798 0.40 1 113 53 33 PHE N N 126.942 0.40 1 114 54 34 SER H H 9.207 0.04 1 115 54 34 SER C C 175.256 0.40 1 116 54 34 SER CA C 55.699 0.40 1 117 54 34 SER CB C 59.226 0.40 1 118 54 34 SER N N 120.566 0.40 1 119 55 35 PRO C C 177.197 0.40 1 120 55 35 PRO CA C 64.731 0.40 1 121 55 35 PRO CB C 30.629 0.40 1 122 56 36 ASN H H 7.240 0.04 1 123 56 36 ASN C C 176.624 0.40 1 124 56 36 ASN CA C 51.858 0.40 1 125 56 36 ASN CB C 36.151 0.40 1 126 56 36 ASN N N 110.952 0.40 1 127 57 37 GLY H H 8.170 0.04 1 128 57 37 GLY C C 173.152 0.40 1 129 57 37 GLY CA C 44.911 0.40 1 130 57 37 GLY N N 109.455 0.40 1 131 58 38 GLU H H 6.871 0.04 1 132 58 38 GLU C C 177.939 0.40 1 133 58 38 GLU CA C 57.648 0.40 1 134 58 38 GLU CB C 28.927 0.40 1 135 58 38 GLU N N 115.120 0.40 1 136 59 39 TRP C C 175.453 0.40 1 137 59 39 TRP CA C 53.553 0.40 1 138 59 39 TRP CB C 29.296 0.40 1 139 60 40 LEU H H 8.272 0.04 1 140 60 40 LEU CA C 52.484 0.40 1 141 60 40 LEU CB C 45.198 0.40 1 142 60 40 LEU N N 119.386 0.40 1 143 62 42 SER C C 172.620 0.40 1 144 62 42 SER CA C 55.447 0.40 1 145 62 42 SER CB C 67.345 0.40 1 146 63 43 SER H H 8.518 0.04 1 147 63 43 SER C C 174.575 0.40 1 148 63 43 SER CA C 55.889 0.40 1 149 63 43 SER CB C 67.221 0.40 1 150 63 43 SER N N 112.602 0.40 1 151 64 44 SER H H 6.713 0.04 1 152 64 44 SER C C 174.450 0.40 1 153 64 44 SER CA C 55.508 0.40 1 154 64 44 SER CB C 62.978 0.40 1 155 64 44 SER N N 111.035 0.40 1 156 65 45 ALA H H 7.732 0.04 1 157 65 45 ALA C C 176.607 0.40 1 158 65 45 ALA CA C 54.010 0.40 1 159 65 45 ALA CB C 18.091 0.40 1 160 65 45 ALA N N 130.322 0.40 1 161 66 46 ASP H H 8.902 0.04 1 162 66 46 ASP C C 175.677 0.40 1 163 66 46 ASP CA C 54.309 0.40 1 164 66 46 ASP CB C 39.307 0.40 1 165 66 46 ASP N N 120.632 0.40 1 166 67 47 LYS H H 7.380 0.04 1 167 67 47 LYS C C 175.502 0.40 1 168 67 47 LYS CA C 58.099 0.40 1 169 67 47 LYS CB C 30.435 0.40 1 170 67 47 LYS N N 107.236 0.40 1 171 68 48 LEU H H 8.875 0.04 1 172 68 48 LEU CA C 53.356 0.40 1 173 68 48 LEU CB C 42.183 0.40 1 174 68 48 LEU N N 122.980 0.40 1 175 72 52 TRP C C 177.074 0.40 1 176 72 52 TRP CA C 53.308 0.40 1 177 72 52 TRP CB C 31.611 0.40 1 178 73 53 GLY H H 9.982 0.04 1 179 73 53 GLY C C 175.256 0.40 1 180 73 53 GLY CA C 46.600 0.40 1 181 73 53 GLY N N 112.886 0.40 1 182 74 54 ALA H H 8.001 0.04 1 183 74 54 ALA C C 175.712 0.40 1 184 74 54 ALA CA C 54.663 0.40 1 185 74 54 ALA CB C 19.196 0.40 1 186 74 54 ALA N N 127.032 0.40 1 187 75 55 TYR H H 7.685 0.04 1 188 75 55 TYR C C 177.729 0.40 1 189 75 55 TYR CA C 58.123 0.40 1 190 75 55 TYR CB C 37.799 0.40 1 191 75 55 TYR N N 107.534 0.40 1 192 76 56 ASP H H 7.410 0.04 1 193 76 56 ASP C C 175.817 0.40 1 194 76 56 ASP CA C 51.531 0.40 1 195 76 56 ASP CB C 41.271 0.40 1 196 76 56 ASP N N 115.644 0.40 1 197 77 57 GLY H H 7.445 0.04 1 198 77 57 GLY C C 173.345 0.40 1 199 77 57 GLY CA C 46.246 0.40 1 200 77 57 GLY N N 108.831 0.40 1 201 78 58 LYS H H 7.722 0.04 1 202 78 58 LYS C C 178.255 0.40 1 203 78 58 LYS CA C 56.843 0.40 1 204 78 58 LYS CB C 32.258 0.40 1 205 78 58 LYS N N 119.881 0.40 1 206 80 60 GLU C C 175.055 0.40 1 207 80 60 GLU CA C 56.401 0.40 1 208 80 60 GLU CB C 30.524 0.40 1 209 81 61 LYS H H 6.320 0.04 1 210 81 61 LYS C C 172.784 0.40 1 211 81 61 LYS CA C 55.617 0.40 1 212 81 61 LYS CB C 32.890 0.40 1 213 81 61 LYS N N 111.576 0.40 1 214 82 62 THR H H 8.377 0.04 1 215 82 62 THR C C 173.591 0.40 1 216 82 62 THR CA C 60.929 0.40 1 217 82 62 THR CB C 70.097 0.40 1 218 82 62 THR N N 119.186 0.40 1 219 83 63 ILE H H 9.583 0.04 1 220 83 63 ILE C C 173.801 0.40 1 221 83 63 ILE CA C 61.065 0.40 1 222 83 63 ILE CB C 38.430 0.40 1 223 83 63 ILE N N 130.670 0.40 1 224 84 64 SER H H 8.025 0.04 1 225 84 64 SER CA C 56.107 0.40 1 226 84 64 SER CB C 66.274 0.40 1 227 84 64 SER N N 120.890 0.40 1 228 85 65 GLY C C 175.496 0.40 1 229 85 65 GLY CA C 46.014 0.40 1 230 86 66 HIS H H 8.446 0.04 1 231 86 66 HIS C C 177.062 0.40 1 232 86 66 HIS CA C 59.372 0.40 1 233 86 66 HIS CB C 28.997 0.40 1 234 86 66 HIS N N 120.410 0.40 1 235 87 67 LYS H H 9.360 0.04 1 236 87 67 LYS C C 176.431 0.40 1 237 87 67 LYS CA C 56.860 0.40 1 238 87 67 LYS CB C 33.240 0.40 1 239 87 67 LYS N N 119.936 0.40 1 240 88 68 LEU H H 7.118 0.04 1 241 88 68 LEU C C 175.291 0.40 1 242 88 68 LEU CA C 52.811 0.40 1 243 88 68 LEU CB C 47.321 0.40 1 244 88 68 LEU N N 115.783 0.40 1 245 89 69 GLY H H 8.564 0.04 1 246 89 69 GLY C C 171.487 0.40 1 247 89 69 GLY CA C 45.947 0.40 1 248 89 69 GLY N N 103.769 0.40 1 249 90 70 ILE H H 6.912 0.04 1 250 90 70 ILE C C 176.782 0.40 1 251 90 70 ILE CA C 60.248 0.40 1 252 90 70 ILE CB C 41.060 0.40 1 253 90 70 ILE N N 121.736 0.40 1 254 91 71 SER H H 8.745 0.04 1 255 91 71 SER C C 171.838 0.40 1 256 91 71 SER CA C 60.548 0.40 1 257 91 71 SER CB C 64.942 0.40 1 258 91 71 SER N N 125.858 0.40 1 259 92 72 ASP C C 173.678 0.40 1 260 92 72 ASP CA C 52.852 0.40 1 261 92 72 ASP CB C 44.306 0.40 1 262 93 73 VAL H H 8.058 0.04 1 263 93 73 VAL C C 172.574 0.40 1 264 93 73 VAL CA C 57.625 0.40 1 265 93 73 VAL CB C 35.660 0.40 1 266 93 73 VAL N N 116.016 0.40 1 267 94 74 ALA C C 175.632 0.40 1 268 94 74 ALA CA C 51.660 0.40 1 269 94 74 ALA CB C 22.493 0.40 1 270 95 75 TRP H H 9.285 0.04 1 271 95 75 TRP C C 177.886 0.40 1 272 95 75 TRP CA C 56.370 0.40 1 273 95 75 TRP CB C 32.855 0.40 1 274 95 75 TRP N N 121.424 0.40 1 275 96 76 SER H H 8.762 0.04 1 276 96 76 SER C C 176.834 0.40 1 277 96 76 SER CA C 58.068 0.40 1 278 96 76 SER CB C 62.312 0.40 1 279 96 76 SER N N 118.247 0.40 1 280 97 77 SER H H 8.731 0.04 1 281 97 77 SER C C 175.208 0.40 1 282 97 77 SER CA C 61.010 0.40 1 283 97 77 SER CB C 63.083 0.40 1 284 97 77 SER N N 116.505 0.40 1 285 98 78 ASP H H 7.959 0.04 1 286 98 78 ASP C C 175.975 0.40 1 287 98 78 ASP CA C 53.002 0.40 1 288 98 78 ASP CB C 40.149 0.40 1 289 98 78 ASP N N 120.158 0.40 1 290 99 79 SER H H 8.140 0.04 1 291 99 79 SER C C 172.328 0.40 1 292 99 79 SER CA C 60.932 0.40 1 293 99 79 SER N N 107.512 0.40 1 294 100 80 ASN H H 8.141 0.04 1 295 100 80 ASN C C 175.397 0.40 1 296 100 80 ASN CA C 53.955 0.40 1 297 100 80 ASN CB C 39.763 0.40 1 298 100 80 ASN N N 114.823 0.40 1 299 105 85 ALA C C 175.512 0.40 1 300 105 85 ALA CA C 50.222 0.40 1 301 105 85 ALA CB C 21.231 0.40 1 302 106 86 SER H H 7.454 0.04 1 303 106 86 SER C C 175.747 0.40 1 304 106 86 SER CA C 55.174 0.40 1 305 106 86 SER CB C 63.609 0.40 1 306 106 86 SER N N 113.431 0.40 1 307 107 87 ASP H H 8.344 0.04 1 308 107 87 ASP C C 175.344 0.40 1 309 107 87 ASP CA C 55.590 0.40 1 310 107 87 ASP CB C 39.693 0.40 1 311 107 87 ASP N N 131.009 0.40 1 312 108 88 ASP H H 8.762 0.04 1 313 108 88 ASP C C 175.081 0.40 1 314 108 88 ASP CA C 54.146 0.40 1 315 108 88 ASP CB C 39.202 0.40 1 316 108 88 ASP N N 119.496 0.40 1 317 109 89 LYS H H 7.539 0.04 1 318 109 89 LYS C C 175.835 0.40 1 319 109 89 LYS CA C 58.958 0.40 1 320 109 89 LYS CB C 29.208 0.40 1 321 109 89 LYS N N 107.362 0.40 1 322 110 90 THR H H 8.768 0.04 1 323 110 90 THR C C 174.187 0.40 1 324 110 90 THR CA C 60.452 0.40 1 325 110 90 THR CB C 72.201 0.40 1 326 110 90 THR N N 115.829 0.40 1 327 113 93 ILE C C 174.684 0.40 1 328 113 93 ILE CA C 59.550 0.40 1 329 113 93 ILE CB C 38.572 0.40 1 330 114 94 TRP H H 9.729 0.04 1 331 114 94 TRP C C 175.747 0.40 1 332 114 94 TRP CA C 54.473 0.40 1 333 114 94 TRP CB C 31.171 0.40 1 334 114 94 TRP N N 128.553 0.40 1 335 115 95 ASP H H 8.657 0.04 1 336 115 95 ASP C C 176.449 0.40 1 337 115 95 ASP CA C 52.975 0.40 1 338 115 95 ASP CB C 41.797 0.40 1 339 115 95 ASP N N 122.448 0.40 1 340 116 96 VAL H H 8.020 0.04 1 341 116 96 VAL C C 176.677 0.40 1 342 116 96 VAL CA C 66.813 0.40 1 343 116 96 VAL CB C 30.856 0.40 1 344 116 96 VAL N N 127.799 0.40 1 345 117 97 SER H H 8.682 0.04 1 346 117 97 SER C C 175.644 0.40 1 347 117 97 SER CA C 61.146 0.40 1 348 117 97 SER CB C 62.452 0.40 1 349 117 97 SER N N 115.011 0.40 1 350 118 98 SER H H 7.769 0.04 1 351 118 98 SER C C 176.554 0.40 1 352 118 98 SER CA C 58.341 0.40 1 353 118 98 SER CB C 65.187 0.40 1 354 118 98 SER N N 112.997 0.40 1 355 119 99 GLY H H 8.550 0.04 1 356 119 99 GLY C C 172.504 0.40 1 357 119 99 GLY CA C 45.229 0.40 1 358 119 99 GLY N N 114.545 0.40 1 359 120 100 LYS H H 7.683 0.04 1 360 120 100 LYS C C 175.975 0.40 1 361 120 100 LYS CA C 55.699 0.40 1 362 120 100 LYS CB C 33.521 0.40 1 363 120 100 LYS N N 118.403 0.40 1 364 121 101 CYS H H 8.787 0.04 1 365 121 101 CYS C C 175.467 0.40 1 366 121 101 CYS CA C 58.436 0.40 1 367 121 101 CYS CB C 25.806 0.40 1 368 121 101 CYS N N 122.901 0.40 1 369 122 102 LEU H H 9.454 0.04 1 370 122 102 LEU C C 177.904 0.40 1 371 122 102 LEU CA C 55.916 0.40 1 372 122 102 LEU CB C 42.183 0.40 1 373 122 102 LEU N N 132.256 0.40 1 374 123 103 LYS H H 7.100 0.04 1 375 123 103 LYS C C 173.906 0.40 1 376 123 103 LYS CA C 54.255 0.40 1 377 123 103 LYS CB C 36.712 0.40 1 378 123 103 LYS N N 115.151 0.40 1 379 124 104 THR H H 8.275 0.04 1 380 124 104 THR C C 172.661 0.40 1 381 124 104 THR CA C 61.909 0.40 1 382 124 104 THR CB C 69.150 0.40 1 383 124 104 THR N N 118.744 0.40 1 384 125 105 LEU H H 9.470 0.04 1 385 125 105 LEU C C 175.502 0.40 1 386 125 105 LEU CA C 53.846 0.40 1 387 125 105 LEU CB C 36.782 0.40 1 388 125 105 LEU N N 130.777 0.40 1 389 126 106 LYS H H 8.347 0.04 1 390 126 106 LYS C C 175.712 0.40 1 391 126 106 LYS CA C 55.018 0.40 1 392 126 106 LYS CB C 34.257 0.40 1 393 126 106 LYS N N 125.166 0.40 1 394 127 107 GLY C C 174.316 0.40 1 395 127 107 GLY CA C 46.119 0.40 1 396 128 108 HIS H H 8.775 0.04 1 397 128 108 HIS C C 176.782 0.40 1 398 128 108 HIS CA C 58.995 0.40 1 399 128 108 HIS CB C 28.506 0.40 1 400 128 108 HIS N N 119.808 0.40 1 401 129 109 SER H H 9.901 0.04 1 402 129 109 SER C C 173.871 0.40 1 403 129 109 SER CA C 57.551 0.40 1 404 129 109 SER CB C 63.574 0.40 1 405 129 109 SER N N 115.801 0.40 1 406 130 110 ASN H H 7.567 0.04 1 407 130 110 ASN C C 173.433 0.40 1 408 130 110 ASN CA C 50.768 0.40 1 409 130 110 ASN CB C 41.516 0.40 1 410 130 110 ASN N N 117.975 0.40 1 411 131 111 TYR H H 8.998 0.04 1 412 131 111 TYR C C 177.045 0.40 1 413 131 111 TYR CA C 56.706 0.40 1 414 131 111 TYR CB C 37.869 0.40 1 415 131 111 TYR N N 118.121 0.40 1 416 132 112 VAL H H 8.072 0.04 1 417 132 112 VAL C C 174.082 0.40 1 418 132 112 VAL CA C 63.435 0.40 1 419 132 112 VAL CB C 30.610 0.40 1 420 132 112 VAL N N 128.254 0.40 1 421 133 113 PHE H H 8.754 0.04 1 422 133 113 PHE C C 172.715 0.40 1 423 133 113 PHE CA C 57.546 0.40 1 424 133 113 PHE CB C 43.094 0.40 1 425 133 113 PHE N N 129.110 0.40 1 426 134 114 CYS H H 7.597 0.04 1 427 134 114 CYS C C 174.011 0.40 1 428 134 114 CYS CA C 52.665 0.40 1 429 134 114 CYS CB C 31.031 0.40 1 430 134 114 CYS N N 109.975 0.40 1 431 135 115 CYS H H 8.817 0.04 1 432 135 115 CYS C C 172.679 0.40 1 433 135 115 CYS CA C 54.554 0.40 1 434 135 115 CYS CB C 31.277 0.40 1 435 135 115 CYS N N 114.041 0.40 1 436 136 116 ASN H H 8.472 0.04 1 437 136 116 ASN C C 175.327 0.40 1 438 136 116 ASN CA C 54.010 0.40 1 439 136 116 ASN CB C 46.075 0.40 1 440 136 116 ASN N N 117.534 0.40 1 441 137 117 PHE H H 9.134 0.04 1 442 137 117 PHE C C 177.816 0.40 1 443 137 117 PHE CA C 57.939 0.40 1 444 137 117 PHE CB C 41.481 0.40 1 445 137 117 PHE N N 119.836 0.40 1 446 138 118 ASN H H 8.594 0.04 1 447 138 118 ASN C C 174.748 0.40 1 448 138 118 ASN CA C 52.130 0.40 1 449 138 118 ASN CB C 32.364 0.40 1 450 138 118 ASN N N 119.398 0.40 1 451 140 120 GLN C C 175.596 0.40 1 452 140 120 GLN CA C 57.621 0.40 1 453 140 120 GLN CB C 27.473 0.40 1 454 141 121 SER H H 7.785 0.04 1 455 141 121 SER C C 171.667 0.40 1 456 141 121 SER CA C 59.256 0.40 1 457 141 121 SER CB C 61.260 0.40 1 458 141 121 SER N N 110.433 0.40 1 459 142 122 ASN H H 8.842 0.04 1 460 142 122 ASN C C 175.204 0.40 1 461 142 122 ASN CA C 53.192 0.40 1 462 142 122 ASN CB C 37.799 0.40 1 463 142 122 ASN N N 114.427 0.40 1 464 143 123 LEU H H 8.361 0.04 1 465 143 123 LEU C C 175.607 0.40 1 466 143 123 LEU CA C 53.431 0.40 1 467 143 123 LEU CB C 46.180 0.40 1 468 143 123 LEU N N 122.400 0.40 1 469 144 124 ILE H H 8.453 0.04 1 470 144 124 ILE C C 174.765 0.40 1 471 144 124 ILE CA C 58.504 0.40 1 472 144 124 ILE CB C 43.129 0.40 1 473 144 124 ILE N N 118.469 0.40 1 474 145 125 VAL H H 9.396 0.04 1 475 145 125 VAL C C 172.416 0.40 1 476 145 125 VAL CA C 57.469 0.40 1 477 145 125 VAL CB C 33.836 0.40 1 478 145 125 VAL N N 125.815 0.40 1 479 146 126 SER H H 9.645 0.04 1 480 146 126 SER C C 172.749 0.40 1 481 146 126 SER CA C 56.734 0.40 1 482 146 126 SER CB C 67.747 0.40 1 483 146 126 SER N N 121.324 0.40 1 484 147 127 GLY H H 8.253 0.04 1 485 147 127 GLY C C 173.748 0.40 1 486 147 127 GLY CA C 43.545 0.40 1 487 147 127 GLY N N 105.176 0.40 1 488 148 128 SER H H 7.032 0.04 1 489 148 128 SER C C 174.958 0.40 1 490 148 128 SER CA C 54.745 0.40 1 491 148 128 SER CB C 64.205 0.40 1 492 148 128 SER N N 113.611 0.40 1 493 149 129 PHE H H 8.482 0.04 1 494 149 129 PHE C C 173.994 0.40 1 495 149 129 PHE CA C 60.193 0.40 1 496 149 129 PHE CB C 38.851 0.40 1 497 149 129 PHE N N 129.549 0.40 1 498 150 130 ASP H H 8.775 0.04 1 499 150 130 ASP C C 176.098 0.40 1 500 150 130 ASP CA C 53.819 0.40 1 501 150 130 ASP CB C 39.587 0.40 1 502 150 130 ASP N N 118.112 0.40 1 503 151 131 GLU H H 7.267 0.04 1 504 151 131 GLU C C 173.784 0.40 1 505 151 131 GLU CA C 58.995 0.40 1 506 151 131 GLU CB C 24.684 0.40 1 507 151 131 GLU N N 110.769 0.40 1 508 152 132 SER H H 8.769 0.04 1 509 152 132 SER C C 172.959 0.40 1 510 152 132 SER CA C 57.033 0.40 1 511 152 132 SER CB C 67.642 0.40 1 512 152 132 SER N N 115.485 0.40 1 513 153 133 VAL H H 7.635 0.04 1 514 153 133 VAL C C 175.432 0.40 1 515 153 133 VAL CA C 59.539 0.40 1 516 153 133 VAL CB C 34.398 0.40 1 517 153 133 VAL N N 119.643 0.40 1 518 154 134 ARG H H 8.761 0.04 1 519 154 134 ARG C C 173.538 0.40 1 520 154 134 ARG CA C 53.765 0.40 1 521 154 134 ARG CB C 33.416 0.40 1 522 154 134 ARG N N 125.218 0.40 1 523 155 135 ILE H H 7.709 0.04 1 524 155 135 ILE C C 174.853 0.40 1 525 155 135 ILE CA C 59.676 0.40 1 526 155 135 ILE CB C 39.693 0.40 1 527 155 135 ILE N N 119.533 0.40 1 528 156 136 TRP H H 9.878 0.04 1 529 156 136 TRP C C 175.099 0.40 1 530 156 136 TRP CA C 54.718 0.40 1 531 156 136 TRP CB C 31.487 0.40 1 532 156 136 TRP N N 127.988 0.40 1 533 157 137 ASP H H 8.915 0.04 1 534 157 137 ASP C C 176.571 0.40 1 535 157 137 ASP CA C 53.601 0.40 1 536 157 137 ASP CB C 43.094 0.40 1 537 157 137 ASP N N 122.201 0.40 1 538 158 138 VAL H H 7.965 0.04 1 539 158 138 VAL C C 176.221 0.40 1 540 158 138 VAL CA C 66.404 0.40 1 541 158 138 VAL CB C 32.223 0.40 1 542 158 138 VAL N N 128.576 0.40 1 543 159 139 LYS H H 8.310 0.04 1 544 159 139 LYS C C 179.026 0.40 1 545 159 139 LYS CA C 59.131 0.40 1 546 159 139 LYS CB C 31.662 0.40 1 547 159 139 LYS N N 116.822 0.40 1 548 160 140 THR H H 7.872 0.04 1 549 160 140 THR C C 177.203 0.40 1 550 160 140 THR CA C 61.715 0.40 1 551 160 140 THR CB C 71.219 0.40 1 552 160 140 THR N N 105.120 0.40 1 553 161 141 GLY H H 8.363 0.04 1 554 161 141 GLY C C 172.504 0.40 1 555 161 141 GLY CA C 45.385 0.40 1 556 161 141 GLY N N 113.430 0.40 1 557 162 142 LYS H H 7.585 0.04 1 558 162 142 LYS C C 175.958 0.40 1 559 162 142 LYS CA C 55.753 0.40 1 560 162 142 LYS CB C 33.275 0.40 1 561 162 142 LYS N N 118.634 0.40 1 562 163 143 CYS H H 8.931 0.04 1 563 163 143 CYS CA C 59.022 0.40 1 564 163 143 CYS CB C 37.238 0.40 1 565 163 143 CYS N N 123.796 0.40 1 566 164 144 LEU C C 177.912 0.40 1 567 164 144 LEU CA C 55.929 0.40 1 568 164 144 LEU CB C 42.482 0.40 1 569 165 145 LYS H H 7.343 0.04 1 570 165 145 LYS C C 173.784 0.40 1 571 165 145 LYS CA C 55.127 0.40 1 572 165 145 LYS CB C 36.958 0.40 1 573 165 145 LYS N N 116.310 0.40 1 574 166 146 THR H H 8.232 0.04 1 575 166 146 THR C C 173.468 0.40 1 576 166 146 THR CA C 61.473 0.40 1 577 166 146 THR CB C 68.729 0.40 1 578 166 146 THR N N 120.156 0.40 1 579 167 147 LEU H H 9.452 0.04 1 580 167 147 LEU C C 175.853 0.40 1 581 167 147 LEU CA C 50.691 0.40 1 582 167 147 LEU CB C 39.938 0.40 1 583 167 147 LEU N N 128.698 0.40 1 584 168 148 PRO C C 177.074 0.40 1 585 168 148 PRO CA C 61.514 0.40 1 586 168 148 PRO CB C 26.631 0.40 1 587 169 149 ALA H H 7.731 0.04 1 588 169 149 ALA C C 176.238 0.40 1 589 169 149 ALA CA C 55.018 0.40 1 590 169 149 ALA CB C 23.106 0.40 1 591 169 149 ALA N N 125.691 0.40 1 592 170 150 HIS H H 7.664 0.04 1 593 170 150 HIS C C 173.766 0.40 1 594 170 150 HIS CA C 55.099 0.40 1 595 170 150 HIS CB C 34.327 0.40 1 596 170 150 HIS N N 113.619 0.40 1 597 171 151 SER H H 9.285 0.04 1 598 171 151 SER C C 172.048 0.40 1 599 171 151 SER CA C 56.995 0.40 1 600 171 151 SER CB C 63.364 0.40 1 601 171 151 SER N N 114.356 0.40 1 602 173 153 PRO C C 174.534 0.40 1 603 173 153 PRO CA C 64.495 0.40 1 604 173 153 PRO CB C 31.260 0.40 1 605 174 154 VAL H H 6.766 0.04 1 606 174 154 VAL C C 174.169 0.40 1 607 174 154 VAL CA C 62.427 0.40 1 608 174 154 VAL CB C 31.908 0.40 1 609 174 154 VAL N N 126.587 0.40 1 610 175 155 SER H H 8.618 0.04 1 611 175 155 SER C C 173.626 0.40 1 612 175 155 SER CA C 57.142 0.40 1 613 175 155 SER CB C 65.398 0.40 1 614 175 155 SER N N 121.287 0.40 1 615 176 156 ALA H H 7.014 0.04 1 616 176 156 ALA C C 174.993 0.40 1 617 176 156 ALA CA C 53.136 0.40 1 618 176 156 ALA CB C 21.387 0.40 1 619 176 156 ALA N N 122.579 0.40 1 620 177 157 VAL H H 7.710 0.04 1 621 177 157 VAL C C 175.344 0.40 1 622 177 157 VAL CA C 58.395 0.40 1 623 177 157 VAL CB C 36.116 0.40 1 624 177 157 VAL N N 108.899 0.40 1 625 178 158 HIS H H 8.519 0.04 1 626 178 158 HIS C C 174.653 0.40 1 627 178 158 HIS CA C 57.306 0.40 1 628 178 158 HIS CB C 36.116 0.40 1 629 178 158 HIS N N 121.843 0.40 1 630 179 159 PHE C C 175.862 0.40 1 631 179 159 PHE CA C 57.832 0.40 1 632 179 159 PHE CB C 41.202 0.40 1 633 180 160 ASN H H 8.216 0.04 1 634 180 160 ASN C C 177.851 0.40 1 635 180 160 ASN CA C 51.994 0.40 1 636 180 160 ASN CB C 35.625 0.40 1 637 180 160 ASN N N 117.562 0.40 1 638 181 161 ARG H H 6.959 0.04 1 639 181 161 ARG C C 176.221 0.40 1 640 181 161 ARG CA C 58.641 0.40 1 641 181 161 ARG CB C 29.278 0.40 1 642 181 161 ARG N N 115.261 0.40 1 643 182 162 ASP H H 7.022 0.04 1 644 182 162 ASP C C 177.290 0.40 1 645 182 162 ASP CA C 51.885 0.40 1 646 182 162 ASP CB C 40.499 0.40 1 647 182 162 ASP N N 114.521 0.40 1 648 183 163 GLY H H 7.757 0.04 1 649 183 163 GLY C C 173.906 0.40 1 650 183 163 GLY CA C 45.783 0.40 1 651 183 163 GLY N N 109.169 0.40 1 652 184 164 SER H H 8.739 0.04 1 653 184 164 SER C C 174.276 0.40 1 654 184 164 SER CA C 60.578 0.40 1 655 184 164 SER CB C 63.083 0.40 1 656 184 164 SER N N 120.961 0.40 1 657 185 165 LEU H H 8.053 0.04 1 658 185 165 LEU C C 175.519 0.40 1 659 185 165 LEU CA C 52.878 0.40 1 660 185 165 LEU CB C 46.566 0.40 1 661 185 165 LEU N N 122.424 0.40 1 662 186 166 ILE H H 8.652 0.04 1 663 186 166 ILE C C 175.379 0.40 1 664 186 166 ILE CA C 58.641 0.40 1 665 186 166 ILE CB C 42.709 0.40 1 666 186 166 ILE N N 118.787 0.40 1 667 187 167 VAL H H 9.303 0.04 1 668 187 167 VAL C C 171.907 0.40 1 669 187 167 VAL CA C 57.496 0.40 1 670 187 167 VAL CB C 33.346 0.40 1 671 187 167 VAL N N 125.960 0.40 1 672 188 168 SER H H 9.558 0.04 1 673 188 168 SER C C 172.644 0.40 1 674 188 168 SER CA C 56.325 0.40 1 675 188 168 SER CB C 68.413 0.40 1 676 188 168 SER N N 122.187 0.40 1 677 189 169 SER H H 8.076 0.04 1 678 189 169 SER C C 174.099 0.40 1 679 189 169 SER CA C 55.916 0.40 1 680 189 169 SER CB C 66.730 0.40 1 681 189 169 SER N N 112.688 0.40 1 682 190 170 SER H H 6.696 0.04 1 683 190 170 SER C C 174.467 0.40 1 684 190 170 SER CA C 55.372 0.40 1 685 190 170 SER CB C 62.732 0.40 1 686 190 170 SER N N 109.339 0.40 1 687 191 171 TYR H H 7.093 0.04 1 688 191 171 TYR C C 174.573 0.40 1 689 191 171 TYR CA C 59.218 0.40 1 690 191 171 TYR CB C 37.553 0.40 1 691 191 171 TYR N N 126.047 0.40 1 692 192 172 ASP H H 8.491 0.04 1 693 192 172 ASP C C 176.712 0.40 1 694 192 172 ASP CA C 55.127 0.40 1 695 192 172 ASP CB C 39.798 0.40 1 696 192 172 ASP N N 120.972 0.40 1 697 193 173 GLY H H 7.858 0.04 1 698 193 173 GLY C C 174.169 0.40 1 699 193 173 GLY CA C 44.421 0.40 1 700 193 173 GLY N N 106.609 0.40 1 701 194 174 LEU H H 8.863 0.04 1 702 194 174 LEU C C 176.283 0.40 1 703 194 174 LEU CA C 54.228 0.40 1 704 194 174 LEU CB C 42.709 0.40 1 705 194 174 LEU N N 122.787 0.40 1 706 195 175 CYS H H 6.755 0.04 1 707 195 175 CYS C C 174.538 0.40 1 708 195 175 CYS CA C 56.952 0.40 1 709 195 175 CYS CB C 28.611 0.40 1 710 195 175 CYS N N 116.172 0.40 1 711 196 176 ARG H H 9.153 0.04 1 712 196 176 ARG C C 172.504 0.40 1 713 196 176 ARG CA C 54.811 0.40 1 714 196 176 ARG CB C 34.187 0.40 1 715 196 176 ARG N N 124.788 0.40 1 716 197 177 ILE H H 8.047 0.04 1 717 197 177 ILE C C 174.380 0.40 1 718 197 177 ILE CA C 59.104 0.40 1 719 197 177 ILE CB C 37.975 0.40 1 720 197 177 ILE N N 120.633 0.40 1 721 198 178 TRP H H 9.971 0.04 1 722 198 178 TRP C C 175.379 0.40 1 723 198 178 TRP CA C 54.343 0.40 1 724 198 178 TRP CB C 30.821 0.40 1 725 198 178 TRP N N 129.036 0.40 1 726 199 179 ASP H H 8.712 0.04 1 727 199 179 ASP C C 176.361 0.40 1 728 199 179 ASP CA C 53.492 0.40 1 729 199 179 ASP CB C 42.709 0.40 1 730 199 179 ASP N N 122.311 0.40 1 731 200 180 THR H H 8.478 0.04 1 732 200 180 THR C C 175.011 0.40 1 733 200 180 THR CA C 66.349 0.40 1 734 200 180 THR CB C 68.939 0.40 1 735 200 180 THR N N 127.024 0.40 1 736 201 181 ALA C C 179.594 0.40 1 737 201 181 ALA CA C 54.500 0.40 1 738 201 181 ALA CB C 18.215 0.40 1 739 202 182 SER H H 8.314 0.04 1 740 202 182 SER C C 177.080 0.40 1 741 202 182 SER CA C 58.477 0.40 1 742 202 182 SER CB C 65.643 0.40 1 743 202 182 SER N N 110.896 0.40 1 744 203 183 GLY H H 8.799 0.04 1 745 203 183 GLY C C 172.276 0.40 1 746 203 183 GLY CA C 45.701 0.40 1 747 203 183 GLY N N 114.582 0.40 1 748 204 184 GLN H H 7.756 0.04 1 749 204 184 GLN C C 175.625 0.40 1 750 204 184 GLN CA C 55.018 0.40 1 751 204 184 GLN CB C 29.628 0.40 1 752 204 184 GLN N N 117.349 0.40 1 753 205 185 CYS H H 8.885 0.04 1 754 205 185 CYS C C 175.344 0.40 1 755 205 185 CYS CA C 58.722 0.40 1 756 205 185 CYS CB C 25.490 0.40 1 757 205 185 CYS N N 124.080 0.40 1 758 206 186 LEU H H 9.276 0.04 1 759 206 186 LEU C C 177.571 0.40 1 760 206 186 LEU CA C 55.796 0.40 1 761 206 186 LEU CB C 42.393 0.40 1 762 206 186 LEU N N 132.281 0.40 1 763 207 187 LYS H H 7.372 0.04 1 764 207 187 LYS C C 173.415 0.40 1 765 207 187 LYS CA C 55.372 0.40 1 766 207 187 LYS CB C 35.239 0.40 1 767 207 187 LYS N N 117.501 0.40 1 768 208 188 THR H H 8.231 0.04 1 769 208 188 THR C C 173.308 0.40 1 770 208 188 THR CA C 61.582 0.40 1 771 208 188 THR CB C 69.991 0.40 1 772 208 188 THR N N 121.219 0.40 1 773 209 189 LEU H H 8.642 0.04 1 774 209 189 LEU C C 174.765 0.40 1 775 209 189 LEU CA C 53.628 0.40 1 776 209 189 LEU CB C 39.412 0.40 1 777 209 189 LEU N N 128.023 0.40 1 778 210 190 ILE H H 7.776 0.04 1 779 210 190 ILE C C 174.029 0.40 1 780 210 190 ILE CA C 60.069 0.40 1 781 210 190 ILE CB C 40.710 0.40 1 782 210 190 ILE N N 123.036 0.40 1 783 211 191 ASP H H 8.996 0.04 1 784 211 191 ASP C C 176.414 0.40 1 785 211 191 ASP CA C 52.130 0.40 1 786 211 191 ASP CB C 43.305 0.40 1 787 211 191 ASP N N 128.374 0.40 1 788 212 192 ASP H H 8.735 0.04 1 789 212 192 ASP C C 176.203 0.40 1 790 212 192 ASP CA C 56.563 0.40 1 791 212 192 ASP CB C 40.429 0.40 1 792 212 192 ASP N N 122.761 0.40 1 793 213 193 ASP H H 8.213 0.04 1 794 213 193 ASP C C 174.976 0.40 1 795 213 193 ASP CA C 54.119 0.40 1 796 213 193 ASP CB C 41.516 0.40 1 797 213 193 ASP N N 117.847 0.40 1 798 214 194 ASN H H 8.340 0.04 1 799 214 194 ASN C C 171.592 0.40 1 800 214 194 ASN CA C 52.866 0.40 1 801 214 194 ASN CB C 39.447 0.40 1 802 214 194 ASN N N 118.744 0.40 1 803 216 196 PRO C C 174.725 0.40 1 804 216 196 PRO CA C 63.688 0.40 1 805 216 196 PRO CB C 32.348 0.40 1 806 217 197 VAL H H 7.089 0.04 1 807 217 197 VAL C C 175.712 0.40 1 808 217 197 VAL CA C 60.820 0.40 1 809 217 197 VAL CB C 30.855 0.40 1 810 217 197 VAL N N 123.993 0.40 1 811 218 198 SER H H 8.859 0.04 1 812 218 198 SER C C 172.924 0.40 1 813 218 198 SER CA C 58.232 0.40 1 814 218 198 SER CB C 64.135 0.40 1 815 218 198 SER N N 123.438 0.40 1 816 219 199 PHE H H 7.325 0.04 1 817 219 199 PHE C C 172.486 0.40 1 818 219 199 PHE CA C 59.785 0.40 1 819 219 199 PHE CB C 41.516 0.40 1 820 219 199 PHE N N 118.398 0.40 1 821 220 200 VAL C C 171.858 0.40 1 822 220 200 VAL CA C 59.024 0.40 1 823 220 200 VAL CB C 34.627 0.40 1 824 221 201 LYS H H 7.842 0.04 1 825 221 201 LYS C C 175.853 0.40 1 826 221 201 LYS CA C 55.702 0.40 1 827 221 201 LYS CB C 35.765 0.40 1 828 221 201 LYS N N 118.202 0.40 1 829 222 202 PHE C C 177.439 0.40 1 830 222 202 PHE CA C 59.690 0.40 1 831 222 202 PHE CB C 40.553 0.40 1 832 223 203 SER H H 8.936 0.04 1 833 223 203 SER C C 174.730 0.40 1 834 223 203 SER CA C 56.516 0.40 1 835 223 203 SER CB C 61.751 0.40 1 836 223 203 SER N N 115.251 0.40 1 837 226 206 GLY C C 173.730 0.40 1 838 226 206 GLY CA C 45.418 0.40 1 839 227 207 LYS H H 7.498 0.04 1 840 227 207 LYS C C 175.554 0.40 1 841 227 207 LYS CA C 57.551 0.40 1 842 227 207 LYS CB C 32.329 0.40 1 843 227 207 LYS N N 119.134 0.40 1 844 228 208 TYR H H 8.004 0.04 1 845 228 208 TYR C C 175.730 0.40 1 846 228 208 TYR CA C 53.812 0.40 1 847 228 208 TYR CB C 42.183 0.40 1 848 228 208 TYR N N 115.070 0.40 1 849 229 209 ILE H H 9.008 0.04 1 850 229 209 ILE C C 174.362 0.40 1 851 229 209 ILE CA C 59.676 0.40 1 852 229 209 ILE CB C 41.586 0.40 1 853 229 209 ILE N N 117.031 0.40 1 854 230 210 LEU H H 9.346 0.04 1 855 230 210 LEU C C 173.626 0.40 1 856 230 210 LEU CA C 53.002 0.40 1 857 230 210 LEU CB C 44.813 0.40 1 858 230 210 LEU N N 130.026 0.40 1 859 231 211 ALA H H 9.534 0.04 1 860 231 211 ALA C C 175.958 0.40 1 861 231 211 ALA CA C 49.706 0.40 1 862 231 211 ALA CB C 22.580 0.40 1 863 231 211 ALA N N 128.092 0.40 1 864 232 212 ALA H H 9.126 0.04 1 865 232 212 ALA C C 175.677 0.40 1 866 232 212 ALA CA C 50.659 0.40 1 867 232 212 ALA CB C 22.650 0.40 1 868 232 212 ALA N N 128.319 0.40 1 869 233 213 THR H H 8.494 0.04 1 870 233 213 THR C C 176.694 0.40 1 871 233 213 THR CA C 58.014 0.40 1 872 233 213 THR CB C 71.324 0.40 1 873 233 213 THR N N 110.229 0.40 1 874 234 214 LEU H H 7.435 0.04 1 875 234 214 LEU C C 175.853 0.40 1 876 234 214 LEU CA C 54.106 0.40 1 877 234 214 LEU CB C 37.799 0.40 1 878 234 214 LEU N N 118.276 0.40 1 879 235 215 ASP H H 8.564 0.04 1 880 235 215 ASP C C 177.571 0.40 1 881 235 215 ASP CA C 52.118 0.40 1 882 235 215 ASP CB C 39.517 0.40 1 883 235 215 ASP N N 122.191 0.40 1 884 236 216 ASN H H 8.259 0.04 1 885 236 216 ASN C C 173.748 0.40 1 886 236 216 ASN CA C 54.183 0.40 1 887 236 216 ASN CB C 37.764 0.40 1 888 236 216 ASN N N 113.202 0.40 1 889 237 217 THR H H 7.361 0.04 1 890 237 217 THR C C 172.206 0.40 1 891 237 217 THR CA C 63.131 0.40 1 892 237 217 THR CB C 71.499 0.40 1 893 237 217 THR N N 110.789 0.40 1 894 238 218 LEU H H 8.455 0.04 1 895 238 218 LEU C C 175.695 0.40 1 896 238 218 LEU CA C 53.928 0.40 1 897 238 218 LEU CB C 44.462 0.40 1 898 238 218 LEU N N 125.880 0.40 1 899 239 219 LYS H H 9.431 0.04 1 900 239 219 LYS C C 173.801 0.40 1 901 239 219 LYS CA C 55.273 0.40 1 902 239 219 LYS CB C 36.467 0.40 1 903 239 219 LYS N N 121.088 0.40 1 904 240 220 LEU H H 8.484 0.04 1 905 240 220 LEU C C 175.309 0.40 1 906 240 220 LEU CA C 52.920 0.40 1 907 240 220 LEU CB C 45.198 0.40 1 908 240 220 LEU N N 124.062 0.40 1 909 241 221 TRP H H 10.070 0.04 1 910 241 221 TRP C C 177.220 0.40 1 911 241 221 TRP CA C 56.792 0.40 1 912 241 221 TRP CB C 31.206 0.40 1 913 241 221 TRP N N 127.214 0.40 1 914 242 222 ASP H H 9.185 0.04 1 915 242 222 ASP C C 177.530 0.40 1 916 242 222 ASP CA C 53.601 0.40 1 917 242 222 ASP CB C 40.955 0.40 1 918 242 222 ASP N N 121.987 0.40 1 919 243 223 TYR H H 7.380 0.04 1 920 243 223 TYR C C 175.309 0.40 1 921 243 223 TYR CA C 59.436 0.40 1 922 243 223 TYR CB C 38.010 0.40 1 923 243 223 TYR N N 123.367 0.40 1 924 244 224 SER H H 8.074 0.04 1 925 244 224 SER C C 176.202 0.40 1 926 244 224 SER CA C 60.983 0.40 1 927 244 224 SER CB C 62.382 0.40 1 928 244 224 SER N N 119.793 0.40 1 929 245 225 LYS H H 7.632 0.04 1 930 245 225 LYS C C 177.483 0.40 1 931 245 225 LYS CA C 55.699 0.40 1 932 245 225 LYS CB C 33.275 0.40 1 933 245 225 LYS N N 118.094 0.40 1 934 246 226 GLY H H 7.991 0.04 1 935 246 226 GLY C C 173.553 0.40 1 936 246 226 GLY CA C 46.192 0.40 1 937 246 226 GLY N N 109.142 0.40 1 938 247 227 LYS H H 7.473 0.04 1 939 247 227 LYS C C 174.239 0.40 1 940 247 227 LYS CA C 53.765 0.40 1 941 247 227 LYS CB C 36.186 0.40 1 942 247 227 LYS N N 116.570 0.40 1 943 248 228 CYS C C 174.493 0.40 1 944 248 228 CYS CA C 58.498 0.40 1 945 248 228 CYS CB C 24.738 0.40 1 946 249 229 LEU H H 9.102 0.04 1 947 249 229 LEU C C 177.396 0.40 1 948 249 229 LEU CA C 55.889 0.40 1 949 249 229 LEU CB C 43.726 0.40 1 950 249 229 LEU N N 129.992 0.40 1 951 250 230 LYS H H 7.236 0.04 1 952 250 230 LYS C C 173.661 0.40 1 953 250 230 LYS CA C 54.228 0.40 1 954 250 230 LYS CB C 37.764 0.40 1 955 250 230 LYS N N 115.031 0.40 1 956 251 231 THR C C 175.767 0.40 1 957 251 231 THR CA C 59.445 0.40 1 958 251 231 THR CB C 70.869 0.40 1 959 252 232 TYR H H 8.898 0.04 1 960 252 232 TYR C C 174.922 0.40 1 961 252 232 TYR CA C 56.189 0.40 1 962 252 232 TYR CB C 36.747 0.40 1 963 252 232 TYR N N 123.236 0.40 1 964 253 233 THR H H 8.757 0.04 1 965 253 233 THR C C 174.678 0.40 1 966 253 233 THR CA C 59.757 0.40 1 967 253 233 THR CB C 72.060 0.40 1 968 253 233 THR N N 112.945 0.40 1 969 254 234 GLY H H 9.644 0.04 1 970 254 234 GLY C C 173.222 0.40 1 971 254 234 GLY CA C 44.557 0.40 1 972 254 234 GLY N N 110.922 0.40 1 973 255 235 HIS H H 9.891 0.04 1 974 255 235 HIS C C 173.468 0.40 1 975 255 235 HIS CA C 54.746 0.40 1 976 255 235 HIS CB C 29.278 0.40 1 977 255 235 HIS N N 123.250 0.40 1 978 256 236 LYS C C 175.424 0.40 1 979 256 236 LYS CA C 53.413 0.40 1 980 256 236 LYS CB C 33.743 0.40 1 981 257 237 ASN H H 10.435 0.04 1 982 257 237 ASN C C 170.592 0.40 1 983 257 237 ASN CA C 52.567 0.40 1 984 257 237 ASN CB C 38.150 0.40 1 985 257 237 ASN N N 125.736 0.40 1 986 258 238 GLU H H 10.006 0.04 1 987 258 238 GLU C C 175.905 0.40 1 988 258 238 GLU CA C 55.181 0.40 1 989 258 238 GLU CB C 32.574 0.40 1 990 258 238 GLU N N 123.529 0.40 1 991 259 239 LYS H H 10.056 0.04 1 992 259 239 LYS C C 175.449 0.40 1 993 259 239 LYS CA C 57.660 0.40 1 994 259 239 LYS CB C 36.326 0.40 1 995 259 239 LYS N N 124.944 0.40 1 996 260 240 TYR H H 8.194 0.04 1 997 260 240 TYR C C 174.836 0.40 1 998 260 240 TYR CA C 58.313 0.40 1 999 260 240 TYR CB C 40.745 0.40 1 1000 260 240 TYR N N 118.946 0.40 1 1001 261 241 CYS H H 8.742 0.04 1 1002 261 241 CYS C C 173.293 0.40 1 1003 261 241 CYS CA C 59.294 0.40 1 1004 261 241 CYS CB C 25.701 0.40 1 1005 261 241 CYS N N 119.661 0.40 1 1006 262 242 ILE H H 8.446 0.04 1 1007 262 242 ILE C C 176.010 0.40 1 1008 262 242 ILE CA C 59.975 0.40 1 1009 262 242 ILE CB C 38.851 0.40 1 1010 262 242 ILE N N 128.586 0.40 1 1011 263 243 PHE H H 7.711 0.04 1 1012 263 243 PHE C C 174.099 0.40 1 1013 263 243 PHE CA C 58.232 0.40 1 1014 263 243 PHE CB C 40.464 0.40 1 1015 263 243 PHE N N 125.235 0.40 1 1016 264 244 ALA C C 175.801 0.40 1 1017 264 244 ALA CA C 50.012 0.40 1 1018 264 244 ALA CB C 21.652 0.40 1 1019 265 245 ASN H H 8.810 0.04 1 1020 265 245 ASN C C 173.713 0.40 1 1021 265 245 ASN CA C 53.056 0.40 1 1022 265 245 ASN CB C 46.671 0.40 1 1023 265 245 ASN N N 112.801 0.40 1 1024 266 246 PHE H H 8.813 0.04 1 1025 266 246 PHE C C 174.222 0.40 1 1026 266 246 PHE CA C 57.325 0.40 1 1027 266 246 PHE CB C 38.921 0.40 1 1028 266 246 PHE N N 118.658 0.40 1 1029 267 247 SER H H 8.569 0.04 1 1030 267 247 SER C C 177.062 0.40 1 1031 267 247 SER CA C 56.516 0.40 1 1032 267 247 SER CB C 63.399 0.40 1 1033 267 247 SER N N 118.552 0.40 1 1034 268 248 VAL H H 9.885 0.04 1 1035 268 248 VAL C C 176.396 0.40 1 1036 268 248 VAL CA C 60.401 0.40 1 1037 268 248 VAL CB C 33.100 0.40 1 1038 268 248 VAL N N 120.379 0.40 1 1039 269 249 THR H H 7.547 0.04 1 1040 269 249 THR C C 175.625 0.40 1 1041 269 249 THR CA C 63.544 0.40 1 1042 269 249 THR CB C 68.378 0.40 1 1043 269 249 THR N N 115.151 0.40 1 1044 270 250 GLY H H 8.980 0.04 1 1045 270 250 GLY C C 174.936 0.40 1 1046 270 250 GLY CA C 45.211 0.40 1 1047 270 250 GLY N N 117.855 0.40 1 1048 271 251 GLY H H 8.640 0.04 1 1049 271 251 GLY C C 170.359 0.40 1 1050 271 251 GLY CA C 43.767 0.40 1 1051 271 251 GLY N N 115.481 0.40 1 1052 272 252 LYS H H 7.124 0.04 1 1053 272 252 LYS C C 174.362 0.40 1 1054 272 252 LYS CA C 53.955 0.40 1 1055 272 252 LYS CB C 29.681 0.40 1 1056 272 252 LYS N N 116.052 0.40 1 1057 273 253 TRP H H 7.885 0.04 1 1058 273 253 TRP C C 177.290 0.40 1 1059 273 253 TRP CA C 52.188 0.40 1 1060 273 253 TRP CB C 34.503 0.40 1 1061 273 253 TRP N N 124.059 0.40 1 1062 274 254 ILE H H 8.882 0.04 1 1063 274 254 ILE C C 174.757 0.40 1 1064 274 254 ILE CA C 58.147 0.40 1 1065 274 254 ILE CB C 38.045 0.40 1 1066 274 254 ILE N N 123.622 0.40 1 1067 275 255 VAL H H 8.606 0.04 1 1068 275 255 VAL C C 175.186 0.40 1 1069 275 255 VAL CA C 59.757 0.40 1 1070 275 255 VAL CB C 35.485 0.40 1 1071 275 255 VAL N N 126.115 0.40 1 1072 276 256 SER H H 9.009 0.04 1 1073 276 256 SER C C 174.485 0.40 1 1074 276 256 SER CA C 58.205 0.40 1 1075 276 256 SER CB C 66.239 0.40 1 1076 276 256 SER N N 118.359 0.40 1 1077 277 257 GLY H H 6.596 0.04 1 1078 277 257 GLY C C 172.013 0.40 1 1079 277 257 GLY CA C 44.585 0.40 1 1080 277 257 GLY N N 108.941 0.40 1 1081 278 258 SER C C 175.882 0.40 1 1082 278 258 SER CA C 56.745 0.40 1 1083 278 258 SER CB C 63.137 0.40 1 1084 279 259 GLU H H 9.825 0.04 1 1085 279 259 GLU C C 174.117 0.40 1 1086 279 259 GLU CA C 56.761 0.40 1 1087 279 259 GLU CB C 26.893 0.40 1 1088 279 259 GLU N N 126.441 0.40 1 1089 280 260 ASP H H 8.125 0.04 1 1090 280 260 ASP C C 175.554 0.40 1 1091 280 260 ASP CA C 52.430 0.40 1 1092 280 260 ASP CB C 39.482 0.40 1 1093 280 260 ASP N N 118.474 0.40 1 1094 281 261 ASN H H 7.141 0.04 1 1095 281 261 ASN C C 173.906 0.40 1 1096 281 261 ASN CA C 54.827 0.40 1 1097 281 261 ASN CB C 34.732 0.40 1 1098 281 261 ASN N N 108.377 0.40 1 1099 282 262 LEU H H 7.214 0.04 1 1100 282 262 LEU C C 175.449 0.40 1 1101 282 262 LEU CA C 53.601 0.40 1 1102 282 262 LEU CB C 43.796 0.40 1 1103 282 262 LEU N N 120.449 0.40 1 1104 283 263 VAL H H 7.093 0.04 1 1105 283 263 VAL C C 175.460 0.40 1 1106 283 263 VAL CA C 61.010 0.40 1 1107 283 263 VAL CB C 31.803 0.40 1 1108 283 263 VAL N N 116.040 0.40 1 1109 284 264 TYR H H 8.815 0.04 1 1110 284 264 TYR C C 173.503 0.40 1 1111 284 264 TYR CA C 57.737 0.40 1 1112 284 264 TYR CB C 41.096 0.40 1 1113 284 264 TYR N N 128.069 0.40 1 1114 285 265 ILE H H 7.364 0.04 1 1115 285 265 ILE C C 175.905 0.40 1 1116 285 265 ILE CA C 59.730 0.40 1 1117 285 265 ILE CB C 38.290 0.40 1 1118 285 265 ILE N N 117.305 0.40 1 1119 286 266 TRP H H 9.823 0.04 1 1120 286 266 TRP C C 177.623 0.40 1 1121 286 266 TRP CA C 57.333 0.40 1 1122 286 266 TRP CB C 33.942 0.40 1 1123 286 266 TRP N N 126.124 0.40 1 1124 287 267 ASN H H 9.316 0.04 1 1125 287 267 ASN C C 175.940 0.40 1 1126 287 267 ASN CA C 54.337 0.40 1 1127 287 267 ASN CB C 39.658 0.40 1 1128 287 267 ASN N N 120.816 0.40 1 1129 288 268 LEU H H 8.111 0.04 1 1130 288 268 LEU C C 178.167 0.40 1 1131 288 268 LEU CA C 59.049 0.40 1 1132 288 268 LEU CB C 43.200 0.40 1 1133 288 268 LEU N N 129.765 0.40 1 1134 289 269 GLN H H 8.292 0.04 1 1135 289 269 GLN C C 178.483 0.40 1 1136 289 269 GLN CA C 58.368 0.40 1 1137 289 269 GLN CB C 28.646 0.40 1 1138 289 269 GLN N N 115.567 0.40 1 1139 290 270 THR H H 8.252 0.04 1 1140 290 270 THR C C 176.624 0.40 1 1141 290 270 THR CA C 62.209 0.40 1 1142 290 270 THR CB C 69.641 0.40 1 1143 290 270 THR N N 109.050 0.40 1 1144 291 271 LYS H H 8.292 0.04 1 1145 291 271 LYS C C 174.713 0.40 1 1146 291 271 LYS CA C 58.171 0.40 1 1147 291 271 LYS CB C 27.910 0.40 1 1148 291 271 LYS N N 114.191 0.40 1 1149 292 272 GLU H H 7.860 0.04 1 1150 292 272 GLU C C 177.255 0.40 1 1151 292 272 GLU CA C 55.889 0.40 1 1152 292 272 GLU CB C 30.645 0.40 1 1153 292 272 GLU N N 119.914 0.40 1 1154 293 273 ILE H H 8.992 0.04 1 1155 293 273 ILE C C 177.133 0.40 1 1156 293 273 ILE CA C 62.972 0.40 1 1157 293 273 ILE CB C 37.273 0.40 1 1158 293 273 ILE N N 124.612 0.40 1 1159 294 274 VAL H H 9.192 0.04 1 1160 294 274 VAL C C 175.765 0.40 1 1161 294 274 VAL CA C 60.792 0.40 1 1162 294 274 VAL CB C 32.294 0.40 1 1163 294 274 VAL N N 122.319 0.40 1 1164 295 275 GLN H H 7.453 0.04 1 1165 295 275 GLN C C 172.539 0.40 1 1166 295 275 GLN CA C 57.144 0.40 1 1167 295 275 GLN CB C 33.135 0.40 1 1168 295 275 GLN N N 121.577 0.40 1 1169 296 276 LYS H H 7.649 0.04 1 1170 296 276 LYS C C 175.853 0.40 1 1171 296 276 LYS CA C 53.955 0.40 1 1172 296 276 LYS CB C 33.942 0.40 1 1173 296 276 LYS N N 120.594 0.40 1 1174 297 277 LEU H H 9.070 0.04 1 1175 297 277 LEU C C 176.045 0.40 1 1176 297 277 LEU CA C 53.085 0.40 1 1177 297 277 LEU CB C 37.519 0.40 1 1178 297 277 LEU N N 123.020 0.40 1 1179 298 278 GLN H H 8.637 0.04 1 1180 298 278 GLN C C 174.748 0.40 1 1181 298 278 GLN CA C 54.418 0.40 1 1182 298 278 GLN CB C 30.575 0.40 1 1183 298 278 GLN N N 125.964 0.40 1 1184 299 279 GLY H H 9.144 0.04 1 1185 299 279 GLY C C 174.625 0.40 1 1186 299 279 GLY CA C 46.059 0.40 1 1187 299 279 GLY N N 112.196 0.40 1 1188 300 280 HIS H H 9.091 0.04 1 1189 300 280 HIS C C 177.133 0.40 1 1190 300 280 HIS CA C 58.166 0.40 1 1191 300 280 HIS CB C 28.997 0.40 1 1192 300 280 HIS N N 121.410 0.40 1 1193 301 281 THR H H 10.025 0.04 1 1194 301 281 THR C C 173.766 0.40 1 1195 301 281 THR CA C 60.656 0.40 1 1196 301 281 THR CB C 68.028 0.40 1 1197 301 281 THR N N 111.590 0.40 1 1198 302 282 ASP H H 7.606 0.04 1 1199 302 282 ASP C C 172.995 0.40 1 1200 302 282 ASP CA C 51.367 0.40 1 1201 302 282 ASP CB C 44.813 0.40 1 1202 302 282 ASP N N 119.489 0.40 1 1203 303 283 VAL H H 9.467 0.04 1 1204 303 283 VAL C C 175.467 0.40 1 1205 303 283 VAL CA C 63.974 0.40 1 1206 303 283 VAL CB C 32.784 0.40 1 1207 303 283 VAL N N 117.650 0.40 1 1208 304 284 VAL H H 6.950 0.04 1 1209 304 284 VAL C C 173.924 0.40 1 1210 304 284 VAL CA C 61.092 0.40 1 1211 304 284 VAL CB C 30.680 0.40 1 1212 304 284 VAL N N 126.336 0.40 1 1213 305 285 ILE H H 7.285 0.04 1 1214 305 285 ILE C C 173.801 0.40 1 1215 305 285 ILE CA C 58.586 0.40 1 1216 305 285 ILE CB C 40.570 0.40 1 1217 305 285 ILE N N 125.479 0.40 1 1218 306 286 SER H H 7.279 0.04 1 1219 306 286 SER C C 173.047 0.40 1 1220 306 286 SER CA C 57.574 0.40 1 1221 306 286 SER CB C 64.275 0.40 1 1222 306 286 SER N N 112.016 0.40 1 1223 307 287 THR H H 6.917 0.04 1 1224 307 287 THR C C 173.871 0.40 1 1225 307 287 THR CA C 58.232 0.40 1 1226 307 287 THR CB C 73.779 0.40 1 1227 307 287 THR N N 113.372 0.40 1 1228 308 288 ALA H H 9.261 0.04 1 1229 308 288 ALA C C 175.607 0.40 1 1230 308 288 ALA CA C 51.651 0.40 1 1231 308 288 ALA CB C 22.545 0.40 1 1232 308 288 ALA N N 125.131 0.40 1 1233 309 289 CYS H H 9.053 0.04 1 1234 309 289 CYS C C 173.801 0.40 1 1235 309 289 CYS CA C 58.136 0.40 1 1236 309 289 CYS CB C 30.259 0.40 1 1237 309 289 CYS N N 120.165 0.40 1 1238 310 290 HIS H H 8.931 0.04 1 1239 310 290 HIS C C 173.731 0.40 1 1240 310 290 HIS CA C 56.407 0.40 1 1241 310 290 HIS CB C 31.627 0.40 1 1242 310 290 HIS N N 129.892 0.40 1 1243 311 291 PRO C C 177.763 0.40 1 1244 311 291 PRO CA C 64.319 0.40 1 1245 311 291 PRO CB C 31.721 0.40 1 1246 312 292 THR H H 9.198 0.04 1 1247 312 292 THR C C 174.222 0.40 1 1248 312 292 THR CA C 62.650 0.40 1 1249 312 292 THR CB C 70.588 0.40 1 1250 312 292 THR N N 110.005 0.40 1 1251 313 293 GLU H H 9.581 0.04 1 1252 313 293 GLU C C 175.502 0.40 1 1253 313 293 GLU CA C 53.465 0.40 1 1254 313 293 GLU CB C 31.803 0.40 1 1255 313 293 GLU N N 126.787 0.40 1 1256 314 294 ASN H H 8.886 0.04 1 1257 314 294 ASN C C 173.275 0.40 1 1258 314 294 ASN CA C 51.640 0.40 1 1259 314 294 ASN CB C 36.116 0.40 1 1260 314 294 ASN N N 119.232 0.40 1 1261 315 295 ILE H H 8.093 0.04 1 1262 315 295 ILE C C 175.028 0.40 1 1263 315 295 ILE CA C 59.539 0.40 1 1264 315 295 ILE CB C 42.218 0.40 1 1265 315 295 ILE N N 123.688 0.40 1 1266 316 296 ILE H H 8.963 0.04 1 1267 316 296 ILE C C 175.607 0.40 1 1268 316 296 ILE CA C 58.940 0.40 1 1269 316 296 ILE CB C 41.937 0.40 1 1270 316 296 ILE N N 127.030 0.40 1 1271 317 297 ALA H H 9.284 0.04 1 1272 317 297 ALA C C 175.726 0.40 1 1273 317 297 ALA CA C 49.188 0.40 1 1274 317 297 ALA CB C 23.036 0.40 1 1275 317 297 ALA N N 127.215 0.40 1 1276 318 298 SER H H 9.948 0.04 1 1277 318 298 SER C C 172.348 0.40 1 1278 318 298 SER CA C 56.271 0.40 1 1279 318 298 SER CB C 66.450 0.40 1 1280 318 298 SER N N 117.204 0.40 1 1281 319 299 ALA H H 8.294 0.04 1 1282 319 299 ALA C C 175.660 0.40 1 1283 319 299 ALA CA C 50.686 0.40 1 1284 319 299 ALA CB C 24.228 0.40 1 1285 319 299 ALA N N 121.495 0.40 1 1286 321 301 LEU C C 177.585 0.40 1 1287 321 301 LEU CA C 54.676 0.40 1 1288 321 301 LEU CB C 38.975 0.40 1 1289 322 302 GLU H H 7.669 0.04 1 1290 322 302 GLU C C 175.256 0.40 1 1291 322 302 GLU CA C 60.220 0.40 1 1292 322 302 GLU CB C 30.365 0.40 1 1293 322 302 GLU N N 117.132 0.40 1 1294 323 303 ASN H H 10.091 0.04 1 1295 323 303 ASN C C 174.064 0.40 1 1296 323 303 ASN CA C 54.010 0.40 1 1297 323 303 ASN CB C 37.413 0.40 1 1298 323 303 ASN N N 117.479 0.40 1 1299 324 304 ASP H H 8.295 0.04 1 1300 324 304 ASP C C 174.713 0.40 1 1301 324 304 ASP CA C 55.916 0.40 1 1302 324 304 ASP CB C 45.374 0.40 1 1303 324 304 ASP N N 120.303 0.40 1 1304 325 305 LYS C C 174.990 0.40 1 1305 325 305 LYS CA C 58.568 0.40 1 1306 325 305 LYS CB C 30.208 0.40 1 1307 326 306 THR H H 9.242 0.04 1 1308 326 306 THR C C 173.117 0.40 1 1309 326 306 THR CA C 60.929 0.40 1 1310 326 306 THR CB C 72.306 0.40 1 1311 326 306 THR N N 113.510 0.40 1 1312 327 307 ILE H H 7.723 0.04 1 1313 327 307 ILE C C 175.554 0.40 1 1314 327 307 ILE CA C 58.041 0.40 1 1315 327 307 ILE CB C 40.429 0.40 1 1316 327 307 ILE N N 118.350 0.40 1 1317 328 308 LYS H H 9.619 0.04 1 1318 328 308 LYS C C 174.204 0.40 1 1319 328 308 LYS CA C 54.691 0.40 1 1320 328 308 LYS CB C 34.117 0.40 1 1321 328 308 LYS N N 126.812 0.40 1 1322 329 309 LEU H H 8.245 0.04 1 1323 329 309 LEU C C 175.449 0.40 1 1324 329 309 LEU CA C 52.757 0.40 1 1325 329 309 LEU CB C 44.217 0.40 1 1326 329 309 LEU N N 120.440 0.40 1 1327 330 310 TRP H H 9.579 0.04 1 1328 330 310 TRP CA C 54.147 0.40 1 1329 330 310 TRP CB C 31.066 0.40 1 1330 330 310 TRP N N 125.121 0.40 1 1331 331 311 LYS H H 8.914 0.04 1 1332 331 311 LYS C C 174.976 0.40 1 1333 331 311 LYS CA C 55.018 0.40 1 1334 331 311 LYS CB C 37.168 0.40 1 1335 331 311 LYS N N 123.576 0.40 1 1336 332 312 SER H H 7.990 0.04 1 1337 332 312 SER C C 174.292 0.40 1 1338 332 312 SER CA C 54.446 0.40 1 1339 332 312 SER CB C 62.207 0.40 1 1340 332 312 SER N N 121.598 0.40 1 1341 333 313 ASP H H 9.102 0.04 1 1342 333 313 ASP C C 175.502 0.40 1 1343 333 313 ASP CA C 55.605 0.40 1 1344 333 313 ASP CB C 40.885 0.40 1 1345 333 313 ASP N N 127.024 0.40 1 1346 334 314 CYS H H 7.857 0.04 1 1347 334 314 CYS C C 177.641 0.40 1 1348 334 314 CYS CA C 58.695 0.40 1 1349 334 314 CYS CB C 29.979 0.40 1 1350 334 314 CYS N N 120.395 0.40 1 stop_ save_