data_17820 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone resonance assignments for IsdH-N2N3 ; _BMRB_accession_number 17820 _BMRB_flat_file_name bmr17820.str _Entry_type original _Submission_date 2011-07-29 _Accession_date 2011-07-29 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Backbone 1H, 13C and 15N resonance assignments for Staphylococcus aurues hemoglobin receptor IsdH (domains NEAT 2 and NEAT 3)' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Spirig Thomas . . 2 Clubb Robert T. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 292 "13C chemical shifts" 878 "15N chemical shifts" 292 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2013-03-27 update BMRB 'update entry citation' 2011-12-12 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Backbone 1H, 13C and 15N resonance assignments of the 39 kDa staphylococcal hemoglobin receptor IsdH.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 22101872 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Spirig Thomas . . 2 Clubb Robert T. . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_name_full 'Biomolecular NMR assignments' _Journal_volume 6 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 169 _Page_last 172 _Year 2012 _Details . loop_ _Keyword 'heme acquisition' 'hemoglobin receptor' 'iron uptake' 'NEAT domain' 'NMR resonance assignments' 'secondary structure' 'Staphylococcus aureus' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'IsdH-N2N3 monomer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label IsdH-N2N3 $IsdH-N2N3 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_IsdH-N2N3 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common IsdH-N2N3 _Molecular_mass . _Mol_thiol_state 'not present' loop_ _Biological_function 'Binding of hemoglobin' 'Extraction of heme from hemoglobin' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 336 _Mol_residue_sequence ; SADESLQDAIKNPAIIDKEH TADNWRPIDFQMKNDKGERQ FYHYASTVEPATVIFTKTGP IIELGLKTASTWKKFEVYEG DKKLPVELVSYDSDKDYAYI RFPVSNGTREVKIVSSIEYG ENIHEDYDYTLMVFAQPITN NPDDYVDEETYNLQKLLAPY HKAKTLERQVYELEKLQEKL PEKYKAEYKKKLDQTRVELA DQVKSAVTEFENVTPTNDQL TDLQEAHFVVFESEENSESV MDGFVEHPFYTATLNGQKYV VMKTKDDSYWKDLIVEGKRV TTVSKDPKNNSRTLIFPYIP DKAVYNAIVKVVVANIGAEG QYHVRIINQDINTKDD ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 325 SER 2 326 ALA 3 327 ASP 4 328 GLU 5 329 SER 6 330 LEU 7 331 GLN 8 332 ASP 9 333 ALA 10 334 ILE 11 335 LYS 12 336 ASN 13 337 PRO 14 338 ALA 15 339 ILE 16 340 ILE 17 341 ASP 18 342 LYS 19 343 GLU 20 344 HIS 21 345 THR 22 346 ALA 23 347 ASP 24 348 ASN 25 349 TRP 26 350 ARG 27 351 PRO 28 352 ILE 29 353 ASP 30 354 PHE 31 355 GLN 32 356 MET 33 357 LYS 34 358 ASN 35 359 ASP 36 360 LYS 37 361 GLY 38 362 GLU 39 363 ARG 40 364 GLN 41 365 PHE 42 366 TYR 43 367 HIS 44 368 TYR 45 369 ALA 46 370 SER 47 371 THR 48 372 VAL 49 373 GLU 50 374 PRO 51 375 ALA 52 376 THR 53 377 VAL 54 378 ILE 55 379 PHE 56 380 THR 57 381 LYS 58 382 THR 59 383 GLY 60 384 PRO 61 385 ILE 62 386 ILE 63 387 GLU 64 388 LEU 65 389 GLY 66 390 LEU 67 391 LYS 68 392 THR 69 393 ALA 70 394 SER 71 395 THR 72 396 TRP 73 397 LYS 74 398 LYS 75 399 PHE 76 400 GLU 77 401 VAL 78 402 TYR 79 403 GLU 80 404 GLY 81 405 ASP 82 406 LYS 83 407 LYS 84 408 LEU 85 409 PRO 86 410 VAL 87 411 GLU 88 412 LEU 89 413 VAL 90 414 SER 91 415 TYR 92 416 ASP 93 417 SER 94 418 ASP 95 419 LYS 96 420 ASP 97 421 TYR 98 422 ALA 99 423 TYR 100 424 ILE 101 425 ARG 102 426 PHE 103 427 PRO 104 428 VAL 105 429 SER 106 430 ASN 107 431 GLY 108 432 THR 109 433 ARG 110 434 GLU 111 435 VAL 112 436 LYS 113 437 ILE 114 438 VAL 115 439 SER 116 440 SER 117 441 ILE 118 442 GLU 119 443 TYR 120 444 GLY 121 445 GLU 122 446 ASN 123 447 ILE 124 448 HIS 125 449 GLU 126 450 ASP 127 451 TYR 128 452 ASP 129 453 TYR 130 454 THR 131 455 LEU 132 456 MET 133 457 VAL 134 458 PHE 135 459 ALA 136 460 GLN 137 461 PRO 138 462 ILE 139 463 THR 140 464 ASN 141 465 ASN 142 466 PRO 143 467 ASP 144 468 ASP 145 469 TYR 146 470 VAL 147 471 ASP 148 472 GLU 149 473 GLU 150 474 THR 151 475 TYR 152 476 ASN 153 477 LEU 154 478 GLN 155 479 LYS 156 480 LEU 157 481 LEU 158 482 ALA 159 483 PRO 160 484 TYR 161 485 HIS 162 486 LYS 163 487 ALA 164 488 LYS 165 489 THR 166 490 LEU 167 491 GLU 168 492 ARG 169 493 GLN 170 494 VAL 171 495 TYR 172 496 GLU 173 497 LEU 174 498 GLU 175 499 LYS 176 500 LEU 177 501 GLN 178 502 GLU 179 503 LYS 180 504 LEU 181 505 PRO 182 506 GLU 183 507 LYS 184 508 TYR 185 509 LYS 186 510 ALA 187 511 GLU 188 512 TYR 189 513 LYS 190 514 LYS 191 515 LYS 192 516 LEU 193 517 ASP 194 518 GLN 195 519 THR 196 520 ARG 197 521 VAL 198 522 GLU 199 523 LEU 200 524 ALA 201 525 ASP 202 526 GLN 203 527 VAL 204 528 LYS 205 529 SER 206 530 ALA 207 531 VAL 208 532 THR 209 533 GLU 210 534 PHE 211 535 GLU 212 536 ASN 213 537 VAL 214 538 THR 215 539 PRO 216 540 THR 217 541 ASN 218 542 ASP 219 543 GLN 220 544 LEU 221 545 THR 222 546 ASP 223 547 LEU 224 548 GLN 225 549 GLU 226 550 ALA 227 551 HIS 228 552 PHE 229 553 VAL 230 554 VAL 231 555 PHE 232 556 GLU 233 557 SER 234 558 GLU 235 559 GLU 236 560 ASN 237 561 SER 238 562 GLU 239 563 SER 240 564 VAL 241 565 MET 242 566 ASP 243 567 GLY 244 568 PHE 245 569 VAL 246 570 GLU 247 571 HIS 248 572 PRO 249 573 PHE 250 574 TYR 251 575 THR 252 576 ALA 253 577 THR 254 578 LEU 255 579 ASN 256 580 GLY 257 581 GLN 258 582 LYS 259 583 TYR 260 584 VAL 261 585 VAL 262 586 MET 263 587 LYS 264 588 THR 265 589 LYS 266 590 ASP 267 591 ASP 268 592 SER 269 593 TYR 270 594 TRP 271 595 LYS 272 596 ASP 273 597 LEU 274 598 ILE 275 599 VAL 276 600 GLU 277 601 GLY 278 602 LYS 279 603 ARG 280 604 VAL 281 605 THR 282 606 THR 283 607 VAL 284 608 SER 285 609 LYS 286 610 ASP 287 611 PRO 288 612 LYS 289 613 ASN 290 614 ASN 291 615 SER 292 616 ARG 293 617 THR 294 618 LEU 295 619 ILE 296 620 PHE 297 621 PRO 298 622 TYR 299 623 ILE 300 624 PRO 301 625 ASP 302 626 LYS 303 627 ALA 304 628 VAL 305 629 TYR 306 630 ASN 307 631 ALA 308 632 ILE 309 633 VAL 310 634 LYS 311 635 VAL 312 636 VAL 313 637 VAL 314 638 ALA 315 639 ASN 316 640 ILE 317 641 GLY 318 642 ALA 319 643 GLU 320 644 GLY 321 645 GLN 322 646 TYR 323 647 HIS 324 648 VAL 325 649 ARG 326 650 ILE 327 651 ILE 328 652 ASN 329 653 GLN 330 654 ASP 331 655 ILE 332 656 ASN 333 657 THR 334 658 LYS 335 659 ASP 336 660 ASP stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-09-30 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 4IJ2 "Human Methemoglobin In Complex With The Second And Third Neat Domains Of Isdh From Staphylococcus Aureus" 100.00 336 100.00 100.00 0.00e+00 PDB 4XS0 "Human Methemoglobin In Complex With The Second And Third Neat Domains Of Isdh(f365y/a369f/y642a) From Staphylococcus Aureus" 100.00 336 99.40 99.70 0.00e+00 EMBL CAI81279 "iron-regulated surface protein [Staphylococcus aureus RF122]" 99.70 617 97.91 98.51 0.00e+00 EMBL COX93366 "cell wall surface anchor family protein [Staphylococcus aureus]" 61.01 440 99.51 99.51 1.02e-140 EMBL CPE78318 "cell wall surface anchor family protein [Staphylococcus aureus]" 66.37 458 99.10 99.55 1.12e-154 EMBL CPJ07879 "cell wall surface anchor family protein [Staphylococcus aureus]" 90.77 540 99.34 99.34 0.00e+00 EMBL CPL95539 "cell wall surface anchor family protein [Staphylococcus haemolyticus]" 56.85 426 98.43 98.95 1.37e-127 GB AIW27424 "Cell surface receptor IsdH for hemoglobin-haptoglobin complexes [Staphylococcus aureus subsp. aureus]" 90.77 535 97.05 98.69 0.00e+00 GB EEV26426 "cell wall anchor protein [Staphylococcus aureus A9781]" 99.70 615 99.10 99.70 0.00e+00 GB EFB57600 "LOW QUALITY PROTEIN: haptoglobin-binding heme uptake protein HarA, partial [Staphylococcus aureus subsp. aureus WW2703/97]" 99.70 611 97.01 98.81 0.00e+00 GB EFB60931 "LOW QUALITY PROTEIN: cell surface receptor IsdH for hemoglobin-haptoglobin complexes, partial [Staphylococcus aureus subsp. aur" 99.70 611 97.01 98.81 0.00e+00 GB EFC00882 "LOW QUALITY PROTEIN: cell wall surface anchor family protein, partial [Staphylococcus aureus subsp. aureus C160]" 99.70 611 97.01 98.81 0.00e+00 REF WP_042745476 "heme transporter HarA, partial [Staphylococcus aureus]" 99.70 618 99.70 99.70 0.00e+00 REF WP_052997956 "heme transporter HarA, partial [Staphylococcus aureus]" 81.55 509 99.27 99.64 0.00e+00 REF WP_053014930 "heme transporter HarA, partial [Staphylococcus aureus]" 81.55 509 99.64 99.64 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 $IsdH-N2N3 'Staphylococcus aureus' 1280 Bacteria . Staphylococcus aureus 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 $IsdH-N2N3 'recombinant technology' . Escherichia coli BL21(DE3) - 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 $IsdH-N2N3 1.1 mM '[U-100% 13C; U-100% 15N; U-80% 2H]' 'potassium phosphate' 20 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' 'sodium azide' 0.01 % 'natural abundance' D2O 7 % [U-2H] H2O 93 % 'natural abundance' 'Protease Inhibitor Cocktail' 0.01 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRDraw _Saveframe_category software _Name NMRDraw _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_CARA _Saveframe_category software _Name CARA _Version . loop_ _Vendor _Address _Electronic_address Keller . . 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_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _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_HNCACB_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HN(CO)CACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CACB' _Sample_label $sample_1 save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HN(CA)CO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _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' 70 . mM pH 6.0 . pH pressure 1 . atm temperature 310 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCACB' '3D HN(CO)CACB' '3D HNCO' '3D HN(CA)CO' '3D 1H-15N NOESY' 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 IsdH-N2N3 _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 1 331 7 GLN H H 7.884 0.020 1 2 331 7 GLN C C 176.541 0.3 1 3 331 7 GLN CA C 57.470 0.3 1 4 331 7 GLN CB C 27.062 0.3 1 5 331 7 GLN N N 113.010 0.3 1 6 332 8 ASP H H 7.186 0.020 1 7 332 8 ASP C C 178.346 0.3 1 8 332 8 ASP CA C 55.539 0.3 1 9 332 8 ASP CB C 40.491 0.3 1 10 332 8 ASP N N 118.095 0.3 1 11 333 9 ALA H H 7.977 0.020 1 12 333 9 ALA C C 180.209 0.3 1 13 333 9 ALA CA C 54.036 0.3 1 14 333 9 ALA CB C 17.767 0.3 1 15 333 9 ALA N N 126.344 0.3 1 16 334 10 ILE H H 7.457 0.020 1 17 334 10 ILE C C 173.832 0.3 1 18 334 10 ILE CA C 62.758 0.3 1 19 334 10 ILE CB C 35.019 0.3 1 20 334 10 ILE N N 110.214 0.3 1 21 335 11 LYS H H 6.714 0.020 1 22 335 11 LYS C C 176.608 0.3 1 23 335 11 LYS CA C 54.800 0.3 1 24 335 11 LYS CB C 30.632 0.3 1 25 335 11 LYS N N 116.511 0.3 1 26 336 12 ASN H H 6.920 0.020 1 27 336 12 ASN C C 174.271 0.3 1 28 336 12 ASN CA C 49.802 0.3 1 29 336 12 ASN CB C 38.317 0.3 1 30 336 12 ASN N N 120.431 0.3 1 31 337 13 PRO C C 177.950 0.3 1 32 337 13 PRO CA C 63.780 0.3 1 33 337 13 PRO CB C 30.750 0.3 1 34 338 14 ALA H H 7.675 0.020 1 35 338 14 ALA C C 179.047 0.3 1 36 338 14 ALA CA C 53.323 0.3 1 37 338 14 ALA CB C 17.805 0.3 1 38 338 14 ALA N N 117.624 0.3 1 39 339 15 ILE H H 7.466 0.020 1 40 339 15 ILE C C 176.804 0.3 1 41 339 15 ILE CA C 58.072 0.3 1 42 339 15 ILE CB C 38.786 0.3 1 43 339 15 ILE N N 108.427 0.3 1 44 340 16 ILE H H 6.970 0.020 1 45 340 16 ILE C C 176.104 0.3 1 46 340 16 ILE CA C 63.818 0.3 1 47 340 16 ILE CB C 36.084 0.3 1 48 340 16 ILE N N 124.131 0.3 1 49 341 17 ASP H H 10.230 0.020 1 50 341 17 ASP C C 174.863 0.3 1 51 341 17 ASP CA C 55.155 0.3 1 52 341 17 ASP CB C 38.097 0.3 1 53 341 17 ASP N N 127.230 0.3 1 54 342 18 LYS H H 6.841 0.020 1 55 342 18 LYS C C 177.808 0.3 1 56 342 18 LYS CA C 54.914 0.3 1 57 342 18 LYS CB C 32.861 0.3 1 58 342 18 LYS N N 119.288 0.3 1 59 343 19 GLU H H 8.874 0.020 1 60 343 19 GLU C C 175.888 0.3 1 61 343 19 GLU CA C 56.887 0.3 1 62 343 19 GLU CB C 28.218 0.3 1 63 343 19 GLU N N 128.645 0.3 1 64 344 20 HIS H H 8.750 0.020 1 65 344 20 HIS C C 173.068 0.3 1 66 344 20 HIS CA C 52.670 0.3 1 67 344 20 HIS CB C 26.403 0.3 1 68 344 20 HIS N N 120.136 0.3 1 69 345 21 THR H H 7.560 0.020 1 70 345 21 THR C C 173.507 0.3 1 71 345 21 THR CA C 61.013 0.3 1 72 345 21 THR CB C 68.765 0.3 1 73 345 21 THR N N 115.894 0.3 1 74 346 22 ALA H H 8.212 0.020 1 75 346 22 ALA C C 176.272 0.3 1 76 346 22 ALA CA C 49.916 0.3 1 77 346 22 ALA CB C 20.675 0.3 1 78 346 22 ALA N N 127.486 0.3 1 79 347 23 ASP H H 8.263 0.020 1 80 347 23 ASP C C 176.382 0.3 1 81 347 23 ASP CA C 55.707 0.3 1 82 347 23 ASP CB C 40.018 0.3 1 83 347 23 ASP N N 119.544 0.3 1 84 348 24 ASN H H 7.818 0.020 1 85 348 24 ASN C C 172.707 0.3 1 86 348 24 ASN CA C 52.014 0.3 1 87 348 24 ASN CB C 39.241 0.3 1 88 348 24 ASN N N 117.333 0.3 1 89 349 25 TRP H H 8.041 0.020 1 90 349 25 TRP C C 175.754 0.3 1 91 349 25 TRP CA C 54.548 0.3 1 92 349 25 TRP CB C 31.208 0.3 1 93 349 25 TRP N N 122.256 0.3 1 94 350 26 ARG H H 9.079 0.020 1 95 350 26 ARG C C 172.489 0.3 1 96 350 26 ARG CA C 51.085 0.3 1 97 350 26 ARG CB C 31.825 0.3 1 98 350 26 ARG N N 121.423 0.3 1 99 351 27 PRO C C 175.470 0.3 1 100 351 27 PRO CA C 61.040 0.3 1 101 351 27 PRO CB C 31.150 0.3 1 102 352 28 ILE H H 8.388 0.020 1 103 352 28 ILE C C 172.668 0.3 1 104 352 28 ILE CA C 57.481 0.3 1 105 352 28 ILE CB C 40.649 0.3 1 106 352 28 ILE N N 116.548 0.3 1 107 353 29 ASP H H 8.450 0.020 1 108 353 29 ASP C C 175.439 0.3 1 109 353 29 ASP CA C 53.743 0.3 1 110 353 29 ASP CB C 41.095 0.3 1 111 353 29 ASP N N 127.821 0.3 1 112 354 30 PHE H H 8.057 0.020 1 113 354 30 PHE C C 173.501 0.3 1 114 354 30 PHE CA C 55.171 0.3 1 115 354 30 PHE CB C 41.091 0.3 1 116 354 30 PHE N N 113.540 0.3 1 117 355 31 GLN H H 8.652 0.020 1 118 355 31 GLN C C 174.704 0.3 1 119 355 31 GLN CA C 53.372 0.3 1 120 355 31 GLN CB C 32.025 0.3 1 121 355 31 GLN N N 117.706 0.3 1 122 356 32 MET H H 8.758 0.020 1 123 356 32 MET CA C 52.783 0.3 1 124 356 32 MET CB C 33.187 0.3 1 125 356 32 MET N N 120.922 0.3 1 126 357 33 LYS H H 9.611 0.020 1 127 357 33 LYS C C 175.909 0.3 1 128 357 33 LYS N N 125.329 0.3 1 129 360 36 LYS H H 7.568 0.020 1 130 360 36 LYS C C 177.076 0.3 1 131 360 36 LYS CA C 54.600 0.3 1 132 360 36 LYS CB C 31.211 0.3 1 133 360 36 LYS N N 119.276 0.3 1 134 361 37 GLY H H 7.997 0.020 1 135 361 37 GLY C C 174.052 0.3 1 136 361 37 GLY CA C 44.619 0.3 1 137 361 37 GLY N N 108.145 0.3 1 138 362 38 GLU H H 7.664 0.020 1 139 362 38 GLU C C 175.488 0.3 1 140 362 38 GLU CA C 53.400 0.3 1 141 362 38 GLU CB C 29.712 0.3 1 142 362 38 GLU N N 120.655 0.3 1 143 363 39 ARG H H 8.365 0.020 1 144 363 39 ARG C C 175.592 0.3 1 145 363 39 ARG CA C 56.313 0.3 1 146 363 39 ARG CB C 29.374 0.3 1 147 363 39 ARG N N 121.431 0.3 1 148 372 48 VAL H H 8.416 0.020 1 149 372 48 VAL C C 174.442 0.3 1 150 372 48 VAL CA C 62.168 0.3 1 151 372 48 VAL CB C 31.193 0.3 1 152 372 48 VAL N N 124.246 0.3 1 153 373 49 GLU H H 7.958 0.020 1 154 373 49 GLU C C 175.291 0.3 1 155 373 49 GLU CA C 51.652 0.3 1 156 373 49 GLU CB C 30.610 0.3 1 157 373 49 GLU N N 127.121 0.3 1 158 374 50 PRO C C 177.230 0.3 1 159 374 50 PRO CA C 62.750 0.3 1 160 374 50 PRO CB C 32.560 0.3 1 161 375 51 ALA H H 8.461 0.020 1 162 375 51 ALA C C 176.730 0.3 1 163 375 51 ALA CA C 50.885 0.3 1 164 375 51 ALA CB C 17.719 0.3 1 165 375 51 ALA N N 119.843 0.3 1 166 376 52 THR H H 8.160 0.020 1 167 376 52 THR C C 172.357 0.3 1 168 376 52 THR CA C 61.635 0.3 1 169 376 52 THR CB C 70.381 0.3 1 170 376 52 THR N N 117.229 0.3 1 171 377 53 VAL H H 9.181 0.020 1 172 377 53 VAL C C 173.373 0.3 1 173 377 53 VAL CA C 59.879 0.3 1 174 377 53 VAL CB C 31.242 0.3 1 175 377 53 VAL N N 127.100 0.3 1 176 378 54 ILE H H 9.190 0.020 1 177 378 54 ILE C C 174.536 0.3 1 178 378 54 ILE CA C 59.532 0.3 1 179 378 54 ILE CB C 38.695 0.3 1 180 378 54 ILE N N 127.763 0.3 1 181 379 55 PHE H H 7.096 0.020 1 182 379 55 PHE C C 176.860 0.3 1 183 379 55 PHE CA C 56.333 0.3 1 184 379 55 PHE CB C 37.684 0.3 1 185 379 55 PHE N N 125.588 0.3 1 186 380 56 THR H H 7.570 0.020 1 187 380 56 THR C C 176.156 0.3 1 188 380 56 THR CA C 59.209 0.3 1 189 380 56 THR CB C 71.802 0.3 1 190 380 56 THR N N 114.738 0.3 1 191 382 58 THR H H 7.831 0.020 1 192 382 58 THR C C 173.931 0.3 1 193 382 58 THR CA C 60.500 0.3 1 194 382 58 THR CB C 67.752 0.3 1 195 382 58 THR N N 107.489 0.3 1 196 383 59 GLY H H 7.137 0.020 1 197 383 59 GLY C C 170.904 0.3 1 198 383 59 GLY CA C 43.615 0.3 1 199 383 59 GLY N N 110.766 0.3 1 200 384 60 PRO C C 176.360 0.3 1 201 384 60 PRO CA C 61.710 0.3 1 202 384 60 PRO CB C 30.940 0.3 1 203 385 61 ILE H H 8.701 0.020 1 204 385 61 ILE C C 173.904 0.3 1 205 385 61 ILE CA C 57.996 0.3 1 206 385 61 ILE CB C 39.930 0.3 1 207 385 61 ILE N N 122.597 0.3 1 208 386 62 ILE H H 8.368 0.020 1 209 386 62 ILE C C 174.999 0.3 1 210 386 62 ILE CA C 55.634 0.3 1 211 386 62 ILE CB C 34.724 0.3 1 212 386 62 ILE N N 125.852 0.3 1 213 387 63 GLU H H 9.034 0.020 1 214 387 63 GLU C C 174.003 0.3 1 215 387 63 GLU CA C 53.298 0.3 1 216 387 63 GLU CB C 31.818 0.3 1 217 387 63 GLU N N 125.344 0.3 1 218 388 64 LEU H H 8.877 0.020 1 219 388 64 LEU C C 174.649 0.3 1 220 388 64 LEU CA C 51.566 0.3 1 221 388 64 LEU CB C 46.107 0.3 1 222 388 64 LEU N N 131.376 0.3 1 223 389 65 GLY H H 9.678 0.020 1 224 389 65 GLY C C 171.572 0.3 1 225 389 65 GLY CA C 43.742 0.3 1 226 389 65 GLY N N 113.911 0.3 1 227 390 66 LEU H H 8.942 0.020 1 228 390 66 LEU C C 176.619 0.3 1 229 390 66 LEU CA C 52.506 0.3 1 230 390 66 LEU CB C 40.889 0.3 1 231 390 66 LEU N N 126.786 0.3 1 232 391 67 LYS H H 7.958 0.020 1 233 391 67 LYS C C 176.444 0.3 1 234 391 67 LYS CA C 54.105 0.3 1 235 391 67 LYS CB C 32.292 0.3 1 236 391 67 LYS N N 120.548 0.3 1 237 392 68 THR H H 9.081 0.020 1 238 392 68 THR N N 115.885 0.3 1 239 393 69 ALA H H 8.519 0.020 1 240 393 69 ALA C C 177.846 0.3 1 241 393 69 ALA CA C 55.118 0.3 1 242 393 69 ALA CB C 18.974 0.3 1 243 393 69 ALA N N 123.066 0.3 1 244 394 70 SER H H 8.695 0.020 1 245 394 70 SER CA C 60.386 0.3 1 246 394 70 SER CB C 62.018 0.3 1 247 394 70 SER N N 109.742 0.3 1 248 395 71 THR H H 8.392 0.020 1 249 395 71 THR C C 174.782 0.3 1 250 395 71 THR CA C 61.216 0.3 1 251 395 71 THR CB C 69.325 0.3 1 252 395 71 THR N N 112.880 0.3 1 253 396 72 TRP H H 7.564 0.020 1 254 396 72 TRP C C 175.383 0.3 1 255 396 72 TRP CA C 57.710 0.3 1 256 396 72 TRP CB C 28.854 0.3 1 257 396 72 TRP N N 123.551 0.3 1 258 400 76 GLU H H 8.477 0.020 1 259 400 76 GLU C C 174.527 0.3 1 260 400 76 GLU CA C 53.430 0.3 1 261 400 76 GLU CB C 32.374 0.3 1 262 400 76 GLU N N 124.985 0.3 1 263 401 77 VAL H H 8.406 0.020 1 264 401 77 VAL C C 173.374 0.3 1 265 401 77 VAL CA C 59.782 0.3 1 266 401 77 VAL CB C 32.415 0.3 1 267 401 77 VAL N N 121.281 0.3 1 268 402 78 TYR H H 9.271 0.020 1 269 402 78 TYR C C 175.572 0.3 1 270 402 78 TYR CA C 55.755 0.3 1 271 402 78 TYR CB C 41.174 0.3 1 272 402 78 TYR N N 123.866 0.3 1 273 403 79 GLU H H 8.629 0.020 1 274 403 79 GLU C C 176.910 0.3 1 275 403 79 GLU CA C 53.873 0.3 1 276 403 79 GLU CB C 30.600 0.3 1 277 403 79 GLU N N 123.753 0.3 1 278 404 80 GLY H H 8.856 0.020 1 279 404 80 GLY C C 174.240 0.3 1 280 404 80 GLY CA C 46.378 0.3 1 281 404 80 GLY N N 118.870 0.3 1 282 405 81 ASP H H 8.632 0.020 1 283 405 81 ASP C C 175.718 0.3 1 284 405 81 ASP CA C 53.430 0.3 1 285 405 81 ASP CB C 39.945 0.3 1 286 405 81 ASP N N 126.276 0.3 1 287 406 82 LYS H H 8.037 0.020 1 288 406 82 LYS C C 174.490 0.3 1 289 406 82 LYS CA C 54.924 0.3 1 290 406 82 LYS CB C 32.280 0.3 1 291 406 82 LYS N N 122.854 0.3 1 292 407 83 LYS H H 8.393 0.020 1 293 407 83 LYS C C 176.489 0.3 1 294 407 83 LYS CA C 56.281 0.3 1 295 407 83 LYS CB C 31.348 0.3 1 296 407 83 LYS N N 128.671 0.3 1 297 408 84 LEU H H 8.894 0.020 1 298 408 84 LEU C C 174.936 0.3 1 299 408 84 LEU CA C 51.566 0.3 1 300 408 84 LEU CB C 39.915 0.3 1 301 408 84 LEU N N 130.513 0.3 1 302 409 85 PRO C C 175.450 0.3 1 303 409 85 PRO CA C 61.470 0.3 1 304 409 85 PRO CB C 29.360 0.3 1 305 410 86 VAL H H 7.802 0.020 1 306 410 86 VAL C C 175.772 0.3 1 307 410 86 VAL CA C 60.750 0.3 1 308 410 86 VAL CB C 32.804 0.3 1 309 410 86 VAL N N 124.208 0.3 1 310 411 87 GLU H H 8.989 0.020 1 311 411 87 GLU C C 175.122 0.3 1 312 411 87 GLU CA C 53.371 0.3 1 313 411 87 GLU CB C 31.676 0.3 1 314 411 87 GLU N N 128.404 0.3 1 315 412 88 LEU H H 8.764 0.020 1 316 412 88 LEU C C 176.069 0.3 1 317 412 88 LEU CA C 53.472 0.3 1 318 412 88 LEU CB C 40.554 0.3 1 319 412 88 LEU N N 128.555 0.3 1 320 413 89 VAL H H 8.472 0.020 1 321 413 89 VAL C C 175.387 0.3 1 322 413 89 VAL CA C 60.968 0.3 1 323 413 89 VAL CB C 31.131 0.3 1 324 413 89 VAL N N 120.498 0.3 1 325 414 90 SER H H 6.942 0.020 1 326 414 90 SER C C 172.237 0.3 1 327 414 90 SER CA C 57.827 0.3 1 328 414 90 SER CB C 62.249 0.3 1 329 414 90 SER N N 110.322 0.3 1 330 415 91 TYR H H 8.118 0.020 1 331 415 91 TYR C C 172.806 0.3 1 332 415 91 TYR CA C 54.736 0.3 1 333 415 91 TYR CB C 40.575 0.3 1 334 415 91 TYR N N 127.589 0.3 1 335 416 92 ASP H H 8.974 0.020 1 336 416 92 ASP C C 175.991 0.3 1 337 416 92 ASP CA C 51.685 0.3 1 338 416 92 ASP CB C 40.524 0.3 1 339 416 92 ASP N N 129.238 0.3 1 340 417 93 SER H H 8.458 0.020 1 341 417 93 SER C C 176.049 0.3 1 342 417 93 SER CA C 59.854 0.3 1 343 417 93 SER CB C 62.198 0.3 1 344 417 93 SER N N 122.769 0.3 1 345 418 94 ASP H H 8.158 0.020 1 346 418 94 ASP C C 177.686 0.3 1 347 418 94 ASP CA C 55.781 0.3 1 348 418 94 ASP CB C 40.986 0.3 1 349 418 94 ASP N N 123.506 0.3 1 350 419 95 LYS H H 7.102 0.020 1 351 419 95 LYS C C 176.341 0.3 1 352 419 95 LYS CA C 55.106 0.3 1 353 419 95 LYS CB C 30.957 0.3 1 354 419 95 LYS N N 115.372 0.3 1 355 420 96 ASP H H 8.058 0.020 1 356 420 96 ASP C C 175.230 0.3 1 357 420 96 ASP CA C 54.616 0.3 1 358 420 96 ASP CB C 38.228 0.3 1 359 420 96 ASP N N 119.808 0.3 1 360 421 97 TYR H H 6.997 0.020 1 361 421 97 TYR C C 174.913 0.3 1 362 421 97 TYR CA C 51.672 0.3 1 363 421 97 TYR CB C 38.817 0.3 1 364 421 97 TYR N N 116.460 0.3 1 365 423 99 TYR H H 8.408 0.020 1 366 423 99 TYR C C 174.423 0.3 1 367 423 99 TYR CA C 56.904 0.3 1 368 423 99 TYR CB C 38.080 0.3 1 369 423 99 TYR N N 119.010 0.3 1 370 424 100 ILE H H 8.671 0.020 1 371 424 100 ILE CA C 56.894 0.3 1 372 424 100 ILE CB C 39.885 0.3 1 373 424 100 ILE N N 119.605 0.3 1 374 425 101 ARG H H 9.044 0.020 1 375 425 101 ARG C C 176.300 0.3 1 376 425 101 ARG CA C 53.197 0.3 1 377 425 101 ARG CB C 34.048 0.3 1 378 425 101 ARG N N 119.330 0.3 1 379 426 102 PHE H H 8.172 0.020 1 380 426 102 PHE C C 171.223 0.3 1 381 426 102 PHE CA C 52.790 0.3 1 382 426 102 PHE CB C 37.821 0.3 1 383 426 102 PHE N N 116.233 0.3 1 384 427 103 PRO C C 175.820 0.3 1 385 427 103 PRO CA C 61.440 0.3 1 386 427 103 PRO CB C 31.130 0.3 1 387 428 104 VAL H H 7.213 0.020 1 388 428 104 VAL C C 175.658 0.3 1 389 428 104 VAL CA C 57.740 0.3 1 390 428 104 VAL CB C 34.120 0.3 1 391 428 104 VAL N N 109.335 0.3 1 392 429 105 SER H H 9.311 0.020 1 393 429 105 SER C C 175.546 0.3 1 394 429 105 SER CA C 57.978 0.3 1 395 429 105 SER CB C 62.303 0.3 1 396 429 105 SER N N 118.248 0.3 1 397 430 106 ASN H H 8.622 0.020 1 398 430 106 ASN C C 177.043 0.3 1 399 430 106 ASN CA C 54.557 0.3 1 400 430 106 ASN CB C 38.176 0.3 1 401 430 106 ASN N N 122.209 0.3 1 402 431 107 GLY H H 9.513 0.020 1 403 431 107 GLY C C 174.208 0.3 1 404 431 107 GLY CA C 43.998 0.3 1 405 431 107 GLY N N 115.265 0.3 1 406 432 108 THR H H 7.748 0.020 1 407 432 108 THR C C 173.358 0.3 1 408 432 108 THR CA C 65.060 0.3 1 409 432 108 THR CB C 68.652 0.3 1 410 432 108 THR N N 120.876 0.3 1 411 433 109 ARG H H 9.134 0.020 1 412 433 109 ARG CA C 55.232 0.3 1 413 433 109 ARG CB C 31.783 0.3 1 414 433 109 ARG N N 126.120 0.3 1 415 434 110 GLU H H 7.717 0.020 1 416 434 110 GLU CA C 53.367 0.3 1 417 434 110 GLU CB C 31.147 0.3 1 418 434 110 GLU N N 116.699 0.3 1 419 435 111 VAL H H 8.479 0.020 1 420 435 111 VAL C C 173.190 0.3 1 421 435 111 VAL CA C 59.118 0.3 1 422 435 111 VAL CB C 34.067 0.3 1 423 435 111 VAL N N 113.040 0.3 1 424 436 112 LYS H H 8.738 0.020 1 425 436 112 LYS C C 174.500 0.3 1 426 436 112 LYS CA C 53.900 0.3 1 427 436 112 LYS CB C 33.505 0.3 1 428 436 112 LYS N N 123.606 0.3 1 429 437 113 ILE H H 9.126 0.020 1 430 437 113 ILE CA C 58.149 0.3 1 431 437 113 ILE CB C 39.820 0.3 1 432 437 113 ILE N N 126.158 0.3 1 433 438 114 VAL H H 8.926 0.020 1 434 438 114 VAL C C 174.708 0.3 1 435 438 114 VAL N N 133.167 0.3 1 436 442 118 GLU H H 8.679 0.020 1 437 442 118 GLU C C 174.461 0.3 1 438 442 118 GLU CA C 55.104 0.3 1 439 442 118 GLU CB C 31.449 0.3 1 440 442 118 GLU N N 123.816 0.3 1 441 443 119 TYR H H 8.270 0.020 1 442 443 119 TYR CA C 56.069 0.3 1 443 443 119 TYR CB C 38.522 0.3 1 444 443 119 TYR N N 123.402 0.3 1 445 444 120 GLY H H 8.270 0.020 1 446 444 120 GLY C C 174.423 0.3 1 447 444 120 GLY CA C 44.864 0.3 1 448 444 120 GLY N N 108.749 0.3 1 449 445 121 GLU H H 8.335 0.020 1 450 445 121 GLU C C 176.355 0.3 1 451 445 121 GLU CA C 55.753 0.3 1 452 445 121 GLU CB C 27.559 0.3 1 453 445 121 GLU N N 122.676 0.3 1 454 446 122 ASN H H 8.105 0.020 1 455 446 122 ASN C C 174.395 0.3 1 456 446 122 ASN CA C 53.387 0.3 1 457 446 122 ASN CB C 37.617 0.3 1 458 446 122 ASN N N 116.517 0.3 1 459 447 123 ILE H H 7.602 0.020 1 460 447 123 ILE C C 174.965 0.3 1 461 447 123 ILE CA C 60.412 0.3 1 462 447 123 ILE CB C 35.822 0.3 1 463 447 123 ILE N N 120.540 0.3 1 464 448 124 HIS H H 8.232 0.020 1 465 448 124 HIS C C 173.796 0.3 1 466 448 124 HIS CA C 53.870 0.3 1 467 448 124 HIS CB C 29.409 0.3 1 468 448 124 HIS N N 124.918 0.3 1 469 449 125 GLU H H 8.256 0.020 1 470 449 125 GLU C C 174.051 0.3 1 471 449 125 GLU CA C 54.542 0.3 1 472 449 125 GLU CB C 31.196 0.3 1 473 449 125 GLU N N 125.135 0.3 1 474 450 126 ASP H H 8.401 0.020 1 475 450 126 ASP C C 174.844 0.3 1 476 450 126 ASP CA C 53.475 0.3 1 477 450 126 ASP CB C 41.964 0.3 1 478 450 126 ASP N N 123.551 0.3 1 479 456 132 MET H H 9.036 0.020 1 480 456 132 MET C C 173.574 0.3 1 481 456 132 MET CA C 53.974 0.3 1 482 456 132 MET CB C 31.756 0.3 1 483 456 132 MET N N 129.830 0.3 1 484 457 133 VAL H H 8.764 0.020 1 485 457 133 VAL C C 177.677 0.3 1 486 457 133 VAL CA C 60.384 0.3 1 487 457 133 VAL CB C 31.774 0.3 1 488 457 133 VAL N N 126.311 0.3 1 489 458 134 PHE H H 8.662 0.020 1 490 458 134 PHE C C 176.858 0.3 1 491 458 134 PHE CA C 58.652 0.3 1 492 458 134 PHE CB C 39.931 0.3 1 493 458 134 PHE N N 129.109 0.3 1 494 459 135 ALA H H 8.502 0.020 1 495 459 135 ALA C C 176.686 0.3 1 496 459 135 ALA CA C 53.753 0.3 1 497 459 135 ALA CB C 18.921 0.3 1 498 459 135 ALA N N 122.484 0.3 1 499 460 136 GLN H H 7.706 0.020 1 500 460 136 GLN CA C 51.664 0.3 1 501 460 136 GLN CB C 29.098 0.3 1 502 460 136 GLN N N 112.136 0.3 1 503 461 137 PRO C C 176.270 0.3 1 504 461 137 PRO CA C 61.570 0.3 1 505 461 137 PRO CB C 30.020 0.3 1 506 462 138 ILE H H 8.657 0.020 1 507 462 138 ILE C C 176.266 0.3 1 508 462 138 ILE CA C 58.260 0.3 1 509 462 138 ILE CB C 33.561 0.3 1 510 462 138 ILE N N 124.235 0.3 1 511 463 139 THR H H 7.662 0.020 1 512 463 139 THR C C 175.806 0.3 1 513 463 139 THR CA C 58.628 0.3 1 514 463 139 THR CB C 70.329 0.3 1 515 463 139 THR N N 117.290 0.3 1 516 464 140 ASN H H 8.360 0.020 1 517 464 140 ASN C C 173.875 0.3 1 518 464 140 ASN CA C 51.009 0.3 1 519 464 140 ASN CB C 38.843 0.3 1 520 464 140 ASN N N 120.334 0.3 1 521 465 141 ASN H H 6.829 0.020 1 522 465 141 ASN C C 173.433 0.3 1 523 465 141 ASN CA C 48.151 0.3 1 524 465 141 ASN CB C 38.768 0.3 1 525 465 141 ASN N N 116.520 0.3 1 526 466 142 PRO C C 177.210 0.3 1 527 466 142 PRO CA C 63.530 0.3 1 528 466 142 PRO CB C 29.730 0.3 1 529 467 143 ASP H H 7.398 0.020 1 530 467 143 ASP C C 176.822 0.3 1 531 467 143 ASP CA C 55.027 0.3 1 532 467 143 ASP CB C 38.848 0.3 1 533 467 143 ASP N N 113.657 0.3 1 534 468 144 ASP H H 7.754 0.020 1 535 468 144 ASP C C 174.991 0.3 1 536 468 144 ASP CA C 54.605 0.3 1 537 468 144 ASP CB C 38.790 0.3 1 538 468 144 ASP N N 118.575 0.3 1 539 469 145 TYR H H 7.584 0.020 1 540 469 145 TYR C C 176.233 0.3 1 541 469 145 TYR CA C 55.736 0.3 1 542 469 145 TYR CB C 39.410 0.3 1 543 469 145 TYR N N 120.381 0.3 1 544 470 146 VAL H H 8.027 0.020 1 545 470 146 VAL C C 175.675 0.3 1 546 470 146 VAL CA C 61.025 0.3 1 547 470 146 VAL CB C 31.215 0.3 1 548 470 146 VAL N N 119.323 0.3 1 549 471 147 ASP H H 7.983 0.020 1 550 471 147 ASP C C 175.256 0.3 1 551 471 147 ASP CA C 52.250 0.3 1 552 471 147 ASP CB C 40.096 0.3 1 553 471 147 ASP N N 121.238 0.3 1 554 472 148 GLU H H 8.557 0.020 1 555 472 148 GLU C C 177.691 0.3 1 556 472 148 GLU CA C 59.217 0.3 1 557 472 148 GLU CB C 28.253 0.3 1 558 472 148 GLU N N 120.187 0.3 1 559 473 149 GLU H H 8.245 0.020 1 560 473 149 GLU C C 179.337 0.3 1 561 473 149 GLU CA C 58.827 0.3 1 562 473 149 GLU N N 119.751 0.3 1 563 474 150 THR H H 8.287 0.020 1 564 474 150 THR CA C 65.806 0.3 1 565 474 150 THR CB C 66.892 0.3 1 566 474 150 THR N N 119.380 0.3 1 567 475 151 TYR H H 8.871 0.020 1 568 475 151 TYR C C 178.015 0.3 1 569 475 151 TYR CA C 61.067 0.3 1 570 475 151 TYR CB C 37.655 0.3 1 571 475 151 TYR N N 124.428 0.3 1 572 476 152 ASN H H 8.394 0.020 1 573 476 152 ASN CA C 55.180 0.3 1 574 476 152 ASN CB C 37.225 0.3 1 575 476 152 ASN N N 117.781 0.3 1 576 477 153 LEU H H 8.073 0.020 1 577 477 153 LEU CA C 57.365 0.3 1 578 477 153 LEU CB C 40.098 0.3 1 579 477 153 LEU N N 123.559 0.3 1 580 478 154 GLN H H 8.244 0.020 1 581 478 154 GLN C C 179.540 0.3 1 582 478 154 GLN CA C 58.101 0.3 1 583 478 154 GLN CB C 26.215 0.3 1 584 478 154 GLN N N 116.763 0.3 1 585 479 155 LYS H H 7.365 0.020 1 586 479 155 LYS C C 179.940 0.3 1 587 479 155 LYS CA C 57.955 0.3 1 588 479 155 LYS CB C 30.560 0.3 1 589 479 155 LYS N N 118.566 0.3 1 590 480 156 LEU H H 7.671 0.020 1 591 480 156 LEU C C 178.868 0.3 1 592 480 156 LEU CA C 56.382 0.3 1 593 480 156 LEU CB C 40.910 0.3 1 594 480 156 LEU N N 121.238 0.3 1 595 481 157 LEU H H 7.682 0.020 1 596 481 157 LEU C C 176.263 0.3 1 597 481 157 LEU CA C 53.991 0.3 1 598 481 157 LEU CB C 41.651 0.3 1 599 481 157 LEU N N 115.346 0.3 1 600 482 158 ALA H H 7.049 0.020 1 601 482 158 ALA C C 176.797 0.3 1 602 482 158 ALA CA C 56.271 0.3 1 603 482 158 ALA CB C 14.471 0.3 1 604 482 158 ALA N N 122.527 0.3 1 605 483 159 PRO C C 180.400 0.3 1 606 483 159 PRO CA C 65.700 0.3 1 607 483 159 PRO CB C 29.370 0.3 1 608 484 160 TYR H H 8.217 0.020 1 609 484 160 TYR CA C 59.833 0.3 1 610 484 160 TYR CB C 36.973 0.3 1 611 484 160 TYR N N 120.099 0.3 1 612 485 161 HIS H H 8.341 0.020 1 613 485 161 HIS C C 176.443 0.3 1 614 485 161 HIS CA C 56.614 0.3 1 615 485 161 HIS CB C 28.230 0.3 1 616 485 161 HIS N N 118.382 0.3 1 617 486 162 LYS H H 7.616 0.020 1 618 486 162 LYS C C 176.042 0.3 1 619 486 162 LYS CA C 55.730 0.3 1 620 486 162 LYS CB C 31.696 0.3 1 621 486 162 LYS N N 117.770 0.3 1 622 487 163 ALA H H 7.154 0.020 1 623 487 163 ALA C C 178.123 0.3 1 624 487 163 ALA CA C 52.154 0.3 1 625 487 163 ALA CB C 17.772 0.3 1 626 487 163 ALA N N 123.251 0.3 1 627 488 164 LYS H H 8.769 0.020 1 628 488 164 LYS C C 176.611 0.3 1 629 488 164 LYS CB C 32.949 0.3 1 630 488 164 LYS N N 122.719 0.3 1 631 489 165 THR H H 7.186 0.020 1 632 489 165 THR C C 174.787 0.3 1 633 489 165 THR CA C 58.008 0.3 1 634 489 165 THR CB C 69.522 0.3 1 635 489 165 THR N N 106.659 0.3 1 636 490 166 LEU H H 9.595 0.020 1 637 490 166 LEU C C 179.057 0.3 1 638 490 166 LEU CA C 57.589 0.3 1 639 490 166 LEU CB C 41.569 0.3 1 640 490 166 LEU N N 125.864 0.3 1 641 491 167 GLU H H 10.087 0.020 1 642 491 167 GLU C C 179.715 0.3 1 643 491 167 GLU CA C 61.016 0.3 1 644 491 167 GLU CB C 27.578 0.3 1 645 491 167 GLU N N 120.255 0.3 1 646 492 168 ARG H H 8.027 0.020 1 647 492 168 ARG C C 178.617 0.3 1 648 492 168 ARG CA C 55.832 0.3 1 649 492 168 ARG CB C 28.297 0.3 1 650 492 168 ARG N N 120.413 0.3 1 651 493 169 GLN H H 8.395 0.020 1 652 493 169 GLN C C 178.422 0.3 1 653 493 169 GLN CA C 60.316 0.3 1 654 493 169 GLN CB C 27.737 0.3 1 655 493 169 GLN N N 121.644 0.3 1 656 494 170 VAL H H 8.481 0.020 1 657 494 170 VAL C C 176.766 0.3 1 658 494 170 VAL CA C 67.022 0.3 1 659 494 170 VAL CB C 30.063 0.3 1 660 494 170 VAL N N 118.842 0.3 1 661 495 171 TYR H H 7.459 0.020 1 662 495 171 TYR C C 178.301 0.3 1 663 495 171 TYR CA C 60.477 0.3 1 664 495 171 TYR CB C 37.349 0.3 1 665 495 171 TYR N N 119.815 0.3 1 666 496 172 GLU H H 8.741 0.020 1 667 496 172 GLU C C 181.308 0.3 1 668 496 172 GLU CA C 56.469 0.3 1 669 496 172 GLU CB C 27.653 0.3 1 670 496 172 GLU N N 116.104 0.3 1 671 497 173 LEU H H 8.672 0.020 1 672 497 173 LEU C C 180.159 0.3 1 673 497 173 LEU CA C 56.950 0.3 1 674 497 173 LEU CB C 42.222 0.3 1 675 497 173 LEU N N 121.933 0.3 1 676 498 174 GLU H H 8.720 0.020 1 677 498 174 GLU CA C 59.209 0.3 1 678 498 174 GLU CB C 28.016 0.3 1 679 498 174 GLU N N 123.082 0.3 1 680 499 175 LYS H H 7.404 0.020 1 681 499 175 LYS C C 179.182 0.3 1 682 499 175 LYS CA C 57.474 0.3 1 683 499 175 LYS CB C 30.629 0.3 1 684 499 175 LYS N N 118.935 0.3 1 685 500 176 LEU H H 7.553 0.020 1 686 500 176 LEU C C 178.560 0.3 1 687 500 176 LEU CA C 56.190 0.3 1 688 500 176 LEU CB C 41.020 0.3 1 689 500 176 LEU N N 117.881 0.3 1 690 501 177 GLN H H 7.070 0.020 1 691 501 177 GLN C C 177.069 0.3 1 692 501 177 GLN CA C 58.070 0.3 1 693 501 177 GLN CB C 27.649 0.3 1 694 501 177 GLN N N 115.552 0.3 1 695 502 178 GLU H H 7.538 0.020 1 696 502 178 GLU C C 177.195 0.3 1 697 502 178 GLU CA C 56.322 0.3 1 698 502 178 GLU CB C 28.737 0.3 1 699 502 178 GLU N N 113.549 0.3 1 700 503 179 LYS H H 7.287 0.020 1 701 503 179 LYS C C 176.618 0.3 1 702 503 179 LYS CA C 55.199 0.3 1 703 503 179 LYS CB C 33.945 0.3 1 704 503 179 LYS N N 116.605 0.3 1 705 504 180 LEU H H 7.270 0.020 1 706 504 180 LEU C C 174.613 0.3 1 707 504 180 LEU CA C 52.798 0.3 1 708 504 180 LEU CB C 41.683 0.3 1 709 504 180 LEU N N 119.697 0.3 1 710 505 181 PRO C C 177.520 0.3 1 711 505 181 PRO CA C 61.630 0.3 1 712 505 181 PRO CB C 30.730 0.3 1 713 506 182 GLU H H 8.550 0.020 1 714 506 182 GLU C C 178.486 0.3 1 715 506 182 GLU CA C 59.279 0.3 1 716 506 182 GLU CB C 28.234 0.3 1 717 506 182 GLU N N 123.679 0.3 1 718 507 183 LYS H H 8.416 0.020 1 719 507 183 LYS C C 176.698 0.3 1 720 507 183 LYS CA C 57.727 0.3 1 721 507 183 LYS CB C 30.562 0.3 1 722 507 183 LYS N N 115.996 0.3 1 723 508 184 TYR H H 7.588 0.020 1 724 508 184 TYR C C 176.024 0.3 1 725 508 184 TYR CA C 57.513 0.3 1 726 508 184 TYR CB C 39.996 0.3 1 727 508 184 TYR N N 116.126 0.3 1 728 509 185 LYS H H 7.489 0.020 1 729 509 185 LYS C C 178.986 0.3 1 730 509 185 LYS CA C 60.470 0.3 1 731 509 185 LYS CB C 31.751 0.3 1 732 509 185 LYS N N 120.072 0.3 1 733 510 186 ALA H H 8.752 0.020 1 734 510 186 ALA C C 181.092 0.3 1 735 510 186 ALA CA C 55.067 0.3 1 736 510 186 ALA CB C 16.280 0.3 1 737 510 186 ALA N N 121.984 0.3 1 738 511 187 GLU H H 8.438 0.020 1 739 511 187 GLU C C 179.226 0.3 1 740 511 187 GLU CA C 58.095 0.3 1 741 511 187 GLU CB C 27.755 0.3 1 742 511 187 GLU N N 120.491 0.3 1 743 512 188 TYR H H 7.514 0.020 1 744 512 188 TYR C C 178.269 0.3 1 745 512 188 TYR CA C 62.063 0.3 1 746 512 188 TYR CB C 36.792 0.3 1 747 512 188 TYR N N 117.333 0.3 1 748 513 189 LYS H H 8.586 0.020 1 749 513 189 LYS C C 178.002 0.3 1 750 513 189 LYS CA C 58.620 0.3 1 751 513 189 LYS CB C 30.404 0.3 1 752 513 189 LYS N N 128.478 0.3 1 753 514 190 LYS H H 7.487 0.020 1 754 514 190 LYS C C 179.435 0.3 1 755 514 190 LYS CA C 58.708 0.3 1 756 514 190 LYS CB C 30.064 0.3 1 757 514 190 LYS N N 120.354 0.3 1 758 515 191 LYS H H 7.356 0.020 1 759 515 191 LYS C C 179.809 0.3 1 760 515 191 LYS CA C 58.077 0.3 1 761 515 191 LYS CB C 30.629 0.3 1 762 515 191 LYS N N 117.907 0.3 1 763 516 192 LEU H H 7.956 0.020 1 764 516 192 LEU C C 176.842 0.3 1 765 516 192 LEU CA C 57.958 0.3 1 766 516 192 LEU CB C 39.378 0.3 1 767 516 192 LEU N N 125.262 0.3 1 768 517 193 ASP H H 8.401 0.020 1 769 517 193 ASP C C 179.399 0.3 1 770 517 193 ASP CA C 57.226 0.3 1 771 517 193 ASP CB C 38.792 0.3 1 772 517 193 ASP N N 121.277 0.3 1 773 518 194 GLN H H 8.193 0.020 1 774 518 194 GLN C C 178.838 0.3 1 775 518 194 GLN CA C 57.663 0.3 1 776 518 194 GLN CB C 27.118 0.3 1 777 518 194 GLN N N 118.658 0.3 1 778 519 195 THR H H 8.334 0.020 1 779 519 195 THR CA C 66.004 0.3 1 780 519 195 THR CB C 67.440 0.3 1 781 519 195 THR N N 118.393 0.3 1 782 520 196 ARG H H 8.545 0.020 1 783 520 196 ARG C C 179.714 0.3 1 784 520 196 ARG CA C 60.335 0.3 1 785 520 196 ARG CB C 28.877 0.3 1 786 520 196 ARG N N 121.708 0.3 1 787 521 197 VAL H H 7.299 0.020 1 788 521 197 VAL C C 177.799 0.3 1 789 521 197 VAL CA C 65.656 0.3 1 790 521 197 VAL CB C 30.337 0.3 1 791 521 197 VAL N N 121.406 0.3 1 792 522 198 GLU H H 7.723 0.020 1 793 522 198 GLU C C 180.184 0.3 1 794 522 198 GLU CA C 58.687 0.3 1 795 522 198 GLU CB C 28.302 0.3 1 796 522 198 GLU N N 121.318 0.3 1 797 523 199 LEU H H 8.599 0.020 1 798 523 199 LEU C C 177.077 0.3 1 799 523 199 LEU CA C 56.966 0.3 1 800 523 199 LEU CB C 39.367 0.3 1 801 523 199 LEU N N 121.668 0.3 1 802 524 200 ALA H H 7.973 0.020 1 803 524 200 ALA C C 181.090 0.3 1 804 524 200 ALA CA C 54.360 0.3 1 805 524 200 ALA CB C 16.459 0.3 1 806 524 200 ALA N N 121.851 0.3 1 807 525 201 ASP H H 8.160 0.020 1 808 525 201 ASP C C 178.827 0.3 1 809 525 201 ASP CA C 56.334 0.3 1 810 525 201 ASP CB C 39.848 0.3 1 811 525 201 ASP N N 118.620 0.3 1 812 526 202 GLN H H 8.123 0.020 1 813 526 202 GLN C C 178.302 0.3 1 814 526 202 GLN CA C 59.259 0.3 1 815 526 202 GLN CB C 29.955 0.3 1 816 526 202 GLN N N 124.664 0.3 1 817 527 203 VAL H H 8.504 0.020 1 818 527 203 VAL C C 179.133 0.3 1 819 527 203 VAL CA C 64.813 0.3 1 820 527 203 VAL CB C 30.809 0.3 1 821 527 203 VAL N N 119.986 0.3 1 822 528 204 LYS H H 8.157 0.020 1 823 528 204 LYS C C 180.381 0.3 1 824 528 204 LYS CA C 58.759 0.3 1 825 528 204 LYS CB C 31.168 0.3 1 826 528 204 LYS N N 120.875 0.3 1 827 529 205 SER H H 8.216 0.020 1 828 529 205 SER C C 175.997 0.3 1 829 529 205 SER CA C 60.366 0.3 1 830 529 205 SER CB C 61.947 0.3 1 831 529 205 SER N N 114.653 0.3 1 832 530 206 ALA H H 7.628 0.020 1 833 530 206 ALA C C 180.190 0.3 1 834 530 206 ALA CA C 55.133 0.3 1 835 530 206 ALA CB C 17.198 0.3 1 836 530 206 ALA N N 125.650 0.3 1 837 531 207 VAL H H 7.342 0.020 1 838 531 207 VAL C C 177.561 0.3 1 839 531 207 VAL CA C 66.041 0.3 1 840 531 207 VAL CB C 30.568 0.3 1 841 531 207 VAL N N 118.943 0.3 1 842 532 208 THR H H 6.893 0.020 1 843 532 208 THR C C 176.740 0.3 1 844 532 208 THR CA C 62.788 0.3 1 845 532 208 THR CB C 68.019 0.3 1 846 532 208 THR N N 108.373 0.3 1 847 533 209 GLU H H 8.506 0.020 1 848 533 209 GLU C C 176.950 0.3 1 849 533 209 GLU CA C 56.258 0.3 1 850 533 209 GLU CB C 30.624 0.3 1 851 533 209 GLU N N 116.387 0.3 1 852 534 210 PHE H H 8.269 0.020 1 853 534 210 PHE C C 176.571 0.3 1 854 534 210 PHE CA C 60.740 0.3 1 855 534 210 PHE CB C 41.642 0.3 1 856 534 210 PHE N N 119.622 0.3 1 857 535 211 GLU H H 8.926 0.020 1 858 535 211 GLU C C 177.257 0.3 1 859 535 211 GLU CA C 61.043 0.3 1 860 535 211 GLU CB C 29.494 0.3 1 861 535 211 GLU N N 126.255 0.3 1 862 536 212 ASN H H 8.492 0.020 1 863 536 212 ASN C C 174.484 0.3 1 864 536 212 ASN CA C 51.071 0.3 1 865 536 212 ASN CB C 37.572 0.3 1 866 536 212 ASN N N 114.770 0.3 1 867 537 213 VAL H H 5.987 0.020 1 868 537 213 VAL CA C 60.399 0.3 1 869 537 213 VAL CB C 32.290 0.3 1 870 537 213 VAL N N 121.127 0.3 1 871 538 214 THR H H 8.321 0.020 1 872 538 214 THR C C 172.550 0.3 1 873 538 214 THR CA C 59.300 0.3 1 874 538 214 THR CB C 68.414 0.3 1 875 538 214 THR N N 125.418 0.3 1 876 539 215 PRO C C 176.110 0.3 1 877 539 215 PRO CA C 61.000 0.3 1 878 539 215 PRO CB C 30.640 0.3 1 879 540 216 THR H H 8.375 0.020 1 880 540 216 THR C C 176.517 0.3 1 881 540 216 THR CA C 62.718 0.3 1 882 540 216 THR CB C 68.074 0.3 1 883 540 216 THR N N 111.801 0.3 1 884 541 217 ASN H H 8.928 0.020 1 885 541 217 ASN C C 174.961 0.3 1 886 541 217 ASN CA C 53.600 0.3 1 887 541 217 ASN CB C 36.144 0.3 1 888 541 217 ASN N N 116.039 0.3 1 889 542 218 ASP H H 7.231 0.020 1 890 542 218 ASP CA C 55.116 0.3 1 891 542 218 ASP CB C 42.370 0.3 1 892 542 218 ASP N N 117.607 0.3 1 893 543 219 GLN H H 8.282 0.020 1 894 543 219 GLN C C 174.600 0.3 1 895 543 219 GLN CA C 53.790 0.3 1 896 543 219 GLN CB C 27.584 0.3 1 897 543 219 GLN N N 120.199 0.3 1 898 544 220 LEU H H 7.939 0.020 1 899 544 220 LEU C C 176.739 0.3 1 900 544 220 LEU CA C 53.594 0.3 1 901 544 220 LEU CB C 40.605 0.3 1 902 544 220 LEU N N 125.396 0.3 1 903 545 221 THR H H 8.268 0.020 1 904 545 221 THR C C 173.125 0.3 1 905 545 221 THR CA C 59.256 0.3 1 906 545 221 THR CB C 70.476 0.3 1 907 545 221 THR N N 113.939 0.3 1 908 546 222 ASP H H 8.565 0.020 1 909 546 222 ASP C C 174.657 0.3 1 910 546 222 ASP CA C 53.907 0.3 1 911 546 222 ASP CB C 38.186 0.3 1 912 546 222 ASP N N 119.789 0.3 1 913 547 223 LEU H H 7.696 0.020 1 914 547 223 LEU C C 178.956 0.3 1 915 547 223 LEU CA C 55.655 0.3 1 916 547 223 LEU CB C 40.761 0.3 1 917 547 223 LEU N N 119.842 0.3 1 918 548 224 GLN H H 8.865 0.020 1 919 548 224 GLN C C 174.912 0.3 1 920 548 224 GLN CA C 53.416 0.3 1 921 548 224 GLN CB C 30.819 0.3 1 922 548 224 GLN N N 124.361 0.3 1 923 549 225 GLU H H 8.831 0.020 1 924 549 225 GLU C C 174.986 0.3 1 925 549 225 GLU CA C 57.476 0.3 1 926 549 225 GLU CB C 28.862 0.3 1 927 549 225 GLU N N 125.696 0.3 1 928 550 226 ALA H H 8.408 0.020 1 929 550 226 ALA C C 175.204 0.3 1 930 550 226 ALA CA C 49.240 0.3 1 931 550 226 ALA CB C 21.296 0.3 1 932 550 226 ALA N N 129.367 0.3 1 933 551 227 HIS H H 8.945 0.020 1 934 551 227 HIS C C 171.507 0.3 1 935 551 227 HIS CA C 54.548 0.3 1 936 551 227 HIS CB C 26.984 0.3 1 937 551 227 HIS N N 121.800 0.3 1 938 552 228 PHE H H 8.024 0.020 1 939 552 228 PHE C C 175.270 0.3 1 940 552 228 PHE CA C 54.480 0.3 1 941 552 228 PHE CB C 41.747 0.3 1 942 552 228 PHE N N 123.843 0.3 1 943 553 229 VAL H H 8.138 0.020 1 944 553 229 VAL C C 172.830 0.3 1 945 553 229 VAL CA C 59.160 0.3 1 946 553 229 VAL CB C 34.729 0.3 1 947 553 229 VAL N N 116.011 0.3 1 948 554 230 VAL H H 8.738 0.020 1 949 554 230 VAL C C 175.471 0.3 1 950 554 230 VAL CA C 61.462 0.3 1 951 554 230 VAL CB C 29.996 0.3 1 952 554 230 VAL N N 124.634 0.3 1 953 555 231 PHE H H 9.683 0.020 1 954 555 231 PHE C C 176.829 0.3 1 955 555 231 PHE CA C 53.373 0.3 1 956 555 231 PHE CB C 41.016 0.3 1 957 555 231 PHE N N 130.166 0.3 1 958 556 232 GLU H H 7.994 0.020 1 959 556 232 GLU C C 176.167 0.3 1 960 556 232 GLU CA C 56.013 0.3 1 961 556 232 GLU CB C 29.920 0.3 1 962 556 232 GLU N N 117.078 0.3 1 963 557 233 SER H H 8.358 0.020 1 964 557 233 SER CA C 61.475 0.3 1 965 557 233 SER CB C 62.804 0.3 1 966 557 233 SER N N 114.246 0.3 1 967 558 234 GLU H H 8.432 0.020 1 968 558 234 GLU C C 175.765 0.3 1 969 558 234 GLU CA C 55.596 0.3 1 970 558 234 GLU CB C 30.845 0.3 1 971 558 234 GLU N N 112.887 0.3 1 972 559 235 GLU H H 7.508 0.020 1 973 559 235 GLU C C 176.300 0.3 1 974 559 235 GLU CA C 54.393 0.3 1 975 559 235 GLU CB C 30.362 0.3 1 976 559 235 GLU N N 118.524 0.3 1 977 560 236 ASN H H 8.674 0.020 1 978 560 236 ASN CA C 51.008 0.3 1 979 560 236 ASN CB C 34.661 0.3 1 980 560 236 ASN N N 125.088 0.3 1 981 561 237 SER H H 7.351 0.020 1 982 561 237 SER C C 172.331 0.3 1 983 561 237 SER CA C 55.715 0.3 1 984 561 237 SER CB C 64.500 0.3 1 985 561 237 SER N N 116.434 0.3 1 986 562 238 GLU H H 9.037 0.020 1 987 562 238 GLU C C 177.065 0.3 1 988 562 238 GLU CA C 58.112 0.3 1 989 562 238 GLU CB C 27.744 0.3 1 990 562 238 GLU N N 123.579 0.3 1 991 563 239 SER H H 8.693 0.020 1 992 563 239 SER C C 177.863 0.3 1 993 563 239 SER CA C 56.305 0.3 1 994 563 239 SER CB C 62.400 0.3 1 995 563 239 SER N N 117.139 0.3 1 996 564 240 VAL H H 8.689 0.020 1 997 564 240 VAL C C 178.013 0.3 1 998 564 240 VAL CA C 64.465 0.3 1 999 564 240 VAL CB C 29.994 0.3 1 1000 564 240 VAL N N 131.131 0.3 1 1001 565 241 MET H H 8.345 0.020 1 1002 565 241 MET C C 178.908 0.3 1 1003 565 241 MET CA C 54.708 0.3 1 1004 565 241 MET CB C 29.462 0.3 1 1005 565 241 MET N N 117.521 0.3 1 1006 566 242 ASP H H 8.071 0.020 1 1007 566 242 ASP CA C 57.520 0.3 1 1008 566 242 ASP CB C 41.738 0.3 1 1009 566 242 ASP N N 120.306 0.3 1 1010 567 243 GLY H H 7.493 0.020 1 1011 567 243 GLY C C 174.293 0.3 1 1012 567 243 GLY CA C 44.669 0.3 1 1013 567 243 GLY N N 101.677 0.3 1 1014 568 244 PHE H H 7.834 0.020 1 1015 568 244 PHE C C 173.297 0.3 1 1016 568 244 PHE CA C 57.611 0.3 1 1017 568 244 PHE CB C 38.294 0.3 1 1018 568 244 PHE N N 118.618 0.3 1 1019 569 245 VAL H H 7.349 0.020 1 1020 569 245 VAL C C 174.684 0.3 1 1021 569 245 VAL CA C 58.599 0.3 1 1022 569 245 VAL CB C 33.547 0.3 1 1023 569 245 VAL N N 114.284 0.3 1 1024 570 246 GLU H H 8.124 0.020 1 1025 570 246 GLU C C 175.914 0.3 1 1026 570 246 GLU CA C 55.024 0.3 1 1027 570 246 GLU CB C 28.925 0.3 1 1028 570 246 GLU N N 121.915 0.3 1 1029 571 247 HIS H H 8.310 0.020 1 1030 571 247 HIS C C 173.145 0.3 1 1031 571 247 HIS CA C 53.406 0.3 1 1032 571 247 HIS CB C 28.845 0.3 1 1033 571 247 HIS N N 118.360 0.3 1 1034 572 248 PRO C C 176.630 0.3 1 1035 572 248 PRO CA C 62.140 0.3 1 1036 572 248 PRO CB C 33.060 0.3 1 1037 573 249 PHE H H 8.164 0.020 1 1038 573 249 PHE C C 174.013 0.3 1 1039 573 249 PHE CA C 55.871 0.3 1 1040 573 249 PHE CB C 39.006 0.3 1 1041 573 249 PHE N N 120.455 0.3 1 1042 574 250 TYR H H 8.141 0.020 1 1043 574 250 TYR C C 176.238 0.3 1 1044 574 250 TYR CA C 56.327 0.3 1 1045 574 250 TYR CB C 41.708 0.3 1 1046 574 250 TYR N N 115.190 0.3 1 1047 575 251 THR H H 9.131 0.020 1 1048 575 251 THR C C 173.601 0.3 1 1049 575 251 THR CA C 59.809 0.3 1 1050 575 251 THR CB C 71.231 0.3 1 1051 575 251 THR N N 108.904 0.3 1 1052 576 252 ALA H H 8.640 0.020 1 1053 576 252 ALA C C 175.837 0.3 1 1054 576 252 ALA CA C 50.478 0.3 1 1055 576 252 ALA CB C 23.951 0.3 1 1056 576 252 ALA N N 119.707 0.3 1 1057 577 253 THR H H 8.987 0.020 1 1058 577 253 THR C C 173.597 0.3 1 1059 577 253 THR CA C 60.401 0.3 1 1060 577 253 THR CB C 69.513 0.3 1 1061 577 253 THR N N 115.255 0.3 1 1062 578 254 LEU H H 8.957 0.020 1 1063 578 254 LEU C C 176.525 0.3 1 1064 578 254 LEU CA C 54.106 0.3 1 1065 578 254 LEU CB C 42.867 0.3 1 1066 578 254 LEU N N 125.547 0.3 1 1067 579 255 ASN H H 9.453 0.020 1 1068 579 255 ASN C C 175.562 0.3 1 1069 579 255 ASN CA C 53.909 0.3 1 1070 579 255 ASN CB C 36.401 0.3 1 1071 579 255 ASN N N 127.875 0.3 1 1072 580 256 GLY H H 8.327 0.020 1 1073 580 256 GLY C C 173.307 0.3 1 1074 580 256 GLY CA C 44.625 0.3 1 1075 580 256 GLY N N 103.553 0.3 1 1076 581 257 GLN H H 7.706 0.020 1 1077 581 257 GLN C C 173.295 0.3 1 1078 581 257 GLN CA C 52.819 0.3 1 1079 581 257 GLN CB C 30.075 0.3 1 1080 581 257 GLN N N 121.061 0.3 1 1081 582 258 LYS H H 8.410 0.020 1 1082 582 258 LYS C C 176.023 0.3 1 1083 582 258 LYS CA C 54.627 0.3 1 1084 582 258 LYS CB C 32.830 0.3 1 1085 582 258 LYS N N 123.454 0.3 1 1086 583 259 TYR H H 9.334 0.020 1 1087 583 259 TYR C C 174.727 0.3 1 1088 583 259 TYR CA C 57.529 0.3 1 1089 583 259 TYR CB C 41.131 0.3 1 1090 583 259 TYR N N 124.243 0.3 1 1091 584 260 VAL H H 8.881 0.020 1 1092 584 260 VAL C C 173.530 0.3 1 1093 584 260 VAL CA C 61.606 0.3 1 1094 584 260 VAL CB C 29.509 0.3 1 1095 584 260 VAL N N 121.831 0.3 1 1096 585 261 VAL H H 8.741 0.020 1 1097 585 261 VAL C C 174.402 0.3 1 1098 585 261 VAL CA C 59.323 0.3 1 1099 585 261 VAL CB C 31.753 0.3 1 1100 585 261 VAL N N 125.927 0.3 1 1101 586 262 MET H H 8.721 0.020 1 1102 586 262 MET C C 173.255 0.3 1 1103 586 262 MET CA C 52.244 0.3 1 1104 586 262 MET CB C 36.820 0.3 1 1105 586 262 MET N N 127.473 0.3 1 1106 587 263 LYS H H 8.679 0.020 1 1107 587 263 LYS C C 176.796 0.3 1 1108 587 263 LYS CA C 52.850 0.3 1 1109 587 263 LYS CB C 33.462 0.3 1 1110 587 263 LYS N N 125.465 0.3 1 1111 588 264 THR H H 8.445 0.020 1 1112 588 264 THR C C 174.532 0.3 1 1113 588 264 THR CA C 59.884 0.3 1 1114 588 264 THR CB C 70.341 0.3 1 1115 588 264 THR N N 112.235 0.3 1 1116 589 265 LYS H H 8.346 0.020 1 1117 589 265 LYS C C 175.038 0.3 1 1118 589 265 LYS CA C 53.950 0.3 1 1119 589 265 LYS CB C 34.018 0.3 1 1120 589 265 LYS N N 119.651 0.3 1 1121 590 266 ASP H H 9.157 0.020 1 1122 590 266 ASP C C 177.143 0.3 1 1123 590 266 ASP CB C 38.178 0.3 1 1124 590 266 ASP N N 120.157 0.3 1 1125 591 267 ASP H H 7.963 0.020 1 1126 591 267 ASP C C 178.437 0.3 1 1127 591 267 ASP CA C 57.908 0.3 1 1128 591 267 ASP CB C 41.699 0.3 1 1129 591 267 ASP N N 117.543 0.3 1 1130 592 268 SER H H 8.638 0.020 1 1131 592 268 SER CA C 59.863 0.3 1 1132 592 268 SER CB C 61.627 0.3 1 1133 592 268 SER N N 113.023 0.3 1 1134 593 269 TYR H H 8.675 0.020 1 1135 593 269 TYR C C 176.259 0.3 1 1136 593 269 TYR CA C 56.418 0.3 1 1137 593 269 TYR CB C 36.920 0.3 1 1138 593 269 TYR N N 121.657 0.3 1 1139 594 270 TRP H H 8.762 0.020 1 1140 594 270 TRP C C 176.341 0.3 1 1141 594 270 TRP CA C 58.313 0.3 1 1142 594 270 TRP CB C 27.721 0.3 1 1143 594 270 TRP N N 121.382 0.3 1 1144 595 271 LYS H H 9.144 0.020 1 1145 595 271 LYS C C 175.673 0.3 1 1146 595 271 LYS CA C 54.550 0.3 1 1147 595 271 LYS CB C 31.693 0.3 1 1148 595 271 LYS N N 121.096 0.3 1 1149 596 272 ASP H H 7.586 0.020 1 1150 596 272 ASP C C 174.472 0.3 1 1151 596 272 ASP CA C 52.794 0.3 1 1152 596 272 ASP CB C 42.306 0.3 1 1153 596 272 ASP N N 114.344 0.3 1 1154 597 273 LEU H H 7.469 0.020 1 1155 597 273 LEU C C 173.377 0.3 1 1156 597 273 LEU CA C 55.378 0.3 1 1157 597 273 LEU CB C 41.764 0.3 1 1158 597 273 LEU N N 120.001 0.3 1 1159 598 274 ILE H H 8.705 0.020 1 1160 598 274 ILE C C 176.088 0.3 1 1161 598 274 ILE CA C 59.270 0.3 1 1162 598 274 ILE CB C 39.369 0.3 1 1163 598 274 ILE N N 128.504 0.3 1 1164 599 275 VAL H H 8.281 0.020 1 1165 599 275 VAL C C 176.056 0.3 1 1166 599 275 VAL CA C 61.002 0.3 1 1167 599 275 VAL CB C 31.800 0.3 1 1168 599 275 VAL N N 127.679 0.3 1 1169 600 276 GLU H H 9.835 0.020 1 1170 600 276 GLU C C 176.626 0.3 1 1171 600 276 GLU CA C 56.263 0.3 1 1172 600 276 GLU CB C 25.912 0.3 1 1173 600 276 GLU N N 129.004 0.3 1 1174 601 277 GLY H H 8.415 0.020 1 1175 601 277 GLY C C 173.574 0.3 1 1176 601 277 GLY CA C 44.574 0.3 1 1177 601 277 GLY N N 103.128 0.3 1 1178 602 278 LYS H H 7.726 0.020 1 1179 602 278 LYS C C 175.921 0.3 1 1180 602 278 LYS CA C 53.414 0.3 1 1181 602 278 LYS CB C 33.587 0.3 1 1182 602 278 LYS N N 122.308 0.3 1 1183 603 279 ARG H H 9.218 0.020 1 1184 603 279 ARG C C 176.750 0.3 1 1185 603 279 ARG CA C 57.517 0.3 1 1186 603 279 ARG CB C 27.888 0.3 1 1187 603 279 ARG N N 132.033 0.3 1 1188 604 280 VAL H H 7.165 0.020 1 1189 604 280 VAL C C 175.438 0.3 1 1190 604 280 VAL CA C 61.214 0.3 1 1191 604 280 VAL CB C 30.650 0.3 1 1192 604 280 VAL N N 118.232 0.3 1 1193 605 281 THR H H 7.920 0.020 1 1194 605 281 THR C C 174.337 0.3 1 1195 605 281 THR CA C 61.598 0.3 1 1196 605 281 THR CB C 69.539 0.3 1 1197 605 281 THR N N 119.452 0.3 1 1198 606 282 THR H H 9.176 0.020 1 1199 606 282 THR C C 173.473 0.3 1 1200 606 282 THR CA C 63.372 0.3 1 1201 606 282 THR CB C 67.755 0.3 1 1202 606 282 THR N N 126.158 0.3 1 1203 607 283 VAL H H 8.515 0.020 1 1204 607 283 VAL C C 175.833 0.3 1 1205 607 283 VAL CA C 61.717 0.3 1 1206 607 283 VAL CB C 31.570 0.3 1 1207 607 283 VAL N N 127.718 0.3 1 1208 608 284 SER H H 7.663 0.020 1 1209 608 284 SER C C 172.429 0.3 1 1210 608 284 SER CA C 56.599 0.3 1 1211 608 284 SER CB C 64.486 0.3 1 1212 608 284 SER N N 111.830 0.3 1 1213 609 285 LYS H H 8.471 0.020 1 1214 609 285 LYS C C 174.144 0.3 1 1215 609 285 LYS CA C 55.701 0.3 1 1216 609 285 LYS CB C 34.729 0.3 1 1217 609 285 LYS N N 121.352 0.3 1 1218 610 286 ASP H H 8.414 0.020 1 1219 610 286 ASP C C 174.955 0.3 1 1220 610 286 ASP CA C 49.269 0.3 1 1221 610 286 ASP CB C 40.633 0.3 1 1222 610 286 ASP N N 122.313 0.3 1 1223 611 287 PRO C C 178.920 0.3 1 1224 611 287 PRO CA C 63.330 0.3 1 1225 611 287 PRO CB C 30.730 0.3 1 1226 612 288 LYS H H 7.880 0.020 1 1227 612 288 LYS C C 177.596 0.3 1 1228 612 288 LYS CA C 57.924 0.3 1 1229 612 288 LYS CB C 30.580 0.3 1 1230 612 288 LYS N N 119.338 0.3 1 1231 613 289 ASN H H 7.140 0.020 1 1232 613 289 ASN C C 174.089 0.3 1 1233 613 289 ASN CA C 51.870 0.3 1 1234 613 289 ASN CB C 38.214 0.3 1 1235 613 289 ASN N N 114.927 0.3 1 1236 614 290 ASN H H 7.819 0.020 1 1237 614 290 ASN C C 173.012 0.3 1 1238 614 290 ASN CB C 35.284 0.3 1 1239 614 290 ASN N N 119.929 0.3 1 1240 615 291 SER H H 7.468 0.020 1 1241 615 291 SER C C 172.590 0.3 1 1242 615 291 SER CA C 55.801 0.3 1 1243 615 291 SER CB C 65.492 0.3 1 1244 615 291 SER N N 111.559 0.3 1 1245 616 292 ARG H H 7.993 0.020 1 1246 616 292 ARG C C 173.445 0.3 1 1247 616 292 ARG CA C 53.289 0.3 1 1248 616 292 ARG CB C 32.045 0.3 1 1249 616 292 ARG N N 126.673 0.3 1 1250 617 293 THR H H 8.351 0.020 1 1251 617 293 THR C C 172.769 0.3 1 1252 617 293 THR CA C 61.352 0.3 1 1253 617 293 THR CB C 68.101 0.3 1 1254 617 293 THR N N 117.732 0.3 1 1255 618 294 LEU H H 9.493 0.020 1 1256 618 294 LEU C C 173.588 0.3 1 1257 618 294 LEU CA C 52.224 0.3 1 1258 618 294 LEU CB C 44.636 0.3 1 1259 618 294 LEU N N 129.275 0.3 1 1260 619 295 ILE H H 8.756 0.020 1 1261 619 295 ILE C C 175.896 0.3 1 1262 619 295 ILE CA C 57.515 0.3 1 1263 619 295 ILE CB C 41.204 0.3 1 1264 619 295 ILE N N 111.232 0.3 1 1265 620 296 PHE H H 8.054 0.020 1 1266 620 296 PHE C C 172.293 0.3 1 1267 620 296 PHE CA C 53.715 0.3 1 1268 620 296 PHE CB C 38.103 0.3 1 1269 620 296 PHE N N 115.428 0.3 1 1270 621 297 PRO C C 174.420 0.3 1 1271 621 297 PRO CA C 64.520 0.3 1 1272 621 297 PRO CB C 31.160 0.3 1 1273 622 298 TYR H H 7.878 0.020 1 1274 622 298 TYR C C 174.519 0.3 1 1275 622 298 TYR CA C 56.108 0.3 1 1276 622 298 TYR CB C 38.122 0.3 1 1277 622 298 TYR N N 122.541 0.3 1 1278 623 299 ILE H H 8.213 0.020 1 1279 623 299 ILE C C 174.535 0.3 1 1280 623 299 ILE CA C 55.922 0.3 1 1281 623 299 ILE CB C 37.029 0.3 1 1282 623 299 ILE N N 131.982 0.3 1 1283 624 300 PRO C C 176.260 0.3 1 1284 624 300 PRO CA C 63.460 0.3 1 1285 624 300 PRO CB C 30.610 0.3 1 1286 625 301 ASP H H 8.168 0.020 1 1287 625 301 ASP C C 174.199 0.3 1 1288 625 301 ASP CA C 53.754 0.3 1 1289 625 301 ASP CB C 38.854 0.3 1 1290 625 301 ASP N N 114.541 0.3 1 1291 626 302 LYS H H 6.938 0.020 1 1292 626 302 LYS C C 174.779 0.3 1 1293 626 302 LYS CA C 55.124 0.3 1 1294 626 302 LYS CB C 32.366 0.3 1 1295 626 302 LYS N N 121.269 0.3 1 1296 627 303 ALA H H 8.486 0.020 1 1297 627 303 ALA C C 175.995 0.3 1 1298 627 303 ALA CA C 53.512 0.3 1 1299 627 303 ALA CB C 18.917 0.3 1 1300 627 303 ALA N N 130.513 0.3 1 1301 628 304 VAL H H 7.377 0.020 1 1302 628 304 VAL C C 173.953 0.3 1 1303 628 304 VAL CA C 60.948 0.3 1 1304 628 304 VAL CB C 32.921 0.3 1 1305 628 304 VAL N N 114.781 0.3 1 1306 629 305 TYR H H 9.419 0.020 1 1307 629 305 TYR C C 175.730 0.3 1 1308 629 305 TYR CA C 55.107 0.3 1 1309 629 305 TYR CB C 36.880 0.3 1 1310 629 305 TYR N N 127.277 0.3 1 1311 630 306 ASN H H 9.922 0.020 1 1312 630 306 ASN C C 174.425 0.3 1 1313 630 306 ASN CA C 54.458 0.3 1 1314 630 306 ASN CB C 40.012 0.3 1 1315 630 306 ASN N N 125.698 0.3 1 1316 631 307 ALA H H 8.847 0.020 1 1317 631 307 ALA C C 174.522 0.3 1 1318 631 307 ALA CA C 49.503 0.3 1 1319 631 307 ALA CB C 21.857 0.3 1 1320 631 307 ALA N N 125.430 0.3 1 1321 632 308 ILE H H 8.861 0.020 1 1322 632 308 ILE C C 174.569 0.3 1 1323 632 308 ILE CA C 58.738 0.3 1 1324 632 308 ILE CB C 39.113 0.3 1 1325 632 308 ILE N N 120.596 0.3 1 1326 633 309 VAL H H 8.973 0.020 1 1327 633 309 VAL C C 173.702 0.3 1 1328 633 309 VAL CA C 58.680 0.3 1 1329 633 309 VAL CB C 33.539 0.3 1 1330 633 309 VAL N N 126.723 0.3 1 1331 634 310 LYS H H 7.936 0.020 1 1332 634 310 LYS C C 175.051 0.3 1 1333 634 310 LYS CB C 32.352 0.3 1 1334 634 310 LYS N N 125.478 0.3 1 1335 635 311 VAL H H 8.476 0.020 1 1336 635 311 VAL C C 174.598 0.3 1 1337 635 311 VAL CA C 58.081 0.3 1 1338 635 311 VAL CB C 35.005 0.3 1 1339 635 311 VAL N N 119.295 0.3 1 1340 636 312 VAL H H 8.676 0.020 1 1341 636 312 VAL C C 174.836 0.3 1 1342 636 312 VAL CA C 61.958 0.3 1 1343 636 312 VAL CB C 31.205 0.3 1 1344 636 312 VAL N N 123.243 0.3 1 1345 637 313 VAL H H 7.926 0.020 1 1346 637 313 VAL C C 176.504 0.3 1 1347 637 313 VAL CA C 60.689 0.3 1 1348 637 313 VAL CB C 30.592 0.3 1 1349 637 313 VAL N N 126.120 0.3 1 1350 638 314 ALA H H 8.002 0.020 1 1351 638 314 ALA C C 178.576 0.3 1 1352 638 314 ALA CA C 53.478 0.3 1 1353 638 314 ALA CB C 17.663 0.3 1 1354 638 314 ALA N N 129.109 0.3 1 1355 639 315 ASN H H 8.152 0.020 1 1356 639 315 ASN C C 175.480 0.3 1 1357 639 315 ASN CA C 53.981 0.3 1 1358 639 315 ASN CB C 37.059 0.3 1 1359 639 315 ASN N N 114.469 0.3 1 1360 640 316 ILE H H 7.462 0.020 1 1361 640 316 ILE C C 176.669 0.3 1 1362 640 316 ILE CA C 60.620 0.3 1 1363 640 316 ILE CB C 37.548 0.3 1 1364 640 316 ILE N N 116.186 0.3 1 1365 641 317 GLY H H 8.060 0.020 1 1366 641 317 GLY C C 173.580 0.3 1 1367 641 317 GLY CA C 45.126 0.3 1 1368 641 317 GLY N N 111.514 0.3 1 1369 642 318 ALA H H 7.288 0.020 1 1370 642 318 ALA C C 176.252 0.3 1 1371 642 318 ALA CA C 50.478 0.3 1 1372 642 318 ALA CB C 19.459 0.3 1 1373 642 318 ALA N N 121.815 0.3 1 1374 643 319 GLU H H 8.234 0.020 1 1375 643 319 GLU C C 176.018 0.3 1 1376 643 319 GLU CA C 55.158 0.3 1 1377 643 319 GLU CB C 29.602 0.3 1 1378 643 319 GLU N N 120.747 0.3 1 1379 644 320 GLY H H 8.415 0.020 1 1380 644 320 GLY C C 172.082 0.3 1 1381 644 320 GLY CA C 44.005 0.3 1 1382 644 320 GLY N N 110.435 0.3 1 1383 645 321 GLN H H 7.075 0.020 1 1384 645 321 GLN C C 174.365 0.3 1 1385 645 321 GLN CA C 53.940 0.3 1 1386 645 321 GLN CB C 27.631 0.3 1 1387 645 321 GLN N N 117.881 0.3 1 1388 646 322 TYR H H 9.070 0.020 1 1389 646 322 TYR C C 174.788 0.3 1 1390 646 322 TYR CA C 55.722 0.3 1 1391 646 322 TYR CB C 40.515 0.3 1 1392 646 322 TYR N N 122.209 0.3 1 1393 647 323 HIS H H 8.698 0.020 1 1394 647 323 HIS C C 174.509 0.3 1 1395 647 323 HIS CA C 55.101 0.3 1 1396 647 323 HIS CB C 31.144 0.3 1 1397 647 323 HIS N N 124.110 0.3 1 1398 648 324 VAL H H 8.722 0.020 1 1399 648 324 VAL C C 172.987 0.3 1 1400 648 324 VAL CA C 57.512 0.3 1 1401 648 324 VAL CB C 34.144 0.3 1 1402 648 324 VAL N N 120.504 0.3 1 1403 649 325 ARG H H 8.040 0.020 1 1404 649 325 ARG C C 174.468 0.3 1 1405 649 325 ARG CA C 53.346 0.3 1 1406 649 325 ARG CB C 31.030 0.3 1 1407 649 325 ARG N N 118.149 0.3 1 1408 650 326 ILE H H 9.344 0.020 1 1409 650 326 ILE C C 175.253 0.3 1 1410 650 326 ILE CA C 60.999 0.3 1 1411 650 326 ILE CB C 36.519 0.3 1 1412 650 326 ILE N N 127.210 0.3 1 1413 651 327 ILE H H 9.079 0.020 1 1414 651 327 ILE C C 175.471 0.3 1 1415 651 327 ILE CA C 58.681 0.3 1 1416 651 327 ILE CB C 37.916 0.3 1 1417 651 327 ILE N N 129.534 0.3 1 1418 652 328 ASN H H 8.826 0.020 1 1419 652 328 ASN C C 176.411 0.3 1 1420 652 328 ASN CA C 50.546 0.3 1 1421 652 328 ASN CB C 37.152 0.3 1 1422 652 328 ASN N N 123.781 0.3 1 1423 653 329 GLN H H 8.708 0.020 1 1424 653 329 GLN C C 176.585 0.3 1 1425 653 329 GLN CA C 56.370 0.3 1 1426 653 329 GLN CB C 28.239 0.3 1 1427 653 329 GLN N N 124.627 0.3 1 1428 654 330 ASP H H 7.980 0.020 1 1429 654 330 ASP C C 175.960 0.3 1 1430 654 330 ASP CA C 54.545 0.3 1 1431 654 330 ASP CB C 39.581 0.3 1 1432 654 330 ASP N N 116.893 0.3 1 1433 655 331 ILE H H 6.727 0.020 1 1434 655 331 ILE C C 175.218 0.3 1 1435 655 331 ILE CA C 58.790 0.3 1 1436 655 331 ILE CB C 36.019 0.3 1 1437 655 331 ILE N N 119.246 0.3 1 1438 656 332 ASN H H 8.299 0.020 1 1439 656 332 ASN C C 175.113 0.3 1 1440 656 332 ASN CA C 52.467 0.3 1 1441 656 332 ASN CB C 38.185 0.3 1 1442 656 332 ASN N N 124.418 0.3 1 1443 657 333 THR H H 7.952 0.020 1 1444 657 333 THR C C 174.160 0.3 1 1445 657 333 THR CA C 60.903 0.3 1 1446 657 333 THR CB C 68.666 0.3 1 1447 657 333 THR N N 115.773 0.3 1 1448 658 334 LYS H H 8.069 0.020 1 1449 658 334 LYS C C 175.916 0.3 1 1450 658 334 LYS CA C 55.208 0.3 1 1451 658 334 LYS CB C 31.771 0.3 1 1452 658 334 LYS N N 123.723 0.3 1 1453 659 335 ASP H H 8.199 0.020 1 1454 659 335 ASP C C 174.892 0.3 1 1455 659 335 ASP CA C 53.453 0.3 1 1456 659 335 ASP CB C 40.425 0.3 1 1457 659 335 ASP N N 122.983 0.3 1 1458 660 336 ASP H H 7.749 0.020 1 1459 660 336 ASP C C 180.700 0.3 1 1460 660 336 ASP CA C 54.878 0.3 1 1461 660 336 ASP CB C 41.062 0.3 1 1462 660 336 ASP N N 126.292 0.3 1 stop_ save_