data_6542 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Main Chain 1H, 13C, and 15N chemical shift assignments for arginine kinase ; _BMRB_accession_number 6542 _BMRB_flat_file_name bmr6542.str _Entry_type original _Submission_date 2005-03-09 _Accession_date 2005-03-09 _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 Davulcu Omar . . 2 Clark Shawn A. . 3 Chapman Michael S. . 4 Skalicky Jack J. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 328 "13C chemical shifts" 662 "15N chemical shifts" 328 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2005-07-26 original author . stop_ _Original_release_date 2005-07-26 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Main chain 1H, 13C, and 15N resonance assignments of the 42-kDa enzyme arginine kinase ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Davulcu Omar . . 2 Clark Shawn A. . 3 Chapman Michael S. . 4 Skalicky Jack J. . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_volume 32 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 178 _Page_last 178 _Year 2005 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Arginine kinase' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Arginine_kinsae_polypeptide $Arginine_kinsae_polypeptide stop_ _System_molecular_weight 42000 _System_physical_state native _System_oligomer_state protein _System_paramagnetic no _System_thiol_state 'all free' loop_ _Biological_function 'Energy buffering' 'Phosphoryl transfer between MgATP and arginine' stop_ _Database_query_date . _Details 'Arginine kinase from Limulus polyphemus' save_ ######################## # Monomeric polymers # ######################## save_Arginine_kinsae_polypeptide _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'Arginine kinase' _Molecular_mass 42000 _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 357 _Mol_residue_sequence ; MVDQATLDKLEAGFKKLQEA SDCKSLLKKHLTKDVFDSIK NKKTGMGATLLDVIQSGVEN LDSGVGIYAPDAESYRTFGP LFDPIIDDYHGGFKLTDKHP PKEWGDINTLVDLDPGGQFI ISTRVRCGRSLQGYPFNPCL TAEQYKEMEEKVSSTLSSME DELKGTYYPLTGMSKATQQQ LIDDHFLFKEGDRFLQTANA CRYWPTGRGIFHNDAKTFLV WVNEEDHLRIISMQKGGDLK TVYKRLVTAVDNIESKLPFS HDDRFGFLTFCPTNLGTTMR ASVHIQLPKLAKDRKVLEDI ASKFNLQVRGTRGEHTESEG GVYDISNKRRLGLTEYQAVR EMQDGILEMIKMEKAAA ; loop_ _Residue_seq_code _Residue_label 1 MET 2 VAL 3 ASP 4 GLN 5 ALA 6 THR 7 LEU 8 ASP 9 LYS 10 LEU 11 GLU 12 ALA 13 GLY 14 PHE 15 LYS 16 LYS 17 LEU 18 GLN 19 GLU 20 ALA 21 SER 22 ASP 23 CYS 24 LYS 25 SER 26 LEU 27 LEU 28 LYS 29 LYS 30 HIS 31 LEU 32 THR 33 LYS 34 ASP 35 VAL 36 PHE 37 ASP 38 SER 39 ILE 40 LYS 41 ASN 42 LYS 43 LYS 44 THR 45 GLY 46 MET 47 GLY 48 ALA 49 THR 50 LEU 51 LEU 52 ASP 53 VAL 54 ILE 55 GLN 56 SER 57 GLY 58 VAL 59 GLU 60 ASN 61 LEU 62 ASP 63 SER 64 GLY 65 VAL 66 GLY 67 ILE 68 TYR 69 ALA 70 PRO 71 ASP 72 ALA 73 GLU 74 SER 75 TYR 76 ARG 77 THR 78 PHE 79 GLY 80 PRO 81 LEU 82 PHE 83 ASP 84 PRO 85 ILE 86 ILE 87 ASP 88 ASP 89 TYR 90 HIS 91 GLY 92 GLY 93 PHE 94 LYS 95 LEU 96 THR 97 ASP 98 LYS 99 HIS 100 PRO 101 PRO 102 LYS 103 GLU 104 TRP 105 GLY 106 ASP 107 ILE 108 ASN 109 THR 110 LEU 111 VAL 112 ASP 113 LEU 114 ASP 115 PRO 116 GLY 117 GLY 118 GLN 119 PHE 120 ILE 121 ILE 122 SER 123 THR 124 ARG 125 VAL 126 ARG 127 CYS 128 GLY 129 ARG 130 SER 131 LEU 132 GLN 133 GLY 134 TYR 135 PRO 136 PHE 137 ASN 138 PRO 139 CYS 140 LEU 141 THR 142 ALA 143 GLU 144 GLN 145 TYR 146 LYS 147 GLU 148 MET 149 GLU 150 GLU 151 LYS 152 VAL 153 SER 154 SER 155 THR 156 LEU 157 SER 158 SER 159 MET 160 GLU 161 ASP 162 GLU 163 LEU 164 LYS 165 GLY 166 THR 167 TYR 168 TYR 169 PRO 170 LEU 171 THR 172 GLY 173 MET 174 SER 175 LYS 176 ALA 177 THR 178 GLN 179 GLN 180 GLN 181 LEU 182 ILE 183 ASP 184 ASP 185 HIS 186 PHE 187 LEU 188 PHE 189 LYS 190 GLU 191 GLY 192 ASP 193 ARG 194 PHE 195 LEU 196 GLN 197 THR 198 ALA 199 ASN 200 ALA 201 CYS 202 ARG 203 TYR 204 TRP 205 PRO 206 THR 207 GLY 208 ARG 209 GLY 210 ILE 211 PHE 212 HIS 213 ASN 214 ASP 215 ALA 216 LYS 217 THR 218 PHE 219 LEU 220 VAL 221 TRP 222 VAL 223 ASN 224 GLU 225 GLU 226 ASP 227 HIS 228 LEU 229 ARG 230 ILE 231 ILE 232 SER 233 MET 234 GLN 235 LYS 236 GLY 237 GLY 238 ASP 239 LEU 240 LYS 241 THR 242 VAL 243 TYR 244 LYS 245 ARG 246 LEU 247 VAL 248 THR 249 ALA 250 VAL 251 ASP 252 ASN 253 ILE 254 GLU 255 SER 256 LYS 257 LEU 258 PRO 259 PHE 260 SER 261 HIS 262 ASP 263 ASP 264 ARG 265 PHE 266 GLY 267 PHE 268 LEU 269 THR 270 PHE 271 CYS 272 PRO 273 THR 274 ASN 275 LEU 276 GLY 277 THR 278 THR 279 MET 280 ARG 281 ALA 282 SER 283 VAL 284 HIS 285 ILE 286 GLN 287 LEU 288 PRO 289 LYS 290 LEU 291 ALA 292 LYS 293 ASP 294 ARG 295 LYS 296 VAL 297 LEU 298 GLU 299 ASP 300 ILE 301 ALA 302 SER 303 LYS 304 PHE 305 ASN 306 LEU 307 GLN 308 VAL 309 ARG 310 GLY 311 THR 312 ARG 313 GLY 314 GLU 315 HIS 316 THR 317 GLU 318 SER 319 GLU 320 GLY 321 GLY 322 VAL 323 TYR 324 ASP 325 ILE 326 SER 327 ASN 328 LYS 329 ARG 330 ARG 331 LEU 332 GLY 333 LEU 334 THR 335 GLU 336 TYR 337 GLN 338 ALA 339 VAL 340 ARG 341 GLU 342 MET 343 GLN 344 ASP 345 GLY 346 ILE 347 LEU 348 GLU 349 MET 350 ILE 351 LYS 352 MET 353 GLU 354 LYS 355 ALA 356 ALA 357 ALA stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2014-10-26 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 19208 Arginine_kinase 100.00 357 100.00 100.00 0.00e+00 PDB 1BG0 "Transition State Structure Of Arginine Kinase" 99.72 356 99.16 99.44 0.00e+00 PDB 1M15 "Transition State Structure Of Arginine Kinase" 100.00 357 99.16 99.44 0.00e+00 PDB 1P50 "Transition State Structure Of An Arginine Kinase Mutant" 99.72 356 98.88 99.44 0.00e+00 PDB 1P52 "Structure Of Arginine Kinase E314d Mutant" 100.00 357 99.16 99.72 0.00e+00 PDB 1RL9 "Crystal Structure Of Creatine-adp Arginine Kinase Ternary Complex" 100.00 357 99.72 99.72 0.00e+00 PDB 1SD0 "Structure Of Arginine Kinase C271a Mutant" 100.00 357 98.60 99.16 0.00e+00 PDB 3M10 "Substrate-Free Form Of Arginine Kinase" 100.00 357 99.16 99.44 0.00e+00 PDB 4GVY "Crystal Structure Of Arginine Kinase In Complex With L-Citrulline And Mgadp" 100.00 357 99.16 99.44 0.00e+00 PDB 4GVZ "Crystal Structure Of Arginine Kinase In Complex With D-Arginine, Mgadp, And Nitrate." 100.00 357 99.16 99.44 0.00e+00 PDB 4GW0 "Crystal Structure Of Arginine Kinase In Complex With Imino-L- Ornithine, Mgadp, And Nitrate." 100.00 357 99.16 99.44 0.00e+00 PDB 4GW2 "Crystal Structure Of Arginine Kinase In Complex With L-Ornithine, Mgadp, And Nitrate" 100.00 357 99.16 99.44 0.00e+00 GB AAA82169 "arginine kinase [Limulus polyphemus]" 100.00 357 100.00 100.00 0.00e+00 PRF 2104180A "Arg kinase" 100.00 357 100.00 100.00 0.00e+00 SP P51541 "RecName: Full=Arginine kinase; Short=AK [Limulus polyphemus]" 100.00 357 100.00 100.00 0.00e+00 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Arginine_kinsae_polypeptide 'Horseshoe crab' 6850 Eukaryota Metazoa Limulus polyphemus 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 $Arginine_kinsae_polypeptide 'recombinant technology' 'Escherichia coli' . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details 'Long term NMR solution conditions for 25 deg C, pH=6.5' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Arginine_kinsae_polypeptide 1.4 mM '[U-100% 13C; U-100% 15N; U-80% 2H]' 'Citric Acid' 10 mM '[U-98% 2,2,4,4 2H]' DTT 0.5 mM . 'Potassium Chloride' 50 mM . 'Sodium Azide' 50 uM . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_720MHz_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model InovaUNITY _Field_strength '720 MHz' _Details '720 MHz spectrometer at NHMFL in Tallahassee, FL' save_ ############################# # NMR applied experiments # ############################# save_1H15N_TROSY_1 _Saveframe_category NMR_applied_experiment _Experiment_name 1H15N_TROSY _Sample_label $sample_1 save_ save_1H15N_TROSY _Saveframe_category NMR_applied_experiment _Experiment_name 1H15N_TROSY _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 pH 6.5 0.2 pH temperature 298 0.5 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio _Indirect_shift_ratio_citation_label _Correction_value_citation_label DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 $entry_citation $entry_citation DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 $entry_citation $entry_citation DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 $entry_citation $entry_citation 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 . loop_ _Experiment_label 1H15N_TROSY stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $conditions_1 _Chem_shift_reference_set_label $chemical_shift_referencing _Mol_system_component_name Arginine_kinsae_polypeptide _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 VAL CA C 61.190 0.200 1 2 2 2 VAL CB C 33.000 0.200 1 3 3 3 ASP H H 8.150 0.010 1 4 3 3 ASP CA C 53.550 0.200 1 5 3 3 ASP CB C 41.180 0.200 1 6 3 3 ASP N N 123.000 0.050 1 7 4 4 GLN H H 8.640 0.010 1 8 4 4 GLN CA C 58.090 0.200 1 9 4 4 GLN CB C 27.950 0.200 1 10 4 4 GLN N N 121.200 0.050 1 11 5 5 ALA H H 8.360 0.010 1 12 5 5 ALA CA C 54.910 0.200 1 13 5 5 ALA CB C 16.980 0.200 1 14 5 5 ALA N N 120.600 0.050 1 15 6 6 THR H H 7.840 0.010 1 16 6 6 THR CA C 66.440 0.200 1 17 6 6 THR CB C 50.540 0.200 1 18 6 6 THR N N 117.600 0.050 1 19 7 7 LEU H H 8.090 0.010 1 20 7 7 LEU CA C 58.220 0.200 1 21 7 7 LEU CB C 40.140 0.200 1 22 7 7 LEU N N 123.600 0.050 1 23 8 8 ASP H H 8.980 0.010 1 24 8 8 ASP CA C 57.290 0.200 1 25 8 8 ASP CB C 39.210 0.200 1 26 8 8 ASP N N 120.000 0.050 1 27 9 9 LYS H H 7.710 0.010 1 28 9 9 LYS CA C 59.210 0.200 1 29 9 9 LYS CB C 32.330 0.200 1 30 9 9 LYS N N 122.000 0.050 1 31 10 10 LEU H H 8.710 0.010 1 32 10 10 LEU CA C 57.860 0.200 1 33 10 10 LEU CB C 41.510 0.200 1 34 10 10 LEU N N 123.700 0.050 1 35 11 11 GLU H H 9.010 0.010 1 36 11 11 GLU CA C 59.040 0.200 1 37 11 11 GLU CB C 28.000 0.200 1 38 11 11 GLU N N 119.600 0.050 1 39 12 12 ALA H H 7.980 0.010 1 40 12 12 ALA CA C 54.530 0.200 1 41 12 12 ALA CB C 17.160 0.200 1 42 12 12 ALA N N 122.000 0.050 1 43 13 13 GLY H H 8.370 0.010 1 44 13 13 GLY CA C 47.200 0.200 1 45 13 13 GLY N N 109.900 0.050 1 46 14 14 PHE H H 8.600 0.010 1 47 14 14 PHE CA C 61.660 0.200 1 48 14 14 PHE CB C 38.340 0.200 1 49 14 14 PHE N N 122.500 0.050 1 50 15 15 LYS H H 7.620 0.010 1 51 15 15 LYS CA C 59.190 0.200 1 52 15 15 LYS CB C 31.730 0.200 1 53 15 15 LYS N N 118.900 0.050 1 54 16 16 LYS H H 7.740 0.010 1 55 16 16 LYS CA C 58.960 0.200 1 56 16 16 LYS CB C 31.830 0.200 1 57 16 16 LYS N N 119.600 0.050 1 58 17 17 LEU H H 7.750 0.010 1 59 17 17 LEU CA C 57.350 0.200 1 60 17 17 LEU CB C 41.520 0.200 1 61 17 17 LEU N N 117.900 0.050 1 62 18 18 GLN H H 7.810 0.010 1 63 18 18 GLN CA C 57.680 0.200 1 64 18 18 GLN CB C 27.530 0.200 1 65 18 18 GLN N N 117.000 0.050 1 66 19 19 GLU H H 7.680 0.010 1 67 19 19 GLU CA C 56.310 0.200 1 68 19 19 GLU CB C 29.000 0.200 1 69 19 19 GLU N N 116.300 0.050 1 70 20 20 ALA H H 7.070 0.010 1 71 20 20 ALA CA C 50.900 0.200 1 72 20 20 ALA CB C 17.570 0.200 1 73 20 20 ALA N N 124.200 0.050 1 74 21 21 SER H H 8.110 0.010 1 75 21 21 SER CA C 57.790 0.200 1 76 21 21 SER CB C 64.350 0.200 1 77 21 21 SER N N 120.900 0.050 1 78 22 22 ASP H H 8.640 0.010 1 79 22 22 ASP CA C 53.890 0.200 1 80 22 22 ASP CB C 38.980 0.200 1 81 22 22 ASP N N 118.600 0.050 1 82 23 23 CYS H H 7.640 0.010 1 83 23 23 CYS CA C 56.980 0.200 1 84 23 23 CYS CB C 27.300 0.200 1 85 23 23 CYS N N 121.300 0.050 1 86 24 24 LYS H H 8.920 0.010 1 87 24 24 LYS CA C 54.610 0.200 1 88 24 24 LYS CB C 31.650 0.200 1 89 24 24 LYS N N 130.300 0.050 1 90 25 25 SER H H 7.800 0.010 1 91 25 25 SER CA C 57.150 0.200 1 92 25 25 SER CB C 65.790 0.200 1 93 25 25 SER N N 118.900 0.050 1 94 26 26 LEU H H 8.160 0.010 1 95 26 26 LEU CA C 57.310 0.200 1 96 26 26 LEU CB C 40.660 0.200 1 97 26 26 LEU N N 120.600 0.050 1 98 27 27 LEU H H 7.870 0.010 1 99 27 27 LEU CA C 58.190 0.200 1 100 27 27 LEU CB C 40.220 0.200 1 101 27 27 LEU N N 118.800 0.050 1 102 28 28 LYS H H 7.460 0.010 1 103 28 28 LYS CA C 58.190 0.200 1 104 28 28 LYS CB C 31.650 0.200 1 105 28 28 LYS N N 117.900 0.050 1 106 29 29 LYS H H 7.450 0.010 1 107 29 29 LYS CA C 58.650 0.200 1 108 29 29 LYS CB C 33.070 0.200 1 109 29 29 LYS N N 117.100 0.050 1 110 30 30 HIS H H 7.640 0.010 1 111 30 30 HIS CA C 56.910 0.200 1 112 30 30 HIS CB C 31.930 0.200 1 113 30 30 HIS N N 111.900 0.050 1 114 31 31 LEU H H 8.240 0.010 1 115 31 31 LEU CA C 52.770 0.200 1 116 31 31 LEU CB C 38.170 0.200 1 117 31 31 LEU N N 124.400 0.050 1 118 32 32 THR H H 7.280 0.010 1 119 32 32 THR CA C 60.190 0.200 1 120 32 32 THR CB C 70.040 0.200 1 121 32 32 THR N N 114.700 0.050 1 122 33 33 LYS H H 9.230 0.010 1 123 33 33 LYS CA C 59.580 0.200 1 124 33 33 LYS CB C 31.330 0.200 1 125 33 33 LYS N N 122.700 0.050 1 126 34 34 ASP H H 8.330 0.010 1 127 34 34 ASP CA C 56.810 0.200 1 128 34 34 ASP CB C 39.750 0.200 1 129 34 34 ASP N N 115.600 0.050 1 130 35 35 VAL H H 7.430 0.010 1 131 35 35 VAL CA C 66.480 0.200 1 132 35 35 VAL CB C 31.400 0.200 1 133 35 35 VAL N N 122.000 0.050 1 134 36 36 PHE H H 9.010 0.010 1 135 36 36 PHE CA C 61.220 0.200 1 136 36 36 PHE CB C 38.800 0.200 1 137 36 36 PHE N N 120.600 0.050 1 138 37 37 ASP H H 8.850 0.010 1 139 37 37 ASP CA C 56.910 0.200 1 140 37 37 ASP CB C 38.880 0.200 1 141 37 37 ASP N N 117.900 0.050 1 142 38 38 SER H H 7.570 0.010 1 143 38 38 SER CA C 60.620 0.200 1 144 38 38 SER CB C 63.660 0.200 1 145 38 38 SER N N 114.100 0.050 1 146 39 39 ILE H H 7.360 0.010 1 147 39 39 ILE CA C 61.320 0.200 1 148 39 39 ILE CB C 38.770 0.200 1 149 39 39 ILE N N 111.100 0.050 1 150 40 40 LYS H H 7.920 0.010 1 151 40 40 LYS CA C 58.910 0.200 1 152 40 40 LYS CB C 29.800 0.200 1 153 40 40 LYS N N 120.100 0.050 1 154 41 41 ASN H H 8.170 0.010 1 155 41 41 ASN CA C 52.870 0.200 1 156 41 41 ASN CB C 38.970 0.200 1 157 41 41 ASN N N 115.100 0.050 1 158 42 42 LYS H H 7.620 0.010 1 159 42 42 LYS CA C 56.380 0.200 1 160 42 42 LYS CB C 33.330 0.200 1 161 42 42 LYS N N 120.500 0.050 1 162 43 43 LYS H H 7.880 0.010 1 163 43 43 LYS CA C 54.110 0.200 1 164 43 43 LYS CB C 35.790 0.200 1 165 43 43 LYS N N 116.800 0.050 1 166 44 44 THR H H 9.040 0.010 1 167 44 44 THR CA C 60.310 0.200 1 168 44 44 THR CB C 70.410 0.200 1 169 44 44 THR N N 114.700 0.050 1 170 45 45 GLY H H 9.780 0.010 1 171 45 45 GLY CA C 46.520 0.200 1 172 45 45 GLY N N 111.900 0.050 1 173 46 46 MET H H 7.760 0.010 1 174 46 46 MET CA C 56.240 0.200 1 175 46 46 MET CB C 30.960 0.200 1 176 46 46 MET N N 117.700 0.050 1 177 47 47 GLY H H 7.910 0.010 1 178 47 47 GLY CA C 44.720 0.200 1 179 47 47 GLY N N 108.400 0.050 1 180 48 48 ALA H H 7.870 0.010 1 181 48 48 ALA CA C 51.910 0.200 1 182 48 48 ALA CB C 19.360 0.200 1 183 48 48 ALA N N 124.600 0.050 1 184 49 49 THR H H 9.510 0.010 1 185 49 49 THR CA C 59.790 0.200 1 186 49 49 THR CB C 72.060 0.200 1 187 49 49 THR N N 111.900 0.050 1 188 50 50 LEU H H 10.410 0.010 1 189 50 50 LEU CA C 55.580 0.200 1 190 50 50 LEU CB C 39.380 0.200 1 191 50 50 LEU N N 120.000 0.050 1 192 51 51 LEU H H 7.970 0.010 1 193 51 51 LEU CA C 57.130 0.200 1 194 51 51 LEU CB C 40.950 0.200 1 195 51 51 LEU N N 121.800 0.050 1 196 52 52 ASP H H 6.940 0.010 1 197 52 52 ASP CA C 56.400 0.200 1 198 52 52 ASP CB C 41.010 0.200 1 199 52 52 ASP N N 115.200 0.050 1 200 53 53 VAL H H 6.920 0.010 1 201 53 53 VAL CA C 62.520 0.200 1 202 53 53 VAL CB C 32.230 0.200 1 203 53 53 VAL N N 117.200 0.050 1 204 54 54 ILE H H 7.660 0.010 1 205 54 54 ILE CA C 62.030 0.200 1 206 54 54 ILE CB C 39.220 0.200 1 207 54 54 ILE N N 109.800 0.050 1 208 55 55 GLN H H 7.990 0.010 1 209 55 55 GLN CA C 59.480 0.200 1 210 55 55 GLN CB C 25.290 0.200 1 211 55 55 GLN N N 120.600 0.050 1 212 56 56 SER H H 9.270 0.010 1 213 56 56 SER CA C 60.610 0.200 1 214 56 56 SER CB C 62.850 0.200 1 215 56 56 SER N N 114.300 0.050 1 216 57 57 GLY H H 7.360 0.010 1 217 57 57 GLY CA C 46.140 0.200 1 218 57 57 GLY N N 109.100 0.050 1 219 58 58 VAL H H 7.420 0.010 1 220 58 58 VAL CA C 64.450 0.200 1 221 58 58 VAL CB C 31.350 0.200 1 222 58 58 VAL N N 119.100 0.050 1 223 59 59 GLU H H 7.680 0.010 1 224 59 59 GLU CA C 57.020 0.200 1 225 59 59 GLU CB C 29.320 0.200 1 226 59 59 GLU N N 115.500 0.050 1 227 60 60 ASN H H 7.810 0.010 1 228 60 60 ASN CA C 50.730 0.200 1 229 60 60 ASN CB C 38.550 0.200 1 230 60 60 ASN N N 115.700 0.050 1 231 61 61 LEU CA C 57.050 0.200 1 232 61 61 LEU CB C 40.460 0.200 1 233 62 62 ASP H H 9.210 0.010 1 234 62 62 ASP CA C 53.120 0.200 1 235 62 62 ASP CB C 37.730 0.200 1 236 62 62 ASP N N 115.700 0.050 1 237 63 63 SER H H 7.440 0.010 1 238 63 63 SER CA C 58.870 0.200 1 239 63 63 SER CB C 64.310 0.200 1 240 63 63 SER N N 115.800 0.050 1 241 64 64 GLY H H 8.260 0.010 1 242 64 64 GLY CA C 46.050 0.200 1 243 64 64 GLY N N 111.900 0.050 1 244 65 65 VAL H H 8.330 0.010 1 245 65 65 VAL CA C 64.790 0.200 1 246 65 65 VAL CB C 29.730 0.200 1 247 65 65 VAL N N 124.200 0.050 1 248 66 66 GLY H H 8.190 0.010 1 249 66 66 GLY CA C 44.380 0.200 1 250 66 66 GLY N N 103.500 0.050 1 251 67 67 ILE H H 5.980 0.010 1 252 67 67 ILE CA C 57.130 0.200 1 253 67 67 ILE CB C 40.450 0.200 1 254 67 67 ILE N N 104.600 0.050 1 255 68 68 TYR H H 7.990 0.010 1 256 68 68 TYR CA C 56.450 0.200 1 257 68 68 TYR CB C 42.930 0.200 1 258 68 68 TYR N N 118.000 0.050 1 259 69 69 ALA H H 9.510 0.010 1 260 69 69 ALA CA C 48.750 0.200 1 261 69 69 ALA CB C 20.080 0.200 1 262 69 69 ALA N N 121.700 0.050 1 263 70 70 PRO CA C 62.680 0.200 1 264 70 70 PRO CB C 32.440 0.200 1 265 71 71 ASP H H 7.340 0.010 1 266 71 71 ASP CA C 51.870 0.200 1 267 71 71 ASP CB C 39.920 0.200 1 268 71 71 ASP N N 113.600 0.050 1 269 72 72 ALA H H 8.070 0.010 1 270 72 72 ALA CA C 54.780 0.200 1 271 72 72 ALA CB C 18.150 0.200 1 272 72 72 ALA N N 120.000 0.050 1 273 73 73 GLU H H 7.900 0.010 1 274 73 73 GLU CA C 57.770 0.200 1 275 73 73 GLU CB C 29.220 0.200 1 276 73 73 GLU N N 119.200 0.050 1 277 74 74 SER H H 8.650 0.010 1 278 74 74 SER CA C 63.480 0.200 1 279 74 74 SER CB C 62.580 0.200 1 280 74 74 SER N N 117.400 0.050 1 281 75 75 TYR H H 6.610 0.010 1 282 75 75 TYR CA C 62.580 0.200 1 283 75 75 TYR CB C 38.300 0.200 1 284 75 75 TYR N N 117.700 0.050 1 285 76 76 ARG H H 7.720 0.010 1 286 76 76 ARG CA C 58.200 0.200 1 287 76 76 ARG CB C 30.010 0.200 1 288 76 76 ARG N N 114.800 0.050 1 289 77 77 THR H H 8.660 0.010 1 290 77 77 THR CA C 63.280 0.200 1 291 77 77 THR CB C 66.720 0.200 1 292 77 77 THR N N 121.100 0.050 1 293 78 78 PHE H H 7.790 0.010 1 294 78 78 PHE CA C 58.490 0.200 1 295 78 78 PHE CB C 36.790 0.200 1 296 78 78 PHE N N 113.400 0.050 1 297 79 79 GLY H H 7.730 0.010 1 298 79 79 GLY CA C 48.990 0.200 1 299 79 79 GLY N N 113.800 0.050 1 300 80 80 PRO CA C 65.110 0.200 1 301 80 80 PRO CB C 31.560 0.200 1 302 81 81 LEU H H 7.630 0.010 1 303 81 81 LEU CA C 54.660 0.200 1 304 81 81 LEU CB C 44.050 0.200 1 305 81 81 LEU N N 112.500 0.050 1 306 82 82 PHE H H 7.910 0.010 1 307 82 82 PHE CA C 63.350 0.200 1 308 82 82 PHE CB C 39.090 0.200 1 309 82 82 PHE N N 115.600 0.050 1 310 83 83 ASP H H 10.070 0.010 1 311 83 83 ASP CA C 59.960 0.200 1 312 83 83 ASP CB C 36.690 0.200 1 313 83 83 ASP N N 118.400 0.050 1 314 84 84 PRO CA C 64.970 0.200 1 315 84 84 PRO CB C 29.490 0.200 1 316 85 85 ILE H H 6.600 0.010 1 317 85 85 ILE CA C 66.180 0.200 1 318 85 85 ILE CB C 36.340 0.200 1 319 85 85 ILE N N 120.400 0.050 1 320 86 86 ILE H H 8.870 0.010 1 321 86 86 ILE CA C 66.080 0.200 1 322 86 86 ILE CB C 46.970 0.200 1 323 86 86 ILE N N 122.900 0.050 1 324 87 87 ASP H H 7.970 0.010 1 325 87 87 ASP CA C 57.110 0.200 1 326 87 87 ASP CB C 41.790 0.200 1 327 87 87 ASP N N 118.500 0.050 1 328 88 88 ASP H H 7.500 0.010 1 329 88 88 ASP CA C 55.870 0.200 1 330 88 88 ASP CB C 41.810 0.200 1 331 88 88 ASP N N 117.200 0.050 1 332 89 89 TYR H H 8.990 0.010 1 333 89 89 TYR CA C 62.370 0.200 1 334 89 89 TYR CB C 37.830 0.200 1 335 89 89 TYR N N 118.400 0.050 1 336 90 90 HIS H H 8.300 0.010 1 337 90 90 HIS CA C 57.280 0.200 1 338 90 90 HIS CB C 29.500 0.200 1 339 90 90 HIS N N 112.800 0.050 1 340 91 91 GLY H H 7.530 0.010 1 341 91 91 GLY CA C 46.660 0.200 1 342 91 91 GLY N N 109.100 0.050 1 343 92 92 GLY H H 8.480 0.010 1 344 92 92 GLY CA C 45.060 0.200 1 345 92 92 GLY N N 111.000 0.050 1 346 93 93 PHE H H 9.990 0.010 1 347 93 93 PHE CA C 59.870 0.200 1 348 93 93 PHE CB C 38.700 0.200 1 349 93 93 PHE N N 133.800 0.050 1 350 94 94 LYS H H 9.300 0.010 1 351 94 94 LYS CA C 54.790 0.200 1 352 94 94 LYS CB C 32.730 0.200 1 353 94 94 LYS N N 126.700 0.050 1 354 95 95 LEU H H 8.570 0.010 1 355 95 95 LEU CA C 57.800 0.200 1 356 95 95 LEU CB C 40.640 0.200 1 357 95 95 LEU N N 122.100 0.050 1 358 96 96 THR H H 6.870 0.010 1 359 96 96 THR CA C 60.500 0.200 1 360 96 96 THR CB C 68.290 0.200 1 361 96 96 THR N N 101.800 0.050 1 362 97 97 ASP H H 7.000 0.010 1 363 97 97 ASP CA C 54.360 0.200 1 364 97 97 ASP CB C 40.340 0.200 1 365 97 97 ASP N N 123.400 0.050 1 366 98 98 LYS H H 7.990 0.010 1 367 98 98 LYS CA C 55.180 0.200 1 368 98 98 LYS CB C 34.540 0.200 1 369 98 98 LYS N N 116.000 0.050 1 370 99 99 HIS H H 9.120 0.010 1 371 99 99 HIS CA C 54.630 0.200 1 372 99 99 HIS CB C 31.390 0.200 1 373 99 99 HIS N N 129.300 0.050 1 374 101 101 PRO CA C 62.400 0.200 1 375 101 101 PRO CB C 31.090 0.200 1 376 102 102 LYS H H 7.850 0.010 1 377 102 102 LYS CA C 56.570 0.200 1 378 102 102 LYS CB C 30.890 0.200 1 379 102 102 LYS N N 126.000 0.050 1 380 103 103 GLU H H 8.630 0.010 1 381 103 103 GLU CA C 55.300 0.200 1 382 103 103 GLU CB C 30.440 0.200 1 383 103 103 GLU N N 129.900 0.050 1 384 104 104 TRP H H 8.570 0.010 1 385 104 104 TRP CA C 57.240 0.200 1 386 104 104 TRP CB C 31.650 0.200 1 387 104 104 TRP N N 126.500 0.050 1 388 105 105 GLY H H 8.510 0.010 1 389 105 105 GLY CA C 43.410 0.200 1 390 105 105 GLY N N 102.700 0.050 1 391 106 106 ASP H H 7.210 0.010 1 392 106 106 ASP CA C 52.380 0.200 1 393 106 106 ASP CB C 39.210 0.200 1 394 106 106 ASP N N 115.200 0.050 1 395 107 107 ILE H H 8.660 0.010 1 396 107 107 ILE CA C 63.730 0.200 1 397 107 107 ILE CB C 37.210 0.200 1 398 107 107 ILE N N 130.800 0.050 1 399 108 108 ASN H H 8.170 0.010 1 400 108 108 ASN CA C 54.820 0.200 1 401 108 108 ASN CB C 37.420 0.200 1 402 108 108 ASN N N 114.700 0.050 1 403 109 109 THR H H 7.690 0.010 1 404 109 109 THR CA C 61.770 0.200 1 405 109 109 THR CB C 70.170 0.200 1 406 109 109 THR N N 108.100 0.050 1 407 110 110 LEU H H 7.530 0.010 1 408 110 110 LEU CA C 53.230 0.200 1 409 110 110 LEU CB C 40.660 0.200 1 410 110 110 LEU N N 124.000 0.050 1 411 111 111 VAL H H 7.690 0.010 1 412 111 111 VAL CA C 58.640 0.200 1 413 111 111 VAL CB C 34.860 0.200 1 414 111 111 VAL N N 110.500 0.050 1 415 112 112 ASP H H 7.600 0.010 1 416 112 112 ASP CA C 53.640 0.200 1 417 112 112 ASP CB C 39.570 0.200 1 418 112 112 ASP N N 117.200 0.050 1 419 113 113 LEU H H 8.350 0.010 1 420 113 113 LEU CA C 55.520 0.200 1 421 113 113 LEU CB C 42.290 0.200 1 422 113 113 LEU N N 125.600 0.050 1 423 114 114 ASP H H 7.900 0.010 1 424 114 114 ASP CA C 51.980 0.200 1 425 114 114 ASP CB C 42.610 0.200 1 426 114 114 ASP N N 110.000 0.050 1 427 115 115 PRO CA C 64.550 0.200 1 428 115 115 PRO CB C 30.690 0.200 1 429 116 116 GLY H H 8.530 0.010 1 430 116 116 GLY CA C 45.080 0.200 1 431 116 116 GLY N N 107.000 0.050 1 432 117 117 GLY H H 7.840 0.010 1 433 117 117 GLY CA C 46.600 0.200 1 434 117 117 GLY N N 109.200 0.050 1 435 118 118 GLN H H 8.630 0.010 1 436 118 118 GLN CA C 56.850 0.200 1 437 118 118 GLN CB C 29.160 0.200 1 438 118 118 GLN N N 119.500 0.050 1 439 119 119 PHE H H 10.070 0.010 1 440 119 119 PHE CA C 59.430 0.200 1 441 119 119 PHE CB C 41.210 0.200 1 442 119 119 PHE N N 118.500 0.050 1 443 120 120 ILE H H 9.320 0.010 1 444 120 120 ILE CA C 62.970 0.200 1 445 120 120 ILE CB C 37.640 0.200 1 446 120 120 ILE N N 120.800 0.050 1 447 121 121 ILE H H 9.200 0.010 1 448 121 121 ILE CA C 63.010 0.200 1 449 121 121 ILE CB C 38.620 0.200 1 450 121 121 ILE N N 131.200 0.050 1 451 122 122 SER H H 7.710 0.010 1 452 122 122 SER CA C 58.260 0.200 1 453 122 122 SER CB C 64.340 0.200 1 454 122 122 SER N N 114.700 0.050 1 455 123 123 THR H H 8.420 0.010 1 456 123 123 THR CA C 63.100 0.200 1 457 123 123 THR CB C 71.120 0.200 1 458 123 123 THR N N 117.900 0.050 1 459 124 124 ARG H H 9.040 0.010 1 460 124 124 ARG CA C 54.380 0.200 1 461 124 124 ARG CB C 33.760 0.200 1 462 124 124 ARG N N 124.500 0.050 1 463 125 125 VAL H H 9.230 0.010 1 464 125 125 VAL CA C 61.750 0.200 1 465 125 125 VAL CB C 34.040 0.200 1 466 125 125 VAL N N 121.600 0.050 1 467 126 126 ARG H H 8.420 0.010 1 468 126 126 ARG CA C 52.490 0.200 1 469 126 126 ARG CB C 34.150 0.200 1 470 126 126 ARG N N 125.700 0.050 1 471 127 127 CYS H H 9.310 0.010 1 472 127 127 CYS CA C 56.800 0.200 1 473 127 127 CYS CB C 31.160 0.200 1 474 127 127 CYS N N 119.400 0.050 1 475 128 128 GLY H H 9.050 0.010 1 476 128 128 GLY CA C 43.800 0.200 1 477 128 128 GLY N N 108.900 0.050 1 478 129 129 ARG H H 8.670 0.010 1 479 129 129 ARG CA C 52.810 0.200 1 480 129 129 ARG CB C 37.040 0.200 1 481 129 129 ARG N N 118.200 0.050 1 482 130 130 SER H H 9.150 0.010 1 483 130 130 SER CA C 55.890 0.200 1 484 130 130 SER CB C 63.640 0.200 1 485 130 130 SER N N 116.200 0.050 1 486 131 131 LEU H H 13.220 0.010 1 487 131 131 LEU CA C 54.470 0.200 1 488 131 131 LEU CB C 40.540 0.200 1 489 131 131 LEU N N 131.900 0.050 1 490 132 132 GLN H H 8.540 0.010 1 491 132 132 GLN CA C 57.020 0.200 1 492 132 132 GLN CB C 28.270 0.200 1 493 132 132 GLN N N 124.600 0.050 1 494 133 133 GLY H H 8.870 0.010 1 495 133 133 GLY CA C 44.360 0.200 1 496 133 133 GLY N N 111.000 0.050 1 497 134 134 TYR H H 7.360 0.010 1 498 134 134 TYR CA C 55.510 0.200 1 499 134 134 TYR CB C 41.070 0.200 1 500 134 134 TYR N N 117.300 0.050 1 501 135 135 PRO CA C 62.020 0.200 1 502 135 135 PRO CB C 31.340 0.200 1 503 136 136 PHE H H 8.320 0.010 1 504 136 136 PHE CA C 52.760 0.200 1 505 136 136 PHE CB C 36.310 0.200 1 506 136 136 PHE N N 116.400 0.050 1 507 137 137 ASN H H 8.600 0.010 1 508 137 137 ASN CA C 58.220 0.200 1 509 137 137 ASN CB C 37.750 0.200 1 510 137 137 ASN N N 115.900 0.050 1 511 138 138 PRO CA C 65.290 0.200 1 512 138 138 PRO CB C 32.040 0.200 1 513 139 139 CYS H H 7.920 0.010 1 514 139 139 CYS CA C 57.980 0.200 1 515 139 139 CYS CB C 31.430 0.200 1 516 139 139 CYS N N 109.200 0.050 1 517 140 140 LEU H H 6.970 0.010 1 518 140 140 LEU CA C 55.740 0.200 1 519 140 140 LEU CB C 42.330 0.200 1 520 140 140 LEU N N 124.000 0.050 1 521 141 141 THR H H 8.510 0.010 1 522 141 141 THR CA C 59.340 0.200 1 523 141 141 THR CB C 70.760 0.200 1 524 141 141 THR N N 112.600 0.050 1 525 142 142 ALA H H 8.020 0.010 1 526 142 142 ALA CA C 55.730 0.200 1 527 142 142 ALA CB C 16.400 0.200 1 528 142 142 ALA N N 123.800 0.050 1 529 143 143 GLU H H 8.430 0.010 1 530 143 143 GLU CA C 59.650 0.200 1 531 143 143 GLU CB C 28.110 0.200 1 532 143 143 GLU N N 116.100 0.050 1 533 144 144 GLN H H 7.750 0.010 1 534 144 144 GLN CA C 58.760 0.200 1 535 144 144 GLN CB C 30.210 0.200 1 536 144 144 GLN N N 120.700 0.050 1 537 145 145 TYR H H 8.500 0.010 1 538 145 145 TYR CA C 63.720 0.200 1 539 145 145 TYR CB C 37.660 0.200 1 540 145 145 TYR N N 119.000 0.050 1 541 146 146 LYS H H 7.630 0.010 1 542 146 146 LYS CA C 59.010 0.200 1 543 146 146 LYS CB C 31.950 0.200 1 544 146 146 LYS N N 117.400 0.050 1 545 147 147 GLU H H 8.150 0.010 1 546 147 147 GLU CA C 59.040 0.200 1 547 147 147 GLU CB C 29.820 0.200 1 548 147 147 GLU N N 121.500 0.050 1 549 148 148 MET H H 8.740 0.010 1 550 148 148 MET CA C 59.050 0.200 1 551 148 148 MET CB C 33.650 0.200 1 552 148 148 MET N N 119.300 0.050 1 553 149 149 GLU H H 8.080 0.010 1 554 149 149 GLU CA C 59.670 0.200 1 555 149 149 GLU CB C 28.400 0.200 1 556 149 149 GLU N N 119.200 0.050 1 557 150 150 GLU H H 7.870 0.010 1 558 150 150 GLU CA C 59.460 0.200 1 559 150 150 GLU CB C 28.320 0.200 1 560 150 150 GLU N N 121.500 0.050 1 561 151 151 LYS H H 7.660 0.010 1 562 151 151 LYS CA C 59.020 0.200 1 563 151 151 LYS CB C 31.950 0.200 1 564 151 151 LYS N N 119.600 0.050 1 565 152 152 VAL H H 8.980 0.010 1 566 152 152 VAL CA C 66.300 0.200 1 567 152 152 VAL CB C 30.830 0.200 1 568 152 152 VAL N N 121.100 0.050 1 569 153 153 SER H H 8.890 0.010 1 570 153 153 SER CA C 62.210 0.200 1 571 153 153 SER CB C 61.190 0.200 1 572 153 153 SER N N 116.700 0.050 1 573 154 154 SER H H 7.600 0.010 1 574 154 154 SER CA C 61.190 0.200 1 575 154 154 SER CB C 62.650 0.200 1 576 154 154 SER N N 118.300 0.050 1 577 155 155 THR H H 7.430 0.010 1 578 155 155 THR CA C 66.940 0.200 1 579 155 155 THR CB C 67.850 0.200 1 580 155 155 THR N N 119.900 0.050 1 581 156 156 LEU H H 8.510 0.010 1 582 156 156 LEU CA C 56.910 0.200 1 583 156 156 LEU CB C 38.660 0.200 1 584 156 156 LEU N N 121.600 0.050 1 585 157 157 SER H H 8.240 0.010 1 586 157 157 SER CA C 61.200 0.200 1 587 157 157 SER CB C 62.340 0.200 1 588 157 157 SER N N 114.300 0.050 1 589 158 158 SER H H 7.200 0.010 1 590 158 158 SER CA C 58.250 0.200 1 591 158 158 SER CB C 64.140 0.200 1 592 158 158 SER N N 114.600 0.050 1 593 159 159 MET H H 7.130 0.010 1 594 159 159 MET CA C 56.820 0.200 1 595 159 159 MET CB C 32.330 0.200 1 596 159 159 MET N N 121.400 0.050 1 597 160 160 GLU H H 8.480 0.010 1 598 160 160 GLU CA C 54.600 0.200 1 599 160 160 GLU CB C 33.100 0.200 1 600 160 160 GLU N N 120.300 0.050 1 601 161 161 ASP H H 8.970 0.010 1 602 161 161 ASP CA C 55.470 0.200 1 603 161 161 ASP CB C 39.360 0.200 1 604 161 161 ASP N N 120.600 0.050 1 605 162 162 GLU H H 8.600 0.010 1 606 162 162 GLU CA C 58.390 0.200 1 607 162 162 GLU CB C 28.590 0.200 1 608 162 162 GLU N N 124.000 0.050 1 609 163 163 LEU H H 7.480 0.010 1 610 163 163 LEU CA C 54.030 0.200 1 611 163 163 LEU CB C 40.720 0.200 1 612 163 163 LEU N N 118.200 0.050 1 613 164 164 LYS H H 6.730 0.010 1 614 164 164 LYS CA C 56.360 0.200 1 615 164 164 LYS CB C 32.120 0.200 1 616 164 164 LYS N N 118.500 0.050 1 617 165 165 GLY H H 8.600 0.010 1 618 165 165 GLY CA C 46.290 0.200 1 619 165 165 GLY N N 113.600 0.050 1 620 166 166 THR H H 6.980 0.010 1 621 166 166 THR CA C 61.450 0.200 1 622 166 166 THR CB C 71.520 0.200 1 623 166 166 THR N N 118.400 0.050 1 624 167 167 TYR H H 8.470 0.010 1 625 167 167 TYR CA C 57.010 0.200 1 626 167 167 TYR CB C 39.590 0.200 1 627 167 167 TYR N N 125.100 0.050 1 628 168 168 TYR H H 9.230 0.010 1 629 168 168 TYR CA C 53.670 0.200 1 630 168 168 TYR CB C 38.430 0.200 1 631 168 168 TYR N N 128.900 0.050 1 632 169 169 PRO CA C 61.690 0.200 1 633 169 169 PRO CB C 30.740 0.200 1 634 170 170 LEU H H 8.830 0.010 1 635 170 170 LEU CA C 57.930 0.200 1 636 170 170 LEU CB C 40.370 0.200 1 637 170 170 LEU N N 122.200 0.050 1 638 171 171 THR H H 8.260 0.010 1 639 171 171 THR CA C 64.860 0.200 1 640 171 171 THR CB C 67.850 0.200 1 641 171 171 THR N N 117.900 0.050 1 642 172 172 GLY H H 9.020 0.010 1 643 172 172 GLY CA C 45.090 0.200 1 644 172 172 GLY N N 117.700 0.050 1 645 173 173 MET H H 7.050 0.010 1 646 173 173 MET CA C 56.610 0.200 1 647 173 173 MET CB C 33.640 0.200 1 648 173 173 MET N N 121.500 0.050 1 649 174 174 SER H H 9.120 0.010 1 650 174 174 SER CA C 57.330 0.200 1 651 174 174 SER CB C 64.790 0.200 1 652 174 174 SER N N 126.300 0.050 1 653 175 175 LYS H H 8.830 0.010 1 654 175 175 LYS CA C 58.840 0.200 1 655 175 175 LYS CB C 30.850 0.200 1 656 175 175 LYS N N 122.900 0.050 1 657 176 176 ALA H H 8.340 0.010 1 658 176 176 ALA CA C 54.750 0.200 1 659 176 176 ALA CB C 17.230 0.200 1 660 176 176 ALA N N 121.600 0.050 1 661 177 177 THR H H 7.900 0.010 1 662 177 177 THR CA C 65.880 0.200 1 663 177 177 THR CB C 67.550 0.200 1 664 177 177 THR N N 119.100 0.050 1 665 178 178 GLN H H 8.240 0.010 1 666 178 178 GLN CA C 59.490 0.200 1 667 178 178 GLN CB C 28.180 0.200 1 668 178 178 GLN N N 121.200 0.050 1 669 179 179 GLN H H 8.090 0.010 1 670 179 179 GLN CA C 57.810 0.200 1 671 179 179 GLN CB C 27.510 0.200 1 672 179 179 GLN N N 116.800 0.050 1 673 180 180 GLN H H 7.560 0.010 1 674 180 180 GLN CA C 58.130 0.200 1 675 180 180 GLN CB C 27.840 0.200 1 676 180 180 GLN N N 119.500 0.050 1 677 181 181 LEU H H 7.900 0.010 1 678 181 181 LEU CA C 57.040 0.200 1 679 181 181 LEU CB C 41.530 0.200 1 680 181 181 LEU N N 118.000 0.050 1 681 182 182 ILE H H 8.560 0.010 1 682 182 182 ILE CA C 65.050 0.200 1 683 182 182 ILE CB C 37.030 0.200 1 684 182 182 ILE N N 124.400 0.050 1 685 183 183 ASP H H 8.320 0.010 1 686 183 183 ASP CA C 57.050 0.200 1 687 183 183 ASP CB C 38.980 0.200 1 688 183 183 ASP N N 124.700 0.050 1 689 184 184 ASP H H 7.000 0.010 1 690 184 184 ASP CA C 54.270 0.200 1 691 184 184 ASP CB C 40.490 0.200 1 692 184 184 ASP N N 116.700 0.050 1 693 185 185 HIS H H 7.840 0.010 1 694 185 185 HIS CA C 56.190 0.200 1 695 185 185 HIS CB C 25.160 0.200 1 696 185 185 HIS N N 113.600 0.050 1 697 186 186 PHE H H 8.530 0.010 1 698 186 186 PHE CA C 53.480 0.200 1 699 186 186 PHE CB C 40.110 0.200 1 700 186 186 PHE N N 115.200 0.050 1 701 187 187 LEU H H 7.230 0.010 1 702 187 187 LEU CA C 54.740 0.200 1 703 187 187 LEU CB C 42.560 0.200 1 704 187 187 LEU N N 121.100 0.050 1 705 188 188 PHE H H 5.670 0.010 1 706 188 188 PHE CA C 54.010 0.200 1 707 188 188 PHE CB C 38.830 0.200 1 708 188 188 PHE N N 119.600 0.050 1 709 189 189 LYS H H 8.200 0.010 1 710 189 189 LYS CA C 53.890 0.200 1 711 189 189 LYS CB C 34.230 0.200 1 712 189 189 LYS N N 118.300 0.050 1 713 190 190 GLU H H 8.240 0.010 1 714 190 190 GLU CA C 56.950 0.200 1 715 190 190 GLU CB C 28.370 0.200 1 716 190 190 GLU N N 119.600 0.050 1 717 191 191 GLY H H 6.900 0.010 1 718 191 191 GLY CA C 44.800 0.200 1 719 191 191 GLY N N 109.700 0.050 1 720 192 192 ASP H H 7.810 0.010 1 721 192 192 ASP CA C 52.550 0.200 1 722 192 192 ASP CB C 40.800 0.200 1 723 192 192 ASP N N 119.200 0.050 1 724 193 193 ARG H H 8.250 0.010 1 725 193 193 ARG CA C 58.360 0.200 1 726 193 193 ARG CB C 28.280 0.200 1 727 193 193 ARG N N 114.700 0.050 1 728 194 194 PHE H H 7.690 0.010 1 729 194 194 PHE CA C 60.780 0.200 1 730 194 194 PHE CB C 36.390 0.200 1 731 194 194 PHE N N 122.000 0.050 1 732 195 195 LEU H H 7.360 0.010 1 733 195 195 LEU CA C 56.640 0.200 1 734 195 195 LEU CB C 40.920 0.200 1 735 195 195 LEU N N 119.900 0.050 1 736 196 196 GLN H H 9.200 0.010 1 737 196 196 GLN CA C 58.410 0.200 1 738 196 196 GLN CB C 27.030 0.200 1 739 196 196 GLN N N 121.000 0.050 1 740 197 197 THR H H 7.590 0.010 1 741 197 197 THR CA C 63.300 0.200 1 742 197 197 THR CB C 69.010 0.200 1 743 197 197 THR N N 108.200 0.050 1 744 198 198 ALA H H 6.820 0.010 1 745 198 198 ALA CA C 51.000 0.200 1 746 198 198 ALA CB C 18.740 0.200 1 747 198 198 ALA N N 120.600 0.050 1 748 199 199 ASN H H 7.840 0.010 1 749 199 199 ASN CA C 53.240 0.200 1 750 199 199 ASN CB C 34.140 0.200 1 751 199 199 ASN N N 112.900 0.050 1 752 200 200 ALA H H 7.540 0.010 1 753 200 200 ALA CA C 52.360 0.200 1 754 200 200 ALA CB C 20.200 0.200 1 755 200 200 ALA N N 114.800 0.050 1 756 201 201 CYS H H 8.410 0.010 1 757 201 201 CYS CA C 55.860 0.200 1 758 201 201 CYS CB C 29.020 0.200 1 759 201 201 CYS N N 117.300 0.050 1 760 202 202 ARG H H 9.160 0.010 1 761 202 202 ARG CA C 57.410 0.200 1 762 202 202 ARG CB C 30.220 0.200 1 763 202 202 ARG N N 123.000 0.050 1 764 205 205 PRO CA C 63.480 0.200 1 765 205 205 PRO CB C 30.880 0.200 1 766 206 206 THR H H 8.840 0.010 1 767 206 206 THR CA C 64.760 0.200 1 768 206 206 THR CB C 67.960 0.200 1 769 206 206 THR N N 123.300 0.050 1 770 207 207 GLY H H 8.580 0.010 1 771 207 207 GLY CA C 45.590 0.200 1 772 207 207 GLY N N 113.100 0.050 1 773 208 208 ARG H H 7.660 0.010 1 774 208 208 ARG CA C 54.440 0.200 1 775 208 208 ARG CB C 31.150 0.200 1 776 208 208 ARG N N 120.400 0.050 1 777 209 209 GLY H H 8.270 0.010 1 778 209 209 GLY CA C 45.590 0.200 1 779 209 209 GLY N N 108.600 0.050 1 780 210 210 ILE H H 8.200 0.010 1 781 210 210 ILE CA C 59.080 0.200 1 782 210 210 ILE CB C 42.130 0.200 1 783 210 210 ILE N N 119.000 0.050 1 784 211 211 PHE H H 9.670 0.010 1 785 211 211 PHE CA C 54.710 0.200 1 786 211 211 PHE CB C 45.070 0.200 1 787 211 211 PHE N N 127.000 0.050 1 788 212 212 HIS H H 7.170 0.010 1 789 212 212 HIS CA C 53.810 0.200 1 790 212 212 HIS CB C 32.120 0.200 1 791 212 212 HIS N N 120.400 0.050 1 792 213 213 ASN H H 8.690 0.010 1 793 213 213 ASN CA C 51.740 0.200 1 794 213 213 ASN CB C 38.400 0.200 1 795 213 213 ASN N N 118.800 0.050 1 796 214 214 ASP H H 9.050 0.010 1 797 214 214 ASP CA C 57.970 0.200 1 798 214 214 ASP CB C 38.920 0.200 1 799 214 214 ASP N N 127.800 0.050 1 800 215 215 ALA H H 8.110 0.010 1 801 215 215 ALA CA C 52.520 0.200 1 802 215 215 ALA CB C 18.730 0.200 1 803 215 215 ALA N N 117.800 0.050 1 804 216 216 LYS H H 7.960 0.010 1 805 216 216 LYS CA C 58.530 0.200 1 806 216 216 LYS CB C 28.410 0.200 1 807 216 216 LYS N N 113.600 0.050 1 808 217 217 THR H H 8.820 0.010 1 809 217 217 THR CA C 59.760 0.200 1 810 217 217 THR CB C 70.600 0.200 1 811 217 217 THR N N 107.700 0.050 1 812 218 218 PHE H H 7.810 0.010 1 813 218 218 PHE CA C 56.340 0.200 1 814 218 218 PHE CB C 42.640 0.200 1 815 218 218 PHE N N 123.600 0.050 1 816 219 219 LEU H H 8.640 0.010 1 817 219 219 LEU CA C 52.630 0.200 1 818 219 219 LEU CB C 46.250 0.200 1 819 219 219 LEU N N 130.100 0.050 1 820 220 220 VAL H H 9.470 0.010 1 821 220 220 VAL CA C 59.300 0.200 1 822 220 220 VAL CB C 35.440 0.200 1 823 220 220 VAL N N 123.200 0.050 1 824 221 221 TRP H H 9.150 0.010 1 825 221 221 TRP CA C 52.940 0.200 1 826 221 221 TRP CB C 31.720 0.200 1 827 221 221 TRP N N 126.100 0.050 1 828 222 222 VAL H H 9.510 0.010 1 829 222 222 VAL CA C 61.500 0.200 1 830 222 222 VAL CB C 32.010 0.200 1 831 222 222 VAL N N 129.600 0.050 1 832 223 223 ASN H H 9.150 0.010 1 833 223 223 ASN CA C 55.540 0.200 1 834 223 223 ASN CB C 35.800 0.200 1 835 223 223 ASN N N 120.000 0.050 1 836 224 224 GLU H H 7.910 0.010 1 837 224 224 GLU CA C 57.880 0.200 1 838 224 224 GLU CB C 24.640 0.200 1 839 224 224 GLU N N 120.000 0.050 1 840 226 226 ASP CA C 53.120 0.200 1 841 226 226 ASP CB C 44.660 0.200 1 842 227 227 HIS H H 8.390 0.010 1 843 227 227 HIS CA C 58.380 0.200 1 844 227 227 HIS CB C 31.500 0.200 1 845 227 227 HIS N N 121.200 0.050 1 846 228 228 LEU H H 8.040 0.010 1 847 228 228 LEU CA C 53.550 0.200 1 848 228 228 LEU CB C 45.680 0.200 1 849 228 228 LEU N N 110.700 0.050 1 850 229 229 ARG H H 8.360 0.010 1 851 229 229 ARG CA C 55.220 0.200 1 852 229 229 ARG CB C 31.940 0.200 1 853 229 229 ARG N N 123.200 0.050 1 854 230 230 ILE H H 8.810 0.010 1 855 230 230 ILE CA C 61.300 0.200 1 856 230 230 ILE CB C 39.410 0.200 1 857 230 230 ILE N N 128.200 0.050 1 858 231 231 ILE H H 9.040 0.010 1 859 231 231 ILE CA C 60.120 0.200 1 860 231 231 ILE CB C 40.720 0.200 1 861 231 231 ILE N N 127.000 0.050 1 862 232 232 SER H H 8.610 0.010 1 863 232 232 SER CA C 54.220 0.200 1 864 232 232 SER CB C 65.510 0.200 1 865 232 232 SER N N 120.000 0.050 1 866 233 233 MET H H 8.900 0.010 1 867 233 233 MET CA C 54.740 0.200 1 868 233 233 MET CB C 35.200 0.200 1 869 233 233 MET N N 126.000 0.050 1 870 234 234 GLN H H 8.230 0.010 1 871 234 234 GLN CA C 55.070 0.200 1 872 234 234 GLN CB C 31.640 0.200 1 873 234 234 GLN N N 111.300 0.050 1 874 235 235 LYS H H 8.260 0.010 1 875 235 235 LYS CA C 56.260 0.200 1 876 235 235 LYS CB C 31.920 0.200 1 877 235 235 LYS N N 118.800 0.050 1 878 236 236 GLY H H 8.160 0.010 1 879 236 236 GLY CA C 44.430 0.200 1 880 236 236 GLY N N 112.500 0.050 1 881 237 237 GLY H H 8.560 0.010 1 882 237 237 GLY CA C 46.220 0.200 1 883 237 237 GLY N N 106.100 0.050 1 884 238 238 ASP H H 8.700 0.010 1 885 238 238 ASP CA C 52.930 0.200 1 886 238 238 ASP CB C 37.040 0.200 1 887 238 238 ASP N N 121.400 0.050 1 888 239 239 LEU H H 8.410 0.010 1 889 239 239 LEU CA C 56.840 0.200 1 890 239 239 LEU CB C 41.160 0.200 1 891 239 239 LEU N N 128.200 0.050 1 892 240 240 LYS H H 6.950 0.010 1 893 240 240 LYS CA C 60.300 0.200 1 894 240 240 LYS CB C 30.380 0.200 1 895 240 240 LYS N N 117.700 0.050 1 896 241 241 THR H H 7.220 0.010 1 897 241 241 THR CA C 66.150 0.200 1 898 241 241 THR CB C 67.000 0.200 1 899 241 241 THR N N 116.800 0.050 1 900 242 242 VAL H H 7.930 0.010 1 901 242 242 VAL CA C 66.130 0.200 1 902 242 242 VAL CB C 31.490 0.200 1 903 242 242 VAL N N 121.800 0.050 1 904 243 243 TYR H H 9.110 0.010 1 905 243 243 TYR CA C 60.640 0.200 1 906 243 243 TYR CB C 38.770 0.200 1 907 243 243 TYR N N 122.900 0.050 1 908 244 244 LYS H H 8.630 0.010 1 909 244 244 LYS CA C 59.340 0.200 1 910 244 244 LYS CB C 31.440 0.200 1 911 244 244 LYS N N 119.400 0.050 1 912 245 245 ARG H H 7.750 0.010 1 913 245 245 ARG CA C 58.900 0.200 1 914 245 245 ARG CB C 28.790 0.200 1 915 245 245 ARG N N 120.300 0.050 1 916 246 246 LEU H H 6.990 0.010 1 917 246 246 LEU CA C 58.340 0.200 1 918 246 246 LEU CB C 40.880 0.200 1 919 246 246 LEU N N 118.900 0.050 1 920 247 247 VAL H H 7.850 0.010 1 921 247 247 VAL CA C 65.320 0.200 1 922 247 247 VAL CB C 29.600 0.200 1 923 247 247 VAL N N 118.000 0.050 1 924 248 248 THR H H 7.500 0.010 1 925 248 248 THR CA C 65.440 0.200 1 926 248 248 THR CB C 68.620 0.200 1 927 248 248 THR N N 113.100 0.050 1 928 249 249 ALA H H 7.760 0.010 1 929 249 249 ALA CA C 54.980 0.200 1 930 249 249 ALA CB C 20.300 0.200 1 931 249 249 ALA N N 123.000 0.050 1 932 250 250 VAL H H 8.850 0.010 1 933 250 250 VAL CA C 67.860 0.200 1 934 250 250 VAL CB C 30.490 0.200 1 935 250 250 VAL N N 118.900 0.050 1 936 251 251 ASP H H 8.410 0.010 1 937 251 251 ASP CA C 57.120 0.200 1 938 251 251 ASP CB C 38.680 0.200 1 939 251 251 ASP N N 119.100 0.050 1 940 252 252 ASN H H 7.850 0.010 1 941 252 252 ASN CA C 56.190 0.200 1 942 252 252 ASN CB C 37.990 0.200 1 943 252 252 ASN N N 119.600 0.050 1 944 253 253 ILE H H 8.630 0.010 1 945 253 253 ILE CA C 65.710 0.200 1 946 253 253 ILE CB C 37.880 0.200 1 947 253 253 ILE N N 122.600 0.050 1 948 254 254 GLU H H 8.600 0.010 1 949 254 254 GLU CA C 56.580 0.200 1 950 254 254 GLU CB C 28.640 0.200 1 951 254 254 GLU N N 121.600 0.050 1 952 255 255 SER H H 7.200 0.010 1 953 255 255 SER CA C 60.620 0.200 1 954 255 255 SER CB C 62.750 0.200 1 955 255 255 SER N N 110.300 0.050 1 956 256 256 LYS H H 7.230 0.010 1 957 256 256 LYS CA C 56.000 0.200 1 958 256 256 LYS CB C 34.320 0.200 1 959 256 256 LYS N N 119.400 0.050 1 960 257 257 LEU H H 8.050 0.010 1 961 257 257 LEU CA C 50.660 0.200 1 962 257 257 LEU CB C 42.680 0.200 1 963 257 257 LEU N N 122.600 0.050 1 964 258 258 PRO CA C 62.280 0.200 1 965 258 258 PRO CB C 31.630 0.200 1 966 259 259 PHE H H 8.880 0.010 1 967 259 259 PHE CA C 53.300 0.200 1 968 259 259 PHE CB C 40.840 0.200 1 969 259 259 PHE N N 121.500 0.050 1 970 260 260 SER H H 9.000 0.010 1 971 260 260 SER CA C 59.050 0.200 1 972 260 260 SER CB C 63.360 0.200 1 973 260 260 SER N N 118.400 0.050 1 974 261 261 HIS H H 9.040 0.010 1 975 261 261 HIS CA C 55.660 0.200 1 976 261 261 HIS CB C 31.470 0.200 1 977 261 261 HIS N N 130.000 0.050 1 978 262 262 ASP H H 8.410 0.010 1 979 262 262 ASP CA C 52.480 0.200 1 980 262 262 ASP CB C 47.530 0.200 1 981 262 262 ASP N N 128.200 0.050 1 982 263 263 ASP H H 8.720 0.010 1 983 263 263 ASP CA C 56.480 0.200 1 984 263 263 ASP CB C 40.270 0.200 1 985 263 263 ASP N N 125.500 0.050 1 986 264 264 ARG H H 8.190 0.010 1 987 264 264 ARG CA C 57.880 0.200 1 988 264 264 ARG CB C 29.360 0.200 1 989 264 264 ARG N N 117.200 0.050 1 990 265 265 PHE H H 8.430 0.010 1 991 265 265 PHE CA C 56.520 0.200 1 992 265 265 PHE CB C 40.130 0.200 1 993 265 265 PHE N N 114.800 0.050 1 994 266 266 GLY H H 7.620 0.010 1 995 266 266 GLY CA C 45.120 0.200 1 996 266 266 GLY N N 106.600 0.050 1 997 267 267 PHE H H 8.400 0.010 1 998 267 267 PHE CA C 61.070 0.200 1 999 267 267 PHE CB C 37.030 0.200 1 1000 267 267 PHE N N 125.000 0.050 1 1001 268 268 LEU H H 6.390 0.010 1 1002 268 268 LEU CA C 54.690 0.200 1 1003 268 268 LEU CB C 42.210 0.200 1 1004 268 268 LEU N N 118.100 0.050 1 1005 269 269 THR H H 6.370 0.010 1 1006 269 269 THR CA C 58.830 0.200 1 1007 269 269 THR CB C 71.530 0.200 1 1008 269 269 THR N N 111.000 0.050 1 1009 270 270 PHE H H 9.850 0.010 1 1010 270 270 PHE CA C 52.800 0.200 1 1011 270 270 PHE CB C 39.070 0.200 1 1012 270 270 PHE N N 125.500 0.050 1 1013 271 271 CYS H H 9.050 0.010 1 1014 271 271 CYS CA C 55.590 0.200 1 1015 271 271 CYS CB C 28.930 0.200 1 1016 271 271 CYS N N 119.700 0.050 1 1017 273 273 THR CA C 63.270 0.200 1 1018 273 273 THR CB C 68.430 0.200 1 1019 274 274 ASN H H 7.600 0.010 1 1020 274 274 ASN CA C 52.760 0.200 1 1021 274 274 ASN CB C 39.330 0.200 1 1022 274 274 ASN N N 121.500 0.050 1 1023 275 275 LEU CA C 54.120 0.200 1 1024 275 275 LEU CB C 43.840 0.200 1 1025 276 276 GLY H H 7.230 0.010 1 1026 276 276 GLY CA C 45.280 0.200 1 1027 276 276 GLY N N 105.200 0.050 1 1028 277 277 THR H H 9.340 0.010 1 1029 277 277 THR CA C 62.650 0.200 1 1030 277 277 THR CB C 69.970 0.200 1 1031 277 277 THR N N 117.200 0.050 1 1032 278 278 THR CA C 64.640 0.200 1 1033 278 278 THR CB C 70.400 0.200 1 1034 279 279 MET H H 8.570 0.010 1 1035 279 279 MET CA C 56.050 0.200 1 1036 279 279 MET CB C 34.840 0.200 1 1037 279 279 MET N N 123.300 0.050 1 1038 280 280 ARG H H 8.830 0.010 1 1039 280 280 ARG CA C 55.040 0.200 1 1040 280 280 ARG CB C 31.990 0.200 1 1041 280 280 ARG N N 128.200 0.050 1 1042 281 281 ALA H H 9.950 0.010 1 1043 281 281 ALA CA C 49.900 0.200 1 1044 281 281 ALA CB C 19.800 0.200 1 1045 281 281 ALA N N 136.100 0.050 1 1046 282 282 SER H H 9.470 0.010 1 1047 282 282 SER CA C 56.650 0.200 1 1048 282 282 SER CB C 65.780 0.200 1 1049 282 282 SER N N 115.300 0.050 1 1050 283 283 VAL H H 8.830 0.010 1 1051 283 283 VAL CA C 58.750 0.200 1 1052 283 283 VAL CB C 34.730 0.200 1 1053 283 283 VAL N N 117.300 0.050 1 1054 284 284 HIS H H 8.400 0.010 1 1055 284 284 HIS CA C 53.580 0.200 1 1056 284 284 HIS CB C 30.410 0.200 1 1057 284 284 HIS N N 124.200 0.050 1 1058 285 285 ILE H H 9.770 0.010 1 1059 285 285 ILE CA C 58.820 0.200 1 1060 285 285 ILE CB C 43.190 0.200 1 1061 285 285 ILE N N 126.900 0.050 1 1062 286 286 GLN H H 8.850 0.010 1 1063 286 286 GLN CA C 54.170 0.200 1 1064 286 286 GLN CB C 30.090 0.200 1 1065 286 286 GLN N N 128.000 0.050 1 1066 287 287 LEU H H 8.420 0.010 1 1067 287 287 LEU CA C 51.000 0.200 1 1068 287 287 LEU CB C 42.240 0.200 1 1069 287 287 LEU N N 125.000 0.050 1 1070 288 288 PRO CA C 65.210 0.200 1 1071 288 288 PRO CB C 31.360 0.200 1 1072 289 289 LYS H H 11.670 0.010 1 1073 289 289 LYS CA C 59.190 0.200 1 1074 289 289 LYS CB C 30.650 0.200 1 1075 289 289 LYS N N 123.900 0.050 1 1076 290 290 LEU H H 10.670 0.010 1 1077 290 290 LEU CA C 57.160 0.200 1 1078 290 290 LEU CB C 40.340 0.200 1 1079 290 290 LEU N N 127.100 0.050 1 1080 291 291 ALA H H 8.200 0.010 1 1081 291 291 ALA CA C 53.570 0.200 1 1082 291 291 ALA CB C 18.870 0.200 1 1083 291 291 ALA N N 118.300 0.050 1 1084 292 292 LYS H H 7.210 0.010 1 1085 292 292 LYS CA C 56.830 0.200 1 1086 292 292 LYS CB C 31.390 0.200 1 1087 292 292 LYS N N 115.200 0.050 1 1088 293 293 ASP H H 7.830 0.010 1 1089 293 293 ASP CA C 52.360 0.200 1 1090 293 293 ASP CB C 40.110 0.200 1 1091 293 293 ASP N N 122.100 0.050 1 1092 294 294 ARG H H 8.070 0.010 1 1093 294 294 ARG CA C 58.590 0.200 1 1094 294 294 ARG CB C 29.200 0.200 1 1095 294 294 ARG N N 122.000 0.050 1 1096 295 295 LYS H H 8.300 0.010 1 1097 295 295 LYS CA C 58.810 0.200 1 1098 295 295 LYS CB C 31.150 0.200 1 1099 295 295 LYS N N 119.400 0.050 1 1100 296 296 VAL H H 7.500 0.010 1 1101 296 296 VAL CA C 65.640 0.200 1 1102 296 296 VAL CB C 31.020 0.200 1 1103 296 296 VAL N N 120.000 0.050 1 1104 297 297 LEU H H 7.060 0.010 1 1105 297 297 LEU CA C 57.990 0.200 1 1106 297 297 LEU CB C 41.190 0.200 1 1107 297 297 LEU N N 120.000 0.050 1 1108 298 298 GLU H H 8.320 0.010 1 1109 298 298 GLU CA C 58.720 0.200 1 1110 298 298 GLU CB C 28.310 0.200 1 1111 298 298 GLU N N 117.200 0.050 1 1112 299 299 ASP H H 8.380 0.010 1 1113 299 299 ASP CA C 57.170 0.200 1 1114 299 299 ASP CB C 39.860 0.200 1 1115 299 299 ASP N N 122.200 0.050 1 1116 300 300 ILE H H 8.060 0.010 1 1117 300 300 ILE CA C 64.820 0.200 1 1118 300 300 ILE CB C 37.380 0.200 1 1119 300 300 ILE N N 121.600 0.050 1 1120 301 301 ALA H H 8.220 0.010 1 1121 301 301 ALA CA C 55.480 0.200 1 1122 301 301 ALA CB C 17.050 0.200 1 1123 301 301 ALA N N 120.500 0.050 1 1124 302 302 SER H H 8.410 0.010 1 1125 302 302 SER CA C 61.930 0.200 1 1126 302 302 SER N N 113.000 0.050 1 1127 303 303 LYS H H 7.640 0.010 1 1128 303 303 LYS CA C 58.490 0.200 1 1129 303 303 LYS CB C 31.170 0.200 1 1130 303 303 LYS N N 123.300 0.050 1 1131 304 304 PHE H H 7.310 0.010 1 1132 304 304 PHE CA C 57.530 0.200 1 1133 304 304 PHE CB C 38.800 0.200 1 1134 304 304 PHE N N 115.700 0.050 1 1135 305 305 ASN H H 7.550 0.010 1 1136 305 305 ASN CA C 54.620 0.200 1 1137 305 305 ASN CB C 37.220 0.200 1 1138 305 305 ASN N N 110.900 0.050 1 1139 306 306 LEU H H 8.740 0.010 1 1140 306 306 LEU CA C 52.730 0.200 1 1141 306 306 LEU CB C 42.050 0.200 1 1142 306 306 LEU N N 117.500 0.050 1 1143 307 307 GLN H H 9.330 0.010 1 1144 307 307 GLN CA C 53.680 0.200 1 1145 307 307 GLN CB C 30.700 0.200 1 1146 307 307 GLN N N 120.900 0.050 1 1147 308 308 VAL H H 8.880 0.010 1 1148 308 308 VAL CA C 61.010 0.200 1 1149 308 308 VAL CB C 32.200 0.200 1 1150 308 308 VAL N N 126.000 0.050 1 1151 309 309 ARG H H 8.870 0.010 1 1152 309 309 ARG CA C 54.280 0.200 1 1153 309 309 ARG CB C 32.780 0.200 1 1154 309 309 ARG N N 127.800 0.050 1 1155 310 310 GLY H H 8.850 0.010 1 1156 310 310 GLY CA C 44.910 0.200 1 1157 310 310 GLY N N 112.100 0.050 1 1158 311 311 THR H H 8.090 0.010 1 1159 311 311 THR CA C 61.720 0.200 1 1160 311 311 THR CB C 69.180 0.200 1 1161 311 311 THR N N 113.800 0.050 1 1162 312 312 ARG H H 8.330 0.010 1 1163 312 312 ARG CA C 55.320 0.200 1 1164 312 312 ARG CB C 29.700 0.200 1 1165 312 312 ARG N N 122.400 0.050 1 1166 313 313 GLY H H 8.070 0.010 1 1167 313 313 GLY CA C 45.850 0.200 1 1168 313 313 GLY N N 109.900 0.050 1 1169 314 314 GLU H H 8.640 0.010 1 1170 314 314 GLU CA C 56.760 0.200 1 1171 314 314 GLU CB C 29.120 0.200 1 1172 314 314 GLU N N 121.400 0.050 1 1173 315 315 HIS H H 8.440 0.010 1 1174 315 315 HIS CA C 55.520 0.200 1 1175 315 315 HIS CB C 29.020 0.200 1 1176 315 315 HIS N N 118.300 0.050 1 1177 316 316 THR H H 7.800 0.010 1 1178 316 316 THR CA C 62.100 0.200 1 1179 316 316 THR CB C 69.310 0.200 1 1180 316 316 THR N N 114.100 0.050 1 1181 317 317 GLU H H 8.610 0.010 1 1182 317 317 GLU CA C 57.120 0.200 1 1183 317 317 GLU CB C 28.880 0.200 1 1184 317 317 GLU N N 122.700 0.050 1 1185 318 318 SER H H 8.110 0.010 1 1186 318 318 SER CA C 58.040 0.200 1 1187 318 318 SER CB C 63.500 0.200 1 1188 318 318 SER N N 115.800 0.050 1 1189 319 319 GLU H H 8.250 0.010 1 1190 319 319 GLU CA C 56.320 0.200 1 1191 319 319 GLU CB C 29.170 0.200 1 1192 319 319 GLU N N 123.600 0.050 1 1193 320 320 GLY H H 8.290 0.010 1 1194 320 320 GLY CA C 45.030 0.200 1 1195 320 320 GLY N N 110.300 0.050 1 1196 321 321 GLY H H 8.050 0.010 1 1197 321 321 GLY CA C 46.050 0.200 1 1198 321 321 GLY N N 108.000 0.050 1 1199 322 322 VAL H H 7.160 0.010 1 1200 322 322 VAL CA C 61.220 0.200 1 1201 322 322 VAL CB C 31.100 0.200 1 1202 322 322 VAL N N 119.100 0.050 1 1203 323 323 TYR H H 9.080 0.010 1 1204 323 323 TYR CA C 57.120 0.200 1 1205 323 323 TYR CB C 42.070 0.200 1 1206 323 323 TYR N N 126.100 0.050 1 1207 324 324 ASP H H 9.000 0.010 1 1208 324 324 ASP CA C 52.990 0.200 1 1209 324 324 ASP CB C 42.770 0.200 1 1210 324 324 ASP N N 122.100 0.050 1 1211 325 325 ILE H H 9.070 0.010 1 1212 325 325 ILE CA C 59.270 0.200 1 1213 325 325 ILE CB C 37.720 0.200 1 1214 325 325 ILE N N 128.000 0.050 1 1215 326 326 SER H H 8.590 0.010 1 1216 326 326 SER CA C 56.170 0.200 1 1217 326 326 SER CB C 67.630 0.200 1 1218 326 326 SER N N 118.600 0.050 1 1219 327 327 ASN H H 8.700 0.010 1 1220 327 327 ASN CA C 54.520 0.200 1 1221 327 327 ASN CB C 37.470 0.200 1 1222 327 327 ASN N N 116.900 0.050 1 1223 328 328 LYS H H 8.530 0.010 1 1224 328 328 LYS CA C 57.810 0.200 1 1225 328 328 LYS CB C 34.060 0.200 1 1226 328 328 LYS N N 122.100 0.050 1 1227 329 329 ARG H H 8.850 0.010 1 1228 329 329 ARG CA C 57.410 0.200 1 1229 329 329 ARG CB C 32.030 0.200 1 1230 329 329 ARG N N 118.100 0.050 1 1231 330 330 ARG H H 9.450 0.010 1 1232 330 330 ARG CA C 56.460 0.200 1 1233 330 330 ARG CB C 32.990 0.200 1 1234 330 330 ARG N N 120.700 0.050 1 1235 331 331 LEU H H 8.290 0.010 1 1236 331 331 LEU CA C 53.300 0.200 1 1237 331 331 LEU CB C 44.320 0.200 1 1238 331 331 LEU N N 123.300 0.050 1 1239 332 332 GLY H H 12.090 0.010 1 1240 332 332 GLY CA C 44.550 0.200 1 1241 332 332 GLY N N 116.000 0.050 1 1242 333 333 LEU H H 7.440 0.010 1 1243 333 333 LEU CA C 53.790 0.200 1 1244 333 333 LEU CB C 42.020 0.200 1 1245 333 333 LEU N N 122.700 0.050 1 1246 334 334 THR H H 8.130 0.010 1 1247 334 334 THR CA C 59.450 0.200 1 1248 334 334 THR CB C 72.360 0.200 1 1249 334 334 THR N N 107.600 0.050 1 1250 335 335 GLU H H 10.290 0.010 1 1251 335 335 GLU CA C 62.550 0.200 1 1252 335 335 GLU CB C 27.130 0.200 1 1253 335 335 GLU N N 123.400 0.050 1 1254 336 336 TYR H H 7.900 0.010 1 1255 336 336 TYR CA C 61.210 0.200 1 1256 336 336 TYR CB C 37.160 0.200 1 1257 336 336 TYR N N 115.600 0.050 1 1258 337 337 GLN H H 8.060 0.010 1 1259 337 337 GLN CA C 58.640 0.200 1 1260 337 337 GLN CB C 27.950 0.200 1 1261 337 337 GLN N N 117.100 0.050 1 1262 338 338 ALA H H 8.460 0.010 1 1263 338 338 ALA CA C 54.820 0.200 1 1264 338 338 ALA CB C 17.850 0.200 1 1265 338 338 ALA N N 122.600 0.050 1 1266 339 339 VAL H H 8.170 0.010 1 1267 339 339 VAL CA C 65.110 0.200 1 1268 339 339 VAL CB C 30.430 0.200 1 1269 339 339 VAL N N 116.300 0.050 1 1270 340 340 ARG H H 8.410 0.010 1 1271 340 340 ARG CA C 61.800 0.200 1 1272 340 340 ARG N N 122.300 0.050 1 1273 344 344 ASP CA C 57.080 0.200 1 1274 344 344 ASP CB C 39.200 0.200 1 1275 345 345 GLY H H 7.800 0.010 1 1276 345 345 GLY CA C 46.570 0.200 1 1277 345 345 GLY N N 108.600 0.050 1 1278 346 346 ILE H H 8.400 0.010 1 1279 346 346 ILE CA C 61.950 0.200 1 1280 346 346 ILE CB C 33.490 0.200 1 1281 346 346 ILE N N 122.300 0.050 1 1282 347 347 LEU H H 8.490 0.010 1 1283 347 347 LEU CA C 58.020 0.200 1 1284 347 347 LEU CB C 40.280 0.200 1 1285 347 347 LEU N N 119.000 0.050 1 1286 349 349 MET CA C 59.840 0.200 1 1287 350 350 ILE H H 8.260 0.010 1 1288 350 350 ILE CA C 65.580 0.200 1 1289 350 350 ILE CB C 37.100 0.200 1 1290 350 350 ILE N N 118.800 0.050 1 1291 351 351 LYS H H 7.740 0.010 1 1292 351 351 LYS CA C 59.520 0.200 1 1293 351 351 LYS CB C 31.410 0.200 1 1294 351 351 LYS N N 120.300 0.050 1 1295 352 352 MET H H 7.990 0.010 1 1296 352 352 MET CA C 57.000 0.200 1 1297 352 352 MET CB C 30.610 0.200 1 1298 352 352 MET N N 118.000 0.050 1 1299 353 353 GLU H H 8.520 0.010 1 1300 353 353 GLU CA C 58.750 0.200 1 1301 353 353 GLU CB C 28.370 0.200 1 1302 353 353 GLU N N 125.500 0.050 1 1303 354 354 LYS H H 8.160 0.010 1 1304 354 354 LYS CA C 58.760 0.200 1 1305 354 354 LYS CB C 32.050 0.200 1 1306 354 354 LYS N N 117.100 0.050 1 1307 355 355 ALA H H 7.380 0.010 1 1308 355 355 ALA CA C 52.170 0.200 1 1309 355 355 ALA CB C 18.690 0.200 1 1310 355 355 ALA N N 119.800 0.050 1 1311 356 356 ALA H H 7.310 0.010 1 1312 356 356 ALA CA C 52.160 0.200 1 1313 356 356 ALA CB C 18.200 0.200 1 1314 356 356 ALA N N 123.300 0.050 1 1315 357 357 ALA H H 7.930 0.010 1 1316 357 357 ALA CA C 53.740 0.200 1 1317 357 357 ALA CB C 19.150 0.200 1 1318 357 357 ALA N N 129.500 0.050 1 stop_ save_