data_30410 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of the four-helix bundle region of human J-protein Zuotin, a component of ribosome-associated complex (RAC) ; _BMRB_accession_number 30410 _BMRB_flat_file_name bmr30410.str _Entry_type original _Submission_date 2018-02-20 _Accession_date 2018-02-20 _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 Shrestha O. K. . 2 Lee W. . . 3 Tonelli M. . . 4 Cornilescu G. . . 5 Markley J. L. . 6 Ciesielski S. J. . 7 Craig E. A. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 441 "13C chemical shifts" 268 "15N chemical shifts" 85 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-05-22 update BMRB 'update entry citation' 2019-06-07 original author 'original release' stop_ _Original_release_date 2018-04-05 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Structure and Evolution of the 4-helix Bundle Domain of Zuotin, a J-domain Protein Co-Chaperone of Hsp70 ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 31091298 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Shrestha 'Om Kumar' K. . 2 Sharma Ruchika . . 3 Tomiczek Bartlomiej . . 4 Lee Woonghee . . 5 Tonelli Marco . . 6 Cornilescu Gabriel . . 7 Stolarska Milena . . 8 Nierzwicki Lukasz . . 9 Czub Jacek . . 10 Markley John L. . 11 Marszalek Jaroslaw . . 12 Ciesielski Szymon J. . 13 Craig Elizabeth A. . stop_ _Journal_abbreviation 'PLoS ONE' _Journal_name_full 'PloS one' _Journal_volume 14 _Journal_issue 5 _Journal_ISSN 1932-6203 _Journal_CSD 0353 _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first e0217098 _Page_last e0217098 _Year 2019 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'DnaJ homolog subfamily C member 2' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label entity_1 $entity_1 stop_ _System_molecular_weight . _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity_1 _Molecular_mass 10401.884 _Mol_thiol_state . _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 89 _Mol_residue_sequence ; GSKKAIKKERQKLRNSCKTW NHFSDNEAERVKMMEEVEKL CDRLELASLQCLNETLTSCT KEVGKAALEKQIEEINEQIR KEKEEAEAR ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 344 GLY 2 345 SER 3 346 LYS 4 347 LYS 5 348 ALA 6 349 ILE 7 350 LYS 8 351 LYS 9 352 GLU 10 353 ARG 11 354 GLN 12 355 LYS 13 356 LEU 14 357 ARG 15 358 ASN 16 359 SER 17 360 CYS 18 361 LYS 19 362 THR 20 363 TRP 21 364 ASN 22 365 HIS 23 366 PHE 24 367 SER 25 368 ASP 26 369 ASN 27 370 GLU 28 371 ALA 29 372 GLU 30 373 ARG 31 374 VAL 32 375 LYS 33 376 MET 34 377 MET 35 378 GLU 36 379 GLU 37 380 VAL 38 381 GLU 39 382 LYS 40 383 LEU 41 384 CYS 42 385 ASP 43 386 ARG 44 387 LEU 45 388 GLU 46 389 LEU 47 390 ALA 48 391 SER 49 392 LEU 50 393 GLN 51 394 CYS 52 395 LEU 53 396 ASN 54 397 GLU 55 398 THR 56 399 LEU 57 400 THR 58 401 SER 59 402 CYS 60 403 THR 61 404 LYS 62 405 GLU 63 406 VAL 64 407 GLY 65 408 LYS 66 409 ALA 67 410 ALA 68 411 LEU 69 412 GLU 70 413 LYS 71 414 GLN 72 415 ILE 73 416 GLU 74 417 GLU 75 418 ILE 76 419 ASN 77 420 GLU 78 421 GLN 79 422 ILE 80 423 ARG 81 424 LYS 82 425 GLU 83 426 LYS 84 427 GLU 85 428 GLU 86 429 ALA 87 430 GLU 88 431 ALA 89 432 ARG stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Gene_mnemonic $entity_1 Human 9606 Eukaryota Metazoa Homo sapiens 'DNAJC2, MPHOSPH11, MPP11, ZRF1' 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 $entity_1 'recombinant technology' . Escherichia coli . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '300 uM [U-100% 13C; U-100% 15N] Mpp11 (346-432), 93% H2O/7% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 300 uM '[U-100% 13C; U-100% 15N]' NaCl 250 mM 'natural abundance' 'sodium phosphate' 20 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details '300 uM [U-100% 15N] Mpp11 (346-432), 93% H2O/7% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 300 uM '[U-100% 15N]' NaCl 250 mM 'natural abundance' 'sodium phosphate' 20 mM 'natural abundance' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type bicelle _Details '200 uM [U-100% 13C; U-100% 15N] Mpp11 (346-432), 93% H2O/7% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 200 uM '[U-100% 13C; U-100% 15N]' NaCl 250 mM 'natural abundance' 'sodium phosphate' 20 mM 'natural abundance' stop_ save_ save_sample_4 _Saveframe_category sample _Sample_type bicelle _Details '150 uM [U-100% 13C; U-100% 15N] Mpp11 (346-432), 93% H2O/7% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 150 uM '[U-100% 13C; U-100% 15N]' NaCl 250 mM 'natural abundance' 'sodium phosphate' 20 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection stop_ _Details . save_ save_software_2 _Saveframe_category software _Name VNMR _Version . loop_ _Vendor _Address _Electronic_address Varian . . stop_ loop_ _Task collection stop_ _Details . save_ save_software_3 _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_software_4 _Saveframe_category software _Name APES _Version . loop_ _Vendor _Address _Electronic_address 'Shin, Lee and Lee' . . stop_ loop_ _Task 'peak picking' stop_ _Details . save_ save_software_5 _Saveframe_category software _Name NMRFAM-SPARKY _Version . loop_ _Vendor _Address _Electronic_address 'Lee, Tonelli and Markley' . . stop_ loop_ _Task 'peak picking' stop_ _Details . save_ save_software_6 _Saveframe_category software _Name PINE _Version . loop_ _Vendor _Address _Electronic_address 'Bahrami, Markley, Assadi, and Eghbalnia' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_software_7 _Saveframe_category software _Name PINE-SPARKY _Version . loop_ _Vendor _Address _Electronic_address 'Lee, Westler, Bahrami, Eghbalnia and Markley' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_software_8 _Saveframe_category software _Name PONDEROSA-C/S _Version . loop_ _Vendor _Address _Electronic_address 'Lee, Stark and Markley' . . stop_ loop_ _Task refinement 'structure calculation' stop_ _Details . save_ save_software_9 _Saveframe_category software _Name AUDANA _Version . loop_ _Vendor _Address _Electronic_address 'Lee, Petit, Cornilescu, Stark and Markley' . . stop_ loop_ _Task 'structure calculation' stop_ _Details . save_ save_software_10 _Saveframe_category software _Name 'X-PLOR NIH' _Version . loop_ _Vendor _Address _Electronic_address 'Schwieters, Kuszewski, Tjandra and Clore' . . stop_ loop_ _Task refinement 'structure calculation' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model VNS _Field_strength 600 _Details . save_ save_NMR_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 750 _Details . save_ save_NMR_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_NMR_spectrometer_4 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model VNS _Field_strength 900 _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_CBCA(CO)NH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HBHA(CO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_aliphatic_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC aliphatic' _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_ save_3D_1H-13C_NOESY_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_1 save_ save_3D_H(CCO)NH_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $sample_1 save_ save_3D_C(CO)NH_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $sample_1 save_ save_1H-15N_IPAP_HSQC_10 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N IPAP HSQC' _Sample_label $sample_1 save_ save_1H-15N_IPAP_HSQC_11 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N IPAP HSQC' _Sample_label $sample_3 save_ save_1H-15N_IPAP_HSQC_12 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N IPAP HSQC' _Sample_label $sample_4 save_ save_2D_1H-15N_HSQC_13 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_2 save_ save_3D_1H-13C_NOESY_aromatic_14 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aromatic' _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' 270 . mM pH 7.5 . pH pressure 1 . Pa temperature 278 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_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 0.000 internal indirect . . . 0.25144953 DSS H 1 'methyl protons' ppm 0.000 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0.000 internal indirect . . . 0.10132912 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCACB' '3D CBCA(CO)NH' '3D HBHA(CO)NH' '2D 1H-13C HSQC aliphatic' '3D 1H-15N NOESY' '3D 1H-13C NOESY' '3D H(CCO)NH' '3D C(CO)NH' '1H-15N IPAP HSQC' '3D 1H-13C NOESY aromatic' stop_ loop_ _Sample_label $sample_1 $sample_3 $sample_4 $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name entity_1 _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 1 347 4 LYS H H 7.690 0.00 . 2 347 4 LYS N N 115.764 0.00 . 3 348 5 ALA H H 8.303 0.00 . 4 348 5 ALA HA H 4.176 0.00 . 5 348 5 ALA HB H 1.511 0.00 . 6 348 5 ALA CA C 55.096 0.00 . 7 348 5 ALA CB C 18.473 0.00 . 8 348 5 ALA N N 121.604 0.00 . 9 349 6 ILE H H 8.373 0.00 . 10 349 6 ILE HA H 3.870 0.00 . 11 349 6 ILE HB H 1.874 0.00 . 12 349 6 ILE HG12 H 1.205 0.00 . 13 349 6 ILE HG13 H 1.495 0.00 . 14 349 6 ILE HG2 H 1.035 0.00 . 15 349 6 ILE HD1 H 0.957 0.00 . 16 349 6 ILE CA C 65.075 0.00 . 17 349 6 ILE CB C 38.319 0.00 . 18 349 6 ILE CG1 C 31.244 0.00 . 19 349 6 ILE CG2 C 16.724 0.00 . 20 349 6 ILE CD1 C 14.223 0.00 . 21 349 6 ILE N N 119.035 0.00 . 22 350 7 LYS H H 7.809 0.00 . 23 350 7 LYS HA H 3.985 0.00 . 24 350 7 LYS HB2 H 1.961 0.00 . 25 350 7 LYS HB3 H 1.961 0.00 . 26 350 7 LYS HG2 H 1.409 0.00 . 27 350 7 LYS HG3 H 1.409 0.00 . 28 350 7 LYS HD2 H 1.694 0.00 . 29 350 7 LYS HD3 H 1.694 0.00 . 30 350 7 LYS HE2 H 2.962 0.00 . 31 350 7 LYS HE3 H 2.962 0.00 . 32 350 7 LYS CA C 60.611 0.00 . 33 350 7 LYS CB C 32.283 0.00 . 34 350 7 LYS CG C 25.655 0.00 . 35 350 7 LYS CD C 29.779 0.00 . 36 350 7 LYS CE C 42.086 0.00 . 37 350 7 LYS N N 122.648 0.00 . 38 351 8 LYS H H 7.699 0.00 . 39 351 8 LYS HA H 3.993 0.00 . 40 351 8 LYS HB2 H 1.927 0.00 . 41 351 8 LYS HB3 H 1.927 0.00 . 42 351 8 LYS HG2 H 1.425 0.00 . 43 351 8 LYS HG3 H 1.425 0.00 . 44 351 8 LYS HD2 H 1.671 0.00 . 45 351 8 LYS HD3 H 1.671 0.00 . 46 351 8 LYS HE2 H 2.967 0.00 . 47 351 8 LYS HE3 H 2.967 0.00 . 48 351 8 LYS CA C 59.327 0.00 . 49 351 8 LYS CB C 32.342 0.00 . 50 351 8 LYS CG C 25.224 0.00 . 51 351 8 LYS CD C 29.304 0.00 . 52 351 8 LYS CE C 42.135 0.00 . 53 351 8 LYS N N 118.973 0.00 . 54 352 9 GLU H H 8.072 0.00 . 55 352 9 GLU HA H 3.985 0.00 . 56 352 9 GLU HB2 H 2.000 0.00 . 57 352 9 GLU HB3 H 2.000 0.00 . 58 352 9 GLU HG2 H 2.122 0.00 . 59 352 9 GLU HG3 H 2.432 0.00 . 60 352 9 GLU CA C 58.690 0.00 . 61 352 9 GLU CB C 29.638 0.00 . 62 352 9 GLU CG C 36.395 0.00 . 63 352 9 GLU N N 119.530 0.00 . 64 353 10 ARG H H 8.502 0.00 . 65 353 10 ARG HA H 4.069 0.00 . 66 353 10 ARG HB2 H 1.947 0.00 . 67 353 10 ARG HB3 H 1.947 0.00 . 68 353 10 ARG HG2 H 1.480 0.00 . 69 353 10 ARG HG3 H 1.480 0.00 . 70 353 10 ARG HD2 H 3.090 0.00 . 71 353 10 ARG HD3 H 3.090 0.00 . 72 353 10 ARG CA C 60.025 0.00 . 73 353 10 ARG CB C 30.864 0.00 . 74 353 10 ARG CG C 28.845 0.00 . 75 353 10 ARG CD C 44.569 0.00 . 76 353 10 ARG N N 120.570 0.00 . 77 354 11 GLN H H 7.584 0.00 . 78 354 11 GLN HA H 3.976 0.00 . 79 354 11 GLN HB2 H 2.121 0.00 . 80 354 11 GLN HB3 H 2.212 0.00 . 81 354 11 GLN HG2 H 2.451 0.00 . 82 354 11 GLN HG3 H 2.451 0.00 . 83 354 11 GLN CA C 58.654 0.00 . 84 354 11 GLN CB C 28.169 0.00 . 85 354 11 GLN CG C 33.584 0.00 . 86 354 11 GLN N N 117.364 0.00 . 87 355 12 LYS H H 8.157 0.00 . 88 355 12 LYS HA H 3.975 0.00 . 89 355 12 LYS HB2 H 1.842 0.00 . 90 355 12 LYS HB3 H 1.842 0.00 . 91 355 12 LYS HG2 H 1.341 0.00 . 92 355 12 LYS HG3 H 1.341 0.00 . 93 355 12 LYS HD2 H 1.618 0.00 . 94 355 12 LYS HD3 H 1.618 0.00 . 95 355 12 LYS HE2 H 2.816 0.00 . 96 355 12 LYS HE3 H 2.816 0.00 . 97 355 12 LYS CA C 59.936 0.00 . 98 355 12 LYS CB C 32.524 0.00 . 99 355 12 LYS CG C 25.262 0.00 . 100 355 12 LYS CD C 30.015 0.00 . 101 355 12 LYS CE C 41.972 0.00 . 102 355 12 LYS N N 120.018 0.00 . 103 356 13 LEU H H 7.818 0.00 . 104 356 13 LEU HA H 4.449 0.00 . 105 356 13 LEU HB2 H 1.743 0.00 . 106 356 13 LEU HB3 H 2.083 0.00 . 107 356 13 LEU HG H 1.417 0.00 . 108 356 13 LEU HD1 H 0.831 0.00 . 109 356 13 LEU HD2 H 0.898 0.00 . 110 356 13 LEU CA C 58.672 0.00 . 111 356 13 LEU CB C 40.667 0.00 . 112 356 13 LEU CG C 27.590 0.00 . 113 356 13 LEU CD1 C 24.419 0.00 . 114 356 13 LEU CD2 C 27.032 0.00 . 115 356 13 LEU N N 122.984 0.00 . 116 357 14 ARG H H 7.952 0.00 . 117 357 14 ARG HA H 3.949 0.00 . 118 357 14 ARG HB2 H 1.865 0.00 . 119 357 14 ARG HB3 H 1.865 0.00 . 120 357 14 ARG HG2 H 1.470 0.00 . 121 357 14 ARG HG3 H 1.470 0.00 . 122 357 14 ARG HD2 H 3.139 0.00 . 123 357 14 ARG HD3 H 3.139 0.00 . 124 357 14 ARG CA C 60.333 0.00 . 125 357 14 ARG CB C 30.226 0.00 . 126 357 14 ARG CG C 28.940 0.00 . 127 357 14 ARG CD C 43.627 0.00 . 128 357 14 ARG N N 118.707 0.00 . 129 358 15 ASN H H 8.615 0.00 . 130 358 15 ASN HA H 4.398 0.00 . 131 358 15 ASN HB2 H 2.866 0.00 . 132 358 15 ASN HB3 H 2.931 0.00 . 133 358 15 ASN CA C 56.139 0.00 . 134 358 15 ASN CB C 37.770 0.00 . 135 358 15 ASN N N 118.218 0.00 . 136 359 16 SER H H 8.954 0.00 . 137 359 16 SER HA H 4.217 0.00 . 138 359 16 SER HB2 H 3.883 0.00 . 139 359 16 SER HB3 H 3.883 0.00 . 140 359 16 SER CA C 62.337 0.00 . 141 359 16 SER CB C 63.116 0.00 . 142 359 16 SER N N 119.777 0.00 . 143 360 17 CYS H H 8.261 0.00 . 144 360 17 CYS HA H 3.889 0.00 . 145 360 17 CYS HB2 H 1.874 0.00 . 146 360 17 CYS HB3 H 2.954 0.00 . 147 360 17 CYS CA C 65.462 0.00 . 148 360 17 CYS CB C 26.258 0.00 . 149 360 17 CYS N N 118.531 0.00 . 150 361 18 LYS H H 8.069 0.00 . 151 361 18 LYS CA C 60.074 0.00 . 152 361 18 LYS CB C 31.913 0.00 . 153 361 18 LYS N N 121.394 0.00 . 154 362 19 THR H H 8.231 0.00 . 155 362 19 THR HA H 4.085 0.00 . 156 362 19 THR HB H 3.770 0.00 . 157 362 19 THR HG2 H 0.806 0.00 . 158 362 19 THR CA C 67.233 0.00 . 159 362 19 THR CB C 67.837 0.00 . 160 362 19 THR CG2 C 21.406 0.00 . 161 362 19 THR N N 119.801 0.00 . 162 363 20 TRP H H 6.987 0.00 . 163 363 20 TRP HA H 4.540 0.00 . 164 363 20 TRP HB2 H 1.953 0.00 . 165 363 20 TRP HB3 H 2.369 0.00 . 166 363 20 TRP HD1 H 7.039 0.00 . 167 363 20 TRP HE3 H 7.390 0.00 . 168 363 20 TRP HZ2 H 7.622 0.00 . 169 363 20 TRP HZ3 H 7.109 0.00 . 170 363 20 TRP HH2 H 7.256 0.00 . 171 363 20 TRP CA C 56.544 0.00 . 172 363 20 TRP CB C 28.989 0.00 . 173 363 20 TRP CD1 C 127.312 0.00 . 174 363 20 TRP CE3 C 120.243 0.00 . 175 363 20 TRP CZ2 C 115.736 0.00 . 176 363 20 TRP CZ3 C 121.171 0.00 . 177 363 20 TRP CH2 C 124.221 0.00 . 178 363 20 TRP N N 119.181 0.00 . 179 364 21 ASN H H 8.382 0.00 . 180 364 21 ASN HA H 4.494 0.00 . 181 364 21 ASN HB2 H 2.713 0.00 . 182 364 21 ASN HB3 H 3.248 0.00 . 183 364 21 ASN CA C 54.495 0.00 . 184 364 21 ASN CB C 37.605 0.00 . 185 364 21 ASN N N 122.954 0.00 . 186 365 22 HIS H H 8.731 0.00 . 187 365 22 HIS HE1 H 7.613 0.00 . 188 365 22 HIS CE1 C 138.620 0.00 . 189 365 22 HIS N N 108.895 0.00 . 190 366 23 PHE H H 7.697 0.00 . 191 366 23 PHE HD1 H 6.824 0.00 . 192 366 23 PHE HD2 H 6.824 0.00 . 193 366 23 PHE HE1 H 6.622 0.00 . 194 366 23 PHE HE2 H 6.622 0.00 . 195 366 23 PHE HZ H 6.331 0.00 . 196 366 23 PHE CA C 60.037 0.00 . 197 366 23 PHE CB C 36.294 0.00 . 198 366 23 PHE CD1 C 130.976 0.00 . 199 366 23 PHE CE1 C 131.059 0.00 . 200 366 23 PHE CZ C 129.202 0.00 . 201 366 23 PHE N N 107.710 0.00 . 202 367 24 SER H H 7.457 0.00 . 203 367 24 SER CA C 58.320 0.00 . 204 367 24 SER CB C 65.799 0.00 . 205 367 24 SER N N 110.992 0.00 . 206 368 25 ASP H H 9.088 0.00 . 207 368 25 ASP HA H 4.824 0.00 . 208 368 25 ASP HB2 H 2.637 0.00 . 209 368 25 ASP HB3 H 2.842 0.00 . 210 368 25 ASP CA C 54.649 0.00 . 211 368 25 ASP CB C 41.994 0.00 . 212 368 25 ASP N N 123.051 0.00 . 213 369 26 ASN H H 8.196 0.00 . 214 369 26 ASN CA C 52.350 0.00 . 215 369 26 ASN CB C 40.689 0.00 . 216 369 26 ASN N N 117.033 0.00 . 217 370 27 GLU H H 9.044 0.00 . 218 370 27 GLU HA H 3.997 0.00 . 219 370 27 GLU HB2 H 1.984 0.00 . 220 370 27 GLU HB3 H 2.077 0.00 . 221 370 27 GLU HG2 H 2.304 0.00 . 222 370 27 GLU HG3 H 2.304 0.00 . 223 370 27 GLU CA C 59.845 0.00 . 224 370 27 GLU CB C 29.653 0.00 . 225 370 27 GLU CG C 35.483 0.00 . 226 370 27 GLU N N 124.652 0.00 . 227 371 28 ALA H H 8.293 0.00 . 228 371 28 ALA HA H 4.117 0.00 . 229 371 28 ALA HB H 1.455 0.00 . 230 371 28 ALA CA C 55.392 0.00 . 231 371 28 ALA CB C 17.737 0.00 . 232 371 28 ALA N N 121.195 0.00 . 233 372 29 GLU H H 8.024 0.00 . 234 372 29 GLU HA H 4.083 0.00 . 235 372 29 GLU HB2 H 2.205 0.00 . 236 372 29 GLU HB3 H 2.205 0.00 . 237 372 29 GLU HG2 H 2.402 0.00 . 238 372 29 GLU HG3 H 2.458 0.00 . 239 372 29 GLU CA C 58.979 0.00 . 240 372 29 GLU CB C 29.786 0.00 . 241 372 29 GLU CG C 36.923 0.00 . 242 372 29 GLU N N 118.252 0.00 . 243 373 30 ARG H H 8.165 0.00 . 244 373 30 ARG HA H 3.935 0.00 . 245 373 30 ARG HB2 H 1.813 0.00 . 246 373 30 ARG HB3 H 2.034 0.00 . 247 373 30 ARG HG2 H 1.504 0.00 . 248 373 30 ARG HG3 H 1.656 0.00 . 249 373 30 ARG HD2 H 3.146 0.00 . 250 373 30 ARG HD3 H 3.301 0.00 . 251 373 30 ARG CA C 60.764 0.00 . 252 373 30 ARG CB C 30.745 0.00 . 253 373 30 ARG CG C 28.327 0.00 . 254 373 30 ARG CD C 43.934 0.00 . 255 373 30 ARG N N 121.852 0.00 . 256 374 31 VAL H H 8.207 0.00 . 257 374 31 VAL HA H 3.636 0.00 . 258 374 31 VAL HB H 2.089 0.00 . 259 374 31 VAL HG1 H 1.062 0.00 . 260 374 31 VAL HG2 H 0.938 0.00 . 261 374 31 VAL CA C 66.484 0.00 . 262 374 31 VAL CB C 31.909 0.00 . 263 374 31 VAL CG1 C 22.669 0.00 . 264 374 31 VAL CG2 C 21.150 0.00 . 265 374 31 VAL N N 117.933 0.00 . 266 375 32 LYS H H 7.379 0.00 . 267 375 32 LYS HA H 4.202 0.00 . 268 375 32 LYS HB2 H 1.929 0.00 . 269 375 32 LYS HB3 H 2.006 0.00 . 270 375 32 LYS HG2 H 1.532 0.00 . 271 375 32 LYS HG3 H 1.532 0.00 . 272 375 32 LYS HD2 H 1.750 0.00 . 273 375 32 LYS HD3 H 1.750 0.00 . 274 375 32 LYS HE2 H 2.972 0.00 . 275 375 32 LYS HE3 H 2.972 0.00 . 276 375 32 LYS CA C 58.967 0.00 . 277 375 32 LYS CB C 32.132 0.00 . 278 375 32 LYS CG C 24.732 0.00 . 279 375 32 LYS CD C 28.995 0.00 . 280 375 32 LYS CE C 42.188 0.00 . 281 375 32 LYS N N 120.320 0.00 . 282 376 33 MET H H 8.405 0.00 . 283 376 33 MET HA H 4.430 0.00 . 284 376 33 MET HB2 H 2.302 0.00 . 285 376 33 MET HB3 H 2.470 0.00 . 286 376 33 MET HG2 H 2.849 0.00 . 287 376 33 MET HG3 H 2.989 0.00 . 288 376 33 MET CA C 57.484 0.00 . 289 376 33 MET CB C 32.178 0.00 . 290 376 33 MET CG C 32.507 0.00 . 291 376 33 MET N N 118.653 0.00 . 292 377 34 MET H H 8.520 0.00 . 293 377 34 MET HA H 3.760 0.00 . 294 377 34 MET HB2 H 2.003 0.00 . 295 377 34 MET HB3 H 2.003 0.00 . 296 377 34 MET HG2 H 1.786 0.00 . 297 377 34 MET HG3 H 2.128 0.00 . 298 377 34 MET CA C 60.483 0.00 . 299 377 34 MET CB C 32.865 0.00 . 300 377 34 MET CG C 31.480 0.00 . 301 377 34 MET N N 119.177 0.00 . 302 378 35 GLU H H 7.648 0.00 . 303 378 35 GLU HA H 4.076 0.00 . 304 378 35 GLU HB2 H 2.175 0.00 . 305 378 35 GLU HB3 H 2.339 0.00 . 306 378 35 GLU HG2 H 2.500 0.00 . 307 378 35 GLU HG3 H 2.500 0.00 . 308 378 35 GLU CA C 59.496 0.00 . 309 378 35 GLU CB C 29.476 0.00 . 310 378 35 GLU CG C 36.398 0.00 . 311 378 35 GLU N N 119.809 0.00 . 312 379 36 GLU H H 8.332 0.00 . 313 379 36 GLU HA H 4.562 0.00 . 314 379 36 GLU HB2 H 2.141 0.00 . 315 379 36 GLU HB3 H 2.242 0.00 . 316 379 36 GLU HG2 H 2.356 0.00 . 317 379 36 GLU HG3 H 2.700 0.00 . 318 379 36 GLU CA C 58.404 0.00 . 319 379 36 GLU CB C 28.618 0.00 . 320 379 36 GLU CG C 34.446 0.00 . 321 379 36 GLU N N 120.417 0.00 . 322 380 37 VAL H H 8.821 0.00 . 323 380 37 VAL HA H 3.573 0.00 . 324 380 37 VAL HB H 2.428 0.00 . 325 380 37 VAL HG1 H 1.330 0.00 . 326 380 37 VAL HG2 H 1.024 0.00 . 327 380 37 VAL CA C 67.458 0.00 . 328 380 37 VAL CB C 31.976 0.00 . 329 380 37 VAL CG1 C 25.623 0.00 . 330 380 37 VAL CG2 C 21.809 0.00 . 331 380 37 VAL N N 119.982 0.00 . 332 381 38 GLU H H 7.664 0.00 . 333 381 38 GLU HA H 4.049 0.00 . 334 381 38 GLU HB2 H 2.155 0.00 . 335 381 38 GLU HB3 H 2.155 0.00 . 336 381 38 GLU HG2 H 2.479 0.00 . 337 381 38 GLU HG3 H 2.479 0.00 . 338 381 38 GLU CA C 59.314 0.00 . 339 381 38 GLU CB C 28.486 0.00 . 340 381 38 GLU CG C 35.615 0.00 . 341 381 38 GLU N N 119.255 0.00 . 342 382 39 LYS H H 7.431 0.00 . 343 382 39 LYS HA H 4.147 0.00 . 344 382 39 LYS HB2 H 1.910 0.00 . 345 382 39 LYS HB3 H 2.144 0.00 . 346 382 39 LYS HG2 H 1.597 0.00 . 347 382 39 LYS HG3 H 1.597 0.00 . 348 382 39 LYS HE2 H 2.797 0.00 . 349 382 39 LYS HE3 H 2.885 0.00 . 350 382 39 LYS CA C 59.758 0.00 . 351 382 39 LYS CB C 32.507 0.00 . 352 382 39 LYS CG C 24.782 0.00 . 353 382 39 LYS CD C 30.073 0.00 . 354 382 39 LYS CE C 41.478 0.00 . 355 382 39 LYS N N 119.847 0.00 . 356 383 40 LEU H H 7.996 0.00 . 357 383 40 LEU HA H 3.908 0.00 . 358 383 40 LEU HB2 H 1.263 0.00 . 359 383 40 LEU HB3 H 2.277 0.00 . 360 383 40 LEU HG H 1.976 0.00 . 361 383 40 LEU HD1 H 0.735 0.00 . 362 383 40 LEU HD2 H 0.827 0.00 . 363 383 40 LEU CA C 58.307 0.00 . 364 383 40 LEU CB C 41.009 0.00 . 365 383 40 LEU CG C 26.666 0.00 . 366 383 40 LEU CD1 C 23.487 0.00 . 367 383 40 LEU CD2 C 26.136 0.00 . 368 383 40 LEU N N 118.125 0.00 . 369 384 41 CYS H H 8.490 0.00 . 370 384 41 CYS HA H 3.931 0.00 . 371 384 41 CYS HB2 H 2.504 0.00 . 372 384 41 CYS HB3 H 3.281 0.00 . 373 384 41 CYS CA C 65.069 0.00 . 374 384 41 CYS CB C 27.271 0.00 . 375 384 41 CYS N N 115.930 0.00 . 376 385 42 ASP H H 7.868 0.00 . 377 385 42 ASP HA H 4.501 0.00 . 378 385 42 ASP HB2 H 2.670 0.00 . 379 385 42 ASP HB3 H 2.780 0.00 . 380 385 42 ASP CA C 56.566 0.00 . 381 385 42 ASP CB C 42.157 0.00 . 382 385 42 ASP N N 117.376 0.00 . 383 386 43 ARG H H 7.711 0.00 . 384 386 43 ARG HA H 4.428 0.00 . 385 386 43 ARG HB2 H 1.707 0.00 . 386 386 43 ARG HB3 H 1.927 0.00 . 387 386 43 ARG HD2 H 3.069 0.00 . 388 386 43 ARG HD3 H 3.093 0.00 . 389 386 43 ARG CA C 56.824 0.00 . 390 386 43 ARG CB C 33.309 0.00 . 391 386 43 ARG CG C 28.341 0.00 . 392 386 43 ARG CD C 42.788 0.00 . 393 386 43 ARG N N 115.033 0.00 . 394 387 44 LEU H H 8.361 0.00 . 395 387 44 LEU HA H 4.367 0.00 . 396 387 44 LEU HB2 H 1.442 0.00 . 397 387 44 LEU HB3 H 1.793 0.00 . 398 387 44 LEU HG H 1.897 0.00 . 399 387 44 LEU HD1 H 0.907 0.00 . 400 387 44 LEU HD2 H 0.788 0.00 . 401 387 44 LEU CA C 55.829 0.00 . 402 387 44 LEU CB C 42.642 0.00 . 403 387 44 LEU CG C 27.165 0.00 . 404 387 44 LEU CD1 C 23.331 0.00 . 405 387 44 LEU CD2 C 26.270 0.00 . 406 387 44 LEU N N 120.059 0.00 . 407 388 45 GLU H H 8.424 0.00 . 408 388 45 GLU HA H 4.306 0.00 . 409 388 45 GLU HB2 H 2.056 0.00 . 410 388 45 GLU HB3 H 2.304 0.00 . 411 388 45 GLU HG2 H 2.436 0.00 . 412 388 45 GLU HG3 H 2.436 0.00 . 413 388 45 GLU CA C 55.590 0.00 . 414 388 45 GLU CB C 30.568 0.00 . 415 388 45 GLU CG C 36.942 0.00 . 416 388 45 GLU N N 119.532 0.00 . 417 389 46 LEU H H 8.817 0.00 . 418 389 46 LEU HA H 3.892 0.00 . 419 389 46 LEU HB2 H 1.528 0.00 . 420 389 46 LEU HB3 H 1.885 0.00 . 421 389 46 LEU HG H 1.569 0.00 . 422 389 46 LEU HD1 H 0.836 0.00 . 423 389 46 LEU HD2 H 0.924 0.00 . 424 389 46 LEU CA C 59.509 0.00 . 425 389 46 LEU CB C 41.660 0.00 . 426 389 46 LEU CG C 27.002 0.00 . 427 389 46 LEU CD1 C 23.577 0.00 . 428 389 46 LEU CD2 C 26.008 0.00 . 429 389 46 LEU N N 122.148 0.00 . 430 390 47 ALA H H 8.909 0.00 . 431 390 47 ALA HA H 4.323 0.00 . 432 390 47 ALA HB H 1.454 0.00 . 433 390 47 ALA CA C 55.391 0.00 . 434 390 47 ALA CB C 17.965 0.00 . 435 390 47 ALA N N 118.160 0.00 . 436 391 48 SER H H 7.232 0.00 . 437 391 48 SER HA H 4.353 0.00 . 438 391 48 SER HB2 H 3.929 0.00 . 439 391 48 SER HB3 H 4.000 0.00 . 440 391 48 SER CA C 61.664 0.00 . 441 391 48 SER CB C 63.162 0.00 . 442 391 48 SER N N 113.626 0.00 . 443 392 49 LEU H H 8.238 0.00 . 444 392 49 LEU HA H 3.922 0.00 . 445 392 49 LEU HB2 H 1.468 0.00 . 446 392 49 LEU HB3 H 1.894 0.00 . 447 392 49 LEU HD1 H 0.790 0.00 . 448 392 49 LEU HD2 H 0.883 0.00 . 449 392 49 LEU CA C 58.504 0.00 . 450 392 49 LEU CB C 42.687 0.00 . 451 392 49 LEU CD1 C 25.715 0.00 . 452 392 49 LEU CD2 C 26.604 0.00 . 453 392 49 LEU N N 124.634 0.00 . 454 393 50 GLN H H 8.751 0.00 . 455 393 50 GLN HA H 4.136 0.00 . 456 393 50 GLN HB2 H 1.972 0.00 . 457 393 50 GLN HB3 H 2.251 0.00 . 458 393 50 GLN HG2 H 2.473 0.00 . 459 393 50 GLN HG3 H 2.473 0.00 . 460 393 50 GLN CA C 59.429 0.00 . 461 393 50 GLN CB C 28.417 0.00 . 462 393 50 GLN CG C 34.453 0.00 . 463 393 50 GLN N N 117.336 0.00 . 464 394 51 CYS H H 7.757 0.00 . 465 394 51 CYS HA H 4.170 0.00 . 466 394 51 CYS HB2 H 2.984 0.00 . 467 394 51 CYS HB3 H 3.062 0.00 . 468 394 51 CYS CA C 62.527 0.00 . 469 394 51 CYS CB C 26.610 0.00 . 470 394 51 CYS N N 117.872 0.00 . 471 395 52 LEU H H 7.856 0.00 . 472 395 52 LEU HA H 4.167 0.00 . 473 395 52 LEU HB2 H 1.639 0.00 . 474 395 52 LEU HB3 H 1.813 0.00 . 475 395 52 LEU HG H 1.518 0.00 . 476 395 52 LEU HD1 H 0.802 0.00 . 477 395 52 LEU HD2 H 0.792 0.00 . 478 395 52 LEU CA C 57.941 0.00 . 479 395 52 LEU CB C 41.883 0.00 . 480 395 52 LEU CG C 26.683 0.00 . 481 395 52 LEU CD1 C 22.652 0.00 . 482 395 52 LEU CD2 C 26.608 0.00 . 483 395 52 LEU N N 122.197 0.00 . 484 396 53 ASN H H 8.728 0.00 . 485 396 53 ASN HA H 4.554 0.00 . 486 396 53 ASN HB2 H 2.461 0.00 . 487 396 53 ASN HB3 H 2.988 0.00 . 488 396 53 ASN CA C 56.089 0.00 . 489 396 53 ASN CB C 38.111 0.00 . 490 396 53 ASN N N 117.012 0.00 . 491 397 54 GLU H H 8.193 0.00 . 492 397 54 GLU HA H 4.072 0.00 . 493 397 54 GLU HB2 H 2.171 0.00 . 494 397 54 GLU HB3 H 2.171 0.00 . 495 397 54 GLU HG2 H 2.349 0.00 . 496 397 54 GLU HG3 H 2.349 0.00 . 497 397 54 GLU CA C 59.552 0.00 . 498 397 54 GLU CB C 29.045 0.00 . 499 397 54 GLU CG C 36.216 0.00 . 500 397 54 GLU N N 121.478 0.00 . 501 398 55 THR H H 8.032 0.00 . 502 398 55 THR HA H 3.934 0.00 . 503 398 55 THR HB H 4.408 0.00 . 504 398 55 THR HG2 H 1.076 0.00 . 505 398 55 THR CA C 66.909 0.00 . 506 398 55 THR CB C 68.649 0.00 . 507 398 55 THR CG2 C 21.231 0.00 . 508 398 55 THR N N 119.086 0.00 . 509 399 56 LEU H H 8.314 0.00 . 510 399 56 LEU HA H 4.599 0.00 . 511 399 56 LEU HB2 H 1.708 0.00 . 512 399 56 LEU HB3 H 2.114 0.00 . 513 399 56 LEU HG H 1.973 0.00 . 514 399 56 LEU HD1 H 0.800 0.00 . 515 399 56 LEU HD2 H 0.886 0.00 . 516 399 56 LEU CA C 57.241 0.00 . 517 399 56 LEU CB C 42.065 0.00 . 518 399 56 LEU CG C 27.221 0.00 . 519 399 56 LEU CD1 C 23.534 0.00 . 520 399 56 LEU CD2 C 26.737 0.00 . 521 399 56 LEU N N 118.024 0.00 . 522 400 57 THR H H 7.717 0.00 . 523 400 57 THR HA H 4.379 0.00 . 524 400 57 THR HB H 4.416 0.00 . 525 400 57 THR HG2 H 1.325 0.00 . 526 400 57 THR CA C 64.340 0.00 . 527 400 57 THR CB C 69.769 0.00 . 528 400 57 THR CG2 C 21.607 0.00 . 529 400 57 THR N N 110.348 0.00 . 530 401 58 SER H H 7.733 0.00 . 531 401 58 SER HA H 4.886 0.00 . 532 401 58 SER HB2 H 3.936 0.00 . 533 401 58 SER HB3 H 4.017 0.00 . 534 401 58 SER CA C 58.067 0.00 . 535 401 58 SER CB C 64.593 0.00 . 536 401 58 SER N N 114.044 0.00 . 537 402 59 CYS H H 7.735 0.00 . 538 402 59 CYS HA H 5.086 0.00 . 539 402 59 CYS HB2 H 3.095 0.00 . 540 402 59 CYS HB3 H 3.095 0.00 . 541 402 59 CYS CA C 56.744 0.00 . 542 402 59 CYS CB C 31.094 0.00 . 543 402 59 CYS N N 118.372 0.00 . 544 403 60 THR H H 7.528 0.00 . 545 403 60 THR HA H 4.626 0.00 . 546 403 60 THR HB H 4.719 0.00 . 547 403 60 THR HG2 H 1.401 0.00 . 548 403 60 THR CA C 60.732 0.00 . 549 403 60 THR CB C 71.190 0.00 . 550 403 60 THR CG2 C 22.424 0.00 . 551 403 60 THR N N 108.252 0.00 . 552 404 61 LYS H H 9.004 0.00 . 553 404 61 LYS HA H 2.990 0.00 . 554 404 61 LYS HB2 H 1.706 0.00 . 555 404 61 LYS HB3 H 1.895 0.00 . 556 404 61 LYS HG2 H 1.323 0.00 . 557 404 61 LYS HG3 H 1.323 0.00 . 558 404 61 LYS CA C 60.341 0.00 . 559 404 61 LYS CB C 32.703 0.00 . 560 404 61 LYS CG C 24.878 0.00 . 561 404 61 LYS CD C 30.051 0.00 . 562 404 61 LYS CE C 42.135 0.00 . 563 404 61 LYS N N 123.125 0.00 . 564 405 62 GLU H H 8.825 0.00 . 565 405 62 GLU HA H 3.827 0.00 . 566 405 62 GLU HB2 H 1.908 0.00 . 567 405 62 GLU HB3 H 1.995 0.00 . 568 405 62 GLU HG2 H 2.256 0.00 . 569 405 62 GLU HG3 H 2.439 0.00 . 570 405 62 GLU CA C 60.213 0.00 . 571 405 62 GLU CB C 28.697 0.00 . 572 405 62 GLU CG C 36.993 0.00 . 573 405 62 GLU N N 115.565 0.00 . 574 406 63 VAL H H 7.153 0.00 . 575 406 63 VAL HA H 3.599 0.00 . 576 406 63 VAL HB H 1.908 0.00 . 577 406 63 VAL HG1 H 0.932 0.00 . 578 406 63 VAL HG2 H 0.925 0.00 . 579 406 63 VAL CA C 65.863 0.00 . 580 406 63 VAL CB C 32.374 0.00 . 581 406 63 VAL CG1 C 21.992 0.00 . 582 406 63 VAL CG2 C 21.991 0.00 . 583 406 63 VAL N N 121.808 0.00 . 584 407 64 GLY H H 8.317 0.00 . 585 407 64 GLY HA2 H 3.263 0.00 . 586 407 64 GLY HA3 H 3.263 0.00 . 587 407 64 GLY CA C 48.398 0.00 . 588 407 64 GLY N N 109.820 0.00 . 589 408 65 LYS H H 7.801 0.00 . 590 408 65 LYS HA H 2.695 0.00 . 591 408 65 LYS HB2 H 1.392 0.00 . 592 408 65 LYS HB3 H 1.562 0.00 . 593 408 65 LYS HG2 H 0.849 0.00 . 594 408 65 LYS HG3 H 1.206 0.00 . 595 408 65 LYS HD2 H 1.626 0.00 . 596 408 65 LYS HD3 H 1.626 0.00 . 597 408 65 LYS HE2 H 2.962 0.00 . 598 408 65 LYS HE3 H 2.962 0.00 . 599 408 65 LYS CA C 59.718 0.00 . 600 408 65 LYS CB C 33.172 0.00 . 601 408 65 LYS CG C 25.122 0.00 . 602 408 65 LYS CD C 30.045 0.00 . 603 408 65 LYS CE C 42.369 0.00 . 604 408 65 LYS N N 121.367 0.00 . 605 409 66 ALA H H 7.151 0.00 . 606 409 66 ALA HA H 4.090 0.00 . 607 409 66 ALA HB H 1.376 0.00 . 608 409 66 ALA CA C 54.630 0.00 . 609 409 66 ALA CB C 17.877 0.00 . 610 409 66 ALA N N 118.071 0.00 . 611 410 67 ALA H H 7.909 0.00 . 612 410 67 ALA HA H 4.064 0.00 . 613 410 67 ALA HB H 1.380 0.00 . 614 410 67 ALA CA C 54.821 0.00 . 615 410 67 ALA CB C 17.652 0.00 . 616 410 67 ALA N N 121.636 0.00 . 617 411 68 LEU H H 8.028 0.00 . 618 411 68 LEU HA H 3.843 0.00 . 619 411 68 LEU HB2 H 1.513 0.00 . 620 411 68 LEU HB3 H 1.513 0.00 . 621 411 68 LEU HG H 1.555 0.00 . 622 411 68 LEU HD1 H 0.832 0.00 . 623 411 68 LEU CA C 58.248 0.00 . 624 411 68 LEU CB C 42.237 0.00 . 625 411 68 LEU CG C 27.242 0.00 . 626 411 68 LEU CD1 C 25.788 0.00 . 627 411 68 LEU N N 120.071 0.00 . 628 412 69 GLU H H 8.613 0.00 . 629 412 69 GLU HA H 3.811 0.00 . 630 412 69 GLU HB2 H 1.928 0.00 . 631 412 69 GLU HB3 H 2.087 0.00 . 632 412 69 GLU HG2 H 2.101 0.00 . 633 412 69 GLU HG3 H 2.448 0.00 . 634 412 69 GLU CA C 60.181 0.00 . 635 412 69 GLU CB C 29.362 0.00 . 636 412 69 GLU CG C 37.423 0.00 . 637 412 69 GLU N N 117.376 0.00 . 638 413 70 LYS H H 7.960 0.00 . 639 413 70 LYS HA H 4.144 0.00 . 640 413 70 LYS HB2 H 1.919 0.00 . 641 413 70 LYS HB3 H 1.919 0.00 . 642 413 70 LYS HG2 H 1.457 0.00 . 643 413 70 LYS HG3 H 1.457 0.00 . 644 413 70 LYS HD2 H 1.692 0.00 . 645 413 70 LYS HD3 H 1.692 0.00 . 646 413 70 LYS HE2 H 2.957 0.00 . 647 413 70 LYS HE3 H 2.957 0.00 . 648 413 70 LYS CA C 59.024 0.00 . 649 413 70 LYS CB C 32.153 0.00 . 650 413 70 LYS CG C 24.602 0.00 . 651 413 70 LYS CD C 28.953 0.00 . 652 413 70 LYS CE C 42.240 0.00 . 653 413 70 LYS N N 119.670 0.00 . 654 414 71 GLN H H 7.377 0.00 . 655 414 71 GLN HA H 4.174 0.00 . 656 414 71 GLN HB2 H 2.123 0.00 . 657 414 71 GLN HB3 H 2.248 0.00 . 658 414 71 GLN HG2 H 2.507 0.00 . 659 414 71 GLN HG3 H 2.507 0.00 . 660 414 71 GLN CA C 57.862 0.00 . 661 414 71 GLN CB C 28.370 0.00 . 662 414 71 GLN CG C 34.442 0.00 . 663 414 71 GLN N N 116.973 0.00 . 664 415 72 ILE H H 8.608 0.00 . 665 415 72 ILE HA H 3.547 0.00 . 666 415 72 ILE HB H 1.869 0.00 . 667 415 72 ILE HG2 H 0.877 0.00 . 668 415 72 ILE HD1 H 0.795 0.00 . 669 415 72 ILE CA C 65.896 0.00 . 670 415 72 ILE CB C 38.604 0.00 . 671 415 72 ILE CG1 C 30.310 0.00 . 672 415 72 ILE CG2 C 17.321 0.00 . 673 415 72 ILE CD1 C 14.723 0.00 . 674 415 72 ILE N N 121.347 0.00 . 675 416 73 GLU H H 8.162 0.00 . 676 416 73 GLU HA H 4.096 0.00 . 677 416 73 GLU HB2 H 2.172 0.00 . 678 416 73 GLU HB3 H 2.172 0.00 . 679 416 73 GLU HG2 H 2.268 0.00 . 680 416 73 GLU HG3 H 2.388 0.00 . 681 416 73 GLU CA C 59.729 0.00 . 682 416 73 GLU CB C 29.374 0.00 . 683 416 73 GLU CG C 36.210 0.00 . 684 416 73 GLU N N 120.142 0.00 . 685 417 74 GLU H H 7.870 0.00 . 686 417 74 GLU HA H 4.058 0.00 . 687 417 74 GLU HB2 H 2.083 0.00 . 688 417 74 GLU HB3 H 2.177 0.00 . 689 417 74 GLU HG2 H 2.465 0.00 . 690 417 74 GLU HG3 H 2.465 0.00 . 691 417 74 GLU CA C 59.765 0.00 . 692 417 74 GLU CB C 29.599 0.00 . 693 417 74 GLU CG C 36.533 0.00 . 694 417 74 GLU N N 119.174 0.00 . 695 418 75 ILE H H 8.398 0.00 . 696 418 75 ILE HA H 4.026 0.00 . 697 418 75 ILE HB H 2.030 0.00 . 698 418 75 ILE HG12 H 1.356 0.00 . 699 418 75 ILE HG13 H 1.515 0.00 . 700 418 75 ILE HG2 H 0.907 0.00 . 701 418 75 ILE HD1 H 0.802 0.00 . 702 418 75 ILE CA C 62.437 0.00 . 703 418 75 ILE CB C 36.357 0.00 . 704 418 75 ILE CG1 C 29.535 0.00 . 705 418 75 ILE CG2 C 19.187 0.00 . 706 418 75 ILE CD1 C 12.213 0.00 . 707 418 75 ILE N N 120.960 0.00 . 708 419 76 ASN H H 8.673 0.00 . 709 419 76 ASN HA H 4.560 0.00 . 710 419 76 ASN HB2 H 2.662 0.00 . 711 419 76 ASN HB3 H 2.948 0.00 . 712 419 76 ASN CA C 56.350 0.00 . 713 419 76 ASN CB C 37.699 0.00 . 714 419 76 ASN N N 120.679 0.00 . 715 420 77 GLU H H 8.018 0.00 . 716 420 77 GLU HA H 4.333 0.00 . 717 420 77 GLU HB2 H 2.098 0.00 . 718 420 77 GLU HB3 H 2.192 0.00 . 719 420 77 GLU HG2 H 2.359 0.00 . 720 420 77 GLU HG3 H 2.359 0.00 . 721 420 77 GLU CA C 58.834 0.00 . 722 420 77 GLU CB C 28.991 0.00 . 723 420 77 GLU CG C 35.653 0.00 . 724 420 77 GLU N N 122.421 0.00 . 725 421 78 GLN H H 7.783 0.00 . 726 421 78 GLN HA H 4.035 0.00 . 727 421 78 GLN HB2 H 2.298 0.00 . 728 421 78 GLN HB3 H 2.298 0.00 . 729 421 78 GLN HG2 H 2.555 0.00 . 730 421 78 GLN HG3 H 2.555 0.00 . 731 421 78 GLN CA C 59.161 0.00 . 732 421 78 GLN CB C 28.270 0.00 . 733 421 78 GLN CG C 33.742 0.00 . 734 421 78 GLN N N 120.733 0.00 . 735 422 79 ILE H H 8.398 0.00 . 736 422 79 ILE HA H 3.606 0.00 . 737 422 79 ILE HB H 1.859 0.00 . 738 422 79 ILE HG2 H 0.919 0.00 . 739 422 79 ILE HD1 H 0.842 0.00 . 740 422 79 ILE CA C 65.507 0.00 . 741 422 79 ILE CB C 38.626 0.00 . 742 422 79 ILE CG1 C 29.403 0.00 . 743 422 79 ILE CG2 C 17.005 0.00 . 744 422 79 ILE CD1 C 14.221 0.00 . 745 422 79 ILE N N 120.451 0.00 . 746 423 80 ARG H H 8.000 0.00 . 747 423 80 ARG CA C 59.826 0.00 . 748 423 80 ARG CB C 29.871 0.00 . 749 423 80 ARG N N 120.808 0.00 . 750 424 81 LYS H H 8.138 0.00 . 751 424 81 LYS CA C 57.908 0.00 . 752 424 81 LYS CB C 32.354 0.00 . 753 424 81 LYS N N 119.423 0.00 . 754 425 82 GLU CB C 29.639 0.00 . 755 426 83 LYS H H 8.012 0.00 . 756 426 83 LYS N N 119.976 0.00 . 757 427 84 GLU H H 8.127 0.00 . 758 427 84 GLU N N 119.552 0.00 . 759 428 85 GLU H H 8.197 0.00 . 760 428 85 GLU HA H 4.160 0.00 . 761 428 85 GLU HB2 H 2.062 0.00 . 762 428 85 GLU HB3 H 2.062 0.00 . 763 428 85 GLU HG2 H 2.264 0.00 . 764 428 85 GLU HG3 H 2.412 0.00 . 765 428 85 GLU CA C 57.901 0.00 . 766 428 85 GLU CB C 29.750 0.00 . 767 428 85 GLU CG C 36.542 0.00 . 768 428 85 GLU N N 119.328 0.00 . 769 429 86 ALA H H 7.846 0.00 . 770 429 86 ALA HA H 4.221 0.00 . 771 429 86 ALA HB H 1.481 0.00 . 772 429 86 ALA CA C 53.558 0.00 . 773 429 86 ALA CB C 18.939 0.00 . 774 429 86 ALA N N 122.180 0.00 . 775 430 87 GLU H H 7.941 0.00 . 776 430 87 GLU HA H 4.212 0.00 . 777 430 87 GLU HB2 H 1.987 0.00 . 778 430 87 GLU HB3 H 2.067 0.00 . 779 430 87 GLU HG2 H 2.274 0.00 . 780 430 87 GLU HG3 H 2.399 0.00 . 781 430 87 GLU CA C 56.757 0.00 . 782 430 87 GLU CB C 30.165 0.00 . 783 430 87 GLU CG C 36.463 0.00 . 784 430 87 GLU N N 118.071 0.00 . 785 431 88 ALA H H 7.885 0.00 . 786 431 88 ALA HA H 4.348 0.00 . 787 431 88 ALA HB H 1.413 0.00 . 788 431 88 ALA CA C 52.550 0.00 . 789 431 88 ALA CB C 19.024 0.00 . 790 431 88 ALA N N 124.454 0.00 . 791 432 89 ARG H H 7.774 0.00 . 792 432 89 ARG CA C 57.479 0.00 . 793 432 89 ARG CB C 31.640 0.00 . 794 432 89 ARG N N 125.787 0.00 . stop_ save_