data_28058 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 28058 _Entry.Title ; NMR assignment of self-processing module of FrpC protein of Neisseria meningitidis loaded with calcium ions ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-01-02 _Entry.Accession_date 2020-01-02 _Entry.Last_release_date 2020-01-03 _Entry.Original_release_date 2020-01-03 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Vojtech Kuban . . . . 28058 2 Lukas Zidek . . . . 28058 3 Pavel Macek . . . . 28058 4 Jozef Hritz . . . . 28058 5 Ladislav Bumba . . . . 28058 6 Faldyna M. . . . . 28058 7 Nedbalcova K. . . . . 28058 8 Nechvatalova K. . . . . 28058 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 28058 heteronucl_NOEs 1 28058 heteronucl_T1_relaxation 1 28058 heteronucl_T2_relaxation 1 28058 spectral_peak_list 8 28058 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 608 28058 '15N chemical shifts' 162 28058 '1H chemical shifts' 974 28058 'T1 relaxation values' 124 28058 'T2 relaxation values' 124 28058 'heteronuclear NOE values' 124 28058 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2020-03-27 2020-01-02 update BMRB 'update entry citation' 28058 1 . . 2020-02-20 2020-01-02 original author 'original release' 28058 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6SJW 'NMR data for the structure. Should be released in the same time.' 28058 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 28058 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 32184239 _Citation.DOI 10.1128/mBio.00226-20 _Citation.Full_citation . _Citation.Title ; Structural basis of Ca 2+ -dependent self-processing activity of repeat-in-toxin proteins ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev mBio _Citation.Journal_name_full . _Citation.Journal_volume 11 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first e00226-20 _Citation.Page_last e00226-20 _Citation.Year 2020 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 V. Kuban V. . . . 28058 1 2 P. Macek P. . . . 28058 1 3 J. Hritz J. . . . 28058 1 4 K. Nechvatalova K. . . . 28058 1 5 K. Nedbalcova K. . . . 28058 1 6 M. Faldyna M. . . . 28058 1 7 L. Zidek L. . . . 28058 1 8 L. Bumba L. . . . 28058 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 28058 _Assembly.ID 1 _Assembly.Name 4Ca.SPM _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 SPM 1 $SPM A . yes native no no . . . 28058 1 2 CA 2 $entity_CA A . no native no no . . . 28058 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_SPM _Entity.Sf_category entity _Entity.Sf_framecode SPM _Entity.Entry_ID 28058 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name SPM _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; PLALDLDGDGIETVATKGFS GSLFDHNRDGIRTATGWVSA DDGLLVRDLNGNGIIDNGAE LFGDNTKLADGSFAKHGYAA LAELDSNGDNIINAADAAFQ SLRVWQDLNQDGISQANELR TLEELGIQSLDLAYKDVNKN LGNGNTLAQQGSYTKTNGTT AKMGDLLLAADNLHSRFLE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 179 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 415 PRO . 28058 1 2 416 LEU . 28058 1 3 417 ALA . 28058 1 4 418 LEU . 28058 1 5 419 ASP . 28058 1 6 420 LEU . 28058 1 7 421 ASP . 28058 1 8 422 GLY . 28058 1 9 423 ASP . 28058 1 10 424 GLY . 28058 1 11 425 ILE . 28058 1 12 426 GLU . 28058 1 13 427 THR . 28058 1 14 428 VAL . 28058 1 15 429 ALA . 28058 1 16 430 THR . 28058 1 17 431 LYS . 28058 1 18 432 GLY . 28058 1 19 433 PHE . 28058 1 20 434 SER . 28058 1 21 435 GLY . 28058 1 22 436 SER . 28058 1 23 437 LEU . 28058 1 24 438 PHE . 28058 1 25 439 ASP . 28058 1 26 440 HIS . 28058 1 27 441 ASN . 28058 1 28 442 ARG . 28058 1 29 443 ASP . 28058 1 30 444 GLY . 28058 1 31 445 ILE . 28058 1 32 446 ARG . 28058 1 33 447 THR . 28058 1 34 448 ALA . 28058 1 35 449 THR . 28058 1 36 450 GLY . 28058 1 37 451 TRP . 28058 1 38 452 VAL . 28058 1 39 453 SER . 28058 1 40 454 ALA . 28058 1 41 455 ASP . 28058 1 42 456 ASP . 28058 1 43 457 GLY . 28058 1 44 458 LEU . 28058 1 45 459 LEU . 28058 1 46 460 VAL . 28058 1 47 461 ARG . 28058 1 48 462 ASP . 28058 1 49 463 LEU . 28058 1 50 464 ASN . 28058 1 51 465 GLY . 28058 1 52 466 ASN . 28058 1 53 467 GLY . 28058 1 54 468 ILE . 28058 1 55 469 ILE . 28058 1 56 470 ASP . 28058 1 57 471 ASN . 28058 1 58 472 GLY . 28058 1 59 473 ALA . 28058 1 60 474 GLU . 28058 1 61 475 LEU . 28058 1 62 476 PHE . 28058 1 63 477 GLY . 28058 1 64 478 ASP . 28058 1 65 479 ASN . 28058 1 66 480 THR . 28058 1 67 481 LYS . 28058 1 68 482 LEU . 28058 1 69 483 ALA . 28058 1 70 484 ASP . 28058 1 71 485 GLY . 28058 1 72 486 SER . 28058 1 73 487 PHE . 28058 1 74 488 ALA . 28058 1 75 489 LYS . 28058 1 76 490 HIS . 28058 1 77 491 GLY . 28058 1 78 492 TYR . 28058 1 79 493 ALA . 28058 1 80 494 ALA . 28058 1 81 495 LEU . 28058 1 82 496 ALA . 28058 1 83 497 GLU . 28058 1 84 498 LEU . 28058 1 85 499 ASP . 28058 1 86 500 SER . 28058 1 87 501 ASN . 28058 1 88 502 GLY . 28058 1 89 503 ASP . 28058 1 90 504 ASN . 28058 1 91 505 ILE . 28058 1 92 506 ILE . 28058 1 93 507 ASN . 28058 1 94 508 ALA . 28058 1 95 509 ALA . 28058 1 96 510 ASP . 28058 1 97 511 ALA . 28058 1 98 512 ALA . 28058 1 99 513 PHE . 28058 1 100 514 GLN . 28058 1 101 515 SER . 28058 1 102 516 LEU . 28058 1 103 517 ARG . 28058 1 104 518 VAL . 28058 1 105 519 TRP . 28058 1 106 520 GLN . 28058 1 107 521 ASP . 28058 1 108 522 LEU . 28058 1 109 523 ASN . 28058 1 110 524 GLN . 28058 1 111 525 ASP . 28058 1 112 526 GLY . 28058 1 113 527 ILE . 28058 1 114 528 SER . 28058 1 115 529 GLN . 28058 1 116 530 ALA . 28058 1 117 531 ASN . 28058 1 118 532 GLU . 28058 1 119 533 LEU . 28058 1 120 534 ARG . 28058 1 121 535 THR . 28058 1 122 536 LEU . 28058 1 123 537 GLU . 28058 1 124 538 GLU . 28058 1 125 539 LEU . 28058 1 126 540 GLY . 28058 1 127 541 ILE . 28058 1 128 542 GLN . 28058 1 129 543 SER . 28058 1 130 544 LEU . 28058 1 131 545 ASP . 28058 1 132 546 LEU . 28058 1 133 547 ALA . 28058 1 134 548 TYR . 28058 1 135 549 LYS . 28058 1 136 550 ASP . 28058 1 137 551 VAL . 28058 1 138 552 ASN . 28058 1 139 553 LYS . 28058 1 140 554 ASN . 28058 1 141 555 LEU . 28058 1 142 556 GLY . 28058 1 143 557 ASN . 28058 1 144 558 GLY . 28058 1 145 559 ASN . 28058 1 146 560 THR . 28058 1 147 561 LEU . 28058 1 148 562 ALA . 28058 1 149 563 GLN . 28058 1 150 564 GLN . 28058 1 151 565 GLY . 28058 1 152 566 SER . 28058 1 153 567 TYR . 28058 1 154 568 THR . 28058 1 155 569 LYS . 28058 1 156 570 THR . 28058 1 157 571 ASN . 28058 1 158 572 GLY . 28058 1 159 573 THR . 28058 1 160 574 THR . 28058 1 161 575 ALA . 28058 1 162 576 LYS . 28058 1 163 577 MET . 28058 1 164 578 GLY . 28058 1 165 579 ASP . 28058 1 166 580 LEU . 28058 1 167 581 LEU . 28058 1 168 582 LEU . 28058 1 169 583 ALA . 28058 1 170 584 ALA . 28058 1 171 585 ASP . 28058 1 172 586 ASN . 28058 1 173 587 LEU . 28058 1 174 588 HIS . 28058 1 175 589 SER . 28058 1 176 590 ARG . 28058 1 177 591 PHE . 28058 1 178 592 LEU . 28058 1 179 593 GLU . 28058 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . PRO 1 1 28058 1 . LEU 2 2 28058 1 . ALA 3 3 28058 1 . LEU 4 4 28058 1 . ASP 5 5 28058 1 . LEU 6 6 28058 1 . ASP 7 7 28058 1 . GLY 8 8 28058 1 . ASP 9 9 28058 1 . GLY 10 10 28058 1 . ILE 11 11 28058 1 . GLU 12 12 28058 1 . THR 13 13 28058 1 . VAL 14 14 28058 1 . ALA 15 15 28058 1 . THR 16 16 28058 1 . LYS 17 17 28058 1 . GLY 18 18 28058 1 . PHE 19 19 28058 1 . SER 20 20 28058 1 . GLY 21 21 28058 1 . SER 22 22 28058 1 . LEU 23 23 28058 1 . PHE 24 24 28058 1 . ASP 25 25 28058 1 . HIS 26 26 28058 1 . ASN 27 27 28058 1 . ARG 28 28 28058 1 . ASP 29 29 28058 1 . GLY 30 30 28058 1 . ILE 31 31 28058 1 . ARG 32 32 28058 1 . THR 33 33 28058 1 . ALA 34 34 28058 1 . THR 35 35 28058 1 . GLY 36 36 28058 1 . TRP 37 37 28058 1 . VAL 38 38 28058 1 . SER 39 39 28058 1 . ALA 40 40 28058 1 . ASP 41 41 28058 1 . ASP 42 42 28058 1 . GLY 43 43 28058 1 . LEU 44 44 28058 1 . LEU 45 45 28058 1 . VAL 46 46 28058 1 . ARG 47 47 28058 1 . ASP 48 48 28058 1 . LEU 49 49 28058 1 . ASN 50 50 28058 1 . GLY 51 51 28058 1 . ASN 52 52 28058 1 . GLY 53 53 28058 1 . ILE 54 54 28058 1 . ILE 55 55 28058 1 . ASP 56 56 28058 1 . ASN 57 57 28058 1 . GLY 58 58 28058 1 . ALA 59 59 28058 1 . GLU 60 60 28058 1 . LEU 61 61 28058 1 . PHE 62 62 28058 1 . GLY 63 63 28058 1 . ASP 64 64 28058 1 . ASN 65 65 28058 1 . THR 66 66 28058 1 . LYS 67 67 28058 1 . LEU 68 68 28058 1 . ALA 69 69 28058 1 . ASP 70 70 28058 1 . GLY 71 71 28058 1 . SER 72 72 28058 1 . PHE 73 73 28058 1 . ALA 74 74 28058 1 . LYS 75 75 28058 1 . HIS 76 76 28058 1 . GLY 77 77 28058 1 . TYR 78 78 28058 1 . ALA 79 79 28058 1 . ALA 80 80 28058 1 . LEU 81 81 28058 1 . ALA 82 82 28058 1 . GLU 83 83 28058 1 . LEU 84 84 28058 1 . ASP 85 85 28058 1 . SER 86 86 28058 1 . ASN 87 87 28058 1 . GLY 88 88 28058 1 . ASP 89 89 28058 1 . ASN 90 90 28058 1 . ILE 91 91 28058 1 . ILE 92 92 28058 1 . ASN 93 93 28058 1 . ALA 94 94 28058 1 . ALA 95 95 28058 1 . ASP 96 96 28058 1 . ALA 97 97 28058 1 . ALA 98 98 28058 1 . PHE 99 99 28058 1 . GLN 100 100 28058 1 . SER 101 101 28058 1 . LEU 102 102 28058 1 . ARG 103 103 28058 1 . VAL 104 104 28058 1 . TRP 105 105 28058 1 . GLN 106 106 28058 1 . ASP 107 107 28058 1 . LEU 108 108 28058 1 . ASN 109 109 28058 1 . GLN 110 110 28058 1 . ASP 111 111 28058 1 . GLY 112 112 28058 1 . ILE 113 113 28058 1 . SER 114 114 28058 1 . GLN 115 115 28058 1 . ALA 116 116 28058 1 . ASN 117 117 28058 1 . GLU 118 118 28058 1 . LEU 119 119 28058 1 . ARG 120 120 28058 1 . THR 121 121 28058 1 . LEU 122 122 28058 1 . GLU 123 123 28058 1 . GLU 124 124 28058 1 . LEU 125 125 28058 1 . GLY 126 126 28058 1 . ILE 127 127 28058 1 . GLN 128 128 28058 1 . SER 129 129 28058 1 . LEU 130 130 28058 1 . ASP 131 131 28058 1 . LEU 132 132 28058 1 . ALA 133 133 28058 1 . TYR 134 134 28058 1 . LYS 135 135 28058 1 . ASP 136 136 28058 1 . VAL 137 137 28058 1 . ASN 138 138 28058 1 . LYS 139 139 28058 1 . ASN 140 140 28058 1 . LEU 141 141 28058 1 . GLY 142 142 28058 1 . ASN 143 143 28058 1 . GLY 144 144 28058 1 . ASN 145 145 28058 1 . THR 146 146 28058 1 . LEU 147 147 28058 1 . ALA 148 148 28058 1 . GLN 149 149 28058 1 . GLN 150 150 28058 1 . GLY 151 151 28058 1 . SER 152 152 28058 1 . TYR 153 153 28058 1 . THR 154 154 28058 1 . LYS 155 155 28058 1 . THR 156 156 28058 1 . ASN 157 157 28058 1 . GLY 158 158 28058 1 . THR 159 159 28058 1 . THR 160 160 28058 1 . ALA 161 161 28058 1 . LYS 162 162 28058 1 . MET 163 163 28058 1 . GLY 164 164 28058 1 . ASP 165 165 28058 1 . LEU 166 166 28058 1 . LEU 167 167 28058 1 . LEU 168 168 28058 1 . ALA 169 169 28058 1 . ALA 170 170 28058 1 . ASP 171 171 28058 1 . ASN 172 172 28058 1 . LEU 173 173 28058 1 . HIS 174 174 28058 1 . SER 175 175 28058 1 . ARG 176 176 28058 1 . PHE 177 177 28058 1 . LEU 178 178 28058 1 . GLU 179 179 28058 1 stop_ save_ save_entity_CA _Entity.Sf_category entity _Entity.Sf_framecode entity_CA _Entity.Entry_ID 28058 _Entity.ID 2 _Entity.BMRB_code CA _Entity.Name entity_CA _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID CA _Entity.Nonpolymer_comp_label $chem_comp_CA _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 40.078 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'CALCIUM ION' BMRB 28058 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'CALCIUM ION' BMRB 28058 2 CA 'Three letter code' 28058 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 CA $chem_comp_CA 28058 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 28058 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $SPM . 487 organism . 'Neisseria meningitidis' 'Neisseria meningitidis' . . Bacteria . Neisseria meningitidis . . . . . . . . . . . frpC . 28058 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 28058 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $SPM . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli K-12 . . . . . pSPM-His . . . 28058 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_CA _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_CA _Chem_comp.Entry_ID 28058 _Chem_comp.ID CA _Chem_comp.Provenance PDB _Chem_comp.Name 'CALCIUM ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code CA _Chem_comp.PDB_code CA _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code CA _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Ca/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Ca _Chem_comp.Formula_weight 40.078 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID BHPQYMZQTOCNFJ-UHFFFAOYSA-N InChIKey InChI 1.03 28058 CA InChI=1S/Ca/q+2 InChI InChI 1.03 28058 CA [Ca++] SMILES CACTVS 3.341 28058 CA [Ca++] SMILES_CANONICAL CACTVS 3.341 28058 CA [Ca+2] SMILES ACDLabs 10.04 28058 CA [Ca+2] SMILES 'OpenEye OEToolkits' 1.5.0 28058 CA [Ca+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 28058 CA stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID calcium 'SYSTEMATIC NAME' ACDLabs 10.04 28058 CA 'calcium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 28058 CA stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID CA CA CA CA . CA . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 28058 CA stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 28058 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 SPM '[U-100% 13C; U-100% 15N]' . . 1 $SPM . . 0.4 . . mM . . . . 28058 1 2 TRIS 'natural abundance' . . . . . . 5 . . mM . . . . 28058 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 28058 1 4 'sodium azide' 'natural abundance' . . . . . . 0.1 . . % . . . . 28058 1 5 'Calcium chloride' 'natural abundance' . . . . . . 10 . . mM . . . . 28058 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 28058 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 65 . mM 28058 1 pH 7.4 . pH 28058 1 pressure 1 . atm 28058 1 temperature 303 . K 28058 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 28058 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version 3.115 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 28058 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 28058 1 . 'peak picking' 28058 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 28058 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 28058 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 28058 2 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 28058 _Software.ID 3 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.2 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 28058 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 28058 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 28058 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 28058 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 28058 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 28058 _NMR_spectrometer.ID 4 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 950 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 28058 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 28058 1 2 spectrometer_2 Bruker Avance . 700 . . . 28058 1 3 spectrometer_3 Bruker Avance . 850 . . . 28058 1 4 spectrometer_4 Bruker Avance . 950 . . . 28058 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 28058 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28058 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28058 1 3 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28058 1 4 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28058 1 5 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28058 1 6 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28058 1 7 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 28058 1 8 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 28058 1 9 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 28058 1 10 '2D R2 15N,1H correlation' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 28058 1 11 '2D R1 15N,1H correlation' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 28058 1 12 '2D NOE 15N,1H correlation' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 28058 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 28058 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 28058 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 28058 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 28058 1 P 31 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.404808636 . . . . . 28058 1 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 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 28058 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCO' . . . 28058 1 2 '3D HNCACB' . . . 28058 1 3 '3D HBHA(CO)NH' . . . 28058 1 4 '3D 1H-15N NOESY' . . . 28058 1 5 '3D HCCH-TOCSY' . . . 28058 1 6 '3D 1H-13C NOESY aromatic' . . . 28058 1 7 '2D 1H-13C HSQC aromatic' . . . 28058 1 8 '2D 1H-15N HSQC' . . . 28058 1 9 '3D 1H-13C NOESY aliphatic' . . . 28058 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $SPARKY . . 28058 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 PRO HA H 1 5.384 0.005 0 1 . 18 . . A 415 PRO HA . 28058 1 2 . 1 . 1 1 1 PRO HB2 H 1 2.262 0.004 0 2 . 11 . . A 415 PRO HB2 . 28058 1 3 . 1 . 1 1 1 PRO HB3 H 1 2.336 0.003 0 2 . 13 . . A 415 PRO HB3 . 28058 1 4 . 1 . 1 1 1 PRO HG2 H 1 1.739 0.006 0 2 . 22 . . A 415 PRO HG2 . 28058 1 5 . 1 . 1 1 1 PRO HG3 H 1 2.06 0.007 0 2 . 23 . . A 415 PRO HG3 . 28058 1 6 . 1 . 1 1 1 PRO HD2 H 1 3.32 0.008 0 2 . 20 . . A 415 PRO HD2 . 28058 1 7 . 1 . 1 1 1 PRO HD3 H 1 3.567 0.005 0 2 . 21 . . A 415 PRO HD3 . 28058 1 8 . 1 . 1 1 1 PRO C C 13 175.369 0 0 1 . 2 . . A 415 PRO C . 28058 1 9 . 1 . 1 1 1 PRO CA C 13 61.828 0.078 0 1 . 12 . . A 415 PRO CA . 28058 1 10 . 1 . 1 1 1 PRO CB C 13 33.354 0.068 0 1 . 20 . . A 415 PRO CB . 28058 1 11 . 1 . 1 1 1 PRO CG C 13 26 0.049 0 1 . 23 . . A 415 PRO CG . 28058 1 12 . 1 . 1 1 1 PRO CD C 13 49.305 0.045 0 1 . 21 . . A 415 PRO CD . 28058 1 13 . 1 . 1 2 2 LEU H H 1 8.59 0.007 0 1 . 19 . . A 416 LEU H . 28058 1 14 . 1 . 1 2 2 LEU HA H 1 4.987 0.007 0 1 . 17 . . A 416 LEU HA . 28058 1 15 . 1 . 1 2 2 LEU HB2 H 1 0.779 0.006 0 2 . 23 . . A 416 LEU HB2 . 28058 1 16 . 1 . 1 2 2 LEU HB3 H 1 1.91 0.006 0 2 . 15 . . A 416 LEU HB3 . 28058 1 17 . 1 . 1 2 2 LEU HG H 1 1.513 0.003 0 1 . 14 . . A 416 LEU HG . 28058 1 18 . 1 . 1 2 2 LEU HD11 H 1 -0.032 0.003 0 2 . 24 . . A 416 LEU MD1 . 28058 1 19 . 1 . 1 2 2 LEU HD12 H 1 -0.032 0.003 0 2 . 24 . . A 416 LEU MD1 . 28058 1 20 . 1 . 1 2 2 LEU HD13 H 1 -0.032 0.003 0 2 . 24 . . A 416 LEU MD1 . 28058 1 21 . 1 . 1 2 2 LEU HD21 H 1 0.179 0.005 0 2 . 24 . . A 416 LEU MD2 . 28058 1 22 . 1 . 1 2 2 LEU HD22 H 1 0.179 0.005 0 2 . 24 . . A 416 LEU MD2 . 28058 1 23 . 1 . 1 2 2 LEU HD23 H 1 0.179 0.005 0 2 . 24 . . A 416 LEU MD2 . 28058 1 24 . 1 . 1 2 2 LEU C C 13 177.087 0 0 1 . 2 . . A 416 LEU C . 28058 1 25 . 1 . 1 2 2 LEU CA C 13 55.389 0.104 0 1 . 14 . . A 416 LEU CA . 28058 1 26 . 1 . 1 2 2 LEU CB C 13 43.702 0.052 0 1 . 24 . . A 416 LEU CB . 28058 1 27 . 1 . 1 2 2 LEU CG C 13 26.154 0.035 0 1 . 8 . . A 416 LEU CG . 28058 1 28 . 1 . 1 2 2 LEU CD1 C 13 22.032 0.027 0 2 . 11 . . A 416 LEU CD1 . 28058 1 29 . 1 . 1 2 2 LEU CD2 C 13 27.88 0.039 0 2 . 11 . . A 416 LEU CD2 . 28058 1 30 . 1 . 1 2 2 LEU N N 15 117.815 0.067 0 1 . 12 . . A 416 LEU N . 28058 1 31 . 1 . 1 3 3 ALA H H 1 9.344 0.009 0 1 . 15 . . A 417 ALA H . 28058 1 32 . 1 . 1 3 3 ALA HA H 1 5.148 0.006 0 1 . 14 . . A 417 ALA HA . 28058 1 33 . 1 . 1 3 3 ALA HB1 H 1 1.146 0.004 0 1 . 11 . . A 417 ALA MB . 28058 1 34 . 1 . 1 3 3 ALA HB2 H 1 1.146 0.004 0 1 . 11 . . A 417 ALA MB . 28058 1 35 . 1 . 1 3 3 ALA HB3 H 1 1.146 0.004 0 1 . 11 . . A 417 ALA MB . 28058 1 36 . 1 . 1 3 3 ALA C C 13 174.658 0 0 1 . 2 . . A 417 ALA C . 28058 1 37 . 1 . 1 3 3 ALA CA C 13 50.337 0.023 0 1 . 10 . . A 417 ALA CA . 28058 1 38 . 1 . 1 3 3 ALA CB C 13 24.346 0.052 0 1 . 9 . . A 417 ALA CB . 28058 1 39 . 1 . 1 3 3 ALA N N 15 124.154 0.048 0 1 . 12 . . A 417 ALA N . 28058 1 40 . 1 . 1 4 4 LEU H H 1 8.952 0.008 0 1 . 24 . . A 418 LEU H . 28058 1 41 . 1 . 1 4 4 LEU HA H 1 4.642 0.006 0 1 . 13 . . A 418 LEU HA . 28058 1 42 . 1 . 1 4 4 LEU HB2 H 1 0.885 0.006 0 2 . 15 . . A 418 LEU HB2 . 28058 1 43 . 1 . 1 4 4 LEU HB3 H 1 1.278 0.004 0 2 . 17 . . A 418 LEU HB3 . 28058 1 44 . 1 . 1 4 4 LEU HG H 1 1.378 0.003 0 1 . 13 . . A 418 LEU HG . 28058 1 45 . 1 . 1 4 4 LEU HD11 H 1 -0.078 0.003 0 2 . 35 . . A 418 LEU MD1 . 28058 1 46 . 1 . 1 4 4 LEU HD12 H 1 -0.078 0.003 0 2 . 35 . . A 418 LEU MD1 . 28058 1 47 . 1 . 1 4 4 LEU HD13 H 1 -0.078 0.003 0 2 . 35 . . A 418 LEU MD1 . 28058 1 48 . 1 . 1 4 4 LEU HD21 H 1 0.495 0.005 0 2 . 26 . . A 418 LEU MD2 . 28058 1 49 . 1 . 1 4 4 LEU HD22 H 1 0.495 0.005 0 2 . 26 . . A 418 LEU MD2 . 28058 1 50 . 1 . 1 4 4 LEU HD23 H 1 0.495 0.005 0 2 . 26 . . A 418 LEU MD2 . 28058 1 51 . 1 . 1 4 4 LEU C C 13 175.025 0 0 1 . 2 . . A 418 LEU C . 28058 1 52 . 1 . 1 4 4 LEU CA C 13 55.538 0.048 0 1 . 11 . . A 418 LEU CA . 28058 1 53 . 1 . 1 4 4 LEU CB C 13 44.987 0.035 0 1 . 23 . . A 418 LEU CB . 28058 1 54 . 1 . 1 4 4 LEU CG C 13 30.603 0.057 0 1 . 7 . . A 418 LEU CG . 28058 1 55 . 1 . 1 4 4 LEU CD1 C 13 26.185 0.026 0 2 . 16 . . A 418 LEU CD1 . 28058 1 56 . 1 . 1 4 4 LEU CD2 C 13 25.302 0.051 0 2 . 14 . . A 418 LEU CD2 . 28058 1 57 . 1 . 1 4 4 LEU N N 15 119.159 0.041 0 1 . 16 . . A 418 LEU N . 28058 1 58 . 1 . 1 5 5 ASP H H 1 8.365 0.003 0 1 . 19 . . A 419 ASP H . 28058 1 59 . 1 . 1 5 5 ASP HA H 1 4.616 0.006 0 1 . 9 . . A 419 ASP HA . 28058 1 60 . 1 . 1 5 5 ASP HB2 H 1 2.173 0.002 0 2 . 10 . . A 419 ASP HB2 . 28058 1 61 . 1 . 1 5 5 ASP HB3 H 1 3.323 0.009 0 2 . 10 . . A 419 ASP HB3 . 28058 1 62 . 1 . 1 5 5 ASP C C 13 177.631 0 0 1 . 2 . . A 419 ASP C . 28058 1 63 . 1 . 1 5 5 ASP CA C 13 52.104 0.036 0 1 . 9 . . A 419 ASP CA . 28058 1 64 . 1 . 1 5 5 ASP CB C 13 41.474 0.029 0 1 . 13 . . A 419 ASP CB . 28058 1 65 . 1 . 1 5 5 ASP N N 15 118.08 0.051 0 1 . 12 . . A 419 ASP N . 28058 1 66 . 1 . 1 6 6 LEU H H 1 9.112 0.004 0 1 . 18 . . A 420 LEU H . 28058 1 67 . 1 . 1 6 6 LEU HA H 1 4.384 0.006 0 1 . 15 . . A 420 LEU HA . 28058 1 68 . 1 . 1 6 6 LEU HB2 H 1 1.445 0.005 0 2 . 15 . . A 420 LEU HB2 . 28058 1 69 . 1 . 1 6 6 LEU HB3 H 1 2.583 0.005 0 2 . 14 . . A 420 LEU HB3 . 28058 1 70 . 1 . 1 6 6 LEU HG H 1 1.599 0.005 0 1 . 13 . . A 420 LEU HG . 28058 1 71 . 1 . 1 6 6 LEU HD11 H 1 0.663 0.005 0 2 . 13 . . A 420 LEU MD1 . 28058 1 72 . 1 . 1 6 6 LEU HD12 H 1 0.663 0.005 0 2 . 13 . . A 420 LEU MD1 . 28058 1 73 . 1 . 1 6 6 LEU HD13 H 1 0.663 0.005 0 2 . 13 . . A 420 LEU MD1 . 28058 1 74 . 1 . 1 6 6 LEU HD21 H 1 0.639 0.003 0 2 . 11 . . A 420 LEU MD2 . 28058 1 75 . 1 . 1 6 6 LEU HD22 H 1 0.639 0.003 0 2 . 11 . . A 420 LEU MD2 . 28058 1 76 . 1 . 1 6 6 LEU HD23 H 1 0.639 0.003 0 2 . 11 . . A 420 LEU MD2 . 28058 1 77 . 1 . 1 6 6 LEU C C 13 177.452 0 0 1 . 2 . . A 420 LEU C . 28058 1 78 . 1 . 1 6 6 LEU CA C 13 55.967 0.081 0 1 . 10 . . A 420 LEU CA . 28058 1 79 . 1 . 1 6 6 LEU CB C 13 40.876 0.069 0 1 . 17 . . A 420 LEU CB . 28058 1 80 . 1 . 1 6 6 LEU CG C 13 26.99 0.029 0 1 . 5 . . A 420 LEU CG . 28058 1 81 . 1 . 1 6 6 LEU CD1 C 13 22.812 0.033 0 2 . 9 . . A 420 LEU CD1 . 28058 1 82 . 1 . 1 6 6 LEU CD2 C 13 24.605 0.04 0 2 . 9 . . A 420 LEU CD2 . 28058 1 83 . 1 . 1 6 6 LEU N N 15 129.488 0.06 0 1 . 14 . . A 420 LEU N . 28058 1 84 . 1 . 1 7 7 ASP H H 1 8.714 0.004 0 1 . 15 . . A 421 ASP H . 28058 1 85 . 1 . 1 7 7 ASP HA H 1 4.705 0.006 0 1 . 4 . . A 421 ASP HA . 28058 1 86 . 1 . 1 7 7 ASP HB2 H 1 2.566 0.004 0 2 . 6 . . A 421 ASP HB2 . 28058 1 87 . 1 . 1 7 7 ASP HB3 H 1 2.868 0.004 0 2 . 8 . . A 421 ASP HB3 . 28058 1 88 . 1 . 1 7 7 ASP C C 13 177.751 0 0 1 . 2 . . A 421 ASP C . 28058 1 89 . 1 . 1 7 7 ASP CA C 13 53.228 0.025 0 1 . 4 . . A 421 ASP CA . 28058 1 90 . 1 . 1 7 7 ASP CB C 13 39.494 0.013 0 1 . 12 . . A 421 ASP CB . 28058 1 91 . 1 . 1 7 7 ASP N N 15 117.733 0.04 0 1 . 13 . . A 421 ASP N . 28058 1 92 . 1 . 1 8 8 GLY H H 1 7.861 0.003 0 1 . 11 . . A 422 GLY H . 28058 1 93 . 1 . 1 8 8 GLY HA2 H 1 3.652 0.005 0 2 . 9 . . A 422 GLY HA2 . 28058 1 94 . 1 . 1 8 8 GLY HA3 H 1 4.111 0.006 0 2 . 11 . . A 422 GLY HA3 . 28058 1 95 . 1 . 1 8 8 GLY C C 13 174.35 0 0 1 . 2 . . A 422 GLY C . 28058 1 96 . 1 . 1 8 8 GLY CA C 13 47.675 0.028 0 1 . 14 . . A 422 GLY CA . 28058 1 97 . 1 . 1 8 8 GLY N N 15 109.487 0.029 0 1 . 10 . . A 422 GLY N . 28058 1 98 . 1 . 1 9 9 ASP H H 1 7.743 0.007 0 1 . 12 . . A 423 ASP H . 28058 1 99 . 1 . 1 9 9 ASP HA H 1 4.616 0.002 0 1 . 11 . . A 423 ASP HA . 28058 1 100 . 1 . 1 9 9 ASP HB2 H 1 2.328 0.005 0 2 . 10 . . A 423 ASP HB2 . 28058 1 101 . 1 . 1 9 9 ASP HB3 H 1 3.027 0.003 0 2 . 10 . . A 423 ASP HB3 . 28058 1 102 . 1 . 1 9 9 ASP C C 13 177.463 0 0 1 . 2 . . A 423 ASP C . 28058 1 103 . 1 . 1 9 9 ASP CA C 13 52.859 0.073 0 1 . 9 . . A 423 ASP CA . 28058 1 104 . 1 . 1 9 9 ASP CB C 13 40.701 0.033 0 1 . 13 . . A 423 ASP CB . 28058 1 105 . 1 . 1 9 9 ASP N N 15 121.059 0.142 0 1 . 10 . . A 423 ASP N . 28058 1 106 . 1 . 1 10 10 GLY H H 1 9.413 0.002 0 1 . 12 . . A 424 GLY H . 28058 1 107 . 1 . 1 10 10 GLY HA2 H 1 3.411 0.007 0 2 . 11 . . A 424 GLY HA2 . 28058 1 108 . 1 . 1 10 10 GLY HA3 H 1 4.503 0.007 0 2 . 11 . . A 424 GLY HA3 . 28058 1 109 . 1 . 1 10 10 GLY C C 13 174.032 0 0 1 . 2 . . A 424 GLY C . 28058 1 110 . 1 . 1 10 10 GLY CA C 13 43.274 0.022 0 1 . 15 . . A 424 GLY CA . 28058 1 111 . 1 . 1 10 10 GLY N N 15 111.343 0.026 0 1 . 10 . . A 424 GLY N . 28058 1 112 . 1 . 1 11 11 ILE H H 1 8.78 0.005 0 1 . 6 . . A 425 ILE H . 28058 1 113 . 1 . 1 11 11 ILE HA H 1 3.811 0.006 0 1 . 16 . . A 425 ILE HA . 28058 1 114 . 1 . 1 11 11 ILE HB H 1 1.619 0.002 0 1 . 10 . . A 425 ILE HB . 28058 1 115 . 1 . 1 11 11 ILE HG12 H 1 0.613 0.003 0 2 . 9 . . A 425 ILE HG12 . 28058 1 116 . 1 . 1 11 11 ILE HG13 H 1 1.559 0.008 0 2 . 10 . . A 425 ILE HG13 . 28058 1 117 . 1 . 1 11 11 ILE HG21 H 1 0.618 0.003 0 1 . 9 . . A 425 ILE MG . 28058 1 118 . 1 . 1 11 11 ILE HG22 H 1 0.618 0.003 0 1 . 9 . . A 425 ILE MG . 28058 1 119 . 1 . 1 11 11 ILE HG23 H 1 0.618 0.003 0 1 . 9 . . A 425 ILE MG . 28058 1 120 . 1 . 1 11 11 ILE HD11 H 1 0.671 0.003 0 1 . 8 . . A 425 ILE MD . 28058 1 121 . 1 . 1 11 11 ILE HD12 H 1 0.671 0.003 0 1 . 8 . . A 425 ILE MD . 28058 1 122 . 1 . 1 11 11 ILE HD13 H 1 0.671 0.003 0 1 . 8 . . A 425 ILE MD . 28058 1 123 . 1 . 1 11 11 ILE C C 13 175.289 0 0 1 . 2 . . A 425 ILE C . 28058 1 124 . 1 . 1 11 11 ILE CA C 13 63.204 0.084 0 1 . 11 . . A 425 ILE CA . 28058 1 125 . 1 . 1 11 11 ILE CB C 13 37.373 0.092 0 1 . 8 . . A 425 ILE CB . 28058 1 126 . 1 . 1 11 11 ILE CG1 C 13 29.294 0.097 0 1 . 11 . . A 425 ILE CG1 . 28058 1 127 . 1 . 1 11 11 ILE CG2 C 13 17.979 0.034 0 1 . 5 . . A 425 ILE CG2 . 28058 1 128 . 1 . 1 11 11 ILE CD1 C 13 13.746 0.011 0 1 . 4 . . A 425 ILE CD1 . 28058 1 129 . 1 . 1 11 11 ILE N N 15 123.666 0.072 0 1 . 7 . . A 425 ILE N . 28058 1 130 . 1 . 1 12 12 GLU H H 1 9.861 0.006 0 1 . 14 . . A 426 GLU H . 28058 1 131 . 1 . 1 12 12 GLU HA H 1 4.23 0.006 0 1 . 8 . . A 426 GLU HA . 28058 1 132 . 1 . 1 12 12 GLU HB2 H 1 2.006 0.002 0 2 . 5 . . A 426 GLU HB2 . 28058 1 133 . 1 . 1 12 12 GLU HB3 H 1 2.05 0.003 0 2 . 4 . . A 426 GLU HB3 . 28058 1 134 . 1 . 1 12 12 GLU HG2 H 1 2.005 0.003 0 2 . 4 . . A 426 GLU HG2 . 28058 1 135 . 1 . 1 12 12 GLU HG3 H 1 2.106 0.002 0 2 . 4 . . A 426 GLU HG3 . 28058 1 136 . 1 . 1 12 12 GLU C C 13 174.89 0 0 1 . 2 . . A 426 GLU C . 28058 1 137 . 1 . 1 12 12 GLU CA C 13 56.751 0.04 0 1 . 6 . . A 426 GLU CA . 28058 1 138 . 1 . 1 12 12 GLU CB C 13 31.03 0.05 0 1 . 10 . . A 426 GLU CB . 28058 1 139 . 1 . 1 12 12 GLU CG C 13 37.366 0.079 0 1 . 8 . . A 426 GLU CG . 28058 1 140 . 1 . 1 12 12 GLU N N 15 133.462 0.079 0 1 . 9 . . A 426 GLU N . 28058 1 141 . 1 . 1 13 13 THR H H 1 8.172 0.004 0 1 . 14 . . A 427 THR H . 28058 1 142 . 1 . 1 13 13 THR HA H 1 5.2 0.007 0 1 . 11 . . A 427 THR HA . 28058 1 143 . 1 . 1 13 13 THR HB H 1 4.344 0.005 0 1 . 8 . . A 427 THR HB . 28058 1 144 . 1 . 1 13 13 THR HG21 H 1 0.858 0.003 0 1 . 12 . . A 427 THR MG . 28058 1 145 . 1 . 1 13 13 THR HG22 H 1 0.858 0.003 0 1 . 12 . . A 427 THR MG . 28058 1 146 . 1 . 1 13 13 THR HG23 H 1 0.858 0.003 0 1 . 12 . . A 427 THR MG . 28058 1 147 . 1 . 1 13 13 THR C C 13 173.48 0 0 1 . 2 . . A 427 THR C . 28058 1 148 . 1 . 1 13 13 THR CA C 13 59.262 0.022 0 1 . 8 . . A 427 THR CA . 28058 1 149 . 1 . 1 13 13 THR CB C 13 72.873 0.042 0 1 . 9 . . A 427 THR CB . 28058 1 150 . 1 . 1 13 13 THR CG2 C 13 23.205 0.065 0 1 . 6 . . A 427 THR CG2 . 28058 1 151 . 1 . 1 13 13 THR N N 15 113.091 0.041 0 1 . 12 . . A 427 THR N . 28058 1 152 . 1 . 1 14 14 VAL H H 1 8.337 0.004 0 1 . 15 . . A 428 VAL H . 28058 1 153 . 1 . 1 14 14 VAL HA H 1 4.545 0.004 0 1 . 17 . . A 428 VAL HA . 28058 1 154 . 1 . 1 14 14 VAL HB H 1 2.068 0.004 0 1 . 14 . . A 428 VAL HB . 28058 1 155 . 1 . 1 14 14 VAL HG11 H 1 0.819 0.003 0 2 . 8 . . A 428 VAL MG1 . 28058 1 156 . 1 . 1 14 14 VAL HG12 H 1 0.819 0.003 0 2 . 8 . . A 428 VAL MG1 . 28058 1 157 . 1 . 1 14 14 VAL HG13 H 1 0.819 0.003 0 2 . 8 . . A 428 VAL MG1 . 28058 1 158 . 1 . 1 14 14 VAL HG21 H 1 0.941 0.004 0 2 . 10 . . A 428 VAL MG2 . 28058 1 159 . 1 . 1 14 14 VAL HG22 H 1 0.941 0.004 0 2 . 10 . . A 428 VAL MG2 . 28058 1 160 . 1 . 1 14 14 VAL HG23 H 1 0.941 0.004 0 2 . 10 . . A 428 VAL MG2 . 28058 1 161 . 1 . 1 14 14 VAL C C 13 176.126 0 0 1 . 1 . . A 428 VAL C . 28058 1 162 . 1 . 1 14 14 VAL CA C 13 59.604 0.061 0 1 . 11 . . A 428 VAL CA . 28058 1 163 . 1 . 1 14 14 VAL CB C 13 35.764 0.038 0 1 . 8 . . A 428 VAL CB . 28058 1 164 . 1 . 1 14 14 VAL CG1 C 13 19.335 0.031 0 2 . 4 . . A 428 VAL CG1 . 28058 1 165 . 1 . 1 14 14 VAL CG2 C 13 21.446 0.065 0 2 . 5 . . A 428 VAL CG2 . 28058 1 166 . 1 . 1 14 14 VAL N N 15 113.871 0.1 0 1 . 12 . . A 428 VAL N . 28058 1 167 . 1 . 1 15 15 ALA H H 1 8.467 0.003 0 1 . 4 . . A 429 ALA H . 28058 1 168 . 1 . 1 15 15 ALA N N 15 126.987 0.125 0 1 . 4 . . A 429 ALA N . 28058 1 169 . 1 . 1 37 37 TRP HA H 1 5.402 0.004 0 1 . 11 . . A 451 TRP HA . 28058 1 170 . 1 . 1 37 37 TRP HB2 H 1 2.857 0.006 0 2 . 5 . . A 451 TRP HB2 . 28058 1 171 . 1 . 1 37 37 TRP HB3 H 1 2.947 0.019 0 2 . 6 . . A 451 TRP HB3 . 28058 1 172 . 1 . 1 37 37 TRP HD1 H 1 7 0.001 0 1 . 4 . . A 451 TRP HD1 . 28058 1 173 . 1 . 1 37 37 TRP HE3 H 1 8.008 0.014 0 1 . 5 . . A 451 TRP HE3 . 28058 1 174 . 1 . 1 37 37 TRP C C 13 173.891 0 0 1 . 1 . . A 451 TRP C . 28058 1 175 . 1 . 1 37 37 TRP CA C 13 54.72 0.085 0 1 . 8 . . A 451 TRP CA . 28058 1 176 . 1 . 1 37 37 TRP CB C 13 35.997 0.07 0 1 . 7 . . A 451 TRP CB . 28058 1 177 . 1 . 1 37 37 TRP CD1 C 13 129.177 0.083 0 1 . 3 . . A 451 TRP CD1 . 28058 1 178 . 1 . 1 37 37 TRP CE3 C 13 121.124 0.043 0 1 . 2 . . A 451 TRP CE3 . 28058 1 179 . 1 . 1 38 38 VAL H H 1 5.905 0.007 0 1 . 16 . . A 452 VAL H . 28058 1 180 . 1 . 1 38 38 VAL HA H 1 3.971 0.007 0 1 . 16 . . A 452 VAL HA . 28058 1 181 . 1 . 1 38 38 VAL HB H 1 0.857 0.005 0 1 . 19 . . A 452 VAL HB . 28058 1 182 . 1 . 1 38 38 VAL HG11 H 1 0.177 0.004 0 2 . 17 . . A 452 VAL MG1 . 28058 1 183 . 1 . 1 38 38 VAL HG12 H 1 0.177 0.004 0 2 . 17 . . A 452 VAL MG1 . 28058 1 184 . 1 . 1 38 38 VAL HG13 H 1 0.177 0.004 0 2 . 17 . . A 452 VAL MG1 . 28058 1 185 . 1 . 1 38 38 VAL HG21 H 1 0.634 0.003 0 2 . 19 . . A 452 VAL MG2 . 28058 1 186 . 1 . 1 38 38 VAL HG22 H 1 0.634 0.003 0 2 . 19 . . A 452 VAL MG2 . 28058 1 187 . 1 . 1 38 38 VAL HG23 H 1 0.634 0.003 0 2 . 19 . . A 452 VAL MG2 . 28058 1 188 . 1 . 1 38 38 VAL C C 13 176.094 0 0 1 . 1 . . A 452 VAL C . 28058 1 189 . 1 . 1 38 38 VAL CA C 13 61.516 0.032 0 1 . 10 . . A 452 VAL CA . 28058 1 190 . 1 . 1 38 38 VAL CB C 13 33.235 0.041 0 1 . 11 . . A 452 VAL CB . 28058 1 191 . 1 . 1 38 38 VAL CG1 C 13 22.078 0.027 0 2 . 8 . . A 452 VAL CG1 . 28058 1 192 . 1 . 1 38 38 VAL CG2 C 13 20.966 0.07 0 2 . 10 . . A 452 VAL CG2 . 28058 1 193 . 1 . 1 38 38 VAL N N 15 121.409 0.11 0 1 . 11 . . A 452 VAL N . 28058 1 194 . 1 . 1 39 39 SER H H 1 8.131 0.008 0 1 . 6 . . A 453 SER H . 28058 1 195 . 1 . 1 39 39 SER HA H 1 3.979 0.004 0 1 . 13 . . A 453 SER HA . 28058 1 196 . 1 . 1 39 39 SER HB2 H 1 3.486 0.002 0 2 . 10 . . A 453 SER HB2 . 28058 1 197 . 1 . 1 39 39 SER HB3 H 1 3.585 0.003 0 2 . 10 . . A 453 SER HB3 . 28058 1 198 . 1 . 1 39 39 SER C C 13 174.149 0 0 1 . 2 . . A 453 SER C . 28058 1 199 . 1 . 1 39 39 SER CA C 13 58.475 0.066 0 1 . 8 . . A 453 SER CA . 28058 1 200 . 1 . 1 39 39 SER CB C 13 63.732 0.057 0 1 . 15 . . A 453 SER CB . 28058 1 201 . 1 . 1 39 39 SER N N 15 122.804 0.206 0 1 . 3 . . A 453 SER N . 28058 1 202 . 1 . 1 40 40 ALA H H 1 8.333 0.007 0 1 . 12 . . A 454 ALA H . 28058 1 203 . 1 . 1 40 40 ALA HA H 1 3.804 0.004 0 1 . 11 . . A 454 ALA HA . 28058 1 204 . 1 . 1 40 40 ALA HB1 H 1 1.459 0.003 0 1 . 9 . . A 454 ALA MB . 28058 1 205 . 1 . 1 40 40 ALA HB2 H 1 1.459 0.003 0 1 . 9 . . A 454 ALA MB . 28058 1 206 . 1 . 1 40 40 ALA HB3 H 1 1.459 0.003 0 1 . 9 . . A 454 ALA MB . 28058 1 207 . 1 . 1 40 40 ALA C C 13 176.685 0 0 1 . 2 . . A 454 ALA C . 28058 1 208 . 1 . 1 40 40 ALA CA C 13 54.646 0.096 0 1 . 8 . . A 454 ALA CA . 28058 1 209 . 1 . 1 40 40 ALA CB C 13 20.016 0.056 0 1 . 8 . . A 454 ALA CB . 28058 1 210 . 1 . 1 40 40 ALA N N 15 125.256 0.052 0 1 . 11 . . A 454 ALA N . 28058 1 211 . 1 . 1 41 41 ASP H H 1 7.614 0.003 0 1 . 13 . . A 455 ASP H . 28058 1 212 . 1 . 1 41 41 ASP HA H 1 4.018 0.004 0 1 . 7 . . A 455 ASP HA . 28058 1 213 . 1 . 1 41 41 ASP HB2 H 1 2.284 0.004 0 2 . 5 . . A 455 ASP HB2 . 28058 1 214 . 1 . 1 41 41 ASP HB3 H 1 2.77 0.004 0 2 . 5 . . A 455 ASP HB3 . 28058 1 215 . 1 . 1 41 41 ASP C C 13 175.611 0 0 1 . 2 . . A 455 ASP C . 28058 1 216 . 1 . 1 41 41 ASP CA C 13 56.335 0.023 0 1 . 6 . . A 455 ASP CA . 28058 1 217 . 1 . 1 41 41 ASP CB C 13 41.307 0.039 0 1 . 9 . . A 455 ASP CB . 28058 1 218 . 1 . 1 41 41 ASP N N 15 116.069 0.05 0 1 . 11 . . A 455 ASP N . 28058 1 219 . 1 . 1 42 42 ASP H H 1 7.508 0.005 0 1 . 10 . . A 456 ASP H . 28058 1 220 . 1 . 1 42 42 ASP HA H 1 5.066 0.008 0 1 . 11 . . A 456 ASP HA . 28058 1 221 . 1 . 1 42 42 ASP HB2 H 1 2.291 0.002 0 2 . 8 . . A 456 ASP HB2 . 28058 1 222 . 1 . 1 42 42 ASP HB3 H 1 3.287 0.005 0 2 . 9 . . A 456 ASP HB3 . 28058 1 223 . 1 . 1 42 42 ASP C C 13 173.696 0 0 1 . 2 . . A 456 ASP C . 28058 1 224 . 1 . 1 42 42 ASP CA C 13 52.79 0.029 0 1 . 9 . . A 456 ASP CA . 28058 1 225 . 1 . 1 42 42 ASP CB C 13 43.154 0.032 0 1 . 11 . . A 456 ASP CB . 28058 1 226 . 1 . 1 42 42 ASP N N 15 116.42 0.052 0 1 . 11 . . A 456 ASP N . 28058 1 227 . 1 . 1 43 43 GLY H H 1 7.48 0.004 0 1 . 12 . . A 457 GLY H . 28058 1 228 . 1 . 1 43 43 GLY HA2 H 1 3.093 0.007 0 2 . 10 . . A 457 GLY HA2 . 28058 1 229 . 1 . 1 43 43 GLY HA3 H 1 4.808 0.004 0 2 . 7 . . A 457 GLY HA3 . 28058 1 230 . 1 . 1 43 43 GLY C C 13 172.193 0 0 1 . 2 . . A 457 GLY C . 28058 1 231 . 1 . 1 43 43 GLY CA C 13 45.643 0.039 0 1 . 12 . . A 457 GLY CA . 28058 1 232 . 1 . 1 43 43 GLY N N 15 99.221 0.036 0 1 . 11 . . A 457 GLY N . 28058 1 233 . 1 . 1 44 44 LEU H H 1 8.489 0.003 0 1 . 7 . . A 458 LEU H . 28058 1 234 . 1 . 1 44 44 LEU HB2 H 1 1.327 0.003 0 2 . 3 . . A 458 LEU HB2 . 28058 1 235 . 1 . 1 44 44 LEU HB3 H 1 1.423 0.005 0 2 . 5 . . A 458 LEU HB3 . 28058 1 236 . 1 . 1 44 44 LEU HD11 H 1 -0.509 0.006 0 2 . 5 . . A 458 LEU MD1 . 28058 1 237 . 1 . 1 44 44 LEU HD12 H 1 -0.509 0.006 0 2 . 5 . . A 458 LEU MD1 . 28058 1 238 . 1 . 1 44 44 LEU HD13 H 1 -0.509 0.006 0 2 . 5 . . A 458 LEU MD1 . 28058 1 239 . 1 . 1 44 44 LEU HD21 H 1 0.35 0 0 2 . 1 . . A 458 LEU MD2 . 28058 1 240 . 1 . 1 44 44 LEU HD22 H 1 0.35 0 0 2 . 1 . . A 458 LEU MD2 . 28058 1 241 . 1 . 1 44 44 LEU HD23 H 1 0.35 0 0 2 . 1 . . A 458 LEU MD2 . 28058 1 242 . 1 . 1 44 44 LEU C C 13 176.082 0 0 1 . 2 . . A 458 LEU C . 28058 1 243 . 1 . 1 44 44 LEU CA C 13 54.05 0.055 0 1 . 3 . . A 458 LEU CA . 28058 1 244 . 1 . 1 44 44 LEU CB C 13 44.819 0.052 0 1 . 9 . . A 458 LEU CB . 28058 1 245 . 1 . 1 44 44 LEU CD1 C 13 25.479 0.005 0 2 . 2 . . A 458 LEU CD1 . 28058 1 246 . 1 . 1 44 44 LEU CD2 C 13 24.12 0 0 2 . 1 . . A 458 LEU CD2 . 28058 1 247 . 1 . 1 44 44 LEU N N 15 120.063 0.032 0 1 . 7 . . A 458 LEU N . 28058 1 248 . 1 . 1 45 45 LEU H H 1 7.338 0.004 0 1 . 16 . . A 459 LEU H . 28058 1 249 . 1 . 1 45 45 LEU HA H 1 4.729 0.008 0 1 . 8 . . A 459 LEU HA . 28058 1 250 . 1 . 1 45 45 LEU HB2 H 1 0.783 0.008 0 2 . 8 . . A 459 LEU HB2 . 28058 1 251 . 1 . 1 45 45 LEU HB3 H 1 1.723 0.007 0 2 . 12 . . A 459 LEU HB3 . 28058 1 252 . 1 . 1 45 45 LEU HG H 1 1.454 0.002 0 1 . 3 . . A 459 LEU HG . 28058 1 253 . 1 . 1 45 45 LEU HD11 H 1 0.125 0.005 0 2 . 21 . . A 459 LEU MD1 . 28058 1 254 . 1 . 1 45 45 LEU HD12 H 1 0.125 0.005 0 2 . 21 . . A 459 LEU MD1 . 28058 1 255 . 1 . 1 45 45 LEU HD13 H 1 0.125 0.005 0 2 . 21 . . A 459 LEU MD1 . 28058 1 256 . 1 . 1 45 45 LEU HD21 H 1 0.704 0.007 0 2 . 14 . . A 459 LEU MD2 . 28058 1 257 . 1 . 1 45 45 LEU HD22 H 1 0.704 0.007 0 2 . 14 . . A 459 LEU MD2 . 28058 1 258 . 1 . 1 45 45 LEU HD23 H 1 0.704 0.007 0 2 . 14 . . A 459 LEU MD2 . 28058 1 259 . 1 . 1 45 45 LEU C C 13 175.721 0 0 1 . 2 . . A 459 LEU C . 28058 1 260 . 1 . 1 45 45 LEU CA C 13 54.595 0.111 0 1 . 9 . . A 459 LEU CA . 28058 1 261 . 1 . 1 45 45 LEU CB C 13 43.105 0.095 0 1 . 13 . . A 459 LEU CB . 28058 1 262 . 1 . 1 45 45 LEU CD1 C 13 27.635 0.044 0 2 . 11 . . A 459 LEU CD1 . 28058 1 263 . 1 . 1 45 45 LEU CD2 C 13 23.004 0.022 0 2 . 8 . . A 459 LEU CD2 . 28058 1 264 . 1 . 1 45 45 LEU N N 15 123.616 0.06 0 1 . 13 . . A 459 LEU N . 28058 1 265 . 1 . 1 46 46 VAL H H 1 9.104 0.004 0 1 . 16 . . A 460 VAL H . 28058 1 266 . 1 . 1 46 46 VAL HA H 1 5.595 0.005 0 1 . 16 . . A 460 VAL HA . 28058 1 267 . 1 . 1 46 46 VAL HB H 1 2.323 0.003 0 1 . 17 . . A 460 VAL HB . 28058 1 268 . 1 . 1 46 46 VAL HG11 H 1 0.582 0.003 0 2 . 19 . . A 460 VAL MG1 . 28058 1 269 . 1 . 1 46 46 VAL HG12 H 1 0.582 0.003 0 2 . 19 . . A 460 VAL MG1 . 28058 1 270 . 1 . 1 46 46 VAL HG13 H 1 0.582 0.003 0 2 . 19 . . A 460 VAL MG1 . 28058 1 271 . 1 . 1 46 46 VAL HG21 H 1 1.136 0.003 0 2 . 18 . . A 460 VAL MG2 . 28058 1 272 . 1 . 1 46 46 VAL HG22 H 1 1.136 0.003 0 2 . 18 . . A 460 VAL MG2 . 28058 1 273 . 1 . 1 46 46 VAL HG23 H 1 1.136 0.003 0 2 . 18 . . A 460 VAL MG2 . 28058 1 274 . 1 . 1 46 46 VAL C C 13 174.027 0 0 1 . 1 . . A 460 VAL C . 28058 1 275 . 1 . 1 46 46 VAL CA C 13 59.307 0.026 0 1 . 12 . . A 460 VAL CA . 28058 1 276 . 1 . 1 46 46 VAL CB C 13 36.441 0.069 0 1 . 13 . . A 460 VAL CB . 28058 1 277 . 1 . 1 46 46 VAL CG1 C 13 20.371 0.01 0 2 . 10 . . A 460 VAL CG1 . 28058 1 278 . 1 . 1 46 46 VAL CG2 C 13 23.479 0.023 0 2 . 10 . . A 460 VAL CG2 . 28058 1 279 . 1 . 1 46 46 VAL N N 15 119.408 0.102 0 1 . 13 . . A 460 VAL N . 28058 1 280 . 1 . 1 47 47 ARG H H 1 8.53 0.006 0 1 . 8 . . A 461 ARG H . 28058 1 281 . 1 . 1 47 47 ARG HA H 1 4.352 0.003 0 1 . 7 . . A 461 ARG HA . 28058 1 282 . 1 . 1 47 47 ARG HB2 H 1 1.603 0 0 2 . 1 . . A 461 ARG HB2 . 28058 1 283 . 1 . 1 47 47 ARG HB3 H 1 1.799 0.004 0 2 . 4 . . A 461 ARG HB3 . 28058 1 284 . 1 . 1 47 47 ARG HG2 H 1 1.225 0.003 0 2 . 4 . . A 461 ARG HG2 . 28058 1 285 . 1 . 1 47 47 ARG HG3 H 1 1.568 0.004 0 2 . 4 . . A 461 ARG HG3 . 28058 1 286 . 1 . 1 47 47 ARG HD2 H 1 2.999 0.001 0 2 . 3 . . A 461 ARG HD2 . 28058 1 287 . 1 . 1 47 47 ARG HD3 H 1 3.069 0.005 0 2 . 3 . . A 461 ARG HD3 . 28058 1 288 . 1 . 1 47 47 ARG C C 13 173.742 0 0 1 . 2 . . A 461 ARG C . 28058 1 289 . 1 . 1 47 47 ARG CA C 13 56.098 0.049 0 1 . 6 . . A 461 ARG CA . 28058 1 290 . 1 . 1 47 47 ARG CB C 13 34.258 0.016 0 1 . 4 . . A 461 ARG CB . 28058 1 291 . 1 . 1 47 47 ARG CG C 13 26.436 0.019 0 1 . 6 . . A 461 ARG CG . 28058 1 292 . 1 . 1 47 47 ARG CD C 13 44.76 0.038 0 1 . 6 . . A 461 ARG CD . 28058 1 293 . 1 . 1 47 47 ARG N N 15 119.435 0.083 0 1 . 7 . . A 461 ARG N . 28058 1 294 . 1 . 1 48 48 ASP H H 1 8.955 0.003 0 1 . 14 . . A 462 ASP H . 28058 1 295 . 1 . 1 48 48 ASP HA H 1 4.566 0.003 0 1 . 10 . . A 462 ASP HA . 28058 1 296 . 1 . 1 48 48 ASP HB2 H 1 2.044 0.003 0 2 . 11 . . A 462 ASP HB2 . 28058 1 297 . 1 . 1 48 48 ASP HB3 H 1 2.694 0.002 0 2 . 8 . . A 462 ASP HB3 . 28058 1 298 . 1 . 1 48 48 ASP C C 13 177.434 0 0 1 . 2 . . A 462 ASP C . 28058 1 299 . 1 . 1 48 48 ASP CA C 13 53.207 0.027 0 1 . 8 . . A 462 ASP CA . 28058 1 300 . 1 . 1 48 48 ASP CB C 13 39.558 0.031 0 1 . 14 . . A 462 ASP CB . 28058 1 301 . 1 . 1 48 48 ASP N N 15 123.775 0.045 0 1 . 12 . . A 462 ASP N . 28058 1 302 . 1 . 1 49 49 LEU H H 1 8.395 0.004 0 1 . 14 . . A 463 LEU H . 28058 1 303 . 1 . 1 49 49 LEU HA H 1 4.191 0.004 0 1 . 17 . . A 463 LEU HA . 28058 1 304 . 1 . 1 49 49 LEU HB2 H 1 1.506 0.005 0 2 . 12 . . A 463 LEU HB2 . 28058 1 305 . 1 . 1 49 49 LEU HB3 H 1 1.803 0.004 0 2 . 16 . . A 463 LEU HB3 . 28058 1 306 . 1 . 1 49 49 LEU HG H 1 1.66 0.003 0 1 . 9 . . A 463 LEU HG . 28058 1 307 . 1 . 1 49 49 LEU HD11 H 1 0.794 0.006 0 2 . 20 . . A 463 LEU MD1 . 28058 1 308 . 1 . 1 49 49 LEU HD12 H 1 0.794 0.006 0 2 . 20 . . A 463 LEU MD1 . 28058 1 309 . 1 . 1 49 49 LEU HD13 H 1 0.794 0.006 0 2 . 20 . . A 463 LEU MD1 . 28058 1 310 . 1 . 1 49 49 LEU HD21 H 1 0.925 0.002 0 2 . 18 . . A 463 LEU MD2 . 28058 1 311 . 1 . 1 49 49 LEU HD22 H 1 0.925 0.002 0 2 . 18 . . A 463 LEU MD2 . 28058 1 312 . 1 . 1 49 49 LEU HD23 H 1 0.925 0.002 0 2 . 18 . . A 463 LEU MD2 . 28058 1 313 . 1 . 1 49 49 LEU C C 13 178.152 0 0 1 . 2 . . A 463 LEU C . 28058 1 314 . 1 . 1 49 49 LEU CA C 13 56.741 0.038 0 1 . 12 . . A 463 LEU CA . 28058 1 315 . 1 . 1 49 49 LEU CB C 13 43.73 0.059 0 1 . 17 . . A 463 LEU CB . 28058 1 316 . 1 . 1 49 49 LEU CG C 13 26.72 0.072 0 1 . 8 . . A 463 LEU CG . 28058 1 317 . 1 . 1 49 49 LEU CD1 C 13 22.321 0.031 0 2 . 10 . . A 463 LEU CD1 . 28058 1 318 . 1 . 1 49 49 LEU CD2 C 13 26.528 0.087 0 2 . 9 . . A 463 LEU CD2 . 28058 1 319 . 1 . 1 49 49 LEU N N 15 127.315 0.037 0 1 . 10 . . A 463 LEU N . 28058 1 320 . 1 . 1 50 50 ASN H H 1 7.798 0.005 0 1 . 13 . . A 464 ASN H . 28058 1 321 . 1 . 1 50 50 ASN HA H 1 4.799 0.003 0 1 . 11 . . A 464 ASN HA . 28058 1 322 . 1 . 1 50 50 ASN HB2 H 1 2.79 0.001 0 2 . 7 . . A 464 ASN HB2 . 28058 1 323 . 1 . 1 50 50 ASN HB3 H 1 3.292 0.004 0 2 . 8 . . A 464 ASN HB3 . 28058 1 324 . 1 . 1 50 50 ASN C C 13 176.909 0 0 1 . 2 . . A 464 ASN C . 28058 1 325 . 1 . 1 50 50 ASN CA C 13 51.643 0.031 0 1 . 10 . . A 464 ASN CA . 28058 1 326 . 1 . 1 50 50 ASN CB C 13 37.048 0.022 0 1 . 10 . . A 464 ASN CB . 28058 1 327 . 1 . 1 50 50 ASN N N 15 113.073 0.123 0 1 . 13 . . A 464 ASN N . 28058 1 328 . 1 . 1 51 51 GLY H H 1 7.551 0.002 0 1 . 9 . . A 465 GLY H . 28058 1 329 . 1 . 1 51 51 GLY HA2 H 1 3.729 0.003 0 2 . 8 . . A 465 GLY HA2 . 28058 1 330 . 1 . 1 51 51 GLY HA3 H 1 3.845 0.007 0 2 . 6 . . A 465 GLY HA3 . 28058 1 331 . 1 . 1 51 51 GLY C C 13 174.453 0 0 1 . 2 . . A 465 GLY C . 28058 1 332 . 1 . 1 51 51 GLY CA C 13 47.422 0.033 0 1 . 12 . . A 465 GLY CA . 28058 1 333 . 1 . 1 51 51 GLY N N 15 107.243 0.063 0 1 . 8 . . A 465 GLY N . 28058 1 334 . 1 . 1 52 52 ASN H H 1 7.753 0.006 0 1 . 11 . . A 466 ASN H . 28058 1 335 . 1 . 1 52 52 ASN HA H 1 4.635 0.004 0 1 . 12 . . A 466 ASN HA . 28058 1 336 . 1 . 1 52 52 ASN HB2 H 1 2.651 0.003 0 2 . 9 . . A 466 ASN HB2 . 28058 1 337 . 1 . 1 52 52 ASN HB3 H 1 3.217 0.002 0 2 . 7 . . A 466 ASN HB3 . 28058 1 338 . 1 . 1 52 52 ASN C C 13 176.508 0 0 1 . 2 . . A 466 ASN C . 28058 1 339 . 1 . 1 52 52 ASN CA C 13 52.144 0.078 0 1 . 10 . . A 466 ASN CA . 28058 1 340 . 1 . 1 52 52 ASN CB C 13 37.802 0.019 0 1 . 11 . . A 466 ASN CB . 28058 1 341 . 1 . 1 52 52 ASN N N 15 117.106 0.049 0 1 . 9 . . A 466 ASN N . 28058 1 342 . 1 . 1 53 53 GLY H H 1 10.192 0.003 0 1 . 15 . . A 467 GLY H . 28058 1 343 . 1 . 1 53 53 GLY HA2 H 1 3.315 0.001 0 2 . 7 . . A 467 GLY HA2 . 28058 1 344 . 1 . 1 53 53 GLY HA3 H 1 3.966 0.005 0 2 . 9 . . A 467 GLY HA3 . 28058 1 345 . 1 . 1 53 53 GLY C C 13 172.533 0 0 1 . 1 . . A 467 GLY C . 28058 1 346 . 1 . 1 53 53 GLY CA C 13 45.464 0.031 0 1 . 12 . . A 467 GLY CA . 28058 1 347 . 1 . 1 53 53 GLY N N 15 112.465 0.043 0 1 . 13 . . A 467 GLY N . 28058 1 348 . 1 . 1 54 54 ILE H H 1 7.252 0.005 0 1 . 15 . . A 468 ILE H . 28058 1 349 . 1 . 1 54 54 ILE HA H 1 4.017 0.005 0 1 . 17 . . A 468 ILE HA . 28058 1 350 . 1 . 1 54 54 ILE HB H 1 1.42 0.002 0 1 . 22 . . A 468 ILE HB . 28058 1 351 . 1 . 1 54 54 ILE HG12 H 1 0.641 0.003 0 2 . 7 . . A 468 ILE HG12 . 28058 1 352 . 1 . 1 54 54 ILE HG13 H 1 1.118 0.005 0 2 . 20 . . A 468 ILE HG13 . 28058 1 353 . 1 . 1 54 54 ILE HG21 H 1 0.626 0.001 0 1 . 12 . . A 468 ILE MG . 28058 1 354 . 1 . 1 54 54 ILE HG22 H 1 0.626 0.001 0 1 . 12 . . A 468 ILE MG . 28058 1 355 . 1 . 1 54 54 ILE HG23 H 1 0.626 0.001 0 1 . 12 . . A 468 ILE MG . 28058 1 356 . 1 . 1 54 54 ILE HD11 H 1 0.665 0.003 0 1 . 14 . . A 468 ILE MD . 28058 1 357 . 1 . 1 54 54 ILE HD12 H 1 0.665 0.003 0 1 . 14 . . A 468 ILE MD . 28058 1 358 . 1 . 1 54 54 ILE HD13 H 1 0.665 0.003 0 1 . 14 . . A 468 ILE MD . 28058 1 359 . 1 . 1 54 54 ILE C C 13 174.082 0 0 1 . 1 . . A 468 ILE C . 28058 1 360 . 1 . 1 54 54 ILE CA C 13 58.379 0.039 0 1 . 11 . . A 468 ILE CA . 28058 1 361 . 1 . 1 54 54 ILE CB C 13 42.134 0.047 0 1 . 13 . . A 468 ILE CB . 28058 1 362 . 1 . 1 54 54 ILE CG1 C 13 26.642 0.116 0 1 . 16 . . A 468 ILE CG1 . 28058 1 363 . 1 . 1 54 54 ILE CG2 C 13 18.012 0.024 0 1 . 8 . . A 468 ILE CG2 . 28058 1 364 . 1 . 1 54 54 ILE CD1 C 13 13.58 0.018 0 1 . 9 . . A 468 ILE CD1 . 28058 1 365 . 1 . 1 54 54 ILE N N 15 114.18 0.062 0 1 . 8 . . A 468 ILE N . 28058 1 366 . 1 . 1 55 55 ILE H H 1 8.354 0.007 0 1 . 13 . . A 469 ILE H . 28058 1 367 . 1 . 1 55 55 ILE HA H 1 4.948 0.004 0 1 . 19 . . A 469 ILE HA . 28058 1 368 . 1 . 1 55 55 ILE HB H 1 1.411 0.005 0 1 . 18 . . A 469 ILE HB . 28058 1 369 . 1 . 1 55 55 ILE HG12 H 1 0.769 0.005 0 2 . 11 . . A 469 ILE HG12 . 28058 1 370 . 1 . 1 55 55 ILE HG13 H 1 1.082 0.005 0 2 . 11 . . A 469 ILE HG13 . 28058 1 371 . 1 . 1 55 55 ILE HG21 H 1 1.001 0.007 0 1 . 18 . . A 469 ILE MG . 28058 1 372 . 1 . 1 55 55 ILE HG22 H 1 1.001 0.007 0 1 . 18 . . A 469 ILE MG . 28058 1 373 . 1 . 1 55 55 ILE HG23 H 1 1.001 0.007 0 1 . 18 . . A 469 ILE MG . 28058 1 374 . 1 . 1 55 55 ILE HD11 H 1 0.392 0.004 0 1 . 25 . . A 469 ILE MD . 28058 1 375 . 1 . 1 55 55 ILE HD12 H 1 0.392 0.004 0 1 . 25 . . A 469 ILE MD . 28058 1 376 . 1 . 1 55 55 ILE HD13 H 1 0.392 0.004 0 1 . 25 . . A 469 ILE MD . 28058 1 377 . 1 . 1 55 55 ILE C C 13 176.007 0 0 1 . 1 . . A 469 ILE C . 28058 1 378 . 1 . 1 55 55 ILE CA C 13 56.761 0.118 0 1 . 15 . . A 469 ILE CA . 28058 1 379 . 1 . 1 55 55 ILE CB C 13 33.044 0.082 0 1 . 13 . . A 469 ILE CB . 28058 1 380 . 1 . 1 55 55 ILE CG1 C 13 26.302 0.031 0 1 . 11 . . A 469 ILE CG1 . 28058 1 381 . 1 . 1 55 55 ILE CG2 C 13 17.265 0.02 0 1 . 10 . . A 469 ILE CG2 . 28058 1 382 . 1 . 1 55 55 ILE CD1 C 13 7.044 0.043 0 1 . 12 . . A 469 ILE CD1 . 28058 1 383 . 1 . 1 55 55 ILE N N 15 127.735 0.081 0 1 . 10 . . A 469 ILE N . 28058 1 384 . 1 . 1 56 56 ASP H H 1 8.785 0.01 0 1 . 10 . . A 470 ASP H . 28058 1 385 . 1 . 1 56 56 ASP HA H 1 4.112 0.008 0 1 . 5 . . A 470 ASP HA . 28058 1 386 . 1 . 1 56 56 ASP HB2 H 1 2.158 0.01 0 2 . 6 . . A 470 ASP HB2 . 28058 1 387 . 1 . 1 56 56 ASP HB3 H 1 2.483 0.01 0 2 . 6 . . A 470 ASP HB3 . 28058 1 388 . 1 . 1 56 56 ASP CB C 13 44.354 0.044 0 1 . 9 . . A 470 ASP CB . 28058 1 389 . 1 . 1 56 56 ASP N N 15 124.778 0.081 0 1 . 7 . . A 470 ASP N . 28058 1 390 . 1 . 1 57 57 ASN H H 1 7.228 0.003 0 1 . 6 . . A 471 ASN H . 28058 1 391 . 1 . 1 57 57 ASN N N 15 107.126 0.094 0 1 . 5 . . A 471 ASN N . 28058 1 392 . 1 . 1 58 58 GLY C C 13 174.127 0 0 1 . 1 . . A 472 GLY C . 28058 1 393 . 1 . 1 58 58 GLY CA C 13 47.538 0 0 1 . 1 . . A 472 GLY CA . 28058 1 394 . 1 . 1 59 59 ALA H H 1 8.252 0.009 0 1 . 4 . . A 473 ALA H . 28058 1 395 . 1 . 1 59 59 ALA HB1 H 1 1.591 0.002 0 1 . 4 . . A 473 ALA MB . 28058 1 396 . 1 . 1 59 59 ALA HB2 H 1 1.591 0.002 0 1 . 4 . . A 473 ALA MB . 28058 1 397 . 1 . 1 59 59 ALA HB3 H 1 1.591 0.002 0 1 . 4 . . A 473 ALA MB . 28058 1 398 . 1 . 1 59 59 ALA C C 13 179.56 0 0 1 . 1 . . A 473 ALA C . 28058 1 399 . 1 . 1 59 59 ALA CB C 13 18.493 0.006 0 1 . 4 . . A 473 ALA CB . 28058 1 400 . 1 . 1 59 59 ALA N N 15 121.79 0.014 0 1 . 3 . . A 473 ALA N . 28058 1 401 . 1 . 1 60 60 GLU H H 1 7.64 0.016 0 1 . 8 . . A 474 GLU H . 28058 1 402 . 1 . 1 60 60 GLU HA H 1 4.502 0.003 0 1 . 14 . . A 474 GLU HA . 28058 1 403 . 1 . 1 60 60 GLU HB2 H 1 2.029 0.004 0 2 . 11 . . A 474 GLU HB2 . 28058 1 404 . 1 . 1 60 60 GLU HB3 H 1 2.964 0.008 0 2 . 11 . . A 474 GLU HB3 . 28058 1 405 . 1 . 1 60 60 GLU HG2 H 1 2.376 0.006 0 2 . 8 . . A 474 GLU HG2 . 28058 1 406 . 1 . 1 60 60 GLU HG3 H 1 2.631 0.006 0 2 . 12 . . A 474 GLU HG3 . 28058 1 407 . 1 . 1 60 60 GLU C C 13 174.752 0 0 1 . 2 . . A 474 GLU C . 28058 1 408 . 1 . 1 60 60 GLU CA C 13 56.73 0.05 0 1 . 12 . . A 474 GLU CA . 28058 1 409 . 1 . 1 60 60 GLU CB C 13 30.556 0.077 0 1 . 15 . . A 474 GLU CB . 28058 1 410 . 1 . 1 60 60 GLU CG C 13 38.463 0.07 0 1 . 11 . . A 474 GLU CG . 28058 1 411 . 1 . 1 60 60 GLU N N 15 114.868 0.112 0 1 . 5 . . A 474 GLU N . 28058 1 412 . 1 . 1 61 61 LEU H H 1 6.738 0.006 0 1 . 14 . . A 475 LEU H . 28058 1 413 . 1 . 1 61 61 LEU HA H 1 4.944 0.007 0 1 . 18 . . A 475 LEU HA . 28058 1 414 . 1 . 1 61 61 LEU HB2 H 1 1.848 0.009 0 2 . 11 . . A 475 LEU HB2 . 28058 1 415 . 1 . 1 61 61 LEU HB3 H 1 2.002 0.006 0 2 . 8 . . A 475 LEU HB3 . 28058 1 416 . 1 . 1 61 61 LEU HG H 1 1.951 0.005 0 1 . 7 . . A 475 LEU HG . 28058 1 417 . 1 . 1 61 61 LEU HD11 H 1 0.988 0.012 0 1 . 12 . . A 475 LEU MD1 . 28058 1 418 . 1 . 1 61 61 LEU HD12 H 1 0.988 0.012 0 1 . 12 . . A 475 LEU MD1 . 28058 1 419 . 1 . 1 61 61 LEU HD13 H 1 0.988 0.012 0 1 . 12 . . A 475 LEU MD1 . 28058 1 420 . 1 . 1 61 61 LEU HD21 H 1 0.988 0.012 0 1 . 12 . . A 475 LEU MD2 . 28058 1 421 . 1 . 1 61 61 LEU HD22 H 1 0.988 0.012 0 1 . 12 . . A 475 LEU MD2 . 28058 1 422 . 1 . 1 61 61 LEU HD23 H 1 0.988 0.012 0 1 . 12 . . A 475 LEU MD2 . 28058 1 423 . 1 . 1 61 61 LEU C C 13 176.412 0 0 1 . 2 . . A 475 LEU C . 28058 1 424 . 1 . 1 61 61 LEU CA C 13 53.267 0.064 0 1 . 12 . . A 475 LEU CA . 28058 1 425 . 1 . 1 61 61 LEU CB C 13 42.617 0.056 0 1 . 16 . . A 475 LEU CB . 28058 1 426 . 1 . 1 61 61 LEU CG C 13 27.827 0.038 0 1 . 5 . . A 475 LEU CG . 28058 1 427 . 1 . 1 61 61 LEU CD1 C 13 26.224 0.01 0 1 . 4 . . A 475 LEU CD1 . 28058 1 428 . 1 . 1 61 61 LEU CD2 C 13 26.224 0.01 0 1 . 4 . . A 475 LEU CD2 . 28058 1 429 . 1 . 1 61 61 LEU N N 15 115.93 0.033 0 1 . 11 . . A 475 LEU N . 28058 1 430 . 1 . 1 62 62 PHE H H 1 8.674 0.004 0 1 . 16 . . A 476 PHE H . 28058 1 431 . 1 . 1 62 62 PHE HA H 1 4.533 0.006 0 1 . 10 . . A 476 PHE HA . 28058 1 432 . 1 . 1 62 62 PHE HB2 H 1 2.76 0.003 0 2 . 4 . . A 476 PHE HB2 . 28058 1 433 . 1 . 1 62 62 PHE HB3 H 1 2.787 0.004 0 2 . 3 . . A 476 PHE HB3 . 28058 1 434 . 1 . 1 62 62 PHE C C 13 174.081 0 0 1 . 2 . . A 476 PHE C . 28058 1 435 . 1 . 1 62 62 PHE CA C 13 58.142 0.063 0 1 . 7 . . A 476 PHE CA . 28058 1 436 . 1 . 1 62 62 PHE CB C 13 40.164 0.04 0 1 . 9 . . A 476 PHE CB . 28058 1 437 . 1 . 1 62 62 PHE N N 15 119.899 0.079 0 1 . 13 . . A 476 PHE N . 28058 1 438 . 1 . 1 63 63 GLY H H 1 8.955 0.008 0 1 . 6 . . A 477 GLY H . 28058 1 439 . 1 . 1 63 63 GLY HA2 H 1 4.007 0.005 0 1 . 7 . . A 477 GLY HA2 . 28058 1 440 . 1 . 1 63 63 GLY HA3 H 1 4.007 0.005 0 1 . 7 . . A 477 GLY HA3 . 28058 1 441 . 1 . 1 63 63 GLY C C 13 171.902 0 0 1 . 1 . . A 477 GLY C . 28058 1 442 . 1 . 1 63 63 GLY CA C 13 46.732 0.066 0 1 . 9 . . A 477 GLY CA . 28058 1 443 . 1 . 1 63 63 GLY N N 15 112.909 0.065 0 1 . 6 . . A 477 GLY N . 28058 1 444 . 1 . 1 64 64 ASP H H 1 7.978 0.014 0 1 . 7 . . A 478 ASP H . 28058 1 445 . 1 . 1 64 64 ASP HA H 1 4.813 0.002 0 1 . 5 . . A 478 ASP HA . 28058 1 446 . 1 . 1 64 64 ASP HB2 H 1 2.396 0.003 0 2 . 7 . . A 478 ASP HB2 . 28058 1 447 . 1 . 1 64 64 ASP HB3 H 1 3.004 0.001 0 2 . 4 . . A 478 ASP HB3 . 28058 1 448 . 1 . 1 64 64 ASP CA C 13 53.975 0.01 0 1 . 4 . . A 478 ASP CA . 28058 1 449 . 1 . 1 64 64 ASP CB C 13 39.281 0.021 0 1 . 8 . . A 478 ASP CB . 28058 1 450 . 1 . 1 64 64 ASP N N 15 116.566 0.031 0 1 . 6 . . A 478 ASP N . 28058 1 451 . 1 . 1 65 65 ASN C C 13 172.135 0 0 1 . 1 . . A 479 ASN C . 28058 1 452 . 1 . 1 66 66 THR H H 1 7.824 0.006 0 1 . 6 . . A 480 THR H . 28058 1 453 . 1 . 1 66 66 THR HA H 1 4.134 0.001 0 1 . 3 . . A 480 THR HA . 28058 1 454 . 1 . 1 66 66 THR HB H 1 4.073 0.002 0 1 . 5 . . A 480 THR HB . 28058 1 455 . 1 . 1 66 66 THR HG21 H 1 1.267 0.002 0 1 . 6 . . A 480 THR MG . 28058 1 456 . 1 . 1 66 66 THR HG22 H 1 1.267 0.002 0 1 . 6 . . A 480 THR MG . 28058 1 457 . 1 . 1 66 66 THR HG23 H 1 1.267 0.002 0 1 . 6 . . A 480 THR MG . 28058 1 458 . 1 . 1 66 66 THR C C 13 173.122 0 0 1 . 2 . . A 480 THR C . 28058 1 459 . 1 . 1 66 66 THR CA C 13 64.367 0.05 0 1 . 5 . . A 480 THR CA . 28058 1 460 . 1 . 1 66 66 THR CB C 13 68.926 0.024 0 1 . 7 . . A 480 THR CB . 28058 1 461 . 1 . 1 66 66 THR CG2 C 13 23.252 0.003 0 1 . 3 . . A 480 THR CG2 . 28058 1 462 . 1 . 1 66 66 THR N N 15 117.47 0.163 0 1 . 3 . . A 480 THR N . 28058 1 463 . 1 . 1 67 67 LYS H H 1 8.73 0.008 0 1 . 12 . . A 481 LYS H . 28058 1 464 . 1 . 1 67 67 LYS HB2 H 1 1.422 0.002 0 2 . 5 . . A 481 LYS HB2 . 28058 1 465 . 1 . 1 67 67 LYS HB3 H 1 1.525 0.003 0 2 . 3 . . A 481 LYS HB3 . 28058 1 466 . 1 . 1 67 67 LYS HG2 H 1 0.84 0 0 2 . 3 . . A 481 LYS HG2 . 28058 1 467 . 1 . 1 67 67 LYS HG3 H 1 1.052 0.003 0 2 . 4 . . A 481 LYS HG3 . 28058 1 468 . 1 . 1 67 67 LYS HD2 H 1 1.333 0.002 0 2 . 2 . . A 481 LYS HD2 . 28058 1 469 . 1 . 1 67 67 LYS HD3 H 1 1.378 0.003 0 2 . 2 . . A 481 LYS HD3 . 28058 1 470 . 1 . 1 67 67 LYS HE2 H 1 2.636 0.002 0 2 . 2 . . A 481 LYS HE2 . 28058 1 471 . 1 . 1 67 67 LYS HE3 H 1 2.676 0.007 0 2 . 3 . . A 481 LYS HE3 . 28058 1 472 . 1 . 1 67 67 LYS C C 13 176.589 0 0 1 . 2 . . A 481 LYS C . 28058 1 473 . 1 . 1 67 67 LYS CA C 13 56.144 0.056 0 1 . 3 . . A 481 LYS CA . 28058 1 474 . 1 . 1 67 67 LYS CB C 13 33.43 0.053 0 1 . 9 . . A 481 LYS CB . 28058 1 475 . 1 . 1 67 67 LYS CG C 13 24.627 0.029 0 1 . 4 . . A 481 LYS CG . 28058 1 476 . 1 . 1 67 67 LYS CD C 13 29.183 0.033 0 1 . 5 . . A 481 LYS CD . 28058 1 477 . 1 . 1 67 67 LYS CE C 13 41.784 0.036 0 1 . 5 . . A 481 LYS CE . 28058 1 478 . 1 . 1 67 67 LYS N N 15 128.422 0.071 0 1 . 9 . . A 481 LYS N . 28058 1 479 . 1 . 1 68 68 LEU H H 1 8.918 0.003 0 1 . 18 . . A 482 LEU H . 28058 1 480 . 1 . 1 68 68 LEU HA H 1 4.527 0.003 0 1 . 19 . . A 482 LEU HA . 28058 1 481 . 1 . 1 68 68 LEU HB2 H 1 1.623 0.007 0 2 . 10 . . A 482 LEU HB2 . 28058 1 482 . 1 . 1 68 68 LEU HB3 H 1 1.785 0.003 0 2 . 17 . . A 482 LEU HB3 . 28058 1 483 . 1 . 1 68 68 LEU HG H 1 1.433 0.008 0 1 . 12 . . A 482 LEU HG . 28058 1 484 . 1 . 1 68 68 LEU HD11 H 1 0.718 0.003 0 2 . 13 . . A 482 LEU MD1 . 28058 1 485 . 1 . 1 68 68 LEU HD12 H 1 0.718 0.003 0 2 . 13 . . A 482 LEU MD1 . 28058 1 486 . 1 . 1 68 68 LEU HD13 H 1 0.718 0.003 0 2 . 13 . . A 482 LEU MD1 . 28058 1 487 . 1 . 1 68 68 LEU HD21 H 1 0.761 0.004 0 2 . 12 . . A 482 LEU MD2 . 28058 1 488 . 1 . 1 68 68 LEU HD22 H 1 0.761 0.004 0 2 . 12 . . A 482 LEU MD2 . 28058 1 489 . 1 . 1 68 68 LEU HD23 H 1 0.761 0.004 0 2 . 12 . . A 482 LEU MD2 . 28058 1 490 . 1 . 1 68 68 LEU C C 13 179.788 0 0 1 . 2 . . A 482 LEU C . 28058 1 491 . 1 . 1 68 68 LEU CA C 13 53.735 0.051 0 1 . 15 . . A 482 LEU CA . 28058 1 492 . 1 . 1 68 68 LEU CB C 13 41.936 0.022 0 1 . 15 . . A 482 LEU CB . 28058 1 493 . 1 . 1 68 68 LEU CG C 13 26.934 0.028 0 1 . 5 . . A 482 LEU CG . 28058 1 494 . 1 . 1 68 68 LEU CD1 C 13 22.396 0.022 0 2 . 9 . . A 482 LEU CD1 . 28058 1 495 . 1 . 1 68 68 LEU CD2 C 13 25.849 0.032 0 2 . 10 . . A 482 LEU CD2 . 28058 1 496 . 1 . 1 68 68 LEU N N 15 125.094 0.051 0 1 . 13 . . A 482 LEU N . 28058 1 497 . 1 . 1 69 69 ALA H H 1 10.22 0.005 0 1 . 14 . . A 483 ALA H . 28058 1 498 . 1 . 1 69 69 ALA HA H 1 3.997 0.005 0 1 . 12 . . A 483 ALA HA . 28058 1 499 . 1 . 1 69 69 ALA HB1 H 1 1.41 0.002 0 1 . 12 . . A 483 ALA MB . 28058 1 500 . 1 . 1 69 69 ALA HB2 H 1 1.41 0.002 0 1 . 12 . . A 483 ALA MB . 28058 1 501 . 1 . 1 69 69 ALA HB3 H 1 1.41 0.002 0 1 . 12 . . A 483 ALA MB . 28058 1 502 . 1 . 1 69 69 ALA C C 13 178.933 0 0 1 . 2 . . A 483 ALA C . 28058 1 503 . 1 . 1 69 69 ALA CA C 13 55.211 0.031 0 1 . 9 . . A 483 ALA CA . 28058 1 504 . 1 . 1 69 69 ALA CB C 13 18.104 0.017 0 1 . 9 . . A 483 ALA CB . 28058 1 505 . 1 . 1 69 69 ALA N N 15 126.282 0.05 0 1 . 11 . . A 483 ALA N . 28058 1 506 . 1 . 1 70 70 ASP H H 1 7.784 0.003 0 1 . 18 . . A 484 ASP H . 28058 1 507 . 1 . 1 70 70 ASP HA H 1 4.405 0.003 0 1 . 13 . . A 484 ASP HA . 28058 1 508 . 1 . 1 70 70 ASP HB2 H 1 2.542 0.002 0 2 . 9 . . A 484 ASP HB2 . 28058 1 509 . 1 . 1 70 70 ASP HB3 H 1 3.017 0.004 0 2 . 12 . . A 484 ASP HB3 . 28058 1 510 . 1 . 1 70 70 ASP C C 13 177.419 0 0 1 . 2 . . A 484 ASP C . 28058 1 511 . 1 . 1 70 70 ASP CA C 13 53.382 0.024 0 1 . 10 . . A 484 ASP CA . 28058 1 512 . 1 . 1 70 70 ASP CB C 13 39.668 0.024 0 1 . 14 . . A 484 ASP CB . 28058 1 513 . 1 . 1 70 70 ASP N N 15 113.893 0.04 0 1 . 15 . . A 484 ASP N . 28058 1 514 . 1 . 1 71 71 GLY H H 1 8.18 0.007 0 1 . 12 . . A 485 GLY H . 28058 1 515 . 1 . 1 71 71 GLY HA2 H 1 3.328 0.005 0 2 . 10 . . A 485 GLY HA2 . 28058 1 516 . 1 . 1 71 71 GLY HA3 H 1 4.255 0.003 0 2 . 9 . . A 485 GLY HA3 . 28058 1 517 . 1 . 1 71 71 GLY C C 13 173.691 0 0 1 . 2 . . A 485 GLY C . 28058 1 518 . 1 . 1 71 71 GLY CA C 13 45.109 0.079 0 1 . 13 . . A 485 GLY CA . 28058 1 519 . 1 . 1 71 71 GLY N N 15 109.014 0.046 0 1 . 11 . . A 485 GLY N . 28058 1 520 . 1 . 1 72 72 SER H H 1 8.104 0.003 0 1 . 13 . . A 486 SER H . 28058 1 521 . 1 . 1 72 72 SER HA H 1 4.28 0.005 0 1 . 13 . . A 486 SER HA . 28058 1 522 . 1 . 1 72 72 SER HB2 H 1 3.765 0.004 0 2 . 11 . . A 486 SER HB2 . 28058 1 523 . 1 . 1 72 72 SER HB3 H 1 3.932 0.004 0 2 . 10 . . A 486 SER HB3 . 28058 1 524 . 1 . 1 72 72 SER C C 13 172.08 0 0 1 . 2 . . A 486 SER C . 28058 1 525 . 1 . 1 72 72 SER CA C 13 57.976 0.039 0 1 . 10 . . A 486 SER CA . 28058 1 526 . 1 . 1 72 72 SER CB C 13 64.274 0.05 0 1 . 13 . . A 486 SER CB . 28058 1 527 . 1 . 1 72 72 SER N N 15 117.89 0.035 0 1 . 11 . . A 486 SER N . 28058 1 528 . 1 . 1 73 73 PHE H H 1 8.368 0.007 0 1 . 20 . . A 487 PHE H . 28058 1 529 . 1 . 1 73 73 PHE HA H 1 4.745 0.018 0 1 . 11 . . A 487 PHE HA . 28058 1 530 . 1 . 1 73 73 PHE HB2 H 1 2.685 0.005 0 2 . 14 . . A 487 PHE HB2 . 28058 1 531 . 1 . 1 73 73 PHE HB3 H 1 3.025 0.007 0 2 . 9 . . A 487 PHE HB3 . 28058 1 532 . 1 . 1 73 73 PHE HD1 H 1 7.003 0.007 0 1 . 19 . . A 487 PHE HD1 . 28058 1 533 . 1 . 1 73 73 PHE HD2 H 1 7.003 0.007 0 1 . 19 . . A 487 PHE HD2 . 28058 1 534 . 1 . 1 73 73 PHE HE1 H 1 7.212 0.012 0 1 . 6 . . A 487 PHE HE1 . 28058 1 535 . 1 . 1 73 73 PHE HE2 H 1 7.212 0.012 0 1 . 6 . . A 487 PHE HE2 . 28058 1 536 . 1 . 1 73 73 PHE C C 13 176.707 0 0 1 . 2 . . A 487 PHE C . 28058 1 537 . 1 . 1 73 73 PHE CA C 13 58.414 0.028 0 1 . 7 . . A 487 PHE CA . 28058 1 538 . 1 . 1 73 73 PHE CB C 13 40.079 0.058 0 1 . 14 . . A 487 PHE CB . 28058 1 539 . 1 . 1 73 73 PHE CD1 C 13 131.258 0.131 0 1 . 13 . . A 487 PHE CD1 . 28058 1 540 . 1 . 1 73 73 PHE CD2 C 13 131.258 0.131 0 1 . 13 . . A 487 PHE CD2 . 28058 1 541 . 1 . 1 73 73 PHE CE1 C 13 131.553 0.141 0 1 . 3 . . A 487 PHE CE1 . 28058 1 542 . 1 . 1 73 73 PHE CE2 C 13 131.553 0.141 0 1 . 3 . . A 487 PHE CE2 . 28058 1 543 . 1 . 1 73 73 PHE N N 15 116.438 0.037 0 1 . 17 . . A 487 PHE N . 28058 1 544 . 1 . 1 74 74 ALA H H 1 8.644 0.003 0 1 . 17 . . A 488 ALA H . 28058 1 545 . 1 . 1 74 74 ALA HA H 1 3.989 0.009 0 1 . 10 . . A 488 ALA HA . 28058 1 546 . 1 . 1 74 74 ALA HB1 H 1 1.471 0.008 0 1 . 7 . . A 488 ALA MB . 28058 1 547 . 1 . 1 74 74 ALA HB2 H 1 1.471 0.008 0 1 . 7 . . A 488 ALA MB . 28058 1 548 . 1 . 1 74 74 ALA HB3 H 1 1.471 0.008 0 1 . 7 . . A 488 ALA MB . 28058 1 549 . 1 . 1 74 74 ALA C C 13 177.757 0 0 1 . 2 . . A 488 ALA C . 28058 1 550 . 1 . 1 74 74 ALA CA C 13 52.055 0.031 0 1 . 9 . . A 488 ALA CA . 28058 1 551 . 1 . 1 74 74 ALA CB C 13 19.485 0.02 0 1 . 6 . . A 488 ALA CB . 28058 1 552 . 1 . 1 74 74 ALA N N 15 126.239 0.035 0 1 . 15 . . A 488 ALA N . 28058 1 553 . 1 . 1 75 75 LYS H H 1 8.386 0.002 0 1 . 16 . . A 489 LYS H . 28058 1 554 . 1 . 1 75 75 LYS HA H 1 4.017 0.006 0 1 . 19 . . A 489 LYS HA . 28058 1 555 . 1 . 1 75 75 LYS HB2 H 1 1.533 0.004 0 1 . 15 . . A 489 LYS HB2 . 28058 1 556 . 1 . 1 75 75 LYS HB3 H 1 1.533 0.004 0 1 . 15 . . A 489 LYS HB3 . 28058 1 557 . 1 . 1 75 75 LYS HG2 H 1 1.315 0.001 0 2 . 6 . . A 489 LYS HG2 . 28058 1 558 . 1 . 1 75 75 LYS HG3 H 1 1.342 0.002 0 2 . 6 . . A 489 LYS HG3 . 28058 1 559 . 1 . 1 75 75 LYS HD2 H 1 1.626 0.005 0 1 . 16 . . A 489 LYS HD2 . 28058 1 560 . 1 . 1 75 75 LYS HD3 H 1 1.626 0.005 0 1 . 16 . . A 489 LYS HD3 . 28058 1 561 . 1 . 1 75 75 LYS HE2 H 1 2.975 0.003 0 1 . 16 . . A 489 LYS HE2 . 28058 1 562 . 1 . 1 75 75 LYS HE3 H 1 2.975 0.003 0 1 . 16 . . A 489 LYS HE3 . 28058 1 563 . 1 . 1 75 75 LYS C C 13 176.333 0 0 1 . 1 . . A 489 LYS C . 28058 1 564 . 1 . 1 75 75 LYS CA C 13 57.786 0.043 0 1 . 9 . . A 489 LYS CA . 28058 1 565 . 1 . 1 75 75 LYS CB C 13 33.1 0.05 0 1 . 13 . . A 489 LYS CB . 28058 1 566 . 1 . 1 75 75 LYS CG C 13 24.74 0.029 0 1 . 16 . . A 489 LYS CG . 28058 1 567 . 1 . 1 75 75 LYS CD C 13 28.972 0.046 0 1 . 10 . . A 489 LYS CD . 28058 1 568 . 1 . 1 75 75 LYS CE C 13 42.124 0.023 0 1 . 9 . . A 489 LYS CE . 28058 1 569 . 1 . 1 75 75 LYS N N 15 118.309 0.051 0 1 . 10 . . A 489 LYS N . 28058 1 570 . 1 . 1 76 76 HIS H H 1 7.121 0.006 0 1 . 18 . . A 490 HIS H . 28058 1 571 . 1 . 1 76 76 HIS HA H 1 4.605 0.006 0 1 . 11 . . A 490 HIS HA . 28058 1 572 . 1 . 1 76 76 HIS HB2 H 1 3.444 0.003 0 2 . 12 . . A 490 HIS HB2 . 28058 1 573 . 1 . 1 76 76 HIS HB3 H 1 3.525 0.008 0 2 . 14 . . A 490 HIS HB3 . 28058 1 574 . 1 . 1 76 76 HIS HD2 H 1 6.94 0.007 0 1 . 12 . . A 490 HIS HD2 . 28058 1 575 . 1 . 1 76 76 HIS HE1 H 1 7.635 0.009 0 1 . 5 . . A 490 HIS HE1 . 28058 1 576 . 1 . 1 76 76 HIS C C 13 176.012 0 0 1 . 2 . . A 490 HIS C . 28058 1 577 . 1 . 1 76 76 HIS CA C 13 53.684 0.055 0 1 . 9 . . A 490 HIS CA . 28058 1 578 . 1 . 1 76 76 HIS CB C 13 31.337 0.074 0 1 . 17 . . A 490 HIS CB . 28058 1 579 . 1 . 1 76 76 HIS CD2 C 13 119.139 0.149 0 1 . 7 . . A 490 HIS CD2 . 28058 1 580 . 1 . 1 76 76 HIS CE1 C 13 139.816 0.113 0 1 . 4 . . A 490 HIS CE1 . 28058 1 581 . 1 . 1 76 76 HIS N N 15 108.967 0.036 0 1 . 11 . . A 490 HIS N . 28058 1 582 . 1 . 1 77 77 GLY H H 1 9.947 0.003 0 1 . 14 . . A 491 GLY H . 28058 1 583 . 1 . 1 77 77 GLY HA2 H 1 3.539 0.002 0 2 . 3 . . A 491 GLY HA2 . 28058 1 584 . 1 . 1 77 77 GLY HA3 H 1 3.606 0.004 0 2 . 3 . . A 491 GLY HA3 . 28058 1 585 . 1 . 1 77 77 GLY C C 13 175.752 0 0 1 . 1 . . A 491 GLY C . 28058 1 586 . 1 . 1 77 77 GLY CA C 13 47.437 0.027 0 1 . 8 . . A 491 GLY CA . 28058 1 587 . 1 . 1 77 77 GLY N N 15 107.665 0.053 0 1 . 11 . . A 491 GLY N . 28058 1 588 . 1 . 1 78 78 TYR H H 1 8.178 0.009 0 1 . 5 . . A 492 TYR H . 28058 1 589 . 1 . 1 78 78 TYR HA H 1 4.047 0.004 0 1 . 16 . . A 492 TYR HA . 28058 1 590 . 1 . 1 78 78 TYR HB2 H 1 2.258 0.011 0 2 . 19 . . A 492 TYR HB2 . 28058 1 591 . 1 . 1 78 78 TYR HB3 H 1 2.903 0.009 0 2 . 18 . . A 492 TYR HB3 . 28058 1 592 . 1 . 1 78 78 TYR HD1 H 1 6.808 0.009 0 1 . 5 . . A 492 TYR HD1 . 28058 1 593 . 1 . 1 78 78 TYR HD2 H 1 6.808 0.009 0 1 . 5 . . A 492 TYR HD2 . 28058 1 594 . 1 . 1 78 78 TYR C C 13 178.639 0 0 1 . 2 . . A 492 TYR C . 28058 1 595 . 1 . 1 78 78 TYR CA C 13 64.814 0.052 0 1 . 10 . . A 492 TYR CA . 28058 1 596 . 1 . 1 78 78 TYR CB C 13 38.162 0.058 0 1 . 18 . . A 492 TYR CB . 28058 1 597 . 1 . 1 78 78 TYR CD1 C 13 132.9 0.158 0 1 . 4 . . A 492 TYR CD1 . 28058 1 598 . 1 . 1 78 78 TYR CD2 C 13 132.9 0.158 0 1 . 4 . . A 492 TYR CD2 . 28058 1 599 . 1 . 1 78 78 TYR N N 15 119.828 0.119 0 1 . 5 . . A 492 TYR N . 28058 1 600 . 1 . 1 79 79 ALA H H 1 8.738 0.015 0 1 . 16 . . A 493 ALA H . 28058 1 601 . 1 . 1 79 79 ALA HA H 1 4.259 0.004 0 1 . 9 . . A 493 ALA HA . 28058 1 602 . 1 . 1 79 79 ALA HB1 H 1 1.249 0.003 0 1 . 10 . . A 493 ALA MB . 28058 1 603 . 1 . 1 79 79 ALA HB2 H 1 1.249 0.003 0 1 . 10 . . A 493 ALA MB . 28058 1 604 . 1 . 1 79 79 ALA HB3 H 1 1.249 0.003 0 1 . 10 . . A 493 ALA MB . 28058 1 605 . 1 . 1 79 79 ALA C C 13 179.965 0 0 1 . 2 . . A 493 ALA C . 28058 1 606 . 1 . 1 79 79 ALA CA C 13 54.799 0.076 0 1 . 8 . . A 493 ALA CA . 28058 1 607 . 1 . 1 79 79 ALA CB C 13 17.81 0.042 0 1 . 8 . . A 493 ALA CB . 28058 1 608 . 1 . 1 79 79 ALA N N 15 124.705 0.071 0 1 . 12 . . A 493 ALA N . 28058 1 609 . 1 . 1 80 80 ALA H H 1 7.319 0.005 0 1 . 13 . . A 494 ALA H . 28058 1 610 . 1 . 1 80 80 ALA HA H 1 4.084 0.005 0 1 . 8 . . A 494 ALA HA . 28058 1 611 . 1 . 1 80 80 ALA HB1 H 1 1.665 0.003 0 1 . 7 . . A 494 ALA MB . 28058 1 612 . 1 . 1 80 80 ALA HB2 H 1 1.665 0.003 0 1 . 7 . . A 494 ALA MB . 28058 1 613 . 1 . 1 80 80 ALA HB3 H 1 1.665 0.003 0 1 . 7 . . A 494 ALA MB . 28058 1 614 . 1 . 1 80 80 ALA C C 13 179.386 0 0 1 . 2 . . A 494 ALA C . 28058 1 615 . 1 . 1 80 80 ALA CA C 13 54.563 0.06 0 1 . 8 . . A 494 ALA CA . 28058 1 616 . 1 . 1 80 80 ALA CB C 13 18.484 0.033 0 1 . 7 . . A 494 ALA CB . 28058 1 617 . 1 . 1 80 80 ALA N N 15 117.868 0.03 0 1 . 11 . . A 494 ALA N . 28058 1 618 . 1 . 1 81 81 LEU H H 1 8.119 0.003 0 1 . 16 . . A 495 LEU H . 28058 1 619 . 1 . 1 81 81 LEU HA H 1 4.036 0.004 0 1 . 19 . . A 495 LEU HA . 28058 1 620 . 1 . 1 81 81 LEU HB2 H 1 1.01 0.005 0 2 . 20 . . A 495 LEU HB2 . 28058 1 621 . 1 . 1 81 81 LEU HB3 H 1 1.616 0.006 0 2 . 18 . . A 495 LEU HB3 . 28058 1 622 . 1 . 1 81 81 LEU HG H 1 1.412 0.005 0 1 . 16 . . A 495 LEU HG . 28058 1 623 . 1 . 1 81 81 LEU HD11 H 1 0.155 0.003 0 2 . 27 . . A 495 LEU MD1 . 28058 1 624 . 1 . 1 81 81 LEU HD12 H 1 0.155 0.003 0 2 . 27 . . A 495 LEU MD1 . 28058 1 625 . 1 . 1 81 81 LEU HD13 H 1 0.155 0.003 0 2 . 27 . . A 495 LEU MD1 . 28058 1 626 . 1 . 1 81 81 LEU HD21 H 1 0.36 0.003 0 2 . 28 . . A 495 LEU MD2 . 28058 1 627 . 1 . 1 81 81 LEU HD22 H 1 0.36 0.003 0 2 . 28 . . A 495 LEU MD2 . 28058 1 628 . 1 . 1 81 81 LEU HD23 H 1 0.36 0.003 0 2 . 28 . . A 495 LEU MD2 . 28058 1 629 . 1 . 1 81 81 LEU C C 13 178.068 0 0 1 . 2 . . A 495 LEU C . 28058 1 630 . 1 . 1 81 81 LEU CA C 13 56.849 0.069 0 1 . 13 . . A 495 LEU CA . 28058 1 631 . 1 . 1 81 81 LEU CB C 13 41.889 0.06 0 1 . 24 . . A 495 LEU CB . 28058 1 632 . 1 . 1 81 81 LEU CG C 13 26.126 0.077 0 1 . 9 . . A 495 LEU CG . 28058 1 633 . 1 . 1 81 81 LEU CD1 C 13 22.482 0.027 0 2 . 13 . . A 495 LEU CD1 . 28058 1 634 . 1 . 1 81 81 LEU CD2 C 13 25.436 0.044 0 2 . 14 . . A 495 LEU CD2 . 28058 1 635 . 1 . 1 81 81 LEU N N 15 119.579 0.032 0 1 . 12 . . A 495 LEU N . 28058 1 636 . 1 . 1 82 82 ALA H H 1 8.38 0.003 0 1 . 12 . . A 496 ALA H . 28058 1 637 . 1 . 1 82 82 ALA HA H 1 4.066 0.009 0 1 . 8 . . A 496 ALA HA . 28058 1 638 . 1 . 1 82 82 ALA HB1 H 1 1.659 0.002 0 1 . 9 . . A 496 ALA MB . 28058 1 639 . 1 . 1 82 82 ALA HB2 H 1 1.659 0.002 0 1 . 9 . . A 496 ALA MB . 28058 1 640 . 1 . 1 82 82 ALA HB3 H 1 1.659 0.002 0 1 . 9 . . A 496 ALA MB . 28058 1 641 . 1 . 1 82 82 ALA C C 13 180.04 0 0 1 . 2 . . A 496 ALA C . 28058 1 642 . 1 . 1 82 82 ALA CA C 13 54.83 0.078 0 1 . 8 . . A 496 ALA CA . 28058 1 643 . 1 . 1 82 82 ALA CB C 13 18.077 0.037 0 1 . 8 . . A 496 ALA CB . 28058 1 644 . 1 . 1 82 82 ALA N N 15 118.887 0.061 0 1 . 11 . . A 496 ALA N . 28058 1 645 . 1 . 1 83 83 GLU H H 1 6.995 0.002 0 1 . 18 . . A 497 GLU H . 28058 1 646 . 1 . 1 83 83 GLU HA H 1 4.156 0.006 0 1 . 17 . . A 497 GLU HA . 28058 1 647 . 1 . 1 83 83 GLU HB2 H 1 2.137 0.005 0 1 . 16 . . A 497 GLU HB2 . 28058 1 648 . 1 . 1 83 83 GLU HB3 H 1 2.137 0.005 0 1 . 16 . . A 497 GLU HB3 . 28058 1 649 . 1 . 1 83 83 GLU HG2 H 1 2.363 0.005 0 2 . 18 . . A 497 GLU HG2 . 28058 1 650 . 1 . 1 83 83 GLU HG3 H 1 2.501 0.005 0 2 . 19 . . A 497 GLU HG3 . 28058 1 651 . 1 . 1 83 83 GLU C C 13 176.992 0 0 1 . 2 . . A 497 GLU C . 28058 1 652 . 1 . 1 83 83 GLU CA C 13 58.511 0.04 0 1 . 12 . . A 497 GLU CA . 28058 1 653 . 1 . 1 83 83 GLU CB C 13 29.69 0.034 0 1 . 11 . . A 497 GLU CB . 28058 1 654 . 1 . 1 83 83 GLU CG C 13 37.751 0.098 0 1 . 20 . . A 497 GLU CG . 28058 1 655 . 1 . 1 83 83 GLU N N 15 115.393 0.028 0 1 . 14 . . A 497 GLU N . 28058 1 656 . 1 . 1 84 84 LEU H H 1 8.056 0.003 0 1 . 20 . . A 498 LEU H . 28058 1 657 . 1 . 1 84 84 LEU HA H 1 4.315 0.004 0 1 . 21 . . A 498 LEU HA . 28058 1 658 . 1 . 1 84 84 LEU HB2 H 1 1.743 0.003 0 2 . 17 . . A 498 LEU HB2 . 28058 1 659 . 1 . 1 84 84 LEU HB3 H 1 1.974 0.004 0 2 . 16 . . A 498 LEU HB3 . 28058 1 660 . 1 . 1 84 84 LEU HG H 1 1.883 0.002 0 1 . 19 . . A 498 LEU HG . 28058 1 661 . 1 . 1 84 84 LEU HD11 H 1 0.828 0.004 0 2 . 21 . . A 498 LEU MD1 . 28058 1 662 . 1 . 1 84 84 LEU HD12 H 1 0.828 0.004 0 2 . 21 . . A 498 LEU MD1 . 28058 1 663 . 1 . 1 84 84 LEU HD13 H 1 0.828 0.004 0 2 . 21 . . A 498 LEU MD1 . 28058 1 664 . 1 . 1 84 84 LEU HD21 H 1 1.013 0.004 0 2 . 26 . . A 498 LEU MD2 . 28058 1 665 . 1 . 1 84 84 LEU HD22 H 1 1.013 0.004 0 2 . 26 . . A 498 LEU MD2 . 28058 1 666 . 1 . 1 84 84 LEU HD23 H 1 1.013 0.004 0 2 . 26 . . A 498 LEU MD2 . 28058 1 667 . 1 . 1 84 84 LEU C C 13 176.434 0 0 1 . 2 . . A 498 LEU C . 28058 1 668 . 1 . 1 84 84 LEU CA C 13 55.034 0.07 0 1 . 14 . . A 498 LEU CA . 28058 1 669 . 1 . 1 84 84 LEU CB C 13 40.065 0.047 0 1 . 22 . . A 498 LEU CB . 28058 1 670 . 1 . 1 84 84 LEU CG C 13 28.211 0.035 0 1 . 11 . . A 498 LEU CG . 28058 1 671 . 1 . 1 84 84 LEU CD1 C 13 23.219 0.09 0 2 . 10 . . A 498 LEU CD1 . 28058 1 672 . 1 . 1 84 84 LEU CD2 C 13 26.209 0.054 0 2 . 13 . . A 498 LEU CD2 . 28058 1 673 . 1 . 1 84 84 LEU N N 15 116.485 0.032 0 1 . 13 . . A 498 LEU N . 28058 1 674 . 1 . 1 85 85 ASP H H 1 7.344 0.005 0 1 . 17 . . A 499 ASP H . 28058 1 675 . 1 . 1 85 85 ASP HA H 1 4.789 0.004 0 1 . 10 . . A 499 ASP HA . 28058 1 676 . 1 . 1 85 85 ASP HB2 H 1 2.347 0.006 0 2 . 10 . . A 499 ASP HB2 . 28058 1 677 . 1 . 1 85 85 ASP HB3 H 1 3.027 0.013 0 2 . 11 . . A 499 ASP HB3 . 28058 1 678 . 1 . 1 85 85 ASP C C 13 176.626 0 0 1 . 2 . . A 499 ASP C . 28058 1 679 . 1 . 1 85 85 ASP CA C 13 53.333 0.081 0 1 . 9 . . A 499 ASP CA . 28058 1 680 . 1 . 1 85 85 ASP CB C 13 39.612 0.057 0 1 . 15 . . A 499 ASP CB . 28058 1 681 . 1 . 1 85 85 ASP N N 15 119.334 0.052 0 1 . 15 . . A 499 ASP N . 28058 1 682 . 1 . 1 86 86 SER H H 1 9.002 0.004 0 1 . 18 . . A 500 SER H . 28058 1 683 . 1 . 1 86 86 SER HA H 1 4.358 0.004 0 1 . 13 . . A 500 SER HA . 28058 1 684 . 1 . 1 86 86 SER HB2 H 1 4.1 0.003 0 2 . 10 . . A 500 SER HB2 . 28058 1 685 . 1 . 1 86 86 SER HB3 H 1 4.214 0.002 0 2 . 9 . . A 500 SER HB3 . 28058 1 686 . 1 . 1 86 86 SER C C 13 175.574 0 0 1 . 2 . . A 500 SER C . 28058 1 687 . 1 . 1 86 86 SER CA C 13 60.782 0.042 0 1 . 9 . . A 500 SER CA . 28058 1 688 . 1 . 1 86 86 SER CB C 13 64.114 0.034 0 1 . 15 . . A 500 SER CB . 28058 1 689 . 1 . 1 86 86 SER N N 15 124.174 0.05 0 1 . 13 . . A 500 SER N . 28058 1 690 . 1 . 1 87 87 ASN H H 1 7.893 0.004 0 1 . 15 . . A 501 ASN H . 28058 1 691 . 1 . 1 87 87 ASN HA H 1 4.864 0.007 0 1 . 12 . . A 501 ASN HA . 28058 1 692 . 1 . 1 87 87 ASN HB2 H 1 2.786 0.009 0 2 . 10 . . A 501 ASN HB2 . 28058 1 693 . 1 . 1 87 87 ASN HB3 H 1 3.223 0.012 0 2 . 11 . . A 501 ASN HB3 . 28058 1 694 . 1 . 1 87 87 ASN HD21 H 1 7.149 0.004 0 2 . 7 . . A 501 ASN HD21 . 28058 1 695 . 1 . 1 87 87 ASN HD22 H 1 7.799 0.003 0 2 . 6 . . A 501 ASN HD22 . 28058 1 696 . 1 . 1 87 87 ASN C C 13 176.964 0 0 1 . 2 . . A 501 ASN C . 28058 1 697 . 1 . 1 87 87 ASN CA C 13 51.606 0.032 0 1 . 12 . . A 501 ASN CA . 28058 1 698 . 1 . 1 87 87 ASN CB C 13 37.524 0.079 0 1 . 17 . . A 501 ASN CB . 28058 1 699 . 1 . 1 87 87 ASN CG C 13 178.004 0 0 1 . 1 . . A 501 ASN CG . 28058 1 700 . 1 . 1 87 87 ASN N N 15 116.69 0.051 0 1 . 13 . . A 501 ASN N . 28058 1 701 . 1 . 1 87 87 ASN ND2 N 15 112.158 0.26 0 1 . 9 . . A 501 ASN ND2 . 28058 1 702 . 1 . 1 88 88 GLY H H 1 7.413 0.003 0 1 . 16 . . A 502 GLY H . 28058 1 703 . 1 . 1 88 88 GLY HA2 H 1 3.849 0.003 0 1 . 8 . . A 502 GLY HA2 . 28058 1 704 . 1 . 1 88 88 GLY HA3 H 1 3.849 0.003 0 1 . 8 . . A 502 GLY HA3 . 28058 1 705 . 1 . 1 88 88 GLY C C 13 174.398 0 0 1 . 2 . . A 502 GLY C . 28058 1 706 . 1 . 1 88 88 GLY CA C 13 47.847 0.057 0 1 . 7 . . A 502 GLY CA . 28058 1 707 . 1 . 1 88 88 GLY N N 15 107.687 0.065 0 1 . 13 . . A 502 GLY N . 28058 1 708 . 1 . 1 89 89 ASP H H 1 8.026 0.003 0 1 . 15 . . A 503 ASP H . 28058 1 709 . 1 . 1 89 89 ASP HA H 1 4.568 0.005 0 1 . 13 . . A 503 ASP HA . 28058 1 710 . 1 . 1 89 89 ASP HB2 H 1 2.335 0.003 0 2 . 12 . . A 503 ASP HB2 . 28058 1 711 . 1 . 1 89 89 ASP HB3 H 1 3 0.011 0 2 . 9 . . A 503 ASP HB3 . 28058 1 712 . 1 . 1 89 89 ASP C C 13 176.699 0 0 1 . 2 . . A 503 ASP C . 28058 1 713 . 1 . 1 89 89 ASP CA C 13 53.126 0.071 0 1 . 11 . . A 503 ASP CA . 28058 1 714 . 1 . 1 89 89 ASP CB C 13 40.034 0.057 0 1 . 15 . . A 503 ASP CB . 28058 1 715 . 1 . 1 89 89 ASP N N 15 118.843 0.041 0 1 . 12 . . A 503 ASP N . 28058 1 716 . 1 . 1 90 90 ASN H H 1 10.131 0.004 0 1 . 19 . . A 504 ASN H . 28058 1 717 . 1 . 1 90 90 ASN HA H 1 4.154 0.008 0 1 . 13 . . A 504 ASN HA . 28058 1 718 . 1 . 1 90 90 ASN HB2 H 1 2.768 0.005 0 2 . 13 . . A 504 ASN HB2 . 28058 1 719 . 1 . 1 90 90 ASN HB3 H 1 3.124 0.006 0 2 . 14 . . A 504 ASN HB3 . 28058 1 720 . 1 . 1 90 90 ASN HD21 H 1 6.663 0.003 0 2 . 15 . . A 504 ASN HD21 . 28058 1 721 . 1 . 1 90 90 ASN HD22 H 1 7.536 0.004 0 2 . 13 . . A 504 ASN HD22 . 28058 1 722 . 1 . 1 90 90 ASN C C 13 173.414 0 0 1 . 2 . . A 504 ASN C . 28058 1 723 . 1 . 1 90 90 ASN CA C 13 55.154 0.053 0 1 . 13 . . A 504 ASN CA . 28058 1 724 . 1 . 1 90 90 ASN CB C 13 38.927 0.088 0 1 . 21 . . A 504 ASN CB . 28058 1 725 . 1 . 1 90 90 ASN CG C 13 178.423 0.012 0 1 . 2 . . A 504 ASN CG . 28058 1 726 . 1 . 1 90 90 ASN N N 15 117.939 0.045 0 1 . 15 . . A 504 ASN N . 28058 1 727 . 1 . 1 90 90 ASN ND2 N 15 111.996 0.246 0 1 . 20 . . A 504 ASN ND2 . 28058 1 728 . 1 . 1 91 91 ILE H H 1 7.733 0.004 0 1 . 18 . . A 505 ILE H . 28058 1 729 . 1 . 1 91 91 ILE HA H 1 4.789 0.003 0 1 . 15 . . A 505 ILE HA . 28058 1 730 . 1 . 1 91 91 ILE HB H 1 1.617 0.003 0 1 . 18 . . A 505 ILE HB . 28058 1 731 . 1 . 1 91 91 ILE HG12 H 1 0.906 0.003 0 2 . 5 . . A 505 ILE HG12 . 28058 1 732 . 1 . 1 91 91 ILE HG13 H 1 1.198 0.004 0 2 . 16 . . A 505 ILE HG13 . 28058 1 733 . 1 . 1 91 91 ILE HG21 H 1 0.852 0.002 0 1 . 15 . . A 505 ILE MG . 28058 1 734 . 1 . 1 91 91 ILE HG22 H 1 0.852 0.002 0 1 . 15 . . A 505 ILE MG . 28058 1 735 . 1 . 1 91 91 ILE HG23 H 1 0.852 0.002 0 1 . 15 . . A 505 ILE MG . 28058 1 736 . 1 . 1 91 91 ILE HD11 H 1 0.716 0.003 0 1 . 20 . . A 505 ILE MD . 28058 1 737 . 1 . 1 91 91 ILE HD12 H 1 0.716 0.003 0 1 . 20 . . A 505 ILE MD . 28058 1 738 . 1 . 1 91 91 ILE HD13 H 1 0.716 0.003 0 1 . 20 . . A 505 ILE MD . 28058 1 739 . 1 . 1 91 91 ILE C C 13 174.737 0 0 1 . 2 . . A 505 ILE C . 28058 1 740 . 1 . 1 91 91 ILE CA C 13 59.587 0.034 0 1 . 12 . . A 505 ILE CA . 28058 1 741 . 1 . 1 91 91 ILE CB C 13 42.926 0.068 0 1 . 12 . . A 505 ILE CB . 28058 1 742 . 1 . 1 91 91 ILE CG1 C 13 26.428 0.03 0 1 . 10 . . A 505 ILE CG1 . 28058 1 743 . 1 . 1 91 91 ILE CG2 C 13 18.246 0.023 0 1 . 9 . . A 505 ILE CG2 . 28058 1 744 . 1 . 1 91 91 ILE CD1 C 13 13.526 0.088 0 1 . 11 . . A 505 ILE CD1 . 28058 1 745 . 1 . 1 91 91 ILE N N 15 113.352 0.057 0 1 . 14 . . A 505 ILE N . 28058 1 746 . 1 . 1 92 92 ILE H H 1 9.332 0.005 0 1 . 22 . . A 506 ILE H . 28058 1 747 . 1 . 1 92 92 ILE HA H 1 5.333 0.007 0 1 . 25 . . A 506 ILE HA . 28058 1 748 . 1 . 1 92 92 ILE HB H 1 2.17 0.003 0 1 . 17 . . A 506 ILE HB . 28058 1 749 . 1 . 1 92 92 ILE HG12 H 1 1.005 0.004 0 2 . 9 . . A 506 ILE HG12 . 28058 1 750 . 1 . 1 92 92 ILE HG13 H 1 1.414 0.008 0 2 . 14 . . A 506 ILE HG13 . 28058 1 751 . 1 . 1 92 92 ILE HG21 H 1 0.918 0.01 0 1 . 21 . . A 506 ILE MG . 28058 1 752 . 1 . 1 92 92 ILE HG22 H 1 0.918 0.01 0 1 . 21 . . A 506 ILE MG . 28058 1 753 . 1 . 1 92 92 ILE HG23 H 1 0.918 0.01 0 1 . 21 . . A 506 ILE MG . 28058 1 754 . 1 . 1 92 92 ILE HD11 H 1 0.628 0.003 0 1 . 24 . . A 506 ILE MD . 28058 1 755 . 1 . 1 92 92 ILE HD12 H 1 0.628 0.003 0 1 . 24 . . A 506 ILE MD . 28058 1 756 . 1 . 1 92 92 ILE HD13 H 1 0.628 0.003 0 1 . 24 . . A 506 ILE MD . 28058 1 757 . 1 . 1 92 92 ILE C C 13 174.96 0 0 1 . 2 . . A 506 ILE C . 28058 1 758 . 1 . 1 92 92 ILE CA C 13 56.796 0.061 0 1 . 16 . . A 506 ILE CA . 28058 1 759 . 1 . 1 92 92 ILE CB C 13 35.801 0.049 0 1 . 12 . . A 506 ILE CB . 28058 1 760 . 1 . 1 92 92 ILE CG1 C 13 26.016 0.104 0 1 . 12 . . A 506 ILE CG1 . 28058 1 761 . 1 . 1 92 92 ILE CG2 C 13 16.93 0.086 0 1 . 13 . . A 506 ILE CG2 . 28058 1 762 . 1 . 1 92 92 ILE CD1 C 13 9.185 0.036 0 1 . 11 . . A 506 ILE CD1 . 28058 1 763 . 1 . 1 92 92 ILE N N 15 126.733 0.03 0 1 . 15 . . A 506 ILE N . 28058 1 764 . 1 . 1 93 93 ASN H H 1 9.818 0.007 0 1 . 15 . . A 507 ASN H . 28058 1 765 . 1 . 1 93 93 ASN HA H 1 4.307 0.003 0 1 . 13 . . A 507 ASN HA . 28058 1 766 . 1 . 1 93 93 ASN HB2 H 1 2.628 0.004 0 2 . 12 . . A 507 ASN HB2 . 28058 1 767 . 1 . 1 93 93 ASN HB3 H 1 3.103 0.005 0 2 . 12 . . A 507 ASN HB3 . 28058 1 768 . 1 . 1 93 93 ASN HD21 H 1 7.318 0.003 0 2 . 13 . . A 507 ASN HD21 . 28058 1 769 . 1 . 1 93 93 ASN HD22 H 1 7.711 0.008 0 2 . 9 . . A 507 ASN HD22 . 28058 1 770 . 1 . 1 93 93 ASN C C 13 174.553 0 0 1 . 2 . . A 507 ASN C . 28058 1 771 . 1 . 1 93 93 ASN CA C 13 51.658 0.026 0 1 . 12 . . A 507 ASN CA . 28058 1 772 . 1 . 1 93 93 ASN CB C 13 39.278 0.05 0 1 . 16 . . A 507 ASN CB . 28058 1 773 . 1 . 1 93 93 ASN CG C 13 177.796 0.022 0 1 . 2 . . A 507 ASN CG . 28058 1 774 . 1 . 1 93 93 ASN N N 15 128.066 0.058 0 1 . 14 . . A 507 ASN N . 28058 1 775 . 1 . 1 93 93 ASN ND2 N 15 113.112 0.232 0 1 . 15 . . A 507 ASN ND2 . 28058 1 776 . 1 . 1 94 94 ALA H H 1 7.601 0.004 0 1 . 13 . . A 508 ALA H . 28058 1 777 . 1 . 1 94 94 ALA HA H 1 3.398 0.003 0 1 . 12 . . A 508 ALA HA . 28058 1 778 . 1 . 1 94 94 ALA HB1 H 1 1.065 0.002 0 1 . 12 . . A 508 ALA MB . 28058 1 779 . 1 . 1 94 94 ALA HB2 H 1 1.065 0.002 0 1 . 12 . . A 508 ALA MB . 28058 1 780 . 1 . 1 94 94 ALA HB3 H 1 1.065 0.002 0 1 . 12 . . A 508 ALA MB . 28058 1 781 . 1 . 1 94 94 ALA C C 13 177.648 0 0 1 . 2 . . A 508 ALA C . 28058 1 782 . 1 . 1 94 94 ALA CA C 13 54.111 0.042 0 1 . 9 . . A 508 ALA CA . 28058 1 783 . 1 . 1 94 94 ALA CB C 13 17.847 0.013 0 1 . 8 . . A 508 ALA CB . 28058 1 784 . 1 . 1 94 94 ALA N N 15 115.551 0.044 0 1 . 12 . . A 508 ALA N . 28058 1 785 . 1 . 1 95 95 ALA H H 1 7.486 0.002 0 1 . 15 . . A 509 ALA H . 28058 1 786 . 1 . 1 95 95 ALA HA H 1 4.135 0.003 0 1 . 11 . . A 509 ALA HA . 28058 1 787 . 1 . 1 95 95 ALA HB1 H 1 1.299 0.003 0 1 . 10 . . A 509 ALA MB . 28058 1 788 . 1 . 1 95 95 ALA HB2 H 1 1.299 0.003 0 1 . 10 . . A 509 ALA MB . 28058 1 789 . 1 . 1 95 95 ALA HB3 H 1 1.299 0.003 0 1 . 10 . . A 509 ALA MB . 28058 1 790 . 1 . 1 95 95 ALA C C 13 178.414 0 0 1 . 2 . . A 509 ALA C . 28058 1 791 . 1 . 1 95 95 ALA CA C 13 53.12 0.096 0 1 . 9 . . A 509 ALA CA . 28058 1 792 . 1 . 1 95 95 ALA CB C 13 18.341 0.029 0 1 . 8 . . A 509 ALA CB . 28058 1 793 . 1 . 1 95 95 ALA N N 15 118.917 0.031 0 1 . 13 . . A 509 ALA N . 28058 1 794 . 1 . 1 96 96 ASP H H 1 8.527 0.004 0 1 . 14 . . A 510 ASP H . 28058 1 795 . 1 . 1 96 96 ASP HA H 1 4.922 0.006 0 1 . 9 . . A 510 ASP HA . 28058 1 796 . 1 . 1 96 96 ASP HB2 H 1 3.119 0.003 0 2 . 8 . . A 510 ASP HB2 . 28058 1 797 . 1 . 1 96 96 ASP HB3 H 1 3.249 0.002 0 2 . 11 . . A 510 ASP HB3 . 28058 1 798 . 1 . 1 96 96 ASP C C 13 176.957 0 0 1 . 2 . . A 510 ASP C . 28058 1 799 . 1 . 1 96 96 ASP CA C 13 54.81 0.074 0 1 . 8 . . A 510 ASP CA . 28058 1 800 . 1 . 1 96 96 ASP CB C 13 41.179 0.091 0 1 . 15 . . A 510 ASP CB . 28058 1 801 . 1 . 1 96 96 ASP N N 15 119.303 0.07 0 1 . 11 . . A 510 ASP N . 28058 1 802 . 1 . 1 97 97 ALA H H 1 8.488 0.004 0 1 . 11 . . A 511 ALA H . 28058 1 803 . 1 . 1 97 97 ALA HA H 1 4.136 0.003 0 1 . 10 . . A 511 ALA HA . 28058 1 804 . 1 . 1 97 97 ALA HB1 H 1 1.512 0.002 0 1 . 10 . . A 511 ALA MB . 28058 1 805 . 1 . 1 97 97 ALA HB2 H 1 1.512 0.002 0 1 . 10 . . A 511 ALA MB . 28058 1 806 . 1 . 1 97 97 ALA HB3 H 1 1.512 0.002 0 1 . 10 . . A 511 ALA MB . 28058 1 807 . 1 . 1 97 97 ALA C C 13 179.959 0 0 1 . 2 . . A 511 ALA C . 28058 1 808 . 1 . 1 97 97 ALA CA C 13 55.593 0.07 0 1 . 8 . . A 511 ALA CA . 28058 1 809 . 1 . 1 97 97 ALA CB C 13 18.519 0.051 0 1 . 9 . . A 511 ALA CB . 28058 1 810 . 1 . 1 97 97 ALA N N 15 127.808 0.042 0 1 . 10 . . A 511 ALA N . 28058 1 811 . 1 . 1 98 98 ALA H H 1 9.55 0.004 0 1 . 15 . . A 512 ALA H . 28058 1 812 . 1 . 1 98 98 ALA HA H 1 4.585 0.006 0 1 . 10 . . A 512 ALA HA . 28058 1 813 . 1 . 1 98 98 ALA HB1 H 1 1.491 0.003 0 1 . 10 . . A 512 ALA MB . 28058 1 814 . 1 . 1 98 98 ALA HB2 H 1 1.491 0.003 0 1 . 10 . . A 512 ALA MB . 28058 1 815 . 1 . 1 98 98 ALA HB3 H 1 1.491 0.003 0 1 . 10 . . A 512 ALA MB . 28058 1 816 . 1 . 1 98 98 ALA C C 13 179.648 0 0 1 . 2 . . A 512 ALA C . 28058 1 817 . 1 . 1 98 98 ALA CA C 13 52.378 0.026 0 1 . 8 . . A 512 ALA CA . 28058 1 818 . 1 . 1 98 98 ALA CB C 13 20.36 0.082 0 1 . 8 . . A 512 ALA CB . 28058 1 819 . 1 . 1 98 98 ALA N N 15 116.603 0.04 0 1 . 13 . . A 512 ALA N . 28058 1 820 . 1 . 1 99 99 PHE H H 1 8.03 0.003 0 1 . 18 . . A 513 PHE H . 28058 1 821 . 1 . 1 99 99 PHE HA H 1 3.727 0.006 0 1 . 18 . . A 513 PHE HA . 28058 1 822 . 1 . 1 99 99 PHE HB2 H 1 3.078 0.01 0 2 . 16 . . A 513 PHE HB2 . 28058 1 823 . 1 . 1 99 99 PHE HB3 H 1 3.392 0.003 0 2 . 18 . . A 513 PHE HB3 . 28058 1 824 . 1 . 1 99 99 PHE HD1 H 1 6.872 0.006 0 1 . 19 . . A 513 PHE HD1 . 28058 1 825 . 1 . 1 99 99 PHE HD2 H 1 6.872 0.006 0 1 . 19 . . A 513 PHE HD2 . 28058 1 826 . 1 . 1 99 99 PHE HE1 H 1 7.094 0.008 0 1 . 13 . . A 513 PHE HE1 . 28058 1 827 . 1 . 1 99 99 PHE HE2 H 1 7.094 0.008 0 1 . 13 . . A 513 PHE HE2 . 28058 1 828 . 1 . 1 99 99 PHE C C 13 177.607 0 0 1 . 2 . . A 513 PHE C . 28058 1 829 . 1 . 1 99 99 PHE CA C 13 63.413 0.039 0 1 . 12 . . A 513 PHE CA . 28058 1 830 . 1 . 1 99 99 PHE CB C 13 40.628 0.052 0 1 . 17 . . A 513 PHE CB . 28058 1 831 . 1 . 1 99 99 PHE CD1 C 13 131.518 0.051 0 1 . 11 . . A 513 PHE CD1 . 28058 1 832 . 1 . 1 99 99 PHE CD2 C 13 131.518 0.051 0 1 . 11 . . A 513 PHE CD2 . 28058 1 833 . 1 . 1 99 99 PHE CE1 C 13 131.462 0.102 0 1 . 9 . . A 513 PHE CE1 . 28058 1 834 . 1 . 1 99 99 PHE CE2 C 13 131.462 0.102 0 1 . 9 . . A 513 PHE CE2 . 28058 1 835 . 1 . 1 99 99 PHE N N 15 122.073 0.071 0 1 . 16 . . A 513 PHE N . 28058 1 836 . 1 . 1 100 100 GLN H H 1 8.609 0.005 0 1 . 20 . . A 514 GLN H . 28058 1 837 . 1 . 1 100 100 GLN HA H 1 4.192 0.004 0 1 . 17 . . A 514 GLN HA . 28058 1 838 . 1 . 1 100 100 GLN HB2 H 1 2.19 0.004 0 2 . 16 . . A 514 GLN HB2 . 28058 1 839 . 1 . 1 100 100 GLN HB3 H 1 2.323 0.004 0 2 . 17 . . A 514 GLN HB3 . 28058 1 840 . 1 . 1 100 100 GLN HG2 H 1 2.644 0.004 0 1 . 21 . . A 514 GLN HG2 . 28058 1 841 . 1 . 1 100 100 GLN HG3 H 1 2.644 0.004 0 1 . 21 . . A 514 GLN HG3 . 28058 1 842 . 1 . 1 100 100 GLN HE21 H 1 7.059 0.009 0 2 . 9 . . A 514 GLN HE21 . 28058 1 843 . 1 . 1 100 100 GLN HE22 H 1 7.749 0.002 0 2 . 9 . . A 514 GLN HE22 . 28058 1 844 . 1 . 1 100 100 GLN C C 13 176.1 0 0 1 . 2 . . A 514 GLN C . 28058 1 845 . 1 . 1 100 100 GLN CA C 13 57.692 0.086 0 1 . 11 . . A 514 GLN CA . 28058 1 846 . 1 . 1 100 100 GLN CB C 13 28.1 0.063 0 1 . 24 . . A 514 GLN CB . 28058 1 847 . 1 . 1 100 100 GLN CG C 13 33.912 0.026 0 1 . 16 . . A 514 GLN CG . 28058 1 848 . 1 . 1 100 100 GLN CD C 13 180.262 0.01 0 1 . 2 . . A 514 GLN CD . 28058 1 849 . 1 . 1 100 100 GLN N N 15 113.062 0.045 0 1 . 16 . . A 514 GLN N . 28058 1 850 . 1 . 1 100 100 GLN NE2 N 15 111.824 0.252 0 1 . 16 . . A 514 GLN NE2 . 28058 1 851 . 1 . 1 101 101 SER H H 1 7.967 0.003 0 1 . 16 . . A 515 SER H . 28058 1 852 . 1 . 1 101 101 SER HA H 1 4.459 0.003 0 1 . 15 . . A 515 SER HA . 28058 1 853 . 1 . 1 101 101 SER HB2 H 1 3.991 0.003 0 2 . 8 . . A 515 SER HB2 . 28058 1 854 . 1 . 1 101 101 SER HB3 H 1 4.087 0.003 0 2 . 8 . . A 515 SER HB3 . 28058 1 855 . 1 . 1 101 101 SER C C 13 174.019 0 0 1 . 2 . . A 515 SER C . 28058 1 856 . 1 . 1 101 101 SER CA C 13 59.323 0.052 0 1 . 11 . . A 515 SER CA . 28058 1 857 . 1 . 1 101 101 SER CB C 13 64.558 0.033 0 1 . 13 . . A 515 SER CB . 28058 1 858 . 1 . 1 101 101 SER N N 15 114.564 0.042 0 1 . 13 . . A 515 SER N . 28058 1 859 . 1 . 1 102 102 LEU H H 1 7.117 0.002 0 1 . 18 . . A 516 LEU H . 28058 1 860 . 1 . 1 102 102 LEU HA H 1 4.636 0.007 0 1 . 14 . . A 516 LEU HA . 28058 1 861 . 1 . 1 102 102 LEU HB2 H 1 0.978 0.007 0 2 . 16 . . A 516 LEU HB2 . 28058 1 862 . 1 . 1 102 102 LEU HB3 H 1 1.684 0.007 0 2 . 12 . . A 516 LEU HB3 . 28058 1 863 . 1 . 1 102 102 LEU HG H 1 1.752 0.006 0 1 . 13 . . A 516 LEU HG . 28058 1 864 . 1 . 1 102 102 LEU HD11 H 1 0.54 0.003 0 2 . 19 . . A 516 LEU MD1 . 28058 1 865 . 1 . 1 102 102 LEU HD12 H 1 0.54 0.003 0 2 . 19 . . A 516 LEU MD1 . 28058 1 866 . 1 . 1 102 102 LEU HD13 H 1 0.54 0.003 0 2 . 19 . . A 516 LEU MD1 . 28058 1 867 . 1 . 1 102 102 LEU HD21 H 1 0.643 0.006 0 2 . 21 . . A 516 LEU MD2 . 28058 1 868 . 1 . 1 102 102 LEU HD22 H 1 0.643 0.006 0 2 . 21 . . A 516 LEU MD2 . 28058 1 869 . 1 . 1 102 102 LEU HD23 H 1 0.643 0.006 0 2 . 21 . . A 516 LEU MD2 . 28058 1 870 . 1 . 1 102 102 LEU C C 13 178.079 0 0 1 . 2 . . A 516 LEU C . 28058 1 871 . 1 . 1 102 102 LEU CA C 13 54.929 0.052 0 1 . 11 . . A 516 LEU CA . 28058 1 872 . 1 . 1 102 102 LEU CB C 13 42.536 0.095 0 1 . 20 . . A 516 LEU CB . 28058 1 873 . 1 . 1 102 102 LEU CG C 13 26.409 0.083 0 1 . 8 . . A 516 LEU CG . 28058 1 874 . 1 . 1 102 102 LEU CD1 C 13 25.506 0.072 0 2 . 9 . . A 516 LEU CD1 . 28058 1 875 . 1 . 1 102 102 LEU CD2 C 13 23.191 0.028 0 2 . 10 . . A 516 LEU CD2 . 28058 1 876 . 1 . 1 102 102 LEU N N 15 121.19 0.03 0 1 . 13 . . A 516 LEU N . 28058 1 877 . 1 . 1 103 103 ARG H H 1 8.83 0.008 0 1 . 14 . . A 517 ARG H . 28058 1 878 . 1 . 1 103 103 ARG HA H 1 4.798 0.005 0 1 . 8 . . A 517 ARG HA . 28058 1 879 . 1 . 1 103 103 ARG HB2 H 1 1.423 0.003 0 2 . 6 . . A 517 ARG HB2 . 28058 1 880 . 1 . 1 103 103 ARG HB3 H 1 1.48 0.007 0 2 . 7 . . A 517 ARG HB3 . 28058 1 881 . 1 . 1 103 103 ARG HG2 H 1 1.375 0.004 0 2 . 5 . . A 517 ARG HG2 . 28058 1 882 . 1 . 1 103 103 ARG HG3 H 1 1.498 0.003 0 2 . 4 . . A 517 ARG HG3 . 28058 1 883 . 1 . 1 103 103 ARG HD2 H 1 2.588 0.006 0 2 . 11 . . A 517 ARG HD2 . 28058 1 884 . 1 . 1 103 103 ARG HD3 H 1 3.156 0.009 0 2 . 8 . . A 517 ARG HD3 . 28058 1 885 . 1 . 1 103 103 ARG C C 13 173.919 0 0 1 . 2 . . A 517 ARG C . 28058 1 886 . 1 . 1 103 103 ARG CA C 13 52.885 0.069 0 1 . 8 . . A 517 ARG CA . 28058 1 887 . 1 . 1 103 103 ARG CB C 13 34.21 0.044 0 1 . 15 . . A 517 ARG CB . 28058 1 888 . 1 . 1 103 103 ARG CG C 13 26.684 0.078 0 1 . 9 . . A 517 ARG CG . 28058 1 889 . 1 . 1 103 103 ARG CD C 13 43.045 0.038 0 1 . 6 . . A 517 ARG CD . 28058 1 890 . 1 . 1 103 103 ARG N N 15 120.999 0.037 0 1 . 10 . . A 517 ARG N . 28058 1 891 . 1 . 1 104 104 VAL H H 1 9.084 0.004 0 1 . 14 . . A 518 VAL H . 28058 1 892 . 1 . 1 104 104 VAL HA H 1 4.746 0.003 0 1 . 6 . . A 518 VAL HA . 28058 1 893 . 1 . 1 104 104 VAL HB H 1 1.615 0.004 0 1 . 12 . . A 518 VAL HB . 28058 1 894 . 1 . 1 104 104 VAL HG11 H 1 0.502 0.002 0 2 . 15 . . A 518 VAL MG1 . 28058 1 895 . 1 . 1 104 104 VAL HG12 H 1 0.502 0.002 0 2 . 15 . . A 518 VAL MG1 . 28058 1 896 . 1 . 1 104 104 VAL HG13 H 1 0.502 0.002 0 2 . 15 . . A 518 VAL MG1 . 28058 1 897 . 1 . 1 104 104 VAL HG21 H 1 0.592 0.002 0 2 . 14 . . A 518 VAL MG2 . 28058 1 898 . 1 . 1 104 104 VAL HG22 H 1 0.592 0.002 0 2 . 14 . . A 518 VAL MG2 . 28058 1 899 . 1 . 1 104 104 VAL HG23 H 1 0.592 0.002 0 2 . 14 . . A 518 VAL MG2 . 28058 1 900 . 1 . 1 104 104 VAL C C 13 174.464 0 0 1 . 2 . . A 518 VAL C . 28058 1 901 . 1 . 1 104 104 VAL CA C 13 60.917 0.031 0 1 . 6 . . A 518 VAL CA . 28058 1 902 . 1 . 1 104 104 VAL CB C 13 33.739 0.081 0 1 . 9 . . A 518 VAL CB . 28058 1 903 . 1 . 1 104 104 VAL CG1 C 13 22.416 0.017 0 2 . 10 . . A 518 VAL CG1 . 28058 1 904 . 1 . 1 104 104 VAL CG2 C 13 21.814 0.09 0 2 . 9 . . A 518 VAL CG2 . 28058 1 905 . 1 . 1 104 104 VAL N N 15 119.433 0.024 0 1 . 9 . . A 518 VAL N . 28058 1 906 . 1 . 1 105 105 TRP H H 1 9.534 0.004 0 1 . 16 . . A 519 TRP H . 28058 1 907 . 1 . 1 105 105 TRP HA H 1 5.646 0.006 0 1 . 28 . . A 519 TRP HA . 28058 1 908 . 1 . 1 105 105 TRP HB2 H 1 2.639 0.004 0 2 . 19 . . A 519 TRP HB2 . 28058 1 909 . 1 . 1 105 105 TRP HB3 H 1 3.22 0.006 0 2 . 19 . . A 519 TRP HB3 . 28058 1 910 . 1 . 1 105 105 TRP HD1 H 1 7.071 0.008 0 1 . 9 . . A 519 TRP HD1 . 28058 1 911 . 1 . 1 105 105 TRP HE1 H 1 10.082 0.004 0 1 . 6 . . A 519 TRP HE1 . 28058 1 912 . 1 . 1 105 105 TRP HE3 H 1 7.166 0.008 0 1 . 16 . . A 519 TRP HE3 . 28058 1 913 . 1 . 1 105 105 TRP HZ2 H 1 7.005 0.006 0 1 . 11 . . A 519 TRP HZ2 . 28058 1 914 . 1 . 1 105 105 TRP HZ3 H 1 6.767 0.02 0 1 . 9 . . A 519 TRP HZ3 . 28058 1 915 . 1 . 1 105 105 TRP HH2 H 1 7.281 0.01 0 1 . 7 . . A 519 TRP HH2 . 28058 1 916 . 1 . 1 105 105 TRP C C 13 174.533 0 0 1 . 2 . . A 519 TRP C . 28058 1 917 . 1 . 1 105 105 TRP CA C 13 52.821 0.064 0 1 . 20 . . A 519 TRP CA . 28058 1 918 . 1 . 1 105 105 TRP CB C 13 31.975 0.099 0 1 . 22 . . A 519 TRP CB . 28058 1 919 . 1 . 1 105 105 TRP CD1 C 13 124.308 0.084 0 1 . 5 . . A 519 TRP CD1 . 28058 1 920 . 1 . 1 105 105 TRP CE3 C 13 119.965 0.124 0 1 . 9 . . A 519 TRP CE3 . 28058 1 921 . 1 . 1 105 105 TRP CZ2 C 13 113.233 0.133 0 1 . 8 . . A 519 TRP CZ2 . 28058 1 922 . 1 . 1 105 105 TRP CZ3 C 13 121.702 0.273 0 1 . 3 . . A 519 TRP CZ3 . 28058 1 923 . 1 . 1 105 105 TRP CH2 C 13 125.692 0.066 0 1 . 4 . . A 519 TRP CH2 . 28058 1 924 . 1 . 1 105 105 TRP N N 15 129.145 0.066 0 1 . 13 . . A 519 TRP N . 28058 1 925 . 1 . 1 105 105 TRP NE1 N 15 125.953 0.057 0 1 . 3 . . A 519 TRP NE1 . 28058 1 926 . 1 . 1 106 106 GLN H H 1 8.714 0.01 0 1 . 15 . . A 520 GLN H . 28058 1 927 . 1 . 1 106 106 GLN HA H 1 4.582 0.007 0 1 . 13 . . A 520 GLN HA . 28058 1 928 . 1 . 1 106 106 GLN HB2 H 1 1.77 0.007 0 2 . 17 . . A 520 GLN HB2 . 28058 1 929 . 1 . 1 106 106 GLN HB3 H 1 2.135 0.006 0 2 . 16 . . A 520 GLN HB3 . 28058 1 930 . 1 . 1 106 106 GLN HG2 H 1 1.96 0.01 0 2 . 15 . . A 520 GLN HG2 . 28058 1 931 . 1 . 1 106 106 GLN HG3 H 1 2.216 0.009 0 2 . 9 . . A 520 GLN HG3 . 28058 1 932 . 1 . 1 106 106 GLN HE21 H 1 6.435 0.004 0 2 . 14 . . A 520 GLN HE21 . 28058 1 933 . 1 . 1 106 106 GLN HE22 H 1 7.307 0.003 0 2 . 14 . . A 520 GLN HE22 . 28058 1 934 . 1 . 1 106 106 GLN C C 13 174.326 0 0 1 . 2 . . A 520 GLN C . 28058 1 935 . 1 . 1 106 106 GLN CA C 13 54.219 0.132 0 1 . 10 . . A 520 GLN CA . 28058 1 936 . 1 . 1 106 106 GLN CB C 13 31.27 0.083 0 1 . 23 . . A 520 GLN CB . 28058 1 937 . 1 . 1 106 106 GLN CG C 13 34.874 0.089 0 1 . 18 . . A 520 GLN CG . 28058 1 938 . 1 . 1 106 106 GLN CD C 13 180.532 0.022 0 1 . 2 . . A 520 GLN CD . 28058 1 939 . 1 . 1 106 106 GLN N N 15 127.896 0.057 0 1 . 10 . . A 520 GLN N . 28058 1 940 . 1 . 1 106 106 GLN NE2 N 15 110.406 0.209 0 1 . 16 . . A 520 GLN NE2 . 28058 1 941 . 1 . 1 107 107 ASP H H 1 8.817 0.005 0 1 . 14 . . A 521 ASP H . 28058 1 942 . 1 . 1 107 107 ASP HA H 1 4.997 0.009 0 1 . 13 . . A 521 ASP HA . 28058 1 943 . 1 . 1 107 107 ASP HB2 H 1 1.488 0.006 0 2 . 11 . . A 521 ASP HB2 . 28058 1 944 . 1 . 1 107 107 ASP HB3 H 1 2.628 0.006 0 2 . 9 . . A 521 ASP HB3 . 28058 1 945 . 1 . 1 107 107 ASP C C 13 178.119 0 0 1 . 2 . . A 521 ASP C . 28058 1 946 . 1 . 1 107 107 ASP CA C 13 52.698 0.076 0 1 . 10 . . A 521 ASP CA . 28058 1 947 . 1 . 1 107 107 ASP CB C 13 37.783 0.022 0 1 . 14 . . A 521 ASP CB . 28058 1 948 . 1 . 1 107 107 ASP N N 15 124.766 0.039 0 1 . 12 . . A 521 ASP N . 28058 1 949 . 1 . 1 108 108 LEU H H 1 8.242 0.005 0 1 . 18 . . A 522 LEU H . 28058 1 950 . 1 . 1 108 108 LEU HA H 1 3.987 0.004 0 1 . 17 . . A 522 LEU HA . 28058 1 951 . 1 . 1 108 108 LEU HB2 H 1 1.536 0.011 0 2 . 12 . . A 522 LEU HB2 . 28058 1 952 . 1 . 1 108 108 LEU HB3 H 1 1.967 0.007 0 2 . 13 . . A 522 LEU HB3 . 28058 1 953 . 1 . 1 108 108 LEU HG H 1 1.96 0.003 0 1 . 11 . . A 522 LEU HG . 28058 1 954 . 1 . 1 108 108 LEU HD11 H 1 0.886 0.002 0 2 . 14 . . A 522 LEU MD1 . 28058 1 955 . 1 . 1 108 108 LEU HD12 H 1 0.886 0.002 0 2 . 14 . . A 522 LEU MD1 . 28058 1 956 . 1 . 1 108 108 LEU HD13 H 1 0.886 0.002 0 2 . 14 . . A 522 LEU MD1 . 28058 1 957 . 1 . 1 108 108 LEU HD21 H 1 0.996 0.003 0 2 . 16 . . A 522 LEU MD2 . 28058 1 958 . 1 . 1 108 108 LEU HD22 H 1 0.996 0.003 0 2 . 16 . . A 522 LEU MD2 . 28058 1 959 . 1 . 1 108 108 LEU HD23 H 1 0.996 0.003 0 2 . 16 . . A 522 LEU MD2 . 28058 1 960 . 1 . 1 108 108 LEU C C 13 177.7 0 0 1 . 2 . . A 522 LEU C . 28058 1 961 . 1 . 1 108 108 LEU CA C 13 58.018 0.071 0 1 . 11 . . A 522 LEU CA . 28058 1 962 . 1 . 1 108 108 LEU CB C 13 42.513 0.048 0 1 . 19 . . A 522 LEU CB . 28058 1 963 . 1 . 1 108 108 LEU CG C 13 26.804 0.029 0 1 . 9 . . A 522 LEU CG . 28058 1 964 . 1 . 1 108 108 LEU CD1 C 13 22.727 0.083 0 2 . 6 . . A 522 LEU CD1 . 28058 1 965 . 1 . 1 108 108 LEU CD2 C 13 25.385 0.121 0 2 . 8 . . A 522 LEU CD2 . 28058 1 966 . 1 . 1 108 108 LEU N N 15 127.613 0.057 0 1 . 13 . . A 522 LEU N . 28058 1 967 . 1 . 1 109 109 ASN H H 1 7.879 0.005 0 1 . 16 . . A 523 ASN H . 28058 1 968 . 1 . 1 109 109 ASN HA H 1 4.865 0.005 0 1 . 9 . . A 523 ASN HA . 28058 1 969 . 1 . 1 109 109 ASN HB2 H 1 2.731 0.01 0 2 . 10 . . A 523 ASN HB2 . 28058 1 970 . 1 . 1 109 109 ASN HB3 H 1 3.296 0.004 0 2 . 11 . . A 523 ASN HB3 . 28058 1 971 . 1 . 1 109 109 ASN HD21 H 1 6.325 0.004 0 2 . 13 . . A 523 ASN HD21 . 28058 1 972 . 1 . 1 109 109 ASN HD22 H 1 7.877 0.004 0 2 . 7 . . A 523 ASN HD22 . 28058 1 973 . 1 . 1 109 109 ASN C C 13 174.737 0 0 1 . 2 . . A 523 ASN C . 28058 1 974 . 1 . 1 109 109 ASN CA C 13 51.616 0.038 0 1 . 8 . . A 523 ASN CA . 28058 1 975 . 1 . 1 109 109 ASN CB C 13 37 0.043 0 1 . 17 . . A 523 ASN CB . 28058 1 976 . 1 . 1 109 109 ASN CG C 13 177.57 0 0 1 . 1 . . A 523 ASN CG . 28058 1 977 . 1 . 1 109 109 ASN N N 15 111.705 0.054 0 1 . 13 . . A 523 ASN N . 28058 1 978 . 1 . 1 109 109 ASN ND2 N 15 111.843 0.24 0 1 . 14 . . A 523 ASN ND2 . 28058 1 979 . 1 . 1 110 110 GLN H H 1 7.973 0.004 0 1 . 12 . . A 524 GLN H . 28058 1 980 . 1 . 1 110 110 GLN HA H 1 3.739 0.008 0 1 . 8 . . A 524 GLN HA . 28058 1 981 . 1 . 1 110 110 GLN HB2 H 1 2.039 0.003 0 2 . 8 . . A 524 GLN HB2 . 28058 1 982 . 1 . 1 110 110 GLN HB3 H 1 2.307 0.004 0 2 . 6 . . A 524 GLN HB3 . 28058 1 983 . 1 . 1 110 110 GLN HG2 H 1 2.298 0.001 0 1 . 2 . . A 524 GLN HG2 . 28058 1 984 . 1 . 1 110 110 GLN HG3 H 1 2.298 0.001 0 1 . 2 . . A 524 GLN HG3 . 28058 1 985 . 1 . 1 110 110 GLN C C 13 173.607 0 0 1 . 2 . . A 524 GLN C . 28058 1 986 . 1 . 1 110 110 GLN CA C 13 56.743 0.05 0 1 . 8 . . A 524 GLN CA . 28058 1 987 . 1 . 1 110 110 GLN CB C 13 27.403 0.044 0 1 . 11 . . A 524 GLN CB . 28058 1 988 . 1 . 1 110 110 GLN CG C 13 34.716 0.01 0 1 . 2 . . A 524 GLN CG . 28058 1 989 . 1 . 1 110 110 GLN N N 15 113.379 0.077 0 1 . 9 . . A 524 GLN N . 28058 1 990 . 1 . 1 111 111 ASP H H 1 8.031 0.007 0 1 . 11 . . A 525 ASP H . 28058 1 991 . 1 . 1 111 111 ASP HA H 1 4.637 0.002 0 1 . 6 . . A 525 ASP HA . 28058 1 992 . 1 . 1 111 111 ASP HB2 H 1 2.444 0.006 0 2 . 10 . . A 525 ASP HB2 . 28058 1 993 . 1 . 1 111 111 ASP HB3 H 1 2.973 0.002 0 2 . 4 . . A 525 ASP HB3 . 28058 1 994 . 1 . 1 111 111 ASP CA C 13 52.924 0.102 0 1 . 5 . . A 525 ASP CA . 28058 1 995 . 1 . 1 111 111 ASP CB C 13 41.559 0.025 0 1 . 10 . . A 525 ASP CB . 28058 1 996 . 1 . 1 111 111 ASP N N 15 114.46 0.084 0 1 . 9 . . A 525 ASP N . 28058 1 997 . 1 . 1 112 112 GLY H H 1 10.438 0.005 0 1 . 8 . . A 526 GLY H . 28058 1 998 . 1 . 1 112 112 GLY HA2 H 1 3.193 0.008 0 1 . 5 . . A 526 GLY HA2 . 28058 1 999 . 1 . 1 112 112 GLY HA3 H 1 3.193 0.008 0 1 . 5 . . A 526 GLY HA3 . 28058 1 1000 . 1 . 1 112 112 GLY CA C 13 46.239 0.041 0 1 . 3 . . A 526 GLY CA . 28058 1 1001 . 1 . 1 112 112 GLY N N 15 115.71 0.179 0 1 . 4 . . A 526 GLY N . 28058 1 1002 . 1 . 1 113 113 ILE HA H 1 4.579 0.005 0 1 . 5 . . A 527 ILE HA . 28058 1 1003 . 1 . 1 113 113 ILE HB H 1 1.853 0.003 0 1 . 13 . . A 527 ILE HB . 28058 1 1004 . 1 . 1 113 113 ILE HG12 H 1 0.852 0.002 0 2 . 4 . . A 527 ILE HG12 . 28058 1 1005 . 1 . 1 113 113 ILE HG13 H 1 1.434 0.004 0 2 . 8 . . A 527 ILE HG13 . 28058 1 1006 . 1 . 1 113 113 ILE HG21 H 1 0.706 0.003 0 1 . 8 . . A 527 ILE MG . 28058 1 1007 . 1 . 1 113 113 ILE HG22 H 1 0.706 0.003 0 1 . 8 . . A 527 ILE MG . 28058 1 1008 . 1 . 1 113 113 ILE HG23 H 1 0.706 0.003 0 1 . 8 . . A 527 ILE MG . 28058 1 1009 . 1 . 1 113 113 ILE HD11 H 1 0.738 0.008 0 1 . 13 . . A 527 ILE MD . 28058 1 1010 . 1 . 1 113 113 ILE HD12 H 1 0.738 0.008 0 1 . 13 . . A 527 ILE MD . 28058 1 1011 . 1 . 1 113 113 ILE HD13 H 1 0.738 0.008 0 1 . 13 . . A 527 ILE MD . 28058 1 1012 . 1 . 1 113 113 ILE C C 13 176.891 0 0 1 . 2 . . A 527 ILE C . 28058 1 1013 . 1 . 1 113 113 ILE CA C 13 59.232 0.059 0 1 . 6 . . A 527 ILE CA . 28058 1 1014 . 1 . 1 113 113 ILE CB C 13 39.839 0.053 0 1 . 7 . . A 527 ILE CB . 28058 1 1015 . 1 . 1 113 113 ILE CG1 C 13 27.171 0.087 0 1 . 6 . . A 527 ILE CG1 . 28058 1 1016 . 1 . 1 113 113 ILE CG2 C 13 17.169 0.048 0 1 . 6 . . A 527 ILE CG2 . 28058 1 1017 . 1 . 1 113 113 ILE CD1 C 13 13.016 0.025 0 1 . 8 . . A 527 ILE CD1 . 28058 1 1018 . 1 . 1 114 114 SER H H 1 9.596 0.007 0 1 . 12 . . A 528 SER H . 28058 1 1019 . 1 . 1 114 114 SER HA H 1 4.521 0.004 0 1 . 5 . . A 528 SER HA . 28058 1 1020 . 1 . 1 114 114 SER HB2 H 1 1.546 0.005 0 2 . 6 . . A 528 SER HB2 . 28058 1 1021 . 1 . 1 114 114 SER HB3 H 1 2.835 0.005 0 2 . 8 . . A 528 SER HB3 . 28058 1 1022 . 1 . 1 114 114 SER C C 13 176.516 0 0 1 . 2 . . A 528 SER C . 28058 1 1023 . 1 . 1 114 114 SER CA C 13 53.206 0.114 0 1 . 4 . . A 528 SER CA . 28058 1 1024 . 1 . 1 114 114 SER CB C 13 63.024 0.041 0 1 . 11 . . A 528 SER CB . 28058 1 1025 . 1 . 1 114 114 SER N N 15 128.234 0.061 0 1 . 9 . . A 528 SER N . 28058 1 1026 . 1 . 1 115 115 GLN H H 1 7.771 0.01 0 1 . 8 . . A 529 GLN H . 28058 1 1027 . 1 . 1 115 115 GLN HA H 1 4.291 0.006 0 1 . 8 . . A 529 GLN HA . 28058 1 1028 . 1 . 1 115 115 GLN HB2 H 1 2.136 0.002 0 2 . 2 . . A 529 GLN HB2 . 28058 1 1029 . 1 . 1 115 115 GLN HB3 H 1 2.183 0.003 0 2 . 2 . . A 529 GLN HB3 . 28058 1 1030 . 1 . 1 115 115 GLN HG2 H 1 2.355 0.002 0 2 . 8 . . A 529 GLN HG2 . 28058 1 1031 . 1 . 1 115 115 GLN HG3 H 1 2.848 0.004 0 2 . 10 . . A 529 GLN HG3 . 28058 1 1032 . 1 . 1 115 115 GLN HE21 H 1 7.7 0.005 0 2 . 8 . . A 529 GLN HE21 . 28058 1 1033 . 1 . 1 115 115 GLN HE22 H 1 8.918 0.012 0 2 . 5 . . A 529 GLN HE22 . 28058 1 1034 . 1 . 1 115 115 GLN C C 13 177.501 0 0 1 . 2 . . A 529 GLN C . 28058 1 1035 . 1 . 1 115 115 GLN CA C 13 58.501 0.066 0 1 . 6 . . A 529 GLN CA . 28058 1 1036 . 1 . 1 115 115 GLN CB C 13 27.525 0.039 0 1 . 7 . . A 529 GLN CB . 28058 1 1037 . 1 . 1 115 115 GLN CG C 13 35.258 0.014 0 1 . 13 . . A 529 GLN CG . 28058 1 1038 . 1 . 1 115 115 GLN N N 15 128.341 0.07 0 1 . 8 . . A 529 GLN N . 28058 1 1039 . 1 . 1 115 115 GLN NE2 N 15 115.097 0.094 0 1 . 7 . . A 529 GLN NE2 . 28058 1 1040 . 1 . 1 116 116 ALA H H 1 8.616 0.004 0 1 . 12 . . A 530 ALA H . 28058 1 1041 . 1 . 1 116 116 ALA HA H 1 3.953 0.006 0 1 . 8 . . A 530 ALA HA . 28058 1 1042 . 1 . 1 116 116 ALA HB1 H 1 1.446 0.003 0 1 . 11 . . A 530 ALA MB . 28058 1 1043 . 1 . 1 116 116 ALA HB2 H 1 1.446 0.003 0 1 . 11 . . A 530 ALA MB . 28058 1 1044 . 1 . 1 116 116 ALA HB3 H 1 1.446 0.003 0 1 . 11 . . A 530 ALA MB . 28058 1 1045 . 1 . 1 116 116 ALA C C 13 179.662 0 0 1 . 2 . . A 530 ALA C . 28058 1 1046 . 1 . 1 116 116 ALA CA C 13 56.118 0.016 0 1 . 7 . . A 530 ALA CA . 28058 1 1047 . 1 . 1 116 116 ALA CB C 13 18.49 0.073 0 1 . 9 . . A 530 ALA CB . 28058 1 1048 . 1 . 1 116 116 ALA N N 15 123.102 0.041 0 1 . 11 . . A 530 ALA N . 28058 1 1049 . 1 . 1 117 117 ASN H H 1 8.506 0.005 0 1 . 14 . . A 531 ASN H . 28058 1 1050 . 1 . 1 117 117 ASN HA H 1 4.596 0.003 0 1 . 8 . . A 531 ASN HA . 28058 1 1051 . 1 . 1 117 117 ASN HB2 H 1 2.744 0.006 0 2 . 12 . . A 531 ASN HB2 . 28058 1 1052 . 1 . 1 117 117 ASN HB3 H 1 3.025 0.002 0 2 . 13 . . A 531 ASN HB3 . 28058 1 1053 . 1 . 1 117 117 ASN HD21 H 1 6.971 0.002 0 2 . 13 . . A 531 ASN HD21 . 28058 1 1054 . 1 . 1 117 117 ASN HD22 H 1 7.662 0.006 0 2 . 13 . . A 531 ASN HD22 . 28058 1 1055 . 1 . 1 117 117 ASN C C 13 175.134 0 0 1 . 2 . . A 531 ASN C . 28058 1 1056 . 1 . 1 117 117 ASN CA C 13 54.486 0.071 0 1 . 9 . . A 531 ASN CA . 28058 1 1057 . 1 . 1 117 117 ASN CB C 13 36.756 0.061 0 1 . 19 . . A 531 ASN CB . 28058 1 1058 . 1 . 1 117 117 ASN CG C 13 177.525 0.018 0 1 . 2 . . A 531 ASN CG . 28058 1 1059 . 1 . 1 117 117 ASN N N 15 111.399 0.051 0 1 . 13 . . A 531 ASN N . 28058 1 1060 . 1 . 1 117 117 ASN ND2 N 15 112.85 0.229 0 1 . 18 . . A 531 ASN ND2 . 28058 1 1061 . 1 . 1 118 118 GLU H H 1 7.983 0.004 0 1 . 15 . . A 532 GLU H . 28058 1 1062 . 1 . 1 118 118 GLU HA H 1 4.393 0.003 0 1 . 10 . . A 532 GLU HA . 28058 1 1063 . 1 . 1 118 118 GLU HB2 H 1 2.508 0.003 0 2 . 10 . . A 532 GLU HB2 . 28058 1 1064 . 1 . 1 118 118 GLU HB3 H 1 3.363 0.007 0 2 . 12 . . A 532 GLU HB3 . 28058 1 1065 . 1 . 1 118 118 GLU HG2 H 1 2.373 0.003 0 2 . 9 . . A 532 GLU HG2 . 28058 1 1066 . 1 . 1 118 118 GLU HG3 H 1 2.684 0.003 0 2 . 9 . . A 532 GLU HG3 . 28058 1 1067 . 1 . 1 118 118 GLU C C 13 175.317 0 0 1 . 2 . . A 532 GLU C . 28058 1 1068 . 1 . 1 118 118 GLU CA C 13 56.545 0.028 0 1 . 9 . . A 532 GLU CA . 28058 1 1069 . 1 . 1 118 118 GLU CB C 13 30.216 0.037 0 1 . 17 . . A 532 GLU CB . 28058 1 1070 . 1 . 1 118 118 GLU CG C 13 37.833 0.031 0 1 . 10 . . A 532 GLU CG . 28058 1 1071 . 1 . 1 118 118 GLU N N 15 117.574 0.041 0 1 . 9 . . A 532 GLU N . 28058 1 1072 . 1 . 1 119 119 LEU H H 1 6.996 0.004 0 1 . 19 . . A 533 LEU H . 28058 1 1073 . 1 . 1 119 119 LEU HA H 1 5.1 0.006 0 1 . 28 . . A 533 LEU HA . 28058 1 1074 . 1 . 1 119 119 LEU HB2 H 1 0.908 0.005 0 2 . 19 . . A 533 LEU HB2 . 28058 1 1075 . 1 . 1 119 119 LEU HB3 H 1 1.924 0.004 0 2 . 23 . . A 533 LEU HB3 . 28058 1 1076 . 1 . 1 119 119 LEU HG H 1 1.38 0.004 0 1 . 18 . . A 533 LEU HG . 28058 1 1077 . 1 . 1 119 119 LEU HD11 H 1 0.472 0.003 0 2 . 23 . . A 533 LEU MD1 . 28058 1 1078 . 1 . 1 119 119 LEU HD12 H 1 0.472 0.003 0 2 . 23 . . A 533 LEU MD1 . 28058 1 1079 . 1 . 1 119 119 LEU HD13 H 1 0.472 0.003 0 2 . 23 . . A 533 LEU MD1 . 28058 1 1080 . 1 . 1 119 119 LEU HD21 H 1 0.581 0.008 0 2 . 21 . . A 533 LEU MD2 . 28058 1 1081 . 1 . 1 119 119 LEU HD22 H 1 0.581 0.008 0 2 . 21 . . A 533 LEU MD2 . 28058 1 1082 . 1 . 1 119 119 LEU HD23 H 1 0.581 0.008 0 2 . 21 . . A 533 LEU MD2 . 28058 1 1083 . 1 . 1 119 119 LEU C C 13 176.327 0 0 1 . 2 . . A 533 LEU C . 28058 1 1084 . 1 . 1 119 119 LEU CA C 13 53.569 0.042 0 1 . 17 . . A 533 LEU CA . 28058 1 1085 . 1 . 1 119 119 LEU CB C 13 43.719 0.076 0 1 . 26 . . A 533 LEU CB . 28058 1 1086 . 1 . 1 119 119 LEU CG C 13 26.666 0.062 0 1 . 9 . . A 533 LEU CG . 28058 1 1087 . 1 . 1 119 119 LEU CD1 C 13 24.054 0.139 0 2 . 12 . . A 533 LEU CD1 . 28058 1 1088 . 1 . 1 119 119 LEU CD2 C 13 25.054 0.044 0 2 . 11 . . A 533 LEU CD2 . 28058 1 1089 . 1 . 1 119 119 LEU N N 15 118.449 0.057 0 1 . 16 . . A 533 LEU N . 28058 1 1090 . 1 . 1 120 120 ARG H H 1 8.882 0.008 0 1 . 18 . . A 534 ARG H . 28058 1 1091 . 1 . 1 120 120 ARG HA H 1 4.931 0.008 0 1 . 21 . . A 534 ARG HA . 28058 1 1092 . 1 . 1 120 120 ARG HB2 H 1 1.689 0.003 0 2 . 13 . . A 534 ARG HB2 . 28058 1 1093 . 1 . 1 120 120 ARG HB3 H 1 1.885 0.005 0 2 . 16 . . A 534 ARG HB3 . 28058 1 1094 . 1 . 1 120 120 ARG HG2 H 1 1.688 0.003 0 2 . 15 . . A 534 ARG HG2 . 28058 1 1095 . 1 . 1 120 120 ARG HG3 H 1 1.784 0.02 0 2 . 19 . . A 534 ARG HG3 . 28058 1 1096 . 1 . 1 120 120 ARG HD2 H 1 3.109 0.008 0 2 . 10 . . A 534 ARG HD2 . 28058 1 1097 . 1 . 1 120 120 ARG HD3 H 1 3.152 0.004 0 2 . 9 . . A 534 ARG HD3 . 28058 1 1098 . 1 . 1 120 120 ARG HE H 1 7.27 0.004 0 1 . 4 . . A 534 ARG HE . 28058 1 1099 . 1 . 1 120 120 ARG C C 13 176.591 0 0 1 . 2 . . A 534 ARG C . 28058 1 1100 . 1 . 1 120 120 ARG CA C 13 54.208 0.099 0 1 . 13 . . A 534 ARG CA . 28058 1 1101 . 1 . 1 120 120 ARG CB C 13 33.58 0.097 0 1 . 22 . . A 534 ARG CB . 28058 1 1102 . 1 . 1 120 120 ARG CG C 13 27.547 0.051 0 1 . 20 . . A 534 ARG CG . 28058 1 1103 . 1 . 1 120 120 ARG CD C 13 43.452 0.091 0 1 . 17 . . A 534 ARG CD . 28058 1 1104 . 1 . 1 120 120 ARG CZ C 13 159.677 0 0 1 . 1 . . A 534 ARG CZ . 28058 1 1105 . 1 . 1 120 120 ARG N N 15 122.864 0.034 0 1 . 11 . . A 534 ARG N . 28058 1 1106 . 1 . 1 120 120 ARG NE N 15 85.155 0.044 0 1 . 4 . . A 534 ARG NE . 28058 1 1107 . 1 . 1 121 121 THR H H 1 9.415 0.005 0 1 . 14 . . A 535 THR H . 28058 1 1108 . 1 . 1 121 121 THR HA H 1 4.328 0.003 0 1 . 14 . . A 535 THR HA . 28058 1 1109 . 1 . 1 121 121 THR HB H 1 4.83 0.005 0 1 . 10 . . A 535 THR HB . 28058 1 1110 . 1 . 1 121 121 THR HG21 H 1 1.248 0.004 0 1 . 12 . . A 535 THR MG . 28058 1 1111 . 1 . 1 121 121 THR HG22 H 1 1.248 0.004 0 1 . 12 . . A 535 THR MG . 28058 1 1112 . 1 . 1 121 121 THR HG23 H 1 1.248 0.004 0 1 . 12 . . A 535 THR MG . 28058 1 1113 . 1 . 1 121 121 THR C C 13 174.214 0 0 1 . 2 . . A 535 THR C . 28058 1 1114 . 1 . 1 121 121 THR CA C 13 61.234 0.017 0 1 . 9 . . A 535 THR CA . 28058 1 1115 . 1 . 1 121 121 THR CB C 13 69.986 0.063 0 1 . 10 . . A 535 THR CB . 28058 1 1116 . 1 . 1 121 121 THR CG2 C 13 21.488 0.017 0 1 . 6 . . A 535 THR CG2 . 28058 1 1117 . 1 . 1 121 121 THR N N 15 113.653 0.033 0 1 . 11 . . A 535 THR N . 28058 1 1118 . 1 . 1 122 122 LEU H H 1 7.74 0.004 0 1 . 16 . . A 536 LEU H . 28058 1 1119 . 1 . 1 122 122 LEU HA H 1 3.739 0.003 0 1 . 19 . . A 536 LEU HA . 28058 1 1120 . 1 . 1 122 122 LEU HB2 H 1 1.261 0.005 0 2 . 11 . . A 536 LEU HB2 . 28058 1 1121 . 1 . 1 122 122 LEU HB3 H 1 1.418 0.005 0 2 . 15 . . A 536 LEU HB3 . 28058 1 1122 . 1 . 1 122 122 LEU HG H 1 1.26 0.003 0 1 . 16 . . A 536 LEU HG . 28058 1 1123 . 1 . 1 122 122 LEU HD11 H 1 0.262 0.002 0 2 . 16 . . A 536 LEU MD1 . 28058 1 1124 . 1 . 1 122 122 LEU HD12 H 1 0.262 0.002 0 2 . 16 . . A 536 LEU MD1 . 28058 1 1125 . 1 . 1 122 122 LEU HD13 H 1 0.262 0.002 0 2 . 16 . . A 536 LEU MD1 . 28058 1 1126 . 1 . 1 122 122 LEU HD21 H 1 0.324 0.003 0 2 . 16 . . A 536 LEU MD2 . 28058 1 1127 . 1 . 1 122 122 LEU HD22 H 1 0.324 0.003 0 2 . 16 . . A 536 LEU MD2 . 28058 1 1128 . 1 . 1 122 122 LEU HD23 H 1 0.324 0.003 0 2 . 16 . . A 536 LEU MD2 . 28058 1 1129 . 1 . 1 122 122 LEU C C 13 179.665 0 0 1 . 2 . . A 536 LEU C . 28058 1 1130 . 1 . 1 122 122 LEU CA C 13 59.447 0.028 0 1 . 11 . . A 536 LEU CA . 28058 1 1131 . 1 . 1 122 122 LEU CB C 13 38.243 0.049 0 1 . 17 . . A 536 LEU CB . 28058 1 1132 . 1 . 1 122 122 LEU CG C 13 29.318 0.019 0 1 . 9 . . A 536 LEU CG . 28058 1 1133 . 1 . 1 122 122 LEU CD1 C 13 25.501 0.046 0 2 . 10 . . A 536 LEU CD1 . 28058 1 1134 . 1 . 1 122 122 LEU CD2 C 13 24.291 0.055 0 2 . 10 . . A 536 LEU CD2 . 28058 1 1135 . 1 . 1 122 122 LEU N N 15 119.694 0.039 0 1 . 14 . . A 536 LEU N . 28058 1 1136 . 1 . 1 123 123 GLU H H 1 8.59 0.003 0 1 . 21 . . A 537 GLU H . 28058 1 1137 . 1 . 1 123 123 GLU HA H 1 4.14 0.004 0 1 . 14 . . A 537 GLU HA . 28058 1 1138 . 1 . 1 123 123 GLU HB2 H 1 1.975 0.004 0 2 . 19 . . A 537 GLU HB2 . 28058 1 1139 . 1 . 1 123 123 GLU HB3 H 1 2.151 0.003 0 2 . 10 . . A 537 GLU HB3 . 28058 1 1140 . 1 . 1 123 123 GLU HG2 H 1 2.33 0.005 0 2 . 10 . . A 537 GLU HG2 . 28058 1 1141 . 1 . 1 123 123 GLU HG3 H 1 2.425 0.004 0 2 . 14 . . A 537 GLU HG3 . 28058 1 1142 . 1 . 1 123 123 GLU C C 13 181.035 0 0 1 . 2 . . A 537 GLU C . 28058 1 1143 . 1 . 1 123 123 GLU CA C 13 59.743 0.049 0 1 . 9 . . A 537 GLU CA . 28058 1 1144 . 1 . 1 123 123 GLU CB C 13 29.521 0.081 0 1 . 17 . . A 537 GLU CB . 28058 1 1145 . 1 . 1 123 123 GLU CG C 13 36.649 0.093 0 1 . 17 . . A 537 GLU CG . 28058 1 1146 . 1 . 1 123 123 GLU N N 15 118.282 0.046 0 1 . 17 . . A 537 GLU N . 28058 1 1147 . 1 . 1 124 124 GLU H H 1 8.123 0.004 0 1 . 16 . . A 538 GLU H . 28058 1 1148 . 1 . 1 124 124 GLU HA H 1 4.111 0.004 0 1 . 15 . . A 538 GLU HA . 28058 1 1149 . 1 . 1 124 124 GLU HB2 H 1 1.933 0.004 0 2 . 13 . . A 538 GLU HB2 . 28058 1 1150 . 1 . 1 124 124 GLU HB3 H 1 2.368 0.004 0 2 . 14 . . A 538 GLU HB3 . 28058 1 1151 . 1 . 1 124 124 GLU HG2 H 1 2.211 0.008 0 2 . 8 . . A 538 GLU HG2 . 28058 1 1152 . 1 . 1 124 124 GLU HG3 H 1 2.567 0.003 0 2 . 14 . . A 538 GLU HG3 . 28058 1 1153 . 1 . 1 124 124 GLU C C 13 178.054 0 0 1 . 2 . . A 538 GLU C . 28058 1 1154 . 1 . 1 124 124 GLU CA C 13 58.945 0.041 0 1 . 11 . . A 538 GLU CA . 28058 1 1155 . 1 . 1 124 124 GLU CB C 13 29.529 0.048 0 1 . 16 . . A 538 GLU CB . 28058 1 1156 . 1 . 1 124 124 GLU CG C 13 37.065 0.064 0 1 . 11 . . A 538 GLU CG . 28058 1 1157 . 1 . 1 124 124 GLU N N 15 121.43 0.057 0 1 . 14 . . A 538 GLU N . 28058 1 1158 . 1 . 1 125 125 LEU H H 1 7.045 0.003 0 1 . 26 . . A 539 LEU H . 28058 1 1159 . 1 . 1 125 125 LEU HA H 1 4.358 0.004 0 1 . 13 . . A 539 LEU HA . 28058 1 1160 . 1 . 1 125 125 LEU HB2 H 1 1.621 0.004 0 1 . 7 . . A 539 LEU HB2 . 28058 1 1161 . 1 . 1 125 125 LEU HB3 H 1 1.621 0.004 0 1 . 7 . . A 539 LEU HB3 . 28058 1 1162 . 1 . 1 125 125 LEU HG H 1 1.605 0.012 0 1 . 6 . . A 539 LEU HG . 28058 1 1163 . 1 . 1 125 125 LEU HD11 H 1 0.68 0.003 0 2 . 14 . . A 539 LEU MD1 . 28058 1 1164 . 1 . 1 125 125 LEU HD12 H 1 0.68 0.003 0 2 . 14 . . A 539 LEU MD1 . 28058 1 1165 . 1 . 1 125 125 LEU HD13 H 1 0.68 0.003 0 2 . 14 . . A 539 LEU MD1 . 28058 1 1166 . 1 . 1 125 125 LEU HD21 H 1 0.86 0.002 0 2 . 10 . . A 539 LEU MD2 . 28058 1 1167 . 1 . 1 125 125 LEU HD22 H 1 0.86 0.002 0 2 . 10 . . A 539 LEU MD2 . 28058 1 1168 . 1 . 1 125 125 LEU HD23 H 1 0.86 0.002 0 2 . 10 . . A 539 LEU MD2 . 28058 1 1169 . 1 . 1 125 125 LEU C C 13 176.773 0 0 1 . 2 . . A 539 LEU C . 28058 1 1170 . 1 . 1 125 125 LEU CA C 13 54.29 0.019 0 1 . 8 . . A 539 LEU CA . 28058 1 1171 . 1 . 1 125 125 LEU CB C 13 43.318 0.052 0 1 . 8 . . A 539 LEU CB . 28058 1 1172 . 1 . 1 125 125 LEU CG C 13 27.001 0.104 0 1 . 5 . . A 539 LEU CG . 28058 1 1173 . 1 . 1 125 125 LEU CD1 C 13 26.79 0.064 0 2 . 7 . . A 539 LEU CD1 . 28058 1 1174 . 1 . 1 125 125 LEU CD2 C 13 22.694 0.012 0 2 . 5 . . A 539 LEU CD2 . 28058 1 1175 . 1 . 1 125 125 LEU N N 15 117.971 0.051 0 1 . 19 . . A 539 LEU N . 28058 1 1176 . 1 . 1 126 126 GLY H H 1 7.918 0.003 0 1 . 18 . . A 540 GLY H . 28058 1 1177 . 1 . 1 126 126 GLY HA2 H 1 3.895 0.004 0 2 . 8 . . A 540 GLY HA2 . 28058 1 1178 . 1 . 1 126 126 GLY HA3 H 1 4.004 0.007 0 2 . 8 . . A 540 GLY HA3 . 28058 1 1179 . 1 . 1 126 126 GLY C C 13 174.717 0 0 1 . 2 . . A 540 GLY C . 28058 1 1180 . 1 . 1 126 126 GLY CA C 13 46.925 0.056 0 1 . 14 . . A 540 GLY CA . 28058 1 1181 . 1 . 1 126 126 GLY N N 15 109.025 0.049 0 1 . 14 . . A 540 GLY N . 28058 1 1182 . 1 . 1 127 127 ILE H H 1 8.206 0.004 0 1 . 17 . . A 541 ILE H . 28058 1 1183 . 1 . 1 127 127 ILE HA H 1 3.994 0.004 0 1 . 19 . . A 541 ILE HA . 28058 1 1184 . 1 . 1 127 127 ILE HB H 1 1.614 0.004 0 1 . 11 . . A 541 ILE HB . 28058 1 1185 . 1 . 1 127 127 ILE HG12 H 1 0.84 0.004 0 2 . 8 . . A 541 ILE HG12 . 28058 1 1186 . 1 . 1 127 127 ILE HG13 H 1 1.521 0.003 0 2 . 9 . . A 541 ILE HG13 . 28058 1 1187 . 1 . 1 127 127 ILE HG21 H 1 0.698 0.005 0 1 . 17 . . A 541 ILE MG . 28058 1 1188 . 1 . 1 127 127 ILE HG22 H 1 0.698 0.005 0 1 . 17 . . A 541 ILE MG . 28058 1 1189 . 1 . 1 127 127 ILE HG23 H 1 0.698 0.005 0 1 . 17 . . A 541 ILE MG . 28058 1 1190 . 1 . 1 127 127 ILE HD11 H 1 0.303 0.003 0 1 . 27 . . A 541 ILE MD . 28058 1 1191 . 1 . 1 127 127 ILE HD12 H 1 0.303 0.003 0 1 . 27 . . A 541 ILE MD . 28058 1 1192 . 1 . 1 127 127 ILE HD13 H 1 0.303 0.003 0 1 . 27 . . A 541 ILE MD . 28058 1 1193 . 1 . 1 127 127 ILE C C 13 173.774 0 0 1 . 2 . . A 541 ILE C . 28058 1 1194 . 1 . 1 127 127 ILE CA C 13 63.235 0.049 0 1 . 12 . . A 541 ILE CA . 28058 1 1195 . 1 . 1 127 127 ILE CB C 13 38.277 0.038 0 1 . 11 . . A 541 ILE CB . 28058 1 1196 . 1 . 1 127 127 ILE CG1 C 13 27.701 0.076 0 1 . 12 . . A 541 ILE CG1 . 28058 1 1197 . 1 . 1 127 127 ILE CG2 C 13 16.998 0.056 0 1 . 9 . . A 541 ILE CG2 . 28058 1 1198 . 1 . 1 127 127 ILE CD1 C 13 14.255 0.064 0 1 . 12 . . A 541 ILE CD1 . 28058 1 1199 . 1 . 1 127 127 ILE N N 15 121.319 0.042 0 1 . 11 . . A 541 ILE N . 28058 1 1200 . 1 . 1 128 128 GLN H H 1 9.246 0.002 0 1 . 12 . . A 542 GLN H . 28058 1 1201 . 1 . 1 128 128 GLN HA H 1 4.379 0.003 0 1 . 13 . . A 542 GLN HA . 28058 1 1202 . 1 . 1 128 128 GLN HB2 H 1 1.663 0.003 0 2 . 12 . . A 542 GLN HB2 . 28058 1 1203 . 1 . 1 128 128 GLN HB3 H 1 1.776 0.006 0 2 . 12 . . A 542 GLN HB3 . 28058 1 1204 . 1 . 1 128 128 GLN HG2 H 1 2.089 0.004 0 2 . 13 . . A 542 GLN HG2 . 28058 1 1205 . 1 . 1 128 128 GLN HG3 H 1 2.218 0.006 0 2 . 14 . . A 542 GLN HG3 . 28058 1 1206 . 1 . 1 128 128 GLN HE21 H 1 6.841 0.004 0 2 . 9 . . A 542 GLN HE21 . 28058 1 1207 . 1 . 1 128 128 GLN HE22 H 1 7.528 0.001 0 2 . 8 . . A 542 GLN HE22 . 28058 1 1208 . 1 . 1 128 128 GLN C C 13 175.154 0 0 1 . 2 . . A 542 GLN C . 28058 1 1209 . 1 . 1 128 128 GLN CA C 13 56.838 0.058 0 1 . 10 . . A 542 GLN CA . 28058 1 1210 . 1 . 1 128 128 GLN CB C 13 32.426 0.097 0 1 . 19 . . A 542 GLN CB . 28058 1 1211 . 1 . 1 128 128 GLN CG C 13 34.563 0.098 0 1 . 18 . . A 542 GLN CG . 28058 1 1212 . 1 . 1 128 128 GLN CD C 13 179.524 0.01 0 1 . 2 . . A 542 GLN CD . 28058 1 1213 . 1 . 1 128 128 GLN N N 15 127.884 0.038 0 1 . 11 . . A 542 GLN N . 28058 1 1214 . 1 . 1 128 128 GLN NE2 N 15 111.276 0.264 0 1 . 17 . . A 542 GLN NE2 . 28058 1 1215 . 1 . 1 129 129 SER H H 1 8.211 0.003 0 1 . 11 . . A 543 SER H . 28058 1 1216 . 1 . 1 129 129 SER HA H 1 5.407 0.003 0 1 . 16 . . A 543 SER HA . 28058 1 1217 . 1 . 1 129 129 SER HB2 H 1 3.714 0.003 0 2 . 11 . . A 543 SER HB2 . 28058 1 1218 . 1 . 1 129 129 SER HB3 H 1 3.903 0.003 0 2 . 11 . . A 543 SER HB3 . 28058 1 1219 . 1 . 1 129 129 SER C C 13 172.209 0 0 1 . 2 . . A 543 SER C . 28058 1 1220 . 1 . 1 129 129 SER CA C 13 57.09 0.045 0 1 . 11 . . A 543 SER CA . 28058 1 1221 . 1 . 1 129 129 SER CB C 13 65.958 0.057 0 1 . 14 . . A 543 SER CB . 28058 1 1222 . 1 . 1 129 129 SER N N 15 108.973 0.032 0 1 . 11 . . A 543 SER N . 28058 1 1223 . 1 . 1 130 130 LEU H H 1 9.199 0.004 0 1 . 20 . . A 544 LEU H . 28058 1 1224 . 1 . 1 130 130 LEU HA H 1 4.834 0.008 0 1 . 17 . . A 544 LEU HA . 28058 1 1225 . 1 . 1 130 130 LEU HB2 H 1 1.37 0.004 0 2 . 13 . . A 544 LEU HB2 . 28058 1 1226 . 1 . 1 130 130 LEU HB3 H 1 1.639 0.008 0 2 . 8 . . A 544 LEU HB3 . 28058 1 1227 . 1 . 1 130 130 LEU HG H 1 1.588 0.006 0 1 . 12 . . A 544 LEU HG . 28058 1 1228 . 1 . 1 130 130 LEU HD11 H 1 0.635 0.003 0 2 . 17 . . A 544 LEU MD1 . 28058 1 1229 . 1 . 1 130 130 LEU HD12 H 1 0.635 0.003 0 2 . 17 . . A 544 LEU MD1 . 28058 1 1230 . 1 . 1 130 130 LEU HD13 H 1 0.635 0.003 0 2 . 17 . . A 544 LEU MD1 . 28058 1 1231 . 1 . 1 130 130 LEU HD21 H 1 0.686 0.003 0 2 . 14 . . A 544 LEU MD2 . 28058 1 1232 . 1 . 1 130 130 LEU HD22 H 1 0.686 0.003 0 2 . 14 . . A 544 LEU MD2 . 28058 1 1233 . 1 . 1 130 130 LEU HD23 H 1 0.686 0.003 0 2 . 14 . . A 544 LEU MD2 . 28058 1 1234 . 1 . 1 130 130 LEU C C 13 175.271 0 0 1 . 2 . . A 544 LEU C . 28058 1 1235 . 1 . 1 130 130 LEU CA C 13 53.841 0.113 0 1 . 13 . . A 544 LEU CA . 28058 1 1236 . 1 . 1 130 130 LEU CB C 13 43.221 0.031 0 1 . 13 . . A 544 LEU CB . 28058 1 1237 . 1 . 1 130 130 LEU CG C 13 27.583 0.044 0 1 . 6 . . A 544 LEU CG . 28058 1 1238 . 1 . 1 130 130 LEU CD1 C 13 27.196 0.078 0 2 . 12 . . A 544 LEU CD1 . 28058 1 1239 . 1 . 1 130 130 LEU CD2 C 13 24.855 0.018 0 2 . 10 . . A 544 LEU CD2 . 28058 1 1240 . 1 . 1 130 130 LEU N N 15 118.784 0.04 0 1 . 15 . . A 544 LEU N . 28058 1 1241 . 1 . 1 131 131 ASP H H 1 8.019 0.007 0 1 . 10 . . A 545 ASP H . 28058 1 1242 . 1 . 1 131 131 ASP HA H 1 4.808 0.003 0 1 . 10 . . A 545 ASP HA . 28058 1 1243 . 1 . 1 131 131 ASP HB2 H 1 2.866 0.005 0 2 . 6 . . A 545 ASP HB2 . 28058 1 1244 . 1 . 1 131 131 ASP HB3 H 1 3.009 0.004 0 2 . 6 . . A 545 ASP HB3 . 28058 1 1245 . 1 . 1 131 131 ASP C C 13 177.393 0 0 1 . 2 . . A 545 ASP C . 28058 1 1246 . 1 . 1 131 131 ASP CA C 13 54.967 0.098 0 1 . 9 . . A 545 ASP CA . 28058 1 1247 . 1 . 1 131 131 ASP CB C 13 41.545 0.026 0 1 . 10 . . A 545 ASP CB . 28058 1 1248 . 1 . 1 131 131 ASP N N 15 124.167 0.05 0 1 . 9 . . A 545 ASP N . 28058 1 1249 . 1 . 1 132 132 LEU H H 1 7.76 0.005 0 1 . 16 . . A 546 LEU H . 28058 1 1250 . 1 . 1 132 132 LEU HA H 1 4.645 0.003 0 1 . 11 . . A 546 LEU HA . 28058 1 1251 . 1 . 1 132 132 LEU HB2 H 1 1.6 0.003 0 2 . 10 . . A 546 LEU HB2 . 28058 1 1252 . 1 . 1 132 132 LEU HB3 H 1 1.717 0.005 0 2 . 8 . . A 546 LEU HB3 . 28058 1 1253 . 1 . 1 132 132 LEU HG H 1 1.368 0.001 0 1 . 6 . . A 546 LEU HG . 28058 1 1254 . 1 . 1 132 132 LEU HD11 H 1 0.837 0.002 0 2 . 3 . . A 546 LEU MD1 . 28058 1 1255 . 1 . 1 132 132 LEU HD12 H 1 0.837 0.002 0 2 . 3 . . A 546 LEU MD1 . 28058 1 1256 . 1 . 1 132 132 LEU HD13 H 1 0.837 0.002 0 2 . 3 . . A 546 LEU MD1 . 28058 1 1257 . 1 . 1 132 132 LEU HD21 H 1 0.897 0 0 2 . 3 . . A 546 LEU MD2 . 28058 1 1258 . 1 . 1 132 132 LEU HD22 H 1 0.897 0 0 2 . 3 . . A 546 LEU MD2 . 28058 1 1259 . 1 . 1 132 132 LEU HD23 H 1 0.897 0 0 2 . 3 . . A 546 LEU MD2 . 28058 1 1260 . 1 . 1 132 132 LEU C C 13 176.923 0 0 1 . 2 . . A 546 LEU C . 28058 1 1261 . 1 . 1 132 132 LEU CA C 13 55.228 0.041 0 1 . 9 . . A 546 LEU CA . 28058 1 1262 . 1 . 1 132 132 LEU CB C 13 40.962 0.028 0 1 . 14 . . A 546 LEU CB . 28058 1 1263 . 1 . 1 132 132 LEU CG C 13 27.271 0.018 0 1 . 6 . . A 546 LEU CG . 28058 1 1264 . 1 . 1 132 132 LEU CD1 C 13 22.736 0.004 0 2 . 2 . . A 546 LEU CD1 . 28058 1 1265 . 1 . 1 132 132 LEU CD2 C 13 26.1 0.003 0 2 . 2 . . A 546 LEU CD2 . 28058 1 1266 . 1 . 1 132 132 LEU N N 15 121.625 0.03 0 1 . 11 . . A 546 LEU N . 28058 1 1267 . 1 . 1 133 133 ALA H H 1 8.056 0.003 0 1 . 15 . . A 547 ALA H . 28058 1 1268 . 1 . 1 133 133 ALA HA H 1 4.199 0.004 0 1 . 12 . . A 547 ALA HA . 28058 1 1269 . 1 . 1 133 133 ALA HB1 H 1 1.242 0.002 0 1 . 9 . . A 547 ALA MB . 28058 1 1270 . 1 . 1 133 133 ALA HB2 H 1 1.242 0.002 0 1 . 9 . . A 547 ALA MB . 28058 1 1271 . 1 . 1 133 133 ALA HB3 H 1 1.242 0.002 0 1 . 9 . . A 547 ALA MB . 28058 1 1272 . 1 . 1 133 133 ALA C C 13 176.628 0 0 1 . 2 . . A 547 ALA C . 28058 1 1273 . 1 . 1 133 133 ALA CA C 13 52.018 0.036 0 1 . 9 . . A 547 ALA CA . 28058 1 1274 . 1 . 1 133 133 ALA CB C 13 18.587 0.028 0 1 . 8 . . A 547 ALA CB . 28058 1 1275 . 1 . 1 133 133 ALA N N 15 122.874 0.086 0 1 . 13 . . A 547 ALA N . 28058 1 1276 . 1 . 1 134 134 TYR H H 1 7.324 0.009 0 1 . 22 . . A 548 TYR H . 28058 1 1277 . 1 . 1 134 134 TYR HA H 1 4.786 0.008 0 1 . 11 . . A 548 TYR HA . 28058 1 1278 . 1 . 1 134 134 TYR HB2 H 1 1.441 0.012 0 2 . 13 . . A 548 TYR HB2 . 28058 1 1279 . 1 . 1 134 134 TYR HB3 H 1 1.984 0.01 0 2 . 14 . . A 548 TYR HB3 . 28058 1 1280 . 1 . 1 134 134 TYR HD1 H 1 6.269 0.006 0 1 . 27 . . A 548 TYR HD1 . 28058 1 1281 . 1 . 1 134 134 TYR HD2 H 1 6.269 0.006 0 1 . 27 . . A 548 TYR HD2 . 28058 1 1282 . 1 . 1 134 134 TYR HE1 H 1 6.695 0.01 0 1 . 21 . . A 548 TYR HE1 . 28058 1 1283 . 1 . 1 134 134 TYR HE2 H 1 6.695 0.01 0 1 . 21 . . A 548 TYR HE2 . 28058 1 1284 . 1 . 1 134 134 TYR C C 13 173.875 0 0 1 . 2 . . A 548 TYR C . 28058 1 1285 . 1 . 1 134 134 TYR CA C 13 55.758 0.031 0 1 . 8 . . A 548 TYR CA . 28058 1 1286 . 1 . 1 134 134 TYR CB C 13 40.314 0.042 0 1 . 15 . . A 548 TYR CB . 28058 1 1287 . 1 . 1 134 134 TYR CD1 C 13 133.625 0.157 0 1 . 17 . . A 548 TYR CD1 . 28058 1 1288 . 1 . 1 134 134 TYR CD2 C 13 133.625 0.157 0 1 . 17 . . A 548 TYR CD2 . 28058 1 1289 . 1 . 1 134 134 TYR CE1 C 13 117.707 0.158 0 1 . 16 . . A 548 TYR CE1 . 28058 1 1290 . 1 . 1 134 134 TYR CE2 C 13 117.707 0.158 0 1 . 16 . . A 548 TYR CE2 . 28058 1 1291 . 1 . 1 134 134 TYR N N 15 117.874 0.037 0 1 . 15 . . A 548 TYR N . 28058 1 1292 . 1 . 1 135 135 LYS H H 1 8.657 0.005 0 1 . 18 . . A 549 LYS H . 28058 1 1293 . 1 . 1 135 135 LYS HA H 1 4.592 0.005 0 1 . 11 . . A 549 LYS HA . 28058 1 1294 . 1 . 1 135 135 LYS HB2 H 1 1.614 0.004 0 2 . 8 . . A 549 LYS HB2 . 28058 1 1295 . 1 . 1 135 135 LYS HB3 H 1 1.707 0.003 0 2 . 10 . . A 549 LYS HB3 . 28058 1 1296 . 1 . 1 135 135 LYS HG2 H 1 1.318 0.004 0 2 . 8 . . A 549 LYS HG2 . 28058 1 1297 . 1 . 1 135 135 LYS HG3 H 1 1.378 0.005 0 2 . 9 . . A 549 LYS HG3 . 28058 1 1298 . 1 . 1 135 135 LYS HD2 H 1 1.592 0.007 0 1 . 11 . . A 549 LYS HD2 . 28058 1 1299 . 1 . 1 135 135 LYS HD3 H 1 1.592 0.007 0 1 . 11 . . A 549 LYS HD3 . 28058 1 1300 . 1 . 1 135 135 LYS HE2 H 1 2.898 0.004 0 1 . 14 . . A 549 LYS HE2 . 28058 1 1301 . 1 . 1 135 135 LYS HE3 H 1 2.898 0.004 0 1 . 14 . . A 549 LYS HE3 . 28058 1 1302 . 1 . 1 135 135 LYS C C 13 176.503 0 0 1 . 2 . . A 549 LYS C . 28058 1 1303 . 1 . 1 135 135 LYS CA C 13 54.065 0.091 0 1 . 10 . . A 549 LYS CA . 28058 1 1304 . 1 . 1 135 135 LYS CB C 13 35.94 0.052 0 1 . 16 . . A 549 LYS CB . 28058 1 1305 . 1 . 1 135 135 LYS CG C 13 24.644 0.037 0 1 . 9 . . A 549 LYS CG . 28058 1 1306 . 1 . 1 135 135 LYS CD C 13 29.021 0.031 0 1 . 5 . . A 549 LYS CD . 28058 1 1307 . 1 . 1 135 135 LYS CE C 13 42.162 0.01 0 1 . 7 . . A 549 LYS CE . 28058 1 1308 . 1 . 1 135 135 LYS N N 15 117.998 0.038 0 1 . 12 . . A 549 LYS N . 28058 1 1309 . 1 . 1 136 136 ASP H H 1 8.987 0.006 0 1 . 11 . . A 550 ASP H . 28058 1 1310 . 1 . 1 136 136 ASP HA H 1 4.955 0.002 0 1 . 7 . . A 550 ASP HA . 28058 1 1311 . 1 . 1 136 136 ASP HB2 H 1 2.589 0.002 0 2 . 4 . . A 550 ASP HB2 . 28058 1 1312 . 1 . 1 136 136 ASP HB3 H 1 2.626 0.002 0 2 . 4 . . A 550 ASP HB3 . 28058 1 1313 . 1 . 1 136 136 ASP C C 13 175.612 0 0 1 . 2 . . A 550 ASP C . 28058 1 1314 . 1 . 1 136 136 ASP CA C 13 55.583 0.031 0 1 . 7 . . A 550 ASP CA . 28058 1 1315 . 1 . 1 136 136 ASP CB C 13 41.095 0.058 0 1 . 11 . . A 550 ASP CB . 28058 1 1316 . 1 . 1 136 136 ASP N N 15 125.868 0.099 0 1 . 9 . . A 550 ASP N . 28058 1 1317 . 1 . 1 137 137 VAL H H 1 8.27 0.003 0 1 . 15 . . A 551 VAL H . 28058 1 1318 . 1 . 1 137 137 VAL HA H 1 4.455 0.003 0 1 . 15 . . A 551 VAL HA . 28058 1 1319 . 1 . 1 137 137 VAL HB H 1 2.076 0.005 0 1 . 17 . . A 551 VAL HB . 28058 1 1320 . 1 . 1 137 137 VAL HG11 H 1 0.846 0.003 0 2 . 10 . . A 551 VAL MG1 . 28058 1 1321 . 1 . 1 137 137 VAL HG12 H 1 0.846 0.003 0 2 . 10 . . A 551 VAL MG1 . 28058 1 1322 . 1 . 1 137 137 VAL HG13 H 1 0.846 0.003 0 2 . 10 . . A 551 VAL MG1 . 28058 1 1323 . 1 . 1 137 137 VAL HG21 H 1 0.886 0.002 0 2 . 9 . . A 551 VAL MG2 . 28058 1 1324 . 1 . 1 137 137 VAL HG22 H 1 0.886 0.002 0 2 . 9 . . A 551 VAL MG2 . 28058 1 1325 . 1 . 1 137 137 VAL HG23 H 1 0.886 0.002 0 2 . 9 . . A 551 VAL MG2 . 28058 1 1326 . 1 . 1 137 137 VAL C C 13 175.177 0 0 1 . 2 . . A 551 VAL C . 28058 1 1327 . 1 . 1 137 137 VAL CA C 13 62.148 0.037 0 1 . 10 . . A 551 VAL CA . 28058 1 1328 . 1 . 1 137 137 VAL CB C 13 33.994 0.073 0 1 . 11 . . A 551 VAL CB . 28058 1 1329 . 1 . 1 137 137 VAL CG1 C 13 19.661 0.021 0 2 . 7 . . A 551 VAL CG1 . 28058 1 1330 . 1 . 1 137 137 VAL CG2 C 13 22.329 0.059 0 2 . 6 . . A 551 VAL CG2 . 28058 1 1331 . 1 . 1 137 137 VAL N N 15 118.151 0.04 0 1 . 11 . . A 551 VAL N . 28058 1 1332 . 1 . 1 138 138 ASN H H 1 8.449 0.008 0 1 . 15 . . A 552 ASN H . 28058 1 1333 . 1 . 1 138 138 ASN HA H 1 4.235 0.005 0 1 . 9 . . A 552 ASN HA . 28058 1 1334 . 1 . 1 138 138 ASN HB2 H 1 2.683 0.008 0 2 . 14 . . A 552 ASN HB2 . 28058 1 1335 . 1 . 1 138 138 ASN HB3 H 1 2.788 0.004 0 2 . 13 . . A 552 ASN HB3 . 28058 1 1336 . 1 . 1 138 138 ASN HD21 H 1 6.806 0.004 0 2 . 15 . . A 552 ASN HD21 . 28058 1 1337 . 1 . 1 138 138 ASN HD22 H 1 7.537 0.004 0 2 . 14 . . A 552 ASN HD22 . 28058 1 1338 . 1 . 1 138 138 ASN C C 13 174.09 0 0 1 . 2 . . A 552 ASN C . 28058 1 1339 . 1 . 1 138 138 ASN CA C 13 54.693 0.044 0 1 . 13 . . A 552 ASN CA . 28058 1 1340 . 1 . 1 138 138 ASN CB C 13 37.855 0.069 0 1 . 23 . . A 552 ASN CB . 28058 1 1341 . 1 . 1 138 138 ASN CG C 13 178.029 0.013 0 1 . 2 . . A 552 ASN CG . 28058 1 1342 . 1 . 1 138 138 ASN N N 15 120.667 0.061 0 1 . 12 . . A 552 ASN N . 28058 1 1343 . 1 . 1 138 138 ASN ND2 N 15 112.219 0.208 0 1 . 21 . . A 552 ASN ND2 . 28058 1 1344 . 1 . 1 139 139 LYS H H 1 8.536 0.005 0 1 . 17 . . A 553 LYS H . 28058 1 1345 . 1 . 1 139 139 LYS HA H 1 4.404 0.006 0 1 . 21 . . A 553 LYS HA . 28058 1 1346 . 1 . 1 139 139 LYS HB2 H 1 1.611 0.005 0 2 . 16 . . A 553 LYS HB2 . 28058 1 1347 . 1 . 1 139 139 LYS HB3 H 1 1.804 0.005 0 2 . 21 . . A 553 LYS HB3 . 28058 1 1348 . 1 . 1 139 139 LYS HG2 H 1 1.215 0.007 0 2 . 24 . . A 553 LYS HG2 . 28058 1 1349 . 1 . 1 139 139 LYS HG3 H 1 1.348 0.004 0 2 . 14 . . A 553 LYS HG3 . 28058 1 1350 . 1 . 1 139 139 LYS HD2 H 1 1.577 0.004 0 2 . 5 . . A 553 LYS HD2 . 28058 1 1351 . 1 . 1 139 139 LYS HD3 H 1 1.654 0.002 0 2 . 7 . . A 553 LYS HD3 . 28058 1 1352 . 1 . 1 139 139 LYS HE2 H 1 2.928 0.007 0 1 . 17 . . A 553 LYS HE2 . 28058 1 1353 . 1 . 1 139 139 LYS HE3 H 1 2.928 0.007 0 1 . 17 . . A 553 LYS HE3 . 28058 1 1354 . 1 . 1 139 139 LYS C C 13 175.27 0 0 1 . 1 . . A 553 LYS C . 28058 1 1355 . 1 . 1 139 139 LYS CA C 13 55.222 0.068 0 1 . 11 . . A 553 LYS CA . 28058 1 1356 . 1 . 1 139 139 LYS CB C 13 34.696 0.076 0 1 . 23 . . A 553 LYS CB . 28058 1 1357 . 1 . 1 139 139 LYS CG C 13 24.696 0.055 0 1 . 19 . . A 553 LYS CG . 28058 1 1358 . 1 . 1 139 139 LYS CD C 13 29.248 0.055 0 1 . 12 . . A 553 LYS CD . 28058 1 1359 . 1 . 1 139 139 LYS CE C 13 42.15 0.041 0 1 . 8 . . A 553 LYS CE . 28058 1 1360 . 1 . 1 139 139 LYS N N 15 119.861 0.06 0 1 . 11 . . A 553 LYS N . 28058 1 1361 . 1 . 1 140 140 ASN H H 1 9 0.006 0 1 . 6 . . A 554 ASN H . 28058 1 1362 . 1 . 1 140 140 ASN HA H 1 4.593 0.002 0 1 . 3 . . A 554 ASN HA . 28058 1 1363 . 1 . 1 140 140 ASN HB2 H 1 2.86 0.003 0 2 . 4 . . A 554 ASN HB2 . 28058 1 1364 . 1 . 1 140 140 ASN HB3 H 1 2.953 0.003 0 2 . 4 . . A 554 ASN HB3 . 28058 1 1365 . 1 . 1 140 140 ASN C C 13 176.447 0 0 1 . 1 . . A 554 ASN C . 28058 1 1366 . 1 . 1 140 140 ASN CA C 13 54.072 0.052 0 1 . 3 . . A 554 ASN CA . 28058 1 1367 . 1 . 1 140 140 ASN CB C 13 38.386 0.041 0 1 . 9 . . A 554 ASN CB . 28058 1 1368 . 1 . 1 140 140 ASN N N 15 127.07 0.156 0 1 . 4 . . A 554 ASN N . 28058 1 1369 . 1 . 1 141 141 LEU H H 1 8.418 0.005 0 1 . 12 . . A 555 LEU H . 28058 1 1370 . 1 . 1 141 141 LEU HA H 1 4.397 0.008 0 1 . 10 . . A 555 LEU HA . 28058 1 1371 . 1 . 1 141 141 LEU HB2 H 1 1.667 0.003 0 1 . 5 . . A 555 LEU HB2 . 28058 1 1372 . 1 . 1 141 141 LEU HB3 H 1 1.667 0.003 0 1 . 5 . . A 555 LEU HB3 . 28058 1 1373 . 1 . 1 141 141 LEU HG H 1 1.654 0.006 0 1 . 3 . . A 555 LEU HG . 28058 1 1374 . 1 . 1 141 141 LEU HD11 H 1 0.713 0.003 0 2 . 11 . . A 555 LEU MD1 . 28058 1 1375 . 1 . 1 141 141 LEU HD12 H 1 0.713 0.003 0 2 . 11 . . A 555 LEU MD1 . 28058 1 1376 . 1 . 1 141 141 LEU HD13 H 1 0.713 0.003 0 2 . 11 . . A 555 LEU MD1 . 28058 1 1377 . 1 . 1 141 141 LEU HD21 H 1 0.774 0.003 0 2 . 6 . . A 555 LEU MD2 . 28058 1 1378 . 1 . 1 141 141 LEU HD22 H 1 0.774 0.003 0 2 . 6 . . A 555 LEU MD2 . 28058 1 1379 . 1 . 1 141 141 LEU HD23 H 1 0.774 0.003 0 2 . 6 . . A 555 LEU MD2 . 28058 1 1380 . 1 . 1 141 141 LEU C C 13 178.223 0 0 1 . 1 . . A 555 LEU C . 28058 1 1381 . 1 . 1 141 141 LEU CA C 13 55.166 0.034 0 1 . 6 . . A 555 LEU CA . 28058 1 1382 . 1 . 1 141 141 LEU CB C 13 40.213 0.086 0 1 . 7 . . A 555 LEU CB . 28058 1 1383 . 1 . 1 141 141 LEU CG C 13 26.662 0.074 0 1 . 3 . . A 555 LEU CG . 28058 1 1384 . 1 . 1 141 141 LEU CD1 C 13 25.95 0.057 0 2 . 6 . . A 555 LEU CD1 . 28058 1 1385 . 1 . 1 141 141 LEU CD2 C 13 21.674 0.076 0 2 . 4 . . A 555 LEU CD2 . 28058 1 1386 . 1 . 1 141 141 LEU N N 15 126.614 0.044 0 1 . 8 . . A 555 LEU N . 28058 1 1387 . 1 . 1 142 142 GLY H H 1 8.601 0.01 0 1 . 6 . . A 556 GLY H . 28058 1 1388 . 1 . 1 142 142 GLY N N 15 107.886 0.093 0 1 . 5 . . A 556 GLY N . 28058 1 1389 . 1 . 1 143 143 ASN C C 13 174.875 0 0 1 . 1 . . A 557 ASN C . 28058 1 1390 . 1 . 1 143 143 ASN CB C 13 38.437 0 0 1 . 1 . . A 557 ASN CB . 28058 1 1391 . 1 . 1 144 144 GLY H H 1 8.673 0.002 0 1 . 7 . . A 558 GLY H . 28058 1 1392 . 1 . 1 144 144 GLY HA2 H 1 3.573 0.003 0 2 . 6 . . A 558 GLY HA2 . 28058 1 1393 . 1 . 1 144 144 GLY HA3 H 1 4.225 0.004 0 2 . 5 . . A 558 GLY HA3 . 28058 1 1394 . 1 . 1 144 144 GLY C C 13 174.127 0 0 1 . 2 . . A 558 GLY C . 28058 1 1395 . 1 . 1 144 144 GLY CA C 13 45.107 0.035 0 1 . 10 . . A 558 GLY CA . 28058 1 1396 . 1 . 1 144 144 GLY N N 15 106.563 0.173 0 1 . 5 . . A 558 GLY N . 28058 1 1397 . 1 . 1 145 145 ASN H H 1 7.716 0.003 0 1 . 11 . . A 559 ASN H . 28058 1 1398 . 1 . 1 145 145 ASN HA H 1 5.351 0.007 0 1 . 14 . . A 559 ASN HA . 28058 1 1399 . 1 . 1 145 145 ASN HB2 H 1 2.329 0.004 0 2 . 11 . . A 559 ASN HB2 . 28058 1 1400 . 1 . 1 145 145 ASN HB3 H 1 2.869 0.006 0 2 . 12 . . A 559 ASN HB3 . 28058 1 1401 . 1 . 1 145 145 ASN HD21 H 1 6.348 0.001 0 1 . 2 . . A 559 ASN HD21 . 28058 1 1402 . 1 . 1 145 145 ASN HD22 H 1 6.348 0.001 0 1 . 2 . . A 559 ASN HD22 . 28058 1 1403 . 1 . 1 145 145 ASN C C 13 174.23 0 0 1 . 2 . . A 559 ASN C . 28058 1 1404 . 1 . 1 145 145 ASN CA C 13 52.152 0.039 0 1 . 10 . . A 559 ASN CA . 28058 1 1405 . 1 . 1 145 145 ASN CB C 13 40.802 0.09 0 1 . 15 . . A 559 ASN CB . 28058 1 1406 . 1 . 1 145 145 ASN N N 15 117.483 0.062 0 1 . 10 . . A 559 ASN N . 28058 1 1407 . 1 . 1 145 145 ASN ND2 N 15 111.12 0 0 1 . 1 . . A 559 ASN ND2 . 28058 1 1408 . 1 . 1 146 146 THR H H 1 8.827 0.01 0 1 . 10 . . A 560 THR H . 28058 1 1409 . 1 . 1 146 146 THR HA H 1 4.921 0.006 0 1 . 9 . . A 560 THR HA . 28058 1 1410 . 1 . 1 146 146 THR HB H 1 3.889 0.006 0 1 . 8 . . A 560 THR HB . 28058 1 1411 . 1 . 1 146 146 THR HG21 H 1 0.859 0.003 0 1 . 7 . . A 560 THR MG . 28058 1 1412 . 1 . 1 146 146 THR HG22 H 1 0.859 0.003 0 1 . 7 . . A 560 THR MG . 28058 1 1413 . 1 . 1 146 146 THR HG23 H 1 0.859 0.003 0 1 . 7 . . A 560 THR MG . 28058 1 1414 . 1 . 1 146 146 THR C C 13 172.645 0 0 1 . 2 . . A 560 THR C . 28058 1 1415 . 1 . 1 146 146 THR CA C 13 61.716 0.026 0 1 . 9 . . A 560 THR CA . 28058 1 1416 . 1 . 1 146 146 THR CB C 13 72.717 0.035 0 1 . 7 . . A 560 THR CB . 28058 1 1417 . 1 . 1 146 146 THR CG2 C 13 20.25 0.008 0 1 . 3 . . A 560 THR CG2 . 28058 1 1418 . 1 . 1 146 146 THR N N 15 117.643 0.052 0 1 . 11 . . A 560 THR N . 28058 1 1419 . 1 . 1 147 147 LEU H H 1 9.172 0.006 0 1 . 17 . . A 561 LEU H . 28058 1 1420 . 1 . 1 147 147 LEU HA H 1 4.624 0.007 0 1 . 12 . . A 561 LEU HA . 28058 1 1421 . 1 . 1 147 147 LEU HB2 H 1 1.234 0.008 0 2 . 15 . . A 561 LEU HB2 . 28058 1 1422 . 1 . 1 147 147 LEU HB3 H 1 2.016 0.005 0 2 . 19 . . A 561 LEU HB3 . 28058 1 1423 . 1 . 1 147 147 LEU HG H 1 1.303 0.007 0 1 . 12 . . A 561 LEU HG . 28058 1 1424 . 1 . 1 147 147 LEU HD11 H 1 0.768 0.003 0 2 . 17 . . A 561 LEU MD1 . 28058 1 1425 . 1 . 1 147 147 LEU HD12 H 1 0.768 0.003 0 2 . 17 . . A 561 LEU MD1 . 28058 1 1426 . 1 . 1 147 147 LEU HD13 H 1 0.768 0.003 0 2 . 17 . . A 561 LEU MD1 . 28058 1 1427 . 1 . 1 147 147 LEU HD21 H 1 0.902 0.003 0 2 . 15 . . A 561 LEU MD2 . 28058 1 1428 . 1 . 1 147 147 LEU HD22 H 1 0.902 0.003 0 2 . 15 . . A 561 LEU MD2 . 28058 1 1429 . 1 . 1 147 147 LEU HD23 H 1 0.902 0.003 0 2 . 15 . . A 561 LEU MD2 . 28058 1 1430 . 1 . 1 147 147 LEU C C 13 173.351 0 0 1 . 2 . . A 561 LEU C . 28058 1 1431 . 1 . 1 147 147 LEU CA C 13 53.8 0.058 0 1 . 10 . . A 561 LEU CA . 28058 1 1432 . 1 . 1 147 147 LEU CB C 13 42.789 0.033 0 1 . 20 . . A 561 LEU CB . 28058 1 1433 . 1 . 1 147 147 LEU CG C 13 27.409 0.057 0 1 . 7 . . A 561 LEU CG . 28058 1 1434 . 1 . 1 147 147 LEU CD1 C 13 23.993 0.027 0 2 . 8 . . A 561 LEU CD1 . 28058 1 1435 . 1 . 1 147 147 LEU CD2 C 13 26.608 0.042 0 2 . 9 . . A 561 LEU CD2 . 28058 1 1436 . 1 . 1 147 147 LEU N N 15 128.771 0.052 0 1 . 13 . . A 561 LEU N . 28058 1 1437 . 1 . 1 148 148 ALA H H 1 8.701 0.003 0 1 . 16 . . A 562 ALA H . 28058 1 1438 . 1 . 1 148 148 ALA HA H 1 4.357 0.003 0 1 . 7 . . A 562 ALA HA . 28058 1 1439 . 1 . 1 148 148 ALA HB1 H 1 1.492 0.004 0 1 . 12 . . A 562 ALA MB . 28058 1 1440 . 1 . 1 148 148 ALA HB2 H 1 1.492 0.004 0 1 . 12 . . A 562 ALA MB . 28058 1 1441 . 1 . 1 148 148 ALA HB3 H 1 1.492 0.004 0 1 . 12 . . A 562 ALA MB . 28058 1 1442 . 1 . 1 148 148 ALA C C 13 177.86 0 0 1 . 2 . . A 562 ALA C . 28058 1 1443 . 1 . 1 148 148 ALA CA C 13 55.511 0.06 0 1 . 7 . . A 562 ALA CA . 28058 1 1444 . 1 . 1 148 148 ALA CB C 13 19.629 0.084 0 1 . 9 . . A 562 ALA CB . 28058 1 1445 . 1 . 1 148 148 ALA N N 15 132.023 0.039 0 1 . 14 . . A 562 ALA N . 28058 1 1446 . 1 . 1 149 149 GLN H H 1 7.128 0.005 0 1 . 17 . . A 563 GLN H . 28058 1 1447 . 1 . 1 149 149 GLN HA H 1 5.263 0.005 0 1 . 12 . . A 563 GLN HA . 28058 1 1448 . 1 . 1 149 149 GLN HB2 H 1 1.416 0.005 0 2 . 9 . . A 563 GLN HB2 . 28058 1 1449 . 1 . 1 149 149 GLN HB3 H 1 2.013 0.005 0 2 . 5 . . A 563 GLN HB3 . 28058 1 1450 . 1 . 1 149 149 GLN HG2 H 1 1.951 0.006 0 2 . 9 . . A 563 GLN HG2 . 28058 1 1451 . 1 . 1 149 149 GLN HG3 H 1 2.131 0.005 0 2 . 11 . . A 563 GLN HG3 . 28058 1 1452 . 1 . 1 149 149 GLN C C 13 174.816 0 0 1 . 2 . . A 563 GLN C . 28058 1 1453 . 1 . 1 149 149 GLN CA C 13 54.965 0.073 0 1 . 8 . . A 563 GLN CA . 28058 1 1454 . 1 . 1 149 149 GLN CB C 13 32.267 0.042 0 1 . 12 . . A 563 GLN CB . 28058 1 1455 . 1 . 1 149 149 GLN CG C 13 34.387 0.051 0 1 . 14 . . A 563 GLN CG . 28058 1 1456 . 1 . 1 149 149 GLN N N 15 116.062 0.046 0 1 . 12 . . A 563 GLN N . 28058 1 1457 . 1 . 1 150 150 GLN H H 1 9.376 0.004 0 1 . 12 . . A 564 GLN H . 28058 1 1458 . 1 . 1 150 150 GLN HA H 1 5.242 0.009 0 1 . 11 . . A 564 GLN HA . 28058 1 1459 . 1 . 1 150 150 GLN HB2 H 1 2.009 0.004 0 1 . 14 . . A 564 GLN HB2 . 28058 1 1460 . 1 . 1 150 150 GLN HB3 H 1 2.009 0.004 0 1 . 14 . . A 564 GLN HB3 . 28058 1 1461 . 1 . 1 150 150 GLN HG2 H 1 2.313 0.005 0 2 . 8 . . A 564 GLN HG2 . 28058 1 1462 . 1 . 1 150 150 GLN HG3 H 1 2.579 0.005 0 2 . 13 . . A 564 GLN HG3 . 28058 1 1463 . 1 . 1 150 150 GLN HE21 H 1 6.832 0 0 2 . 1 . . A 564 GLN HE21 . 28058 1 1464 . 1 . 1 150 150 GLN HE22 H 1 7.637 0.008 0 2 . 9 . . A 564 GLN HE22 . 28058 1 1465 . 1 . 1 150 150 GLN C C 13 173.931 0 0 1 . 2 . . A 564 GLN C . 28058 1 1466 . 1 . 1 150 150 GLN CA C 13 55.417 0.045 0 1 . 10 . . A 564 GLN CA . 28058 1 1467 . 1 . 1 150 150 GLN CB C 13 34.25 0.044 0 1 . 11 . . A 564 GLN CB . 28058 1 1468 . 1 . 1 150 150 GLN CG C 13 34.733 0.083 0 1 . 12 . . A 564 GLN CG . 28058 1 1469 . 1 . 1 150 150 GLN CD C 13 179.118 0 0 1 . 1 . . A 564 GLN CD . 28058 1 1470 . 1 . 1 150 150 GLN N N 15 121.5 0.047 0 1 . 9 . . A 564 GLN N . 28058 1 1471 . 1 . 1 150 150 GLN NE2 N 15 110.722 0.176 0 1 . 7 . . A 564 GLN NE2 . 28058 1 1472 . 1 . 1 151 151 GLY H H 1 9.36 0.005 0 1 . 12 . . A 565 GLY H . 28058 1 1473 . 1 . 1 151 151 GLY HA2 H 1 4.225 0.005 0 2 . 7 . . A 565 GLY HA2 . 28058 1 1474 . 1 . 1 151 151 GLY HA3 H 1 4.536 0.002 0 2 . 8 . . A 565 GLY HA3 . 28058 1 1475 . 1 . 1 151 151 GLY C C 13 173.636 0 0 1 . 2 . . A 565 GLY C . 28058 1 1476 . 1 . 1 151 151 GLY CA C 13 45.191 0.025 0 1 . 11 . . A 565 GLY CA . 28058 1 1477 . 1 . 1 151 151 GLY N N 15 119.903 0.033 0 1 . 11 . . A 565 GLY N . 28058 1 1478 . 1 . 1 152 152 SER H H 1 9.105 0.006 0 1 . 11 . . A 566 SER H . 28058 1 1479 . 1 . 1 152 152 SER HA H 1 5.688 0.003 0 1 . 12 . . A 566 SER HA . 28058 1 1480 . 1 . 1 152 152 SER HB2 H 1 3.751 0.002 0 2 . 4 . . A 566 SER HB2 . 28058 1 1481 . 1 . 1 152 152 SER HB3 H 1 3.779 0.002 0 2 . 4 . . A 566 SER HB3 . 28058 1 1482 . 1 . 1 152 152 SER C C 13 171.543 0 0 1 . 2 . . A 566 SER C . 28058 1 1483 . 1 . 1 152 152 SER CA C 13 57.866 0.024 0 1 . 9 . . A 566 SER CA . 28058 1 1484 . 1 . 1 152 152 SER CB C 13 66.681 0.029 0 1 . 14 . . A 566 SER CB . 28058 1 1485 . 1 . 1 152 152 SER N N 15 120.068 0.058 0 1 . 9 . . A 566 SER N . 28058 1 1486 . 1 . 1 153 153 TYR H H 1 8.981 0.009 0 1 . 11 . . A 567 TYR H . 28058 1 1487 . 1 . 1 153 153 TYR HA H 1 5.247 0.007 0 1 . 11 . . A 567 TYR HA . 28058 1 1488 . 1 . 1 153 153 TYR HB2 H 1 2.989 0.008 0 2 . 9 . . A 567 TYR HB2 . 28058 1 1489 . 1 . 1 153 153 TYR HB3 H 1 3.725 0.007 0 2 . 11 . . A 567 TYR HB3 . 28058 1 1490 . 1 . 1 153 153 TYR HD1 H 1 6.73 0.008 0 1 . 18 . . A 567 TYR HD1 . 28058 1 1491 . 1 . 1 153 153 TYR HD2 H 1 6.73 0.008 0 1 . 18 . . A 567 TYR HD2 . 28058 1 1492 . 1 . 1 153 153 TYR HE1 H 1 6.592 0.008 0 1 . 6 . . A 567 TYR HE1 . 28058 1 1493 . 1 . 1 153 153 TYR HE2 H 1 6.592 0.008 0 1 . 6 . . A 567 TYR HE2 . 28058 1 1494 . 1 . 1 153 153 TYR C C 13 172.87 0 0 1 . 2 . . A 567 TYR C . 28058 1 1495 . 1 . 1 153 153 TYR CA C 13 56.256 0.037 0 1 . 8 . . A 567 TYR CA . 28058 1 1496 . 1 . 1 153 153 TYR CB C 13 41.446 0.025 0 1 . 13 . . A 567 TYR CB . 28058 1 1497 . 1 . 1 153 153 TYR CD1 C 13 133.515 0.127 0 1 . 11 . . A 567 TYR CD1 . 28058 1 1498 . 1 . 1 153 153 TYR CD2 C 13 133.515 0.127 0 1 . 11 . . A 567 TYR CD2 . 28058 1 1499 . 1 . 1 153 153 TYR CE1 C 13 117.826 0.058 0 1 . 4 . . A 567 TYR CE1 . 28058 1 1500 . 1 . 1 153 153 TYR CE2 C 13 117.826 0.058 0 1 . 4 . . A 567 TYR CE2 . 28058 1 1501 . 1 . 1 153 153 TYR N N 15 118.592 0.038 0 1 . 11 . . A 567 TYR N . 28058 1 1502 . 1 . 1 154 154 THR H H 1 8.927 0.008 0 1 . 22 . . A 568 THR H . 28058 1 1503 . 1 . 1 154 154 THR HA H 1 4.861 0.011 0 1 . 14 . . A 568 THR HA . 28058 1 1504 . 1 . 1 154 154 THR HB H 1 4.049 0.004 0 1 . 13 . . A 568 THR HB . 28058 1 1505 . 1 . 1 154 154 THR HG21 H 1 1.228 0.007 0 1 . 13 . . A 568 THR MG . 28058 1 1506 . 1 . 1 154 154 THR HG22 H 1 1.228 0.007 0 1 . 13 . . A 568 THR MG . 28058 1 1507 . 1 . 1 154 154 THR HG23 H 1 1.228 0.007 0 1 . 13 . . A 568 THR MG . 28058 1 1508 . 1 . 1 154 154 THR C C 13 174.999 0 0 1 . 2 . . A 568 THR C . 28058 1 1509 . 1 . 1 154 154 THR CA C 13 62.093 0.051 0 1 . 10 . . A 568 THR CA . 28058 1 1510 . 1 . 1 154 154 THR CB C 13 70.638 0.045 0 1 . 10 . . A 568 THR CB . 28058 1 1511 . 1 . 1 154 154 THR CG2 C 13 21.384 0.032 0 1 . 6 . . A 568 THR CG2 . 28058 1 1512 . 1 . 1 154 154 THR N N 15 115.982 0.04 0 1 . 17 . . A 568 THR N . 28058 1 1513 . 1 . 1 155 155 LYS H H 1 9.11 0.003 0 1 . 21 . . A 569 LYS H . 28058 1 1514 . 1 . 1 155 155 LYS HA H 1 5.223 0.007 0 1 . 16 . . A 569 LYS HA . 28058 1 1515 . 1 . 1 155 155 LYS HB2 H 1 1.915 0.009 0 2 . 13 . . A 569 LYS HB2 . 28058 1 1516 . 1 . 1 155 155 LYS HB3 H 1 2.302 0.005 0 2 . 14 . . A 569 LYS HB3 . 28058 1 1517 . 1 . 1 155 155 LYS HG2 H 1 1.411 0.004 0 2 . 9 . . A 569 LYS HG2 . 28058 1 1518 . 1 . 1 155 155 LYS HG3 H 1 1.459 0.008 0 2 . 12 . . A 569 LYS HG3 . 28058 1 1519 . 1 . 1 155 155 LYS HD2 H 1 1.675 0.008 0 1 . 9 . . A 569 LYS HD2 . 28058 1 1520 . 1 . 1 155 155 LYS HD3 H 1 1.675 0.008 0 1 . 9 . . A 569 LYS HD3 . 28058 1 1521 . 1 . 1 155 155 LYS HE2 H 1 2.928 0.004 0 1 . 6 . . A 569 LYS HE2 . 28058 1 1522 . 1 . 1 155 155 LYS HE3 H 1 2.928 0.004 0 1 . 6 . . A 569 LYS HE3 . 28058 1 1523 . 1 . 1 155 155 LYS C C 13 178.804 0 0 1 . 2 . . A 569 LYS C . 28058 1 1524 . 1 . 1 155 155 LYS CA C 13 56.359 0.062 0 1 . 9 . . A 569 LYS CA . 28058 1 1525 . 1 . 1 155 155 LYS CB C 13 34.088 0.044 0 1 . 14 . . A 569 LYS CB . 28058 1 1526 . 1 . 1 155 155 LYS CG C 13 26.765 0.093 0 1 . 16 . . A 569 LYS CG . 28058 1 1527 . 1 . 1 155 155 LYS CD C 13 28.889 0.072 0 1 . 5 . . A 569 LYS CD . 28058 1 1528 . 1 . 1 155 155 LYS CE C 13 41.908 0.041 0 1 . 4 . . A 569 LYS CE . 28058 1 1529 . 1 . 1 155 155 LYS N N 15 127.021 0.037 0 1 . 16 . . A 569 LYS N . 28058 1 1530 . 1 . 1 156 156 THR H H 1 8.915 0.002 0 1 . 18 . . A 570 THR H . 28058 1 1531 . 1 . 1 156 156 THR HA H 1 3.964 0.004 0 1 . 12 . . A 570 THR HA . 28058 1 1532 . 1 . 1 156 156 THR HB H 1 4.33 0.003 0 1 . 14 . . A 570 THR HB . 28058 1 1533 . 1 . 1 156 156 THR HG21 H 1 1.193 0.002 0 1 . 10 . . A 570 THR MG . 28058 1 1534 . 1 . 1 156 156 THR HG22 H 1 1.193 0.002 0 1 . 10 . . A 570 THR MG . 28058 1 1535 . 1 . 1 156 156 THR HG23 H 1 1.193 0.002 0 1 . 10 . . A 570 THR MG . 28058 1 1536 . 1 . 1 156 156 THR C C 13 175.142 0 0 1 . 2 . . A 570 THR C . 28058 1 1537 . 1 . 1 156 156 THR CA C 13 64.586 0.038 0 1 . 9 . . A 570 THR CA . 28058 1 1538 . 1 . 1 156 156 THR CB C 13 68.599 0.062 0 1 . 11 . . A 570 THR CB . 28058 1 1539 . 1 . 1 156 156 THR CG2 C 13 22.565 0.069 0 1 . 4 . . A 570 THR CG2 . 28058 1 1540 . 1 . 1 156 156 THR N N 15 113.514 0.05 0 1 . 16 . . A 570 THR N . 28058 1 1541 . 1 . 1 157 157 ASN H H 1 7.578 0.003 0 1 . 7 . . A 571 ASN H . 28058 1 1542 . 1 . 1 157 157 ASN HA H 1 4.678 0.002 0 1 . 7 . . A 571 ASN HA . 28058 1 1543 . 1 . 1 157 157 ASN HB2 H 1 2.86 0.006 0 2 . 10 . . A 571 ASN HB2 . 28058 1 1544 . 1 . 1 157 157 ASN HB3 H 1 3.334 0.006 0 2 . 8 . . A 571 ASN HB3 . 28058 1 1545 . 1 . 1 157 157 ASN HD21 H 1 6.934 0.003 0 2 . 10 . . A 571 ASN HD21 . 28058 1 1546 . 1 . 1 157 157 ASN HD22 H 1 7.686 0.006 0 2 . 6 . . A 571 ASN HD22 . 28058 1 1547 . 1 . 1 157 157 ASN C C 13 176.369 0 0 1 . 2 . . A 571 ASN C . 28058 1 1548 . 1 . 1 157 157 ASN CA C 13 52.253 0.06 0 1 . 7 . . A 571 ASN CA . 28058 1 1549 . 1 . 1 157 157 ASN CB C 13 37.126 0.022 0 1 . 14 . . A 571 ASN CB . 28058 1 1550 . 1 . 1 157 157 ASN CG C 13 177.434 0.03 0 1 . 2 . . A 571 ASN CG . 28058 1 1551 . 1 . 1 157 157 ASN N N 15 116.654 0.028 0 1 . 8 . . A 571 ASN N . 28058 1 1552 . 1 . 1 157 157 ASN ND2 N 15 110.363 0.265 0 1 . 9 . . A 571 ASN ND2 . 28058 1 1553 . 1 . 1 158 158 GLY H H 1 8.217 0.003 0 1 . 12 . . A 572 GLY H . 28058 1 1554 . 1 . 1 158 158 GLY HA2 H 1 3.631 0.005 0 2 . 13 . . A 572 GLY HA2 . 28058 1 1555 . 1 . 1 158 158 GLY HA3 H 1 4.261 0.003 0 2 . 7 . . A 572 GLY HA3 . 28058 1 1556 . 1 . 1 158 158 GLY C C 13 174.696 0 0 1 . 2 . . A 572 GLY C . 28058 1 1557 . 1 . 1 158 158 GLY CA C 13 45.322 0.041 0 1 . 14 . . A 572 GLY CA . 28058 1 1558 . 1 . 1 158 158 GLY N N 15 107.959 0.043 0 1 . 11 . . A 572 GLY N . 28058 1 1559 . 1 . 1 159 159 THR H H 1 7.556 0.003 0 1 . 16 . . A 573 THR H . 28058 1 1560 . 1 . 1 159 159 THR HA H 1 4.462 0.002 0 1 . 12 . . A 573 THR HA . 28058 1 1561 . 1 . 1 159 159 THR HB H 1 4.261 0.004 0 1 . 17 . . A 573 THR HB . 28058 1 1562 . 1 . 1 159 159 THR HG21 H 1 1.139 0.002 0 1 . 9 . . A 573 THR MG . 28058 1 1563 . 1 . 1 159 159 THR HG22 H 1 1.139 0.002 0 1 . 9 . . A 573 THR MG . 28058 1 1564 . 1 . 1 159 159 THR HG23 H 1 1.139 0.002 0 1 . 9 . . A 573 THR MG . 28058 1 1565 . 1 . 1 159 159 THR C C 13 172.953 0 0 1 . 2 . . A 573 THR C . 28058 1 1566 . 1 . 1 159 159 THR CA C 13 61.902 0.033 0 1 . 10 . . A 573 THR CA . 28058 1 1567 . 1 . 1 159 159 THR CB C 13 70.982 0.107 0 1 . 12 . . A 573 THR CB . 28058 1 1568 . 1 . 1 159 159 THR CG2 C 13 21.493 0.021 0 1 . 5 . . A 573 THR CG2 . 28058 1 1569 . 1 . 1 159 159 THR N N 15 112.435 0.047 0 1 . 11 . . A 573 THR N . 28058 1 1570 . 1 . 1 160 160 THR H H 1 8.135 0.004 0 1 . 16 . . A 574 THR H . 28058 1 1571 . 1 . 1 160 160 THR HA H 1 5.227 0.006 0 1 . 12 . . A 574 THR HA . 28058 1 1572 . 1 . 1 160 160 THR HB H 1 4.049 0.007 0 1 . 12 . . A 574 THR HB . 28058 1 1573 . 1 . 1 160 160 THR HG21 H 1 1.14 0.003 0 1 . 9 . . A 574 THR MG . 28058 1 1574 . 1 . 1 160 160 THR HG22 H 1 1.14 0.003 0 1 . 9 . . A 574 THR MG . 28058 1 1575 . 1 . 1 160 160 THR HG23 H 1 1.14 0.003 0 1 . 9 . . A 574 THR MG . 28058 1 1576 . 1 . 1 160 160 THR C C 13 173.903 0 0 1 . 2 . . A 574 THR C . 28058 1 1577 . 1 . 1 160 160 THR CA C 13 59.815 0.022 0 1 . 8 . . A 574 THR CA . 28058 1 1578 . 1 . 1 160 160 THR CB C 13 72.028 0.116 0 1 . 9 . . A 574 THR CB . 28058 1 1579 . 1 . 1 160 160 THR CG2 C 13 21.484 0.055 0 1 . 6 . . A 574 THR CG2 . 28058 1 1580 . 1 . 1 160 160 THR N N 15 111.655 0.046 0 1 . 13 . . A 574 THR N . 28058 1 1581 . 1 . 1 161 161 ALA H H 1 8.318 0.003 0 1 . 13 . . A 575 ALA H . 28058 1 1582 . 1 . 1 161 161 ALA HA H 1 4.48 0.003 0 1 . 7 . . A 575 ALA HA . 28058 1 1583 . 1 . 1 161 161 ALA HB1 H 1 0.938 0.004 0 1 . 10 . . A 575 ALA MB . 28058 1 1584 . 1 . 1 161 161 ALA HB2 H 1 0.938 0.004 0 1 . 10 . . A 575 ALA MB . 28058 1 1585 . 1 . 1 161 161 ALA HB3 H 1 0.938 0.004 0 1 . 10 . . A 575 ALA MB . 28058 1 1586 . 1 . 1 161 161 ALA C C 13 175.172 0 0 1 . 2 . . A 575 ALA C . 28058 1 1587 . 1 . 1 161 161 ALA CA C 13 50.591 0.021 0 1 . 6 . . A 575 ALA CA . 28058 1 1588 . 1 . 1 161 161 ALA CB C 13 22.468 0.025 0 1 . 8 . . A 575 ALA CB . 28058 1 1589 . 1 . 1 161 161 ALA N N 15 125.023 0.042 0 1 . 13 . . A 575 ALA N . 28058 1 1590 . 1 . 1 162 162 LYS H H 1 8.807 0.003 0 1 . 18 . . A 576 LYS H . 28058 1 1591 . 1 . 1 162 162 LYS HA H 1 4.632 0.005 0 1 . 14 . . A 576 LYS HA . 28058 1 1592 . 1 . 1 162 162 LYS HB2 H 1 1.735 0.009 0 2 . 13 . . A 576 LYS HB2 . 28058 1 1593 . 1 . 1 162 162 LYS HB3 H 1 1.878 0.003 0 2 . 13 . . A 576 LYS HB3 . 28058 1 1594 . 1 . 1 162 162 LYS HG2 H 1 1.557 0.002 0 2 . 9 . . A 576 LYS HG2 . 28058 1 1595 . 1 . 1 162 162 LYS HG3 H 1 1.644 0.005 0 2 . 5 . . A 576 LYS HG3 . 28058 1 1596 . 1 . 1 162 162 LYS HD2 H 1 1.561 0.004 0 2 . 4 . . A 576 LYS HD2 . 28058 1 1597 . 1 . 1 162 162 LYS HD3 H 1 1.715 0.003 0 2 . 8 . . A 576 LYS HD3 . 28058 1 1598 . 1 . 1 162 162 LYS HE2 H 1 2.94 0.005 0 1 . 8 . . A 576 LYS HE2 . 28058 1 1599 . 1 . 1 162 162 LYS HE3 H 1 2.94 0.005 0 1 . 8 . . A 576 LYS HE3 . 28058 1 1600 . 1 . 1 162 162 LYS C C 13 175.415 0 0 1 . 2 . . A 576 LYS C . 28058 1 1601 . 1 . 1 162 162 LYS CA C 13 57.328 0.045 0 1 . 11 . . A 576 LYS CA . 28058 1 1602 . 1 . 1 162 162 LYS CB C 13 34.578 0.05 0 1 . 17 . . A 576 LYS CB . 28058 1 1603 . 1 . 1 162 162 LYS CG C 13 25.826 0.141 0 1 . 9 . . A 576 LYS CG . 28058 1 1604 . 1 . 1 162 162 LYS CD C 13 29.238 0.022 0 1 . 10 . . A 576 LYS CD . 28058 1 1605 . 1 . 1 162 162 LYS CE C 13 42.064 0.053 0 1 . 3 . . A 576 LYS CE . 28058 1 1606 . 1 . 1 162 162 LYS N N 15 117.156 0.061 0 1 . 12 . . A 576 LYS N . 28058 1 1607 . 1 . 1 163 163 MET H H 1 7.791 0.003 0 1 . 16 . . A 577 MET H . 28058 1 1608 . 1 . 1 163 163 MET HA H 1 5.23 0.005 0 1 . 15 . . A 577 MET HA . 28058 1 1609 . 1 . 1 163 163 MET HB2 H 1 2.177 0.004 0 2 . 11 . . A 577 MET HB2 . 28058 1 1610 . 1 . 1 163 163 MET HB3 H 1 2.32 0.003 0 2 . 8 . . A 577 MET HB3 . 28058 1 1611 . 1 . 1 163 163 MET HG2 H 1 2.322 0.006 0 2 . 13 . . A 577 MET HG2 . 28058 1 1612 . 1 . 1 163 163 MET HG3 H 1 2.4 0.005 0 2 . 13 . . A 577 MET HG3 . 28058 1 1613 . 1 . 1 163 163 MET HE1 H 1 1.815 0.002 0 1 . 6 . . A 577 MET ME . 28058 1 1614 . 1 . 1 163 163 MET HE2 H 1 1.815 0.002 0 1 . 6 . . A 577 MET ME . 28058 1 1615 . 1 . 1 163 163 MET HE3 H 1 1.815 0.002 0 1 . 6 . . A 577 MET ME . 28058 1 1616 . 1 . 1 163 163 MET C C 13 173.745 0 0 1 . 2 . . A 577 MET C . 28058 1 1617 . 1 . 1 163 163 MET CA C 13 54.422 0.112 0 1 . 12 . . A 577 MET CA . 28058 1 1618 . 1 . 1 163 163 MET CB C 13 37.695 0.061 0 1 . 12 . . A 577 MET CB . 28058 1 1619 . 1 . 1 163 163 MET CG C 13 30.553 0.08 0 1 . 16 . . A 577 MET CG . 28058 1 1620 . 1 . 1 163 163 MET CE C 13 16.875 0.007 0 1 . 5 . . A 577 MET CE . 28058 1 1621 . 1 . 1 163 163 MET N N 15 115.466 0.054 0 1 . 10 . . A 577 MET N . 28058 1 1622 . 1 . 1 164 164 GLY H H 1 8.921 0.015 0 1 . 9 . . A 578 GLY H . 28058 1 1623 . 1 . 1 164 164 GLY HA2 H 1 4.465 0.003 0 2 . 6 . . A 578 GLY HA2 . 28058 1 1624 . 1 . 1 164 164 GLY HA3 H 1 4.584 0.003 0 2 . 6 . . A 578 GLY HA3 . 28058 1 1625 . 1 . 1 164 164 GLY C C 13 170.264 0 0 1 . 2 . . A 578 GLY C . 28058 1 1626 . 1 . 1 164 164 GLY CA C 13 47.427 0.033 0 1 . 11 . . A 578 GLY CA . 28058 1 1627 . 1 . 1 164 164 GLY N N 15 107.474 0.033 0 1 . 8 . . A 578 GLY N . 28058 1 1628 . 1 . 1 165 165 ASP H H 1 8.861 0.006 0 1 . 12 . . A 579 ASP H . 28058 1 1629 . 1 . 1 165 165 ASP HA H 1 4.951 0.009 0 1 . 7 . . A 579 ASP HA . 28058 1 1630 . 1 . 1 165 165 ASP HB2 H 1 2.305 0.005 0 2 . 9 . . A 579 ASP HB2 . 28058 1 1631 . 1 . 1 165 165 ASP HB3 H 1 3.124 0.005 0 2 . 5 . . A 579 ASP HB3 . 28058 1 1632 . 1 . 1 165 165 ASP C C 13 175.609 0 0 1 . 2 . . A 579 ASP C . 28058 1 1633 . 1 . 1 165 165 ASP CA C 13 53.571 0.102 0 1 . 6 . . A 579 ASP CA . 28058 1 1634 . 1 . 1 165 165 ASP CB C 13 42.869 0.061 0 1 . 11 . . A 579 ASP CB . 28058 1 1635 . 1 . 1 165 165 ASP N N 15 119.526 0.061 0 1 . 10 . . A 579 ASP N . 28058 1 1636 . 1 . 1 166 166 LEU H H 1 8.245 0.008 0 1 . 14 . . A 580 LEU H . 28058 1 1637 . 1 . 1 166 166 LEU HA H 1 4.914 0.007 0 1 . 16 . . A 580 LEU HA . 28058 1 1638 . 1 . 1 166 166 LEU HB2 H 1 1.02 0.021 0 2 . 14 . . A 580 LEU HB2 . 28058 1 1639 . 1 . 1 166 166 LEU HB3 H 1 1.604 0.005 0 2 . 14 . . A 580 LEU HB3 . 28058 1 1640 . 1 . 1 166 166 LEU HG H 1 1.656 0.006 0 1 . 13 . . A 580 LEU HG . 28058 1 1641 . 1 . 1 166 166 LEU HD11 H 1 0.512 0.005 0 2 . 23 . . A 580 LEU MD1 . 28058 1 1642 . 1 . 1 166 166 LEU HD12 H 1 0.512 0.005 0 2 . 23 . . A 580 LEU MD1 . 28058 1 1643 . 1 . 1 166 166 LEU HD13 H 1 0.512 0.005 0 2 . 23 . . A 580 LEU MD1 . 28058 1 1644 . 1 . 1 166 166 LEU HD21 H 1 0.626 0.005 0 2 . 17 . . A 580 LEU MD2 . 28058 1 1645 . 1 . 1 166 166 LEU HD22 H 1 0.626 0.005 0 2 . 17 . . A 580 LEU MD2 . 28058 1 1646 . 1 . 1 166 166 LEU HD23 H 1 0.626 0.005 0 2 . 17 . . A 580 LEU MD2 . 28058 1 1647 . 1 . 1 166 166 LEU C C 13 175.889 0 0 1 . 2 . . A 580 LEU C . 28058 1 1648 . 1 . 1 166 166 LEU CA C 13 52.87 0.096 0 1 . 12 . . A 580 LEU CA . 28058 1 1649 . 1 . 1 166 166 LEU CB C 13 44.627 0.075 0 1 . 20 . . A 580 LEU CB . 28058 1 1650 . 1 . 1 166 166 LEU CG C 13 26.511 0.094 0 1 . 9 . . A 580 LEU CG . 28058 1 1651 . 1 . 1 166 166 LEU CD1 C 13 27.917 0.067 0 2 . 11 . . A 580 LEU CD1 . 28058 1 1652 . 1 . 1 166 166 LEU CD2 C 13 24.394 0.065 0 2 . 7 . . A 580 LEU CD2 . 28058 1 1653 . 1 . 1 166 166 LEU N N 15 125.622 0.057 0 1 . 10 . . A 580 LEU N . 28058 1 1654 . 1 . 1 167 167 LEU H H 1 9.252 0.005 0 1 . 15 . . A 581 LEU H . 28058 1 1655 . 1 . 1 167 167 LEU HA H 1 4.662 0.006 0 1 . 8 . . A 581 LEU HA . 28058 1 1656 . 1 . 1 167 167 LEU HB2 H 1 1.516 0.004 0 2 . 9 . . A 581 LEU HB2 . 28058 1 1657 . 1 . 1 167 167 LEU HB3 H 1 1.689 0.004 0 2 . 11 . . A 581 LEU HB3 . 28058 1 1658 . 1 . 1 167 167 LEU HG H 1 1.515 0.003 0 1 . 4 . . A 581 LEU HG . 28058 1 1659 . 1 . 1 167 167 LEU HD11 H 1 0.824 0.002 0 2 . 3 . . A 581 LEU MD1 . 28058 1 1660 . 1 . 1 167 167 LEU HD12 H 1 0.824 0.002 0 2 . 3 . . A 581 LEU MD1 . 28058 1 1661 . 1 . 1 167 167 LEU HD13 H 1 0.824 0.002 0 2 . 3 . . A 581 LEU MD1 . 28058 1 1662 . 1 . 1 167 167 LEU HD21 H 1 0.882 0.002 0 2 . 4 . . A 581 LEU MD2 . 28058 1 1663 . 1 . 1 167 167 LEU HD22 H 1 0.882 0.002 0 2 . 4 . . A 581 LEU MD2 . 28058 1 1664 . 1 . 1 167 167 LEU HD23 H 1 0.882 0.002 0 2 . 4 . . A 581 LEU MD2 . 28058 1 1665 . 1 . 1 167 167 LEU C C 13 176.74 0 0 1 . 2 . . A 581 LEU C . 28058 1 1666 . 1 . 1 167 167 LEU CA C 13 53.799 0.045 0 1 . 6 . . A 581 LEU CA . 28058 1 1667 . 1 . 1 167 167 LEU CB C 13 40.736 0.033 0 1 . 14 . . A 581 LEU CB . 28058 1 1668 . 1 . 1 167 167 LEU CG C 13 26.96 0.012 0 1 . 4 . . A 581 LEU CG . 28058 1 1669 . 1 . 1 167 167 LEU CD1 C 13 22.907 0.026 0 2 . 3 . . A 581 LEU CD1 . 28058 1 1670 . 1 . 1 167 167 LEU CD2 C 13 24.94 0.016 0 2 . 4 . . A 581 LEU CD2 . 28058 1 1671 . 1 . 1 167 167 LEU N N 15 122.646 0.027 0 1 . 10 . . A 581 LEU N . 28058 1 1672 . 1 . 1 168 168 LEU H H 1 8.503 0.012 0 1 . 15 . . A 582 LEU H . 28058 1 1673 . 1 . 1 168 168 LEU HA H 1 4.844 0.004 0 1 . 10 . . A 582 LEU HA . 28058 1 1674 . 1 . 1 168 168 LEU HB2 H 1 1.282 0.007 0 2 . 9 . . A 582 LEU HB2 . 28058 1 1675 . 1 . 1 168 168 LEU HB3 H 1 1.597 0.005 0 2 . 6 . . A 582 LEU HB3 . 28058 1 1676 . 1 . 1 168 168 LEU HG H 1 1.439 0.002 0 1 . 3 . . A 582 LEU HG . 28058 1 1677 . 1 . 1 168 168 LEU HD11 H 1 0.48 0.005 0 2 . 12 . . A 582 LEU MD1 . 28058 1 1678 . 1 . 1 168 168 LEU HD12 H 1 0.48 0.005 0 2 . 12 . . A 582 LEU MD1 . 28058 1 1679 . 1 . 1 168 168 LEU HD13 H 1 0.48 0.005 0 2 . 12 . . A 582 LEU MD1 . 28058 1 1680 . 1 . 1 168 168 LEU HD21 H 1 0.883 0.004 0 2 . 6 . . A 582 LEU MD2 . 28058 1 1681 . 1 . 1 168 168 LEU HD22 H 1 0.883 0.004 0 2 . 6 . . A 582 LEU MD2 . 28058 1 1682 . 1 . 1 168 168 LEU HD23 H 1 0.883 0.004 0 2 . 6 . . A 582 LEU MD2 . 28058 1 1683 . 1 . 1 168 168 LEU C C 13 177.567 0 0 1 . 2 . . A 582 LEU C . 28058 1 1684 . 1 . 1 168 168 LEU CA C 13 53.117 0.121 0 1 . 8 . . A 582 LEU CA . 28058 1 1685 . 1 . 1 168 168 LEU CB C 13 42.215 0.043 0 1 . 10 . . A 582 LEU CB . 28058 1 1686 . 1 . 1 168 168 LEU CG C 13 26.233 0.009 0 1 . 3 . . A 582 LEU CG . 28058 1 1687 . 1 . 1 168 168 LEU CD1 C 13 21.856 0.021 0 2 . 8 . . A 582 LEU CD1 . 28058 1 1688 . 1 . 1 168 168 LEU CD2 C 13 24.913 0.051 0 2 . 4 . . A 582 LEU CD2 . 28058 1 1689 . 1 . 1 168 168 LEU N N 15 125.596 0.066 0 1 . 10 . . A 582 LEU N . 28058 1 1690 . 1 . 1 169 169 ALA H H 1 8.532 0.005 0 1 . 7 . . A 583 ALA H . 28058 1 1691 . 1 . 1 169 169 ALA HA H 1 4.058 0.002 0 1 . 6 . . A 583 ALA HA . 28058 1 1692 . 1 . 1 169 169 ALA HB1 H 1 1.301 0.002 0 1 . 6 . . A 583 ALA MB . 28058 1 1693 . 1 . 1 169 169 ALA HB2 H 1 1.301 0.002 0 1 . 6 . . A 583 ALA MB . 28058 1 1694 . 1 . 1 169 169 ALA HB3 H 1 1.301 0.002 0 1 . 6 . . A 583 ALA MB . 28058 1 1695 . 1 . 1 169 169 ALA C C 13 176.459 0 0 1 . 2 . . A 583 ALA C . 28058 1 1696 . 1 . 1 169 169 ALA CA C 13 52.694 0.075 0 1 . 7 . . A 583 ALA CA . 28058 1 1697 . 1 . 1 169 169 ALA CB C 13 19.941 0.021 0 1 . 7 . . A 583 ALA CB . 28058 1 1698 . 1 . 1 169 169 ALA N N 15 124.798 0.094 0 1 . 7 . . A 583 ALA N . 28058 1 1699 . 1 . 1 170 170 ALA H H 1 8.39 0.009 0 1 . 9 . . A 584 ALA H . 28058 1 1700 . 1 . 1 170 170 ALA HA H 1 4.76 0.012 0 1 . 5 . . A 584 ALA HA . 28058 1 1701 . 1 . 1 170 170 ALA HB1 H 1 1.428 0.002 0 1 . 7 . . A 584 ALA MB . 28058 1 1702 . 1 . 1 170 170 ALA HB2 H 1 1.428 0.002 0 1 . 7 . . A 584 ALA MB . 28058 1 1703 . 1 . 1 170 170 ALA HB3 H 1 1.428 0.002 0 1 . 7 . . A 584 ALA MB . 28058 1 1704 . 1 . 1 170 170 ALA C C 13 176.596 0 0 1 . 2 . . A 584 ALA C . 28058 1 1705 . 1 . 1 170 170 ALA CA C 13 51.512 0.081 0 1 . 5 . . A 584 ALA CA . 28058 1 1706 . 1 . 1 170 170 ALA CB C 13 21.796 0.084 0 1 . 5 . . A 584 ALA CB . 28058 1 1707 . 1 . 1 170 170 ALA N N 15 122.931 0.069 0 1 . 10 . . A 584 ALA N . 28058 1 1708 . 1 . 1 171 171 ASP H H 1 8.069 0.007 0 1 . 8 . . A 585 ASP H . 28058 1 1709 . 1 . 1 171 171 ASP HA H 1 4.68 0.005 0 1 . 3 . . A 585 ASP HA . 28058 1 1710 . 1 . 1 171 171 ASP HB2 H 1 2.604 0.004 0 2 . 3 . . A 585 ASP HB2 . 28058 1 1711 . 1 . 1 171 171 ASP HB3 H 1 2.673 0.008 0 2 . 3 . . A 585 ASP HB3 . 28058 1 1712 . 1 . 1 171 171 ASP C C 13 175.696 0 0 1 . 1 . . A 585 ASP C . 28058 1 1713 . 1 . 1 171 171 ASP CA C 13 53.722 0.027 0 1 . 3 . . A 585 ASP CA . 28058 1 1714 . 1 . 1 171 171 ASP CB C 13 41.835 0.035 0 1 . 8 . . A 585 ASP CB . 28058 1 1715 . 1 . 1 171 171 ASP N N 15 119.54 0.075 0 1 . 7 . . A 585 ASP N . 28058 1 1716 . 1 . 1 172 172 ASN H H 1 8.458 0.008 0 1 . 6 . . A 586 ASN H . 28058 1 1717 . 1 . 1 172 172 ASN HA H 1 4.566 0.001 0 1 . 4 . . A 586 ASN HA . 28058 1 1718 . 1 . 1 172 172 ASN HB2 H 1 2.729 0.003 0 2 . 4 . . A 586 ASN HB2 . 28058 1 1719 . 1 . 1 172 172 ASN HB3 H 1 2.78 0.001 0 2 . 2 . . A 586 ASN HB3 . 28058 1 1720 . 1 . 1 172 172 ASN HD21 H 1 6.834 0.004 0 2 . 7 . . A 586 ASN HD21 . 28058 1 1721 . 1 . 1 172 172 ASN HD22 H 1 7.505 0.003 0 2 . 5 . . A 586 ASN HD22 . 28058 1 1722 . 1 . 1 172 172 ASN C C 13 175.539 0 0 1 . 1 . . A 586 ASN C . 28058 1 1723 . 1 . 1 172 172 ASN CA C 13 53.516 0.071 0 1 . 8 . . A 586 ASN CA . 28058 1 1724 . 1 . 1 172 172 ASN CB C 13 38.571 0.03 0 1 . 11 . . A 586 ASN CB . 28058 1 1725 . 1 . 1 172 172 ASN CG C 13 176.942 0.004 0 1 . 2 . . A 586 ASN CG . 28058 1 1726 . 1 . 1 172 172 ASN N N 15 119.463 0.091 0 1 . 6 . . A 586 ASN N . 28058 1 1727 . 1 . 1 172 172 ASN ND2 N 15 111.955 0.226 0 1 . 11 . . A 586 ASN ND2 . 28058 1 1728 . 1 . 1 173 173 LEU H H 1 8.12 0.006 0 1 . 7 . . A 587 LEU H . 28058 1 1729 . 1 . 1 173 173 LEU HA H 1 4.135 0.003 0 1 . 8 . . A 587 LEU HA . 28058 1 1730 . 1 . 1 173 173 LEU HB2 H 1 1.336 0.002 0 2 . 10 . . A 587 LEU HB2 . 28058 1 1731 . 1 . 1 173 173 LEU HB3 H 1 1.596 0.004 0 2 . 6 . . A 587 LEU HB3 . 28058 1 1732 . 1 . 1 173 173 LEU HG H 1 1.464 0.002 0 1 . 7 . . A 587 LEU HG . 28058 1 1733 . 1 . 1 173 173 LEU HD11 H 1 0.749 0.003 0 2 . 7 . . A 587 LEU MD1 . 28058 1 1734 . 1 . 1 173 173 LEU HD12 H 1 0.749 0.003 0 2 . 7 . . A 587 LEU MD1 . 28058 1 1735 . 1 . 1 173 173 LEU HD13 H 1 0.749 0.003 0 2 . 7 . . A 587 LEU MD1 . 28058 1 1736 . 1 . 1 173 173 LEU HD21 H 1 0.831 0.002 0 2 . 7 . . A 587 LEU MD2 . 28058 1 1737 . 1 . 1 173 173 LEU HD22 H 1 0.831 0.002 0 2 . 7 . . A 587 LEU MD2 . 28058 1 1738 . 1 . 1 173 173 LEU HD23 H 1 0.831 0.002 0 2 . 7 . . A 587 LEU MD2 . 28058 1 1739 . 1 . 1 173 173 LEU CA C 13 55.93 0.065 0 1 . 4 . . A 587 LEU CA . 28058 1 1740 . 1 . 1 173 173 LEU CB C 13 41.731 0.063 0 1 . 9 . . A 587 LEU CB . 28058 1 1741 . 1 . 1 173 173 LEU CG C 13 26.936 0.023 0 1 . 3 . . A 587 LEU CG . 28058 1 1742 . 1 . 1 173 173 LEU CD1 C 13 23.298 0.007 0 2 . 6 . . A 587 LEU CD1 . 28058 1 1743 . 1 . 1 173 173 LEU CD2 C 13 24.808 0.013 0 2 . 6 . . A 587 LEU CD2 . 28058 1 1744 . 1 . 1 173 173 LEU N N 15 120.871 0.114 0 1 . 6 . . A 587 LEU N . 28058 1 stop_ save_ ######################### # Spectral peak lists # ######################### save_spectral_peak_list_1 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_1 _Spectral_peak_list.Entry_ID 28058 _Spectral_peak_list.ID 1 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 1 _Spectral_peak_list.Experiment_name '3D HNCO' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 3 1 175.369 117.820 8.591 1 U 1.01e+07 0 e 0 1 27 20 2 177.087 124.162 9.348 1 U 6.92e+06 0 e 0 14 34 31 3 174.658 119.191 8.960 1 U 2.19e+07 0 e 0 28 48 41 4 175.721 119.372 9.106 1 U 1.84e+07 0 e 0 225 248 243 5 175.612 118.138 8.271 1 U 2.34e+07 0 e 0 1159 1178 1173 6 175.025 118.070 8.365 1 U 1.52e+07 0 e 0 35 56 52 7 177.631 129.541 9.112 1 U 1.26e+07 0 e 0 49 70 63 8 177.462 117.624 8.775 1 U 5.21e+06 0 e 0 0 0 0 9 177.452 117.743 8.716 1 U 1.7e+07 0 e 0 57 79 75 10 174.401 117.816 8.747 1 U 1.94e+06 0 e 0 0 0 0 11 174.230 117.652 8.821 1 U 7.17e+06 0 e 0 1239 1257 1253 12 173.875 118.005 8.659 1 U 2.87e+07 0 e 0 1132 1156 1150 13 177.751 109.476 7.860 1 U 2.27e+07 0 e 0 72 85 82 14 174.331 121.045 7.786 1 U 6.74e+06 0 e 0 0 0 0 15 174.350 120.922 7.744 1 U 2.12e+07 0 e 0 80 93 89 16 177.463 111.351 9.415 1 U 2.57e+07 0 e 0 86 99 96 17 174.032 123.715 8.781 1 U 6.17e+06 0 e 0 94 113 106 18 173.822 123.529 8.884 1 U 3.62e+06 0 e 0 0 0 0 19 173.742 123.791 8.954 1 U 1.07e+07 0 e 0 249 270 266 20 175.289 133.447 9.865 1 U 3.12e+06 0 e 0 100 124 118 21 174.890 113.106 8.175 1 U 1.27e+07 0 e 0 114 134 130 22 173.480 113.898 8.340 1 U 1.16e+07 0 e 0 126 145 140 23 174.149 125.229 8.333 1 U 6.73e+06 0 e 0 177 191 188 24 173.903 125.021 8.319 1 U 2.96e+07 0 e 0 1391 1406 1403 25 176.685 116.058 7.614 1 U 1.77e+07 0 e 0 185 199 195 26 175.611 116.394 7.507 1 U 1.1e+07 0 e 0 192 207 203 27 173.696 99.184 7.480 1 U 1.87e+07 0 e 0 200 213 210 28 172.980 119.951 8.497 1 U 2.72e+06 0 e 0 0 0 0 29 172.193 120.069 8.491 1 U 1.27e+07 0 e 0 208 224 219 30 176.082 123.605 7.338 1 U 1.36e+07 0 e 0 214 237 230 31 173.919 119.437 9.084 1 U 2.73e+07 0 e 0 770 795 790 32 177.434 127.292 8.398 1 U 2.32e+07 0 e 0 263 284 277 33 178.152 113.072 7.797 1 U 2.78e+07 0 e 0 271 292 288 34 176.909 107.258 7.551 1 U 2.76e+07 0 e 0 285 298 295 35 174.453 117.083 7.748 1 U 2.3e+07 0 e 0 293 306 302 36 176.508 112.465 10.192 1 U 2.19e+07 0 e 0 299 312 309 37 174.752 115.893 6.736 1 U 1.33e+07 0 e 0 356 377 372 38 176.412 119.822 8.676 1 U 9.63e+06 0 e 0 367 386 382 39 174.081 112.908 8.952 1 U 4.32e+06 0 e 0 379 391 390 40 173.122 128.350 8.726 1 U 9.64e+06 0 e 0 401 425 416 41 176.589 125.083 8.921 1 U 7.54e+06 0 e 0 410 440 433 42 179.788 126.273 10.220 1 U 9.91e+06 0 e 0 427 448 445 43 178.933 113.912 7.783 1 U 4.11e+07 0 e 0 442 456 452 44 177.419 109.021 8.179 1 U 2.03e+07 0 e 0 449 462 459 45 175.154 108.971 8.211 1 U 2.75e+07 0 e 0 1064 1086 1082 46 173.691 117.895 8.106 1 U 3.5e+07 0 e 0 457 470 466 47 172.080 116.426 8.368 1 U 1.58e+07 0 e 0 463 480 476 48 176.875 126.113 8.693 1 U 5.83e+06 0 e 0 0 0 0 49 176.707 126.212 8.643 1 U 1.92e+07 0 e 0 471 489 486 50 177.757 118.294 8.389 1 U 1.8e+07 0 e 0 483 500 496 51 176.333 108.933 7.121 1 U 1.03e+07 0 e 0 490 516 510 52 176.012 107.711 9.949 1 U 6.28e+06 0 e 0 505 522 519 53 178.639 124.739 8.730 1 U 6.54e+06 0 e 0 524 540 537 54 179.965 117.857 7.316 1 U 2.67e+07 0 e 0 534 547 544 55 176.628 117.890 7.324 1 U 4.39e+07 0 e 0 1125 1141 1137 56 179.386 119.590 8.120 1 U 2.05e+07 0 e 0 541 561 554 57 176.953 119.588 8.153 1 U 2.1e+06 0 e 0 0 0 0 58 176.596 119.547 8.069 1 U 5.58e+06 0 e 0 1499 1513 1509 59 178.068 118.903 8.379 1 U 2.42e+07 0 e 0 548 568 565 60 180.040 115.383 6.998 1 U 3.76e+07 0 e 0 562 577 573 61 176.992 116.468 8.055 1 U 3.27e+07 0 e 0 569 592 585 62 176.434 119.326 7.343 1 U 3.21e+07 0 e 0 579 600 596 63 176.626 124.207 9.002 1 U 2.71e+07 0 e 0 593 608 604 64 175.574 116.679 7.894 1 U 3.31e+07 0 e 0 601 619 613 65 176.964 107.688 7.414 1 U 2.45e+07 0 e 0 609 624 623 66 174.398 118.852 8.028 1 U 2.78e+07 0 e 0 621 633 629 67 176.699 117.950 10.132 1 U 2.51e+07 0 e 0 626 644 638 68 178.412 111.812 6.665 1 U 4.86e+06 0 e 0 637 645 642 69 178.435 111.826 7.537 1 U 4.95e+06 0 e 0 637 645 643 70 178.042 112.136 7.540 1 U 3.93e+06 0 e 0 1182 1190 1188 71 176.946 112.025 7.507 1 U 1.79e+06 0 e 0 1517 1525 1523 72 173.414 113.399 7.735 1 U 3.47e+07 0 e 0 634 659 652 73 174.737 126.720 9.329 1 U 2.21e+07 0 e 0 646 673 666 74 174.960 128.046 9.816 1 U 2.08e+07 0 e 0 660 684 678 75 174.553 115.532 7.602 1 U 2.94e+07 0 e 0 674 692 689 76 177.648 118.929 7.488 1 U 3.32e+07 0 e 0 686 699 696 77 178.414 119.263 8.528 1 U 3.93e+07 0 e 0 693 707 703 78 176.957 127.822 8.489 1 U 1.5e+07 0 e 0 700 714 711 79 179.959 116.616 9.550 1 U 2.81e+07 0 e 0 708 721 718 80 179.648 122.022 8.032 1 U 3.44e+07 0 e 0 715 731 727 81 177.607 113.097 8.605 1 U 2.32e+07 0 e 0 722 745 739 82 180.251 111.710 7.057 1 U 7.13e+06 0 e 0 737 746 743 83 180.272 111.759 7.750 1 U 6.57e+06 0 e 0 737 746 744 84 176.100 114.574 7.967 1 U 2.76e+07 0 e 0 734 755 751 85 174.019 121.172 7.119 1 U 3.16e+07 0 e 0 748 769 762 86 178.079 120.992 8.826 1 U 2.04e+07 0 e 0 756 783 775 87 174.464 129.158 9.533 1 U 1.06e+07 0 e 0 785 814 804 88 174.533 127.870 8.713 1 U 6.78e+06 0 e 0 796 829 821 89 180.555 110.262 7.303 1 U 1.51e+06 0 e 0 819 830 826 90 180.510 110.152 6.435 1 U 2.12e+06 0 e 0 819 830 825 91 176.007 124.833 8.795 1 U 3.16e+06 0 e 0 327 346 342 92 174.326 124.800 8.817 1 U 1.52e+07 0 e 0 816 838 834 93 178.119 127.584 8.250 1 U 1.03e+07 0 e 0 831 852 845 94 174.082 127.742 8.352 1 U 8.43e+06 0 e 0 313 340 333 95 177.700 111.683 7.880 1 U 2.43e+07 0 e 0 839 863 857 96 174.737 113.330 7.976 1 U 7.34e+06 0 e 0 853 873 869 97 173.607 114.549 8.035 1 U 9.13e+06 0 e 0 865 881 877 98 179.513 111.135 6.842 1 U 5.65e+06 0 e 0 1067 1078 1073 99 179.534 111.153 7.530 1 U 6.67e+06 0 e 0 1067 1078 1074 100 178.016 111.977 6.807 1 U 4.39e+06 0 e 0 1182 1190 1187 101 178.004 111.961 7.144 1 U 2.11e+06 0 e 0 612 620 617 102 177.507 112.602 6.974 1 U 2.77e+06 0 e 0 931 939 936 103 177.543 112.616 7.661 1 U 2.9e+06 0 e 0 931 939 937 104 176.938 111.824 6.832 1 U 2.15e+06 0 e 0 1517 1525 1522 105 176.891 128.194 9.601 1 U 3.82e+06 0 e 0 886 905 901 106 176.516 128.288 7.775 1 U 5.93e+06 0 e 0 898 918 910 107 177.501 123.101 8.617 1 U 1.09e+07 0 e 0 906 927 924 108 179.662 111.422 8.506 1 U 1.41e+07 0 e 0 921 938 932 109 175.134 117.568 7.983 1 U 1.88e+07 0 e 0 928 950 944 110 175.317 118.450 6.998 1 U 1.66e+07 0 e 0 940 964 957 111 176.327 122.857 8.883 1 U 1.68e+07 0 e 0 951 980 971 112 176.591 113.650 9.416 1 U 2.93e+07 0 e 0 965 991 987 113 174.214 119.750 7.739 1 U 2.07e+07 0 e 0 983 1005 998 114 179.665 118.306 8.589 1 U 3.69e+07 0 e 0 992 1017 1011 115 181.035 121.453 8.125 1 U 2.99e+07 0 e 0 1007 1029 1023 116 178.054 117.949 7.049 1 U 3.22e+07 0 e 0 1019 1041 1036 117 176.773 109.012 7.917 1 U 3.09e+07 0 e 0 1030 1048 1045 118 174.717 121.305 8.209 1 U 2.34e+07 0 e 0 1043 1063 1056 119 173.774 127.846 9.248 1 U 1.46e+07 0 e 0 1050 1077 1069 120 172.209 118.779 9.198 1 U 2.01e+07 0 e 0 1079 1100 1093 121 175.271 124.163 8.017 1 U 2.46e+07 0 e 0 1087 1109 1105 122 177.393 121.637 7.763 1 U 2.18e+07 0 e 0 1102 1123 1116 123 176.923 122.943 8.059 1 U 3.03e+07 0 e 0 1110 1131 1128 124 176.503 125.786 8.988 1 U 6.61e+06 0 e 0 1144 1166 1162 125 175.177 120.711 8.454 1 U 2.45e+07 0 e 0 1168 1189 1183 126 174.090 119.795 8.533 1 U 2.31e+07 0 e 0 1179 1206 1198 127 174.127 117.488 7.717 1 U 1.66e+07 0 e 0 1233 1246 1242 128 172.645 128.770 9.171 1 U 1.66e+07 0 e 0 1249 1271 1264 129 173.351 132.030 8.704 1 U 1.18e+07 0 e 0 1258 1278 1275 130 177.860 116.051 7.127 1 U 1.29e+07 0 e 0 1272 1289 1283 131 174.816 121.497 9.378 1 U 1.97e+07 0 e 0 1279 1301 1295 132 173.931 119.883 9.357 1 U 2.21e+07 0 e 0 1290 1309 1306 133 173.636 120.051 9.099 1 U 1.04e+07 0 e 0 1304 1317 1313 134 171.543 118.604 8.987 1 U 2.07e+07 0 e 0 1310 1328 1324 135 172.870 116.000 8.927 1 U 2e+07 0 e 0 1319 1339 1335 136 174.999 127.004 9.111 1 U 2.11e+07 0 e 0 1331 1352 1346 137 178.804 113.534 8.917 1 U 2.59e+07 0 e 0 1340 1363 1359 138 175.142 116.634 7.579 1 U 9.05e+06 0 e 0 1355 1374 1368 139 176.369 107.944 8.220 1 U 2.83e+07 0 e 0 1364 1381 1378 140 174.696 112.458 7.557 1 U 4.22e+07 0 e 0 1376 1390 1386 141 172.953 111.652 8.137 1 U 3.4e+07 0 e 0 1382 1399 1395 142 175.172 117.133 8.807 1 U 2.68e+07 0 e 0 1400 1421 1413 143 175.415 115.464 7.793 1 U 2.5e+07 0 e 0 1407 1435 1428 144 173.745 107.467 8.929 1 U 2.22e+07 0 e 0 1423 1441 1438 145 170.264 119.514 8.860 1 U 1.4e+07 0 e 0 1436 1449 1445 146 175.609 125.553 8.254 1 U 6.36e+06 0 e 0 1442 1463 1456 147 175.889 122.618 9.250 1 U 4.03e+06 0 e 0 1450 1477 1470 148 176.740 125.635 8.496 1 U 1.46e+07 0 e 0 1464 1491 1484 149 177.567 124.717 8.534 1 U 3.27e+06 0 e 0 1478 1498 1495 150 176.459 122.874 8.391 1 U 6.09e+06 0 e 0 1492 1505 1502 151 177.639 123.385 8.689 1 U 2.57e+06 0 e 0 0 0 0 152 177.649 115.903 7.024 1 U 4.08e+06 0 e 0 0 0 0 153 177.031 123.550 8.297 1 U 3e+06 0 e 0 0 0 0 154 176.785 125.225 7.918 1 U 3.81e+06 0 e 0 0 0 0 155 176.730 124.540 8.904 1 U 5.36e+06 0 e 0 0 0 0 156 176.702 115.871 7.671 1 U 4.28e+06 0 e 0 0 0 0 157 176.625 109.853 8.107 1 U 2.93e+06 0 e 0 0 0 0 158 176.536 122.916 8.290 1 U 2.84e+06 0 e 0 0 0 0 159 176.487 126.042 7.851 1 U 2.88e+06 0 e 0 0 0 0 160 176.499 119.334 8.178 1 U 3.87e+06 0 e 0 0 0 0 161 176.447 126.591 8.417 1 U 1.16e+07 0 e 0 1208 1227 1222 162 176.327 124.918 8.193 1 U 2.8e+06 0 e 0 0 0 0 163 176.279 124.437 7.944 1 U 2.88e+06 0 e 0 0 0 0 164 176.203 124.626 7.504 1 U 4.09e+06 0 e 0 0 0 0 165 176.167 126.433 7.817 1 U 5.04e+06 0 e 0 0 0 0 166 176.126 126.786 8.463 1 U 2.53e+06 0 e 0 135 147 146 167 176.108 120.201 8.270 1 U 3.15e+06 0 e 0 0 0 0 168 176.070 123.259 8.054 1 U 3.52e+06 0 e 0 0 0 0 169 176.000 130.274 7.789 1 U 6.39e+06 0 e 0 0 0 0 170 175.948 125.540 8.191 1 U 2.95e+06 0 e 0 0 0 0 171 175.906 125.037 7.565 1 U 5.82e+06 0 e 0 0 0 0 172 175.845 130.306 7.738 1 U 2.9e+06 0 e 0 0 0 0 173 175.752 119.948 8.180 1 U 3.22e+06 0 e 0 517 532 528 174 175.708 127.035 7.891 1 U 2.26e+07 0 e 0 1540 1558 1554 175 175.696 119.412 8.459 1 U 4.26e+06 0 e 0 1506 1524 1518 176 175.639 115.965 7.365 1 U 3.95e+06 0 e 0 0 0 0 177 175.604 127.463 7.659 1 U 2.79e+06 0 e 0 0 0 0 178 175.539 120.917 8.126 1 U 5.47e+06 0 e 0 1514 1539 1532 179 175.489 130.067 7.923 1 U 7.99e+06 0 e 0 0 0 0 180 175.492 129.613 7.990 1 U 4.15e+06 0 e 0 0 0 0 181 175.459 128.908 7.877 1 U 3.33e+06 0 e 0 0 0 0 182 175.293 118.921 7.057 1 U 5.94e+06 0 e 0 0 0 0 183 175.251 129.869 7.820 1 U 9.28e+06 0 e 0 0 0 0 184 175.215 119.973 7.680 1 U 2.61e+06 0 e 0 0 0 0 185 175.114 121.895 8.175 1 U 4.99e+06 0 e 0 0 0 0 186 175.058 128.662 7.985 1 U 6.73e+06 0 e 0 0 0 0 187 175.013 126.856 7.929 1 U 5.19e+06 0 e 0 0 0 0 188 174.925 125.275 7.735 1 U 2.91e+06 0 e 0 0 0 0 189 174.926 125.176 7.665 1 U 7.96e+06 0 e 0 0 0 0 190 174.879 125.005 7.743 1 U 3.03e+06 0 e 0 0 0 0 191 174.868 127.433 7.913 1 U 3.47e+06 0 e 0 0 0 0 192 174.799 113.677 8.052 1 U 4.28e+06 0 e 0 0 0 0 193 174.798 124.800 7.914 1 U 3.08e+06 0 e 0 0 0 0 194 174.759 128.629 9.543 1 U 2.93e+06 0 e 0 0 0 0 195 174.650 127.611 8.002 1 U 2.58e+06 0 e 0 0 0 0 196 174.549 125.649 7.741 1 U 2.51e+07 0 e 0 0 0 0 197 174.453 123.602 8.177 1 U 3.91e+06 0 e 0 0 0 0 198 174.423 130.478 7.759 1 U 4.86e+06 0 e 0 0 0 0 199 174.351 116.782 6.782 1 U 3.82e+06 0 e 0 0 0 0 200 174.282 122.442 7.900 1 U 9.41e+06 0 e 0 0 0 0 201 174.254 119.913 8.474 1 U 4.79e+06 0 e 0 0 0 0 202 174.151 127.274 8.213 1 U 2.78e+06 0 e 0 0 0 0 203 174.029 120.024 7.950 1 U 4.11e+06 0 e 0 0 0 0 204 173.951 127.599 7.692 1 U 4.81e+06 0 e 0 0 0 0 205 173.928 119.560 7.859 1 U 3.32e+06 0 e 0 0 0 0 206 173.891 121.380 5.905 1 U 3.61e+06 0 e 0 156 176 171 207 173.902 120.123 7.883 1 U 5.25e+06 0 e 0 0 0 0 208 173.895 115.344 7.958 1 U 3.74e+06 0 e 0 0 0 0 209 173.700 131.458 8.679 1 U 2.98e+06 0 e 0 0 0 0 210 173.577 119.786 9.023 1 U 4.99e+06 0 e 0 0 0 0 211 173.504 129.463 7.959 1 U 3.59e+06 0 e 0 0 0 0 212 173.480 129.548 7.886 1 U 1.57e+07 0 e 0 0 0 0 213 173.469 127.770 7.911 1 U 4.19e+06 0 e 0 0 0 0 214 173.306 128.415 8.227 1 U 1.37e+07 0 e 0 0 0 0 215 172.533 114.160 7.249 1 U 7.58e+06 0 e 0 307 326 319 216 172.512 116.666 8.349 1 U 6.57e+06 0 e 0 0 0 0 217 172.444 113.232 7.199 1 U 4.18e+06 0 e 0 0 0 0 218 171.902 116.549 7.977 1 U 3.41e+06 0 e 0 388 399 395 219 159.677 85.120 7.268 1 U 2.32e+07 0 e 0 970 981 977 220 171.170 113.405 6.985 1 U 4.56e+06 0 e 0 0 0 0 221 174.142 125.868 10.069 1 U 1.05e+06 0 e 0 0 0 0 222 176.094 123.056 8.120 1 U 1.75e+06 0 e 0 166 184 180 223 179.560 114.791 7.641 1 U 2.43e+06 0 e 0 351 366 360 224 174.127 121.779 8.259 1 U 2.29e+06 0 e 0 349 355 353 225 175.955 122.427 8.263 1 U 1.44e+06 0 e 0 0 0 0 226 175.924 122.543 7.867 1 U 1.3e+06 0 e 0 0 0 0 227 172.135 117.244 7.832 1 U 1.94e+06 0 e 0 400 409 405 228 177.774 112.817 7.318 1 U 2.24e+06 0 e 0 677 685 682 229 177.818 112.849 7.707 1 U 2.4e+06 0 e 0 677 685 683 230 177.570 111.667 6.322 1 U 1.47e+06 0 e 0 856 864 861 231 175.270 127.123 9.008 1 U 1.21e+06 0 e 0 1192 1215 1211 232 178.223 107.876 8.597 1 U 2.2e+06 0 e 0 1216 1230 1229 233 174.875 106.599 8.672 1 U 1.44e+06 0 e 0 1231 1238 1235 234 179.118 110.459 7.637 1 U 1.07e+06 0 e 0 1293 1302 1298 235 177.404 110.016 6.935 1 U 1.14e+06 0 e 0 1367 1375 1372 236 177.464 110.130 7.680 1 U 1.04e+06 0 e 0 1367 1375 1373 237 175.919 129.000 7.681 1 U 2.29e+06 0 e 0 0 0 0 238 174.027 119.383 8.530 1 U 1.69e+07 0 e 0 238 262 254 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . CO 13 CO . . 20 ppm . . . . . . 28058 1 2 . . N 15 NH . . 30 ppm . . . . . . 28058 1 3 . . HN 1 HN . . 14 ppm . . . . . . 28058 1 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $SPARKY . . 28058 1 stop_ save_ save_spectral_peak_list_2 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_2 _Spectral_peak_list.Entry_ID 28058 _Spectral_peak_list.ID 2 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 2 _Spectral_peak_list.Experiment_name '3D HNCACB' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 3 1 72.919 113.073 8.171 1 U 1.24e+07 0 e 0 128 134 130 2 72.717 128.809 9.171 1 U 9.8e+06 0 e 0 1251 1271 1264 3 72.768 117.640 8.825 1 U 1.05e+07 0 e 0 1251 1257 1253 4 72.036 125.029 8.316 1 U 1.18e+07 0 e 0 1393 1406 1403 5 72.079 111.651 8.132 1 U 4.82e+07 0 e 0 1393 1399 1395 6 70.969 112.434 7.555 1 U 5.88e+07 0 e 0 1384 1390 1386 7 70.644 126.942 9.108 1 U 1.06e+07 0 e 0 1333 1352 1346 8 70.660 115.973 8.927 1 U 2.83e+07 0 e 0 1333 1339 1335 9 69.970 119.696 7.740 1 U 1.39e+07 0 e 0 985 1005 998 10 69.969 113.620 9.412 1 U 4.07e+07 0 e 0 985 991 987 11 68.597 113.535 8.916 1 U 3.13e+07 0 e 0 1357 1363 1359 12 66.746 120.091 9.098 1 U 1.73e+07 0 e 0 1312 1317 1313 13 66.737 119.984 9.058 1 U 5.7e+06 0 e 0 0 0 0 14 66.633 118.504 8.981 1 U 1.16e+07 0 e 0 1312 1328 1324 15 66.144 108.837 8.261 1 U 5.77e+06 0 e 0 0 0 0 16 66.017 118.789 9.193 1 U 1.28e+07 0 e 0 1081 1100 1093 17 66.008 108.974 8.210 1 U 5.99e+07 0 e 0 1081 1086 1082 18 64.913 122.501 7.900 1 U 7.06e+06 0 e 0 0 0 0 19 64.676 113.563 8.913 1 U -1.93e+07 0 e 0 1356 1363 1359 20 64.598 121.228 7.117 1 U 9.02e+06 0 e 0 750 769 762 21 64.610 114.586 7.965 1 U 4.51e+07 0 e 0 750 755 751 22 64.330 117.895 8.102 1 U 5.22e+07 0 e 0 465 470 466 23 64.354 116.423 8.367 1 U 1.18e+07 0 e 0 465 480 476 24 64.160 124.206 9.000 1 U 4.66e+07 0 e 0 603 608 604 25 64.159 116.616 7.894 1 U 1.02e+07 0 e 0 603 619 613 26 63.833 125.341 8.330 1 U 5.19e+06 0 e 0 179 191 188 27 63.412 124.846 7.505 1 U -6.15e+06 0 e 0 0 0 0 28 63.439 122.056 8.029 1 U -4.84e+07 0 e 0 723 731 727 29 63.466 113.086 8.605 1 U -1.42e+07 0 e 0 723 745 739 30 63.264 121.297 8.205 1 U -3.29e+07 0 e 0 1051 1063 1056 31 63.211 127.969 9.242 1 U -1.29e+07 0 e 0 1051 1077 1069 32 62.214 118.141 8.269 1 U -2.21e+07 0 e 0 1169 1178 1173 33 62.186 127.098 9.109 1 U -6.49e+06 0 e 0 1332 1352 1346 34 62.202 120.734 8.452 1 U -8.12e+06 0 e 0 1169 1189 1183 35 62.159 115.971 8.926 1 U -2.06e+07 0 e 0 1332 1339 1335 36 61.968 111.650 8.131 1 U -1.22e+07 0 e 0 1383 1399 1395 37 61.823 117.812 8.585 1 U -5.9e+06 0 e 0 2 27 20 38 61.950 112.410 7.554 1 U -4.46e+07 0 e 0 1383 1390 1386 39 61.741 128.722 9.167 1 U -9.44e+06 0 e 0 1250 1271 1264 40 61.758 117.611 8.824 1 U -7.33e+06 0 e 0 1250 1257 1253 41 61.523 121.370 5.899 1 U -4.68e+06 0 e 0 167 176 171 42 61.275 120.201 7.884 1 U -9.7e+06 0 e 0 0 0 0 43 61.253 119.682 7.736 1 U -1.02e+07 0 e 0 984 1005 998 44 61.251 113.647 9.413 1 U -2.95e+07 0 e 0 984 991 987 45 60.948 129.155 9.535 1 U -7.76e+06 0 e 0 786 814 804 46 60.961 119.410 9.084 1 U -2.48e+07 0 e 0 786 795 790 47 60.850 124.187 9.001 1 U -3.42e+07 0 e 0 602 608 604 48 60.848 116.634 7.892 1 U -7.15e+06 0 e 0 602 619 613 49 59.811 124.948 8.316 1 U -1.12e+07 0 e 0 1392 1406 1403 50 59.825 111.654 8.133 1 U -3.68e+07 0 e 0 1392 1399 1395 51 59.765 121.441 8.120 1 U -1.57e+07 0 e 0 1008 1029 1023 52 59.729 118.271 8.588 1 U -6.12e+07 0 e 0 1008 1017 1011 53 59.529 126.673 9.329 1 U -1.45e+07 0 e 0 647 673 666 54 59.521 113.906 8.336 1 U -1.42e+07 0 e 0 136 145 140 55 59.579 113.358 7.732 1 U -5.9e+07 0 e 0 647 659 652 56 59.447 121.188 7.117 1 U -8.85e+06 0 e 0 749 769 762 57 59.466 119.646 7.740 1 U -1.7e+07 0 e 0 993 1005 998 58 59.284 119.401 8.521 1 U -4.78e+06 0 e 0 239 262 254 59 59.293 119.365 9.103 1 U -2.18e+07 0 e 0 239 248 243 60 59.341 114.566 7.965 1 U -3.19e+07 0 e 0 749 755 751 61 59.278 113.118 8.173 1 U -1.44e+07 0 e 0 127 134 130 62 59.124 125.646 7.739 1 U -4.49e+07 0 e 0 0 0 0 63 59.058 125.486 7.679 1 U -8.52e+06 0 e 0 0 0 0 64 59.028 117.879 7.041 1 U -1.07e+07 0 e 0 1020 1041 1036 65 58.883 125.074 7.570 1 U -4.89e+06 0 e 0 0 0 0 66 58.978 121.474 8.121 1 U -4.56e+07 0 e 0 1020 1029 1023 67 58.584 128.299 7.773 1 U -7.9e+06 0 e 0 907 918 910 68 58.590 123.145 8.611 1 U -5.94e+06 0 e 0 907 927 924 69 58.533 116.449 8.054 1 U -1.08e+07 0 e 0 570 592 585 70 58.571 115.362 6.993 1 U -5.24e+07 0 e 0 570 577 573 71 58.414 126.240 8.640 1 U -8.79e+06 0 e 0 472 489 486 72 58.405 116.430 8.365 1 U -3.09e+07 0 e 0 472 480 476 73 58.440 114.160 7.250 1 U -1e+07 0 e 0 314 326 319 74 58.257 128.314 8.223 1 U -1.48e+07 0 e 0 0 0 0 75 58.105 127.025 7.890 1 U -4.21e+07 0 e 0 1552 1558 1554 76 58.168 119.945 8.670 1 U -9.65e+06 0 e 0 380 386 382 77 58.060 127.670 8.245 1 U -1.19e+07 0 e 0 840 852 845 78 57.952 126.482 7.745 1 U -8.2e+06 0 e 0 0 0 0 79 57.975 117.890 8.102 1 U -3.82e+07 0 e 0 464 470 466 80 58.030 111.690 7.877 1 U -8.57e+06 0 e 0 840 863 857 81 57.912 120.066 9.108 1 U -1.25e+07 0 e 0 1311 1317 1313 82 57.900 118.591 8.985 1 U -9.24e+06 0 e 0 1311 1328 1324 83 57.756 118.296 8.381 1 U -1.89e+07 0 e 0 491 500 496 84 57.737 113.081 8.604 1 U -3.57e+07 0 e 0 735 745 739 85 57.685 114.506 7.962 1 U -1.01e+07 0 e 0 735 755 751 86 57.375 117.127 8.805 1 U -3.88e+07 0 e 0 1408 1421 1413 87 57.407 115.450 7.787 1 U -1.38e+07 0 e 0 1408 1435 1428 88 57.200 118.780 9.196 1 U -1.06e+07 0 e 0 1080 1100 1093 89 57.155 127.436 7.940 1 U -4.94e+06 0 e 0 0 0 0 90 56.912 108.966 8.209 1 U -2.73e+07 0 e 0 1065 1086 1082 91 57.014 129.685 7.906 1 U -9.03e+06 0 e 0 0 0 0 92 56.944 127.896 9.245 1 U -1.32e+07 0 e 0 1065 1077 1069 93 56.930 127.593 8.361 1 U -6.13e+06 0 e 0 328 340 333 94 56.952 119.558 8.117 1 U -2.8e+07 0 e 0 549 561 554 95 56.940 118.939 8.377 1 U -9.03e+06 0 e 0 549 568 565 96 56.794 129.558 7.779 1 U -5.18e+06 0 e 0 0 0 0 97 56.839 127.972 9.816 1 U -7.19e+06 0 e 0 661 684 678 98 56.819 127.337 8.393 1 U -2.2e+07 0 e 0 272 284 277 99 56.872 126.748 9.326 1 U -2.05e+07 0 e 0 661 673 666 100 56.869 113.332 7.973 1 U -6.6e+06 0 e 0 866 873 869 101 56.752 112.988 7.798 1 U -9.66e+06 0 e 0 272 292 288 102 56.604 117.581 7.977 1 U -5.22e+05 0 e 0 941 950 944 103 56.417 126.969 9.109 1 U -2.75e+07 0 e 0 1341 1352 1346 104 56.443 113.555 8.916 1 U -1.71e+07 0 e 0 1341 1363 1359 105 56.365 116.065 7.612 1 U -2.09e+07 0 e 0 193 199 195 106 56.291 115.965 8.926 1 U -1.04e+07 0 e 0 1320 1339 1335 107 56.223 128.350 8.727 1 U -8.12e+06 0 e 0 411 425 416 108 56.266 118.575 8.983 1 U -3.2e+07 0 e 0 1320 1328 1324 109 56.130 123.742 8.956 1 U -9.51e+06 0 e 0 250 270 266 110 56.142 123.113 8.612 1 U -1.41e+07 0 e 0 922 927 924 111 56.142 111.401 8.501 1 U -7.16e+06 0 e 0 922 938 932 112 56.010 129.544 9.107 1 U -5.63e+05 0 e 0 58 70 63 113 55.902 125.608 7.739 1 U -1.37e+07 0 e 0 0 0 0 114 55.990 117.743 8.714 1 U -6.99e+06 0 e 0 58 79 75 115 55.818 120.746 8.116 1 U -6.65e+06 0 e 0 1527 1539 1532 116 55.774 118.001 8.652 1 U -1.57e+07 0 e 0 1133 1156 1150 117 55.727 117.849 7.319 1 U -5.79e+07 0 e 0 1133 1141 1137 118 55.632 127.803 8.484 1 U -1.66e+07 0 e 0 709 714 711 119 55.528 131.985 8.698 1 U -1.7e+07 0 e 0 1273 1278 1275 120 55.522 125.978 8.973 1 U -5.32e+06 0 e 0 1160 1166 1162 121 55.510 119.971 9.361 1 U -9.09e+06 0 e 0 1291 1309 1306 122 55.550 119.167 8.954 1 U -2.44e+07 0 e 0 36 48 41 123 55.610 118.109 8.274 1 U -1.61e+07 0 e 0 1160 1178 1173 124 55.583 118.020 8.364 1 U -1.61e+07 0 e 0 36 56 52 125 55.575 116.578 9.548 1 U -1.17e+07 0 e 0 709 721 718 126 55.403 122.879 8.134 1 U -4.58e+06 0 e 0 0 0 0 127 55.406 121.533 9.376 1 U -3.32e+07 0 e 0 1291 1301 1295 128 55.249 127.078 7.891 1 U -1.44e+07 0 e 0 1541 1558 1554 129 55.250 126.208 10.219 1 U -1.18e+07 0 e 0 443 448 445 130 55.292 122.743 8.054 1 U -1.69e+07 0 e 0 1111 1131 1128 131 55.333 121.009 7.893 1 U -6.68e+06 0 e 0 0 0 0 132 55.257 113.359 7.729 1 U -6.01e+06 0 e 0 635 659 652 133 55.204 126.665 8.418 1 U -1.04e+07 0 e 0 1217 1227 1222 134 55.177 123.682 8.162 1 U -5.48e+06 0 e 0 0 0 0 135 55.219 123.635 8.050 1 U -5.5e+06 0 e 0 0 0 0 136 55.067 121.594 7.754 1 U -2.67e+07 0 e 0 1103 1123 1116 137 55.194 120.026 8.462 1 U -5.05e+06 0 e 0 0 0 0 138 55.184 119.285 7.338 1 U -8.48e+06 0 e 0 580 600 596 139 55.224 117.905 10.130 1 U -1.6e+07 0 e 0 635 644 638 140 55.193 113.924 7.783 1 U -1.78e+07 0 e 0 443 456 452 141 55.138 111.692 6.665 1 U 6.1e+06 0 e 0 635 645 642 142 54.986 124.309 7.932 1 U -7.2e+06 0 e 0 0 0 0 143 55.070 124.167 8.017 1 U -2.8e+07 0 e 0 1103 1109 1105 144 55.020 124.138 7.945 1 U -1.09e+06 0 e 0 0 0 0 145 55.084 116.478 8.055 1 U -3.35e+07 0 e 0 580 592 585 146 55.084 116.032 7.125 1 U -2.21e+07 0 e 0 1280 1289 1283 147 54.941 127.702 8.482 1 U -1.12e+07 0 e 0 701 714 711 148 54.925 121.175 7.116 1 U -4.89e+07 0 e 0 757 769 762 149 54.917 121.010 8.826 1 U -8.58e+06 0 e 0 757 783 775 150 54.904 120.405 8.069 1 U -5.22e+06 0 e 0 0 0 0 151 54.899 119.392 8.527 1 U -5.15e+07 0 e 0 701 707 703 152 54.884 118.925 8.378 1 U -4.18e+07 0 e 0 563 568 565 153 54.965 115.413 6.995 1 U -1.51e+07 0 e 0 563 577 573 154 54.838 124.784 8.730 1 U -8.06e+06 0 e 0 535 540 537 155 54.678 125.252 8.326 1 U -5.54e+06 0 e 0 186 191 188 156 54.700 120.711 8.448 1 U -1.64e+07 0 e 0 1180 1189 1183 157 54.602 111.392 8.504 1 U -1.44e+07 0 e 0 929 938 932 158 54.584 123.680 7.337 1 U -1.39e+07 0 e 0 226 237 230 159 54.524 119.576 8.120 1 U -1.12e+07 0 e 0 542 561 554 160 54.494 117.641 7.982 1 U -5.74e+06 0 e 0 929 950 944 161 54.400 124.710 8.815 1 U -6.82e+06 0 e 0 817 838 834 162 54.374 115.491 7.790 1 U -3.32e+07 0 e 0 1424 1435 1428 163 54.406 107.479 8.928 1 U -8.5e+06 0 e 0 1424 1441 1438 164 54.315 117.974 7.044 1 U -3.43e+07 0 e 0 1031 1041 1036 165 54.275 108.997 7.916 1 U -9.77e+06 0 e 0 1031 1048 1045 166 54.188 128.008 8.715 1 U -4.95e+06 0 e 0 817 829 821 167 54.145 126.632 8.423 1 U -8.03e+06 0 e 0 1209 1227 1222 168 54.125 122.824 8.884 1 U 3.09e+05 0 e 0 966 980 971 169 54.126 115.549 7.599 1 U -3.81e+07 0 e 0 687 692 689 170 54.183 113.615 9.413 1 U -1.48e+07 0 e 0 966 991 987 171 54.023 120.039 8.487 1 U -1.02e+07 0 e 0 215 224 219 172 54.004 118.874 7.484 1 U -1.39e+07 0 e 0 687 699 696 173 54.018 118.015 8.653 1 U -3.52e+07 0 e 0 1145 1156 1150 174 53.852 126.180 10.208 1 U -5.16e+06 0 e 0 428 448 445 175 53.860 124.066 8.015 1 U -9.03e+06 0 e 0 1088 1109 1105 176 53.885 118.763 9.193 1 U -2.05e+07 0 e 0 1088 1100 1093 177 53.781 132.020 8.698 1 U -7.25e+06 0 e 0 1259 1278 1275 178 53.748 130.409 7.782 1 U -8.4e+06 0 e 0 0 0 0 179 53.716 128.803 9.166 1 U -1.25e+07 0 e 0 1259 1271 1264 180 53.725 125.174 8.918 1 U -1.02e+07 0 e 0 428 440 433 181 53.714 119.375 8.061 1 U -5.21e+06 0 e 0 1507 1513 1509 182 53.707 108.945 7.120 1 U -1.99e+07 0 e 0 506 516 510 183 53.629 119.520 8.857 1 U -1.18e+07 0 e 0 1443 1449 1445 184 53.602 119.473 8.451 1 U -5.93e+06 0 e 0 1515 1524 1518 185 53.579 118.463 6.996 1 U -1.87e+07 0 e 0 952 964 957 186 53.630 107.693 9.945 1 U -4.87e+06 0 e 0 506 522 519 187 53.449 124.186 9.001 1 U -1.38e+07 0 e 0 594 608 604 188 53.411 125.553 8.493 1 U -1.18e+07 0 e 0 1479 1491 1484 189 53.375 120.007 8.674 1 U -5.46e+06 0 e 0 368 386 382 190 53.411 119.376 7.341 1 U -2.49e+07 0 e 0 594 600 596 191 53.413 113.879 7.781 1 U -4.4e+07 0 e 0 450 456 452 192 53.395 109.051 8.182 1 U -4.93e+06 0 e 0 450 462 459 193 53.254 127.335 8.398 1 U -9.85e+06 0 e 0 264 284 277 194 53.232 123.770 8.952 1 U -9.3e+06 0 e 0 264 270 266 195 53.246 117.760 8.713 1 U -1.77e+07 0 e 0 73 79 75 196 53.294 115.925 6.734 1 U -1.67e+07 0 e 0 368 377 372 197 53.250 109.432 7.859 1 U -7.4e+06 0 e 0 73 85 82 198 53.108 118.924 7.484 1 U -4.73e+07 0 e 0 694 699 696 199 53.135 118.859 8.024 1 U 6.41e+05 0 e 0 627 633 629 200 52.944 121.002 8.827 1 U -2.52e+07 0 e 0 771 783 775 201 52.948 114.469 8.030 1 U -6.95e+06 0 e 0 875 881 877 202 52.836 129.171 9.534 1 U -7.65e+06 0 e 0 797 814 804 203 52.893 125.679 8.247 1 U -5.57e+06 0 e 0 1451 1463 1456 204 52.845 124.880 8.527 1 U -5.18e+06 0 e 0 1493 1498 1495 205 52.904 121.011 7.740 1 U -1.72e+07 0 e 0 87 93 89 206 52.900 119.462 9.081 1 U -1.24e+07 0 e 0 771 795 790 207 52.838 116.411 7.502 1 U -1.19e+07 0 e 0 201 207 203 208 52.775 124.736 8.816 1 U -8.35e+06 0 e 0 832 838 834 209 52.422 122.033 8.029 1 U -1.24e+07 0 e 0 716 731 727 210 52.290 116.656 7.576 1 U -6.34e+06 0 e 0 1365 1374 1368 211 52.391 116.603 9.549 1 U -3.82e+07 0 e 0 716 721 718 212 52.340 107.903 8.218 1 U -7.9e+06 0 e 0 1365 1381 1378 213 52.169 117.354 7.723 1 U -1.74e+07 0 e 0 1240 1246 1242 214 52.060 129.447 9.104 1 U -5.84e+06 0 e 0 50 70 63 215 52.068 126.231 8.640 1 U -2.83e+07 0 e 0 484 489 486 216 52.077 118.250 8.383 1 U -2.5e+05 0 e 0 484 500 496 217 52.119 117.121 7.748 1 U -2.49e+07 0 e 0 300 306 302 218 52.132 112.406 10.188 1 U -6.11e+06 0 e 0 300 312 309 219 52.000 122.902 8.055 1 U -5.45e+07 0 e 0 1126 1131 1128 220 52.011 117.829 7.323 1 U -1.66e+07 0 e 0 1126 1141 1137 221 51.656 116.667 7.893 1 U -2.69e+07 0 e 0 610 619 613 222 51.648 115.524 7.603 1 U -1.43e+07 0 e 0 675 692 689 223 51.670 113.117 7.798 1 U -2.65e+07 0 e 0 286 292 288 224 51.651 111.664 7.877 1 U -1.84e+07 0 e 0 854 863 857 225 51.634 107.661 7.412 1 U -6.23e+06 0 e 0 610 624 623 226 50.608 125.041 8.317 1 U -4e+07 0 e 0 1401 1406 1403 227 50.604 117.127 8.805 1 U -1.42e+07 0 e 0 1401 1421 1413 228 50.326 124.102 9.343 1 U -8.91e+06 0 e 0 29 34 31 229 50.329 119.148 8.955 1 U -1.43e+07 0 e 0 29 48 41 230 47.914 107.700 7.411 1 U -5.97e+07 0 e 0 622 624 623 231 47.874 118.873 8.025 1 U -1.39e+07 0 e 0 622 633 629 232 47.654 120.968 7.743 1 U -9.06e+06 0 e 0 81 93 89 233 47.711 109.479 7.859 1 U -6.49e+07 0 e 0 81 85 82 234 47.502 107.644 9.941 1 U -1.24e+07 0 e 0 518 522 519 235 47.463 119.479 8.857 1 U -1.85e+07 0 e 0 1437 1449 1445 236 47.436 117.141 7.754 1 U -1.25e+07 0 e 0 294 306 302 237 47.465 107.439 8.927 1 U -7.36e+07 0 e 0 1437 1441 1438 238 47.462 107.220 7.549 1 U -6.55e+07 0 e 0 294 298 295 239 46.911 121.322 8.203 1 U -1.65e+07 0 e 0 1044 1063 1056 240 46.942 109.012 7.916 1 U -6.94e+07 0 e 0 1044 1048 1045 241 46.685 112.850 8.955 1 U -9.45e+06 0 e 0 389 391 390 242 46.150 116.777 8.014 1 U -7.98e+06 0 e 0 0 0 0 243 45.829 123.344 7.993 1 U -4.6e+06 0 e 0 0 0 0 244 45.700 109.356 8.489 1 U -6.06e+06 0 e 0 0 0 0 245 45.663 99.236 7.480 1 U -5.38e+07 0 e 0 209 213 210 246 45.614 120.866 7.888 1 U -6.88e+06 0 e 0 0 0 0 247 45.617 120.008 8.488 1 U -1.55e+07 0 e 0 209 224 219 248 45.469 120.183 7.880 1 U -1.06e+07 0 e 0 0 0 0 249 45.490 112.436 10.190 1 U -4.79e+07 0 e 0 308 312 309 250 45.344 112.360 7.556 1 U -1.57e+07 0 e 0 1377 1390 1386 251 45.365 107.957 8.217 1 U -6.77e+07 0 e 0 1377 1381 1378 252 45.187 119.897 9.356 1 U -4.81e+07 0 e 0 1305 1309 1306 253 45.163 120.049 9.105 1 U -9.32e+06 0 e 0 1305 1317 1313 254 45.060 117.864 8.101 1 U -1.19e+07 0 e 0 458 470 466 255 45.098 109.029 8.177 1 U -5.9e+07 0 e 0 458 462 459 256 44.954 120.083 8.489 1 U 1.3e+07 0 e 0 216 224 219 257 45.019 119.182 8.954 1 U 2.38e+07 0 e 0 37 48 41 258 44.996 118.056 8.364 1 U 1.25e+07 0 e 0 37 56 52 259 44.810 123.725 7.337 1 U 5.96e+06 0 e 0 216 237 230 260 44.632 125.685 8.249 1 U 5.86e+06 0 e 0 1452 1463 1456 261 43.794 127.306 8.396 1 U 1.85e+07 0 e 0 273 284 277 262 43.675 122.900 8.884 1 U 8.27e+06 0 e 0 953 980 971 263 43.689 118.459 6.991 1 U 1.95e+07 0 e 0 953 964 957 264 43.641 117.765 8.595 1 U 7.5e+06 0 e 0 16 27 20 265 43.754 113.126 7.797 1 U 8.42e+06 0 e 0 273 292 288 266 43.537 85.119 7.267 1 U -3.82e+07 0 e 0 968 981 977 267 43.385 129.562 7.905 1 U 8.4e+06 0 e 0 0 0 0 268 43.440 127.609 7.688 1 U 5.66e+06 0 e 0 0 0 0 269 43.390 108.990 7.915 1 U 8.46e+06 0 e 0 1032 1048 1045 270 43.291 123.524 8.787 1 U -5.49e+06 0 e 0 95 113 106 271 43.366 117.980 7.044 1 U 3.55e+07 0 e 0 1032 1041 1036 272 43.292 111.320 9.411 1 U -7.08e+07 0 e 0 95 99 96 273 43.172 99.235 7.477 1 U 8.34e+06 0 e 0 202 213 210 274 43.198 124.171 8.014 1 U 1.25e+07 0 e 0 1089 1109 1105 275 43.219 118.791 9.196 1 U 2.02e+07 0 e 0 1089 1100 1093 276 43.199 116.441 7.502 1 U 1.54e+07 0 e 0 202 207 203 277 43.085 123.610 7.337 1 U 1.18e+07 0 e 0 227 237 230 278 43.048 119.303 9.106 1 U 7e+06 0 e 0 227 248 243 279 42.900 128.341 8.226 1 U 7.43e+06 0 e 0 0 0 0 280 42.912 126.776 9.328 1 U 1.14e+07 0 e 0 648 673 666 281 42.928 113.364 7.733 1 U 4.6e+07 0 e 0 648 659 652 282 42.816 131.918 8.700 1 U 9.15e+06 0 e 0 1260 1278 1275 283 42.753 128.766 9.168 1 U 1.29e+07 0 e 0 1260 1271 1264 284 42.851 119.444 8.856 1 U 1.2e+07 0 e 0 1444 1449 1445 285 42.668 119.836 8.672 1 U 5.03e+06 0 e 0 369 386 382 286 42.614 115.860 6.738 1 U 1.47e+07 0 e 0 369 377 372 287 42.536 127.703 8.242 1 U 8.71e+06 0 e 0 841 852 845 288 42.525 121.196 7.116 1 U 4.08e+07 0 e 0 758 769 762 289 42.532 111.667 7.873 1 U 7.42e+06 0 e 0 841 863 857 290 42.375 127.039 7.890 1 U 1.42e+07 0 e 0 1542 1558 1554 291 42.420 120.946 8.823 1 U 6.55e+06 0 e 0 758 783 775 292 42.260 123.809 8.159 1 U 5.82e+06 0 e 0 0 0 0 293 42.258 122.778 8.139 1 U 5.11e+06 0 e 0 0 0 0 294 42.270 121.114 7.889 1 U 7.71e+06 0 e 0 0 0 0 295 42.133 125.497 8.495 1 U 1.05e+07 0 e 0 1480 1491 1484 296 42.111 114.242 7.250 1 U 7.68e+06 0 e 0 315 326 319 297 41.967 125.110 8.918 1 U 7.73e+06 0 e 0 429 440 433 298 41.988 118.833 8.377 1 U 1.01e+07 0 e 0 550 568 565 299 41.908 120.794 8.119 1 U 5.34e+06 0 e 0 1528 1539 1532 300 41.879 119.588 8.073 1 U 8.4e+06 0 e 0 1508 1513 1509 301 41.895 119.537 8.118 1 U 2.74e+07 0 e 0 550 561 554 302 41.574 124.149 8.016 1 U 3.27e+07 0 e 0 1104 1109 1105 303 41.596 124.080 7.977 1 U 4.8e+06 0 e 0 0 0 0 304 41.588 114.455 8.028 1 U 1.2e+07 0 e 0 876 881 877 305 41.473 121.614 7.759 1 U 2.01e+07 0 e 0 1104 1123 1116 306 41.463 118.594 8.983 1 U 2.95e+07 0 e 0 1321 1328 1324 307 41.495 118.177 8.366 1 U 1.41e+07 0 e 0 51 56 52 308 41.342 116.051 7.613 1 U 2.5e+07 0 e 0 194 199 195 309 41.413 115.908 8.928 1 U 9.36e+06 0 e 0 1321 1339 1335 310 41.186 127.816 8.484 1 U 1.07e+07 0 e 0 702 714 711 311 41.257 125.875 8.984 1 U 5.19e+06 0 e 0 1161 1166 1162 312 41.270 120.156 8.256 1 U 7.22e+06 0 e 0 0 0 0 313 41.206 119.296 8.527 1 U -3.19e+05 0 e 0 702 707 703 314 40.970 129.488 9.106 1 U 1.26e+07 0 e 0 59 70 63 315 41.058 120.493 8.068 1 U 7.34e+06 0 e 0 0 0 0 316 41.081 118.154 8.269 1 U 1.84e+07 0 e 0 1161 1178 1173 317 40.962 122.652 8.048 1 U 8.63e+06 0 e 0 1112 1131 1128 318 40.952 117.627 8.717 1 U 5.03e+06 0 e 0 59 79 75 319 40.803 117.520 7.713 1 U 1.43e+07 0 e 0 1241 1246 1242 320 40.740 125.742 8.496 1 U 6.31e+06 0 e 0 1466 1491 1484 321 40.739 121.082 7.741 1 U 3.41e+07 0 e 0 88 93 89 322 40.749 111.304 9.411 1 U 5.52e+06 0 e 0 88 99 96 323 40.544 124.312 7.928 1 U 6.19e+06 0 e 0 0 0 0 324 40.621 122.064 8.030 1 U 2.97e+07 0 e 0 724 731 727 325 40.629 113.047 8.605 1 U 1.2e+07 0 e 0 724 745 739 326 40.292 126.604 8.413 1 U 6.77e+06 0 e 0 1218 1227 1222 327 40.313 125.655 7.738 1 U 4.28e+07 0 e 0 0 0 0 328 40.373 125.468 7.674 1 U 9.3e+06 0 e 0 0 0 0 329 40.378 125.091 7.572 1 U 5.31e+06 0 e 0 0 0 0 330 40.370 117.955 8.653 1 U 9.97e+06 0 e 0 1134 1156 1150 331 40.324 117.870 7.324 1 U 4.92e+07 0 e 0 1134 1141 1137 332 40.182 119.882 8.672 1 U 1.14e+07 0 e 0 381 386 382 333 40.118 126.214 8.643 1 U 9.41e+06 0 e 0 473 489 486 334 40.096 118.854 8.024 1 U 4.36e+07 0 e 0 628 633 629 335 40.058 117.992 10.127 1 U 8.53e+06 0 e 0 628 644 638 336 40.039 116.466 8.055 1 U 3.53e+07 0 e 0 581 592 585 337 40.098 116.399 8.366 1 U 2.55e+07 0 e 0 473 480 476 338 39.679 119.399 7.343 1 U 4.38e+07 0 e 0 595 600 596 339 39.708 113.902 7.781 1 U 6.29e+07 0 e 0 451 456 452 340 39.685 108.924 8.174 1 U 9e+06 0 e 0 451 462 459 341 39.571 127.286 8.393 1 U 1.42e+07 0 e 0 265 284 277 342 39.610 124.146 9.000 1 U 2.19e+07 0 e 0 595 608 604 343 39.590 123.814 8.952 1 U 1.54e+07 0 e 0 265 270 266 344 39.513 109.499 7.858 1 U 9.73e+06 0 e 0 74 85 82 345 39.477 117.717 8.711 1 U 2.74e+07 0 e 0 74 79 75 346 39.304 128.034 9.816 1 U 4.41e+07 0 e 0 676 684 678 347 39.309 115.455 7.600 1 U 2.12e+07 0 e 0 676 692 689 348 38.991 113.360 7.731 1 U 1.27e+07 0 e 0 636 659 652 349 38.945 117.955 10.130 1 U 4.36e+07 0 e 0 636 644 638 350 38.902 111.931 7.537 1 U -4.6e+06 0 e 0 636 645 643 351 38.619 119.645 8.452 1 U 4.7e+06 0 e 0 1516 1524 1518 352 38.534 125.257 8.187 1 U 8.07e+06 0 e 0 0 0 0 353 38.551 120.280 7.884 1 U 7.12e+06 0 e 0 0 0 0 354 38.350 126.570 8.417 1 U 1.27e+07 0 e 0 1210 1227 1222 355 38.260 127.872 9.243 1 U 1.14e+07 0 e 0 1052 1077 1069 356 38.279 121.340 8.205 1 U 2.85e+07 0 e 0 1052 1063 1056 357 38.262 119.718 7.740 1 U 1.36e+07 0 e 0 994 1005 998 358 38.265 118.225 8.587 1 U 1.36e+07 0 e 0 994 1017 1011 359 37.849 120.665 8.449 1 U 3.74e+07 0 e 0 1181 1189 1183 360 37.868 119.954 8.534 1 U 1.21e+07 0 e 0 1181 1206 1198 361 37.845 112.481 10.192 1 U 1.11e+07 0 e 0 301 312 309 362 37.771 127.661 8.243 1 U 6.87e+06 0 e 0 833 852 845 363 37.792 124.766 8.815 1 U 1.27e+07 0 e 0 833 838 834 364 37.792 117.125 7.748 1 U 4.15e+07 0 e 0 301 306 302 365 37.697 115.426 7.791 1 U 2.5e+07 0 e 0 1425 1435 1428 366 37.754 107.469 8.928 1 U 6.42e+06 0 e 0 1425 1441 1438 367 37.610 107.687 7.412 1 U 1.21e+07 0 e 0 611 624 623 368 37.539 116.678 7.893 1 U 4.95e+07 0 e 0 611 619 613 369 37.102 116.629 7.575 1 U 1.05e+07 0 e 0 1366 1374 1368 370 37.140 107.932 8.218 1 U 1.21e+07 0 e 0 1366 1381 1378 371 37.050 107.265 7.550 1 U 1.03e+07 0 e 0 287 298 295 372 37.049 113.107 7.798 1 U 5.03e+07 0 e 0 287 292 288 373 36.973 111.693 7.879 1 U 3.91e+07 0 e 0 855 863 857 374 36.850 117.521 7.981 1 U 1.07e+07 0 e 0 930 950 944 375 36.753 111.415 8.502 1 U 2e+07 0 e 0 930 938 932 376 36.431 119.399 9.103 1 U 1.51e+07 0 e 0 240 248 243 377 35.941 118.019 8.653 1 U 3.04e+07 0 e 0 1146 1156 1150 378 35.762 128.118 9.812 1 U 8.57e+06 0 e 0 662 684 678 379 35.775 126.717 9.329 1 U 1.91e+07 0 e 0 662 673 666 380 35.724 113.904 8.338 1 U 8.08e+06 0 e 0 137 145 140 381 34.640 119.848 8.531 1 U 2.67e+07 0 e 0 1194 1206 1198 382 34.635 115.469 7.789 1 U 1.29e+07 0 e 0 1409 1435 1428 383 34.594 117.130 8.806 1 U 3.39e+07 0 e 0 1409 1421 1413 384 34.479 111.305 7.528 1 U -4.87e+06 0 e 0 1068 1078 1074 385 34.233 123.853 8.954 1 U 8.72e+06 0 e 0 251 270 266 386 34.269 121.510 9.372 1 U 1.21e+07 0 e 0 1292 1301 1295 387 34.102 127.031 9.106 1 U 2.19e+07 0 e 0 1342 1352 1346 388 34.172 120.990 8.826 1 U 2.05e+07 0 e 0 772 783 775 389 34.111 113.486 8.915 1 U 1.64e+07 0 e 0 1342 1363 1359 390 33.922 120.615 8.442 1 U 8.71e+06 0 e 0 1170 1189 1183 391 33.614 119.419 9.078 1 U 2.16e+07 0 e 0 787 795 790 392 33.949 118.153 8.269 1 U 1.74e+07 0 e 0 1170 1178 1173 393 33.871 111.720 7.748 1 U -7.94e+06 0 e 0 738 746 744 394 33.866 111.502 7.059 1 U -7.23e+06 0 e 0 738 746 743 395 33.799 129.282 9.534 1 U 5.48e+06 0 e 0 787 814 804 396 33.582 122.881 8.883 1 U 1.71e+07 0 e 0 967 980 971 397 33.518 128.422 8.721 1 U 8.66e+06 0 e 0 412 425 416 398 33.532 113.654 9.414 1 U 1.09e+07 0 e 0 967 991 987 399 33.345 117.671 8.578 1 U 5.32e+06 0 e 0 3 27 20 400 33.056 118.260 8.386 1 U 1.63e+07 0 e 0 492 500 496 401 33.001 127.648 8.344 1 U 5.81e+06 0 e 0 329 340 333 402 32.464 108.928 8.211 1 U 6.28e+06 0 e 0 1066 1086 1082 403 32.399 127.888 9.246 1 U 1.09e+07 0 e 0 1066 1077 1069 404 32.288 121.418 9.377 1 U 8.23e+06 0 e 0 1281 1301 1295 405 32.250 116.028 7.125 1 U 1.64e+07 0 e 0 1281 1289 1283 406 32.073 129.146 9.534 1 U 8.24e+06 0 e 0 798 814 804 407 31.849 125.638 7.738 1 U -5.61e+05 0 e 0 0 0 0 408 31.544 127.972 8.715 1 U 5.33e+06 0 e 0 798 829 821 409 31.421 107.604 9.947 1 U 5.75e+06 0 e 0 507 522 519 410 31.339 108.973 7.118 1 U 2e+07 0 e 0 507 516 510 411 31.116 127.071 7.890 1 U 3.82e+07 0 e 0 1553 1558 1554 412 31.150 126.502 7.747 1 U 8.57e+06 0 e 0 0 0 0 413 31.222 124.766 8.818 1 U 1.06e+07 0 e 0 818 838 834 414 31.064 127.895 8.721 1 U 5.11e+06 0 e 0 818 829 821 415 31.092 113.110 8.169 1 U 5.67e+06 0 e 0 116 134 130 416 30.964 128.356 8.223 1 U 1.21e+07 0 e 0 0 0 0 417 30.209 117.528 7.980 1 U 1.92e+07 0 e 0 942 950 944 418 29.709 116.450 8.055 1 U 1.18e+07 0 e 0 571 592 585 419 29.674 115.361 6.994 1 U 4.74e+07 0 e 0 571 577 573 420 29.351 121.449 8.121 1 U 4.77e+07 0 e 0 1009 1029 1023 421 29.465 118.279 8.588 1 U 4.14e+07 0 e 0 1009 1017 1011 422 29.491 117.962 7.043 1 U 1.01e+07 0 e 0 1021 1041 1036 423 28.088 114.497 7.971 1 U 7.97e+06 0 e 0 736 755 751 424 28.097 113.073 8.604 1 U 2.83e+07 0 e 0 736 745 739 425 28.094 111.787 7.749 1 U 9.77e+06 0 e 0 736 746 744 426 28.079 111.686 7.057 1 U 7.37e+06 0 e 0 736 746 743 427 27.556 123.050 8.616 1 U 5.01e+06 0 e 0 908 927 924 428 27.524 85.152 7.268 1 U 3.58e+07 0 e 0 969 981 977 429 27.485 128.333 7.774 1 U 8.66e+06 0 e 0 908 918 910 430 27.434 113.406 7.975 1 U 9.11e+06 0 e 0 867 873 869 431 26.331 113.469 6.982 1 U 5.2e+06 0 e 0 0 0 0 432 24.345 119.124 8.955 1 U 1.39e+07 0 e 0 30 48 41 433 24.262 124.154 9.344 1 U 8.6e+06 0 e 0 30 34 31 434 22.450 125.034 8.316 1 U 4.8e+07 0 e 0 1402 1406 1403 435 22.425 117.123 8.806 1 U 1.69e+07 0 e 0 1402 1421 1413 436 20.313 122.068 8.028 1 U 1.63e+07 0 e 0 717 731 727 437 20.308 116.600 9.549 1 U 4.67e+07 0 e 0 717 721 718 438 20.136 125.305 8.334 1 U 6.12e+06 0 e 0 187 191 188 439 20.006 116.115 7.611 1 U 7.81e+06 0 e 0 187 199 195 440 19.588 132.007 8.698 1 U 1.54e+07 0 e 0 1274 1278 1275 441 19.577 115.983 7.119 1 U 5.95e+06 0 e 0 1274 1289 1283 442 19.470 126.270 8.643 1 U 2.88e+07 0 e 0 485 489 486 443 19.457 118.256 8.386 1 U 2.02e+07 0 e 0 485 500 496 444 18.499 127.791 8.486 1 U 1.66e+07 0 e 0 710 714 711 445 18.562 122.927 8.055 1 U 5.87e+07 0 e 0 1127 1131 1128 446 18.526 117.854 7.318 1 U 4.6e+07 0 e 0 1127 1141 1137 447 18.540 116.619 9.548 1 U 1.15e+07 0 e 0 710 721 718 448 18.462 123.055 8.619 1 U 1.24e+07 0 e 0 923 927 924 449 18.470 119.589 8.117 1 U 1.23e+07 0 e 0 543 561 554 450 18.446 111.364 8.503 1 U 4.85e+06 0 e 0 923 938 932 451 18.332 119.285 8.524 1 U 1.32e+07 0 e 0 695 707 703 452 18.098 126.255 10.224 1 U 1.21e+07 0 e 0 444 448 445 453 18.096 113.947 7.782 1 U 1.4e+07 0 e 0 444 456 452 454 18.054 118.906 8.378 1 U 4.15e+07 0 e 0 564 568 565 455 18.023 115.400 6.994 1 U 1.49e+07 0 e 0 564 577 573 456 17.778 124.784 8.734 1 U 8.95e+06 0 e 0 536 540 537 457 17.821 115.551 7.600 1 U 3.56e+07 0 e 0 688 692 689 458 51.667 128.045 9.815 1 U -2.69e+07 0 e 0 675 684 678 459 41.391 129.503 9.108 1 U 1.29e+07 0 e 0 51 70 63 460 52.809 99.265 7.476 1 U -4.06e+06 0 e 0 201 213 210 461 68.875 128.545 8.725 1 U -7.38e+05 0 e 0 403 425 416 462 64.446 128.435 8.721 1 U -3.3e+06 0 e 0 402 425 416 463 52.964 127.886 8.716 1 U 3.07e+05 0 e 0 797 829 821 464 58.307 127.707 8.354 1 U -5.09e+06 0 e 0 314 340 333 465 42.175 127.910 8.356 1 U -3.56e+05 0 e 0 315 340 333 466 52.890 127.595 8.244 1 U -2.45e+06 0 e 0 832 852 845 467 41.984 126.350 10.226 1 U 4.74e+06 0 e 0 429 448 445 468 42.849 125.577 8.248 1 U 3.78e+06 0 e 0 1444 1463 1456 469 53.867 125.582 8.492 1 U -5.97e+06 0 e 0 1465 1491 1484 470 58.473 125.306 8.334 1 U -2.06e+06 0 e 0 178 191 188 471 55.409 124.236 9.338 1 U -4.22e+06 0 e 0 15 34 31 472 54.127 123.704 7.330 1 U -5.54e+06 0 e 0 215 237 230 473 53.650 122.824 8.879 1 U -8.51e+06 0 e 0 952 980 971 474 40.650 122.659 9.250 1 U 2.69e+06 0 e 0 1466 1477 1470 475 53.823 122.676 9.249 1 U -3.08e+06 0 e 0 1465 1477 1470 476 44.693 122.622 9.243 1 U 2.78e+06 0 e 0 1452 1477 1470 477 52.859 122.663 9.251 1 U -2.4e+06 0 e 0 1451 1477 1470 478 54.953 121.559 9.373 1 U -9.13e+06 0 e 0 1280 1301 1295 479 29.479 121.449 8.121 1 U 5.09e+07 0 e 0 1021 1029 1023 480 33.346 121.362 5.905 1 U 3.54e+06 0 e 0 168 176 171 481 55.325 119.876 8.531 1 U -5.15e+07 0 e 0 1193 1206 1198 482 40.211 119.404 7.349 1 U 1.37e+07 0 e 0 581 600 596 483 18.280 118.923 7.485 1 U 4.87e+07 0 e 0 695 699 696 484 30.217 118.477 6.994 1 U 3.5e+06 0 e 0 942 964 957 485 56.511 118.574 6.994 1 U -4.63e+06 0 e 0 941 964 957 486 59.382 118.295 8.583 1 U -3.17e+07 0 e 0 993 1017 1011 487 53.151 117.817 10.124 1 U -4.24e+06 0 e 0 627 644 638 488 18.526 117.854 7.318 1 U 4.6e+07 0 e 0 543 547 544 489 54.608 117.867 7.318 1 U -7.74e+06 0 e 0 542 547 544 490 55.394 117.888 8.589 1 U -9.14e+06 0 e 0 15 27 20 491 41.017 117.738 8.828 1 U 3.95e+06 0 e 0 1241 1257 1253 492 52.161 117.661 8.849 1 U -3.15e+06 0 e 0 1240 1257 1253 493 45.066 117.465 7.712 1 U -6.68e+06 0 e 0 1234 1246 1242 494 46.693 116.615 7.967 1 U -4e+06 0 e 0 389 399 395 495 39.301 116.583 7.973 1 U 3.49e+06 0 e 0 394 399 395 496 58.056 116.453 8.365 1 U -1.2e+07 0 e 0 464 480 476 497 41.358 116.552 7.510 1 U 3.14e+06 0 e 0 194 207 203 498 55.499 116.066 7.124 1 U -8.45e+06 0 e 0 1273 1289 1283 499 30.486 115.962 6.728 1 U 3.24e+06 0 e 0 358 377 372 500 56.822 115.941 6.733 1 U -3.89e+06 0 e 0 357 377 372 501 45.494 114.181 7.252 1 U -3.24e+06 0 e 0 308 326 319 502 72.921 113.835 8.343 1 U 3.04e+06 0 e 0 128 145 140 503 37.042 113.503 7.976 1 U 3.55e+06 0 e 0 855 873 869 504 56.704 113.065 8.161 1 U -4.13e+06 0 e 0 115 134 130 505 44.774 113.303 6.987 1 U -6.03e+06 0 e 0 0 0 0 506 71.074 111.653 8.131 1 U 1.2e+07 0 e 0 1384 1399 1395 507 51.687 107.102 7.548 1 U -4.78e+06 0 e 0 286 298 295 508 19.948 122.959 8.385 1 U 3.67e+06 0 e 0 1494 1505 1502 509 52.735 122.811 8.377 1 U -2.16e+05 0 e 0 1493 1505 1502 510 51.537 122.868 8.391 1 U -5.44e+06 0 e 0 1500 1505 1502 511 21.669 123.006 8.404 1 U 3.89e+06 0 e 0 1501 1505 1502 512 53.232 128.171 9.585 1 U -2.15e+06 0 e 0 899 905 901 513 62.984 128.332 9.598 1 U 3.72e+06 0 e 0 900 905 901 514 59.296 128.163 9.604 1 U -2.22e+06 0 e 0 887 905 901 515 63.271 133.459 9.858 1 U -3.27e+06 0 e 0 101 124 118 516 56.818 133.314 9.866 1 U -3.3e+06 0 e 0 115 124 118 517 31.046 133.399 9.849 1 U 2.85e+06 0 e 0 116 124 118 518 54.761 112.128 6.801 1 U 4.32e+06 0 e 0 1180 1190 1187 519 37.686 112.076 6.803 1 U -2.03e+06 0 e 0 1181 1190 1187 520 38.786 111.825 6.661 1 U -4.02e+06 0 e 0 636 645 642 521 32.408 111.219 7.527 1 U 4.96e+06 0 e 0 1066 1078 1074 522 60.805 111.237 7.548 1 U -2.23e+06 0 e 0 0 0 0 523 70.686 111.156 7.556 1 U 2.32e+06 0 e 0 0 0 0 524 32.517 111.033 6.842 1 U 3.29e+06 0 e 0 1066 1078 1073 525 34.440 110.815 6.849 1 U -2.95e+06 0 e 0 1068 1078 1073 526 42.121 124.731 7.512 1 U 2.35e+06 0 e 0 0 0 0 527 55.090 124.801 7.504 1 U -2.46e+06 0 e 0 0 0 0 528 33.240 124.742 7.509 1 U 3.97e+06 0 e 0 0 0 0 529 54.289 125.883 8.986 1 U -3.17e+06 0 e 0 1145 1166 1162 530 35.997 125.683 8.989 1 U 2.61e+06 0 e 0 1146 1166 1162 531 54.584 120.101 8.268 1 U -2.79e+06 0 e 0 0 0 0 532 54.752 119.294 9.115 1 U -4.17e+06 0 e 0 226 248 243 533 34.323 119.891 9.351 1 U 5.59e+06 0 e 0 1292 1309 1306 534 19.295 123.369 7.979 1 U 4.47e+06 0 e 0 0 0 0 535 52.646 123.375 7.982 1 U -4.47e+06 0 e 0 0 0 0 536 55.115 128.416 8.228 1 U -8e+06 0 e 0 0 0 0 537 68.646 116.663 7.575 1 U 2.24e+06 0 e 0 1357 1374 1368 538 53.153 119.206 8.524 1 U -7.54e+06 0 e 0 694 707 703 539 34.021 127.566 7.934 1 U 3.89e+06 0 e 0 0 0 0 540 64.201 129.722 7.913 1 U 4.06e+06 0 e 0 0 0 0 541 20.147 129.825 7.762 1 U 4.81e+06 0 e 0 0 0 0 542 43.413 129.657 7.778 1 U 4.4e+06 0 e 0 0 0 0 543 20.180 130.401 7.787 1 U 8.55e+06 0 e 0 0 0 0 544 20.256 130.457 7.739 1 U 4.73e+06 0 e 0 0 0 0 545 53.706 130.254 7.735 1 U -5.91e+06 0 e 0 0 0 0 546 31.623 130.209 7.920 1 U 6.1e+06 0 e 0 0 0 0 547 19.899 124.771 8.521 1 U 4.05e+06 0 e 0 1494 1498 1495 548 52.328 122.360 8.034 1 U -1.01e+07 0 e 0 0 0 0 549 42.299 122.474 8.051 1 U 9.13e+06 0 e 0 0 0 0 550 42.235 122.890 8.039 1 U 5.12e+06 0 e 0 0 0 0 551 45.636 108.657 8.289 1 U -1.53e+07 0 e 0 0 0 0 552 61.021 125.219 8.191 1 U -9.13e+06 0 e 0 0 0 0 553 56.880 127.816 7.682 1 U -4.12e+06 0 e 0 0 0 0 554 37.502 123.702 8.774 1 U 2.97e+06 0 e 0 102 113 106 555 63.209 123.600 8.773 1 U -4.77e+06 0 e 0 101 113 106 556 60.105 122.352 7.901 1 U -2.97e+06 0 e 0 0 0 0 557 54.878 128.843 7.983 1 U -3.43e+06 0 e 0 0 0 0 558 40.540 128.848 7.983 1 U 4.22e+06 0 e 0 0 0 0 559 54.353 119.122 8.171 1 U -2.6e+06 0 e 0 0 0 0 560 41.141 118.891 8.171 1 U 3.66e+06 0 e 0 0 0 0 561 45.449 120.240 7.945 1 U -2.91e+06 0 e 0 0 0 0 562 38.798 120.134 7.942 1 U 3.51e+06 0 e 0 0 0 0 563 61.141 120.230 7.941 1 U -3.2e+06 0 e 0 0 0 0 564 36.357 119.410 8.516 1 U 3.33e+06 0 e 0 0 0 0 565 18.359 119.346 8.530 1 U 1.21e+07 0 e 0 0 0 0 566 56.007 119.404 8.526 1 U -1.11e+07 0 e 0 250 262 254 567 59.291 113.906 8.338 1 U -1.06e+07 0 e 0 127 145 140 568 40.908 121.614 7.755 1 U 2.02e+07 0 e 0 1112 1123 1116 569 17.899 117.860 7.314 1 U 1.47e+07 0 e 0 536 547 544 570 54.980 117.854 7.324 1 U -2.2e+07 0 e 0 535 547 544 571 34.241 119.410 9.077 1 U 1.6e+07 0 e 0 772 795 790 572 56.956 124.715 8.764 1 U -1.89e+06 0 e 0 328 346 342 573 32.829 124.711 8.777 1 U 2.44e+06 0 e 0 329 346 342 574 64.926 124.689 8.730 1 U -2.88e+06 0 e 0 525 540 537 575 38.232 124.652 8.733 1 U 1.61e+06 0 e 0 526 540 537 576 52.097 118.060 8.365 1 U -1.69e+07 0 e 0 50 56 52 577 33.500 125.071 8.915 1 U 3.01e+06 0 e 0 412 440 433 578 56.105 125.057 8.910 1 U -2.1e+06 0 e 0 411 440 433 579 56.755 114.247 8.044 1 U -2.82e+06 0 e 0 866 881 877 580 57.133 108.966 8.210 1 U -4.91e+07 0 e 0 1080 1086 1082 581 55.202 121.594 7.757 1 U -3.2e+07 0 e 0 1111 1123 1116 582 54.746 119.876 8.534 1 U -1.19e+07 0 e 0 1180 1206 1198 583 37.975 112.092 7.534 1 U -2.68e+06 0 e 0 1181 1190 1188 584 55.241 111.692 7.536 1 U 6.01e+06 0 e 0 635 645 643 585 54.722 112.092 7.536 1 U 5.01e+06 0 e 0 1180 1190 1188 586 30.504 114.756 7.613 1 U 3.35e+06 0 e 0 358 366 360 587 56.759 114.832 7.625 1 U -2.28e+06 0 e 0 357 366 360 588 49.564 119.460 8.496 1 U 6.14e+05 0 e 0 0 0 0 589 55.492 122.515 8.128 1 U -3.41e+06 0 e 0 0 0 0 590 36.457 119.514 8.543 1 U 4.59e+06 0 e 0 240 262 254 591 37.993 124.820 8.741 1 U 2.99e+06 0 e 0 0 0 0 592 54.823 124.695 8.752 1 U -4.8e+06 0 e 0 0 0 0 593 30.040 119.729 8.306 1 U 4.53e+06 0 e 0 0 0 0 594 52.706 119.536 8.312 1 U -2.5e+06 0 e 0 0 0 0 595 19.270 119.688 8.290 1 U 2.43e+06 0 e 0 0 0 0 596 56.630 120.009 8.304 1 U -2.69e+06 0 e 0 0 0 0 597 40.281 113.139 8.919 1 U 2.77e+06 0 e 0 0 0 0 598 40.259 113.101 8.974 1 U 2.11e+06 0 e 0 0 0 0 599 64.695 113.087 8.951 1 U -2.54e+06 0 e 0 0 0 0 600 53.959 116.561 7.957 1 U -2.09e+06 0 e 0 393 399 395 601 34.795 110.188 6.433 1 U -2.43e+06 0 e 0 0 0 0 602 34.714 110.391 6.423 1 U -1.74e+06 0 e 0 0 0 0 603 31.164 110.290 6.426 1 U 1.77e+06 0 e 0 0 0 0 604 45.090 106.446 8.674 1 U -4.45e+06 0 e 0 1234 1238 1235 605 54.379 121.690 8.273 1 U -2.38e+06 0 e 0 0 0 0 606 44.387 124.569 8.783 1 U 1.88e+06 0 e 0 0 0 0 607 33.426 124.530 8.797 1 U 1.76e+06 0 e 0 0 0 0 608 56.871 124.509 8.784 1 U -1.52e+06 0 e 0 0 0 0 609 38.550 111.789 6.834 1 U -1.93e+06 0 e 0 1516 1525 1522 610 53.397 111.707 6.838 1 U 3.03e+06 0 e 0 1515 1525 1522 611 53.622 111.914 7.501 1 U 2.73e+06 0 e 0 1515 1525 1523 612 68.927 117.543 7.828 1 U 3.86e+06 0 e 0 403 409 405 613 31.380 124.773 8.770 1 U 2.3e+06 0 e 0 0 0 0 614 33.963 126.841 9.017 1 U 2.35e+06 0 e 0 0 0 0 615 20.480 112.170 8.310 1 U 1.4e+06 0 e 0 0 0 0 616 20.193 111.656 8.355 1 U 2.42e+06 0 e 0 0 0 0 617 55.053 112.027 8.319 1 U -1.93e+06 0 e 0 0 0 0 618 45.124 117.916 7.874 1 U -1.93e+06 0 e 0 0 0 0 619 64.118 109.654 8.079 1 U -2.09e+06 0 e 0 0 0 0 620 47.911 113.052 7.852 1 U 2.5e+06 0 e 0 0 0 0 621 40.413 121.425 8.721 1 U 2.1e+06 0 e 0 0 0 0 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . CO 13 CO . . 20 ppm . . . . . . 28058 2 2 . . N 15 NH . . 30 ppm . . . . . . 28058 2 3 . . HN 1 HN . . 14 ppm . . . . . . 28058 2 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $SPARKY . . 28058 2 stop_ save_ save_spectral_peak_list_3 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_3 _Spectral_peak_list.Entry_ID 28058 _Spectral_peak_list.ID 3 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 3 _Spectral_peak_list.Experiment_name '3D HBHA(CO)NH' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 3 1 53.846 132.053 8.699 1 U 2.46e+07 0 e 0 1259 1278 1275 2 42.737 132.003 8.703 1 U 3.73e+07 0 e 0 1260 1278 1275 3 41.476 129.527 9.110 1 U 6.81e+07 0 e 0 51 70 63 4 52.075 129.507 9.111 1 U 2.92e+07 0 e 0 50 70 63 5 52.831 99.166 7.482 1 U 2.95e+07 0 e 0 201 213 210 6 43.147 99.168 7.481 1 U 6.32e+07 0 e 0 202 213 210 7 33.591 129.171 9.533 1 U 1.67e+07 0 e 0 787 814 804 8 60.918 129.131 9.535 1 U 2.56e+07 0 e 0 786 814 804 9 61.716 128.781 9.169 1 U 2.63e+07 0 e 0 1250 1271 1264 10 72.644 128.767 9.169 1 U 3.81e+07 0 e 0 1251 1271 1264 11 64.404 128.445 8.725 1 U 2.39e+07 0 e 0 402 425 416 12 68.939 128.372 8.726 1 U 2.37e+07 0 e 0 403 425 416 13 63.128 128.444 7.774 1 U 7.06e+06 0 e 0 900 918 910 14 53.382 128.444 7.768 1 U 2.29e+06 0 e 0 899 918 910 15 35.705 128.032 9.817 1 U 3.1e+07 0 e 0 662 684 678 16 56.851 128.042 9.816 1 U 5.01e+07 0 e 0 661 684 678 17 38.251 127.876 9.245 1 U 2.11e+07 0 e 0 1052 1077 1069 18 63.205 127.859 9.246 1 U 4.02e+07 0 e 0 1051 1077 1069 19 32.052 127.824 8.712 1 U 2.59e+07 0 e 0 798 829 821 20 52.871 127.840 8.714 1 U 1.82e+07 0 e 0 797 829 821 21 41.197 127.808 8.486 1 U 4.37e+07 0 e 0 702 714 711 22 54.836 127.811 8.485 1 U 3.56e+07 0 e 0 701 714 711 23 42.111 127.716 8.356 1 U 1.37e+07 0 e 0 315 340 333 24 58.320 127.778 8.354 1 U 2.58e+07 0 e 0 314 340 333 25 52.714 127.601 8.247 1 U 1.72e+07 0 e 0 832 852 845 26 37.732 127.612 8.250 1 U 4.34e+07 0 e 0 833 852 845 27 53.215 127.259 8.397 1 U 4.22e+07 0 e 0 264 284 277 28 39.540 127.312 8.397 1 U 1.02e+08 0 e 0 265 284 277 29 55.253 127.028 7.890 1 U 1.13e+08 0 e 0 1541 1558 1554 30 42.466 127.027 7.891 1 U 1.3e+08 0 e 0 1542 1558 1554 31 62.107 126.994 9.109 1 U 4.03e+07 0 e 0 1332 1352 1346 32 70.583 127.013 9.110 1 U 5.31e+07 0 e 0 1333 1352 1346 33 42.808 126.709 9.331 1 U 4.37e+07 0 e 0 648 673 666 34 59.521 126.706 9.330 1 U 5.73e+07 0 e 0 647 673 666 35 38.370 126.577 8.418 1 U 5.86e+07 0 e 0 1210 1227 1222 36 54.045 126.573 8.418 1 U 2.55e+07 0 e 0 1209 1227 1222 37 42.409 126.516 7.747 1 U 1.47e+07 0 e 0 0 0 0 38 55.142 126.608 7.746 1 U 1.46e+07 0 e 0 0 0 0 39 41.887 126.297 10.221 1 U 2.15e+07 0 e 0 429 448 445 40 53.778 126.292 10.220 1 U 3.17e+07 0 e 0 428 448 445 41 40.099 126.231 8.643 1 U 4.52e+07 0 e 0 473 489 486 42 58.362 126.211 8.644 1 U 4e+07 0 e 0 472 489 486 43 42.767 125.631 8.248 1 U 2.35e+07 0 e 0 1444 1463 1456 44 53.696 125.590 8.255 1 U 1.4e+07 0 e 0 1443 1463 1456 45 55.907 125.611 7.739 1 U 7.82e+07 0 e 0 0 0 0 46 31.864 125.637 7.737 1 U 2.88e+07 0 e 0 0 0 0 47 40.689 125.631 8.496 1 U 4.64e+07 0 e 0 1466 1491 1484 48 53.795 125.595 8.496 1 U 3.27e+07 0 e 0 1465 1491 1484 49 72.038 125.000 8.317 1 U 7.43e+07 0 e 0 1393 1406 1403 50 59.803 124.945 8.319 1 U 5.99e+07 0 e 0 1392 1406 1403 51 63.727 125.245 8.331 1 U 3e+07 0 e 0 179 191 188 52 58.591 125.300 8.326 1 U 1.61e+07 0 e 0 178 191 188 53 33.379 125.099 8.919 1 U 3.86e+07 0 e 0 412 440 433 54 56.104 125.145 8.918 1 U 2.35e+07 0 e 0 411 440 433 55 31.228 124.799 8.816 1 U 4.65e+07 0 e 0 818 838 834 56 54.167 124.843 8.815 1 U 2.97e+07 0 e 0 817 838 834 57 64.859 124.689 8.729 1 U 4.04e+06 0 e 0 525 540 537 58 38.206 124.681 8.732 1 U 1.95e+07 0 e 0 526 540 537 59 39.557 124.204 9.001 1 U 1.4e+08 0 e 0 595 608 604 60 53.398 124.137 9.001 1 U 4.9e+07 0 e 0 594 608 604 61 55.355 124.201 9.349 1 U 1.89e+07 0 e 0 15 34 31 62 43.726 124.133 9.348 1 U 2.23e+07 0 e 0 16 34 31 63 43.257 124.253 8.015 1 U 4.57e+07 0 e 0 1089 1109 1105 64 53.904 124.142 8.017 1 U 5.75e+07 0 e 0 1088 1109 1105 65 34.258 123.753 8.957 1 U 3.01e+07 0 e 0 251 270 266 66 56.074 123.700 8.956 1 U 3.16e+07 0 e 0 250 270 266 67 44.772 123.579 7.338 1 U 2.83e+07 0 e 0 216 237 230 68 54.000 123.600 7.336 1 U 2.59e+07 0 e 0 215 237 230 69 58.422 123.080 8.617 1 U 2.34e+07 0 e 0 907 927 924 70 27.451 123.051 8.613 1 U 1.16e+07 0 e 0 908 927 924 71 40.933 122.852 8.055 1 U 6.58e+07 0 e 0 1112 1131 1128 72 55.238 122.918 8.055 1 U 7.57e+07 0 e 0 1111 1131 1128 73 43.705 122.845 8.883 1 U 4.92e+07 0 e 0 953 980 971 74 53.589 122.874 8.884 1 U 4.2e+07 0 e 0 952 980 971 75 44.674 122.621 9.249 1 U 1.16e+07 0 e 0 1452 1477 1470 76 52.857 122.676 9.249 1 U 1.1e+07 0 e 0 1451 1477 1470 77 20.283 122.068 8.031 1 U 1.56e+08 0 e 0 717 731 727 78 52.338 122.083 8.030 1 U 9.33e+07 0 e 0 716 731 727 79 41.564 121.676 7.760 1 U 1.17e+08 0 e 0 1104 1123 1116 80 55.041 121.612 7.759 1 U 5.33e+07 0 e 0 1103 1123 1116 81 32.253 121.476 9.379 1 U 3.42e+07 0 e 0 1281 1301 1295 82 55.029 121.442 9.375 1 U 5.16e+07 0 e 0 1280 1301 1295 83 29.414 121.416 8.122 1 U 8.34e+07 0 e 0 1009 1029 1023 84 59.821 121.424 8.124 1 U 1.09e+08 0 e 0 1008 1029 1023 85 54.701 121.379 5.914 1 U 5.76e+06 0 e 0 157 176 171 86 46.896 121.318 8.207 1 U 1.47e+08 0 e 0 1044 1063 1056 87 59.288 121.181 7.117 1 U 8.36e+07 0 e 0 749 769 762 88 64.573 121.179 7.117 1 U 1.19e+08 0 e 0 750 769 762 89 42.512 120.982 8.825 1 U 5.13e+07 0 e 0 758 783 775 90 54.904 121.004 8.825 1 U 5.1e+07 0 e 0 757 783 775 91 47.703 120.989 7.742 1 U 1.5e+08 0 e 0 81 93 89 92 33.941 120.631 8.452 1 U 3.38e+07 0 e 0 1170 1189 1183 93 62.176 120.681 8.453 1 U 7.65e+07 0 e 0 1169 1189 1183 94 45.207 119.951 9.101 1 U 5.98e+07 0 e 0 1305 1317 1313 95 45.694 120.054 8.491 1 U 7.66e+07 0 e 0 209 224 219 96 37.809 119.892 8.533 1 U 1.42e+08 0 e 0 1181 1206 1198 97 54.700 119.848 8.536 1 U 3.22e+07 0 e 0 1180 1206 1198 98 34.278 119.854 9.358 1 U 4.09e+07 0 e 0 1292 1309 1306 99 55.429 119.869 9.357 1 U 6.21e+07 0 e 0 1291 1309 1306 100 42.587 119.843 8.674 1 U 2.57e+07 0 e 0 369 386 382 101 53.231 119.834 8.674 1 U 3.03e+07 0 e 0 368 386 382 102 61.226 119.645 7.741 1 U 4.26e+07 0 e 0 984 1005 998 103 69.922 119.714 7.741 1 U 4.21e+07 0 e 0 985 1005 998 104 18.501 119.579 8.119 1 U 8.54e+07 0 e 0 543 561 554 105 54.494 119.606 8.120 1 U 6.13e+07 0 e 0 542 561 554 106 47.476 119.521 8.860 1 U 6.57e+07 0 e 0 1437 1449 1445 107 34.218 119.420 9.084 1 U 3.99e+07 0 e 0 772 795 790 108 52.888 119.482 9.084 1 U 5.33e+07 0 e 0 771 795 790 109 40.042 119.348 7.345 1 U 6.87e+07 0 e 0 581 600 596 110 55.048 119.320 7.344 1 U 8.72e+07 0 e 0 580 600 596 111 18.324 119.279 8.528 1 U 1.67e+08 0 e 0 695 707 703 112 53.094 119.260 8.528 1 U 1.07e+08 0 e 0 694 707 703 113 59.286 119.346 8.527 1 U 2.67e+07 0 e 0 239 262 254 114 24.255 119.158 8.960 1 U 8.93e+07 0 e 0 30 48 41 115 50.299 119.170 8.959 1 U 5.9e+07 0 e 0 29 48 41 116 17.856 118.921 7.486 1 U 1.75e+08 0 e 0 688 699 696 117 54.098 118.916 7.486 1 U 9.72e+07 0 e 0 687 699 696 118 56.941 118.892 8.379 1 U 7.74e+07 0 e 0 549 568 565 119 41.837 118.893 8.380 1 U 5.91e+07 0 e 0 550 568 565 120 47.911 118.841 8.027 1 U 1.52e+08 0 e 0 622 633 629 121 57.122 118.780 9.197 1 U 5.76e+07 0 e 0 1080 1100 1093 122 65.958 118.779 9.197 1 U 7.02e+07 0 e 0 1081 1100 1093 123 19.477 118.306 8.388 1 U 7.79e+07 0 e 0 485 500 496 124 52.118 118.360 8.388 1 U 4.8e+07 0 e 0 484 500 496 125 41.033 118.132 8.272 1 U 8.43e+07 0 e 0 1161 1178 1173 126 55.595 118.151 8.272 1 U 4.43e+07 0 e 0 1160 1178 1173 127 44.938 118.050 8.364 1 U 3.23e+07 0 e 0 37 56 52 128 41.108 118.298 8.330 1 U 1.7e+07 0 e 0 0 0 0 129 57.836 118.579 8.985 1 U 5.72e+07 0 e 0 1311 1328 1324 130 66.676 118.598 8.986 1 U 1.17e+08 0 e 0 1312 1328 1324 131 30.205 118.451 6.997 1 U 3.09e+07 0 e 0 942 964 957 132 56.542 118.475 6.997 1 U 4.62e+07 0 e 0 941 964 957 133 38.222 118.299 8.588 1 U 6.5e+07 0 e 0 994 1017 1011 134 59.426 118.316 8.588 1 U 9.28e+07 0 e 0 993 1017 1011 135 61.742 117.804 8.589 1 U -6.32e+05 0 e 0 2 27 20 136 33.308 117.734 8.591 1 U 2.24e+07 0 e 0 3 27 20 137 55.781 117.984 8.657 1 U 6.91e+07 0 e 0 1133 1156 1150 138 40.309 117.979 8.656 1 U 6.43e+07 0 e 0 1134 1156 1150 139 29.442 117.975 7.045 1 U 7.38e+07 0 e 0 1021 1041 1036 140 58.975 117.967 7.045 1 U 9.19e+07 0 e 0 1020 1041 1036 141 40.082 117.944 10.130 1 U 9.87e+07 0 e 0 628 644 638 142 53.085 117.919 10.130 1 U 4.03e+07 0 e 0 627 644 638 143 45.064 117.879 8.104 1 U 1.73e+08 0 e 0 458 470 466 144 54.804 117.867 7.315 1 U 7.42e+07 0 e 0 535 547 544 145 52.022 117.869 7.325 1 U 1.17e+08 0 e 0 1126 1141 1137 146 18.608 117.854 7.324 1 U 1.82e+08 0 e 0 1127 1141 1137 147 17.845 117.880 7.315 1 U 1.17e+08 0 e 0 536 547 544 148 40.849 117.755 8.713 1 U 5.11e+07 0 e 0 59 79 75 149 55.971 117.742 8.713 1 U 6.05e+07 0 e 0 58 79 75 150 40.727 117.630 8.819 1 U 2.43e+07 0 e 0 1241 1257 1253 151 50.579 117.128 8.807 1 U 7.48e+07 0 e 0 1401 1421 1413 152 22.437 117.129 8.807 1 U 1.28e+08 0 e 0 1402 1421 1413 153 21.528 117.583 8.816 1 U 6.25e+06 0 e 0 0 0 0 154 52.160 117.576 8.819 1 U 6.82e+06 0 e 0 1240 1257 1253 155 36.724 117.542 7.983 1 U 8.47e+07 0 e 0 930 950 944 156 54.518 117.581 7.982 1 U 5.04e+07 0 e 0 929 950 944 157 45.068 117.485 7.717 1 U 1.07e+08 0 e 0 1234 1246 1242 158 47.464 117.073 7.750 1 U 1.49e+08 0 e 0 294 306 302 159 60.811 116.628 7.893 1 U 8.03e+07 0 e 0 602 619 613 160 64.147 116.677 7.894 1 U 1.31e+08 0 e 0 603 619 613 161 55.577 116.606 9.550 1 U 9.34e+07 0 e 0 709 721 718 162 18.503 116.621 9.550 1 U 1.24e+08 0 e 0 710 721 718 163 29.696 116.495 8.057 1 U 8.1e+07 0 e 0 571 592 585 164 58.489 116.476 8.056 1 U 9.91e+07 0 e 0 570 592 585 165 46.784 116.485 7.979 1 U 1.98e+07 0 e 0 0 0 0 166 58.017 116.453 8.367 1 U 2.96e+07 0 e 0 464 480 476 167 64.307 116.452 8.367 1 U 4.13e+07 0 e 0 465 480 476 168 41.349 116.403 7.507 1 U 4.22e+07 0 e 0 194 207 203 169 56.303 116.384 7.511 1 U 2.83e+07 0 e 0 193 207 203 170 20.011 116.063 7.614 1 U 1.22e+08 0 e 0 187 199 195 171 51.664 115.576 7.600 1 U 4.13e+07 0 e 0 675 692 689 172 39.286 115.534 7.601 1 U 9.57e+07 0 e 0 676 692 689 173 54.634 116.037 7.613 1 U 7.55e+07 0 e 0 186 199 195 174 19.624 116.044 7.127 1 U 6.78e+07 0 e 0 1274 1289 1283 175 55.435 116.066 7.127 1 U 4.41e+07 0 e 0 1273 1289 1283 176 41.443 115.978 8.928 1 U 6.61e+07 0 e 0 1321 1339 1335 177 56.188 115.998 8.928 1 U 5.68e+07 0 e 0 1320 1339 1335 178 30.431 115.955 6.735 1 U 2.39e+07 0 e 0 358 377 372 179 56.742 115.957 6.737 1 U 3.14e+07 0 e 0 357 377 372 180 34.503 115.448 7.790 1 U 6.44e+07 0 e 0 1409 1435 1428 181 57.272 115.455 7.791 1 U 6.28e+07 0 e 0 1408 1435 1428 182 54.880 115.391 6.994 1 U 9.77e+07 0 e 0 563 577 573 183 18.036 115.376 6.995 1 U 1.57e+08 0 e 0 564 577 573 184 57.713 114.586 7.966 1 U 9.26e+07 0 e 0 735 755 751 185 28.102 114.548 7.966 1 U 9.57e+07 0 e 0 736 755 751 186 27.357 114.493 8.031 1 U 3.23e+07 0 e 0 867 881 877 187 56.718 114.453 8.031 1 U 2.55e+07 0 e 0 866 881 877 188 45.497 114.187 7.249 1 U 7.62e+07 0 e 0 308 326 319 189 18.071 113.891 7.783 1 U 1.78e+08 0 e 0 444 456 452 190 38.904 113.366 7.733 1 U 2.74e+08 0 e 0 636 659 652 191 55.211 113.899 7.784 1 U 1.37e+08 0 e 0 443 456 452 192 59.259 113.892 8.339 1 U 3.04e+07 0 e 0 127 145 140 193 72.840 113.967 8.338 1 U 2.13e+07 0 e 0 128 145 140 194 33.506 113.659 9.415 1 U 5.65e+07 0 e 0 967 991 987 195 54.142 113.693 9.415 1 U 7.39e+07 0 e 0 966 991 987 196 34.094 113.545 8.916 1 U 4.8e+07 0 e 0 1342 1363 1359 197 56.323 113.531 8.916 1 U 5.94e+07 0 e 0 1341 1363 1359 198 36.961 113.402 7.975 1 U 5.33e+07 0 e 0 855 873 869 199 51.678 113.409 7.974 1 U 2.28e+07 0 e 0 854 873 869 200 55.164 113.380 7.734 1 U 6.87e+07 0 e 0 635 659 652 201 31.050 113.134 8.175 1 U 2.33e+07 0 e 0 116 134 130 202 56.781 113.017 8.174 1 U 3.19e+07 0 e 0 115 134 130 203 38.386 112.903 6.927 1 U 4.12e+06 0 e 0 0 0 0 204 54.485 112.572 6.971 1 U 7.73e+06 0 e 0 929 939 936 205 40.597 113.084 8.605 1 U 7.67e+07 0 e 0 724 745 739 206 63.363 113.079 8.605 1 U 8.31e+07 0 e 0 723 745 739 207 43.737 113.116 7.799 1 U 7.48e+07 0 e 0 273 292 288 208 56.794 113.153 7.797 1 U 8.63e+07 0 e 0 272 292 288 209 37.771 112.475 10.192 1 U 1.06e+08 0 e 0 301 312 309 210 52.049 112.477 10.192 1 U 4.01e+07 0 e 0 300 312 309 211 45.344 112.445 7.556 1 U 1.95e+08 0 e 0 1377 1390 1386 212 54.765 111.993 7.536 1 U 2.51e+07 0 e 0 1180 1190 1188 213 37.872 112.101 7.538 1 U 1.31e+07 0 e 0 1181 1190 1188 214 33.904 111.825 7.745 1 U 3.42e+07 0 e 0 738 746 744 215 28.124 111.713 7.747 1 U 3.07e+07 0 e 0 736 746 744 216 33.906 111.460 7.056 1 U 3.68e+07 0 e 0 738 746 743 217 28.111 111.609 7.054 1 U 3.49e+07 0 e 0 736 746 743 218 42.503 111.679 7.881 1 U 6.78e+07 0 e 0 841 863 857 219 58.001 111.686 7.880 1 U 9.72e+07 0 e 0 840 863 857 220 61.877 111.662 8.134 1 U 7.52e+07 0 e 0 1383 1399 1395 221 70.913 111.643 8.135 1 U 7.78e+07 0 e 0 1384 1399 1395 222 56.093 111.416 8.506 1 U 6.26e+07 0 e 0 922 938 932 223 18.470 111.437 8.504 1 U 7.8e+07 0 e 0 923 938 932 224 40.668 111.329 9.412 1 U 1.01e+08 0 e 0 88 99 96 225 52.888 111.345 9.411 1 U 3.82e+07 0 e 0 87 99 96 226 39.463 109.487 7.859 1 U 1.09e+08 0 e 0 74 85 82 227 53.187 109.496 7.860 1 U 5.06e+07 0 e 0 73 85 82 228 43.335 109.018 7.917 1 U 8.12e+07 0 e 0 1032 1048 1045 229 54.270 109.014 7.918 1 U 7.78e+07 0 e 0 1031 1048 1045 230 32.377 108.984 8.211 1 U 7e+07 0 e 0 1066 1086 1082 231 56.897 108.958 8.210 1 U 9.69e+07 0 e 0 1065 1086 1082 232 33.026 108.935 7.120 1 U 4.96e+07 0 e 0 492 516 510 233 57.755 108.920 7.119 1 U 5.22e+07 0 e 0 491 516 510 234 52.145 107.946 8.219 1 U 4.48e+07 0 e 0 1365 1381 1378 235 37.145 107.960 8.218 1 U 1.25e+08 0 e 0 1366 1381 1378 236 31.326 107.709 9.948 1 U 2.85e+07 0 e 0 507 522 519 237 53.753 107.657 9.946 1 U 2.31e+07 0 e 0 506 522 519 238 51.634 107.691 7.413 1 U 4.77e+07 0 e 0 610 624 623 239 37.505 107.680 7.413 1 U 1.28e+08 0 e 0 611 624 623 240 37.621 107.458 8.929 1 U 5.56e+07 0 e 0 1425 1441 1438 241 54.326 107.453 8.928 1 U 5.95e+07 0 e 0 1424 1441 1438 242 37.022 107.246 7.551 1 U 1.12e+08 0 e 0 287 298 295 243 51.680 107.250 7.552 1 U 4.26e+07 0 e 0 286 298 295 244 19.920 122.928 8.387 1 U 3.11e+07 0 e 0 1494 1505 1502 245 52.707 122.980 8.384 1 U 2e+07 0 e 0 1493 1505 1502 246 41.382 122.891 8.404 1 U 7.43e+06 0 e 0 0 0 0 247 59.165 128.188 9.601 1 U 1.05e+07 0 e 0 887 905 901 248 39.715 128.304 9.594 1 U 5.24e+06 0 e 0 888 905 901 249 37.270 133.569 9.856 1 U 8.27e+06 0 e 0 102 124 118 250 63.231 133.490 9.862 1 U 1.64e+07 0 e 0 101 124 118 251 40.199 112.947 8.955 1 U 1.54e+07 0 e 0 381 391 390 252 58.125 112.819 8.966 1 U 1.28e+07 0 e 0 380 391 390 253 54.681 111.955 6.808 1 U 2.13e+07 0 e 0 1180 1190 1187 254 37.722 112.073 6.807 1 U 1.32e+07 0 e 0 1181 1190 1187 255 38.765 111.839 6.665 1 U 1.3e+07 0 e 0 636 645 642 256 55.093 111.659 6.662 1 U 2.63e+07 0 e 0 635 645 642 257 32.442 111.148 7.528 1 U 2.04e+07 0 e 0 1066 1078 1074 258 34.359 111.147 7.527 1 U 1.78e+07 0 e 0 1068 1078 1074 259 32.417 111.015 6.841 1 U 1.64e+07 0 e 0 1066 1078 1073 260 34.405 111.039 6.840 1 U 1.66e+07 0 e 0 1068 1078 1073 261 53.490 111.866 6.829 1 U 2.39e+07 0 e 0 1515 1525 1522 262 38.615 111.833 6.829 1 U 1.71e+07 0 e 0 1516 1525 1522 263 31.187 110.141 6.431 1 U 4.22e+06 0 e 0 818 830 825 264 34.757 110.184 6.434 1 U 5.13e+06 0 e 0 820 830 825 265 39.633 109.024 8.178 1 U 9.42e+07 0 e 0 451 462 459 266 53.398 109.034 8.179 1 U 5.09e+07 0 e 0 450 462 459 267 42.031 124.623 7.507 1 U 1.58e+07 0 e 0 0 0 0 268 55.208 124.686 7.505 1 U 1.51e+07 0 e 0 0 0 0 269 45.688 121.122 7.896 1 U 6.85e+07 0 e 0 0 0 0 270 41.133 120.554 8.070 1 U 2.45e+07 0 e 0 0 0 0 271 54.497 120.500 8.075 1 U 8.5e+06 0 e 0 0 0 0 272 53.758 119.431 8.456 1 U 1.4e+07 0 e 0 1507 1524 1518 273 41.776 119.349 8.458 1 U 3.62e+07 0 e 0 1508 1524 1518 274 18.374 119.272 8.443 1 U 4.59e+06 0 e 0 0 0 0 275 35.880 126.005 8.988 1 U 2.44e+07 0 e 0 1146 1166 1162 276 54.016 125.860 8.989 1 U 2.3e+07 0 e 0 1145 1166 1162 277 30.524 120.188 8.263 1 U 1.48e+07 0 e 0 0 0 0 278 56.664 120.068 8.262 1 U 1.29e+07 0 e 0 0 0 0 279 43.090 119.466 9.105 1 U 3.95e+07 0 e 0 227 248 243 280 54.645 119.428 9.106 1 U 3.39e+07 0 e 0 226 248 243 281 45.695 123.382 7.981 1 U 3.52e+07 0 e 0 0 0 0 282 30.798 125.339 7.674 1 U 1.62e+07 0 e 0 0 0 0 283 56.066 125.299 7.673 1 U 2.15e+07 0 e 0 0 0 0 284 55.066 125.106 7.569 1 U 2.08e+07 0 e 0 0 0 0 285 42.516 125.057 7.569 1 U 2.08e+07 0 e 0 0 0 0 286 46.776 116.515 7.976 1 U 1.97e+07 0 e 0 389 399 395 287 55.830 116.897 8.015 1 U 6.3e+06 0 e 0 0 0 0 288 55.059 128.427 8.225 1 U 1.29e+08 0 e 0 0 0 0 289 42.814 128.419 8.225 1 U 1.13e+08 0 e 0 0 0 0 290 64.559 116.653 7.579 1 U 2.91e+07 0 e 0 1356 1374 1368 291 68.516 116.639 7.579 1 U 3.79e+07 0 e 0 1357 1374 1368 292 33.000 127.368 7.946 1 U 1.24e+07 0 e 0 0 0 0 293 56.282 127.422 7.942 1 U 1.46e+07 0 e 0 0 0 0 294 64.241 129.626 7.902 1 U 4.27e+07 0 e 0 0 0 0 295 58.211 129.664 7.903 1 U 2.36e+07 0 e 0 0 0 0 296 61.274 130.102 7.923 1 U 1.85e+07 0 e 0 0 0 0 297 38.450 130.164 7.922 1 U 9.39e+06 0 e 0 0 0 0 298 42.283 130.203 7.735 1 U 1.28e+07 0 e 0 0 0 0 299 54.894 130.283 7.735 1 U 1.31e+07 0 e 0 0 0 0 300 55.175 130.265 7.787 1 U 1.98e+07 0 e 0 0 0 0 301 42.277 130.265 7.790 1 U 1.91e+07 0 e 0 0 0 0 302 19.442 129.516 7.769 1 U 1.19e+07 0 e 0 0 0 0 303 56.149 129.646 7.784 1 U 7.39e+06 0 e 0 0 0 0 304 32.755 129.690 7.780 1 U 8.22e+06 0 e 0 0 0 0 305 53.062 124.682 8.535 1 U 6.61e+06 0 e 0 1479 1498 1495 306 42.244 124.868 8.536 1 U 5.11e+06 0 e 0 1480 1498 1495 307 38.571 120.955 8.123 1 U 6.79e+07 0 e 0 1516 1539 1532 308 53.539 121.057 8.127 1 U 2.18e+07 0 e 0 1515 1539 1532 309 21.724 119.556 8.070 1 U 1.21e+07 0 e 0 1501 1513 1509 310 51.433 119.530 8.064 1 U 1.31e+07 0 e 0 1500 1513 1509 311 55.136 123.637 8.160 1 U 1e+07 0 e 0 0 0 0 312 42.366 123.704 8.165 1 U 7.75e+06 0 e 0 0 0 0 313 30.117 123.105 8.044 1 U 1.53e+07 0 e 0 0 0 0 314 56.243 123.108 8.043 1 U 1.49e+07 0 e 0 0 0 0 315 55.139 124.461 7.935 1 U 1.46e+07 0 e 0 0 0 0 316 42.410 124.527 7.933 1 U 1.47e+07 0 e 0 0 0 0 317 41.062 108.736 8.294 1 U 2.44e+07 0 e 0 0 0 0 318 54.753 108.671 8.296 1 U 1.22e+07 0 e 0 0 0 0 319 45.496 120.219 7.883 1 U 7.81e+07 0 e 0 0 0 0 320 38.787 109.345 8.467 1 U 1.74e+07 0 e 0 0 0 0 321 53.370 109.307 8.480 1 U 7.28e+06 0 e 0 0 0 0 322 38.514 125.229 8.195 1 U 1.16e+07 0 e 0 0 0 0 323 61.167 125.215 8.192 1 U 2.55e+07 0 e 0 0 0 0 324 38.817 127.607 7.690 1 U 2.91e+07 0 e 0 0 0 0 325 53.560 127.582 7.688 1 U 1.22e+07 0 e 0 0 0 0 326 43.318 123.670 8.782 1 U 4.1e+07 0 e 0 95 113 106 327 55.831 122.648 7.898 1 U 1.79e+07 0 e 0 0 0 0 328 30.403 122.534 7.901 1 U 2.97e+07 0 e 0 0 0 0 329 60.977 128.953 7.982 1 U 1.51e+07 0 e 0 0 0 0 330 47.443 119.893 8.176 1 U 2.42e+07 0 e 0 0 0 0 331 45.549 120.306 7.940 1 U 4.46e+07 0 e 0 0 0 0 332 19.143 118.992 8.178 1 U 1.48e+07 0 e 0 0 0 0 333 38.619 128.810 7.984 1 U 7.19e+06 0 e 0 0 0 0 334 52.866 119.038 8.179 1 U 1e+07 0 e 0 0 0 0 335 37.876 119.365 8.530 1 U 3.72e+07 0 e 0 0 0 0 336 18.279 119.365 8.526 1 U 1.63e+08 0 e 0 0 0 0 337 47.538 121.809 8.260 1 U 1.49e+07 0 e 0 350 355 353 338 55.520 118.033 8.362 1 U 2.79e+07 0 e 0 36 56 52 339 56.962 124.744 8.789 1 U 3.83e+06 0 e 0 328 346 342 340 32.906 124.877 8.774 1 U 2.54e+06 0 e 0 329 346 342 341 36.043 121.539 5.927 1 U 2.69e+06 0 e 0 158 176 171 342 55.139 111.659 7.534 1 U 2.24e+07 0 e 0 635 645 643 343 38.808 111.835 7.534 1 U 2.09e+07 0 e 0 636 645 643 344 34.698 110.314 7.305 1 U 3.64e+06 0 e 0 820 830 826 345 31.312 110.144 7.305 1 U 2.81e+06 0 e 0 818 830 826 346 18.504 115.073 7.625 1 U 6.43e+06 0 e 0 352 366 360 347 33.186 111.912 6.821 1 U 3.35e+06 0 e 0 0 0 0 348 63.737 122.654 8.186 1 U 4.21e+06 0 e 0 0 0 0 349 63.807 122.572 8.160 1 U 3.17e+06 0 e 0 0 0 0 350 61.532 122.680 8.165 1 U 1.88e+06 0 e 0 0 0 0 351 63.907 122.329 8.225 1 U 3.7e+06 0 e 0 0 0 0 352 19.334 119.714 8.294 1 U 2.2e+07 0 e 0 0 0 0 353 52.477 119.803 8.290 1 U 1.56e+07 0 e 0 0 0 0 354 51.664 112.784 7.320 1 U 5.45e+06 0 e 0 675 685 682 355 39.262 112.801 7.319 1 U 2.72e+06 0 e 0 676 685 682 356 51.709 112.883 7.709 1 U 5.5e+06 0 e 0 675 685 683 357 51.579 111.480 6.324 1 U 6e+06 0 e 0 854 864 861 358 36.873 111.484 6.318 1 U 2.81e+06 0 e 0 855 864 861 359 52.092 110.027 6.933 1 U 4.82e+06 0 e 0 0 0 0 360 37.121 110.245 6.923 1 U 2.12e+06 0 e 0 0 0 0 361 38.437 106.373 8.672 1 U 4.03e+06 0 e 0 1232 1238 1235 362 36.996 107.290 7.664 1 U 3.39e+06 0 e 0 0 0 0 363 36.652 112.499 6.968 1 U 4.56e+06 0 e 0 930 939 936 364 36.615 112.599 7.660 1 U 7.5e+06 0 e 0 930 939 937 365 54.530 112.591 7.660 1 U 9.66e+06 0 e 0 929 939 937 366 37.497 111.894 7.145 1 U 4.36e+06 0 e 0 611 620 617 367 45.751 112.122 7.142 1 U 3e+06 0 e 0 0 0 0 368 51.582 111.954 7.143 1 U 4.28e+06 0 e 0 610 620 617 369 37.481 111.982 7.801 1 U 2.9e+06 0 e 0 611 620 618 370 51.632 112.055 7.797 1 U 8.21e+06 0 e 0 610 620 618 371 31.188 127.303 7.911 1 U 7.61e+06 0 e 0 0 0 0 372 53.766 120.585 8.122 1 U 1.6e+07 0 e 0 0 0 0 373 53.546 111.821 7.503 1 U 1.48e+07 0 e 0 1515 1525 1523 374 38.557 111.916 7.507 1 U 1.1e+07 0 e 0 1516 1525 1523 375 34.956 126.811 9.008 1 U 6.85e+06 0 e 0 1194 1215 1211 376 55.205 127.115 8.997 1 U 7.16e+06 0 e 0 1193 1215 1211 377 34.532 127.348 9.002 1 U 8.84e+06 0 e 0 0 0 0 378 53.501 110.303 6.849 1 U 2.87e+06 0 e 0 0 0 0 379 38.686 110.090 6.839 1 U 1.73e+06 0 e 0 0 0 0 380 40.186 107.946 8.598 1 U 2.8e+06 0 e 0 1218 1230 1229 381 55.162 107.917 8.599 1 U 8.39e+06 0 e 0 1217 1230 1229 382 20.595 111.834 8.336 1 U 2.76e+06 0 e 0 0 0 0 383 37.068 111.667 7.879 1 U 3.01e+06 0 e 0 855 864 862 384 51.645 111.665 7.878 1 U 4.69e+06 0 e 0 854 864 862 385 39.580 111.813 7.882 1 U 3.05e+06 0 e 0 0 0 0 386 55.158 111.644 7.891 1 U 7.68e+06 0 e 0 0 0 0 387 45.989 112.363 7.345 1 U 8.62e+06 0 e 0 0 0 0 388 51.589 112.586 7.842 1 U 2.91e+06 0 e 0 0 0 0 389 27.967 114.613 7.749 1 U 3.75e+06 0 e 0 0 0 0 390 27.216 115.126 7.714 1 U 2.52e+06 0 e 0 0 0 0 391 34.135 114.503 7.740 1 U 5.58e+06 0 e 0 0 0 0 392 34.273 110.437 7.637 1 U 7.32e+06 0 e 0 1292 1302 1298 393 33.402 109.810 8.109 1 U 8.52e+06 0 e 0 0 0 0 394 55.015 109.861 8.108 1 U 2.98e+06 0 e 0 0 0 0 395 36.807 113.219 7.858 1 U 5.11e+06 0 e 0 0 0 0 396 54.738 113.257 6.815 1 U 3.84e+06 0 e 0 0 0 0 397 55.069 112.850 6.665 1 U 3.62e+06 0 e 0 0 0 0 398 38.804 112.873 6.672 1 U 1.64e+06 0 e 0 0 0 0 399 54.070 116.094 8.387 1 U 7e+06 0 e 0 0 0 0 400 39.258 116.118 8.394 1 U 1.18e+07 0 e 0 0 0 0 401 33.365 118.936 8.154 1 U 2.78e+06 0 e 0 0 0 0 402 58.045 127.151 7.887 1 U 6.91e+06 0 e 0 0 0 0 403 46.401 121.166 8.735 1 U 1.92e+06 0 e 0 0 0 0 404 36.354 119.602 8.533 1 U 1.1e+07 0 e 0 240 262 254 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . CO 13 CO . . 20 ppm . . . . . . 28058 3 2 . . N 15 NH . . 30 ppm . . . . . . 28058 3 3 . . HN 1 HN . . 14 ppm . . . . . . 28058 3 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $SPARKY . . 28058 3 stop_ save_ save_spectral_peak_list_4 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_4 _Spectral_peak_list.Entry_ID 28058 _Spectral_peak_list.ID 4 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 4 _Spectral_peak_list.Experiment_name '3D 1H-15N NOESY' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 3 1 8.335 113.824 8.335 1 U 6.69e+07 0 e 0 140 145 140 2 -0.034 117.806 8.576 1 U 4.82e+06 0 e 0 25 27 20 3 0.201 117.925 8.587 1 U 6.14e+06 0 e 0 26 27 20 4 9.349 124.109 9.348 1 U 5.42e+07 0 e 0 31 34 31 5 5.149 124.122 9.346 1 U 6.32e+06 0 e 0 32 34 31 6 1.140 124.143 9.344 1 U 1.11e+07 0 e 0 33 34 31 7 0.877 119.151 8.957 1 U 1.42e+07 0 e 0 43 48 41 8 4.659 119.185 8.958 1 U 1.26e+07 0 e 0 42 48 41 9 -0.083 119.070 8.965 1 U 1.98e+06 0 e 0 46 48 41 10 4.624 118.066 8.362 1 U 2.42e+07 0 e 0 53 56 52 11 2.170 118.169 8.364 1 U 1.48e+07 0 e 0 54 56 52 12 3.325 118.043 8.362 1 U 1.36e+07 0 e 0 55 56 52 13 3.647 109.472 7.860 1 U 2.78e+07 0 e 0 83 85 82 14 4.108 109.496 7.861 1 U 2.31e+07 0 e 0 84 85 82 15 4.522 111.334 9.413 1 U 1.77e+07 0 e 0 98 99 96 16 3.409 111.352 9.412 1 U 2.02e+07 0 e 0 97 99 96 17 9.414 111.332 9.412 1 U 1.21e+08 0 e 0 96 99 96 18 9.862 133.438 9.860 1 U 2.72e+07 0 e 0 118 124 118 19 4.228 113.055 8.171 1 U 2.78e+07 0 e 0 0 0 0 20 5.190 113.060 8.175 1 U 8.67e+06 0 e 0 131 134 130 21 2.041 113.063 8.169 1 U 9.61e+06 0 e 0 0 0 0 22 0.856 113.075 8.175 1 U 1.12e+07 0 e 0 133 134 130 23 8.171 113.047 8.171 1 U 6.36e+07 0 e 0 130 134 130 24 4.552 113.633 8.331 1 U 6.62e+06 0 e 0 141 145 140 25 2.064 113.747 8.334 1 U 5.06e+06 0 e 0 142 145 140 26 3.793 125.144 8.325 1 U 1.77e+07 0 e 0 189 191 188 27 1.453 125.227 8.327 1 U 3.9e+07 0 e 0 190 191 188 28 4.009 116.063 7.611 1 U 1.94e+07 0 e 0 196 199 195 29 2.774 115.998 7.610 1 U 1.35e+07 0 e 0 198 199 195 30 2.279 116.053 7.611 1 U 2.23e+07 0 e 0 197 199 195 31 5.077 116.391 7.510 1 U 5.14e+06 0 e 0 204 207 203 32 3.281 116.405 7.508 1 U 5.06e+06 0 e 0 206 207 203 33 2.288 116.360 7.502 1 U 1.16e+07 0 e 0 205 207 203 34 7.480 99.230 7.478 1 U 8.56e+07 0 e 0 210 213 210 35 4.254 108.935 8.176 1 U 2.22e+07 0 e 0 461 462 459 36 3.327 109.033 8.174 1 U 2.58e+07 0 e 0 460 462 459 37 10.193 112.424 10.192 1 U 1.17e+08 0 e 0 309 312 309 38 3.962 112.432 10.193 1 U 2.3e+07 0 e 0 311 312 309 39 3.315 112.423 10.192 1 U 3.01e+07 0 e 0 310 312 309 40 3.088 99.242 7.476 1 U 1.11e+07 0 e 0 211 213 210 41 4.807 99.259 7.479 1 U 8.36e+06 0 e 0 212 213 210 42 5.611 119.607 9.098 1 U 6.53e+06 0 e 0 244 248 243 43 2.324 119.606 9.099 1 U 4.72e+06 0 e 0 245 248 243 44 1.142 119.437 9.104 1 U 1e+07 0 e 0 247 248 243 45 3.992 126.322 10.224 1 U 8.13e+06 0 e 0 446 448 445 46 1.409 126.306 10.219 1 U 2.67e+07 0 e 0 447 448 445 47 2.543 113.853 7.783 1 U 2.15e+07 0 e 0 454 456 452 48 3.014 113.883 7.783 1 U 1.56e+07 0 e 0 455 456 452 49 4.265 117.893 8.103 1 U 2.03e+07 0 e 0 467 470 466 50 3.940 117.935 8.102 1 U 9.04e+06 0 e 0 469 470 466 51 3.768 117.825 8.101 1 U 9.06e+06 0 e 0 468 470 466 52 4.755 116.377 8.366 1 U 1.12e+07 0 e 0 477 480 476 53 3.038 116.374 8.363 1 U 1.09e+07 0 e 0 479 480 476 54 2.685 116.475 8.365 1 U 2.08e+07 0 e 0 478 480 476 55 1.462 126.239 8.644 1 U 3.84e+07 0 e 0 488 489 486 56 4.007 126.251 8.645 1 U 1.59e+07 0 e 0 487 489 486 57 9.948 107.648 9.949 1 U 2.91e+07 0 e 0 519 522 519 58 3.537 107.633 9.949 1 U 2.09e+07 0 e 0 523 522 519 59 4.269 124.539 8.731 1 U 8.16e+06 0 e 0 538 540 537 60 1.247 124.682 8.733 1 U 1.53e+07 0 e 0 539 540 537 61 1.659 117.847 7.314 1 U 4.01e+07 0 e 0 546 547 544 62 0.157 119.611 8.118 1 U 1.13e+07 0 e 0 559 561 554 63 0.358 119.516 8.118 1 U 7.54e+06 0 e 0 560 561 554 64 4.043 119.558 8.118 1 U 2.39e+07 0 e 0 555 561 554 65 2.490 115.389 6.995 1 U 1.19e+07 0 e 0 576 577 573 66 2.356 115.436 6.993 1 U 1.47e+07 0 e 0 575 577 573 67 2.128 115.387 6.993 1 U 5.5e+07 0 e 0 578 577 573 68 4.305 116.513 8.055 1 U 1.61e+07 0 e 0 586 592 585 69 0.840 116.524 8.054 1 U 1.21e+07 0 e 0 590 592 585 70 0.999 116.476 8.051 1 U 1.22e+07 0 e 0 591 592 585 71 1.748 116.474 8.053 1 U 1.7e+07 0 e 0 587 592 585 72 4.352 124.067 8.997 1 U 1.85e+07 0 e 0 605 608 604 73 4.148 117.925 10.131 1 U 4.94e+07 0 e 0 639 644 638 74 3.113 117.923 10.130 1 U 9.13e+06 0 e 0 641 644 638 75 2.771 117.907 10.131 1 U 1.13e+07 0 e 0 640 644 638 76 3.125 112.219 6.659 1 U 9.33e+06 0 e 0 641 645 642 77 2.768 112.343 6.660 1 U 7.13e+06 0 e 0 640 645 642 78 6.661 112.199 6.659 1 U 2.12e+08 0 e 0 642 645 642 79 7.532 112.238 6.659 1 U 1.66e+08 0 e 0 643 645 642 80 7.535 112.234 7.533 1 U 4.69e+08 0 e 0 643 645 643 81 6.664 112.246 7.532 1 U 1.59e+08 0 e 0 642 645 643 82 6.818 112.140 7.530 1 U 2.1e+08 0 e 0 1187 1190 1188 83 3.120 112.226 7.534 1 U 1.44e+07 0 e 0 641 645 643 84 1.619 113.324 7.733 1 U 1.61e+07 0 e 0 654 659 652 85 4.784 113.199 7.733 1 U 1.73e+07 0 e 0 653 659 652 86 5.353 126.768 9.327 1 U 8.05e+06 0 e 0 667 673 666 87 0.629 126.755 9.331 1 U 9.87e+06 0 e 0 671 673 666 88 1.402 126.713 9.331 1 U 1.49e+07 0 e 0 670 673 666 89 0.876 126.737 9.330 1 U 2.06e+07 0 e 0 672 673 666 90 2.167 126.729 9.330 1 U 1.38e+07 0 e 0 668 673 666 91 4.304 128.080 9.812 1 U 9e+06 0 e 0 679 684 678 92 3.107 128.022 9.811 1 U 1.04e+07 0 e 0 681 684 678 93 2.628 128.063 9.820 1 U 3.53e+06 0 e 0 680 684 678 94 3.401 115.602 7.599 1 U 2.06e+07 0 e 0 690 692 689 95 1.063 115.530 7.600 1 U 5.52e+07 0 e 0 691 692 689 96 3.394 118.915 7.483 1 U 8.59e+06 0 e 0 690 699 696 97 1.064 118.939 7.485 1 U 1.49e+07 0 e 0 691 699 696 98 1.298 118.897 7.485 1 U 5.09e+07 0 e 0 698 699 696 99 4.135 118.880 7.485 1 U 1.97e+07 0 e 0 697 699 696 100 4.915 119.360 8.528 1 U 1.44e+07 0 e 0 0 0 0 101 4.135 127.825 8.487 1 U 6.57e+06 0 e 0 712 714 711 102 9.550 116.609 9.547 1 U 3.94e+07 0 e 0 718 721 718 103 4.137 116.567 9.545 1 U 4.45e+06 0 e 0 712 721 718 104 4.602 116.506 9.544 1 U 6.92e+06 0 e 0 719 721 718 105 1.494 116.603 9.547 1 U 3.98e+07 0 e 0 720 721 718 106 3.727 122.019 8.029 1 U 2.25e+07 0 e 0 728 731 727 107 3.083 122.052 8.030 1 U 3.32e+07 0 e 0 729 731 727 108 3.391 122.035 8.029 1 U 3.63e+07 0 e 0 730 731 727 109 1.487 122.032 8.029 1 U 1.42e+07 0 e 0 720 731 727 110 4.583 122.228 8.030 1 U 7.02e+06 0 e 0 719 731 727 111 2.640 112.968 8.605 1 U 1.75e+07 0 e 0 747 745 739 112 7.053 112.141 7.052 1 U 3.88e+08 0 e 0 0 0 0 113 7.746 112.165 7.052 1 U 1.46e+08 0 e 0 0 0 0 114 7.053 112.165 7.746 1 U 1.61e+08 0 e 0 0 0 0 115 2.193 112.986 8.607 1 U 1.75e+07 0 e 0 741 745 739 116 2.331 113.076 8.606 1 U 1.29e+07 0 e 0 742 745 739 117 4.186 113.021 8.606 1 U 1.46e+07 0 e 0 740 745 739 118 3.720 113.053 8.610 1 U 4.04e+06 0 e 0 728 745 739 119 3.389 113.016 8.605 1 U 8.35e+06 0 e 0 730 745 739 120 3.069 113.067 8.604 1 U 8.53e+06 0 e 0 729 745 739 121 4.455 114.603 7.963 1 U 1.37e+07 0 e 0 752 755 751 122 4.057 114.571 7.963 1 U 1.3e+07 0 e 0 0 0 0 123 2.655 114.573 7.965 1 U 6.58e+06 0 e 0 747 755 751 124 0.976 121.124 7.117 1 U 1.42e+07 0 e 0 764 769 762 125 4.643 121.209 7.115 1 U 1.11e+07 0 e 0 763 769 762 126 0.598 121.185 7.117 1 U 1.79e+07 0 e 0 0 0 0 127 0.616 120.993 8.823 1 U 1.94e+07 0 e 0 0 0 0 128 5.641 129.002 9.528 1 U 6.34e+06 0 e 0 805 814 804 129 3.217 129.123 9.530 1 U 1.2e+07 0 e 0 807 814 804 130 2.640 129.077 9.533 1 U 9.94e+06 0 e 0 806 814 804 131 0.572 129.069 9.531 1 U 2.34e+07 0 e 0 0 0 0 132 4.744 129.085 9.531 1 U 3.35e+07 0 e 0 0 0 0 133 3.986 127.611 8.241 1 U 9.43e+06 0 e 0 846 852 845 134 1.957 127.585 8.244 1 U 2.61e+07 0 e 0 0 0 0 135 0.916 127.574 8.242 1 U 1.08e+07 0 e 0 0 0 0 136 1.504 127.471 8.243 1 U 1.11e+07 0 e 0 847 852 845 137 2.719 111.704 7.876 1 U 1.53e+07 0 e 0 859 863 857 138 3.298 111.875 7.874 1 U 1.28e+07 0 e 0 860 863 857 139 4.857 111.695 7.875 1 U 1.28e+07 0 e 0 858 863 857 140 3.983 111.703 7.879 1 U 6.88e+06 0 e 0 0 0 0 141 1.957 111.672 7.882 1 U 1.8e+07 0 e 0 0 0 0 142 1.527 111.684 7.879 1 U 1.22e+07 0 e 0 0 0 0 143 0.918 111.547 7.880 1 U 6.6e+06 0 e 0 0 0 0 144 0.938 125.014 8.316 1 U 2.4e+07 0 e 0 1405 1406 1403 145 4.477 125.068 8.318 1 U 1.64e+07 0 e 0 1404 1406 1403 146 4.195 122.843 8.055 1 U 1.97e+07 0 e 0 1129 1131 1128 147 1.239 122.886 8.056 1 U 6.15e+07 0 e 0 1130 1131 1128 148 3.939 123.169 8.610 1 U 5.73e+06 0 e 0 925 927 924 149 1.441 123.089 8.615 1 U 1.57e+07 0 e 0 926 927 924 150 0.854 118.125 8.267 1 U 2.79e+07 0 e 0 0 0 0 151 4.453 118.094 8.269 1 U 1.05e+07 0 e 0 1174 1178 1173 152 2.089 118.199 8.269 1 U 9.2e+06 0 e 0 1175 1178 1173 153 4.327 113.622 9.414 1 U 8.55e+06 0 e 0 988 991 987 154 1.246 113.639 9.414 1 U 2.72e+07 0 e 0 990 991 987 155 1.211 116.070 8.924 1 U 7.44e+06 0 e 0 1338 1339 1335 156 4.044 115.994 8.924 1 U 1.63e+07 0 e 0 1337 1339 1335 157 4.838 115.981 8.923 1 U 1.01e+07 0 e 0 1336 1339 1335 158 1.194 113.484 8.913 1 U 3.14e+07 0 e 0 1362 1363 1359 159 4.334 113.493 8.917 1 U 7.78e+06 0 e 0 1361 1363 1359 160 3.973 113.453 8.914 1 U 2.58e+07 0 e 0 1360 1363 1359 161 4.260 112.403 7.553 1 U 1.95e+07 0 e 0 1388 1390 1386 162 4.464 112.425 7.551 1 U 1.37e+07 0 e 0 1387 1390 1386 163 1.138 111.655 8.132 1 U 3.28e+07 0 e 0 0 0 0 164 4.038 111.566 8.131 1 U 7.93e+06 0 e 0 1397 1399 1395 165 5.216 111.598 8.129 1 U 9.82e+06 0 e 0 1396 1399 1395 166 4.257 111.705 8.132 1 U 2.99e+07 0 e 0 1388 1399 1395 167 4.460 111.654 8.132 1 U 4.8e+07 0 e 0 1387 1399 1395 168 3.998 125.139 8.324 1 U 4.83e+07 0 e 0 0 0 0 169 5.223 125.005 8.315 1 U 4.11e+07 0 e 0 1396 1406 1403 170 1.146 125.066 8.316 1 U 1.61e+07 0 e 0 1398 1406 1403 171 3.940 109.014 7.917 1 U 4.25e+07 0 e 0 1049 1048 1045 172 4.540 119.938 9.357 1 U 1.47e+07 0 e 0 1308 1309 1306 173 4.227 119.899 9.359 1 U 8e+06 0 e 0 1307 1309 1306 174 4.266 108.061 8.215 1 U 2.67e+07 0 e 0 1380 1381 1378 175 3.631 107.927 8.215 1 U 2.92e+07 0 e 0 1379 1381 1378 176 3.630 112.423 7.550 1 U 7.78e+06 0 e 0 1379 1390 1386 177 5.401 108.959 8.208 1 U 8.65e+06 0 e 0 1083 1086 1082 178 3.773 120.071 9.099 1 U 6.93e+06 0 e 0 1318 1317 1313 179 4.232 120.097 9.097 1 U 1.12e+07 0 e 0 1307 1317 1313 180 4.480 117.133 8.806 1 U 3.98e+07 0 e 0 1404 1421 1413 181 0.935 117.149 8.806 1 U 3.39e+07 0 e 0 1405 1421 1413 182 7.063 125.944 10.080 1 U 8.98e+06 0 e 0 808 815 809 183 10.079 125.969 10.077 1 U 2.6e+07 0 e 0 0 0 0 184 8.030 115.655 10.439 1 U 8.53e+06 0 e 0 877 884 883 185 10.435 115.707 10.434 1 U 2.07e+07 0 e 0 883 884 883 186 5.098 118.459 6.997 1 U 8.55e+06 0 e 0 958 964 957 187 1.925 118.412 6.996 1 U 2.06e+07 0 e 0 960 964 957 188 1.382 118.355 6.995 1 U 1.42e+07 0 e 0 961 964 957 189 0.902 118.416 6.994 1 U 1.19e+07 0 e 0 959 964 957 190 3.735 119.746 7.742 1 U 1.05e+07 0 e 0 999 1005 998 191 1.255 119.659 7.738 1 U 3.19e+07 0 e 0 1002 1005 998 192 0.282 119.668 7.739 1 U 1.38e+07 0 e 0 1006 1005 998 193 0.558 118.354 6.995 1 U 8.33e+06 0 e 0 963 964 957 194 0.678 117.951 7.042 1 U 1.11e+07 0 e 0 1039 1041 1036 195 0.860 117.966 7.042 1 U 1.14e+07 0 e 0 1040 1041 1036 196 4.361 117.941 7.043 1 U 1.56e+07 0 e 0 1037 1041 1036 197 4.354 109.018 7.917 1 U 1.2e+07 0 e 0 1037 1048 1045 198 0.674 108.978 7.920 1 U 5.39e+06 0 e 0 1039 1048 1045 199 0.861 109.181 7.918 1 U 5.5e+06 0 e 0 1040 1048 1045 200 4.324 119.652 7.738 1 U 1.88e+07 0 e 0 988 1005 998 201 5.402 118.773 9.198 1 U 2.63e+07 0 e 0 1083 1100 1093 202 4.810 118.833 9.200 1 U 6.29e+06 0 e 0 1094 1100 1093 203 0.669 118.771 9.197 1 U 1.23e+07 0 e 0 1101 1100 1093 204 1.374 118.706 9.197 1 U 8.16e+06 0 e 0 1095 1100 1093 205 3.714 118.743 9.198 1 U 1.22e+07 0 e 0 1084 1100 1093 206 3.900 118.798 9.199 1 U 7.89e+06 0 e 0 1085 1100 1093 207 4.614 128.857 9.169 1 U 8.66e+06 0 e 0 1265 1271 1264 208 2.014 128.726 9.168 1 U 1.21e+07 0 e 0 1267 1271 1264 209 1.243 128.673 9.169 1 U 1.22e+07 0 e 0 1266 1271 1264 210 4.917 128.720 9.169 1 U 2.43e+07 0 e 0 1254 1271 1264 211 4.137 118.266 8.589 1 U 2.52e+07 0 e 0 1012 1017 1011 212 1.964 118.219 8.589 1 U 3.15e+07 0 e 0 1013 1017 1011 213 2.149 118.262 8.589 1 U 3.47e+07 0 e 0 1014 1017 1011 214 2.360 118.271 8.587 1 U 1.76e+07 0 e 0 1018 1017 1011 215 3.737 118.185 8.590 1 U 6.24e+06 0 e 0 999 1017 1011 216 3.724 118.646 8.541 1 U 2.89e+06 0 e 0 0 0 0 217 4.119 121.403 8.120 1 U 2.99e+07 0 e 0 1024 1029 1023 218 4.119 117.878 7.046 1 U 9.8e+06 0 e 0 1024 1041 1036 219 2.565 118.097 7.043 1 U 5.43e+06 0 e 0 1028 1041 1036 220 2.196 117.968 7.043 1 U 5.67e+06 0 e 0 1027 1041 1036 221 2.359 117.948 7.042 1 U 6.79e+06 0 e 0 1026 1041 1036 222 1.927 118.056 7.041 1 U 1.01e+07 0 e 0 1025 1041 1036 223 0.305 121.236 8.202 1 U 1.2e+07 0 e 0 1061 1063 1056 224 0.699 121.312 8.204 1 U 1.09e+07 0 e 0 1062 1063 1056 225 2.985 124.103 8.015 1 U 2.4e+07 0 e 0 0 0 0 226 2.882 124.085 8.017 1 U 2.53e+07 0 e 0 0 0 0 227 5.684 118.565 8.983 1 U 3.55e+07 0 e 0 1314 1328 1324 228 5.241 115.987 8.924 1 U 2.38e+07 0 e 0 1325 1339 1335 229 3.720 115.996 8.924 1 U 1.38e+07 0 e 0 1327 1339 1335 230 2.988 115.952 8.921 1 U 1.04e+07 0 e 0 1326 1339 1335 231 5.336 117.472 7.716 1 U 1.06e+07 0 e 0 1243 1246 1242 232 2.869 117.524 7.715 1 U 1.32e+07 0 e 0 1245 1246 1242 233 2.328 117.428 7.716 1 U 1.16e+07 0 e 0 1244 1246 1242 234 5.341 117.600 8.820 1 U 1.19e+07 0 e 0 1243 1257 1253 235 2.333 117.582 8.818 1 U 5.15e+06 0 e 0 1244 1257 1253 236 2.311 119.450 8.853 1 U 6.9e+06 0 e 0 1447 1449 1445 237 3.125 119.565 8.860 1 U 7.41e+06 0 e 0 1448 1449 1445 238 4.939 119.607 8.854 1 U 4.96e+06 0 e 0 1446 1449 1445 239 5.238 119.907 9.358 1 U 3.58e+07 0 e 0 1296 1309 1306 240 1.494 132.012 8.702 1 U 3.27e+07 0 e 0 1277 1278 1275 241 4.363 132.047 8.701 1 U 7.87e+06 0 e 0 1276 1278 1275 242 4.389 116.286 7.130 1 U 4.89e+06 0 e 0 0 0 0 243 1.486 116.058 7.127 1 U 2.27e+07 0 e 0 1277 1289 1283 244 4.616 132.024 8.701 1 U 2.68e+07 0 e 0 1265 1278 1275 245 2.012 132.052 8.698 1 U 5.45e+06 0 e 0 1267 1278 1275 246 4.709 123.534 7.335 1 U 1.96e+07 0 e 0 231 237 230 247 1.718 123.579 7.336 1 U 9.36e+06 0 e 0 233 237 230 248 0.769 123.539 7.335 1 U 1.25e+07 0 e 0 232 237 230 249 0.143 123.571 7.335 1 U 5.34e+06 0 e 0 235 237 230 250 0.123 119.252 9.100 1 U 3.7e+06 0 e 0 235 248 243 251 4.193 127.334 8.397 1 U 1.21e+07 0 e 0 278 284 277 252 4.803 112.966 7.793 1 U 1.23e+07 0 e 0 289 292 288 253 4.192 113.274 7.789 1 U 9.66e+06 0 e 0 278 292 288 254 4.631 117.019 7.749 1 U 1.4e+07 0 e 0 303 306 302 255 2.654 117.103 7.748 1 U 1.17e+07 0 e 0 304 306 302 256 4.627 112.543 10.186 1 U 5.69e+06 0 e 0 303 312 309 257 2.648 112.460 10.186 1 U 3.02e+06 0 e 0 304 312 309 258 0.975 115.925 6.735 1 U 1.33e+07 0 e 0 378 377 372 259 4.945 115.945 6.733 1 U 9.19e+06 0 e 0 373 377 372 260 4.938 119.849 8.671 1 U 7.4e+06 0 e 0 373 386 382 261 0.981 119.863 8.673 1 U 7.54e+06 0 e 0 378 386 382 262 4.406 113.864 7.782 1 U 1.94e+07 0 e 0 453 456 452 263 1.414 113.832 7.781 1 U 3.35e+07 0 e 0 447 456 452 264 3.986 113.877 7.782 1 U 1.17e+07 0 e 0 446 456 452 265 3.326 117.852 8.102 1 U 7.57e+06 0 e 0 460 470 466 266 4.276 116.468 8.364 1 U 2.81e+07 0 e 0 467 480 476 267 3.932 116.454 8.364 1 U 1.9e+07 0 e 0 469 480 476 268 3.772 116.459 8.366 1 U 1.25e+07 0 e 0 468 480 476 269 4.753 126.253 8.643 1 U 3.02e+07 0 e 0 477 489 486 270 3.024 126.159 8.641 1 U 8.67e+06 0 e 0 479 489 486 271 2.679 126.308 8.642 1 U 6.71e+06 0 e 0 478 489 486 272 4.009 108.995 7.120 1 U 1.18e+07 0 e 0 497 516 510 273 4.597 109.041 7.115 1 U 7.46e+06 0 e 0 511 516 510 274 4.595 107.559 9.947 1 U 8.11e+06 0 e 0 511 522 519 275 1.244 117.847 7.319 1 U 5.34e+07 0 e 0 539 547 544 276 0.154 118.837 8.378 1 U 6.52e+06 0 e 0 559 568 565 277 0.347 118.742 8.380 1 U 4.72e+06 0 e 0 560 568 565 278 1.658 115.374 6.995 1 U 2.48e+07 0 e 0 567 577 573 279 0.873 119.328 7.344 1 U 1.06e+07 0 e 0 0 0 0 280 3.023 119.346 7.343 1 U 2.65e+07 0 e 0 599 600 596 281 2.342 119.346 7.343 1 U 2.31e+07 0 e 0 598 600 596 282 4.794 119.264 7.342 1 U 1.16e+07 0 e 0 597 600 596 283 3.064 124.144 8.998 1 U 6.62e+06 0 e 0 599 608 604 284 2.341 124.168 9.000 1 U 4.64e+06 0 e 0 598 608 604 285 4.793 124.124 8.999 1 U 3.87e+07 0 e 0 597 608 604 286 4.358 116.731 7.894 1 U 8.76e+06 0 e 0 605 619 613 287 2.786 116.781 7.895 1 U 9.38e+06 0 e 0 615 619 613 288 4.843 107.657 7.410 1 U 8.1e+06 0 e 0 614 624 623 289 3.202 107.858 7.412 1 U 2.73e+06 0 e 0 616 624 623 290 2.775 107.574 7.416 1 U 2.69e+06 0 e 0 615 624 623 291 4.567 118.781 8.022 1 U 1.1e+07 0 e 0 630 633 629 292 3.000 118.843 8.024 1 U 1.07e+07 0 e 0 632 633 629 293 2.333 118.766 8.025 1 U 1.39e+07 0 e 0 631 633 629 294 7.741 118.815 8.026 1 U 1.03e+07 0 e 0 0 0 0 295 7.415 118.822 8.026 1 U 1.32e+07 0 e 0 623 633 629 296 10.131 118.836 8.025 1 U 3.83e+07 0 e 0 638 633 629 297 8.026 117.935 10.131 1 U 2.52e+07 0 e 0 629 644 638 298 7.734 117.954 10.130 1 U 2.5e+07 0 e 0 652 644 638 299 4.577 117.995 10.131 1 U 6.02e+06 0 e 0 630 644 638 300 4.153 113.319 7.732 1 U 2.02e+07 0 e 0 639 659 652 301 10.131 113.325 7.733 1 U 3.14e+07 0 e 0 638 659 652 302 9.330 113.309 7.732 1 U 4.74e+06 0 e 0 666 659 652 303 4.794 126.732 9.331 1 U 2.75e+07 0 e 0 653 673 666 304 9.799 127.108 9.334 1 U 2.79e+06 0 e 0 0 0 0 305 0.891 117.895 10.132 1 U 1.23e+07 0 e 0 0 0 0 306 0.627 128.066 9.813 1 U 1.07e+07 0 e 0 671 684 678 307 9.347 128.224 9.819 1 U 3.61e+06 0 e 0 666 684 678 308 9.843 115.597 7.590 1 U 2.85e+06 0 e 0 678 692 689 309 8.528 118.877 7.484 1 U 3.57e+07 0 e 0 703 699 696 310 1.292 119.461 8.528 1 U 2.27e+07 0 e 0 698 707 703 311 7.487 119.262 8.526 1 U 3.33e+07 0 e 0 696 707 703 312 7.780 108.991 8.176 1 U 1.71e+07 0 e 0 452 462 459 313 8.055 119.327 7.343 1 U 2.95e+07 0 e 0 585 600 596 314 6.998 119.281 7.344 1 U 4.8e+06 0 e 0 573 600 596 315 7.314 124.667 8.730 1 U 8.15e+06 0 e 0 544 540 537 316 8.173 124.659 8.730 1 U 6.21e+06 0 e 0 0 0 0 317 7.116 114.529 7.966 1 U 2.37e+07 0 e 0 762 755 751 318 8.611 114.525 7.963 1 U 8.63e+06 0 e 0 739 755 751 319 7.969 121.189 7.116 1 U 1.87e+07 0 e 0 751 769 762 320 8.833 121.196 7.117 1 U 4.25e+06 0 e 0 775 769 762 321 9.095 120.972 8.824 1 U 1.16e+07 0 e 0 790 783 775 322 9.086 129.084 9.529 1 U 4.78e+06 0 e 0 790 814 804 323 5.644 127.854 8.708 1 U 1.73e+07 0 e 0 805 829 821 324 6.432 110.492 6.431 1 U 1.25e+08 0 e 0 825 830 825 325 2.188 110.586 7.306 1 U 1.26e+07 0 e 0 0 0 0 326 6.432 110.632 7.307 1 U 5.77e+07 0 e 0 825 830 826 327 7.309 110.550 7.307 1 U 7.32e+07 0 e 0 826 830 826 328 1.769 110.491 6.435 1 U 4.01e+06 0 e 0 823 830 825 329 2.182 110.595 6.431 1 U 1.22e+07 0 e 0 0 0 0 330 4.572 124.756 8.812 1 U 1.96e+07 0 e 0 822 838 834 331 2.627 124.737 8.813 1 U 1.15e+07 0 e 0 837 838 834 332 1.476 124.702 8.814 1 U 1.22e+07 0 e 0 836 838 834 333 7.887 127.684 8.247 1 U 5.95e+06 0 e 0 857 852 845 334 4.990 127.573 8.242 1 U 1.54e+07 0 e 0 835 852 845 335 8.241 111.687 7.878 1 U 1.16e+07 0 e 0 845 863 857 336 4.868 113.231 7.969 1 U 5.09e+06 0 e 0 858 873 869 337 1.441 111.421 8.502 1 U 6.03e+06 0 e 0 926 938 932 338 7.981 111.302 8.504 1 U 4.42e+06 0 e 0 944 938 932 339 3.026 111.305 8.507 1 U 4.72e+06 0 e 0 935 938 932 340 2.743 111.387 8.501 1 U 4.42e+06 0 e 0 934 938 932 341 4.619 111.274 8.506 1 U 5.04e+06 0 e 0 0 0 0 342 7.980 118.431 6.993 1 U 2.05e+07 0 e 0 944 964 957 343 8.855 118.398 6.991 1 U 3.15e+06 0 e 0 971 964 957 344 5.093 122.813 8.879 1 U 3.13e+07 0 e 0 958 980 971 345 3.124 122.914 8.881 1 U 6.3e+06 0 e 0 982 980 971 346 0.488 122.894 8.879 1 U 1.09e+07 0 e 0 0 0 0 347 0.893 122.840 8.885 1 U 5.66e+06 0 e 0 0 0 0 348 8.587 119.654 7.741 1 U 1.39e+07 0 e 0 1011 1005 998 349 4.326 118.357 8.589 1 U 7.03e+06 0 e 0 988 1017 1011 350 7.736 118.295 8.589 1 U 1.9e+07 0 e 0 998 1017 1011 351 8.121 118.260 8.590 1 U 1.7e+07 0 e 0 1023 1017 1011 352 7.045 121.423 8.122 1 U 1.89e+07 0 e 0 1036 1029 1023 353 8.588 121.472 8.120 1 U 1.66e+07 0 e 0 1011 1029 1023 354 9.405 121.266 8.120 1 U 4.05e+06 0 e 0 987 1029 1023 355 7.914 121.373 8.119 1 U 8.33e+06 0 e 0 1045 1029 1023 356 7.917 117.980 7.043 1 U 2.3e+07 0 e 0 1045 1041 1036 357 8.134 117.979 7.045 1 U 2.06e+07 0 e 0 1023 1041 1036 358 7.048 109.005 7.917 1 U 2.78e+07 0 e 0 1036 1048 1045 359 8.194 109.008 7.916 1 U 2.72e+07 0 e 0 1056 1048 1045 360 7.917 121.298 8.202 1 U 2.01e+07 0 e 0 1045 1063 1056 361 7.047 121.372 8.207 1 U 6.1e+06 0 e 0 1036 1063 1056 362 8.210 127.881 9.245 1 U 1.82e+07 0 e 0 0 0 0 363 3.992 127.881 9.244 1 U 2.32e+07 0 e 0 1057 1077 1069 364 1.684 127.833 9.247 1 U 1.47e+07 0 e 0 0 0 0 365 2.254 127.748 9.245 1 U 3.57e+06 0 e 0 0 0 0 366 2.078 127.793 9.246 1 U 2.92e+06 0 e 0 0 0 0 367 4.378 127.851 9.246 1 U 8.42e+06 0 e 0 1070 1077 1069 368 9.244 108.965 8.208 1 U 2.99e+07 0 e 0 1069 1086 1082 369 8.924 108.894 8.207 1 U 1.37e+07 0 e 0 0 0 0 370 8.909 127.922 9.248 1 U 5.85e+06 0 e 0 0 0 0 371 7.756 122.887 8.055 1 U 3.31e+07 0 e 0 1116 1131 1128 372 7.325 122.880 8.059 1 U 5.41e+06 0 e 0 1137 1131 1128 373 4.806 121.603 7.760 1 U 3.44e+07 0 e 0 1106 1123 1116 374 4.195 117.866 7.322 1 U 8.14e+07 0 e 0 1129 1141 1137 375 1.986 117.839 7.319 1 U 8.08e+06 0 e 0 1140 1141 1137 376 4.793 117.936 7.322 1 U 1.4e+07 0 e 0 1138 1141 1137 377 4.790 117.956 8.656 1 U 2.65e+07 0 e 0 1138 1156 1150 378 1.988 117.937 8.657 1 U 2.22e+07 0 e 0 1140 1156 1150 379 8.437 118.187 8.268 1 U 2.69e+07 0 e 0 0 0 0 380 8.271 118.133 8.268 1 U 7.93e+07 0 e 0 0 0 0 381 0.855 120.580 8.453 1 U 2.52e+07 0 e 0 0 0 0 382 2.068 120.516 8.450 1 U 8.19e+06 0 e 0 1175 1189 1183 383 8.266 120.641 8.450 1 U 2.39e+07 0 e 0 1173 1189 1183 384 4.248 120.638 8.450 1 U 3.01e+07 0 e 0 1184 1189 1183 385 4.230 119.811 8.533 1 U 1.96e+07 0 e 0 0 0 0 386 2.670 119.797 8.534 1 U 5.39e+06 0 e 0 0 0 0 387 8.528 119.498 8.528 1 U 2.83e+08 0 e 0 0 0 0 388 8.329 119.615 8.531 1 U 9.63e+06 0 e 0 0 0 0 389 1.604 119.792 8.533 1 U 2.02e+07 0 e 0 1200 1206 1198 390 1.801 119.819 8.532 1 U 1.76e+07 0 e 0 1201 1206 1198 391 0.858 119.830 8.532 1 U 3.21e+07 0 e 0 0 0 0 392 2.021 119.827 8.536 1 U 9.42e+06 0 e 0 0 0 0 393 7.793 117.341 8.803 1 U 5.8e+06 0 e 0 1428 1421 1413 394 7.123 132.039 8.701 1 U 1.49e+07 0 e 0 1283 1278 1275 395 8.704 116.066 7.127 1 U 1.29e+07 0 e 0 1275 1289 1283 396 9.372 116.164 7.132 1 U 2.66e+06 0 e 0 1295 1289 1283 397 5.257 115.941 7.127 1 U 6.84e+06 0 e 0 0 0 0 398 5.256 121.467 9.376 1 U 3.61e+07 0 e 0 0 0 0 399 9.325 119.733 9.098 1 U 7.47e+06 0 e 0 0 0 0 400 4.855 127.031 9.110 1 U 2.75e+07 0 e 0 1336 1352 1346 401 1.219 127.016 9.108 1 U 2.33e+07 0 e 0 1338 1352 1346 402 8.912 127.039 9.104 1 U 5.43e+06 0 e 0 1359 1352 1346 403 5.222 127.029 9.109 1 U 1.4e+07 0 e 0 1347 1352 1346 404 2.298 127.012 9.110 1 U 7.32e+06 0 e 0 1349 1352 1346 405 1.919 127.010 9.108 1 U 1.23e+07 0 e 0 1348 1352 1346 406 1.672 127.059 9.114 1 U 6.74e+06 0 e 0 1353 1352 1346 407 1.434 127.034 9.110 1 U 1.48e+07 0 e 0 0 0 0 408 5.218 113.477 8.914 1 U 2.61e+07 0 e 0 1347 1363 1359 409 2.294 113.535 8.915 1 U 1.58e+07 0 e 0 1349 1363 1359 410 1.664 113.407 8.914 1 U 1.15e+07 0 e 0 1353 1363 1359 411 9.117 113.466 8.914 1 U 2.59e+06 0 e 0 1346 1363 1359 412 7.554 107.949 8.214 1 U 1.9e+07 0 e 0 1386 1381 1378 413 8.211 112.413 7.554 1 U 1.85e+07 0 e 0 1378 1390 1386 414 8.805 115.386 7.792 1 U 5.43e+06 0 e 0 1413 1435 1428 415 5.223 107.415 8.925 1 U 2.44e+07 0 e 0 0 0 0 416 9.353 107.406 8.926 1 U 1.6e+07 0 e 0 0 0 0 417 4.516 119.526 8.857 1 U 1.36e+07 0 e 0 0 0 0 418 4.903 122.617 9.253 1 U 2.61e+07 0 e 0 1457 1477 1470 419 9.263 125.522 8.502 1 U 3.25e+06 0 e 0 1470 1491 1484 420 4.742 122.971 8.383 1 U 4.06e+06 0 e 0 1503 1505 1502 421 4.721 119.725 8.068 1 U 7.13e+06 0 e 0 0 0 0 422 5.536 121.136 5.929 1 U 2.73e+06 0 e 0 0 0 0 423 4.708 112.123 6.827 1 U 2.18e+07 0 e 0 0 0 0 424 3.124 114.967 7.270 1 U 5.49e+06 0 e 0 0 0 0 425 3.995 114.144 7.249 1 U 1.64e+07 0 e 0 0 0 0 426 3.321 114.246 7.252 1 U 7.39e+06 0 e 0 0 0 0 427 1.706 115.084 7.269 1 U 3.95e+06 0 e 0 0 0 0 428 6.272 117.829 7.322 1 U 1.6e+07 0 e 0 1142 1141 1137 429 6.731 115.932 8.922 1 U 7.05e+06 0 e 0 1329 1339 1335 430 6.872 122.009 8.032 1 U 8.38e+06 0 e 0 732 731 727 431 7.090 122.264 8.033 1 U 3.57e+06 0 e 0 733 731 727 432 7.009 116.388 8.368 1 U 8.63e+06 0 e 0 481 480 476 433 2.996 118.636 8.975 1 U 5.2e+06 0 e 0 1326 1328 1324 434 1.487 108.938 7.120 1 U 2.5e+07 0 e 0 488 516 510 435 1.256 108.932 7.120 1 U 2.9e+07 0 e 0 0 0 0 436 4.004 118.409 8.384 1 U 7.23e+07 0 e 0 497 500 496 437 1.300 118.311 8.383 1 U 3.13e+07 0 e 0 0 0 0 438 8.387 108.995 7.119 1 U 1.57e+07 0 e 0 496 516 510 439 8.690 109.027 7.117 1 U 4.54e+06 0 e 0 0 0 0 440 1.280 131.966 8.707 1 U 6.48e+06 0 e 0 0 0 0 441 10.009 141.200 8.700 1 U 0 0 e 0 0 0 0 442 7.069 127.908 8.713 1 U 1.06e+07 0 e 0 0 0 0 443 7.121 108.956 7.119 1 U 1.31e+08 0 e 0 510 516 510 444 3.382 114.397 6.899 1 U 3.2e+06 0 e 0 0 0 0 445 6.736 113.888 7.145 1 U 3.49e+07 0 e 0 0 0 0 446 7.146 113.914 6.737 1 U 3.09e+07 0 e 0 0 0 0 447 5.395 121.427 5.900 1 U 5.7e+06 0 e 0 0 0 0 448 7.775 128.346 7.773 1 U 6.73e+07 0 e 0 0 0 0 449 10.100 128.317 7.773 1 U 3.59e+06 0 e 0 0 0 0 450 4.979 124.122 9.347 1 U 2.42e+07 0 e 0 0 0 0 451 8.929 124.084 9.345 1 U 9.83e+06 0 e 0 41 34 31 452 9.317 119.107 8.958 1 U 3.95e+06 0 e 0 31 48 41 453 5.153 119.172 8.955 1 U 2.91e+07 0 e 0 32 48 41 454 1.153 119.128 8.954 1 U 2.07e+07 0 e 0 33 48 41 455 9.266 121.291 8.196 1 U 3.21e+06 0 e 0 0 0 0 456 6.926 109.320 7.119 1 U 5.43e+06 0 e 0 0 0 0 457 7.784 113.572 7.786 1 U 2.88e+08 0 e 0 0 0 0 458 10.209 113.835 7.784 1 U 1.34e+07 0 e 0 445 456 452 459 8.394 113.054 7.797 1 U 2.35e+07 0 e 0 277 292 288 460 7.142 112.496 7.792 1 U 3.73e+07 0 e 0 0 0 0 461 8.685 129.078 9.527 1 U 3.14e+06 0 e 0 0 0 0 462 8.492 129.143 9.531 1 U 6.79e+06 0 e 0 0 0 0 463 7.139 128.936 9.534 1 U 3.71e+06 0 e 0 0 0 0 464 10.078 129.363 10.077 1 U 6.5e+06 0 e 0 0 0 0 465 4.992 125.918 10.077 1 U 6.21e+06 0 e 0 0 0 0 466 4.506 125.997 10.074 1 U 7.94e+06 0 e 0 0 0 0 467 5.645 125.888 10.073 1 U 3.22e+06 0 e 0 805 815 809 468 3.374 125.855 10.068 1 U 3.78e+06 0 e 0 0 0 0 469 2.537 125.808 10.072 1 U 3.28e+06 0 e 0 0 0 0 470 2.834 126.220 10.073 1 U 2.74e+06 0 e 0 0 0 0 471 3.492 109.015 7.121 1 U 4.81e+06 0 e 0 0 0 0 472 3.046 109.229 7.120 1 U 3.29e+06 0 e 0 0 0 0 473 3.532 122.829 8.113 1 U 4.48e+06 0 e 0 0 0 0 474 3.988 122.552 8.122 1 U 7.01e+06 0 e 0 181 184 180 475 5.197 122.810 8.103 1 U 3.72e+06 0 e 0 0 0 0 476 1.484 117.948 8.590 1 U 1.39e+07 0 e 0 0 0 0 477 1.260 118.288 8.589 1 U 2.21e+07 0 e 0 0 0 0 478 0.797 118.148 8.586 1 U 5.81e+06 0 e 0 0 0 0 479 0.282 118.263 8.585 1 U 6.28e+06 0 e 0 0 0 0 480 2.769 117.843 8.582 1 U 4.84e+06 0 e 0 0 27 20 481 4.835 118.216 8.590 1 U 1.34e+07 0 e 0 0 0 0 482 5.372 117.779 8.592 1 U 7.73e+06 0 e 0 0 0 0 483 -0.037 124.150 9.354 1 U 6.79e+06 0 e 0 0 0 0 484 0.600 124.242 9.354 1 U 3.93e+06 0 e 0 0 0 0 485 0.797 124.085 9.345 1 U 6.1e+06 0 e 0 0 0 0 486 1.648 124.153 9.350 1 U 3.43e+06 0 e 0 0 0 0 487 1.893 124.036 9.351 1 U 3.45e+06 0 e 0 0 0 0 488 2.328 124.138 9.344 1 U 2.85e+06 0 e 0 0 0 0 489 0.509 119.137 8.957 1 U 1.7e+07 0 e 0 47 48 41 490 7.475 119.163 8.958 1 U 7.8e+06 0 e 0 0 0 0 491 2.329 118.931 8.967 1 U 5.46e+06 0 e 0 0 0 0 492 -0.059 119.223 8.939 1 U 3.76e+06 0 e 0 0 0 0 493 8.934 118.135 8.361 1 U 5.41e+06 0 e 0 0 0 0 494 6.622 118.091 8.358 1 U 7.32e+06 0 e 0 0 0 0 495 5.226 118.009 8.360 1 U 6.16e+06 0 e 0 0 0 0 496 0.811 118.638 8.378 1 U 1.79e+07 0 e 0 0 0 0 497 0.649 129.432 9.110 1 U 1.58e+07 0 e 0 71 70 63 498 1.597 129.376 9.111 1 U 1.24e+07 0 e 0 67 70 63 499 1.450 129.379 9.110 1 U 8.47e+06 0 e 0 65 70 63 500 2.232 129.338 9.109 1 U 4.12e+06 0 e 0 0 0 0 501 2.581 129.513 9.111 1 U 1.21e+07 0 e 0 66 70 63 502 3.288 129.490 9.105 1 U 4.28e+06 0 e 0 0 0 0 503 4.390 129.454 9.112 1 U 7.29e+06 0 e 0 64 70 63 504 4.607 129.415 9.111 1 U 1.95e+07 0 e 0 0 0 0 505 5.061 129.367 9.110 1 U 9.79e+06 0 e 0 0 0 0 506 8.721 129.453 9.110 1 U 1.47e+07 0 e 0 0 0 0 507 7.501 129.524 9.113 1 U 3.31e+06 0 e 0 0 0 0 508 8.715 117.709 8.713 1 U 1.09e+08 0 e 0 75 79 75 509 9.113 117.727 8.713 1 U 2.14e+07 0 e 0 0 0 0 510 7.859 117.746 8.712 1 U 2.17e+07 0 e 0 0 0 0 511 4.695 117.764 8.714 1 U 1.12e+07 0 e 0 76 79 75 512 4.426 117.496 8.721 1 U 5.55e+06 0 e 0 0 0 0 513 3.639 117.798 8.723 1 U 4.13e+06 0 e 0 0 0 0 514 2.861 117.697 8.710 1 U 6.42e+06 0 e 0 78 79 75 515 2.574 117.729 8.712 1 U 1.15e+07 0 e 0 77 79 75 516 2.241 117.749 8.715 1 U 3.94e+06 0 e 0 0 0 0 517 1.585 117.573 8.721 1 U 6.1e+06 0 e 0 0 0 0 518 1.438 117.656 8.707 1 U 6.2e+06 0 e 0 0 0 0 519 0.655 117.787 8.716 1 U 5.82e+06 0 e 0 0 0 0 520 9.407 109.450 7.857 1 U 4.75e+06 0 e 0 0 0 0 521 9.117 109.555 7.858 1 U 5.57e+06 0 e 0 0 0 0 522 8.718 109.526 7.860 1 U 2.89e+07 0 e 0 0 0 0 523 7.860 109.465 7.861 1 U 1.29e+08 0 e 0 0 0 0 524 4.689 109.579 7.862 1 U 8.44e+06 0 e 0 0 0 0 525 2.871 109.588 7.864 1 U 3.39e+06 0 e 0 0 0 0 526 2.568 109.638 7.864 1 U 4.53e+06 0 e 0 0 0 0 527 2.244 109.291 7.857 1 U 3.22e+06 0 e 0 0 0 0 528 0.939 109.493 7.856 1 U 3.55e+06 0 e 0 0 0 0 529 0.643 109.524 7.857 1 U 3.18e+06 0 e 0 0 0 0 530 8.733 121.008 7.747 1 U 5.58e+06 0 e 0 0 0 0 531 9.412 120.996 7.742 1 U 2.67e+07 0 e 0 0 0 0 532 4.620 121.307 7.753 1 U 1.4e+07 0 e 0 90 93 89 533 4.124 121.183 7.748 1 U 8.81e+06 0 e 0 0 0 0 534 3.674 120.778 7.745 1 U 8.68e+06 0 e 0 0 0 0 535 3.024 121.337 7.748 1 U 9.52e+06 0 e 0 92 93 89 536 2.332 120.960 7.743 1 U 9.14e+06 0 e 0 91 93 89 537 1.572 111.230 9.413 1 U 3.19e+06 0 e 0 0 0 0 538 3.041 111.280 9.415 1 U 3.62e+06 0 e 0 0 0 0 539 3.640 111.344 9.406 1 U 4.27e+06 0 e 0 0 0 0 540 7.748 111.325 9.411 1 U 2.63e+07 0 e 0 0 0 0 541 8.123 133.315 9.860 1 U 2.34e+06 0 e 0 0 0 0 542 4.221 133.486 9.859 1 U 3.48e+06 0 e 0 0 0 0 543 3.812 133.405 9.861 1 U 1.56e+07 0 e 0 0 0 0 544 2.041 133.481 9.860 1 U 1.52e+07 0 e 0 0 0 0 545 3.460 133.485 9.859 1 U 2.84e+06 0 e 0 0 0 0 546 0.617 133.452 9.857 1 U 9.71e+06 0 e 0 0 0 0 547 0.673 113.054 8.170 1 U 5.11e+06 0 e 0 0 0 0 548 4.342 113.797 8.335 1 U 1.97e+07 0 e 0 0 0 0 549 3.956 113.703 8.337 1 U 6.01e+06 0 e 0 0 0 0 550 5.193 113.866 8.336 1 U 1.78e+07 0 e 0 0 0 0 551 8.727 113.866 8.335 1 U 6.86e+06 0 e 0 0 0 0 552 8.135 113.852 8.332 1 U 5.3e+06 0 e 0 0 0 0 553 0.846 113.881 8.336 1 U 2.24e+07 0 e 0 0 0 0 554 0.181 121.517 5.902 1 U 4.27e+06 0 e 0 174 176 171 555 0.635 121.589 5.908 1 U 3.82e+06 0 e 0 175 176 171 556 0.861 121.365 5.904 1 U 9e+06 0 e 0 173 176 171 557 2.836 121.145 5.899 1 U 3.57e+06 0 e 0 0 0 0 558 3.948 121.160 5.903 1 U 2.65e+06 0 e 0 172 176 171 559 5.903 121.385 5.900 1 U 3.35e+07 0 e 0 171 176 171 560 0.173 121.517 5.883 1 U 4.84e+06 0 e 0 0 0 0 561 8.984 124.990 8.315 1 U 1.68e+07 0 e 0 0 0 0 562 8.119 125.120 8.321 1 U 8.3e+06 0 e 0 0 0 0 563 7.614 125.268 8.330 1 U 1.1e+07 0 e 0 0 0 0 564 6.733 124.984 8.313 1 U 3.94e+06 0 e 0 0 0 0 565 5.678 125.021 8.313 1 U 4.31e+06 0 e 0 0 0 0 566 4.697 125.446 8.335 1 U 1.28e+07 0 e 0 0 0 0 567 2.289 125.215 8.327 1 U 4.72e+06 0 e 0 0 0 0 568 3.562 125.180 8.328 1 U 9.15e+06 0 e 0 0 0 0 569 0.623 125.340 8.319 1 U 5.27e+06 0 e 0 0 0 0 570 4.305 115.516 7.600 1 U 2.05e+07 0 e 0 0 0 0 571 5.399 115.547 7.604 1 U 3.59e+06 0 e 0 0 0 0 572 3.098 115.535 7.600 1 U 3.04e+07 0 e 0 0 0 0 573 2.632 115.538 7.601 1 U 1.89e+07 0 e 0 0 0 0 574 1.462 115.994 7.610 1 U 1.27e+07 0 e 0 0 0 0 575 3.794 115.941 7.613 1 U 5.79e+06 0 e 0 0 0 0 576 8.323 116.037 7.611 1 U 1.45e+07 0 e 0 0 0 0 577 7.507 116.392 7.503 1 U 6.72e+07 0 e 0 0 0 0 578 4.018 116.386 7.508 1 U 4.93e+06 0 e 0 0 0 0 579 0.637 116.339 7.505 1 U 5.82e+06 0 e 0 0 0 0 580 5.068 99.258 7.479 1 U 1.3e+07 0 e 0 0 0 0 581 3.283 99.250 7.479 1 U 2.35e+07 0 e 0 0 0 0 582 2.285 99.183 7.479 1 U 1.62e+07 0 e 0 0 0 0 583 1.598 99.196 7.476 1 U 8.66e+06 0 e 0 0 0 0 584 1.174 99.199 7.480 1 U 3.72e+06 0 e 0 0 0 0 585 0.858 99.121 7.482 1 U 5.38e+06 0 e 0 0 0 0 586 0.630 99.251 7.478 1 U 2.54e+07 0 e 0 0 0 0 587 4.599 99.337 7.473 1 U 4.17e+06 0 e 0 0 0 0 588 8.472 99.143 7.476 1 U 3.31e+06 0 e 0 0 0 0 589 8.953 99.206 7.478 1 U 8.92e+06 0 e 0 0 0 0 590 0.384 119.890 8.490 1 U 6.65e+06 0 e 0 0 0 0 591 0.610 119.965 8.489 1 U 1.37e+07 0 e 0 0 0 0 592 1.403 120.055 8.488 1 U 1.33e+07 0 e 0 0 0 0 593 1.809 119.837 8.484 1 U 5.82e+06 0 e 0 0 0 0 594 4.800 120.000 8.492 1 U 1.49e+07 0 e 0 0 0 0 595 9.532 120.025 8.489 1 U 6.15e+06 0 e 0 0 0 0 596 0.488 123.573 7.331 1 U 7.03e+06 0 e 0 0 0 0 597 1.143 123.483 7.331 1 U 5.04e+06 0 e 0 0 0 0 598 1.400 123.589 7.329 1 U 6.09e+06 0 e 0 0 0 0 599 5.143 123.477 7.337 1 U 6.81e+06 0 e 0 0 0 0 600 7.337 123.539 7.336 1 U 4e+07 0 e 0 0 0 0 601 0.578 119.383 9.096 1 U 3.29e+07 0 e 0 0 0 0 602 1.450 119.410 9.085 1 U 2.5e+07 0 e 0 0 0 0 603 1.609 119.401 9.084 1 U 2.25e+07 0 e 0 0 0 0 604 2.626 119.516 9.105 1 U 3.68e+06 0 e 0 0 0 0 605 4.752 119.388 9.096 1 U 3.81e+07 0 e 0 0 0 0 606 8.863 119.440 9.088 1 U 1.54e+07 0 e 0 0 0 0 607 9.534 119.275 9.095 1 U 5.05e+06 0 e 0 0 0 0 608 0.304 119.465 9.089 1 U 5.36e+06 0 e 0 0 0 0 609 4.626 120.961 8.822 1 U 2.74e+07 0 e 0 0 0 0 610 4.357 120.995 8.823 1 U 4.94e+06 0 e 0 0 0 0 611 5.319 120.447 8.823 1 U 2.46e+06 0 e 0 0 0 0 612 8.826 120.972 8.823 1 U 8.56e+07 0 e 0 0 0 0 613 0.978 121.031 8.821 1 U 9.28e+06 0 e 0 0 0 0 614 1.463 120.958 8.822 1 U 1.45e+07 0 e 0 0 0 0 615 1.671 121.064 8.819 1 U 8.52e+06 0 e 0 0 0 0 616 0.254 121.034 8.822 1 U 3.26e+06 0 e 0 0 0 0 617 2.431 120.552 8.831 1 U 2.53e+06 0 e 0 0 0 0 618 5.656 122.997 8.879 1 U 3.69e+06 0 e 0 0 0 0 619 7.002 122.707 8.879 1 U 2.69e+06 0 e 0 0 0 0 620 9.416 122.817 8.891 1 U 3.68e+06 0 e 0 0 0 0 621 9.084 122.971 8.881 1 U 9.89e+06 0 e 0 0 0 0 622 8.882 122.889 8.881 1 U 8.66e+07 0 e 0 0 0 0 623 1.882 122.944 8.879 1 U 1.22e+07 0 e 0 0 0 0 624 1.685 122.818 8.881 1 U 2.01e+07 0 e 0 0 0 0 625 1.433 122.971 8.879 1 U 6.42e+06 0 e 0 0 0 0 626 8.959 123.794 8.952 1 U 6.59e+07 0 e 0 0 0 0 627 4.559 123.788 8.951 1 U 7.9e+06 0 e 0 267 270 266 628 4.353 123.762 8.952 1 U 2.35e+07 0 e 0 0 0 0 629 2.692 123.716 8.952 1 U 1.41e+07 0 e 0 269 270 266 630 2.049 123.741 8.953 1 U 1.3e+07 0 e 0 268 270 266 631 1.575 123.840 8.954 1 U 5.73e+06 0 e 0 0 0 0 632 0.591 123.854 8.953 1 U 4.4e+06 0 e 0 0 0 0 633 4.147 118.804 8.024 1 U 1.12e+07 0 e 0 0 0 0 634 3.844 118.857 8.025 1 U 1.71e+07 0 e 0 0 0 0 635 2.761 118.801 8.029 1 U 4.58e+06 0 e 0 0 0 0 636 8.026 118.823 8.025 1 U 1.74e+08 0 e 0 0 0 0 637 0.877 118.830 8.031 1 U 5.36e+06 0 e 0 0 0 0 638 8.400 127.152 8.398 1 U 1.02e+08 0 e 0 0 0 0 639 8.957 127.752 8.396 1 U 3.04e+06 0 e 0 0 0 0 640 7.794 127.315 8.394 1 U 1.5e+07 0 e 0 0 0 0 641 4.568 127.007 8.402 1 U 2.99e+07 0 e 0 0 0 0 642 2.644 127.231 8.397 1 U 9.43e+06 0 e 0 0 0 0 643 2.381 127.395 8.393 1 U 9.01e+06 0 e 0 0 0 0 644 2.044 127.277 8.392 1 U 7.42e+06 0 e 0 0 0 0 645 1.659 126.769 8.410 1 U 3.32e+07 0 e 0 0 0 0 646 1.219 127.278 8.390 1 U 3.93e+06 0 e 0 0 0 0 647 0.777 126.853 8.408 1 U 1.55e+07 0 e 0 0 0 0 648 9.359 125.655 8.246 1 U 4.03e+06 0 e 0 0 0 0 649 8.823 125.704 8.241 1 U 3.25e+06 0 e 0 0 0 0 650 8.258 125.556 8.247 1 U 5.12e+07 0 e 0 0 0 0 651 5.216 125.298 8.242 1 U 4.65e+06 0 e 0 0 0 0 652 -0.040 125.713 8.249 1 U 5.11e+06 0 e 0 0 0 0 653 0.502 125.667 8.244 1 U 7.2e+06 0 e 0 1461 1463 1456 654 1.632 125.638 8.244 1 U 1.61e+07 0 e 0 0 0 0 655 1.033 125.574 8.241 1 U 6.29e+06 0 e 0 1458 1463 1456 656 0.842 125.644 8.241 1 U 4.63e+06 0 e 0 0 0 0 657 1.406 125.587 8.254 1 U 5.79e+06 0 e 0 0 0 0 658 2.296 125.957 8.245 1 U 3.71e+06 0 e 0 0 0 0 659 3.270 125.908 8.239 1 U 2.66e+06 0 e 0 0 0 0 660 3.997 125.050 8.251 1 U 4.34e+06 0 e 0 0 0 0 661 4.653 125.643 8.250 1 U 5.63e+06 0 e 0 0 0 0 662 4.458 125.504 8.247 1 U 3.96e+06 0 e 0 0 0 0 663 4.941 125.642 8.244 1 U 2.68e+07 0 e 0 0 0 0 664 7.557 113.073 7.794 1 U 2.33e+07 0 e 0 0 0 0 665 4.552 113.173 7.795 1 U 9.55e+06 0 e 0 0 0 0 666 3.763 113.172 7.798 1 U 6.61e+06 0 e 0 0 0 0 667 2.788 112.737 7.795 1 U 1.77e+07 0 e 0 290 292 288 668 1.788 113.610 7.786 1 U 1.53e+07 0 e 0 0 0 0 669 1.302 112.662 9.171 1 U 1.83e+06 0 e 0 0 0 0 670 1.286 113.737 8.349 1 U 2.27e+06 0 e 0 0 0 0 671 1.283 113.655 8.313 1 U 1.66e+06 0 e 0 0 0 0 672 1.257 112.864 9.169 1 U 1.68e+06 0 e 0 0 0 0 673 1.240 112.878 8.780 1 U 1.7e+06 0 e 0 0 0 0 674 1.231 113.358 8.835 1 U 2.05e+06 0 e 0 0 0 0 675 1.238 113.465 8.435 1 U 1.85e+06 0 e 0 0 0 0 676 1.216 113.364 8.616 1 U 1.71e+06 0 e 0 0 0 0 677 1.224 113.154 8.172 1 U 1.98e+06 0 e 0 0 0 0 678 1.225 112.828 8.776 1 U 1.82e+06 0 e 0 0 0 0 679 1.194 113.480 8.870 1 U 5.54e+06 0 e 0 0 0 0 680 1.188 113.105 8.771 1 U 1.65e+06 0 e 0 0 0 0 681 1.039 113.380 7.973 1 U 2.66e+06 0 e 0 0 0 0 682 1.035 113.306 8.392 1 U 1.6e+06 0 e 0 0 0 0 683 0.955 113.302 8.612 1 U 1.85e+06 0 e 0 0 0 0 684 0.891 113.583 8.917 1 U 2.12e+06 0 e 0 0 0 0 685 0.884 113.380 9.411 1 U 2.15e+06 0 e 0 0 0 0 686 0.862 113.759 8.266 1 U 2.35e+06 0 e 0 0 0 0 687 0.863 113.108 8.508 1 U 2.37e+06 0 e 0 0 0 0 688 0.853 113.650 8.126 1 U 2.84e+06 0 e 0 0 0 0 689 0.843 113.072 8.019 1 U 1.51e+06 0 e 0 0 0 0 690 0.840 113.730 8.421 1 U 1.69e+06 0 e 0 0 0 0 691 0.818 112.886 8.096 1 U 2.8e+06 0 e 0 0 0 0 692 0.798 113.104 8.426 1 U 1.78e+06 0 e 0 0 0 0 693 0.786 112.824 9.391 1 U 1.59e+06 0 e 0 0 0 0 694 0.723 112.624 7.953 1 U 2.51e+06 0 e 0 0 0 0 695 0.690 113.202 9.352 1 U 2.29e+06 0 e 0 0 0 0 696 0.667 113.466 8.296 1 U 2.13e+06 0 e 0 0 0 0 697 0.661 113.235 8.880 1 U 2e+06 0 e 0 0 0 0 698 0.632 113.780 9.413 1 U 3.79e+06 0 e 0 0 0 0 699 0.611 113.700 8.329 1 U 3.23e+06 0 e 0 0 0 0 700 0.619 112.990 8.832 1 U 1.62e+06 0 e 0 0 0 0 701 0.599 113.475 8.442 1 U 2.54e+06 0 e 0 0 0 0 702 0.591 113.437 8.212 1 U 1.62e+06 0 e 0 0 0 0 703 0.590 113.525 8.108 1 U 2.01e+06 0 e 0 0 0 0 704 0.561 113.256 8.255 1 U 2.18e+06 0 e 0 0 0 0 705 0.526 112.648 8.260 1 U 2.06e+06 0 e 0 0 0 0 706 0.475 112.857 8.178 1 U 2.26e+06 0 e 0 0 0 0 707 0.475 112.913 7.850 1 U 1.93e+06 0 e 0 0 0 0 708 0.908 113.184 7.793 1 U 6.72e+06 0 e 0 0 0 0 709 10.195 107.127 7.548 1 U 2.77e+06 0 e 0 0 0 0 710 8.393 107.039 7.547 1 U 4.02e+06 0 e 0 0 0 0 711 7.783 107.230 7.548 1 U 3.41e+07 0 e 0 0 0 0 712 7.548 107.204 7.548 1 U 9.55e+07 0 e 0 0 0 0 713 4.779 107.237 7.541 1 U 5.79e+06 0 e 0 0 0 0 714 4.199 107.214 7.545 1 U 4e+06 0 e 0 0 0 0 715 3.767 107.206 7.548 1 U 3.04e+07 0 e 0 0 0 0 716 2.704 107.272 7.546 1 U 3.17e+06 0 e 0 0 0 0 717 3.311 107.064 7.537 1 U 2.89e+06 0 e 0 0 0 0 718 7.748 117.091 7.746 1 U 5.58e+06 0 e 0 0 0 0 719 7.541 117.027 7.749 1 U 1.44e+07 0 e 0 0 0 0 720 7.253 117.035 7.750 1 U 6.68e+06 0 e 0 0 0 0 721 10.193 117.084 7.749 1 U 3.12e+07 0 e 0 0 0 0 722 3.777 117.097 7.747 1 U 1.14e+07 0 e 0 0 0 0 723 7.747 112.419 10.191 1 U 2.1e+07 0 e 0 0 0 0 724 7.247 112.414 10.191 1 U 2.15e+07 0 e 0 0 0 0 725 0.634 112.453 10.195 1 U 4.54e+06 0 e 0 0 0 0 726 0.395 112.743 10.194 1 U 2.57e+06 0 e 0 0 0 0 727 1.405 112.417 10.196 1 U 2.88e+06 0 e 0 0 0 0 728 1.412 114.143 7.247 1 U 1.23e+07 0 e 0 321 326 319 729 1.114 114.074 7.244 1 U 7.94e+06 0 e 0 323 326 319 730 0.635 114.171 7.249 1 U 2.37e+07 0 e 0 0 0 0 731 7.249 114.168 7.248 1 U 1.47e+08 0 e 0 0 0 0 732 7.735 113.625 7.238 1 U 6.26e+06 0 e 0 0 0 0 733 8.369 114.101 7.243 1 U 3.06e+06 0 e 0 0 0 0 734 10.191 114.132 7.247 1 U 1.9e+07 0 e 0 0 0 0 735 5.550 127.551 8.345 1 U 4.13e+06 0 e 0 0 0 0 736 4.008 127.692 8.351 1 U 1.27e+07 0 e 0 0 0 0 737 2.735 127.551 8.340 1 U 3.55e+06 0 e 0 0 0 0 738 1.419 127.685 8.348 1 U 1.44e+07 0 e 0 0 0 0 739 1.069 127.761 8.359 1 U 7.24e+06 0 e 0 0 0 0 740 0.624 127.631 8.347 1 U 8.49e+06 0 e 0 0 0 0 741 0.407 127.769 8.348 1 U 5.34e+06 0 e 0 338 340 333 742 4.954 127.703 8.336 1 U 4.02e+06 0 e 0 334 340 333 743 7.793 124.870 8.817 1 U 3.8e+06 0 e 0 0 0 0 744 7.239 124.729 8.792 1 U 1.02e+07 0 e 0 0 0 0 745 8.324 124.620 8.789 1 U 3.97e+06 0 e 0 0 0 0 746 8.265 124.243 8.783 1 U 4.13e+06 0 e 0 0 0 0 747 10.086 124.868 8.823 1 U 3.58e+06 0 e 0 0 0 0 748 10.006 124.722 8.781 1 U 2.41e+06 0 e 0 0 0 0 749 4.945 124.740 8.795 1 U 2.98e+07 0 e 0 0 0 0 750 4.119 124.675 8.790 1 U 8.92e+06 0 e 0 343 346 342 751 3.782 124.572 8.809 1 U 4.93e+06 0 e 0 0 0 0 752 2.486 124.724 8.796 1 U 8.67e+06 0 e 0 0 0 0 753 2.172 124.760 8.798 1 U 1.25e+07 0 e 0 0 0 0 754 1.748 124.816 8.814 1 U 4.63e+06 0 e 0 0 0 0 755 0.394 124.684 8.792 1 U 8.47e+06 0 e 0 0 0 0 756 0.616 124.577 8.804 1 U 5.85e+06 0 e 0 0 0 0 757 0.981 124.740 8.796 1 U 6.66e+06 0 e 0 0 0 0 758 8.690 115.834 6.755 1 U 2.46e+06 0 e 0 0 0 0 759 8.684 115.851 6.728 1 U 2.65e+06 0 e 0 0 0 0 760 8.262 115.694 6.740 1 U 2.7e+06 0 e 0 0 0 0 761 7.633 115.889 6.732 1 U 1.5e+07 0 e 0 0 0 0 762 6.933 115.814 6.735 1 U 4.3e+06 0 e 0 0 0 0 763 6.737 115.906 6.734 1 U 1.03e+08 0 e 0 0 0 0 764 4.502 115.866 6.735 1 U 6.62e+06 0 e 0 0 0 0 765 4.013 115.847 6.728 1 U 4.16e+06 0 e 0 0 0 0 766 2.930 115.792 6.730 1 U 3.52e+06 0 e 0 0 0 0 767 2.631 116.063 6.736 1 U 3.57e+06 0 e 0 0 0 0 768 2.327 115.913 6.748 1 U 3.46e+06 0 e 0 0 0 0 769 1.942 115.928 6.733 1 U 1.75e+07 0 e 0 0 0 0 770 1.576 116.074 6.736 1 U 4.75e+06 0 e 0 0 0 0 771 6.754 114.892 7.629 1 U 6.67e+06 0 e 0 0 0 0 772 1.590 114.654 7.635 1 U 4.34e+06 0 e 0 0 0 0 773 2.036 115.123 7.624 1 U 4.49e+06 0 e 0 0 0 0 774 1.996 114.691 7.647 1 U 1.01e+06 0 e 0 0 0 0 775 2.859 115.069 7.695 1 U 7.59e+06 0 e 0 917 919 914 776 2.349 114.989 7.697 1 U 9.37e+06 0 e 0 916 919 914 777 1.857 114.992 7.695 1 U 6.38e+06 0 e 0 0 0 0 778 0.716 115.027 7.695 1 U 1.02e+07 0 e 0 0 0 0 779 8.936 115.079 7.695 1 U 2.5e+07 0 e 0 915 919 914 780 9.377 114.826 7.646 1 U 2.8e+06 0 e 0 0 0 0 781 7.242 114.834 7.631 1 U 2.69e+06 0 e 0 0 0 0 782 1.585 121.706 8.254 1 U 2.63e+07 0 e 0 0 0 0 783 4.010 121.832 8.251 1 U 5.23e+06 0 e 0 0 0 0 784 4.543 122.056 8.259 1 U 5.58e+06 0 e 0 0 0 0 785 7.632 121.669 8.254 1 U 1.06e+07 0 e 0 0 0 0 786 8.252 121.741 8.254 1 U 7.65e+07 0 e 0 0 0 0 787 6.736 121.799 8.262 1 U 2.71e+06 0 e 0 0 0 0 788 6.872 121.647 8.257 1 U 2.53e+06 0 e 0 0 0 0 789 2.828 121.993 8.261 1 U 3.54e+06 0 e 0 0 0 0 790 1.977 121.717 8.263 1 U 3.18e+06 0 e 0 0 0 0 791 6.941 119.878 8.672 1 U 6.63e+06 0 e 0 0 0 0 792 5.597 119.907 8.663 1 U 3.94e+06 0 e 0 0 0 0 793 4.684 119.943 8.680 1 U 3.72e+06 0 e 0 0 0 0 794 4.520 120.084 8.680 1 U 3.59e+06 0 e 0 383 386 382 795 3.847 119.963 8.671 1 U 2.74e+06 0 e 0 0 0 0 796 8.676 119.899 8.675 1 U 2.7e+07 0 e 0 0 0 0 797 2.756 119.945 8.667 1 U 6.73e+06 0 e 0 384 386 382 798 2.289 119.621 8.673 1 U 5.32e+06 0 e 0 0 0 0 799 1.995 119.876 8.677 1 U 1.07e+07 0 e 0 0 0 0 800 0.132 119.544 8.678 1 U 3.02e+06 0 e 0 0 0 0 801 4.545 112.887 8.964 1 U 5.5e+06 0 e 0 0 0 0 802 4.520 112.882 8.939 1 U 6.04e+06 0 e 0 0 0 0 803 4.038 112.907 8.958 1 U 4.97e+06 0 e 0 0 0 0 804 3.732 112.734 8.948 1 U 2.98e+06 0 e 0 0 0 0 805 2.201 108.959 7.920 1 U 3.7e+06 0 e 0 0 0 0 806 1.921 109.040 7.915 1 U 3.45e+06 0 e 0 0 0 0 807 1.616 109.019 7.918 1 U 1.71e+07 0 e 0 0 0 0 808 1.204 109.132 7.914 1 U 6.42e+06 0 e 0 0 0 0 809 0.313 109.100 7.917 1 U 3.53e+06 0 e 0 0 0 0 810 8.375 116.581 7.982 1 U 4.63e+06 0 e 0 0 0 0 811 3.999 116.616 7.979 1 U 1.16e+07 0 e 0 0 0 0 812 3.008 116.836 7.988 1 U 3.88e+06 0 e 0 0 0 0 813 2.284 107.721 9.953 1 U 3.57e+06 0 e 0 0 0 0 814 1.618 107.769 9.948 1 U 2.29e+06 0 e 0 0 0 0 815 4.032 107.642 9.948 1 U 5.45e+06 0 e 0 0 0 0 816 8.183 107.480 9.954 1 U 2.65e+06 0 e 0 0 0 0 817 4.251 109.037 7.123 1 U 3.03e+06 0 e 0 0 0 0 818 0.742 109.174 7.114 1 U 3.39e+06 0 e 0 0 0 0 819 8.133 118.828 8.377 1 U 2.28e+07 0 e 0 0 0 0 820 8.379 118.587 8.379 1 U 2.76e+08 0 e 0 0 0 0 821 7.114 118.358 8.386 1 U 1.64e+07 0 e 0 0 0 0 822 7.001 118.880 8.377 1 U 1.85e+07 0 e 0 0 0 0 823 4.254 118.795 8.377 1 U 9.68e+06 0 e 0 0 0 0 824 2.984 118.263 8.376 1 U 2.58e+06 0 e 0 0 0 0 825 1.640 118.790 8.377 1 U 7.37e+07 0 e 0 0 0 0 826 8.890 126.277 8.642 1 U 6.44e+06 0 e 0 0 0 0 827 8.645 126.254 8.643 1 U 9.15e+07 0 e 0 486 489 486 828 8.403 126.335 8.644 1 U 6.7e+06 0 e 0 0 0 0 829 7.005 126.380 8.643 1 U 4.71e+06 0 e 0 0 0 0 830 0.731 126.220 8.645 1 U 9.73e+06 0 e 0 0 0 0 831 8.616 116.567 8.370 1 U 4.36e+06 0 e 0 0 0 0 832 8.366 116.467 8.365 1 U 1.35e+08 0 e 0 476 480 476 833 8.145 116.442 8.371 1 U 5.66e+06 0 e 0 0 0 0 834 7.817 116.180 8.394 1 U 6.88e+06 0 e 0 0 0 0 835 2.417 116.223 8.386 1 U 3.82e+06 0 e 0 0 0 0 836 1.437 116.002 8.373 1 U 3.6e+06 0 e 0 0 0 0 837 8.926 117.755 8.097 1 U 4.13e+06 0 e 0 0 0 0 838 8.108 117.889 8.102 1 U 1.23e+08 0 e 0 0 0 0 839 7.784 117.848 8.103 1 U 5.13e+06 0 e 0 0 0 0 840 4.714 118.105 8.106 1 U 5.11e+06 0 e 0 0 0 0 841 4.486 117.830 8.104 1 U 3.41e+06 0 e 0 0 0 0 842 1.792 117.548 8.099 1 U 3.87e+06 0 e 0 0 0 0 843 0.737 118.157 8.098 1 U 4.35e+06 0 e 0 0 0 0 844 2.580 109.232 8.168 1 U 3.03e+06 0 e 0 0 0 0 845 2.510 109.355 8.199 1 U 3.38e+06 0 e 0 0 0 0 846 2.165 108.966 8.207 1 U 5.65e+06 0 e 0 0 0 0 847 1.753 108.933 8.207 1 U 1.83e+07 0 e 0 0 0 0 848 1.402 109.025 8.178 1 U 7.57e+06 0 e 0 0 0 0 849 0.694 109.010 8.207 1 U 2.19e+07 0 e 0 0 0 0 850 1.208 108.191 8.213 1 U 1.25e+07 0 e 0 0 0 0 851 5.223 108.898 8.211 1 U 7.7e+06 0 e 0 0 0 0 852 8.397 108.929 8.173 1 U 4.02e+06 0 e 0 0 0 0 853 8.207 108.692 8.209 1 U 2.14e+08 0 e 0 0 0 0 854 1.050 109.249 8.175 1 U 2.56e+06 0 e 0 0 0 0 855 8.169 113.858 7.783 1 U 2.86e+07 0 e 0 0 0 0 856 8.966 113.379 7.788 1 U 2.25e+06 0 e 0 0 0 0 857 6.905 114.165 7.785 1 U 4.86e+06 0 e 0 0 0 0 858 1.616 113.701 7.784 1 U 1.47e+07 0 e 0 0 0 0 859 0.758 113.728 7.784 1 U 9.12e+06 0 e 0 0 0 0 860 10.220 126.329 10.219 1 U 4.9e+07 0 e 0 0 0 0 861 8.937 126.437 10.231 1 U 1.88e+06 0 e 0 0 0 0 862 8.884 126.258 10.205 1 U 2.64e+06 0 e 0 0 0 0 863 7.780 126.479 10.219 1 U 4.86e+06 0 e 0 0 0 0 864 4.527 126.285 10.216 1 U 1.42e+07 0 e 0 0 0 0 865 1.629 126.355 10.219 1 U 9.46e+06 0 e 0 0 0 0 866 0.729 126.267 10.217 1 U 7.8e+06 0 e 0 0 0 0 867 1.040 124.954 8.907 1 U 5.58e+06 0 e 0 0 0 0 868 1.439 125.062 8.914 1 U 2.13e+07 0 e 0 437 440 433 869 1.778 124.994 8.914 1 U 1.23e+07 0 e 0 436 440 433 870 4.072 125.108 8.917 1 U 2.14e+07 0 e 0 0 0 0 871 4.529 125.073 8.914 1 U 9.39e+06 0 e 0 434 440 433 872 4.762 124.923 8.919 1 U 6.84e+06 0 e 0 0 0 0 873 8.134 125.110 8.911 1 U 3.68e+06 0 e 0 0 0 0 874 8.684 125.142 8.917 1 U 6.14e+06 0 e 0 0 0 0 875 8.918 125.031 8.914 1 U 7.24e+07 0 e 0 0 0 0 876 10.251 125.114 8.918 1 U 2.05e+06 0 e 0 0 0 0 877 0.734 125.077 8.916 1 U 1.31e+07 0 e 0 441 440 433 878 8.722 128.198 8.721 1 U 1.09e+08 0 e 0 0 0 0 879 4.559 128.049 8.712 1 U 5.15e+06 0 e 0 0 0 0 880 4.725 128.322 8.718 1 U 4.25e+06 0 e 0 0 0 0 881 4.119 128.382 8.724 1 U 2.74e+07 0 e 0 0 0 0 882 3.354 127.928 8.723 1 U 4.94e+06 0 e 0 0 0 0 883 3.124 128.022 8.717 1 U 2.65e+06 0 e 0 0 0 0 884 2.616 127.921 8.703 1 U 4.02e+06 0 e 0 0 0 0 885 2.145 128.035 8.712 1 U 6.07e+06 0 e 0 0 0 0 886 1.756 127.860 8.708 1 U 7.9e+06 0 e 0 0 0 0 887 1.469 128.351 8.724 1 U 2.1e+07 0 e 0 0 0 0 888 1.275 128.356 8.723 1 U 1.57e+07 0 e 0 0 0 0 889 1.046 128.325 8.724 1 U 4.68e+06 0 e 0 0 0 0 890 0.862 128.207 8.726 1 U 5.19e+06 0 e 0 0 0 0 891 0.471 128.037 8.742 1 U 2.81e+06 0 e 0 0 0 0 892 7.411 107.636 7.411 1 U 1.11e+08 0 e 0 623 624 623 893 7.900 107.662 7.411 1 U 2.83e+07 0 e 0 0 0 0 894 9.000 107.657 7.405 1 U 4.73e+06 0 e 0 0 0 0 895 7.212 107.550 7.411 1 U 3.46e+06 0 e 0 0 0 0 896 10.128 107.641 7.406 1 U 3.65e+06 0 e 0 0 0 0 897 3.847 107.644 7.411 1 U 4.87e+07 0 e 0 625 624 623 898 4.346 107.778 7.408 1 U 3.45e+06 0 e 0 0 0 0 899 3.013 107.636 7.406 1 U 3.03e+06 0 e 0 0 0 0 900 2.341 107.669 7.413 1 U 3.66e+06 0 e 0 0 0 0 901 0.882 107.914 7.414 1 U 2.06e+06 0 e 0 0 0 0 902 0.632 107.698 7.412 1 U 2.24e+06 0 e 0 0 0 0 903 10.053 116.788 7.897 1 U 2.41e+06 0 e 0 0 0 0 904 9.002 116.796 7.892 1 U 2.66e+07 0 e 0 0 0 0 905 7.894 116.767 7.893 1 U 1.62e+08 0 e 0 613 619 613 906 7.407 116.673 7.894 1 U 2.67e+07 0 e 0 623 619 613 907 7.688 116.768 7.895 1 U 4.73e+06 0 e 0 0 0 0 908 4.845 116.665 7.893 1 U 1.73e+07 0 e 0 0 0 0 909 4.154 116.659 7.893 1 U 8.18e+06 0 e 0 0 0 0 910 3.829 116.664 7.896 1 U 6.62e+06 0 e 0 0 0 0 911 3.224 117.113 7.889 1 U 1.16e+07 0 e 0 0 0 0 912 9.000 124.136 8.999 1 U 1.33e+08 0 e 0 0 0 0 913 9.205 124.265 8.998 1 U 4.08e+06 0 e 0 0 0 0 914 8.491 124.403 8.993 1 U 3.25e+06 0 e 0 0 0 0 915 7.894 124.144 8.998 1 U 2.15e+07 0 e 0 0 0 0 916 7.384 124.031 8.999 1 U 7.45e+06 0 e 0 0 0 0 917 4.552 124.152 8.993 1 U 5.93e+06 0 e 0 0 0 0 918 4.130 124.180 8.999 1 U 1.6e+07 0 e 0 0 0 0 919 3.239 124.196 8.999 1 U 7.21e+06 0 e 0 0 0 0 920 2.034 123.980 8.992 1 U 3.3e+06 0 e 0 0 0 0 921 0.624 124.130 9.001 1 U 7.57e+06 0 e 0 0 0 0 922 0.921 124.165 8.999 1 U 3.05e+06 0 e 0 0 0 0 923 9.007 119.236 7.331 1 U 3.55e+06 0 e 0 604 600 596 924 1.940 119.226 7.342 1 U 6.37e+06 0 e 0 0 0 0 925 0.622 119.365 7.342 1 U 1.34e+07 0 e 0 0 0 0 926 0.629 116.528 8.056 1 U 9.33e+06 0 e 0 0 0 0 927 0.143 116.563 8.054 1 U 4.07e+06 0 e 0 0 0 0 928 0.412 116.377 8.057 1 U 2.35e+06 0 e 0 0 0 0 929 1.447 116.508 8.053 1 U 4.6e+06 0 e 0 0 0 0 930 1.928 116.483 8.054 1 U 3.21e+07 0 e 0 0 0 0 931 2.336 116.504 8.050 1 U 5.37e+06 0 e 0 0 0 0 932 2.516 116.679 8.051 1 U 3.49e+06 0 e 0 0 0 0 933 3.048 116.604 8.045 1 U 2.72e+06 0 e 0 0 0 0 934 4.113 116.467 8.054 1 U 1.24e+07 0 e 0 0 0 0 935 6.993 116.481 8.054 1 U 2.44e+07 0 e 0 0 0 0 936 7.341 116.478 8.053 1 U 2.51e+07 0 e 0 0 0 0 937 8.054 116.493 8.054 1 U 1.48e+08 0 e 0 0 0 0 938 8.397 116.487 8.056 1 U 4.54e+06 0 e 0 0 0 0 939 6.994 115.391 6.994 1 U 2.33e+08 0 e 0 0 0 0 940 7.336 115.354 6.990 1 U 6.54e+06 0 e 0 0 0 0 941 6.787 115.476 6.987 1 U 4.61e+06 0 e 0 0 0 0 942 8.058 115.381 6.993 1 U 2.9e+07 0 e 0 0 0 0 943 8.377 115.358 6.994 1 U 1.82e+07 0 e 0 0 0 0 944 8.718 115.673 7.003 1 U 3.42e+06 0 e 0 0 0 0 945 4.140 115.378 6.994 1 U 3.26e+07 0 e 0 574 577 573 946 1.927 115.405 6.997 1 U 6.44e+06 0 e 0 0 0 0 947 1.477 115.707 7.008 1 U 6.56e+06 0 e 0 0 0 0 948 0.821 115.512 6.997 1 U 6.88e+06 0 e 0 0 0 0 949 8.572 119.168 8.376 1 U 1.03e+07 0 e 0 0 0 0 950 7.310 118.902 8.383 1 U 4.17e+06 0 e 0 0 0 0 951 8.118 119.585 8.117 1 U 9.32e+07 0 e 0 0 0 0 952 8.374 119.551 8.119 1 U 1.84e+07 0 e 0 0 0 0 953 7.315 119.552 8.116 1 U 1.56e+07 0 e 0 0 0 0 954 6.940 119.614 8.117 1 U 8.88e+06 0 e 0 0 0 0 955 8.714 119.617 8.118 1 U 4.13e+06 0 e 0 0 0 0 956 1.641 119.567 8.117 1 U 3.66e+07 0 e 0 0 0 0 957 1.257 119.759 8.121 1 U 5.38e+06 0 e 0 0 0 0 958 1.004 119.571 8.118 1 U 1.83e+07 0 e 0 0 0 0 959 2.290 119.070 8.131 1 U 1.77e+06 0 e 0 0 0 0 960 7.320 117.867 7.320 1 U 3.42e+08 0 e 0 0 0 0 961 7.108 117.866 7.319 1 U 8.24e+06 0 e 0 0 0 0 962 6.973 117.707 7.317 1 U 4.95e+06 0 e 0 0 0 0 963 6.709 117.838 7.323 1 U 6.2e+06 0 e 0 1143 1136 1137 964 7.533 118.257 7.322 1 U 5.55e+06 0 e 0 0 0 0 965 7.659 117.857 7.312 1 U 3.95e+06 0 e 0 0 0 0 966 8.108 117.882 7.314 1 U 2.06e+07 0 e 0 0 0 0 967 8.386 118.006 7.315 1 U 5.06e+06 0 e 0 0 0 0 968 8.723 117.835 7.315 1 U 1.51e+07 0 e 0 0 0 0 969 4.552 117.827 7.311 1 U 4.67e+06 0 e 0 0 0 0 970 3.541 117.866 7.313 1 U 4.82e+06 0 e 0 0 0 0 971 2.885 117.671 7.311 1 U 2.92e+06 0 e 0 531 1136 1137 972 2.217 117.945 7.310 1 U 3e+06 0 e 0 530 1141 1137 973 0.723 117.720 7.314 1 U 6.05e+06 0 e 0 0 0 0 974 1.456 117.849 7.316 1 U 2.55e+07 0 e 0 1139 1141 1137 975 8.736 124.555 8.731 1 U 5.08e+07 0 e 0 0 0 0 976 7.623 124.559 8.722 1 U 5.24e+06 0 e 0 0 0 0 977 6.777 124.692 8.737 1 U 2.94e+06 0 e 0 0 0 0 978 4.033 124.703 8.733 1 U 4.01e+06 0 e 0 0 0 0 979 3.548 124.623 8.720 1 U 3.14e+06 0 e 0 0 0 0 980 0.835 124.142 8.726 1 U 4.72e+06 0 e 0 0 0 0 981 8.122 121.444 8.121 1 U 1.63e+08 0 e 0 0 0 0 982 2.897 119.620 8.180 1 U 2.61e+06 0 e 0 531 532 528 983 2.277 119.842 8.175 1 U 4.29e+06 0 e 0 530 532 528 984 3.525 119.513 8.191 1 U 2.02e+06 0 e 0 0 0 0 985 4.683 119.635 8.185 1 U 4.5e+06 0 e 0 0 0 0 986 8.719 119.794 8.192 1 U 3.91e+06 0 e 0 537 532 528 987 3.981 111.816 6.829 1 U 4.31e+06 0 e 0 0 0 0 988 2.197 111.625 6.835 1 U 5.79e+06 0 e 0 1076 1078 1073 989 1.202 111.552 6.838 1 U 6.28e+06 0 e 0 0 0 0 990 0.789 111.418 6.837 1 U 3.26e+06 0 e 0 0 0 0 991 6.833 111.880 6.832 1 U 2.93e+08 0 e 0 0 0 0 992 7.522 111.823 6.833 1 U 1.47e+08 0 e 0 0 0 0 993 7.316 111.686 6.838 1 U 5.18e+06 0 e 0 0 0 0 994 7.045 111.897 6.832 1 U 7.56e+06 0 e 0 0 0 0 995 1.707 111.368 6.835 1 U 3.62e+06 0 e 0 0 0 0 996 6.797 106.131 6.796 1 U 2.14e+07 0 e 0 0 0 0 997 5.002 106.158 6.792 1 U 1.66e+07 0 e 0 0 0 0 998 9.375 117.956 8.657 1 U 1.51e+07 0 e 0 0 0 0 999 8.660 117.956 8.657 1 U 1.16e+08 0 e 0 0 0 0 1000 6.277 118.037 8.655 1 U 8.97e+06 0 e 0 1142 1156 1150 1001 5.264 117.856 8.660 1 U 8.04e+06 0 e 0 0 0 0 1002 4.569 117.955 8.656 1 U 1.2e+07 0 e 0 0 0 0 1003 2.298 117.661 8.658 1 U 4.28e+06 0 e 0 0 0 0 1004 1.625 117.930 8.656 1 U 2.1e+07 0 e 0 0 0 0 1005 1.417 117.937 8.657 1 U 1.87e+07 0 e 0 0 0 0 1006 0.861 117.914 8.657 1 U 5.19e+06 0 e 0 0 0 0 1007 8.163 123.427 8.167 1 U 1.81e+07 0 e 0 0 0 0 1008 7.271 119.976 8.189 1 U 2.56e+06 0 e 0 0 0 0 1009 6.872 120.168 8.183 1 U 3.08e+06 0 e 0 0 0 0 1010 2.875 126.904 8.411 1 U 4.97e+06 0 e 0 0 0 0 1011 9.165 126.744 8.422 1 U 3.78e+06 0 e 0 0 0 0 1012 8.205 126.639 8.420 1 U 2.65e+06 0 e 0 0 0 0 1013 4.915 126.661 8.415 1 U 1.04e+07 0 e 0 0 0 0 1014 2.071 127.102 8.466 1 U 8.12e+06 0 e 0 142 147 146 1015 2.954 127.035 8.384 1 U 4.19e+06 0 e 0 0 0 0 1016 7.795 112.530 7.143 1 U 3.16e+07 0 e 0 0 0 0 1017 7.149 112.575 7.144 1 U 6.61e+07 0 e 0 0 0 0 1018 4.705 112.439 7.153 1 U 5.54e+06 0 e 0 0 0 0 1019 4.667 113.662 7.142 1 U 4.21e+06 0 e 0 0 0 0 1020 2.715 114.026 7.135 1 U 3.24e+06 0 e 0 0 0 0 1021 2.737 113.132 6.973 1 U 6.01e+06 0 e 0 934 939 936 1022 3.021 113.048 6.968 1 U 8.55e+06 0 e 0 935 939 936 1023 0.991 112.953 6.969 1 U 8.94e+06 0 e 0 0 0 0 1024 4.685 113.071 6.970 1 U 7.59e+06 0 e 0 0 0 0 1025 4.709 113.113 6.926 1 U 8.1e+06 0 e 0 0 0 0 1026 6.970 112.906 6.969 1 U 7.76e+07 0 e 0 936 939 936 1027 7.660 113.021 6.968 1 U 4.17e+07 0 e 0 937 939 936 1028 9.331 126.748 9.331 1 U 8.69e+07 0 e 0 0 0 0 1029 7.742 126.875 9.333 1 U 5.89e+06 0 e 0 0 0 0 1030 3.884 126.872 9.331 1 U 2.33e+06 0 e 0 0 0 0 1031 3.723 126.927 9.311 1 U 2.89e+06 0 e 0 0 0 0 1032 3.034 126.856 9.334 1 U 2.2e+06 0 e 0 0 0 0 1033 2.913 124.497 8.749 1 U 3.6e+06 0 e 0 0 0 0 1034 7.978 113.557 7.741 1 U 1e+07 0 e 0 0 0 0 1035 7.737 113.117 7.736 1 U 3.24e+08 0 e 0 0 0 0 1036 7.315 113.298 7.703 1 U 4.34e+07 0 e 0 682 685 683 1037 4.576 113.093 7.735 1 U 5.47e+06 0 e 0 0 0 0 1038 3.900 113.441 7.712 1 U 4.77e+06 0 e 0 0 0 0 1039 3.788 113.758 7.762 1 U 5.87e+06 0 e 0 0 0 0 1040 2.777 113.125 7.734 1 U 8.18e+06 0 e 0 0 0 0 1041 0.886 113.314 7.732 1 U 3.59e+07 0 e 0 0 0 0 1042 0.720 113.343 7.712 1 U 1.22e+07 0 e 0 0 0 0 1043 1.210 113.166 7.733 1 U 1.14e+07 0 e 0 0 0 0 1044 3.844 117.909 10.133 1 U 6.34e+06 0 e 0 0 0 0 1045 10.131 117.917 10.131 1 U 1.12e+08 0 e 0 0 0 0 1046 1.611 117.709 10.129 1 U 2.27e+06 0 e 0 0 0 0 1047 1.583 118.020 10.110 1 U 1.84e+06 0 e 0 0 0 0 1048 2.323 117.845 10.128 1 U 4.31e+06 0 e 0 0 0 0 1049 7.415 117.917 10.122 1 U 2.04e+06 0 e 0 0 0 0 1050 4.776 118.070 10.123 1 U 2.38e+06 0 e 0 0 0 0 1051 4.729 112.165 6.662 1 U 3.66e+06 0 e 0 0 0 0 1052 4.187 112.164 6.664 1 U 2.83e+06 0 e 0 0 0 0 1053 1.246 112.238 6.659 1 U 6.36e+06 0 e 0 0 0 0 1054 8.035 112.437 6.655 1 U 2.88e+06 0 e 0 0 0 0 1055 7.752 112.214 6.658 1 U 4.58e+06 0 e 0 0 0 0 1056 7.486 118.893 7.484 1 U 1.8e+08 0 e 0 0 0 0 1057 9.825 118.987 7.481 1 U 4.08e+06 0 e 0 0 0 0 1058 3.115 118.901 7.486 1 U 7.43e+06 0 e 0 0 0 0 1059 4.736 119.095 7.485 1 U 2.65e+06 0 e 0 0 0 0 1060 8.494 115.792 7.594 1 U 2.7e+06 0 e 0 0 0 0 1061 7.604 115.768 7.605 1 U 2.23e+08 0 e 0 0 0 0 1062 7.106 115.556 7.603 1 U 5.08e+06 0 e 0 0 0 0 1063 1.279 115.437 7.597 1 U 4.67e+06 0 e 0 0 0 0 1064 5.329 128.031 9.813 1 U 4.71e+07 0 e 0 0 0 0 1065 3.722 128.183 9.810 1 U 2.34e+06 0 e 0 0 0 0 1066 3.402 128.176 9.814 1 U 3.01e+06 0 e 0 0 0 0 1067 2.176 128.085 9.819 1 U 4.83e+06 0 e 0 0 0 0 1068 0.912 128.030 9.812 1 U 1.96e+07 0 e 0 0 0 0 1069 1.402 128.012 9.814 1 U 4.25e+06 0 e 0 0 0 0 1070 6.917 128.038 9.814 1 U 4.23e+06 0 e 0 0 0 0 1071 7.113 127.921 9.802 1 U 2.75e+06 0 e 0 0 0 0 1072 7.570 127.782 9.821 1 U 3.83e+06 0 e 0 0 0 0 1073 7.722 127.858 9.810 1 U 3.25e+06 0 e 0 0 0 0 1074 8.538 128.047 9.811 1 U 5.77e+06 0 e 0 0 0 0 1075 9.814 128.028 9.813 1 U 1.11e+08 0 e 0 0 0 0 1076 7.706 113.297 7.315 1 U 4.7e+07 0 e 0 683 685 682 1077 7.315 113.160 7.316 1 U 7.26e+07 0 e 0 682 685 682 1078 3.101 113.221 7.711 1 U 1.16e+07 0 e 0 681 685 683 1079 2.625 113.218 7.704 1 U 9.6e+06 0 e 0 680 685 683 1080 2.623 113.238 7.316 1 U 6.44e+06 0 e 0 680 685 682 1081 3.098 113.358 7.313 1 U 5.47e+06 0 e 0 681 685 682 1082 1.274 113.304 7.323 1 U 3.83e+06 0 e 0 0 0 0 1083 0.709 113.308 7.317 1 U 7.36e+06 0 e 0 0 0 0 1084 0.841 113.200 7.308 1 U 4.25e+06 0 e 0 0 0 0 1085 3.906 113.274 7.327 1 U 3.52e+06 0 e 0 0 0 0 1086 4.722 113.068 7.332 1 U 3.07e+06 0 e 0 0 0 0 1087 4.168 112.673 7.336 1 U 3.11e+06 0 e 0 0 0 0 1088 8.520 116.720 9.551 1 U 2.91e+06 0 e 0 0 0 0 1089 8.030 116.560 9.549 1 U 8.47e+06 0 e 0 0 0 0 1090 3.133 116.660 9.550 1 U 4.13e+06 0 e 0 0 0 0 1091 3.410 116.596 9.542 1 U 2.61e+06 0 e 0 0 0 0 1092 1.767 116.858 9.549 1 U 2.44e+06 0 e 0 0 0 0 1093 0.819 116.834 9.542 1 U 2.01e+06 0 e 0 0 0 0 1094 1.495 127.531 8.482 1 U 2.18e+07 0 e 0 0 0 0 1095 3.125 128.097 8.482 1 U 4.22e+06 0 e 0 0 0 0 1096 4.916 127.741 8.487 1 U 1.12e+07 0 e 0 0 0 0 1097 8.974 119.355 8.529 1 U 4.07e+06 0 e 0 0 0 0 1098 9.817 119.348 8.524 1 U 8.11e+06 0 e 0 0 0 0 1099 8.027 119.238 8.525 1 U 3.5e+06 0 e 0 0 0 0 1100 6.897 119.203 8.525 1 U 4.68e+06 0 e 0 0 0 0 1101 7.145 119.280 8.528 1 U 2.62e+06 0 e 0 0 0 0 1102 5.585 119.368 8.527 1 U 1.28e+07 0 e 0 0 0 0 1103 5.326 119.291 8.524 1 U 3.81e+06 0 e 0 0 0 0 1104 3.118 119.316 8.526 1 U 3.1e+07 0 e 0 0 0 0 1105 2.330 119.341 8.527 1 U 1.06e+07 0 e 0 0 0 0 1106 0.383 119.381 8.535 1 U 5.38e+06 0 e 0 0 0 0 1107 0.603 119.597 8.521 1 U 8.87e+06 0 e 0 0 0 0 1108 7.882 111.702 7.878 1 U 1.79e+08 0 e 0 0 0 0 1109 6.328 112.079 7.871 1 U 2.94e+07 0 e 0 861 864 862 1110 8.983 112.037 7.874 1 U 3.29e+06 0 e 0 0 0 0 1111 2.331 111.749 7.878 1 U 6.13e+06 0 e 0 0 0 0 1112 6.328 111.824 6.325 1 U 7.67e+07 0 e 0 861 864 861 1113 7.871 112.055 6.325 1 U 3.44e+07 0 e 0 862 864 861 1114 8.950 112.023 6.324 1 U 6.42e+06 0 e 0 0 0 0 1115 8.741 111.643 6.329 1 U 2.65e+06 0 e 0 0 0 0 1116 4.707 111.901 6.336 1 U 4.03e+06 0 e 0 0 0 0 1117 4.815 111.811 6.325 1 U 3.76e+06 0 e 0 0 0 0 1118 3.303 112.051 6.325 1 U 5.27e+06 0 e 0 860 864 861 1119 2.753 112.027 6.325 1 U 5.98e+06 0 e 0 859 864 861 1120 2.422 111.792 6.329 1 U 3.79e+06 0 e 0 0 0 0 1121 8.245 127.533 8.243 1 U 4.7e+07 0 e 0 0 0 0 1122 8.836 127.759 8.247 1 U 2.33e+06 0 e 0 0 0 0 1123 4.359 127.424 8.250 1 U 2.65e+06 0 e 0 0 0 0 1124 3.344 127.554 8.242 1 U 2.32e+06 0 e 0 0 0 0 1125 2.659 127.459 8.241 1 U 4.91e+06 0 e 0 0 0 0 1126 2.368 127.649 8.245 1 U 6.94e+06 0 e 0 0 0 0 1127 5.096 127.992 8.711 1 U 3.58e+06 0 e 0 0 0 0 1128 7.312 110.647 6.430 1 U 7.34e+07 0 e 0 826 830 825 1129 4.025 110.590 6.435 1 U 4.96e+06 0 e 0 0 0 0 1130 2.582 110.933 6.422 1 U 2.96e+06 0 e 0 0 0 0 1131 1.956 110.740 6.432 1 U 6.78e+06 0 e 0 0 0 0 1132 0.640 110.601 6.429 1 U 9.22e+06 0 e 0 0 0 0 1133 0.894 110.646 6.437 1 U 7.23e+06 0 e 0 0 0 0 1134 8.720 110.366 7.303 1 U 2.01e+06 0 e 0 0 0 0 1135 4.022 110.683 7.304 1 U 5.3e+06 0 e 0 0 0 0 1136 2.775 110.483 7.300 1 U 2.19e+06 0 e 0 0 0 0 1137 1.973 110.645 7.307 1 U 7.74e+06 0 e 0 0 0 0 1138 1.751 110.621 7.304 1 U 3.75e+06 0 e 0 823 830 826 1139 0.887 110.682 7.299 1 U 4.22e+06 0 e 0 0 0 0 1140 0.639 110.614 7.308 1 U 7.4e+06 0 e 0 0 0 0 1141 9.533 129.042 9.531 1 U 6.15e+07 0 e 0 0 0 0 1142 1.134 129.063 9.529 1 U 7.4e+06 0 e 0 0 0 0 1143 1.414 129.167 9.526 1 U 5.66e+06 0 e 0 0 0 0 1144 1.614 129.320 9.533 1 U 4.63e+06 0 e 0 0 0 0 1145 5.061 119.397 9.088 1 U 3.96e+06 0 e 0 0 0 0 1146 3.132 119.492 9.085 1 U 4.03e+06 0 e 0 0 0 0 1147 2.550 119.657 9.086 1 U 3.77e+06 0 e 0 0 0 0 1148 0.931 119.423 9.092 1 U 4.72e+06 0 e 0 0 0 0 1149 2.643 120.770 8.816 1 U 2.71e+06 0 e 0 0 0 0 1150 2.562 113.618 9.414 1 U 9.27e+06 0 e 0 0 0 0 1151 2.356 113.646 9.415 1 U 7.98e+06 0 e 0 0 0 0 1152 2.200 113.621 9.414 1 U 6.7e+06 0 e 0 0 0 0 1153 1.891 113.614 9.415 1 U 1.71e+07 0 e 0 0 0 0 1154 1.685 113.623 9.415 1 U 1.41e+07 0 e 0 0 0 0 1155 9.416 113.628 9.414 1 U 1.19e+08 0 e 0 0 0 0 1156 8.879 113.599 9.414 1 U 3.73e+06 0 e 0 0 0 0 1157 3.129 113.784 9.417 1 U 4.03e+06 0 e 0 0 0 0 1158 4.919 113.607 9.414 1 U 4.5e+07 0 e 0 0 0 0 1159 7.118 121.180 7.116 1 U 1.26e+08 0 e 0 0 0 0 1160 4.178 121.262 7.113 1 U 5.22e+06 0 e 0 0 0 0 1161 4.021 121.270 7.115 1 U 4.05e+06 0 e 0 0 0 0 1162 3.723 121.297 7.117 1 U 4.88e+06 0 e 0 0 0 0 1163 4.462 121.173 7.119 1 U 5.46e+06 0 e 0 0 0 0 1164 1.308 121.168 7.122 1 U 3.74e+06 0 e 0 0 0 0 1165 1.723 121.182 7.116 1 U 4.38e+07 0 e 0 0 0 0 1166 0.295 121.202 7.113 1 U 5.48e+06 0 e 0 0 0 0 1167 6.896 121.444 7.118 1 U 3.79e+06 0 e 0 0 0 0 1168 7.327 120.978 7.119 1 U 3.41e+06 0 e 0 0 0 0 1169 8.549 120.971 7.118 1 U 2.86e+06 0 e 0 0 0 0 1170 7.968 114.335 7.967 1 U 1e+08 0 e 0 0 0 0 1171 4.647 114.578 7.965 1 U 9.25e+06 0 e 0 0 0 0 1172 3.038 114.592 7.961 1 U 2.42e+06 0 e 0 0 0 0 1173 1.741 114.447 7.967 1 U 7.95e+06 0 e 0 0 0 0 1174 1.485 114.252 7.966 1 U 5.46e+06 0 e 0 0 0 0 1175 1.260 114.468 7.961 1 U 2.38e+06 0 e 0 0 0 0 1176 0.592 114.710 7.959 1 U 3e+06 0 e 0 0 0 0 1177 8.607 113.015 8.606 1 U 5.26e+07 0 e 0 0 0 0 1178 8.002 112.996 8.605 1 U 1.4e+07 0 e 0 0 0 0 1179 6.884 113.148 8.603 1 U 3.77e+06 0 e 0 0 0 0 1180 1.541 112.993 8.610 1 U 3e+06 0 e 0 0 0 0 1181 1.753 113.002 8.610 1 U 2.31e+06 0 e 0 0 0 0 1182 4.712 112.971 8.603 1 U 5.44e+06 0 e 0 0 0 0 1183 4.708 112.145 7.050 1 U 1.06e+07 0 e 0 0 0 0 1184 2.657 112.225 7.046 1 U 3.78e+06 0 e 0 747 746 743 1185 2.153 112.238 7.048 1 U 2.44e+06 0 e 0 0 0 0 1186 7.535 112.761 7.748 1 U 7.24e+06 0 e 0 0 0 0 1187 4.731 112.368 7.745 1 U 1.29e+07 0 e 0 0 0 0 1188 2.643 112.203 7.748 1 U 1.26e+07 0 e 0 747 746 744 1189 8.587 122.028 8.030 1 U 1.03e+07 0 e 0 0 0 0 1190 9.546 121.995 8.028 1 U 8.31e+06 0 e 0 0 0 0 1191 9.836 122.129 8.022 1 U 2.7e+06 0 e 0 0 0 0 1192 2.614 121.897 8.039 1 U 3.54e+06 0 e 0 0 0 0 1193 0.554 122.272 8.031 1 U 3.66e+06 0 e 0 0 0 0 1194 1.023 122.157 8.029 1 U 4.38e+06 0 e 0 0 0 0 1195 10.436 113.393 7.964 1 U 2.16e+06 0 e 0 0 0 0 1196 3.770 113.410 7.972 1 U 1.54e+07 0 e 0 0 0 0 1197 2.297 113.369 7.974 1 U 1.79e+07 0 e 0 0 0 0 1198 2.039 113.281 7.980 1 U 6.46e+06 0 e 0 0 0 0 1199 2.027 113.078 7.801 1 U 2.69e+06 0 e 0 0 0 0 1200 2.003 113.201 7.796 1 U 2.77e+06 0 e 0 0 0 0 1201 6.971 113.011 7.658 1 U 4.12e+07 0 e 0 936 939 937 1202 7.678 113.092 7.660 1 U 4.99e+07 0 e 0 937 939 937 1203 4.720 112.980 7.659 1 U 5.71e+06 0 e 0 0 0 0 1204 4.374 113.302 7.655 1 U 2.42e+06 0 e 0 0 0 0 1205 3.779 113.281 7.651 1 U 2.19e+06 0 e 0 0 0 0 1206 3.025 112.950 7.661 1 U 8.15e+06 0 e 0 935 939 937 1207 2.727 112.969 7.655 1 U 8.13e+06 0 e 0 934 939 937 1208 0.986 113.080 7.659 1 U 5.52e+06 0 e 0 0 0 0 1209 10.438 114.447 8.031 1 U 2.36e+07 0 e 0 883 881 877 1210 8.739 114.403 8.030 1 U 4.59e+06 0 e 0 0 0 0 1211 8.242 114.211 8.022 1 U 3.97e+06 0 e 0 0 0 0 1212 8.027 114.435 8.032 1 U 1.28e+08 0 e 0 0 0 0 1213 4.632 114.426 8.032 1 U 1.05e+07 0 e 0 0 0 0 1214 3.777 114.394 8.032 1 U 1.01e+07 0 e 0 0 0 0 1215 3.981 114.333 8.023 1 U 4.38e+06 0 e 0 0 0 0 1216 2.974 114.451 8.035 1 U 7.87e+06 0 e 0 0 0 0 1217 2.420 114.444 8.034 1 U 8.56e+06 0 e 0 0 0 0 1218 2.729 114.506 8.011 1 U 3.3e+06 0 e 0 0 0 0 1219 2.047 114.600 8.024 1 U 4.06e+06 0 e 0 0 0 0 1220 8.733 115.674 10.425 1 U 3.13e+06 0 e 0 0 0 0 1221 3.198 115.492 10.431 1 U 4.42e+06 0 e 0 885 884 883 1222 4.609 115.869 10.428 1 U 3.4e+06 0 e 0 0 0 0 1223 4.266 115.229 10.439 1 U 2.1e+06 0 e 0 0 0 0 1224 4.239 115.680 10.439 1 U 2.08e+06 0 e 0 0 0 0 1225 8.514 118.320 6.990 1 U 2.4e+06 0 e 0 0 0 0 1226 6.999 118.394 6.995 1 U 1.26e+08 0 e 0 0 0 0 1227 5.668 117.920 6.990 1 U 2.41e+06 0 e 0 0 0 0 1228 5.655 118.169 6.994 1 U 2.5e+06 0 e 0 0 0 0 1229 4.588 118.403 6.996 1 U 2.88e+06 0 e 0 0 0 0 1230 4.375 118.364 6.992 1 U 5.04e+06 0 e 0 0 0 0 1231 2.498 118.420 6.991 1 U 6.67e+06 0 e 0 0 0 0 1232 2.707 118.325 6.988 1 U 3.61e+06 0 e 0 0 0 0 1233 9.602 118.333 7.000 1 U 1.79e+06 0 e 0 0 0 0 1234 7.982 117.387 7.981 1 U 9.42e+07 0 e 0 0 0 0 1235 8.486 117.329 7.981 1 U 4.13e+06 0 e 0 0 0 0 1236 8.198 117.510 7.978 1 U 4.64e+06 0 e 0 0 0 0 1237 8.834 117.429 7.984 1 U 2.85e+06 0 e 0 0 0 0 1238 4.386 117.506 7.980 1 U 9.62e+06 0 e 0 0 0 0 1239 3.361 117.608 7.981 1 U 8.17e+06 0 e 0 0 0 0 1240 4.547 117.333 7.979 1 U 4.62e+06 0 e 0 0 0 0 1241 2.689 117.537 7.981 1 U 1.39e+07 0 e 0 0 0 0 1242 2.435 117.408 7.981 1 U 1.64e+07 0 e 0 0 0 0 1243 2.172 117.398 7.978 1 U 5.31e+06 0 e 0 0 0 0 1244 1.946 117.496 7.985 1 U 5.17e+06 0 e 0 0 0 0 1245 1.382 117.511 7.982 1 U 6.19e+06 0 e 0 0 0 0 1246 0.569 117.596 7.977 1 U 2.64e+06 0 e 0 0 0 0 1247 0.947 117.409 7.969 1 U 3.36e+06 0 e 0 0 0 0 1248 7.002 117.492 7.981 1 U 2.46e+07 0 e 0 0 0 0 1249 8.507 111.348 8.507 1 U 6.22e+06 0 e 0 0 0 0 1250 5.864 111.124 8.501 1 U 2.03e+06 0 e 0 0 0 0 1251 3.939 111.356 8.505 1 U 1.99e+06 0 e 0 0 0 0 1252 6.995 111.283 8.497 1 U 1.8e+06 0 e 0 0 0 0 1253 7.665 111.495 8.495 1 U 1.88e+06 0 e 0 0 0 0 1254 2.380 111.203 8.501 1 U 2.45e+06 0 e 0 0 0 0 1255 4.297 123.064 8.615 1 U 8.49e+06 0 e 0 0 0 0 1256 4.685 123.132 8.619 1 U 4.57e+06 0 e 0 0 0 0 1257 2.135 123.171 8.617 1 U 5.94e+06 0 e 0 0 0 0 1258 8.615 123.087 8.613 1 U 1.01e+07 0 e 0 0 0 0 1259 8.856 123.005 8.629 1 U 3.58e+06 0 e 0 0 0 0 1260 1.539 128.226 7.783 1 U 3.51e+06 0 e 0 0 0 0 1261 0.709 128.491 7.770 1 U 3.56e+06 0 e 0 0 0 0 1262 2.170 128.263 7.772 1 U 1.16e+07 0 e 0 0 0 0 1263 2.375 128.294 7.771 1 U 6.56e+06 0 e 0 0 0 0 1264 2.829 128.222 7.780 1 U 5.61e+06 0 e 0 0 0 0 1265 4.305 128.246 7.768 1 U 6.71e+06 0 e 0 911 918 910 1266 4.505 128.284 7.774 1 U 1.62e+07 0 e 0 0 0 0 1267 5.021 127.956 7.778 1 U 2.53e+06 0 e 0 0 0 0 1268 6.996 128.131 7.760 1 U 2.88e+06 0 e 0 0 0 0 1269 4.314 115.226 7.688 1 U 5.53e+06 0 e 0 0 0 0 1270 5.419 115.055 7.698 1 U 2.64e+06 0 e 0 0 0 0 1271 6.328 115.243 7.699 1 U 2.41e+06 0 e 0 0 0 0 1272 8.928 115.931 8.924 1 U 8.77e+07 0 e 0 1335 1339 1335 1273 9.145 115.973 8.919 1 U 5.12e+06 0 e 0 0 0 0 1274 8.207 115.959 8.925 1 U 1.07e+07 0 e 0 0 0 0 1275 7.697 115.056 8.925 1 U 1.17e+07 0 e 0 914 919 915 1276 6.345 114.979 8.932 1 U 2.68e+06 0 e 0 0 0 0 1277 1.815 115.267 8.930 1 U 4.22e+06 0 e 0 0 0 0 1278 0.700 115.745 8.930 1 U 1.22e+07 0 e 0 0 0 0 1279 2.148 115.313 7.699 1 U 3.15e+06 0 e 0 920 919 914 1280 4.549 128.215 9.588 1 U 9.08e+06 0 e 0 0 0 0 1281 1.484 128.505 9.585 1 U 3.07e+06 0 e 0 0 0 0 1282 0.696 128.192 9.582 1 U 6.85e+06 0 e 0 0 0 0 1283 9.585 128.260 9.583 1 U 2.18e+07 0 e 0 901 905 901 1284 2.780 127.859 9.598 1 U 2.85e+06 0 e 0 0 0 0 1285 10.019 128.348 9.571 1 U 2.04e+06 0 e 0 0 0 0 1286 8.732 119.571 8.530 1 U 7.39e+06 0 e 0 0 0 0 1287 9.162 119.987 8.535 1 U 5.14e+06 0 e 0 0 0 0 1288 8.464 120.459 8.454 1 U 8.45e+07 0 e 0 0 0 0 1289 6.804 120.420 8.451 1 U 2.04e+06 0 e 0 0 0 0 1290 2.673 112.473 6.803 1 U 1.59e+07 0 e 0 1185 1190 1187 1291 4.254 112.327 6.800 1 U 1.73e+06 0 e 0 0 0 0 1292 6.804 112.416 6.804 1 U 3.17e+08 0 e 0 1187 1190 1187 1293 6.588 112.541 6.802 1 U 3.83e+06 0 e 0 0 0 0 1294 7.138 112.104 6.796 1 U 5.43e+06 0 e 0 0 0 0 1295 7.022 112.334 6.798 1 U 7.36e+06 0 e 0 0 0 0 1296 7.736 112.633 6.795 1 U 3.94e+06 0 e 0 0 0 0 1297 7.532 112.461 6.803 1 U 1.74e+08 0 e 0 1188 1190 1187 1298 8.422 112.692 6.802 1 U 2.08e+06 0 e 0 1183 1190 1187 1299 2.722 112.409 7.535 1 U 2.89e+07 0 e 0 1191 1190 1188 1300 2.296 112.384 7.551 1 U 4.25e+06 0 e 0 0 0 0 1301 1.913 112.421 7.551 1 U 8.44e+06 0 e 0 0 0 0 1302 1.714 111.980 7.532 1 U 5.1e+06 0 e 0 0 0 0 1303 1.429 112.569 7.530 1 U 4.44e+06 0 e 0 0 0 0 1304 1.147 112.398 7.553 1 U 2.3e+07 0 e 0 0 0 0 1305 0.864 112.267 7.539 1 U 4.07e+06 0 e 0 0 0 0 1306 4.711 112.149 7.526 1 U 1.74e+07 0 e 0 0 0 0 1307 7.324 112.242 7.535 1 U 9.66e+06 0 e 0 0 0 0 1308 7.535 112.234 7.533 1 U 4.69e+08 0 e 0 1188 1190 1188 1309 9.111 112.431 7.549 1 U 3.56e+06 0 e 0 0 0 0 1310 9.383 118.030 8.261 1 U 3.71e+06 0 e 0 0 0 0 1311 5.257 118.107 8.266 1 U 1.05e+07 0 e 0 0 0 0 1312 4.948 118.109 8.268 1 U 2.86e+07 0 e 0 0 0 0 1313 4.233 118.128 8.269 1 U 5.97e+06 0 e 0 0 0 0 1314 4.022 118.352 8.303 1 U 4.71e+06 0 e 0 0 0 0 1315 4.027 118.321 8.241 1 U 2.93e+06 0 e 0 0 0 0 1316 2.615 118.069 8.272 1 U 6.79e+06 0 e 0 0 0 0 1317 1.618 118.519 8.267 1 U 4.94e+06 0 e 0 0 0 0 1318 1.516 118.167 8.269 1 U 4.85e+06 0 e 0 0 0 0 1319 1.323 118.127 8.269 1 U 4.19e+06 0 e 0 0 0 0 1320 8.980 118.710 8.978 1 U 1.44e+08 0 e 0 0 0 0 1321 8.313 118.610 8.982 1 U 1.4e+07 0 e 0 0 0 0 1322 7.799 118.619 8.976 1 U 4.23e+06 0 e 0 0 0 0 1323 8.055 122.857 8.053 1 U 2.42e+08 0 e 0 0 0 0 1324 6.720 123.003 8.057 1 U 2.79e+06 0 e 0 0 0 0 1325 4.805 122.982 8.054 1 U 1.26e+07 0 e 0 0 0 0 1326 4.661 122.804 8.057 1 U 9.14e+06 0 e 0 0 0 0 1327 1.685 122.893 8.055 1 U 9.69e+06 0 e 0 0 0 0 1328 0.853 122.783 8.053 1 U 8.57e+06 0 e 0 0 0 0 1329 1.369 121.613 7.760 1 U 1.4e+07 0 e 0 0 0 0 1330 1.653 121.595 7.759 1 U 1.8e+07 0 e 0 0 0 0 1331 0.863 121.587 7.760 1 U 1.89e+07 0 e 0 0 0 0 1332 7.751 121.170 7.748 1 U 1.65e+08 0 e 0 0 0 0 1333 8.058 121.608 7.759 1 U 2.71e+07 0 e 0 1128 1123 1116 1334 0.676 124.090 8.013 1 U 7.58e+06 0 e 0 0 0 0 1335 0.871 124.071 8.017 1 U 3.9e+06 0 e 0 0 0 0 1336 1.365 124.121 8.015 1 U 7.66e+06 0 e 0 0 0 0 1337 1.634 123.947 8.016 1 U 7.53e+06 0 e 0 0 0 0 1338 2.304 124.418 8.013 1 U 2.44e+06 0 e 0 0 0 0 1339 3.726 124.131 8.015 1 U 6.88e+06 0 e 0 0 0 0 1340 1.810 123.955 8.019 1 U 3.66e+06 0 e 0 0 0 0 1341 4.828 124.092 8.016 1 U 3.32e+07 0 e 0 0 0 0 1342 5.246 124.096 8.016 1 U 1.47e+07 0 e 0 0 0 0 1343 8.018 124.050 8.016 1 U 1.25e+08 0 e 0 0 0 0 1344 8.961 124.253 8.014 1 U 4.44e+06 0 e 0 0 0 0 1345 9.134 124.037 8.016 1 U 3.93e+06 0 e 0 0 0 0 1346 6.782 124.064 8.017 1 U 2.26e+06 0 e 0 0 0 0 1347 4.596 123.893 8.016 1 U 5.03e+06 0 e 0 0 0 0 1348 0.371 118.984 9.200 1 U 2.81e+06 0 e 0 0 0 0 1349 0.880 118.808 9.198 1 U 7.53e+06 0 e 0 0 0 0 1350 1.607 118.769 9.197 1 U 1.86e+07 0 e 0 0 0 0 1351 2.165 118.807 9.196 1 U 7.6e+06 0 e 0 0 0 0 1352 2.622 119.047 9.188 1 U 2.44e+06 0 e 0 0 0 0 1353 3.106 119.104 9.190 1 U 2.44e+06 0 e 0 0 0 0 1354 4.293 118.783 9.204 1 U 3.11e+06 0 e 0 0 0 0 1355 9.200 118.784 9.197 1 U 7.05e+07 0 e 0 0 0 0 1356 9.872 118.355 9.207 1 U 2.72e+06 0 e 0 0 0 0 1357 8.214 118.877 9.188 1 U 1.71e+06 0 e 0 0 0 0 1358 4.010 108.888 8.205 1 U 1.86e+07 0 e 0 0 0 0 1359 0.294 108.913 8.210 1 U 2.6e+06 0 e 0 0 0 0 1360 10.235 128.245 9.246 1 U 2.16e+06 0 e 0 0 0 0 1361 9.246 127.860 9.246 1 U 4.51e+07 0 e 0 0 0 0 1362 5.223 127.865 9.246 1 U 1.35e+07 0 e 0 0 0 0 1363 0.703 127.857 9.246 1 U 1.13e+07 0 e 0 0 0 0 1364 1.203 128.000 9.249 1 U 6.2e+06 0 e 0 0 0 0 1365 0.308 128.002 9.246 1 U 2.04e+06 0 e 0 0 0 0 1366 2.094 111.631 6.837 1 U 5.54e+06 0 e 0 1075 1078 1073 1367 7.038 112.084 7.524 1 U 6e+06 0 e 0 0 0 0 1368 7.174 112.121 7.525 1 U 3.31e+06 0 e 0 0 0 0 1369 7.159 112.109 7.489 1 U 2.31e+06 0 e 0 0 0 0 1370 2.214 111.566 7.525 1 U 8.14e+06 0 e 0 1076 1078 1074 1371 3.956 111.685 7.527 1 U 4.47e+06 0 e 0 0 0 0 1372 3.975 121.291 8.203 1 U 1.66e+07 0 e 0 0 0 0 1373 4.338 121.333 8.212 1 U 3.28e+06 0 e 0 0 0 0 1374 5.236 121.671 8.202 1 U 2.41e+06 0 e 0 0 0 0 1375 5.214 121.166 8.205 1 U 2.42e+06 0 e 0 0 0 0 1376 2.915 121.859 8.206 1 U 2.41e+06 0 e 0 0 0 0 1377 8.204 121.300 8.203 1 U 1.22e+08 0 e 0 0 0 0 1378 8.919 120.847 8.202 1 U 2.76e+06 0 e 0 0 0 0 1379 1.596 121.324 8.203 1 U 3.64e+07 0 e 0 0 0 0 1380 1.236 121.277 8.199 1 U 7.65e+06 0 e 0 0 0 0 1381 1.973 121.209 8.201 1 U 2.27e+06 0 e 0 0 0 0 1382 2.389 121.353 8.194 1 U 3.31e+06 0 e 0 0 0 0 1383 3.281 121.505 8.205 1 U 2.22e+06 0 e 0 0 0 0 1384 7.608 121.588 8.215 1 U 2.59e+06 0 e 0 0 0 0 1385 7.917 109.028 7.916 1 U 1.55e+08 0 e 0 0 0 0 1386 7.043 117.992 7.043 1 U 1.3e+08 0 e 0 0 0 0 1387 8.593 117.637 7.041 1 U 3.2e+06 0 e 0 0 0 0 1388 3.945 117.927 7.044 1 U 4.86e+06 0 e 0 0 0 0 1389 3.735 117.941 7.039 1 U 5.13e+06 0 e 0 0 0 0 1390 1.616 117.936 7.044 1 U 5.5e+07 0 e 0 0 0 0 1391 0.301 117.844 7.041 1 U 5.34e+06 0 e 0 0 0 0 1392 4.711 121.121 8.123 1 U 6.87e+06 0 e 0 0 0 0 1393 3.735 121.550 8.126 1 U 3.9e+06 0 e 0 0 0 0 1394 4.345 121.275 8.121 1 U 4.13e+06 0 e 0 0 0 0 1395 2.560 121.470 8.120 1 U 1.27e+07 0 e 0 0 0 0 1396 2.361 121.402 8.121 1 U 2.48e+07 0 e 0 0 0 0 1397 2.172 121.429 8.120 1 U 2.09e+07 0 e 0 0 0 0 1398 1.946 121.437 8.121 1 U 3.03e+07 0 e 0 0 0 0 1399 1.261 121.330 8.125 1 U 6.56e+06 0 e 0 0 0 0 1400 0.818 121.733 8.124 1 U 4.02e+06 0 e 0 0 0 0 1401 8.591 118.230 8.589 1 U 1.94e+08 0 e 0 0 0 0 1402 9.052 118.058 8.586 1 U 3.45e+06 0 e 0 0 0 0 1403 8.926 117.942 8.584 1 U 3.89e+06 0 e 0 0 0 0 1404 9.332 117.827 8.597 1 U 3.83e+06 0 e 0 0 0 0 1405 8.784 118.022 8.584 1 U 6.49e+06 0 e 0 0 0 0 1406 7.066 118.294 8.591 1 U 4.77e+06 0 e 0 0 0 0 1407 0.621 119.665 7.738 1 U 3.5e+06 0 e 0 0 0 0 1408 1.630 119.845 7.737 1 U 4.72e+06 0 e 0 0 0 0 1409 1.917 119.735 7.739 1 U 3.09e+06 0 e 0 0 0 0 1410 2.594 119.538 7.736 1 U 3.38e+06 0 e 0 0 0 0 1411 3.165 119.261 7.735 1 U 3.31e+06 0 e 0 0 0 0 1412 4.832 119.677 7.740 1 U 1.37e+07 0 e 0 0 0 0 1413 8.862 119.539 8.858 1 U 5.81e+07 0 e 0 0 0 0 1414 7.131 119.569 8.856 1 U 6.33e+06 0 e 0 0 0 0 1415 6.551 119.517 8.854 1 U 3.29e+06 0 e 0 0 0 0 1416 6.824 119.487 8.864 1 U 2.48e+06 0 e 0 0 0 0 1417 9.361 119.661 8.850 1 U 2.54e+06 0 e 0 0 0 0 1418 5.228 119.492 8.851 1 U 4.87e+06 0 e 0 0 0 0 1419 2.007 119.700 8.863 1 U 5.9e+06 0 e 0 0 0 0 1420 1.471 119.483 8.868 1 U 5.5e+06 0 e 0 0 0 0 1421 0.758 119.534 8.857 1 U 7.6e+06 0 e 0 0 0 0 1422 -0.012 119.484 8.853 1 U 4.34e+06 0 e 0 0 0 0 1423 2.580 119.077 8.865 1 U 2.8e+06 0 e 0 0 0 0 1424 2.332 107.401 8.925 1 U 2.34e+07 0 e 0 0 0 0 1425 1.802 107.346 8.926 1 U 6.38e+06 0 e 0 0 0 0 1426 1.609 107.499 8.922 1 U 3.23e+06 0 e 0 0 0 0 1427 1.985 107.232 8.933 1 U 2.94e+06 0 e 0 0 0 0 1428 1.372 107.219 8.925 1 U 3.19e+06 0 e 0 0 0 0 1429 1.139 107.470 8.924 1 U 5.59e+06 0 e 0 0 0 0 1430 -0.028 107.360 8.926 1 U 4.98e+06 0 e 0 0 0 0 1431 0.669 107.405 8.924 1 U 1.83e+07 0 e 0 0 0 0 1432 4.540 107.373 8.925 1 U 1.28e+07 0 e 0 0 0 0 1433 4.968 107.449 8.924 1 U 5.85e+06 0 e 0 0 0 0 1434 8.927 107.417 8.925 1 U 1.26e+08 0 e 0 0 0 0 1435 9.126 107.427 8.927 1 U 4.07e+06 0 e 0 0 0 0 1436 8.345 107.280 8.919 1 U 2.73e+06 0 e 0 0 0 0 1437 0.677 115.496 7.795 1 U 4.89e+06 0 e 0 0 0 0 1438 1.702 115.420 7.790 1 U 1.67e+07 0 e 0 0 0 0 1439 2.322 115.435 7.791 1 U 1.51e+07 0 e 0 0 0 0 1440 2.611 115.972 7.785 1 U 3.23e+06 0 e 0 0 0 0 1441 2.590 115.668 7.787 1 U 3.26e+06 0 e 0 0 0 0 1442 3.747 115.570 7.784 1 U 5.3e+06 0 e 0 0 0 0 1443 4.625 115.482 7.790 1 U 4.49e+07 0 e 0 0 0 0 1444 5.226 115.497 7.789 1 U 1.2e+07 0 e 0 0 0 0 1445 5.690 115.514 7.791 1 U 1.5e+07 0 e 0 0 0 0 1446 7.580 115.632 7.788 1 U 4.43e+06 0 e 0 0 0 0 1447 8.974 115.434 7.793 1 U 7.72e+06 0 e 0 0 0 0 1448 9.370 115.486 7.786 1 U 6.3e+06 0 e 0 0 0 0 1449 8.809 117.222 8.806 1 U 1.53e+08 0 e 0 0 0 0 1450 9.245 117.593 8.818 1 U 3.66e+06 0 e 0 0 0 0 1451 9.186 117.689 8.799 1 U 3.51e+06 0 e 0 0 0 0 1452 8.316 117.079 8.795 1 U 3.57e+06 0 e 0 0 0 0 1453 5.669 117.129 8.799 1 U 2.41e+06 0 e 0 0 0 0 1454 4.891 117.536 8.815 1 U 5.31e+06 0 e 0 0 0 0 1455 3.888 117.603 8.808 1 U 5.8e+06 0 e 0 0 0 0 1456 3.329 117.078 8.804 1 U 7.79e+06 0 e 0 0 0 0 1457 2.896 117.357 8.807 1 U 5.01e+06 0 e 0 0 0 0 1458 2.219 117.179 8.801 1 U 5.25e+06 0 e 0 0 0 0 1459 1.874 117.111 8.806 1 U 2.2e+07 0 e 0 0 0 0 1460 1.656 117.163 8.807 1 U 3.11e+07 0 e 0 0 0 0 1461 0.646 117.615 8.797 1 U 3.3e+06 0 e 0 0 0 0 1462 8.998 117.240 8.808 1 U 4.71e+06 0 e 0 0 0 0 1463 2.067 125.004 8.323 1 U 2.94e+06 0 e 0 0 0 0 1464 1.649 125.232 8.314 1 U 3.67e+06 0 e 0 0 0 0 1465 8.323 125.143 8.322 1 U 2.38e+08 0 e 0 0 0 0 1466 8.796 125.061 8.316 1 U 4.83e+06 0 e 0 0 0 0 1467 8.133 111.670 8.132 1 U 1.51e+08 0 e 0 0 0 0 1468 8.326 111.815 8.132 1 U 5.14e+06 0 e 0 0 0 0 1469 3.781 111.896 8.151 1 U 2.56e+06 0 e 0 0 0 0 1470 1.644 111.496 8.133 1 U 2.42e+06 0 e 0 0 0 0 1471 4.684 107.987 8.214 1 U 8.64e+06 0 e 0 0 0 0 1472 4.716 116.516 7.576 1 U 3.56e+06 0 e 0 0 0 0 1473 6.935 110.101 6.932 1 U 2.45e+07 0 e 0 1372 1375 1372 1474 7.682 110.494 6.929 1 U 6.23e+06 0 e 0 1373 1375 1372 1475 4.706 110.343 6.926 1 U 6.32e+06 0 e 0 0 0 0 1476 2.844 110.334 6.940 1 U 2.95e+06 0 e 0 1370 1375 1372 1477 3.320 110.140 6.935 1 U 2.26e+06 0 e 0 1371 1375 1372 1478 1.149 110.551 6.926 1 U 3.42e+06 0 e 0 0 0 0 1479 7.636 110.791 7.631 1 U 2e+07 0 e 0 1298 1302 1298 1480 4.717 110.732 7.630 1 U 8.36e+06 0 e 0 0 0 0 1481 2.577 110.776 7.630 1 U 5.64e+06 0 e 0 1300 1302 1298 1482 2.319 110.872 7.632 1 U 3.43e+06 0 e 0 1299 1302 1298 1483 2.964 110.639 7.638 1 U 2.36e+06 0 e 0 0 0 0 1484 2.002 110.736 7.631 1 U 3.02e+06 0 e 0 0 0 0 1485 1.659 110.811 7.629 1 U 3.08e+06 0 e 0 0 0 0 1486 0.858 110.919 7.632 1 U 2.83e+06 0 e 0 0 0 0 1487 7.122 109.603 6.937 1 U 9.78e+06 0 e 0 0 0 0 1488 8.916 113.475 8.914 1 U 1.1e+08 0 e 0 0 0 0 1489 9.248 113.583 8.916 1 U 6.45e+06 0 e 0 0 0 0 1490 8.216 113.501 8.912 1 U 3.13e+06 0 e 0 0 0 0 1491 4.712 113.436 8.911 1 U 3.84e+06 0 e 0 0 0 0 1492 1.431 113.437 8.913 1 U 9.95e+06 0 e 0 0 0 0 1493 1.898 113.524 8.912 1 U 9.59e+06 0 e 0 0 0 0 1494 9.112 127.033 9.109 1 U 8.02e+07 0 e 0 0 0 0 1495 8.182 127.128 9.104 1 U 3.45e+06 0 e 0 0 0 0 1496 7.550 127.021 9.105 1 U 2.01e+06 0 e 0 0 0 0 1497 4.296 127.347 9.098 1 U 3.14e+06 0 e 0 0 0 0 1498 4.023 127.129 9.112 1 U 5.16e+06 0 e 0 0 0 0 1499 2.239 115.570 8.918 1 U 2.91e+06 0 e 0 0 0 0 1500 1.636 116.191 8.920 1 U 3.35e+06 0 e 0 0 0 0 1501 0.894 116.068 8.918 1 U 2.53e+06 0 e 0 0 0 0 1502 3.758 118.596 8.981 1 U 2.81e+07 0 e 0 0 0 0 1503 4.056 118.424 8.982 1 U 4.7e+06 0 e 0 0 0 0 1504 8.777 118.785 8.989 1 U 3.74e+06 0 e 0 0 0 0 1505 6.738 118.531 8.982 1 U 1.12e+07 0 e 0 0 0 0 1506 6.554 118.706 8.973 1 U 2.86e+06 0 e 0 0 0 0 1507 9.095 119.533 9.092 1 U 1.6e+08 0 e 0 0 0 0 1508 7.765 120.256 9.103 1 U 2.02e+06 0 e 0 0 0 0 1509 3.007 120.062 9.101 1 U 4.73e+06 0 e 0 0 0 0 1510 7.808 119.838 9.353 1 U 5.66e+06 0 e 0 0 0 0 1511 8.836 119.786 9.360 1 U 3.7e+06 0 e 0 0 0 0 1512 9.361 119.907 9.358 1 U 8.6e+07 0 e 0 0 0 0 1513 9.134 119.789 9.356 1 U 4.3e+06 0 e 0 0 0 0 1514 0.860 119.741 9.352 1 U 4.65e+06 0 e 0 0 0 0 1515 0.674 120.036 9.358 1 U 3.14e+06 0 e 0 0 0 0 1516 2.310 119.880 9.358 1 U 1.01e+07 0 e 0 0 0 0 1517 2.569 119.919 9.362 1 U 7.31e+06 0 e 0 0 0 0 1518 9.377 121.447 9.375 1 U 9.39e+07 0 e 0 0 0 0 1519 9.588 121.463 9.384 1 U 3.01e+06 0 e 0 0 0 0 1520 8.662 121.521 9.375 1 U 1.21e+07 0 e 0 0 0 0 1521 8.262 121.558 9.377 1 U 4.2e+06 0 e 0 0 0 0 1522 8.442 121.132 9.386 1 U 2.61e+06 0 e 0 0 0 0 1523 7.104 121.603 9.371 1 U 3.17e+06 0 e 0 0 0 0 1524 0.854 121.485 9.376 1 U 1.7e+07 0 e 0 0 0 0 1525 1.623 121.457 9.375 1 U 5.26e+06 0 e 0 0 0 0 1526 1.409 121.439 9.374 1 U 9.03e+06 0 e 0 0 0 0 1527 2.004 121.486 9.377 1 U 2.93e+07 0 e 0 0 0 0 1528 4.926 121.567 9.372 1 U 5.54e+06 0 e 0 0 0 0 1529 4.561 121.426 9.383 1 U 3.47e+06 0 e 0 0 0 0 1530 6.273 121.645 9.375 1 U 4.78e+06 0 e 0 0 0 0 1531 0.804 116.170 7.125 1 U 5.5e+06 0 e 0 0 0 0 1532 2.003 116.012 7.126 1 U 9.42e+06 0 e 0 0 0 0 1533 3.120 115.915 7.122 1 U 4.79e+06 0 e 0 0 0 0 1534 2.283 115.807 7.125 1 U 3.54e+06 0 e 0 0 0 0 1535 4.618 115.987 7.129 1 U 4.75e+06 0 e 0 0 0 0 1536 7.127 116.047 7.127 1 U 6.97e+07 0 e 0 0 0 0 1537 6.823 115.988 7.135 1 U 2.65e+06 0 e 0 0 0 0 1538 7.332 116.056 7.133 1 U 3.98e+06 0 e 0 0 0 0 1539 7.598 116.111 7.136 1 U 2.77e+06 0 e 0 0 0 0 1540 8.863 116.038 7.128 1 U 7.4e+06 0 e 0 0 0 0 1541 8.702 132.010 8.701 1 U 9.26e+07 0 e 0 0 0 0 1542 8.487 132.119 8.713 1 U 3.47e+06 0 e 0 0 0 0 1543 8.895 132.003 8.700 1 U 3.72e+06 0 e 0 0 0 0 1544 9.252 131.935 8.703 1 U 4.82e+06 0 e 0 0 0 0 1545 4.896 132.033 8.701 1 U 1.01e+07 0 e 0 0 0 0 1546 0.801 131.995 8.702 1 U 1.53e+07 0 e 0 0 0 0 1547 9.173 128.731 9.169 1 U 6.22e+07 0 e 0 0 0 0 1548 8.524 128.734 9.173 1 U 5.96e+06 0 e 0 0 0 0 1549 4.376 128.617 9.169 1 U 3.85e+06 0 e 0 0 0 0 1550 3.921 128.766 9.177 1 U 3.06e+06 0 e 0 0 0 0 1551 1.642 128.767 9.171 1 U 1.34e+07 0 e 0 0 0 0 1552 0.844 128.730 9.170 1 U 2.38e+07 0 e 0 0 0 0 1553 8.804 117.308 7.725 1 U 3.64e+06 0 e 0 0 0 0 1554 8.406 117.367 7.713 1 U 2.7e+06 0 e 0 0 0 0 1555 7.724 117.366 7.724 1 U 1.44e+08 0 e 0 0 0 0 1556 6.558 117.654 7.712 1 U 3.58e+06 0 e 0 0 0 0 1557 6.372 117.512 7.715 1 U 3.61e+06 0 e 0 0 0 0 1558 6.530 111.008 6.340 1 U 9.59e+06 0 e 0 0 0 0 1559 6.933 110.943 6.336 1 U 3.23e+06 0 e 0 0 0 0 1560 2.874 111.406 6.335 1 U 4.24e+06 0 e 0 0 0 0 1561 1.503 111.074 6.338 1 U 2.53e+06 0 e 0 0 0 0 1562 0.834 110.889 6.350 1 U 2.98e+06 0 e 0 0 0 0 1563 0.760 111.428 6.321 1 U 3.12e+06 0 e 0 0 0 0 1564 0.501 111.356 6.357 1 U 2.41e+06 0 e 0 0 0 0 1565 4.354 110.893 6.345 1 U 7.08e+06 0 e 0 0 0 0 1566 4.218 106.873 8.672 1 U 3.22e+06 0 e 0 1237 1238 1235 1567 8.709 113.187 8.921 1 U 1.98e+06 0 e 0 0 0 0 1568 7.342 123.514 7.264 1 U 4.87e+06 0 e 0 0 0 0 1569 4.060 122.909 8.385 1 U 1.21e+07 0 e 0 0 0 0 1570 8.384 122.917 8.384 1 U 2.15e+07 0 e 0 0 0 0 1571 1.400 122.949 8.387 1 U 9.08e+06 0 e 0 0 0 0 1572 1.290 124.926 8.533 1 U 7.89e+06 0 e 0 0 0 0 1573 0.473 125.539 8.491 1 U 7.19e+06 0 e 0 0 0 0 1574 0.860 125.622 8.495 1 U 1.37e+07 0 e 0 0 0 0 1575 1.486 125.677 8.493 1 U 2.16e+07 0 e 0 0 0 0 1576 4.660 125.609 8.495 1 U 3.53e+07 0 e 0 0 0 0 1577 4.107 125.245 8.502 1 U 3.27e+06 0 e 0 0 0 0 1578 3.327 125.696 8.498 1 U 2.05e+06 0 e 0 0 0 0 1579 8.495 125.607 8.494 1 U 9.02e+07 0 e 0 0 0 0 1580 4.639 122.622 9.253 1 U 9.98e+06 0 e 0 0 0 0 1581 3.888 122.613 9.255 1 U 3.69e+06 0 e 0 0 0 0 1582 8.768 122.538 9.255 1 U 5.74e+06 0 e 0 0 0 0 1583 9.254 122.636 9.252 1 U 6.81e+07 0 e 0 0 0 0 1584 2.301 123.016 9.242 1 U 2.82e+06 0 e 0 0 0 0 1585 1.656 122.641 9.250 1 U 1.23e+07 0 e 0 0 0 0 1586 1.513 122.591 9.253 1 U 1.89e+07 0 e 0 0 0 0 1587 1.277 122.520 9.247 1 U 3.4e+06 0 e 0 0 0 0 1588 0.854 122.674 9.253 1 U 8.34e+06 0 e 0 0 0 0 1589 0.612 122.570 9.252 1 U 8.64e+06 0 e 0 0 0 0 1590 2.643 119.583 8.078 1 U 4.49e+06 0 e 0 0 0 0 1591 2.290 119.556 8.456 1 U 3.24e+06 0 e 0 0 0 0 1592 8.950 119.763 8.494 1 U 3.26e+06 0 e 0 0 0 0 1593 7.156 113.894 6.861 1 U 1.94e+06 0 e 0 0 0 0 1594 6.908 114.059 6.905 1 U 3.15e+07 0 e 0 0 0 0 1595 7.770 114.399 6.903 1 U 1.4e+07 0 e 0 0 0 0 1596 2.845 114.616 6.902 1 U 2.59e+06 0 e 0 0 0 0 1597 1.587 113.900 6.905 1 U 1.85e+06 0 e 0 0 0 0 1598 1.546 114.458 6.898 1 U 2.07e+06 0 e 0 0 0 0 1599 1.447 114.219 6.897 1 U 1.93e+06 0 e 0 0 0 0 1600 2.487 114.383 6.906 1 U 2.09e+06 0 e 0 0 0 0 1601 4.690 112.842 6.745 1 U 3.13e+06 0 e 0 0 0 0 1602 2.435 113.969 6.741 1 U 3.45e+06 0 e 0 0 0 0 1603 3.209 113.946 6.729 1 U 2.34e+06 0 e 0 0 0 0 1604 3.398 121.828 8.249 1 U 2.79e+06 0 e 0 0 0 0 1605 8.803 124.749 8.802 1 U 1.01e+08 0 e 0 0 0 0 1606 7.916 113.971 7.245 1 U 2.35e+06 0 e 0 0 0 0 1607 4.079 117.545 7.818 1 U 1.56e+07 0 e 0 0 0 0 1608 4.701 117.561 7.824 1 U 7.02e+06 0 e 0 0 0 0 1609 1.465 117.668 7.818 1 U 5.1e+06 0 e 0 0 0 0 1610 1.252 117.502 7.821 1 U 4.23e+06 0 e 0 0 0 0 1611 1.664 117.849 7.836 1 U 3.2e+06 0 e 0 0 0 0 1612 1.635 117.659 7.815 1 U 2.95e+06 0 e 0 0 0 0 1613 7.823 117.531 7.819 1 U 5.58e+07 0 e 0 0 0 0 1614 8.383 117.615 7.820 1 U 1.17e+07 0 e 0 0 0 0 1615 8.650 117.489 7.823 1 U 3.31e+06 0 e 0 0 0 0 1616 2.902 125.592 7.740 1 U 9.2e+06 0 e 0 0 0 0 1617 3.121 125.595 7.735 1 U 4.71e+06 0 e 0 0 0 0 1618 4.338 125.672 7.738 1 U 2.24e+07 0 e 0 0 0 0 1619 1.761 125.786 7.736 1 U 4.46e+06 0 e 0 0 0 0 1620 1.564 125.708 7.739 1 U 4.88e+06 0 e 0 0 0 0 1621 7.740 125.718 7.739 1 U 2.48e+08 0 e 0 0 0 0 1622 2.295 113.948 7.753 1 U 1.07e+07 0 e 0 0 0 0 1623 8.360 113.681 7.749 1 U 4.17e+06 0 e 0 0 0 0 1624 2.704 120.525 8.451 1 U 1.01e+07 0 e 0 0 0 0 1625 1.497 120.442 8.453 1 U 8.45e+06 0 e 0 0 0 0 1626 4.943 120.626 8.454 1 U 6.25e+06 0 e 0 0 0 0 1627 1.376 112.531 6.840 1 U 2.29e+06 0 e 0 0 0 0 1628 0.841 112.416 6.813 1 U 2.47e+06 0 e 0 0 0 0 1629 3.210 120.532 8.103 1 U 2e+06 0 e 0 0 0 0 1630 2.771 117.687 7.809 1 U 2.83e+06 0 e 0 0 0 0 1631 3.716 117.794 7.803 1 U 2.72e+06 0 e 0 0 0 0 1632 2.115 106.069 6.790 1 U 2.55e+06 0 e 0 0 0 0 1633 6.782 105.992 5.010 1 U 7.31e+06 0 e 0 0 0 0 1634 5.023 106.262 5.008 1 U 1.03e+07 0 e 0 0 0 0 1635 8.323 112.320 8.322 1 U 3.77e+07 0 e 0 0 0 0 1636 4.496 112.227 8.323 1 U 8.51e+06 0 e 0 0 0 0 1637 3.989 112.072 8.317 1 U 3.79e+06 0 e 0 0 0 0 1638 0.967 112.168 8.315 1 U 7.99e+06 0 e 0 0 0 0 1639 1.466 112.164 8.320 1 U 8.3e+06 0 e 0 0 0 0 1640 4.670 109.964 8.105 1 U 3.05e+06 0 e 0 0 0 0 1641 4.389 109.342 8.108 1 U 2.89e+06 0 e 0 0 0 0 1642 4.370 109.198 8.107 1 U 2.94e+06 0 e 0 0 0 0 1643 3.673 109.775 8.099 1 U 3.23e+06 0 e 0 0 0 0 1644 1.332 110.013 8.113 1 U 2.85e+06 0 e 0 0 0 0 1645 6.495 112.334 8.312 1 U 2.59e+06 0 e 0 0 0 0 1646 7.882 111.702 7.878 1 U 1.79e+08 0 e 0 862 864 862 1647 6.745 113.126 6.743 1 U 5.25e+07 0 e 0 0 0 0 1648 8.399 113.745 6.732 1 U 2.22e+06 0 e 0 0 0 0 1649 8.391 113.646 7.145 1 U 3.26e+06 0 e 0 0 0 0 1650 2.439 113.632 7.146 1 U 5.63e+06 0 e 0 0 0 0 1651 2.662 117.654 7.887 1 U 8.58e+06 0 e 0 0 0 0 1652 0.649 117.700 7.884 1 U 7.54e+06 0 e 0 0 0 0 1653 8.648 117.566 7.877 1 U 3.52e+06 0 e 0 0 0 0 1654 8.376 117.737 7.888 1 U 3.8e+06 0 e 0 0 0 0 1655 6.666 117.437 7.890 1 U 2.99e+06 0 e 0 0 0 0 1656 3.876 120.579 7.883 1 U 3.14e+06 0 e 0 0 0 0 1657 4.427 120.135 7.880 1 U 2.37e+06 0 e 0 0 0 0 1658 4.714 119.719 7.879 1 U 3.31e+06 0 e 0 0 0 0 1659 2.736 120.103 7.873 1 U 3.13e+06 0 e 0 0 0 0 1660 4.194 121.496 7.909 1 U 3.42e+06 0 e 0 0 0 0 1661 3.896 121.245 7.938 1 U 4.03e+06 0 e 0 0 0 0 1662 7.931 120.774 7.930 1 U 1.92e+07 0 e 0 0 0 0 1663 7.917 121.135 7.913 1 U 1.86e+07 0 e 0 0 0 0 1664 7.904 120.891 7.901 1 U 1.84e+07 0 e 0 0 0 0 1665 6.850 111.130 7.639 1 U 3.63e+06 0 e 0 0 0 0 1666 1.657 110.654 6.938 1 U 2.42e+06 0 e 0 0 0 0 1667 4.693 110.693 7.672 1 U 4.13e+06 0 e 0 0 0 0 1668 4.658 110.544 6.879 1 U 3.17e+06 0 e 0 0 0 0 1669 3.348 109.963 7.648 1 U 2.7e+06 0 e 0 0 0 0 1670 7.227 107.150 7.227 1 U 8.25e+07 0 e 0 347 348 347 1671 8.794 107.140 7.227 1 U 1.07e+07 0 e 0 342 348 347 1672 6.878 106.941 7.227 1 U 4.58e+06 0 e 0 0 0 0 1673 7.441 107.624 7.226 1 U 4.21e+06 0 e 0 0 0 0 1674 4.931 107.231 7.218 1 U 2.69e+06 0 e 0 0 0 0 1675 4.526 106.979 7.229 1 U 2.63e+06 0 e 0 0 0 0 1676 4.041 107.139 7.224 1 U 3.74e+06 0 e 0 0 0 0 1677 3.918 107.113 7.228 1 U 3.86e+06 0 e 0 0 0 0 1678 2.896 107.150 7.223 1 U 3.44e+06 0 e 0 0 0 0 1679 2.462 106.997 7.225 1 U 5.07e+06 0 e 0 345 348 347 1680 2.142 107.279 7.232 1 U 6.48e+06 0 e 0 344 348 347 1681 0.986 107.148 7.227 1 U 7.3e+06 0 e 0 0 0 0 1682 7.891 127.085 7.891 1 U 1.7e+08 0 e 0 0 0 0 1683 9.657 107.854 8.582 1 U 2.5e+06 0 e 0 0 0 0 1684 8.592 107.714 8.600 1 U 2.77e+06 0 e 0 1229 1230 1229 1685 8.455 108.042 8.608 1 U 3.15e+06 0 e 0 0 0 0 1686 7.145 113.888 7.145 1 U 4.46e+07 0 e 0 0 0 0 1687 -0.477 119.973 8.489 1 U 3.22e+06 0 e 0 0 0 0 1688 6.934 110.777 7.695 1 U 3.02e+06 0 e 0 1372 1375 1373 1689 2.849 110.720 7.676 1 U 1.73e+06 0 e 0 0 0 0 1690 3.253 112.728 7.794 1 U 1.36e+07 0 e 0 0 0 0 1691 0.177 122.945 7.193 1 U -1.71e+06 0 e 0 0 0 0 1692 4.549 126.977 8.467 1 U 1.87e+07 0 e 0 141 147 146 1693 2.169 111.388 9.428 1 U 3.08e+06 0 e 0 0 0 0 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . CO 13 CO . . 20 ppm . . . . . . 28058 4 2 . . N 15 NH . . 30 ppm . . . . . . 28058 4 3 . . HN 1 HN . . 14 ppm . . . . . . 28058 4 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $SPARKY . . 28058 4 stop_ save_ save_spectral_peak_list_5 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_5 _Spectral_peak_list.Entry_ID 28058 _Spectral_peak_list.ID 5 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 5 _Spectral_peak_list.Experiment_name '3D HCCH-TOCSY' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 3 1 63.643 4.216 4.365 1 U 2.26e+07 0 e 0 0 0 0 2 63.643 3.964 4.335 1 U 2.28e+07 0 e 0 0 0 0 3 63.643 3.866 3.872 1 U 2.52e+07 0 e 0 0 0 0 4 63.643 0.432 3.685 1 U 2.54e+07 0 e 0 0 0 0 5 63.531 4.016 4.020 1 U 4.42e+07 0 e 0 0 0 0 6 63.240 4.121 4.212 1 U 4.51e+07 0 e 0 0 0 0 7 63.269 3.998 0.700 1 U 2.28e+07 0 e 0 1051 1057 1062 8 63.292 3.813 3.817 1 U 2.94e+07 0 e 0 101 107 107 9 63.229 3.814 0.616 1 U 2.82e+07 0 e 0 101 107 112 10 63.337 3.728 3.399 1 U 2.09e+07 0 e 0 723 728 730 11 14.272 0.304 1.522 1 U 2.15e+07 0 e 0 1053 1061 1060 12 62.625 3.770 3.684 1 U -8.87e+07 0 e 0 0 0 0 13 62.630 3.681 5.996 1 U 3.13e+07 0 e 0 0 0 0 14 62.656 3.682 5.971 1 U 3.28e+07 0 e 0 0 0 0 15 62.628 3.682 5.957 1 U 3.3e+07 0 e 0 0 0 0 16 62.609 3.681 5.905 1 U 3.47e+07 0 e 0 0 0 0 17 62.627 3.681 5.887 1 U 3.39e+07 0 e 0 0 0 0 18 62.617 3.681 5.830 1 U 3.59e+07 0 e 0 0 0 0 19 62.630 3.682 5.790 1 U 3.68e+07 0 e 0 0 0 0 20 62.621 3.681 5.764 1 U 3.72e+07 0 e 0 0 0 0 21 62.620 3.682 5.729 1 U 3.89e+07 0 e 0 0 0 0 22 62.623 3.681 5.680 1 U 4.07e+07 0 e 0 0 0 0 23 62.617 3.681 5.662 1 U 4.09e+07 0 e 0 0 0 0 24 62.611 3.682 5.622 1 U 4.32e+07 0 e 0 0 0 0 25 62.615 3.682 5.573 1 U 4.59e+07 0 e 0 0 0 0 26 62.614 3.682 5.545 1 U 4.89e+07 0 e 0 0 0 0 27 62.617 3.682 5.500 1 U 5.22e+07 0 e 0 0 0 0 28 62.621 3.682 5.459 1 U 5.59e+07 0 e 0 0 0 0 29 62.614 3.681 5.401 1 U 6.16e+07 0 e 0 0 0 0 30 62.632 3.681 5.358 1 U 6.49e+07 0 e 0 0 0 0 31 62.630 3.681 5.328 1 U 6.75e+07 0 e 0 0 0 0 32 62.613 3.681 5.293 1 U 6.92e+07 0 e 0 0 0 0 33 62.620 3.681 5.271 1 U 7.1e+07 0 e 0 0 0 0 34 62.618 3.682 5.252 1 U 7.07e+07 0 e 0 0 0 0 35 62.619 3.681 5.227 1 U 7.32e+07 0 e 0 0 0 0 36 62.618 3.682 5.202 1 U 7.39e+07 0 e 0 0 0 0 37 62.617 3.682 5.151 1 U 7.34e+07 0 e 0 0 0 0 38 62.617 3.682 5.117 1 U 7.39e+07 0 e 0 0 0 0 39 62.621 3.681 5.091 1 U 6.96e+07 0 e 0 0 0 0 40 62.614 3.682 5.079 1 U 6.87e+07 0 e 0 0 0 0 41 62.622 3.681 5.050 1 U 6.61e+07 0 e 0 0 0 0 42 62.615 3.682 5.022 1 U 6.16e+07 0 e 0 0 0 0 43 62.620 3.681 4.417 1 U -1.11e+08 0 e 0 0 0 0 44 62.623 3.682 4.402 1 U -1.11e+08 0 e 0 0 0 0 45 62.622 3.681 4.374 1 U -1.14e+08 0 e 0 0 0 0 46 62.623 3.681 4.358 1 U -1.15e+08 0 e 0 0 0 0 47 62.619 3.681 4.341 1 U -1.15e+08 0 e 0 0 0 0 48 62.616 3.682 4.332 1 U -1.15e+08 0 e 0 0 0 0 49 62.619 3.682 4.315 1 U -1.14e+08 0 e 0 0 0 0 50 62.614 3.682 4.303 1 U -1.14e+08 0 e 0 0 0 0 51 62.620 3.682 4.289 1 U -1.14e+08 0 e 0 0 0 0 52 62.623 3.681 4.212 1 U -1.05e+08 0 e 0 0 0 0 53 62.622 3.681 4.148 1 U -9.24e+07 0 e 0 0 0 0 54 62.614 3.681 3.548 1 U -5.26e+07 0 e 0 0 0 0 55 62.638 3.682 3.510 1 U -4.64e+07 0 e 0 0 0 0 56 62.616 3.682 3.496 1 U -4.55e+07 0 e 0 0 0 0 57 62.632 3.682 3.465 1 U -4.41e+07 0 e 0 0 0 0 58 62.608 3.681 3.352 1 U -4.55e+07 0 e 0 0 0 0 59 62.614 3.681 3.318 1 U -4.57e+07 0 e 0 0 0 0 60 62.626 3.681 3.299 1 U -4.59e+07 0 e 0 0 0 0 61 62.613 3.681 3.241 1 U -4.42e+07 0 e 0 0 0 0 62 62.625 3.681 3.182 1 U -4.21e+07 0 e 0 0 0 0 63 62.630 3.681 2.991 1 U -3.31e+07 0 e 0 0 0 0 64 62.625 3.681 2.984 1 U -3.31e+07 0 e 0 0 0 0 65 62.632 3.682 2.952 1 U -3.22e+07 0 e 0 0 0 0 66 62.613 3.682 2.921 1 U -3.28e+07 0 e 0 0 0 0 67 14.224 0.304 0.303 1 U 4.96e+07 0 e 0 1053 1061 1061 68 62.589 4.229 4.187 1 U 4.17e+07 0 e 0 0 0 0 69 62.567 4.230 1.178 1 U 2.02e+07 0 e 0 0 0 0 70 62.436 4.071 4.073 1 U 4.07e+07 0 e 0 0 0 0 71 62.468 4.060 4.065 1 U 4.12e+07 0 e 0 0 0 0 72 62.600 3.682 5.938 1 U 3.35e+07 0 e 0 0 0 0 73 62.604 3.681 5.753 1 U 3.76e+07 0 e 0 0 0 0 74 62.599 3.682 3.910 1 U -3.38e+07 0 e 0 0 0 0 75 62.603 3.682 3.429 1 U -4.46e+07 0 e 0 0 0 0 76 62.584 3.681 3.389 1 U -4.47e+07 0 e 0 0 0 0 77 62.593 3.681 3.152 1 U -4.1e+07 0 e 0 0 0 0 78 62.589 3.681 3.111 1 U -3.8e+07 0 e 0 0 0 0 79 62.596 3.681 3.100 1 U -3.8e+07 0 e 0 0 0 0 80 62.593 3.681 3.069 1 U -3.7e+07 0 e 0 0 0 0 81 62.603 3.681 3.035 1 U -3.61e+07 0 e 0 0 0 0 82 62.267 4.107 4.110 1 U 5.97e+07 0 e 0 0 0 0 83 62.346 4.101 0.909 1 U 2.26e+07 0 e 0 0 0 0 84 62.361 4.086 4.089 1 U 4.29e+07 0 e 0 0 0 0 85 62.383 4.075 0.901 1 U 2.15e+07 0 e 0 0 0 0 86 62.096 4.867 4.054 1 U 5.26e+07 0 e 0 1332 1336 1337 87 62.089 4.866 1.232 1 U 2.52e+07 0 e 0 1332 1336 1338 88 62.117 4.457 4.458 1 U 3.68e+07 0 e 0 1169 1174 1174 89 62.149 4.455 0.887 1 U 4.01e+07 0 e 0 1169 1174 1177 90 62.151 4.455 0.848 1 U 3.66e+07 0 e 0 1169 1174 1176 91 62.213 3.631 4.104 1 U 2.41e+07 0 e 0 0 0 0 92 62.162 3.523 4.023 1 U 2.8e+07 0 e 0 0 0 0 93 13.755 0.674 1.558 1 U 2.46e+07 0 e 0 103 111 110 94 61.899 4.463 4.265 1 U 6.49e+07 0 e 0 1383 1387 1388 95 61.907 4.464 1.141 1 U 3.24e+07 0 e 0 1383 1387 1389 96 61.946 4.306 4.208 1 U 3.8e+07 0 e 0 0 0 0 97 61.913 4.309 1.176 1 U 2.13e+07 0 e 0 0 0 0 98 13.561 0.717 1.202 1 U 5.04e+07 0 e 0 649 657 656 99 13.534 0.718 0.909 1 U 4.68e+07 0 e 0 649 657 655 100 13.568 0.714 1.620 1 U 3.15e+07 0 e 0 649 657 654 101 13.554 0.668 1.421 1 U 2.26e+07 0 e 0 316 324 321 102 13.572 0.667 1.121 1 U 4.06e+07 0 e 0 316 324 323 103 13.612 0.669 0.665 1 U 1.56e+08 0 e 0 316 324 324 104 13.604 0.668 0.626 1 U 9.36e+07 0 e 0 316 324 325 105 61.708 4.927 3.897 1 U 4.29e+07 0 e 0 1250 1254 1255 106 61.696 3.746 3.749 1 U 2.22e+07 0 e 0 0 0 0 107 13.323 0.724 0.853 1 U 3.56e+07 0 e 0 649 657 658 108 13.362 0.719 0.718 1 U 1.08e+08 0 e 0 649 657 657 109 61.414 4.222 4.227 1 U 3.03e+07 0 e 0 0 0 0 110 13.030 0.742 0.739 1 U 6.02e+07 0 e 0 889 896 896 111 61.252 4.332 1.252 1 U 2.47e+07 0 e 0 984 988 990 112 61.120 4.168 0.870 1 U 2.67e+07 0 e 0 0 0 0 113 61.152 4.149 1.827 1 U 2.5e+07 0 e 0 0 0 0 114 61.139 4.139 0.843 1 U 3.08e+07 0 e 0 0 0 0 115 61.129 0.822 1.834 1 U 2.01e+07 0 e 0 0 0 0 116 61.175 0.822 1.419 1 U 3.57e+07 0 e 0 0 0 0 117 61.138 0.822 1.136 1 U 3.27e+07 0 e 0 0 0 0 118 61.140 0.822 0.820 1 U 6.23e+07 0 e 0 0 0 0 119 61.203 0.776 0.776 1 U 2.27e+07 0 e 0 0 0 0 120 60.797 4.361 4.108 1 U 4.55e+07 0 e 0 602 605 606 121 60.838 3.682 3.684 1 U -1.6e+08 0 e 0 0 0 0 122 60.304 3.620 5.274 1 U 2.14e+07 0 e 0 0 0 0 123 60.317 3.619 5.254 1 U 2.11e+07 0 e 0 0 0 0 124 60.304 3.620 5.203 1 U 2.48e+07 0 e 0 0 0 0 125 60.299 3.620 5.151 1 U 2.55e+07 0 e 0 0 0 0 126 60.269 3.620 5.099 1 U 2.72e+07 0 e 0 0 0 0 127 60.298 3.620 5.033 1 U 2.87e+07 0 e 0 0 0 0 128 60.302 3.620 4.995 1 U 2.73e+07 0 e 0 0 0 0 129 60.304 3.620 4.982 1 U 2.73e+07 0 e 0 0 0 0 130 60.317 3.620 4.954 1 U 2.76e+07 0 e 0 0 0 0 131 60.294 3.620 4.892 1 U 2.6e+07 0 e 0 0 0 0 132 60.320 3.620 4.862 1 U 2.5e+07 0 e 0 0 0 0 133 60.301 3.620 3.622 1 U 4.43e+08 0 e 0 0 0 0 134 60.281 3.620 1.145 1 U 4.66e+07 0 e 0 0 0 0 135 60.007 4.231 3.816 1 U 1.9e+08 0 e 0 0 0 0 136 59.854 5.230 4.052 1 U 7.64e+07 0 e 0 1392 1396 1397 137 59.820 5.229 1.141 1 U 3.46e+07 0 e 0 1392 1396 1398 138 59.643 4.786 1.618 1 U 2.78e+07 0 e 0 647 653 654 139 59.617 4.787 0.853 1 U 4.79e+07 0 e 0 647 653 658 140 59.644 4.142 2.337 1 U 2.27e+07 0 e 0 1008 1012 1015 141 59.460 3.742 1.265 1 U 2.31e+07 0 e 0 993 999 1002 142 59.343 5.592 5.596 1 U 2.99e+07 0 e 0 239 244 244 143 59.349 4.462 4.091 1 U 2.51e+07 0 e 0 749 752 754 144 59.346 4.460 3.995 1 U 2.56e+07 0 e 0 749 752 753 145 59.213 4.460 3.197 1 U 5.68e+07 0 e 0 0 0 0 146 59.369 3.683 3.685 1 U -4.19e+07 0 e 0 0 0 0 147 59.168 4.459 3.174 1 U 7.87e+07 0 e 0 0 0 0 148 59.078 4.460 3.141 1 U 7.02e+07 0 e 0 0 0 0 149 59.191 4.459 2.936 1 U 5.73e+07 0 e 0 0 0 0 150 59.135 4.460 2.916 1 U 7.46e+07 0 e 0 0 0 0 151 58.926 4.115 2.369 1 U 2.01e+07 0 e 0 1020 1024 1026 152 58.957 3.956 3.261 1 U 3.01e+07 0 e 0 0 0 0 153 58.948 3.955 3.240 1 U 3.81e+07 0 e 0 0 0 0 154 58.934 3.955 3.092 1 U 3.01e+07 0 e 0 0 0 0 155 58.675 4.107 4.113 1 U 1.18e+08 0 e 0 0 0 0 156 58.579 4.569 3.913 1 U 3.37e+07 0 e 0 0 0 0 157 58.498 4.158 2.368 1 U 2.4e+07 0 e 0 570 574 575 158 58.607 4.161 2.139 1 U 3.93e+07 0 e 0 570 574 578 159 58.519 3.978 3.589 1 U 3.59e+07 0 e 0 178 181 183 160 58.512 3.978 3.489 1 U 3.2e+07 0 e 0 178 181 182 161 58.588 3.957 3.960 1 U 3.05e+07 0 e 0 0 0 0 162 58.335 4.400 3.814 1 U 6.62e+07 0 e 0 0 0 0 163 58.328 4.357 3.728 1 U 3.41e+07 0 e 0 0 0 0 164 58.289 4.137 4.652 1 U -3.77e+07 0 e 0 0 0 0 165 58.300 4.136 4.599 1 U -3.73e+07 0 e 0 0 0 0 166 58.290 4.137 4.573 1 U -3.68e+07 0 e 0 0 0 0 167 58.292 4.136 4.527 1 U -3.64e+07 0 e 0 0 0 0 168 58.315 4.135 4.434 1 U -3.16e+07 0 e 0 0 0 0 169 58.369 4.016 1.419 1 U 2.01e+07 0 e 0 314 320 321 170 58.423 4.018 0.626 1 U 4.69e+07 0 e 0 314 320 325 171 58.195 4.471 3.819 1 U 1.16e+08 0 e 0 0 0 0 172 58.233 4.137 4.141 1 U 4.21e+08 0 e 0 0 0 0 173 58.244 4.137 2.195 1 U 2.21e+08 0 e 0 1552 1555 1559 174 58.232 4.137 2.051 1 U 7.94e+07 0 e 0 1552 1555 1557 175 58.241 4.136 1.880 1 U 7.33e+07 0 e 0 1552 1555 1556 176 58.086 3.872 3.869 1 U 1e+08 0 e 0 0 0 0 177 58.048 4.058 4.063 1 U 7.05e+07 0 e 0 0 0 0 178 57.883 4.018 4.023 1 U 1.13e+08 0 e 0 491 497 497 179 58.061 3.729 3.738 1 U 3.75e+07 0 e 0 0 0 0 180 57.877 5.689 3.778 1 U 5.53e+07 0 e 0 1311 1314 1318 181 57.735 4.194 2.645 1 U 4.21e+07 0 e 0 735 740 747 182 57.780 4.045 3.109 1 U 4.26e+07 0 e 0 0 0 0 183 57.805 4.042 3.066 1 U 4.4e+07 0 e 0 0 0 0 184 57.817 4.021 1.335 1 U 2.32e+07 0 e 0 491 497 504 185 57.804 4.015 1.539 1 U 4.87e+07 0 e 0 491 497 501 186 57.762 3.967 3.005 1 U 2.35e+07 0 e 0 0 0 0 187 57.749 3.961 2.968 1 U 2.26e+07 0 e 0 0 0 0 188 57.541 4.627 3.185 1 U 2.03e+07 0 e 0 0 0 0 189 57.565 4.158 1.684 1 U 2.2e+07 0 e 0 0 0 0 190 57.505 3.718 2.317 1 U 2.02e+07 0 e 0 0 0 0 191 9.196 0.629 1.422 1 U 2.06e+07 0 e 0 663 671 670 192 9.203 0.630 0.630 1 U 6.44e+07 0 e 0 663 671 671 193 57.432 4.190 4.194 1 U 1.6e+08 0 e 0 735 740 740 194 57.468 4.167 4.171 1 U 1.55e+08 0 e 0 0 0 0 195 57.399 4.170 1.804 1 U 2.5e+07 0 e 0 0 0 0 196 57.467 3.718 3.721 1 U 4.92e+07 0 e 0 0 0 0 197 57.092 5.409 3.910 1 U 2.36e+07 0 e 0 1080 1083 1085 198 56.810 5.331 5.338 1 U 2.28e+07 0 e 0 661 667 667 199 56.799 5.332 0.922 1 U 2.82e+07 0 e 0 661 667 672 200 56.855 4.165 1.555 1 U 2.19e+08 0 e 0 0 0 0 201 56.811 4.162 0.877 1 U 2.24e+07 0 e 0 0 0 0 202 56.662 3.702 3.706 1 U 2.21e+07 0 e 0 0 0 0 203 56.379 4.272 1.704 1 U 2e+07 0 e 0 0 0 0 204 56.549 4.232 4.236 1 U 6.89e+07 0 e 0 0 0 0 205 56.244 4.379 4.385 1 U 8.21e+07 0 e 0 0 0 0 206 56.195 4.290 4.297 1 U 8.05e+07 0 e 0 0 0 0 207 56.370 4.269 4.274 1 U 9.16e+07 0 e 0 0 0 0 208 56.197 4.250 4.257 1 U 8.55e+07 0 e 0 0 0 0 209 56.308 4.021 2.771 1 U 2.17e+07 0 e 0 193 196 198 210 56.346 4.019 2.289 1 U 2.17e+07 0 e 0 193 196 197 211 56.357 3.697 3.701 1 U 2.29e+07 0 e 0 0 0 0 212 56.339 3.695 1.657 1 U 2.56e+07 0 e 0 0 0 0 213 56.287 3.648 3.651 1 U 5.32e+07 0 e 0 0 0 0 214 56.278 3.650 1.680 1 U 5.3e+07 0 e 0 0 0 0 215 56.110 3.955 1.448 1 U 8.61e+07 0 e 0 922 925 926 216 56.010 3.846 3.852 1 U 2.83e+07 0 e 0 0 0 0 217 56.000 3.824 3.828 1 U 2.96e+07 0 e 0 0 0 0 218 56.069 3.764 3.767 1 U 2.65e+07 0 e 0 0 0 0 219 55.872 4.677 3.080 1 U 2.37e+07 0 e 0 0 0 0 220 55.839 4.345 4.349 1 U 1.31e+08 0 e 0 0 0 0 221 55.860 4.348 2.630 1 U 3.83e+07 0 e 0 0 0 0 222 55.805 4.338 2.613 1 U 3.87e+07 0 e 0 0 0 0 223 55.835 4.344 2.541 1 U 3.83e+07 0 e 0 0 0 0 224 55.948 4.333 1.746 1 U 2.62e+07 0 e 0 0 0 0 225 55.938 4.155 1.457 1 U 2.82e+07 0 e 0 0 0 0 226 55.900 4.154 1.351 1 U 3.25e+07 0 e 0 0 0 0 227 55.937 4.155 0.754 1 U 2.06e+07 0 e 0 0 0 0 228 55.888 3.899 3.905 1 U 3.13e+07 0 e 0 0 0 0 229 55.865 3.860 3.862 1 U 3.05e+07 0 e 0 0 0 0 230 55.797 4.680 3.181 1 U 2.43e+07 0 e 0 0 0 0 231 55.764 4.305 4.311 1 U 8.87e+07 0 e 0 0 0 0 232 55.648 4.140 1.514 1 U 1.17e+08 0 e 0 709 712 713 233 7.103 0.392 0.391 1 U 4.63e+07 0 e 0 330 338 338 234 55.490 5.245 5.251 1 U 5.01e+07 0 e 0 0 0 0 235 55.579 4.961 2.612 1 U 4.37e+07 0 e 0 0 0 0 236 55.600 4.354 1.496 1 U 7.96e+07 0 e 0 1273 1276 1277 237 55.551 4.252 1.526 1 U 2.65e+07 0 e 0 0 0 0 238 55.494 4.249 1.444 1 U 3.02e+07 0 e 0 0 0 0 239 55.324 5.252 2.009 1 U 2.01e+07 0 e 0 1291 1296 1303 240 55.289 4.344 1.602 1 U 1.4e+08 0 e 0 0 0 0 241 55.263 4.310 1.555 1 U 1.02e+08 0 e 0 0 0 0 242 55.360 4.258 1.484 1 U 2.34e+07 0 e 0 0 0 0 243 55.276 4.002 4.005 1 U 7.94e+07 0 e 0 443 446 446 244 55.199 4.338 0.898 1 U 2.52e+07 0 e 0 0 0 0 245 55.135 4.316 0.831 1 U 3.21e+07 0 e 0 580 586 590 246 55.141 4.153 3.127 1 U 5.77e+07 0 e 0 635 639 641 247 55.084 4.153 2.774 1 U 5.34e+07 0 e 0 635 639 640 248 55.223 4.001 1.412 1 U 1.19e+08 0 e 0 443 446 447 249 55.150 3.942 3.943 1 U 2.25e+08 0 e 0 0 0 0 250 55.001 4.810 2.877 1 U 3.9e+07 0 e 0 1103 1106 1107 251 55.035 3.941 1.726 1 U 1.67e+08 0 e 0 1541 1546 1548 252 55.031 3.941 1.657 1 U 2.21e+08 0 e 0 1541 1546 1547 253 55.043 3.941 0.938 1 U 7.3e+07 0 e 0 1541 1546 1551 254 55.045 3.941 0.916 1 U 7.44e+07 0 e 0 1541 1546 1550 255 54.887 3.801 3.805 1 U 3.84e+07 0 e 0 186 189 189 256 54.782 4.439 2.731 1 U 5.17e+07 0 e 0 0 0 0 257 54.811 4.434 2.644 1 U 3.87e+07 0 e 0 0 0 0 258 54.796 4.260 1.254 1 U 7.24e+07 0 e 0 535 538 539 259 54.687 4.235 2.788 1 U 3.37e+07 0 e 0 1180 1184 1186 260 54.696 4.078 1.663 1 U 1.24e+08 0 e 0 542 545 546 261 54.644 5.233 2.319 1 U 2.63e+07 0 e 0 1424 1429 1431 262 54.667 4.237 2.687 1 U 3.37e+07 0 e 0 1180 1184 1185 263 54.620 3.801 1.461 1 U 7.43e+07 0 e 0 186 189 190 264 54.437 4.929 3.130 1 U 2.22e+07 0 e 0 966 972 982 265 54.322 4.599 3.023 1 U 3.19e+07 0 e 0 929 933 935 266 54.349 4.578 2.670 1 U 1.07e+08 0 e 0 0 0 0 267 54.174 4.926 1.692 1 U 2.16e+07 0 e 0 966 972 973 268 54.270 4.610 2.685 1 U 1.02e+08 0 e 0 0 0 0 269 54.178 4.585 2.583 1 U 9.27e+07 0 e 0 0 0 0 270 54.273 4.091 4.095 1 U 1.01e+08 0 e 0 0 0 0 271 54.163 3.400 3.403 1 U 4.19e+07 0 e 0 687 690 690 272 54.147 3.400 1.067 1 U 8.33e+07 0 e 0 687 690 691 273 53.990 4.816 2.409 1 U 2.09e+07 0 e 0 0 0 0 274 53.917 4.631 2.717 1 U 9.54e+07 0 e 0 0 0 0 275 54.018 4.597 2.868 1 U 2.57e+07 0 e 0 0 0 0 276 54.018 4.596 2.858 1 U 2.62e+07 0 e 0 0 0 0 277 53.966 4.587 2.486 1 U 3.21e+07 0 e 0 0 0 0 278 54.083 4.587 1.599 1 U 3.24e+07 0 e 0 1145 1151 1157 279 53.973 4.109 2.745 1 U 2.25e+07 0 e 0 0 0 0 280 53.807 4.669 1.520 1 U 2.79e+07 0 e 0 0 0 0 281 53.740 4.595 2.970 1 U 2.84e+07 0 e 0 0 0 0 282 53.754 4.590 2.463 1 U 2.41e+07 0 e 0 0 0 0 283 53.696 4.611 2.776 1 U 6.7e+07 0 e 0 0 0 0 284 53.601 4.092 1.294 1 U 1.21e+08 0 e 0 0 0 0 285 53.407 4.792 2.347 1 U 2.41e+07 0 e 0 594 597 598 286 53.384 4.725 2.846 1 U 5.64e+07 0 e 0 0 0 0 287 53.396 4.720 2.786 1 U 4.68e+07 0 e 0 0 0 0 288 53.383 4.680 2.813 1 U 5.05e+07 0 e 0 0 0 0 289 53.428 4.659 2.803 1 U 5.54e+07 0 e 0 0 0 0 290 53.440 4.647 2.772 1 U 7.5e+07 0 e 0 0 0 0 291 53.384 4.408 3.024 1 U 3.06e+07 0 e 0 450 453 455 292 53.426 4.407 2.546 1 U 3.07e+07 0 e 0 450 453 454 293 53.535 3.746 1.439 1 U 3.91e+07 0 e 0 0 0 0 294 53.260 4.583 3.006 1 U 3.2e+07 0 e 0 627 630 632 295 53.187 4.467 1.323 1 U 2.29e+07 0 e 0 0 0 0 296 53.319 4.136 4.139 1 U 7.3e+07 0 e 0 694 697 697 297 53.248 4.131 1.302 1 U 1.25e+08 0 e 0 694 697 698 298 53.023 4.617 3.025 1 U 3.24e+07 0 e 0 87 90 92 299 52.896 4.611 2.336 1 U 3.41e+07 0 e 0 87 90 91 300 52.474 4.338 4.341 1 U 2.11e+07 0 e 0 0 0 0 301 52.456 4.340 1.365 1 U 6.69e+07 0 e 0 0 0 0 302 52.515 4.311 4.316 1 U 3.22e+07 0 e 0 0 0 0 303 52.463 4.315 1.359 1 U 6.28e+07 0 e 0 0 0 0 304 52.521 4.298 4.299 1 U 3.33e+07 0 e 0 0 0 0 305 52.466 4.297 1.352 1 U 6.14e+07 0 e 0 0 0 0 306 52.541 4.285 4.288 1 U 3.2e+07 0 e 0 0 0 0 307 52.245 4.680 3.341 1 U 2.55e+07 0 e 0 0 0 0 308 52.360 4.643 2.657 1 U 2.38e+07 0 e 0 300 303 304 309 52.398 4.582 1.492 1 U 1.17e+08 0 e 0 716 719 720 310 52.391 4.269 1.301 1 U 2.21e+07 0 e 0 0 0 0 311 52.120 4.640 3.221 1 U 2.35e+07 0 e 0 300 303 305 312 52.160 4.624 3.335 1 U 2.26e+07 0 e 0 50 53 55 313 52.110 4.203 4.206 1 U 4.64e+07 0 e 0 1126 1129 1129 314 52.040 4.203 1.245 1 U 1.08e+08 0 e 0 1126 1129 1130 315 52.032 4.022 4.025 1 U 4.95e+07 0 e 0 0 0 0 316 52.061 3.990 3.995 1 U 7.58e+07 0 e 0 484 487 487 317 52.003 3.998 1.474 1 U 1.22e+08 0 e 0 484 487 488 318 51.627 4.870 3.231 1 U 2.21e+07 0 e 0 610 614 616 319 51.603 4.860 3.300 1 U 2.25e+07 0 e 0 854 858 860 320 51.636 4.867 2.790 1 U 2.37e+07 0 e 0 610 614 615 321 51.620 4.802 3.296 1 U 2.47e+07 0 e 0 286 289 291 322 51.451 4.752 1.424 1 U 2.85e+07 0 e 0 1500 1503 1504 323 50.621 4.482 0.944 1 U 1.12e+08 0 e 0 1401 1404 1405 324 50.378 5.153 1.149 1 U 5.87e+07 0 e 0 29 32 33 325 48.282 4.895 4.064 1 U 2.59e+07 0 e 0 0 0 0 326 48.234 4.895 3.489 1 U 3.01e+07 0 e 0 0 0 0 327 47.748 3.848 3.855 1 U 4.18e+07 0 e 0 622 625 625 328 46.576 4.010 4.015 1 U 5.51e+07 0 e 0 389 392 392 329 46.171 3.725 3.730 1 U 4.45e+07 0 e 0 0 0 0 330 45.419 3.914 3.917 1 U 3.56e+08 0 e 0 0 0 0 331 45.370 4.024 4.025 1 U 7.64e+07 0 e 0 0 0 0 332 45.341 3.979 3.984 1 U 8.89e+07 0 e 0 0 0 0 333 45.140 4.244 4.249 1 U 3.14e+07 0 e 0 0 0 0 334 45.086 3.847 3.852 1 U 3.78e+07 0 e 0 0 0 0 335 44.379 3.522 3.523 1 U 6.06e+07 0 e 0 0 0 0 336 43.960 3.832 3.834 1 U 5.08e+07 0 e 0 0 0 0 337 43.768 3.812 3.814 1 U 1.55e+08 0 e 0 0 0 0 338 43.730 3.791 3.793 1 U 2.5e+08 0 e 0 0 0 0 339 43.775 3.773 3.775 1 U 3.53e+08 0 e 0 0 0 0 340 43.817 3.739 3.743 1 U 4.48e+07 0 e 0 0 0 0 341 43.361 3.174 3.176 1 U 1.03e+08 0 e 0 0 0 0 342 43.414 3.174 1.595 1 U 4.39e+07 0 e 0 0 0 0 343 43.476 3.156 1.793 1 U 3.18e+07 0 e 0 968 976 979 344 43.395 3.141 3.147 1 U 9.12e+07 0 e 0 0 0 0 345 43.481 3.147 1.558 1 U 6.24e+07 0 e 0 0 0 0 346 43.364 3.101 3.102 1 U 1.25e+08 0 e 0 0 0 0 347 43.413 3.104 1.682 1 U 6.55e+07 0 e 0 968 975 978 348 43.368 3.092 1.483 1 U 5.12e+07 0 e 0 0 0 0 349 43.372 3.047 3.047 1 U 3.58e+07 0 e 0 0 0 0 350 43.360 1.556 4.171 1 U 1.4e+08 0 e 0 0 0 0 351 43.241 1.627 0.687 1 U 2.13e+07 0 e 0 1032 1042 1039 352 43.220 1.555 0.876 1 U 7.92e+07 0 e 0 0 0 0 353 43.119 1.555 1.558 1 U 8.61e+07 0 e 0 0 0 0 354 43.032 1.553 0.832 1 U 7.54e+07 0 e 0 0 0 0 355 42.813 1.726 3.943 1 U 1.71e+08 0 e 0 1542 1548 1546 356 42.800 1.724 1.659 1 U 2.51e+07 0 e 0 1542 1548 1547 357 42.885 1.724 0.932 1 U 5.95e+07 0 e 0 0 0 0 358 42.864 1.723 0.916 1 U 7.26e+07 0 e 0 0 0 0 359 42.864 1.650 3.943 1 U 1.72e+08 0 e 0 1542 1547 1546 360 42.826 1.648 1.656 1 U 3.27e+07 0 e 0 0 0 0 361 42.864 1.646 0.916 1 U 8.86e+07 0 e 0 0 0 0 362 42.829 1.616 0.853 1 U 9.14e+07 0 e 0 648 654 658 363 42.840 1.619 0.717 1 U 3.75e+07 0 e 0 648 654 657 364 42.673 1.581 0.894 1 U 5.71e+07 0 e 0 0 0 0 365 42.447 1.604 4.347 1 U 5.33e+07 0 e 0 0 0 0 366 42.273 2.619 4.342 1 U 3.13e+07 0 e 0 0 0 0 367 42.257 2.537 4.344 1 U 3.18e+07 0 e 0 0 0 0 368 42.375 1.602 0.899 1 U 6.8e+07 0 e 0 0 0 0 369 42.379 1.559 4.313 1 U 5.08e+07 0 e 0 0 0 0 370 42.099 2.976 2.977 1 U 3.4e+08 0 e 0 494 503 503 371 42.128 2.971 1.634 1 U 2.79e+08 0 e 0 494 503 502 372 42.144 2.973 1.337 1 U 8.96e+07 0 e 0 494 503 504 373 42.134 2.933 2.935 1 U 2.62e+08 0 e 0 1196 1207 1207 374 42.163 2.931 1.222 1 U 3.9e+07 0 e 0 1196 1207 1204 375 42.152 2.898 2.900 1 U 2.85e+08 0 e 0 1148 1158 1158 376 42.163 2.904 1.589 1 U 2.57e+08 0 e 0 1148 1158 1157 377 42.171 2.903 1.373 1 U 7.02e+07 0 e 0 1148 1158 1155 378 42.180 2.899 1.323 1 U 8.82e+07 0 e 0 1148 1158 1154 379 42.108 1.420 4.022 1 U 2.01e+07 0 e 0 315 321 320 380 42.078 1.418 0.664 1 U 2.91e+07 0 e 0 315 321 324 381 42.150 1.418 0.627 1 U 5.48e+07 0 e 0 315 321 325 382 41.891 1.584 0.753 1 U 2.13e+07 0 e 0 0 0 0 383 41.849 1.351 0.830 1 U 2.13e+07 0 e 0 0 0 0 384 41.853 1.351 0.754 1 U 2.05e+07 0 e 0 0 0 0 385 41.739 2.650 2.649 1 U 2.75e+07 0 e 0 0 0 0 386 41.806 2.645 1.337 1 U 3.54e+07 0 e 0 0 0 0 387 41.824 1.350 4.158 1 U 3.19e+07 0 e 0 0 0 0 388 41.579 2.676 2.679 1 U 2.39e+07 0 e 0 0 0 0 389 41.327 2.773 4.023 1 U 2.18e+07 0 e 0 194 198 196 390 40.942 3.109 4.046 1 U 3.98e+07 0 e 0 0 0 0 391 40.838 3.061 4.044 1 U 4.3e+07 0 e 0 0 0 0 392 40.245 3.163 4.463 1 U 3.47e+07 0 e 0 0 0 0 393 40.267 2.912 4.463 1 U 3.72e+07 0 e 0 0 0 0 394 39.177 3.248 3.957 1 U 4.4e+07 0 e 0 0 0 0 395 39.176 3.080 3.957 1 U 3.93e+07 0 e 0 0 0 0 396 38.931 3.126 4.156 1 U 6.49e+07 0 e 0 636 641 639 397 38.963 2.769 4.156 1 U 6.45e+07 0 e 0 636 640 639 398 38.823 1.845 0.875 1 U 3.69e+07 0 e 0 0 0 0 399 38.740 1.836 1.836 1 U 3.08e+07 0 e 0 0 0 0 400 38.673 1.830 4.165 1 U 2.64e+07 0 e 0 0 0 0 401 38.634 1.826 4.147 1 U 2.37e+07 0 e 0 0 0 0 402 38.761 1.827 0.841 1 U 4.76e+07 0 e 0 0 0 0 403 38.267 1.617 0.700 1 U 3.08e+07 0 e 0 1052 1058 1062 404 37.896 2.791 4.236 1 U 3.94e+07 0 e 0 1181 1186 1184 405 37.877 2.684 4.238 1 U 3.76e+07 0 e 0 1181 1185 1184 406 37.837 2.506 4.162 1 U 2.69e+07 0 e 0 572 576 574 407 37.782 2.505 2.139 1 U 4.42e+07 0 e 0 572 576 578 408 37.735 2.363 4.162 1 U 2.98e+07 0 e 0 572 575 574 409 37.692 2.363 2.139 1 U 5.15e+07 0 e 0 572 575 578 410 37.464 1.621 0.675 1 U 2.21e+07 0 e 0 102 108 111 411 37.358 1.620 0.617 1 U 3.84e+07 0 e 0 102 108 112 412 37.075 2.342 2.149 1 U 4.42e+07 0 e 0 0 0 0 413 36.669 2.426 4.145 1 U 3.39e+07 0 e 0 1010 1016 1012 414 36.636 2.426 2.150 1 U 3.75e+07 0 e 0 1010 1016 1014 415 36.617 2.427 1.979 1 U 3.55e+07 0 e 0 1010 1016 1013 416 36.722 2.331 4.145 1 U 3.33e+07 0 e 0 1010 1015 1012 417 36.557 2.328 1.983 1 U 4e+07 0 e 0 1010 1015 1013 418 36.707 2.195 4.139 1 U 2.35e+08 0 e 0 0 0 0 419 36.684 2.195 2.194 1 U 2.32e+08 0 e 0 0 0 0 420 36.693 2.196 2.054 1 U 1.45e+08 0 e 0 0 0 0 421 36.689 2.194 1.878 1 U 1.6e+08 0 e 0 0 0 0 422 36.685 2.161 4.104 1 U 2.21e+07 0 e 0 0 0 0 423 36.660 2.162 4.070 1 U 2.35e+07 0 e 0 0 0 0 424 36.486 2.325 1.140 1 U 2.01e+07 0 e 0 240 245 247 425 36.498 2.323 0.584 1 U 2.2e+07 0 e 0 240 245 246 426 36.259 2.317 3.720 1 U 2.02e+07 0 e 0 0 0 0 427 36.330 2.318 2.318 1 U 4.73e+07 0 e 0 240 245 245 428 36.223 2.240 2.239 1 U 2.28e+07 0 e 0 0 0 0 429 35.976 1.708 1.600 1 U 2.16e+07 0 e 0 1146 1153 1157 430 35.821 2.171 0.923 1 U 2.75e+07 0 e 0 662 668 672 431 35.820 2.072 0.940 1 U 2.47e+07 0 e 0 137 142 144 432 35.856 1.613 1.601 1 U 2.54e+07 0 e 0 1146 1152 1157 433 35.703 2.074 0.819 1 U 3.09e+07 0 e 0 137 142 143 434 34.701 2.220 1.775 1 U 2.08e+07 0 e 0 1068 1076 1072 435 34.426 2.320 2.323 1 U 2.95e+07 0 e 0 0 0 0 436 34.171 2.009 2.009 1 U 2.15e+07 0 e 0 1292 1303 1303 437 33.932 2.644 4.198 1 U 6.59e+07 0 e 0 738 747 740 438 33.942 2.644 2.645 1 U 8.99e+07 0 e 0 738 747 747 439 33.938 2.644 2.324 1 U 5.95e+07 0 e 0 738 747 742 440 33.953 2.644 2.192 1 U 5.59e+07 0 e 0 738 747 741 441 33.911 2.078 2.078 1 U 3.88e+07 0 e 0 1170 1175 1175 442 33.923 2.077 0.886 1 U 7.45e+07 0 e 0 1170 1175 1177 443 33.978 2.077 0.848 1 U 6.81e+07 0 e 0 1170 1175 1176 444 33.853 2.334 2.335 1 U 3.27e+07 0 e 0 0 0 0 445 33.856 1.616 1.618 1 U 2.44e+07 0 e 0 787 792 792 446 33.774 1.617 0.593 1 U 3.14e+07 0 e 0 787 792 794 447 33.766 1.617 0.504 1 U 3.61e+07 0 e 0 787 792 793 448 33.215 2.044 2.042 1 U 2.17e+07 0 e 0 0 0 0 449 33.179 1.539 1.537 1 U 3.03e+07 0 e 0 492 501 501 450 33.183 1.537 1.334 1 U 3.9e+07 0 e 0 492 501 504 451 33.212 0.858 0.180 1 U 2.76e+07 0 e 0 168 173 174 452 33.036 1.537 4.023 1 U 3.97e+07 0 e 0 492 501 497 453 33.108 1.537 2.980 1 U 2.05e+07 0 e 0 492 501 503 454 33.079 1.539 1.627 1 U 3.95e+07 0 e 0 492 501 502 455 32.941 2.058 0.905 1 U 4.04e+07 0 e 0 0 0 0 456 32.004 1.681 3.102 1 U 4.79e+07 0 e 0 0 0 0 457 32.023 1.680 1.680 1 U 2.99e+07 0 e 0 0 0 0 458 31.983 1.681 3.651 1 U 2.85e+07 0 e 0 0 0 0 459 31.660 1.811 3.177 1 U 2.06e+07 0 e 0 0 0 0 460 30.985 2.054 4.139 1 U 6.53e+07 0 e 0 1553 1557 1555 461 31.020 2.053 2.196 1 U 1.47e+08 0 e 0 1553 1557 1559 462 31.003 2.051 2.049 1 U 2.43e+07 0 e 0 116 121 121 463 30.980 1.878 4.139 1 U 6.73e+07 0 e 0 1553 1556 1555 464 30.999 1.876 2.195 1 U 1.6e+08 0 e 0 1553 1556 1559 465 30.825 1.873 1.872 1 U 2.61e+07 0 e 0 0 0 0 466 30.683 1.382 -0.076 1 U 3.43e+07 0 e 0 40 45 46 467 30.645 1.379 0.495 1 U 3.74e+07 0 e 0 40 45 47 468 29.750 2.137 2.505 1 U 3.89e+07 0 e 0 571 578 576 469 29.550 2.150 2.420 1 U 3.13e+07 0 e 0 1009 1014 1016 470 29.666 2.141 4.158 1 U 3.89e+07 0 e 0 571 578 574 471 29.638 2.138 2.349 1 U 5.49e+07 0 e 0 571 578 575 472 29.690 2.142 2.142 1 U 2.76e+07 0 e 0 571 578 578 473 29.549 1.978 2.425 1 U 2.96e+07 0 e 0 1009 1013 1016 474 29.590 1.976 2.336 1 U 4.45e+07 0 e 0 1009 1013 1015 475 29.174 1.657 2.935 1 U 1.21e+08 0 e 0 1195 1203 1207 476 29.222 1.558 0.672 1 U 2.71e+07 0 e 0 104 110 111 477 29.168 1.357 2.679 1 U 2.92e+07 0 e 0 0 0 0 478 29.341 1.260 1.262 1 U 2.7e+07 0 e 0 997 1002 1002 479 29.300 1.261 0.324 1 U 4.75e+07 0 e 0 997 1002 1004 480 29.350 1.261 0.263 1 U 4.14e+07 0 e 0 997 1002 1003 481 29.005 1.636 2.975 1 U 2.9e+08 0 e 0 493 502 503 482 28.983 1.625 1.627 1 U 1.66e+08 0 e 0 493 502 502 483 29.037 1.622 1.335 1 U 6.18e+07 0 e 0 493 502 504 484 29.015 1.589 2.901 1 U 2.28e+08 0 e 0 1147 1157 1158 485 28.993 1.598 1.598 1 U 1.29e+08 0 e 0 1147 1157 1157 486 29.153 1.345 2.641 1 U 3.72e+07 0 e 0 0 0 0 487 28.270 1.882 1.883 1 U 2.51e+07 0 e 0 584 589 589 488 28.273 1.884 1.015 1 U 5.76e+07 0 e 0 584 589 591 489 28.146 2.325 2.646 1 U 5.04e+07 0 e 0 736 742 747 490 28.150 2.190 2.646 1 U 4.82e+07 0 e 0 736 741 747 491 28.189 1.883 0.829 1 U 4.77e+07 0 e 0 584 589 590 492 27.902 0.179 0.178 1 U 4.74e+07 0 e 0 18 26 26 493 27.977 0.179 -0.030 1 U 6.58e+07 0 e 0 18 26 25 494 27.962 0.517 0.623 1 U 5.39e+07 0 e 0 1453 1461 1462 495 27.875 0.517 0.517 1 U 4.02e+07 0 e 0 1453 1461 1461 496 27.727 0.124 0.708 1 U 7.62e+07 0 e 0 228 235 236 497 27.730 1.526 0.303 1 U 2.03e+07 0 e 0 1054 1060 1061 498 27.648 0.126 0.125 1 U 4.4e+07 0 e 0 228 235 235 499 27.489 1.591 0.637 1 U 7.26e+07 0 e 0 1092 1097 1098 500 27.479 1.309 0.901 1 U 4.36e+07 0 e 0 1263 1268 1270 501 27.364 1.366 0.899 1 U 4.74e+07 0 e 0 0 0 0 502 27.419 1.308 0.768 1 U 3.04e+07 0 e 0 1263 1268 1269 503 27.136 1.607 0.681 1 U 5.62e+07 0 e 0 1035 1038 1039 504 27.124 1.590 1.588 1 U 1.29e+08 0 e 0 0 0 0 505 27.120 1.589 0.858 1 U 8.44e+07 0 e 0 1035 1038 1040 506 27.161 1.578 1.574 1 U 1.39e+08 0 e 0 0 0 0 507 27.112 1.584 0.895 1 U 1.11e+08 0 e 0 0 0 0 508 27.155 1.566 1.566 1 U 1.48e+08 0 e 0 0 0 0 509 27.201 1.560 4.171 1 U 3.44e+07 0 e 0 0 0 0 510 27.135 1.554 0.882 1 U 1.03e+08 0 e 0 0 0 0 511 27.179 1.134 0.822 1 U 5.68e+07 0 e 0 0 0 0 512 27.209 0.885 0.831 1 U -6.23e+07 0 e 0 0 0 0 513 27.198 0.637 1.589 1 U 3.03e+07 0 e 0 1090 1098 1097 514 27.135 0.637 0.687 1 U 1.37e+08 0 e 0 1090 1098 1099 515 26.975 1.579 3.170 1 U 4.4e+07 0 e 0 0 0 0 516 27.065 1.557 3.149 1 U 4.9e+07 0 e 0 0 0 0 517 27.085 1.546 0.831 1 U 1.07e+08 0 e 0 0 0 0 518 27.044 1.456 0.830 1 U 1.56e+08 0 e 0 0 0 0 519 27.018 1.452 0.755 1 U 1.15e+08 0 e 0 0 0 0 520 26.948 1.405 1.407 1 U 4.11e+07 0 e 0 0 0 0 521 27.078 0.637 0.636 1 U 9.4e+07 0 e 0 1090 1098 1098 522 26.782 1.958 0.887 1 U 2.01e+07 0 e 0 844 849 850 523 26.720 1.656 0.780 1 U 2.32e+07 0 e 0 276 281 282 524 26.765 1.646 0.711 1 U 2.67e+07 0 e 0 1221 1224 1225 525 26.890 1.489 3.043 1 U 2.65e+07 0 e 0 0 0 0 526 26.786 1.381 0.585 1 U 3.87e+07 0 e 0 956 961 963 527 26.738 0.683 1.622 1 U 2.95e+07 0 e 0 1033 1039 1038 528 26.780 0.682 0.862 1 U 9.21e+07 0 e 0 1033 1039 1040 529 26.537 1.755 0.645 1 U 2.26e+07 0 e 0 761 766 768 530 26.647 1.671 1.667 1 U 1.22e+08 0 e 0 0 0 0 531 26.618 1.673 0.933 1 U 1.67e+08 0 e 0 1545 1549 1551 532 26.637 1.673 0.918 1 U 1.9e+08 0 e 0 1545 1549 1550 533 26.686 1.654 0.626 1 U 2.71e+07 0 e 0 1455 1460 1462 534 26.680 1.381 0.473 1 U 2.25e+07 0 e 0 956 961 962 535 26.654 1.121 0.666 1 U 5.43e+07 0 e 0 317 323 324 536 26.642 1.121 0.628 1 U 2.61e+07 0 e 0 317 323 325 537 26.656 0.902 1.310 1 U 2.35e+07 0 e 0 1262 1270 1268 538 26.542 0.903 0.769 1 U 1.33e+08 0 e 0 1262 1270 1269 539 26.490 1.754 0.541 1 U 3.13e+07 0 e 0 761 766 767 540 26.430 1.674 3.943 1 U 5.08e+07 0 e 0 0 0 0 541 26.360 1.661 0.517 1 U 2.56e+07 0 e 0 1455 1460 1461 542 26.418 1.455 1.679 1 U 2.5e+07 0 e 0 0 0 0 543 26.481 1.204 0.717 1 U 6.93e+07 0 e 0 650 656 657 544 26.451 0.922 0.795 1 U 7.65e+07 0 e 0 275 283 282 545 26.474 0.909 0.718 1 U 7.6e+07 0 e 0 650 655 657 546 26.191 -0.075 1.381 1 U 2.98e+07 0 e 0 38 46 45 547 26.191 -0.075 -0.076 1 U 9.46e+07 0 e 0 38 46 46 548 26.203 -0.076 0.494 1 U 7.98e+07 0 e 0 38 46 47 549 26.259 1.408 0.361 1 U 2.35e+07 0 e 0 553 558 560 550 26.163 1.014 1.885 1 U 4.13e+07 0 e 0 583 591 589 551 26.147 1.014 1.013 1 U 1.58e+08 0 e 0 583 591 591 552 26.136 1.421 0.629 1 U 2.59e+07 0 e 0 664 670 671 553 26.101 1.016 0.829 1 U 1.52e+08 0 e 0 583 591 590 554 26.052 1.008 0.630 1 U 2.53e+07 0 e 0 664 669 671 555 26.049 0.899 1.372 1 U 2.11e+07 0 e 0 0 0 0 556 25.823 1.003 1.002 1 U 1.55e+08 0 e 0 0 0 0 557 25.794 0.769 1.426 1 U 2.47e+07 0 e 0 431 439 437 558 25.785 0.765 0.720 1 U 1.07e+08 0 e 0 431 439 438 559 25.919 0.716 0.775 1 U 8.12e+07 0 e 0 1219 1225 1226 560 25.847 0.716 0.712 1 U 6.55e+07 0 e 0 1219 1225 1225 561 25.692 1.556 2.947 1 U 2.32e+07 0 e 0 1412 1419 1422 562 25.660 1.000 1.957 1 U 3.71e+07 0 e 0 843 851 849 563 25.704 0.774 1.407 1 U 2.31e+07 0 e 0 0 0 0 564 25.623 0.777 0.775 1 U 9.58e+07 0 e 0 0 0 0 565 25.592 0.780 0.599 1 U 5.73e+07 0 e 0 0 0 0 566 25.391 0.363 0.361 1 U 5.02e+07 0 e 0 552 560 560 567 25.537 0.264 1.262 1 U 4.66e+07 0 e 0 995 1003 1002 568 25.505 0.264 0.324 1 U 1.02e+08 0 e 0 995 1003 1004 569 25.555 0.264 0.263 1 U 1.19e+08 0 e 0 995 1003 1003 570 25.468 3.486 4.064 1 U 3.8e+07 0 e 0 0 0 0 571 25.473 0.544 0.644 1 U 9.27e+07 0 e 0 759 767 768 572 25.381 0.363 0.154 1 U 7.01e+07 0 e 0 552 560 559 573 25.348 0.998 0.886 1 U 1.2e+08 0 e 0 843 851 850 574 25.317 0.545 0.542 1 U 7.49e+07 0 e 0 759 767 767 575 25.230 0.497 1.382 1 U 3.04e+07 0 e 0 39 47 45 576 25.303 0.496 0.495 1 U 1.05e+08 0 e 0 39 47 47 577 25.356 0.498 -0.077 1 U 8.52e+07 0 e 0 39 47 46 578 25.140 1.048 1.046 1 U 2.47e+07 0 e 0 0 0 0 579 25.021 0.584 0.472 1 U 8.47e+07 0 e 0 955 963 962 580 24.908 0.897 1.588 1 U 1.12e+08 0 e 0 0 0 0 581 24.975 0.893 0.889 1 U 3.68e+08 0 e 0 0 0 0 582 24.831 0.887 0.487 1 U 4.92e+07 0 e 0 1482 1490 1489 583 24.998 0.881 1.554 1 U 1.44e+08 0 e 0 0 0 0 584 24.848 0.690 1.589 1 U 4.13e+07 0 e 0 1091 1099 1097 585 24.885 0.689 0.689 1 U 1.43e+08 0 e 0 1091 1099 1099 586 25.004 0.589 1.384 1 U 3.09e+07 0 e 0 955 963 961 587 24.980 0.591 0.588 1 U 1.08e+08 0 e 0 0 0 0 588 24.668 1.367 2.901 1 U 6.69e+07 0 e 0 1149 1155 1158 589 24.702 1.350 2.930 1 U 5.12e+07 0 e 0 1197 1205 1207 590 24.770 1.331 4.024 1 U 2.31e+07 0 e 0 495 504 497 591 24.774 1.337 2.977 1 U 9.74e+07 0 e 0 495 504 503 592 24.750 1.338 1.623 1 U 7.85e+07 0 e 0 495 504 502 593 24.709 1.338 1.334 1 U 6.41e+07 0 e 0 495 504 504 594 24.679 1.324 2.899 1 U 7.71e+07 0 e 0 1149 1154 1158 595 24.721 1.222 2.933 1 U 4.24e+07 0 e 0 1197 1204 1207 596 24.786 0.976 0.977 1 U 5.36e+07 0 e 0 0 0 0 597 24.765 0.832 1.457 1 U 7.6e+07 0 e 0 0 0 0 598 24.779 0.831 1.353 1 U 2.11e+07 0 e 0 0 0 0 599 24.692 0.830 0.755 1 U 2.31e+08 0 e 0 0 0 0 600 24.818 0.688 0.636 1 U 1.22e+08 0 e 0 1091 1099 1098 601 24.762 0.600 0.780 1 U 4.22e+07 0 e 0 0 0 0 602 24.523 0.636 1.603 1 U 2.77e+07 0 e 0 1454 1462 1459 603 24.266 0.325 1.262 1 U 4.8e+07 0 e 0 996 1004 1002 604 24.269 0.325 0.324 1 U 1.35e+08 0 e 0 996 1004 1004 605 24.289 0.325 0.263 1 U 1.12e+08 0 e 0 996 1004 1003 606 24.327 1.149 5.159 1 U 4.7e+07 0 e 0 30 33 32 607 24.369 0.626 1.655 1 U 2.13e+07 0 e 0 1454 1462 1460 608 24.313 0.622 0.518 1 U 6.15e+07 0 e 0 1454 1462 1461 609 24.424 0.481 1.381 1 U 2.4e+07 0 e 0 954 962 961 610 24.147 0.932 3.943 1 U 5.11e+07 0 e 0 1544 1551 1546 611 24.113 0.925 1.666 1 U 1.71e+08 0 e 0 1544 1551 1549 612 24.190 0.924 0.916 1 U 5.89e+08 0 e 0 0 0 0 613 24.186 0.531 0.596 1 U 2.18e+07 0 e 0 0 0 0 614 24.076 0.474 0.473 1 U 7.08e+07 0 e 0 954 962 962 615 23.920 1.164 5.207 1 U 2.14e+07 0 e 0 0 0 0 616 23.979 0.768 1.307 1 U 2.93e+07 0 e 0 1261 1269 1268 617 24.009 0.769 0.901 1 U 8.51e+07 0 e 0 1261 1269 1270 618 23.917 0.473 0.583 1 U 6.91e+07 0 e 0 954 962 963 619 72.061 4.048 5.236 1 U 6.39e+07 0 e 0 1393 1397 1396 620 23.842 1.144 1.144 1 U 8.83e+07 0 e 0 0 0 0 621 71.759 4.061 4.063 1 U 4.52e+07 0 e 0 1393 1397 1397 622 23.485 1.140 2.322 1 U 2.07e+07 0 e 0 242 247 245 623 23.461 1.138 0.584 1 U 4.43e+07 0 e 0 242 247 246 624 23.353 0.832 0.831 1 U 6.23e+08 0 e 0 582 590 590 625 23.379 0.756 1.457 1 U 6.98e+07 0 e 0 0 0 0 626 23.374 0.758 0.829 1 U 2.13e+08 0 e 0 0 0 0 627 23.486 0.756 0.756 1 U 2.69e+08 0 e 0 0 0 0 628 23.282 4.063 3.489 1 U 2.16e+07 0 e 0 0 0 0 629 23.217 1.269 1.268 1 U 1.27e+08 0 e 0 0 0 0 630 23.173 0.859 0.859 1 U 4.09e+08 0 e 0 129 133 133 631 23.188 0.645 1.755 1 U 2.17e+07 0 e 0 760 768 766 632 23.187 0.645 0.541 1 U 7.19e+07 0 e 0 760 768 767 633 22.993 0.709 0.125 1 U 5.56e+07 0 e 0 229 236 235 634 23.121 0.654 0.644 1 U 1.54e+08 0 e 0 760 768 768 635 22.795 0.886 0.997 1 U 8.41e+07 0 e 0 842 850 851 636 22.797 0.666 1.606 1 U 2.19e+07 0 e 0 60 68 67 637 70.952 4.263 4.466 1 U 2.36e+07 0 e 0 1384 1388 1387 638 22.558 1.193 4.334 1 U 2.96e+07 0 e 0 1358 1362 1361 639 22.593 1.195 3.968 1 U 2.13e+07 0 e 0 1358 1362 1360 640 22.566 0.885 0.886 1 U 2.61e+08 0 e 0 842 850 850 641 22.710 0.861 0.681 1 U 9.46e+07 0 e 0 1034 1040 1039 642 22.704 0.840 1.369 1 U 2.03e+07 0 e 0 0 0 0 643 22.696 0.715 0.714 1 U 1.61e+08 0 e 0 0 0 0 644 22.463 0.156 0.361 1 U 5.63e+07 0 e 0 551 559 560 645 22.475 0.156 0.154 1 U 9.18e+07 0 e 0 551 559 559 646 22.375 4.203 4.125 1 U 4.17e+07 0 e 0 0 0 0 647 22.460 1.193 1.193 1 U 2.88e+08 0 e 0 1358 1362 1362 648 22.482 0.944 4.483 1 U 3.1e+07 0 e 0 1402 1405 1404 649 22.404 0.798 0.797 1 U 1.39e+08 0 e 0 274 282 282 650 22.398 0.504 1.617 1 U 2.9e+07 0 e 0 788 793 792 651 22.447 0.504 0.593 1 U 6.95e+07 0 e 0 788 793 794 652 22.381 0.503 0.502 1 U 9.86e+07 0 e 0 788 793 793 653 22.233 4.018 3.525 1 U 2.05e+07 0 e 0 0 0 0 654 22.245 0.888 2.079 1 U 5.51e+07 0 e 0 1172 1177 1175 655 22.308 0.799 0.926 1 U 5.57e+07 0 e 0 274 282 283 656 22.054 0.180 0.632 1 U 3.76e+07 0 e 0 169 174 175 657 22.084 0.180 0.178 1 U 7.35e+07 0 e 0 169 174 174 658 22.073 0.786 1.661 1 U 3.46e+07 0 e 0 0 0 0 659 21.914 1.180 1.180 1 U 2.2e+08 0 e 0 0 0 0 660 21.805 0.778 0.713 1 U 8.05e+07 0 e 0 1220 1226 1225 661 21.860 0.594 1.618 1 U 2.79e+07 0 e 0 789 794 792 662 21.802 0.594 0.505 1 U 7.37e+07 0 e 0 789 794 793 663 21.897 0.486 0.886 1 U 3.41e+07 0 e 0 1481 1489 1490 664 69.974 4.835 4.335 1 U 3.46e+07 0 e 0 985 989 988 665 21.656 3.850 3.852 1 U 2.1e+07 0 e 0 0 0 0 666 21.620 1.141 1.141 1 U 4.79e+08 0 e 0 0 0 0 667 21.500 4.204 4.327 1 U 2.72e+07 0 e 0 0 0 0 668 21.517 1.248 1.246 1 U 2.52e+08 0 e 0 0 0 0 669 21.450 1.236 1.236 1 U 2.54e+08 0 e 0 1334 1338 1338 670 21.465 1.142 4.263 1 U 2e+07 0 e 0 1385 1389 1388 671 21.493 1.141 4.051 1 U 3.59e+07 0 e 0 1394 1398 1397 672 21.506 0.942 0.821 1 U 4.1e+07 0 e 0 139 144 143 673 21.563 0.593 0.592 1 U 9.96e+07 0 e 0 789 794 794 674 21.414 4.196 4.298 1 U 2.37e+07 0 e 0 0 0 0 675 21.386 4.182 4.233 1 U 4.08e+07 0 e 0 0 0 0 676 21.348 1.232 4.055 1 U 2.46e+07 0 e 0 1334 1338 1337 677 21.278 0.963 0.963 1 U 1.05e+08 0 e 0 0 0 0 678 21.320 0.930 2.073 1 U 3.13e+07 0 e 0 139 144 142 679 20.882 0.929 0.930 1 U 1.79e+08 0 e 0 0 0 0 680 20.915 0.633 0.179 1 U 4.02e+07 0 e 0 170 175 174 681 20.833 0.907 0.907 1 U 1.79e+08 0 e 0 0 0 0 682 20.853 0.633 0.632 1 U 3.54e+07 0 e 0 170 175 175 683 68.697 4.331 1.194 1 U 2.16e+07 0 e 0 1357 1361 1362 684 20.380 0.586 1.139 1 U 4.3e+07 0 e 0 241 246 247 685 68.595 4.332 3.968 1 U 8.43e+07 0 e 0 1357 1361 1360 686 20.156 1.292 4.084 1 U 9.92e+07 0 e 0 0 0 0 687 20.055 1.459 3.804 1 U 5.4e+07 0 e 0 187 190 189 688 19.983 1.310 4.114 1 U 5.39e+07 0 e 0 0 0 0 689 20.091 0.856 0.856 1 U 2.49e+08 0 e 0 0 0 0 690 19.858 1.494 1.492 1 U 2.5e+08 0 e 0 1274 1277 1277 691 19.649 1.502 4.361 1 U 2.2e+07 0 e 0 1274 1277 1276 692 19.633 1.144 3.623 1 U 2.92e+07 0 e 0 0 0 0 693 19.624 1.144 1.144 1 U 4.33e+08 0 e 0 0 0 0 694 19.631 0.844 2.077 1 U 5.79e+07 0 e 0 1171 1176 1175 695 19.706 0.850 0.884 1 U 1.19e+08 0 e 0 1171 1176 1177 696 19.518 1.474 3.994 1 U 8.45e+07 0 e 0 485 488 487 697 19.470 1.365 1.366 1 U 9.47e+07 0 e 0 0 0 0 698 19.410 1.353 1.352 1 U 8.41e+07 0 e 0 0 0 0 699 19.341 1.364 4.349 1 U 2.6e+07 0 e 0 0 0 0 700 19.236 1.361 4.315 1 U 2.87e+07 0 e 0 0 0 0 701 19.221 1.352 4.295 1 U 2.75e+07 0 e 0 0 0 0 702 19.307 0.820 0.941 1 U 2.95e+07 0 e 0 138 143 144 703 19.098 1.437 3.748 1 U 2.1e+07 0 e 0 0 0 0 704 18.656 1.513 1.512 1 U 1.78e+08 0 e 0 710 713 713 705 18.694 1.447 1.447 1 U 1.88e+08 0 e 0 923 926 926 706 18.416 1.666 4.093 1 U 7.55e+07 0 e 0 543 546 545 707 18.498 1.592 1.592 1 U 7.09e+07 0 e 0 0 0 0 708 18.476 1.514 4.142 1 U 9.91e+07 0 e 0 710 713 712 709 18.484 1.448 3.959 1 U 7.52e+07 0 e 0 923 926 925 710 18.575 1.245 4.206 1 U 9.94e+07 0 e 0 1127 1130 1129 711 66.679 3.769 5.695 1 U 5.44e+07 0 e 0 1312 1318 1314 712 18.386 1.302 4.140 1 U 9.24e+07 0 e 0 695 698 697 713 18.256 0.853 1.619 1 U 5.74e+07 0 e 0 651 658 654 714 18.220 0.853 0.852 1 U 2.85e+08 0 e 0 651 658 658 715 18.108 1.661 4.071 1 U 8.34e+07 0 e 0 564 567 566 716 18.155 1.556 1.554 1 U 2.47e+07 0 e 0 0 0 0 717 18.117 1.412 4.003 1 U 9.82e+07 0 e 0 444 447 446 718 18.141 1.412 1.411 1 U 1.54e+08 0 e 0 444 447 447 719 18.191 0.853 0.719 1 U 2.33e+07 0 e 0 651 658 657 720 18.030 0.627 1.417 1 U 3.9e+07 0 e 0 318 325 321 721 18.035 0.624 0.623 1 U 2.88e+08 0 e 0 105 112 112 722 17.844 1.067 1.067 1 U 1.28e+08 0 e 0 688 691 691 723 18.019 0.626 4.023 1 U 2.65e+07 0 e 0 318 325 320 724 17.981 0.618 1.620 1 U 3e+07 0 e 0 105 112 108 725 18.019 0.624 0.658 1 U 3.19e+07 0 e 0 318 325 324 726 17.832 1.254 4.263 1 U 6.69e+07 0 e 0 536 539 538 727 17.832 1.067 3.401 1 U 7.09e+07 0 e 0 688 691 690 728 65.967 3.905 5.413 1 U 2.38e+07 0 e 0 1081 1085 1083 729 65.908 3.717 5.414 1 U 2.05e+07 0 e 0 1081 1084 1083 730 17.553 0.878 0.875 1 U 1.05e+08 0 e 0 0 0 0 731 17.474 0.859 1.829 1 U 3.13e+07 0 e 0 0 0 0 732 17.422 3.798 4.064 1 U 2.28e+07 0 e 0 0 0 0 733 17.430 0.867 4.171 1 U 2.14e+07 0 e 0 0 0 0 734 17.228 0.996 0.996 1 U 2e+07 0 e 0 332 339 339 735 17.258 0.749 0.749 1 U 2.57e+07 0 e 0 0 0 0 736 17.147 0.706 0.705 1 U 2.06e+08 0 e 0 1055 1062 1062 737 16.893 2.077 2.078 1 U 3.4e+07 0 e 0 0 0 0 738 16.895 1.818 1.819 1 U 4.55e+08 0 e 0 0 0 0 739 16.920 0.923 2.171 1 U 2.34e+07 0 e 0 665 672 668 740 16.948 0.922 0.921 1 U 1.07e+08 0 e 0 665 672 672 741 17.010 0.700 1.617 1 U 2.48e+07 0 e 0 1055 1062 1058 742 16.771 3.742 3.739 1 U 2.28e+07 0 e 0 0 0 0 743 16.857 0.923 5.340 1 U 2.13e+07 0 e 0 665 672 667 744 64.788 4.051 4.052 1 U 3.37e+07 0 e 0 525 529 529 745 16.509 3.814 4.232 1 U 1.62e+08 0 e 0 0 0 0 746 64.617 3.965 4.335 1 U 7.46e+07 0 e 0 1356 1360 1361 747 64.602 3.965 1.194 1 U 5.18e+07 0 e 0 1356 1360 1362 748 16.279 3.864 3.872 1 U 8.2e+07 0 e 0 0 0 0 749 16.012 4.134 4.080 1 U 2.26e+07 0 e 0 0 0 0 750 64.122 4.103 4.364 1 U 2.68e+07 0 e 0 603 606 605 751 15.813 3.818 4.474 1 U 4.22e+07 0 e 0 0 0 0 752 15.703 6.135 3.685 1 U 2.46e+07 0 e 0 0 0 0 753 15.712 6.135 1.139 1 U 2.04e+07 0 e 0 0 0 0 754 15.696 4.699 3.686 1 U 2.2e+07 0 e 0 0 0 0 755 64.104 4.217 4.364 1 U 2.85e+07 0 e 0 603 607 605 756 15.472 4.124 4.209 1 U 3e+07 0 e 0 0 0 0 757 15.472 4.022 4.025 1 U 4e+07 0 e 0 0 0 0 758 15.472 3.797 4.394 1 U 3.37e+07 0 e 0 0 0 0 759 15.472 3.730 4.360 1 U 2.16e+07 0 e 0 0 0 0 760 15.472 3.682 3.684 1 U 3.29e+08 0 e 0 0 0 0 761 63.832 3.587 3.983 1 U 3.58e+07 0 e 0 179 183 181 762 63.832 3.487 3.982 1 U 3.41e+07 0 e 0 179 182 181 763 15.691 0.432 3.684 1 U 3.22e+07 0 e 0 0 0 0 764 15.718 0.432 1.140 1 U 2.45e+07 0 e 0 0 0 0 765 15.472 3.812 3.816 1 U 2.24e+07 0 e 0 0 0 0 766 59.269 5.197 0.864 1 U 1.18e+07 0 e 0 127 131 133 767 59.225 5.196 5.195 1 U 4.8e+06 0 e 0 127 131 131 768 59.232 5.188 4.348 1 U 1.33e+07 0 e 0 127 131 132 769 23.173 0.859 0.859 1 U 4.09e+08 0 e 0 0 0 0 770 23.173 0.859 0.859 1 U 4.09e+08 0 e 0 0 0 0 771 43.032 1.553 0.832 1 U 7.54e+07 0 e 0 0 0 0 772 43.220 1.555 0.876 1 U 7.92e+07 0 e 0 0 0 0 773 43.643 1.922 -0.025 1 U 5.75e+06 0 e 0 16 23 25 774 22.061 -0.027 1.514 1 U 1.86e+07 0 e 0 17 25 24 775 55.580 4.990 -0.030 1 U 3.08e+06 0 e 0 15 21 25 776 55.532 4.981 0.179 1 U 3.69e+06 0 e 0 15 21 26 777 43.654 1.916 0.183 1 U 3.81e+06 0 e 0 16 23 26 778 56.262 4.953 4.963 1 U 8.27e+06 0 e 0 0 0 0 779 43.615 1.914 4.991 1 U 3.26e+06 0 e 0 16 23 21 780 55.455 4.992 0.778 1 U 8.62e+06 0 e 0 15 21 22 781 55.352 4.983 1.909 1 U 8.18e+06 0 e 0 15 21 23 782 55.502 4.981 4.999 1 U 6.07e+06 0 e 0 15 21 21 783 43.469 1.932 1.916 1 U 4.38e+06 0 e 0 953 960 960 784 43.679 0.783 5.002 1 U 4.19e+06 0 e 0 16 22 21 785 43.759 0.788 -0.031 1 U 5.36e+06 0 e 0 16 22 25 786 43.601 0.788 0.178 1 U 5.79e+06 0 e 0 16 22 26 787 43.761 0.768 0.767 1 U 2.84e+06 0 e 0 16 22 22 788 43.679 0.281 0.722 1 U 0 0 e 0 0 0 0 789 43.679 0.294 0.713 1 U 0 0 e 0 0 0 0 790 43.608 0.786 1.912 1 U 2.62e+06 0 e 0 16 22 23 791 43.679 0.299 1.925 1 U 0 0 e 0 0 0 0 792 43.679 0.156 1.547 1 U 0 0 e 0 0 0 0 793 22.028 -0.028 0.178 1 U 4.75e+07 0 e 0 17 25 26 794 22.065 -0.028 -0.030 1 U 7.23e+07 0 e 0 17 25 25 795 21.965 -0.029 0.774 1 U 4.61e+06 0 e 0 17 25 22 796 22.063 -0.026 1.916 1 U 3.32e+06 0 e 0 17 25 23 797 27.839 0.176 0.782 1 U 5.74e+06 0 e 0 18 26 22 798 27.871 0.176 1.917 1 U 5.71e+06 0 e 0 18 26 23 799 27.934 0.182 4.987 1 U 2.51e+06 0 e 0 18 26 21 800 26.894 1.460 1.459 1 U 1.07e+08 0 e 0 0 0 0 801 26.193 1.514 -0.029 1 U 1.69e+07 0 e 0 19 24 25 802 26.086 1.520 0.177 1 U 1.96e+07 0 e 0 19 24 26 803 27.867 0.179 1.514 1 U 1.76e+07 0 e 0 18 26 24 804 55.147 4.991 1.511 1 U 3.91e+06 0 e 0 15 21 24 805 50.358 5.151 5.158 1 U 1.28e+07 0 e 0 29 32 32 806 55.563 4.648 -0.075 1 U 6.99e+06 0 e 0 36 42 46 807 55.546 4.640 0.494 1 U 6.91e+06 0 e 0 36 42 47 808 25.453 0.496 1.279 1 U 8.38e+06 0 e 0 39 47 44 809 44.963 1.278 -0.075 1 U 8.55e+06 0 e 0 37 44 46 810 44.932 0.894 -0.075 1 U 7.8e+06 0 e 0 37 43 46 811 44.894 0.891 0.495 1 U 7.33e+06 0 e 0 37 43 47 812 44.925 1.270 0.494 1 U 7.49e+06 0 e 0 37 44 47 813 55.598 4.644 1.279 1 U 1.23e+07 0 e 0 36 42 44 814 55.300 4.647 0.898 1 U 2.26e+07 0 e 0 1111 1117 1122 815 25.246 0.498 0.892 1 U 6.81e+06 0 e 0 39 47 43 816 26.250 -0.070 0.896 1 U 6.56e+06 0 e 0 38 46 43 817 26.236 -0.074 1.289 1 U 8.76e+06 0 e 0 38 46 44 818 55.434 4.645 1.377 1 U 1.52e+07 0 e 0 36 42 45 819 30.505 1.381 1.384 1 U 1.81e+07 0 e 0 40 45 45 820 52.120 4.621 2.176 1 U 1.62e+07 0 e 0 50 53 54 821 22.722 0.666 2.597 1 U 5.59e+06 0 e 0 60 68 66 822 47.746 4.110 4.117 1 U 1.04e+07 0 e 0 81 84 84 823 47.693 3.658 4.123 1 U 9.77e+06 0 e 0 81 83 84 824 47.682 4.120 3.664 1 U 7.58e+06 0 e 0 81 84 83 825 43.287 4.505 4.500 1 U 2.98e+06 0 e 0 95 98 98 826 43.291 4.510 3.407 1 U 8.85e+06 0 e 0 95 98 97 827 43.240 3.421 4.502 1 U 3.23e+06 0 e 0 95 97 98 828 43.272 3.418 3.424 1 U 9.54e+06 0 e 0 95 97 97 829 63.293 3.992 0.306 1 U 3.75e+06 0 e 0 1051 1057 1061 830 63.207 3.994 1.612 1 U 1.02e+07 0 e 0 1051 1057 1058 831 63.112 3.998 1.527 1 U 4.04e+06 0 e 0 1051 1057 1060 832 63.154 3.812 0.669 1 U 5.98e+06 0 e 0 101 107 111 833 62.959 3.811 1.552 1 U 3.59e+06 0 e 0 101 107 110 834 63.227 3.815 1.620 1 U 1.31e+07 0 e 0 101 107 108 835 63.158 4.117 1.128 1 U 1.48e+07 0 e 0 0 0 0 836 38.299 1.618 0.302 1 U 1.39e+07 0 e 0 1052 1058 1061 837 37.343 1.617 3.816 1 U 9.86e+06 0 e 0 102 108 107 838 17.981 0.618 1.620 1 U 3e+07 0 e 0 0 0 0 839 17.969 0.618 3.819 1 U 1.43e+07 0 e 0 105 112 107 840 17.950 0.626 1.120 1 U 1.04e+07 0 e 0 318 325 323 841 37.464 1.619 1.617 1 U 1.68e+07 0 e 0 102 108 108 842 23.099 0.858 5.211 1 U 7.29e+06 0 e 0 129 133 131 843 23.249 0.859 4.350 1 U 1.42e+07 0 e 0 129 133 132 844 72.915 4.348 0.862 1 U 9.79e+06 0 e 0 128 132 133 845 72.885 4.345 5.201 1 U 1.57e+07 0 e 0 128 132 131 846 59.565 4.549 4.546 1 U 6.25e+06 0 e 0 136 141 141 847 59.734 4.550 2.074 1 U 1e+07 0 e 0 136 141 142 848 59.632 4.545 0.941 1 U 1.23e+07 0 e 0 136 141 144 849 59.664 4.547 0.820 1 U 1.35e+07 0 e 0 136 141 143 850 41.310 2.288 4.020 1 U 1.79e+07 0 e 0 194 197 196 851 52.776 5.072 3.298 1 U 1.71e+07 0 e 0 201 204 206 852 52.788 5.070 2.294 1 U 1.62e+07 0 e 0 201 204 205 853 43.100 3.288 5.072 1 U 8.26e+06 0 e 0 202 206 204 854 43.090 2.293 5.079 1 U 1.04e+07 0 e 0 202 205 204 855 44.979 3.333 4.261 1 U 9.7e+06 0 e 0 458 460 461 856 45.140 4.259 3.339 1 U 8.74e+06 0 e 0 458 461 460 857 45.443 3.313 3.975 1 U 1.32e+07 0 e 0 308 310 311 858 45.536 3.974 3.315 1 U 9.44e+06 0 e 0 308 311 310 859 45.258 3.325 3.324 1 U 2.13e+07 0 e 0 0 0 0 860 45.639 4.813 3.102 1 U 8.26e+06 0 e 0 209 212 211 861 45.237 4.539 4.231 1 U 1.06e+07 0 e 0 1305 1308 1307 862 45.718 3.084 3.108 1 U 9.51e+06 0 e 0 209 211 211 863 54.933 4.642 0.543 1 U 8.27e+06 0 e 0 757 763 767 864 54.935 4.643 0.643 1 U 5.41e+06 0 e 0 757 763 768 865 59.643 4.786 1.618 1 U 2.78e+07 0 e 0 0 0 0 866 59.615 4.785 0.719 1 U 1.08e+07 0 e 0 647 653 657 867 59.593 4.787 1.196 1 U 7.89e+06 0 e 0 647 653 656 868 59.598 4.788 0.905 1 U 6.94e+06 0 e 0 647 653 655 869 23.448 1.139 5.597 1 U 1.59e+07 0 e 0 242 247 244 870 36.363 2.328 5.601 1 U 8.54e+06 0 e 0 240 245 244 871 59.315 5.593 2.326 1 U 9.8e+06 0 e 0 239 244 245 872 59.344 5.594 1.139 1 U 1.78e+07 0 e 0 239 244 247 873 59.358 5.591 0.584 1 U 1.68e+07 0 e 0 239 244 246 874 20.350 0.587 5.598 1 U 1.38e+07 0 e 0 241 246 244 875 20.376 0.585 2.323 1 U 1.86e+07 0 e 0 241 246 245 876 39.312 2.769 3.865 1 U 1.62e+07 0 e 0 0 0 0 877 39.295 2.640 3.865 1 U 1.54e+07 0 e 0 0 0 0 878 56.815 4.036 0.361 1 U 9.49e+06 0 e 0 549 555 560 879 56.852 4.030 0.156 1 U 5.68e+06 0 e 0 549 555 559 880 56.866 4.035 1.012 1 U 1.11e+07 0 e 0 549 555 556 881 56.305 4.156 0.830 1 U 3.17e+07 0 e 0 0 0 0 882 51.638 4.804 2.789 1 U 1.98e+07 0 e 0 286 289 290 883 51.626 4.864 2.739 1 U 2e+07 0 e 0 854 858 859 884 52.204 5.352 2.336 1 U 1.39e+07 0 e 0 1240 1243 1244 885 52.186 5.345 2.876 1 U 1.1e+07 0 e 0 1240 1243 1245 886 51.670 4.310 3.105 1 U 1.96e+07 0 e 0 675 679 681 887 51.674 4.308 2.636 1 U 1.78e+07 0 e 0 675 679 680 888 47.357 3.845 3.735 1 U 7.77e+06 0 e 0 294 297 296 889 47.480 3.730 3.861 1 U 9.15e+06 0 e 0 294 296 297 890 53.743 4.526 0.763 1 U 9.45e+06 0 e 0 428 434 439 891 53.790 4.529 0.721 1 U 8.46e+06 0 e 0 428 434 438 892 53.633 5.102 0.472 1 U 6.07e+06 0 e 0 952 958 962 893 53.543 5.102 0.586 1 U 9.84e+06 0 e 0 952 958 963 894 53.581 5.098 0.903 1 U 1.06e+07 0 e 0 952 958 959 895 53.597 5.100 1.924 1 U 1.49e+07 0 e 0 952 958 960 896 53.624 5.101 1.378 1 U 6.82e+06 0 e 0 952 958 961 897 43.596 1.927 5.109 1 U 1.02e+07 0 e 0 953 960 958 898 43.688 1.937 0.584 1 U 8.29e+06 0 e 0 953 960 963 899 43.796 1.925 0.476 1 U 5.49e+06 0 e 0 953 960 962 900 58.401 4.022 0.659 1 U 1.08e+07 0 e 0 314 320 324 901 58.414 4.019 1.122 1 U 5.64e+06 0 e 0 314 320 323 902 58.511 4.160 2.505 1 U 1.91e+07 0 e 0 570 574 576 903 39.690 2.544 4.410 1 U 1.66e+07 0 e 0 451 454 453 904 39.671 3.022 4.410 1 U 1.54e+07 0 e 0 451 455 453 905 57.958 4.282 3.938 1 U 1.95e+07 0 e 0 464 467 469 906 58.004 4.282 3.770 1 U 1.61e+07 0 e 0 464 467 468 907 64.305 3.931 4.288 1 U 1.55e+07 0 e 0 465 469 467 908 58.404 4.757 2.693 1 U 1.54e+07 0 e 0 472 477 478 909 58.460 4.754 3.030 1 U 1.38e+07 0 e 0 472 477 479 910 24.863 1.217 1.346 1 U 8.68e+06 0 e 0 1197 1204 1205 911 24.625 1.346 1.220 1 U 8.46e+06 0 e 0 1197 1205 1204 912 24.706 1.223 1.599 1 U 1.93e+07 0 e 0 1197 1204 1200 913 24.690 1.221 1.803 1 U 6.08e+06 0 e 0 1197 1204 1201 914 24.641 1.358 1.787 1 U 1.42e+07 0 e 0 1197 1205 1201 915 29.064 1.632 4.028 1 U 5.75e+06 0 e 0 493 502 497 916 53.698 4.614 3.537 1 U 1.05e+07 0 e 0 506 511 513 917 53.689 4.615 3.442 1 U 1.16e+07 0 e 0 506 511 512 918 31.150 3.541 3.448 1 U 3.21e+06 0 e 0 507 513 512 919 31.233 3.445 3.439 1 U 2.51e+06 0 e 0 507 512 512 920 31.245 3.512 3.538 1 U 3.37e+06 0 e 0 507 513 513 921 31.510 3.447 3.527 1 U 2.86e+06 0 e 0 507 512 513 922 47.438 3.550 3.560 1 U 1.16e+07 0 e 0 518 523 523 923 18.242 1.663 1.663 1 U 2.05e+08 0 e 0 0 0 0 924 41.861 1.621 0.361 1 U 5.17e+06 0 e 0 550 557 560 925 41.952 1.009 0.155 1 U 5.69e+06 0 e 0 550 556 559 926 41.885 0.995 0.362 1 U 4.81e+06 0 e 0 550 556 560 927 41.895 1.009 4.037 1 U 1.13e+07 0 e 0 550 556 555 928 41.637 1.618 4.039 1 U 7.72e+06 0 e 0 550 557 555 929 22.499 0.156 1.409 1 U 1.89e+07 0 e 0 551 559 558 930 25.411 0.363 1.412 1 U 1.55e+07 0 e 0 552 560 558 931 25.423 0.365 1.020 1 U 4.99e+06 0 e 0 552 560 556 932 22.517 0.154 1.021 1 U 4.45e+06 0 e 0 551 559 556 933 22.559 0.157 1.624 1 U 4.56e+06 0 e 0 551 559 557 934 41.863 1.612 0.154 1 U 5.64e+06 0 e 0 550 557 559 935 25.328 0.364 1.622 1 U 5.6e+06 0 e 0 552 560 557 936 25.430 0.364 4.037 1 U 7.53e+06 0 e 0 552 560 555 937 26.259 1.408 0.361 1 U 2.35e+07 0 e 0 0 0 0 938 26.254 1.412 0.153 1 U 1.64e+07 0 e 0 553 558 559 939 54.880 4.087 1.661 1 U 1.12e+08 0 e 0 563 566 567 940 37.548 2.503 2.500 1 U 1.11e+07 0 e 0 572 576 576 941 37.984 2.366 2.506 1 U 1.36e+07 0 e 0 572 575 576 942 37.499 2.512 2.371 1 U 1.58e+07 0 e 0 572 576 575 943 37.890 2.362 2.370 1 U 1.74e+07 0 e 0 572 575 575 944 54.983 4.318 1.017 1 U 1.17e+07 0 e 0 580 586 591 945 40.091 1.978 1.016 1 U 1.04e+07 0 e 0 581 588 591 946 40.129 1.747 1.017 1 U 1e+07 0 e 0 581 587 591 947 40.050 1.976 0.829 1 U 1.27e+07 0 e 0 581 588 590 948 55.133 4.317 1.974 1 U 1.43e+07 0 e 0 580 586 588 949 40.029 1.976 4.317 1 U 1.25e+07 0 e 0 581 588 586 950 40.100 1.746 4.322 1 U 1.2e+07 0 e 0 581 587 586 951 22.977 0.829 1.746 1 U 8.85e+06 0 e 0 582 590 587 952 23.247 0.828 1.973 1 U 5.71e+06 0 e 0 582 590 588 953 23.223 0.828 1.884 1 U 3.13e+07 0 e 0 582 590 589 954 23.538 0.834 1.554 1 U 1.37e+08 0 e 0 0 0 0 955 23.271 0.828 1.016 1 U 1.08e+08 0 e 0 582 590 591 956 55.080 4.319 1.738 1 U 1.95e+07 0 e 0 0 0 0 957 26.135 1.018 4.321 1 U 7.14e+06 0 e 0 583 591 586 958 55.042 4.318 1.886 1 U 1.11e+07 0 e 0 580 586 589 959 28.144 1.880 4.318 1 U 7.66e+06 0 e 0 584 589 586 960 54.751 4.809 3.009 1 U 4.86e+07 0 e 0 1103 1106 1108 961 55.019 3.862 2.649 1 U 1.29e+07 0 e 0 0 0 0 962 55.142 3.862 2.789 1 U 1.31e+07 0 e 0 0 0 0 963 55.120 3.863 2.761 1 U 1.81e+07 0 e 0 0 0 0 964 38.726 3.129 2.780 1 U 4.63e+06 0 e 0 636 641 640 965 39.134 2.773 3.140 1 U 3.33e+06 0 e 0 636 640 641 966 42.957 1.616 1.206 1 U 5.41e+06 0 e 0 648 654 656 967 18.257 0.853 1.202 1 U 1.22e+07 0 e 0 651 658 656 968 35.783 2.163 5.338 1 U 9.9e+06 0 e 0 662 668 667 969 56.837 5.335 2.175 1 U 1.23e+07 0 e 0 661 667 668 970 56.636 5.322 1.411 1 U 4.41e+06 0 e 0 661 667 670 971 56.870 5.329 0.999 1 U 2.9e+06 0 e 0 661 667 669 972 56.870 5.336 0.628 1 U 5.39e+06 0 e 0 661 667 671 973 35.827 2.174 0.629 1 U 1.39e+07 0 e 0 662 668 671 974 16.933 0.922 0.629 1 U 1.06e+07 0 e 0 665 672 671 975 16.905 0.925 1.008 1 U 6.34e+06 0 e 0 665 672 669 976 17.221 0.912 1.427 1 U 9.65e+06 0 e 0 665 672 670 977 9.206 0.631 2.171 1 U 1.21e+07 0 e 0 663 671 668 978 9.081 0.625 5.331 1 U 4.53e+06 0 e 0 663 671 667 979 9.234 0.630 1.006 1 U 1.61e+07 0 e 0 663 671 669 980 9.193 0.630 0.923 1 U 1.13e+07 0 e 0 663 671 672 981 26.000 0.332 1.321 1 U 0 0 e 0 0 0 0 982 25.818 1.008 5.342 1 U 4.1e+06 0 e 0 664 669 667 983 39.229 2.633 4.313 1 U 1.48e+07 0 e 0 676 680 679 984 39.244 3.107 4.312 1 U 1.2e+07 0 e 0 676 681 679 985 54.828 4.922 3.248 1 U 1.75e+07 0 e 0 701 704 706 986 41.215 3.246 4.931 1 U 6.04e+06 0 e 0 702 706 704 987 41.390 3.123 4.933 1 U 5.09e+06 0 e 0 702 705 704 988 40.902 3.252 3.122 1 U 3.37e+06 0 e 0 702 706 705 989 20.568 1.496 4.583 1 U 9.31e+06 0 e 0 717 720 719 990 63.372 3.729 3.087 1 U 1.87e+07 0 e 0 723 728 729 991 40.587 3.391 3.734 1 U 1.49e+07 0 e 0 724 730 728 992 40.615 3.083 3.738 1 U 1.15e+07 0 e 0 724 729 728 993 40.829 3.387 3.102 1 U 4.06e+06 0 e 0 724 730 729 994 28.110 2.323 4.197 1 U 1.37e+07 0 e 0 736 742 740 995 28.114 2.192 4.197 1 U 1.16e+07 0 e 0 736 741 740 996 28.091 2.315 2.191 1 U 5.52e+06 0 e 0 736 742 741 997 28.078 2.195 2.199 1 U 6.26e+06 0 e 0 736 741 741 998 27.810 2.318 2.318 1 U 8.81e+06 0 e 0 736 742 742 999 57.786 4.194 2.326 1 U 1.72e+07 0 e 0 735 740 742 1000 64.539 4.091 4.462 1 U 6.88e+06 0 e 0 750 754 752 1001 64.627 3.988 4.460 1 U 9.57e+06 0 e 0 750 753 752 1002 59.231 4.461 4.463 1 U 1.97e+07 0 e 0 749 752 752 1003 54.914 4.644 0.971 1 U 1.09e+07 0 e 0 757 763 764 1004 42.466 1.686 0.540 1 U 6.13e+06 0 e 0 758 765 767 1005 42.578 0.987 0.540 1 U 6.94e+06 0 e 0 758 764 767 1006 42.558 0.989 0.644 1 U 6.96e+06 0 e 0 758 764 768 1007 42.923 1.678 0.641 1 U 1.06e+07 0 e 0 758 765 768 1008 25.565 0.543 1.757 1 U 1.9e+07 0 e 0 759 767 766 1009 25.513 0.542 1.682 1 U 7.8e+06 0 e 0 759 767 765 1010 25.488 0.543 0.974 1 U 6.02e+06 0 e 0 0 0 0 1011 23.175 0.642 0.979 1 U 5.54e+06 0 e 0 760 768 764 1012 24.369 0.626 1.655 1 U 2.13e+07 0 e 0 0 0 0 1013 26.975 1.443 0.716 1 U 4.91e+07 0 e 0 432 437 438 1014 26.488 1.755 1.749 1 U 1.59e+07 0 e 0 761 766 766 1015 25.400 0.386 0.313 1 U 0 0 e 0 0 0 0 1016 60.882 4.743 0.503 1 U 1.87e+07 0 e 0 786 791 793 1017 60.876 4.746 0.592 1 U 1.93e+07 0 e 0 786 791 794 1018 52.837 5.650 2.648 1 U 1.17e+07 0 e 0 797 805 806 1019 52.904 5.654 3.222 1 U 1.18e+07 0 e 0 797 805 807 1020 52.888 5.649 5.651 1 U 7.35e+06 0 e 0 797 805 805 1021 31.928 2.633 5.652 1 U 8.65e+06 0 e 0 798 806 805 1022 31.932 3.223 5.657 1 U 9.21e+06 0 e 0 798 807 805 1023 34.183 2.010 2.586 1 U 1.43e+07 0 e 0 1292 1303 1300 1024 34.841 2.579 2.002 1 U 1.07e+07 0 e 0 1294 1300 1303 1025 34.776 2.580 2.587 1 U 7.23e+06 0 e 0 1294 1300 1300 1026 34.240 2.017 2.313 1 U 1.57e+07 0 e 0 1292 1303 1299 1027 34.553 2.220 1.666 1 U 1.51e+07 0 e 0 1068 1076 1071 1028 34.557 2.085 1.669 1 U 1.51e+07 0 e 0 1068 1075 1071 1029 34.597 2.087 1.772 1 U 1.22e+07 0 e 0 1068 1075 1072 1030 30.614 2.323 2.321 1 U 1.14e+07 0 e 0 1427 1432 1432 1031 30.690 2.396 2.403 1 U 5.81e+06 0 e 0 1427 1433 1433 1032 30.561 2.398 5.232 1 U 8.37e+06 0 e 0 1427 1433 1429 1033 30.547 2.321 5.230 1 U 9.27e+06 0 e 0 1427 1432 1429 1034 54.539 5.240 2.182 1 U 1.13e+07 0 e 0 1424 1429 1430 1035 54.245 4.583 2.213 1 U 7.83e+06 0 e 0 817 822 828 1036 54.413 4.580 2.144 1 U 7.17e+06 0 e 0 817 822 824 1037 54.021 4.571 1.985 1 U 6.86e+06 0 e 0 817 822 827 1038 34.691 2.093 2.217 1 U 7.71e+06 0 e 0 1068 1075 1076 1039 34.581 1.611 1.226 1 U 7.66e+06 0 e 0 1194 1200 1204 1040 34.620 1.807 1.226 1 U 7.43e+06 0 e 0 1194 1201 1204 1041 53.211 4.566 2.049 1 U 1.83e+07 0 e 0 264 267 268 1042 52.635 5.001 2.618 1 U 1.32e+07 0 e 0 832 835 837 1043 52.694 5.002 1.495 1 U 1.35e+07 0 e 0 832 835 836 1044 58.028 3.990 1.965 1 U 1.82e+07 0 e 0 840 846 0 1045 57.564 4.140 1.351 1 U 9.84e+06 0 e 0 0 0 0 1046 58.150 4.533 2.787 1 U 1.68e+07 0 e 0 380 383 387 1047 57.540 3.718 2.084 1 U 7.52e+06 0 e 0 0 0 0 1048 57.603 3.717 2.012 1 U 7.14e+06 0 e 0 0 0 0 1049 58.009 3.988 0.885 1 U 5.37e+06 0 e 0 840 846 850 1050 57.809 3.995 0.999 1 U 9.88e+06 0 e 0 840 846 851 1051 58.053 4.078 2.004 1 U 1.58e+07 0 e 0 0 0 0 1052 42.484 1.963 3.993 1 U 1.32e+07 0 e 0 841 848 846 1053 42.485 1.536 3.996 1 U 1.18e+07 0 e 0 841 847 846 1054 42.646 1.986 0.892 1 U 8.59e+06 0 e 0 841 848 850 1055 42.595 1.981 1.001 1 U 9.7e+06 0 e 0 841 848 851 1056 42.538 1.533 0.997 1 U 8.68e+06 0 e 0 841 847 851 1057 22.765 0.888 1.965 1 U 2.48e+07 0 e 0 842 850 0 1058 25.212 1.000 1.541 1 U 1.34e+07 0 e 0 843 851 847 1059 25.287 0.996 3.992 1 U 7.14e+06 0 e 0 843 851 846 1060 26.561 1.960 3.985 1 U 3.94e+06 0 e 0 0 0 0 1061 26.835 1.961 1.558 1 U 3.28e+06 0 e 0 844 849 847 1062 37.061 3.290 4.871 1 U 4.39e+06 0 e 0 855 860 858 1063 37.461 3.232 4.874 1 U 4.69e+06 0 e 0 611 616 614 1064 37.002 2.740 4.871 1 U 3.13e+06 0 e 0 855 859 858 1065 51.720 4.864 4.873 1 U 5.74e+06 0 e 0 0 0 0 1066 57.275 3.723 1.864 1 U 1.4e+07 0 e 0 0 0 0 1067 53.010 4.808 1.482 1 U 1.56e+07 0 e 0 771 776 784 1068 34.075 2.078 4.454 1 U 6.56e+06 0 e 0 1170 1175 1174 1069 19.655 0.848 4.459 1 U 1.06e+07 0 e 0 1171 1176 1174 1070 62.142 4.455 2.079 1 U 1.83e+07 0 e 0 1169 1174 1175 1071 22.312 0.888 4.459 1 U 1.24e+07 0 e 0 1172 1177 1174 1072 70.120 4.837 1.253 1 U 1.06e+07 0 e 0 985 989 990 1073 21.472 1.257 4.334 1 U 4.6e+06 0 e 0 986 990 988 1074 61.912 5.384 5.391 1 U 1.19e+07 0 e 0 2 6 6 1075 61.818 5.386 1.732 1 U 3.95e+06 0 e 0 2 6 11 1076 72.238 4.048 1.140 1 U 1.73e+07 0 e 0 1393 1397 1398 1077 24.987 4.069 4.087 1 U 6.45e+06 0 e 0 0 0 0 1078 61.734 4.923 0.860 1 U 1.84e+07 0 e 0 1250 1254 1256 1079 72.740 3.894 4.935 1 U 1.15e+07 0 e 0 1251 1255 1254 1080 20.261 0.862 3.897 1 U 1.31e+07 0 e 0 1252 1256 1255 1081 70.752 4.056 1.233 1 U 1.06e+07 0 e 0 1333 1337 1338 1082 70.651 4.054 4.888 1 U 6.99e+06 0 e 0 1333 1337 1336 1083 15.472 4.018 4.022 1 U 4.15e+07 0 e 0 0 0 0 1084 68.728 4.331 4.334 1 U 6.2e+06 0 e 0 1357 1361 1361 1085 15.472 4.018 4.022 1 U 4.15e+07 0 e 0 0 0 0 1086 71.210 4.266 4.271 1 U 6.18e+06 0 e 0 1384 1388 1388 1087 71.187 4.262 1.141 1 U 1.49e+07 0 e 0 1384 1388 1389 1088 21.393 1.146 5.287 1 U 3.31e+06 0 e 0 0 0 0 1089 21.383 1.141 5.235 1 U 1.27e+07 0 e 0 1394 1398 1396 1090 59.807 5.226 5.233 1 U 1.47e+07 0 e 0 1392 1396 1396 1091 47.103 3.997 3.899 1 U 5.43e+06 0 e 0 1044 1047 1046 1092 46.840 3.903 4.020 1 U 1.26e+07 0 e 0 1044 1046 1047 1093 45.217 4.260 3.645 1 U 1.05e+07 0 e 0 1377 1380 1379 1094 45.301 3.625 4.266 1 U 1.41e+07 0 e 0 1377 1379 1380 1095 45.403 3.631 3.638 1 U 1.23e+07 0 e 0 1377 1379 1379 1096 57.030 5.408 5.410 1 U 1.09e+07 0 e 0 1080 1083 1083 1097 57.095 5.407 3.720 1 U 1.78e+07 0 e 0 1080 1083 1084 1098 66.121 3.716 3.907 1 U 3.84e+06 0 e 0 1081 1084 1085 1099 57.856 5.687 5.691 1 U 5.78e+06 0 e 0 1311 1314 1314 1100 66.618 3.767 3.779 1 U 7.77e+06 0 e 0 1312 1318 1318 1101 56.297 5.228 1.920 1 U 7.37e+06 0 e 0 1341 1347 1348 1102 56.336 5.216 1.679 1 U 4.72e+06 0 e 0 1341 1347 1353 1103 56.247 5.221 1.415 1 U 5.32e+06 0 e 0 1341 1347 1350 1104 56.431 5.220 1.461 1 U 4.5e+06 0 e 0 1341 1347 1351 1105 56.274 5.250 2.998 1 U 1.77e+07 0 e 0 1320 1325 1326 1106 56.308 5.255 3.721 1 U 1.19e+07 0 e 0 1320 1325 1327 1107 55.813 4.789 1.998 1 U 1.55e+07 0 e 0 1133 1138 1140 1108 34.427 2.136 1.423 1 U 6.15e+06 0 e 0 1282 1288 1285 1109 56.819 4.381 2.219 1 U 1.53e+07 0 e 0 1065 1070 1076 1110 56.817 4.378 2.090 1 U 1.53e+07 0 e 0 1065 1070 1075 1111 28.913 1.671 5.234 1 U 4.54e+06 0 e 0 1343 1353 1347 1112 32.462 1.667 2.224 1 U 1.06e+07 0 e 0 1066 1071 1076 1113 32.413 1.664 2.092 1 U 9.73e+06 0 e 0 1066 1071 1075 1114 32.506 1.658 4.382 1 U 5.66e+06 0 e 0 1066 1071 1070 1115 34.704 2.220 4.384 1 U 1.21e+07 0 e 0 1068 1076 1070 1116 34.715 2.088 4.385 1 U 1.12e+07 0 e 0 1068 1075 1070 1117 32.093 1.775 2.221 1 U 1.3e+07 0 e 0 1066 1072 1076 1118 32.288 1.785 2.095 1 U 1e+07 0 e 0 1066 1072 1075 1119 34.184 2.301 1.677 1 U 7.92e+06 0 e 0 1342 1349 1353 1120 34.746 2.303 5.246 1 U 1.85e+07 0 e 0 1294 1299 1296 1121 34.803 2.310 2.582 1 U 6.55e+06 0 e 0 1294 1299 1300 1122 28.925 1.681 2.310 1 U 5.61e+06 0 e 0 1343 1353 1349 1123 26.822 1.420 5.234 1 U 5.48e+06 0 e 0 1345 1350 1347 1124 26.785 1.410 1.921 1 U 2.99e+06 0 e 0 1345 1350 1348 1125 26.149 1.453 3.650 1 U 1.34e+07 0 e 0 0 0 0 1126 26.609 1.412 2.932 1 U 8.15e+06 0 e 0 1345 1350 1354 1127 27.223 1.419 1.830 1 U 7.61e+06 0 e 0 0 0 0 1128 26.654 1.465 5.233 1 U 7.05e+06 0 e 0 1345 1351 1347 1129 26.915 1.471 4.249 1 U 5.52e+06 0 e 0 0 0 0 1130 27.057 1.455 4.158 1 U 1.65e+07 0 e 0 0 0 0 1131 26.526 1.457 2.933 1 U 8.96e+06 0 e 0 1345 1351 1354 1132 29.025 1.681 5.249 1 U 4.33e+06 0 e 0 0 0 0 1133 34.290 2.012 5.256 1 U 1.22e+07 0 e 0 1292 1303 1296 1134 34.405 1.951 5.268 1 U 1.13e+07 0 e 0 1282 1287 1284 1135 34.484 2.132 5.271 1 U 8.67e+06 0 e 0 1282 1288 1284 1136 34.057 1.906 5.234 1 U 6.8e+06 0 e 0 1342 1348 1347 1137 28.991 1.691 1.892 1 U 7.67e+06 0 e 0 1343 1353 1348 1138 29.223 1.664 1.827 1 U 1.61e+07 0 e 0 0 0 0 1139 57.306 4.640 1.555 1 U 1.33e+07 0 e 0 1408 1414 1419 1140 57.349 4.637 1.651 1 U 9.2e+06 0 e 0 1408 1414 1420 1141 57.300 4.637 1.719 1 U 1.4e+07 0 e 0 1408 1414 1415 1142 57.342 4.638 1.880 1 U 1.18e+07 0 e 0 1408 1414 1416 1143 57.629 4.626 2.985 1 U 2e+07 0 e 0 0 0 0 1144 26.860 1.551 1.678 1 U 1.72e+07 0 e 0 0 0 0 1145 27.007 1.560 1.804 1 U 1.34e+07 0 e 0 0 0 0 1146 54.371 5.231 2.405 1 U 1.15e+07 0 e 0 1424 1429 1433 1147 37.698 2.324 5.234 1 U 8.22e+06 0 e 0 1425 1431 1429 1148 37.826 2.178 5.239 1 U 6.65e+06 0 e 0 1425 1430 1429 1149 30.516 2.404 2.324 1 U 1.38e+07 0 e 0 1427 1433 1432 1150 30.740 2.339 2.384 1 U 5.35e+06 0 e 0 1427 1432 1433 1151 54.644 5.233 2.319 1 U 2.63e+07 0 e 0 1424 1429 1432 1152 37.792 2.178 2.322 1 U 1.2e+07 0 e 0 1425 1430 1431 1153 32.272 1.418 2.137 1 U 4.69e+06 0 e 0 1281 1285 1288 1154 55.049 5.266 1.420 1 U 6.89e+06 0 e 0 1280 1284 1285 1155 54.871 5.260 2.133 1 U 8.25e+06 0 e 0 1280 1284 1288 1156 34.816 1.963 2.136 1 U 1.06e+07 0 e 0 820 827 824 1157 34.350 1.940 1.421 1 U 7.94e+06 0 e 0 1282 1287 1285 1158 34.402 2.131 2.017 1 U 1.07e+07 0 e 0 1282 1288 1286 1159 32.186 1.412 2.020 1 U 3.22e+06 0 e 0 1281 1285 1286 1160 32.034 1.418 5.255 1 U 3.72e+06 0 e 0 0 0 0 1161 32.201 1.417 1.954 1 U 3.85e+06 0 e 0 1281 1285 1287 1162 34.464 2.141 1.962 1 U 5.52e+06 0 e 0 1282 1288 1287 1163 55.378 5.244 2.585 1 U 1.26e+07 0 e 0 1291 1296 1300 1164 34.913 2.582 5.256 1 U 1.38e+07 0 e 0 1294 1300 1296 1165 43.916 0.906 0.473 1 U 5.97e+06 0 e 0 953 959 962 1166 43.829 0.907 0.585 1 U 6.29e+06 0 e 0 953 959 963 1167 53.508 5.104 5.109 1 U 1.13e+07 0 e 0 952 958 958 1168 43.691 0.920 5.116 1 U 7.34e+06 0 e 0 953 959 958 1169 23.843 0.475 5.106 1 U 3.62e+06 0 e 0 954 962 958 1170 24.995 0.584 5.111 1 U 7.61e+06 0 e 0 955 963 958 1171 25.061 0.587 1.931 1 U 8.26e+06 0 e 0 955 963 960 1172 24.110 0.471 1.921 1 U 3.93e+06 0 e 0 954 962 960 1173 26.708 1.375 5.100 1 U 4.14e+06 0 e 0 956 961 958 1174 24.305 0.182 1.388 1 U 0 0 e 0 0 0 0 1175 25.000 0.589 0.910 1 U 5.09e+06 0 e 0 955 963 959 1176 59.468 3.742 1.419 1 U 1.11e+07 0 e 0 993 999 1001 1177 59.479 3.740 0.324 1 U 9.18e+06 0 e 0 993 999 1004 1178 59.481 3.742 0.262 1 U 8.58e+06 0 e 0 993 999 1003 1179 38.280 1.265 0.324 1 U 1.12e+07 0 e 0 994 1000 1004 1180 38.334 1.268 0.262 1 U 1.14e+07 0 e 0 994 1000 1003 1181 38.229 1.423 0.263 1 U 1.04e+07 0 e 0 994 1001 1003 1182 38.280 1.418 0.324 1 U 1.26e+07 0 e 0 994 1001 1004 1183 38.113 1.433 1.258 1 U 5.29e+06 0 e 0 994 1001 1002 1184 38.337 1.257 1.250 1 U 4.54e+06 0 e 0 994 1000 1000 1185 38.226 1.265 3.740 1 U 9.42e+06 0 e 0 994 1000 999 1186 38.215 1.420 3.743 1 U 9.66e+06 0 e 0 994 1001 999 1187 59.460 3.742 1.265 1 U 2.31e+07 0 e 0 993 999 1000 1188 25.430 0.261 1.418 1 U 8.89e+06 0 e 0 995 1003 1001 1189 25.405 0.264 3.739 1 U 4.25e+06 0 e 0 995 1003 999 1190 24.448 0.330 1.424 1 U 1.04e+07 0 e 0 996 1004 1001 1191 24.277 0.326 3.746 1 U 5.19e+06 0 e 0 996 1004 999 1192 29.313 1.259 1.418 1 U 4.36e+06 0 e 0 997 1002 1001 1193 29.334 1.264 3.742 1 U 6.47e+06 0 e 0 997 1002 999 1194 54.324 4.361 0.681 1 U 1.93e+07 0 e 0 1031 1037 1039 1195 43.294 1.370 0.687 1 U 1.03e+07 0 e 0 1089 1095 1099 1196 42.800 1.726 1.724 1 U 1.44e+07 0 e 0 0 0 0 1197 42.813 1.648 1.717 1 U 1.42e+07 0 e 0 1542 1547 1548 1198 26.664 0.682 4.363 1 U 5.14e+06 0 e 0 1033 1039 1037 1199 26.901 1.589 4.346 1 U 1.33e+07 0 e 0 1035 1038 1037 1200 55.009 4.322 1.917 1 U 4.2e+06 0 e 0 0 0 0 1201 26.897 1.492 4.341 1 U 1.29e+07 0 e 0 0 0 0 1202 53.931 4.840 0.688 1 U 8.39e+06 0 e 0 1088 1094 1099 1203 53.981 4.839 0.636 1 U 1.38e+07 0 e 0 1088 1094 1098 1204 43.637 0.956 0.586 1 U 4.96e+06 0 e 0 0 0 0 1205 42.791 1.245 0.899 1 U 6.97e+06 0 e 0 0 0 0 1206 42.824 1.225 0.769 1 U 6.83e+06 0 e 0 1260 1266 1269 1207 54.641 4.735 0.790 1 U 1.21e+07 0 e 0 226 231 232 1208 53.975 4.675 0.826 1 U 1.04e+07 0 e 0 0 0 0 1209 53.920 4.638 0.768 1 U 7.45e+06 0 e 0 1259 1265 1269 1210 53.862 4.668 0.888 1 U 1.34e+07 0 e 0 0 0 0 1211 42.754 2.010 0.769 1 U 8.26e+06 0 e 0 1260 1267 1269 1212 43.710 1.800 0.796 1 U 6.91e+06 0 e 0 273 280 282 1213 43.283 1.732 0.127 1 U 4.74e+06 0 e 0 227 233 235 1214 54.667 4.733 0.125 1 U 9.3e+06 0 e 0 226 231 235 1215 53.750 4.842 1.640 1 U 1.42e+07 0 e 0 1088 1094 1096 1216 53.634 4.843 1.597 1 U 1.6e+07 0 e 0 1088 1094 1097 1217 43.154 1.651 0.638 1 U 1.06e+07 0 e 0 1089 1096 1098 1218 27.132 0.638 1.647 1 U 7.88e+06 0 e 0 1090 1098 1096 1219 53.818 4.838 1.373 1 U 1.45e+07 0 e 0 1088 1094 1095 1220 24.841 0.690 1.372 1 U 9.6e+06 0 e 0 1091 1099 1095 1221 53.596 4.828 4.849 1 U 4.97e+06 0 e 0 1088 1094 1094 1222 27.096 0.638 1.375 1 U 8.75e+06 0 e 0 1090 1098 1095 1223 41.824 1.350 4.158 1 U 3.19e+07 0 e 0 0 0 0 1224 53.747 4.627 2.016 1 U 1.07e+07 0 e 0 1259 1265 1267 1225 23.932 0.768 2.019 1 U 4.49e+06 0 e 0 1261 1269 1267 1226 26.552 0.903 2.020 1 U 7.05e+06 0 e 0 1262 1270 1267 1227 26.662 0.904 1.227 1 U 9.47e+06 0 e 0 1262 1270 1266 1228 26.574 0.905 1.209 1 U 9.81e+06 0 e 0 0 0 0 1229 27.300 1.299 1.312 1 U 1.76e+07 0 e 0 1263 1268 1268 1230 53.863 4.632 1.224 1 U 1.01e+07 0 e 0 1259 1265 1266 1231 42.833 2.010 0.898 1 U 8.86e+06 0 e 0 1260 1267 1270 1232 24.002 0.768 1.249 1 U 8.42e+06 0 e 0 1261 1269 1266 1233 52.989 4.914 0.626 1 U 3.56e+06 0 e 0 1451 1457 1462 1234 52.840 4.906 0.517 1 U 6.32e+06 0 e 0 1451 1457 1461 1235 53.411 4.839 0.551 1 U 4.64e+06 0 e 0 0 0 0 1236 53.284 4.827 0.485 1 U 3.46e+06 0 e 0 0 0 0 1237 44.391 1.602 0.625 1 U 5.99e+06 0 e 0 1452 1459 1462 1238 44.696 1.606 0.513 1 U 4.08e+06 0 e 0 1452 1459 1461 1239 53.084 4.904 1.608 1 U 1.11e+07 0 e 0 1451 1457 1459 1240 44.713 1.069 0.623 1 U 2.96e+06 0 e 0 1452 1458 1462 1241 44.608 1.054 0.508 1 U 3.13e+06 0 e 0 1452 1458 1461 1242 52.832 4.918 1.049 1 U 5.71e+06 0 e 0 1451 1457 1458 1243 53.181 4.937 0.997 1 U 7.93e+06 0 e 0 368 373 378 1244 28.521 0.531 1.543 1 U 3.21e+06 0 e 0 0 0 0 1245 27.823 0.517 1.658 1 U 1.48e+07 0 e 0 1453 1461 1460 1246 27.823 0.519 1.607 1 U 7.55e+06 0 e 0 1453 1461 1459 1247 59.767 4.141 1.978 1 U 1.99e+07 0 e 0 1008 1012 1013 1248 59.775 4.143 2.425 1 U 1.99e+07 0 e 0 1008 1012 1016 1249 29.504 1.973 4.145 1 U 1.63e+07 0 e 0 1009 1013 1012 1250 29.506 1.937 4.112 1 U 1.46e+07 0 e 0 1021 1025 1024 1251 29.768 1.980 1.982 1 U 8.89e+06 0 e 0 1009 1013 1013 1252 29.545 2.153 1.974 1 U 6.19e+06 0 e 0 1009 1014 1013 1253 36.993 2.330 2.418 1 U 1.84e+07 0 e 0 1010 1015 1016 1254 36.601 2.426 2.335 1 U 1.57e+07 0 e 0 1010 1016 1015 1255 36.633 2.428 2.418 1 U 1.43e+07 0 e 0 1010 1016 1016 1256 58.966 4.111 2.569 1 U 1.29e+07 0 e 0 1020 1024 1028 1257 58.988 4.109 1.935 1 U 1.8e+07 0 e 0 1020 1024 1025 1258 29.612 2.369 4.115 1 U 1.28e+07 0 e 0 1021 1026 1024 1259 29.541 2.369 2.567 1 U 1.36e+07 0 e 0 1021 1026 1028 1260 29.593 2.372 2.214 1 U 1.31e+07 0 e 0 1021 1026 1027 1261 29.637 2.365 1.935 1 U 4.69e+06 0 e 0 1021 1026 1025 1262 29.550 1.934 2.569 1 U 1.5e+07 0 e 0 1021 1025 1028 1263 37.082 2.571 2.370 1 U 1.73e+07 0 e 0 1022 1028 1026 1264 37.076 2.569 1.938 1 U 1.6e+07 0 e 0 1022 1028 1025 1265 37.082 2.571 4.112 1 U 1.86e+07 0 e 0 1022 1028 1024 1266 37.143 2.224 2.561 1 U 5.74e+06 0 e 0 1022 1027 1028 1267 37.199 2.212 2.580 1 U 5.16e+06 0 e 0 0 0 0 1268 37.215 2.211 2.377 1 U 1.74e+07 0 e 0 1022 1027 1026 1269 37.000 2.570 2.563 1 U 6.98e+06 0 e 0 1022 1028 1028 1270 36.882 2.566 2.581 1 U 7.79e+06 0 e 0 0 0 0 1271 36.980 2.568 2.200 1 U 7.18e+06 0 e 0 0 0 0 1272 36.982 2.566 2.215 1 U 7.03e+06 0 e 0 1022 1028 1027 1273 56.400 4.383 2.366 1 U 6.07e+06 0 e 0 0 0 0 1274 56.101 4.406 2.694 1 U 1.67e+07 0 e 0 0 0 0 1275 30.543 2.329 2.181 1 U 7.19e+06 0 e 0 1427 1432 1430 1276 30.365 2.403 2.184 1 U 8.48e+06 0 e 0 1427 1433 1430 1277 16.939 0.700 0.302 1 U 8.81e+06 0 e 0 1055 1062 1061 1278 17.203 0.709 1.853 1 U 1.58e+07 0 e 0 891 897 893 1279 16.972 0.701 1.524 1 U 7.4e+06 0 e 0 1055 1062 1060 1280 16.975 0.700 4.001 1 U 1.45e+07 0 e 0 1055 1062 1057 1281 14.206 0.303 1.617 1 U 1.44e+07 0 e 0 1053 1061 1058 1282 14.448 0.314 3.997 1 U 3.41e+06 0 e 0 1053 1061 1057 1283 27.734 0.844 0.303 1 U 1.79e+07 0 e 0 1054 1059 1061 1284 27.924 0.849 4.006 1 U 3.59e+06 0 e 0 1054 1059 1057 1285 38.377 1.621 4.000 1 U 1.03e+07 0 e 0 1052 1058 1057 1286 38.306 1.617 1.525 1 U 4.63e+06 0 e 0 0 0 0 1287 14.170 0.304 0.699 1 U 9.77e+06 0 e 0 1053 1061 1062 1288 14.231 0.305 0.839 1 U 1.87e+07 0 e 0 1053 1061 1059 1289 55.775 4.790 1.445 1 U 1.86e+07 0 e 0 1133 1138 1139 1290 56.035 4.332 2.347 1 U 1.21e+07 0 e 0 0 0 0 1291 41.050 2.760 4.201 1 U -5.86e+06 0 e 0 0 0 0 1292 41.068 2.749 4.112 1 U 1.83e+07 0 e 0 0 0 0 1293 40.987 2.662 4.241 1 U -6.09e+06 0 e 0 0 0 0 1294 41.015 2.631 4.111 1 U 1.12e+07 0 e 0 0 0 0 1295 40.898 2.621 4.214 1 U -5.24e+06 0 e 0 0 0 0 1296 41.506 2.992 5.259 1 U 1.81e+07 0 e 0 1321 1326 1325 1297 41.468 3.719 5.258 1 U 1.42e+07 0 e 0 1321 1327 1325 1298 40.851 2.873 5.361 1 U 1.03e+07 0 e 0 1241 1245 1243 1299 40.822 2.331 5.353 1 U 1.14e+07 0 e 0 1241 1244 1243 1300 40.550 2.324 2.878 1 U 2.76e+06 0 e 0 1241 1244 1245 1301 40.838 2.868 2.321 1 U 2.48e+06 0 e 0 1241 1245 1244 1302 53.546 4.945 2.303 1 U 1.29e+07 0 e 0 1443 1446 1447 1303 42.735 2.303 4.958 1 U 3.22e+06 0 e 0 1444 1447 1446 1304 43.119 3.116 4.953 1 U 6.67e+06 0 e 0 968 975 972 1305 43.186 0.789 0.128 1 U 4.09e+06 0 e 0 227 232 235 1306 54.463 4.733 1.719 1 U 1.46e+07 0 e 0 226 231 233 1307 27.648 0.126 1.456 1 U 1.6e+07 0 e 0 228 235 234 1308 27.695 0.122 1.723 1 U 5.62e+06 0 e 0 228 235 233 1309 54.636 4.736 0.708 1 U 8.53e+06 0 e 0 226 231 236 1310 22.950 0.234 -1.155 1 U 0 0 e 0 0 0 0 1311 23.057 0.711 1.725 1 U 5.19e+06 0 e 0 229 236 233 1312 27.660 0.132 0.791 1 U 5.05e+06 0 e 0 228 235 232 1313 54.357 4.729 1.454 1 U 9.96e+06 0 e 0 226 231 234 1314 42.959 1.741 0.711 1 U 6.75e+06 0 e 0 227 233 236 1315 43.206 0.788 0.706 1 U 6.13e+06 0 e 0 227 232 236 1316 40.011 2.345 4.566 1 U 2.85e+06 0 e 0 628 631 630 1317 40.251 2.896 3.139 1 U 7.83e+06 0 e 0 0 0 0 1318 40.242 3.147 2.909 1 U 9.26e+06 0 e 0 0 0 0 1319 56.703 4.200 0.925 1 U 9.77e+06 0 e 0 272 278 283 1320 56.696 4.190 0.797 1 U 7.51e+06 0 e 0 272 278 282 1321 56.231 4.124 1.049 1 U 3.83e+06 0 e 0 0 0 0 1322 43.580 1.801 0.926 1 U 5.46e+06 0 e 0 273 280 283 1323 43.891 1.503 0.927 1 U 5.02e+06 0 e 0 273 279 283 1324 43.677 1.804 4.199 1 U 1.26e+07 0 e 0 273 280 278 1325 43.662 3.156 4.170 1 U 6.28e+06 0 e 0 0 0 0 1326 43.783 2.448 4.205 1 U 6.49e+06 0 e 0 0 0 0 1327 44.223 2.479 4.134 1 U 1.67e+06 0 e 0 0 0 0 1328 26.335 0.927 1.501 1 U 4.73e+06 0 e 0 275 283 279 1329 26.474 0.930 4.199 1 U 7.71e+06 0 e 0 275 283 278 1330 22.276 0.794 1.791 1 U 4.9e+06 0 e 0 274 282 280 1331 26.613 0.924 1.813 1 U 4e+06 0 e 0 275 283 280 1332 43.646 1.805 1.658 1 U 3.35e+06 0 e 0 0 0 0 1333 26.905 1.668 1.516 1 U 4.41e+06 0 e 0 0 0 0 1334 26.059 1.637 1.871 1 U 5.32e+06 0 e 0 1412 1420 1416 1335 42.466 1.852 0.997 1 U 5e+06 0 e 0 369 374 378 1336 53.357 4.936 1.949 1 U 7.59e+06 0 e 0 368 373 376 1337 53.351 4.941 1.994 1 U 8.18e+06 0 e 0 368 373 375 1338 42.552 1.849 4.950 1 U 3.21e+06 0 e 0 369 374 373 1339 42.637 2.004 4.963 1 U 2.56e+06 0 e 0 369 375 373 1340 17.264 0.998 0.390 1 U 3.87e+06 0 e 0 332 339 338 1341 17.255 0.998 1.414 1 U 1.12e+07 0 e 0 332 339 335 1342 17.309 1.000 4.957 1 U 2.92e+06 0 e 0 332 339 334 1343 33.119 1.409 0.392 1 U 9.4e+06 0 e 0 329 335 338 1344 33.078 1.415 0.994 1 U 1.08e+07 0 e 0 329 335 339 1345 53.799 4.533 1.784 1 U 1.33e+07 0 e 0 428 434 436 1346 41.695 1.781 0.716 1 U 8.5e+06 0 e 0 0 0 0 1347 42.042 1.788 0.761 1 U 7.33e+06 0 e 0 0 0 0 1348 23.154 0.707 1.702 1 U 3.59e+06 0 e 0 0 0 0 1349 22.446 0.722 1.781 1 U 5.01e+06 0 e 0 430 438 436 1350 22.424 0.720 1.634 1 U 6.37e+06 0 e 0 430 438 435 1351 40.014 2.331 3.028 1 U 3.05e+06 0 e 0 628 631 632 1352 39.382 2.374 3.054 1 U 2.69e+06 0 e 0 0 0 0 1353 31.315 2.136 1.978 1 U 5.71e+06 0 e 0 818 824 827 1354 31.802 2.211 2.152 1 U 2.65e+06 0 e 0 0 0 0 1355 35.130 2.192 2.147 1 U 1.15e+07 0 e 0 820 828 824 1356 34.584 2.224 2.089 1 U 1.07e+07 0 e 0 1068 1076 1075 1357 34.779 1.961 1.774 1 U 8.98e+06 0 e 0 820 827 823 1358 54.167 4.600 1.703 1 U 2e+07 0 e 0 1145 1151 1153 1359 54.018 4.602 1.316 1 U 1.39e+07 0 e 0 1145 1151 1154 1360 54.057 4.594 1.380 1 U 1.14e+07 0 e 0 1145 1151 1155 1361 31.365 1.767 1.969 1 U 6.07e+06 0 e 0 818 823 827 1362 31.406 1.778 2.147 1 U 5.45e+06 0 e 0 818 823 824 1363 54.388 4.581 1.761 1 U 1.06e+07 0 e 0 817 822 823 1364 31.039 2.133 1.762 1 U 3.11e+06 0 e 0 818 824 823 1365 34.939 1.967 2.220 1 U 5.8e+06 0 e 0 820 827 828 1366 37.791 1.500 5.022 1 U 5.8e+06 0 e 0 833 836 835 1367 37.817 2.624 5.003 1 U 6.44e+06 0 e 0 833 837 835 1368 56.199 3.764 1.767 1 U 1.55e+07 0 e 0 0 0 0 1369 62.617 3.726 3.683 1 U -2.09e+08 0 e 0 0 0 0 1370 63.386 3.731 3.731 1 U 2.18e+07 0 e 0 723 728 728 1371 27.666 2.158 2.847 1 U 5.02e+06 0 e 0 0 0 0 1372 58.438 4.301 2.170 1 U 5.91e+06 0 e 0 0 0 0 1373 58.579 4.298 2.362 1 U 3.23e+06 0 e 0 0 0 0 1374 36.766 3.023 4.590 1 U 2.28e+06 0 e 0 930 935 933 1375 36.645 2.744 4.596 1 U 2.34e+06 0 e 0 930 934 933 1376 54.023 4.927 1.787 1 U 1.06e+07 0 e 0 966 972 979 1377 54.134 4.929 1.889 1 U 1.2e+07 0 e 0 966 972 974 1378 33.482 1.688 1.780 1 U 6.35e+06 0 e 0 967 973 979 1379 33.625 1.694 3.147 1 U 8.13e+06 0 e 0 967 973 982 1380 33.586 1.882 3.160 1 U 7.59e+06 0 e 0 967 974 976 1381 33.641 1.886 3.127 1 U 6.49e+06 0 e 0 967 974 975 1382 33.942 1.828 2.985 1 U 7.77e+06 0 e 0 0 0 0 1383 33.770 1.787 2.972 1 U 8.46e+06 0 e 0 0 0 0 1384 33.389 1.797 2.889 1 U 4.16e+06 0 e 0 0 0 0 1385 33.412 1.877 4.945 1 U 2.88e+06 0 e 0 967 974 972 1386 33.292 1.691 4.938 1 U 2.53e+06 0 e 0 967 973 972 1387 33.795 1.867 1.788 1 U 3.98e+06 0 e 0 967 979 979 1388 27.432 1.785 4.944 1 U 3.33e+06 0 e 0 969 979 972 1389 27.553 1.689 3.149 1 U 1.88e+07 0 e 0 969 978 982 1390 27.562 1.782 3.154 1 U 1.74e+07 0 e 0 969 979 976 1391 27.527 1.785 3.117 1 U 1.49e+07 0 e 0 969 979 975 1392 27.451 1.779 1.691 1 U 1.11e+07 0 e 0 969 979 978 1393 27.551 1.694 1.778 1 U 5.7e+06 0 e 0 969 978 979 1394 27.702 1.781 1.898 1 U 4.76e+06 0 e 0 969 979 974 1395 43.365 3.199 1.863 1 U 1.58e+07 0 e 0 0 0 0 1396 32.568 1.788 4.382 1 U 5.26e+06 0 e 0 1066 1072 1070 1397 40.970 2.579 0.663 1 U 5.85e+06 0 e 0 0 0 0 1398 40.843 2.579 0.639 1 U 7.14e+06 0 e 0 0 0 0 1399 40.503 1.756 0.706 1 U 1.26e+07 0 e 0 0 0 0 1400 55.220 4.648 0.840 1 U 1.11e+07 0 e 0 1111 1117 1121 1401 55.797 4.395 0.665 1 U 6.34e+06 0 e 0 58 64 68 1402 55.121 4.401 0.775 1 U 4.84e+06 0 e 0 1217 1223 1226 1403 55.122 4.406 0.711 1 U 9.01e+06 0 e 0 1217 1223 1225 1404 55.134 4.413 1.350 1 U 1.49e+07 0 e 0 1193 1199 1205 1405 55.307 4.402 1.226 1 U 9.57e+06 0 e 0 1193 1199 1204 1406 55.315 4.406 1.804 1 U 1.82e+07 0 e 0 1193 1199 1201 1407 24.900 -0.153 -0.145 1 U 0 0 e 0 0 0 0 1408 53.480 4.818 0.896 1 U 3.74e+06 0 e 0 0 0 0 1409 53.135 4.834 0.886 1 U 4.98e+06 0 e 0 0 0 0 1410 35.946 1.711 1.384 1 U 1e+07 0 e 0 1146 1153 1155 1411 35.900 1.706 1.319 1 U 8.74e+06 0 e 0 1146 1153 1154 1412 35.826 1.616 1.378 1 U 9.05e+06 0 e 0 1146 1152 1155 1413 35.900 1.609 1.318 1 U 1.01e+07 0 e 0 1146 1152 1154 1414 35.987 1.622 2.903 1 U 1.16e+07 0 e 0 1146 1152 1158 1415 35.933 1.709 2.901 1 U 1.15e+07 0 e 0 1146 1153 1158 1416 24.695 1.385 1.706 1 U 1.65e+07 0 e 0 1149 1155 1153 1417 35.974 1.613 1.711 1 U 4.97e+06 0 e 0 1146 1152 1153 1418 29.077 1.587 1.707 1 U 1.88e+07 0 e 0 1147 1157 1153 1419 29.383 1.577 1.799 1 U 1.27e+07 0 e 0 0 0 0 1420 37.814 2.687 2.801 1 U 4.25e+06 0 e 0 1181 1185 1186 1421 38.055 2.784 2.707 1 U 5.56e+06 0 e 0 1181 1186 1185 1422 34.773 1.613 2.932 1 U 9.66e+06 0 e 0 1194 1200 1207 1423 34.707 1.808 2.934 1 U 9.61e+06 0 e 0 1194 1201 1207 1424 34.663 1.809 4.406 1 U 1.01e+07 0 e 0 1194 1201 1199 1425 34.743 1.617 4.402 1 U 9.58e+06 0 e 0 1194 1200 1199 1426 34.574 1.619 1.805 1 U 4.76e+06 0 e 0 1194 1200 1201 1427 24.744 1.218 4.400 1 U 5.94e+06 0 e 0 1197 1204 1199 1428 24.778 1.351 4.414 1 U 2.36e+06 0 e 0 1197 1205 1199 1429 42.247 2.938 1.799 1 U 3.91e+06 0 e 0 1196 1207 1201 1430 29.242 1.655 1.803 1 U 1.46e+07 0 e 0 1195 1203 1201 1431 29.218 1.711 1.557 1 U 1.86e+07 0 e 0 1410 1418 1419 1432 25.641 1.642 2.946 1 U 1.91e+07 0 e 0 1412 1420 1422 1433 41.965 2.931 1.460 1 U 1.22e+07 0 e 0 1344 1354 1351 1434 29.180 1.677 0.920 1 U 4.53e+06 0 e 0 0 0 0 1435 34.114 2.293 1.449 1 U 2.91e+06 0 e 0 1342 1349 1351 1436 33.968 1.931 1.480 1 U 3.31e+06 0 e 0 1342 1348 1351 1437 33.539 1.698 2.967 1 U 5.78e+06 0 e 0 0 0 0 1438 26.668 1.469 1.909 1 U 2.3e+06 0 e 0 1345 1351 1348 1439 34.652 1.881 1.558 1 U 1.24e+07 0 e 0 1409 1416 1419 1440 34.021 1.823 1.663 1 U 1.58e+07 0 e 0 0 0 0 1441 34.583 1.732 1.558 1 U 1.16e+07 0 e 0 1409 1415 1419 1442 34.418 1.735 1.879 1 U 2.81e+06 0 e 0 1409 1415 1416 1443 34.549 1.740 2.943 1 U 5.87e+06 0 e 0 1409 1415 1422 1444 57.479 4.647 1.597 1 U 4.2e+06 0 e 0 0 0 0 1445 57.363 4.634 1.680 1 U 6.2e+06 0 e 0 0 0 0 1446 25.811 1.558 1.882 1 U 5.63e+06 0 e 0 1412 1419 1416 1447 26.076 1.558 1.711 1 U 1.5e+07 0 e 0 1412 1419 1415 1448 42.188 1.319 0.483 1 U 3.18e+06 0 e 0 0 0 0 1449 42.516 1.622 0.483 1 U 2.56e+06 0 e 0 0 0 0 1450 21.950 0.487 1.452 1 U 1.25e+07 0 e 0 0 0 0 1451 26.323 1.456 0.485 1 U 1.18e+07 0 e 0 0 0 0 1452 21.723 0.488 1.311 1 U 3.13e+06 0 e 0 0 0 0 1453 40.354 1.686 0.776 1 U 6.09e+06 0 e 0 0 0 0 1454 40.315 1.664 0.715 1 U 5.41e+06 0 e 0 1218 1228 1225 1455 26.662 1.479 3.097 1 U 4.46e+07 0 e 0 0 0 0 1456 53.923 4.112 2.619 1 U 1.28e+07 0 e 0 0 0 0 1457 32.500 1.746 4.342 1 U 9.55e+06 0 e 0 0 0 0 1458 31.841 1.758 4.339 1 U 9.48e+06 0 e 0 0 0 0 1459 31.798 1.594 4.342 1 U 6.97e+06 0 e 0 0 0 0 1460 56.576 4.509 2.836 1 U 1.03e+07 0 e 0 0 0 0 1461 56.942 4.457 3.048 1 U 9.18e+06 0 e 0 0 0 0 1462 57.213 4.441 3.106 1 U 1.23e+07 0 e 0 0 0 0 1463 56.510 4.518 3.118 1 U 1.26e+07 0 e 0 0 0 0 1464 56.584 4.519 3.044 1 U 1.26e+07 0 e 0 0 0 0 1465 57.210 4.586 3.034 1 U 1.51e+07 0 e 0 0 0 0 1466 56.445 4.584 3.104 1 U 1.09e+07 0 e 0 0 0 0 1467 56.478 4.509 2.609 1 U 5.46e+06 0 e 0 0 0 0 1468 56.754 4.238 2.014 1 U 1.23e+07 0 e 0 115 119 125 1469 40.719 2.784 3.972 1 U 7.61e+06 0 e 0 0 0 0 1470 40.683 2.630 3.967 1 U 4.54e+06 0 e 0 0 0 0 1471 40.839 2.997 3.965 1 U 1.78e+07 0 e 0 0 0 0 1472 40.847 2.747 4.381 1 U -7.69e+06 0 e 0 0 0 0 1473 40.838 2.678 4.361 1 U -6.02e+06 0 e 0 0 0 0 1474 40.803 2.651 4.336 1 U -6.37e+06 0 e 0 0 0 0 1475 40.479 2.727 4.441 1 U 1.87e+07 0 e 0 0 0 0 1476 40.418 2.641 4.435 1 U 1.54e+07 0 e 0 0 0 0 1477 40.311 3.144 4.413 1 U 1.62e+07 0 e 0 0 0 0 1478 40.362 2.920 4.408 1 U 1.55e+07 0 e 0 0 0 0 1479 61.558 3.970 0.179 1 U 1.39e+07 0 e 0 167 172 174 1480 61.525 3.968 0.627 1 U 7.46e+06 0 e 0 167 172 175 1481 33.224 0.858 0.632 1 U 1.54e+07 0 e 0 168 173 175 1482 33.246 0.855 0.852 1 U 9.51e+06 0 e 0 168 173 173 1483 61.538 3.967 0.840 1 U 5.02e+06 0 e 0 167 172 173 1484 33.278 0.861 3.982 1 U 4.53e+06 0 e 0 168 173 172 1485 20.945 0.635 0.857 1 U 1.19e+07 0 e 0 170 175 173 1486 20.847 0.631 3.969 1 U 7.06e+06 0 e 0 170 175 172 1487 22.082 0.180 0.856 1 U 1.92e+07 0 e 0 169 174 173 1488 22.019 0.182 3.977 1 U 1.08e+07 0 e 0 169 174 172 1489 54.925 5.397 5.400 1 U 6.52e+06 0 e 0 157 161 161 1490 54.665 5.404 2.957 1 U 4.65e+06 0 e 0 157 161 163 1491 54.658 5.401 2.850 1 U 3.11e+06 0 e 0 157 161 162 1492 36.021 2.854 5.409 1 U 4.41e+06 0 e 0 158 162 161 1493 35.827 2.977 5.410 1 U 4.24e+06 0 e 0 158 163 161 1494 31.606 1.810 4.169 1 U 1.48e+07 0 e 0 0 0 0 1495 61.608 3.971 3.979 1 U 1.63e+07 0 e 0 0 0 0 1496 29.327 0.610 0.618 1 U 1.02e+07 0 e 0 104 109 109 1497 29.239 0.616 3.816 1 U 3.22e+06 0 e 0 104 109 107 1498 29.548 0.614 1.618 1 U 2.58e+06 0 e 0 104 109 108 1499 29.299 0.613 0.669 1 U 1.83e+07 0 e 0 104 109 111 1500 61.934 0.665 4.022 1 U 4.64e+06 0 e 0 0 0 0 1501 61.846 0.683 3.820 1 U 2.15e+06 0 e 0 0 0 0 1502 29.290 0.652 3.816 1 U 3.04e+06 0 e 0 0 0 0 1503 29.427 0.652 0.672 1 U 1.43e+07 0 e 0 0 0 0 1504 29.188 1.558 0.618 1 U 1.47e+07 0 e 0 104 110 112 1505 29.401 1.549 3.812 1 U 1.84e+06 0 e 0 104 110 107 1506 28.908 0.622 2.895 1 U 1.79e+06 0 e 0 0 0 0 1507 63.229 3.814 0.616 1 U 2.82e+07 0 e 0 101 107 109 1508 37.360 1.624 1.566 1 U 6.7e+06 0 e 0 102 108 110 1509 17.981 0.615 1.554 1 U 9.69e+06 0 e 0 105 112 110 1510 7.123 0.393 0.775 1 U 1.12e+07 0 e 0 330 338 336 1511 6.978 0.394 0.998 1 U 4.77e+06 0 e 0 330 338 339 1512 7.114 0.392 1.080 1 U 1.19e+07 0 e 0 330 338 337 1513 26.306 0.779 0.391 1 U 1.58e+07 0 e 0 331 336 338 1514 26.343 1.086 0.390 1 U 1.39e+07 0 e 0 331 337 338 1515 49.247 3.564 3.578 1 U 5.66e+06 0 e 0 4 10 10 1516 49.270 3.324 3.574 1 U 4.91e+06 0 e 0 4 9 10 1517 49.269 3.576 3.324 1 U 3.71e+06 0 e 0 4 10 9 1518 49.338 3.340 3.342 1 U 3.24e+06 0 e 0 4 9 9 1519 49.314 3.566 2.337 1 U 4.08e+06 0 e 0 4 10 8 1520 49.152 3.325 2.069 1 U 5.25e+06 0 e 0 4 9 12 1521 49.323 3.568 2.067 1 U 7.41e+06 0 e 0 4 10 12 1522 49.322 3.318 1.744 1 U 4.67e+06 0 e 0 4 9 11 1523 49.364 3.567 1.749 1 U 6.72e+06 0 e 0 4 10 11 1524 33.228 2.267 5.387 1 U 5.75e+06 0 e 0 3 7 6 1525 33.410 2.340 5.379 1 U 5.95e+06 0 e 0 3 8 6 1526 25.987 2.069 3.565 1 U 5.24e+06 0 e 0 5 12 10 1527 25.943 1.745 3.576 1 U 5.42e+06 0 e 0 5 11 10 1528 25.976 2.063 3.329 1 U 4.72e+06 0 e 0 5 12 9 1529 26.111 1.745 3.321 1 U 3.77e+06 0 e 0 5 11 9 1530 26.014 2.067 2.341 1 U 6.67e+06 0 e 0 5 12 8 1531 26.016 1.739 2.342 1 U 4.95e+06 0 e 0 5 11 8 1532 25.991 2.071 2.065 1 U 4.23e+06 0 e 0 5 12 12 1533 25.858 1.745 2.057 1 U 3.14e+06 0 e 0 5 11 12 1534 25.967 2.062 1.744 1 U 4.14e+06 0 e 0 5 12 11 1535 62.049 5.375 2.051 1 U 3.43e+06 0 e 0 2 6 12 1536 61.802 5.392 2.266 1 U 5.49e+06 0 e 0 2 6 7 1537 61.790 5.386 2.337 1 U 6.61e+06 0 e 0 2 6 8 1538 40.907 1.446 4.386 1 U 5.24e+06 0 e 0 59 65 64 1539 41.410 2.579 4.575 1 U 7.91e+06 0 e 0 0 0 0 1540 24.516 0.639 2.578 1 U 5.71e+06 0 e 0 61 69 66 1541 24.422 0.640 4.391 1 U 2.72e+06 0 e 0 0 0 0 1542 24.676 0.635 1.441 1 U 1.06e+07 0 e 0 61 69 65 1543 30.992 2.077 4.234 1 U 3.37e+06 0 e 0 0 0 0 1544 30.743 2.017 4.242 1 U 4.2e+06 0 e 0 0 0 0 1545 30.460 2.015 4.245 1 U 4.21e+06 0 e 0 0 0 0 1546 30.899 2.008 2.007 1 U 1.84e+07 0 e 0 116 120 120 1547 37.250 2.107 4.239 1 U 5.17e+06 0 e 0 117 123 119 1548 37.526 2.002 4.235 1 U 4.71e+06 0 e 0 117 122 119 1549 63.643 3.587 3.983 1 U 3.63e+07 0 e 0 179 183 181 1550 63.643 3.487 3.982 1 U 3.39e+07 0 e 0 179 182 181 1551 39.541 2.037 4.569 1 U 2.63e+06 0 e 0 265 268 267 1552 26.193 1.725 4.179 1 U 2.88e+06 0 e 0 0 0 0 1553 26.887 1.673 4.930 1 U 1.98e+06 0 e 0 0 0 0 1554 27.818 0.511 4.923 1 U 1.77e+05 0 e 0 1453 1461 1457 1555 42.144 1.420 1.421 1 U 1.7e+07 0 e 0 315 321 321 1556 42.272 1.421 1.117 1 U 4.64e+06 0 e 0 315 321 323 1557 26.972 1.127 1.423 1 U 9.53e+06 0 e 0 317 323 321 1558 27.389 1.133 1.836 1 U 6.43e+06 0 e 0 0 0 0 1559 26.655 1.113 4.028 1 U 6.21e+06 0 e 0 317 323 320 1560 56.856 4.947 0.390 1 U 3.22e+06 0 e 0 328 334 338 1561 56.796 4.950 0.996 1 U 9.82e+06 0 e 0 328 334 339 1562 56.785 4.951 1.411 1 U 7.75e+06 0 e 0 328 334 335 1563 6.999 0.390 1.411 1 U 8.02e+06 0 e 0 330 338 335 1564 7.040 0.387 1.367 1 U 4.45e+06 0 e 0 0 0 0 1565 33.095 1.420 1.412 1 U 1.07e+07 0 e 0 329 335 335 1566 25.795 0.771 1.815 1 U 4.24e+06 0 e 0 0 0 0 1567 25.839 0.767 1.792 1 U 6.52e+06 0 e 0 431 439 436 1568 26.185 1.015 1.741 1 U 1.13e+07 0 e 0 583 591 587 1569 37.835 2.694 4.393 1 U 4.51e+06 0 e 0 0 0 0 1570 56.690 4.500 2.027 1 U 3.24e+06 0 e 0 357 361 362 1571 56.647 4.502 2.975 1 U 5.11e+06 0 e 0 357 361 363 1572 56.529 4.503 4.508 1 U 9.65e+06 0 e 0 0 0 0 1573 56.477 4.493 2.384 1 U 2.78e+06 0 e 0 0 0 0 1574 38.606 2.630 2.645 1 U 5.12e+06 0 e 0 359 365 365 1575 38.297 2.370 2.030 1 U 3.51e+06 0 e 0 0 0 0 1576 38.117 2.375 2.058 1 U 5.33e+06 0 e 0 0 0 0 1577 40.132 2.804 4.525 1 U 3.32e+06 0 e 0 381 387 383 1578 53.753 4.530 1.428 1 U 8.48e+06 0 e 0 428 434 437 1579 53.545 4.539 1.460 1 U 7.33e+06 0 e 0 0 0 0 1580 41.635 1.800 4.529 1 U 2.56e+06 0 e 0 0 0 0 1581 42.358 1.792 1.435 1 U 2.94e+06 0 e 0 0 0 0 1582 56.202 4.344 1.838 1 U 1.57e+07 0 e 0 0 0 0 1583 64.852 4.047 2.263 1 U 1.33e+07 0 e 0 525 529 530 1584 64.824 4.050 2.917 1 U 1.34e+07 0 e 0 525 529 531 1585 15.990 4.135 1.270 1 U 1.37e+07 0 e 0 0 0 0 1586 16.106 4.070 1.265 1 U 5.91e+06 0 e 0 0 0 0 1587 38.326 3.010 3.904 1 U 5.01e+06 0 e 0 0 0 0 1588 38.339 3.163 3.903 1 U 6e+06 0 e 0 0 0 0 1589 38.148 2.905 4.053 1 U 1.41e+07 0 e 0 526 531 529 1590 38.135 2.961 4.003 1 U 6.12e+06 0 e 0 0 0 0 1591 38.163 2.261 4.055 1 U 1.1e+07 0 e 0 526 530 529 1592 38.128 2.254 2.916 1 U 3.24e+06 0 e 0 526 530 531 1593 38.333 2.896 2.257 1 U 2.62e+06 0 e 0 526 531 530 1594 26.830 1.367 3.166 1 U 4.07e+06 0 e 0 774 781 780 1595 26.583 1.375 2.602 1 U 3.83e+06 0 e 0 774 781 779 1596 34.565 2.275 3.794 1 U 2.8e+06 0 e 0 0 0 0 1597 36.650 2.321 1.869 1 U 3.65e+06 0 e 0 0 0 0 1598 36.212 2.318 2.088 1 U 1.81e+07 0 e 0 0 0 0 1599 32.633 1.863 3.717 1 U 3.34e+06 0 e 0 0 0 0 1600 30.206 1.872 3.732 1 U 7.83e+06 0 e 0 0 0 0 1601 29.692 2.017 3.719 1 U 5.85e+06 0 e 0 0 0 0 1602 29.735 2.087 3.722 1 U 6.35e+06 0 e 0 0 0 0 1603 29.747 2.018 2.087 1 U 3.66e+06 0 e 0 0 0 0 1604 30.101 2.098 2.018 1 U 4.35e+06 0 e 0 0 0 0 1605 29.636 2.096 1.994 1 U 3.45e+06 0 e 0 0 0 0 1606 53.111 4.633 2.434 1 U 1.74e+07 0 e 0 875 878 879 1607 53.404 4.512 2.831 1 U 9.11e+06 0 e 0 0 0 0 1608 63.031 2.830 4.521 1 U 2.67e+06 0 e 0 900 904 902 1609 38.824 1.832 1.418 1 U 7.54e+06 0 e 0 0 0 0 1610 38.643 1.836 1.139 1 U 7.01e+06 0 e 0 0 0 0 1611 38.650 1.835 0.776 1 U 1.15e+07 0 e 0 0 0 0 1612 38.894 1.841 0.665 1 U 3.54e+06 0 e 0 0 0 0 1613 40.535 1.513 1.685 1 U 2.84e+06 0 e 0 0 0 0 1614 40.786 1.690 1.525 1 U 5.42e+06 0 e 0 1466 1473 1472 1615 40.908 1.516 0.887 1 U 1.36e+07 0 e 0 0 0 0 1616 40.873 1.699 0.889 1 U 1.44e+07 0 e 0 0 0 0 1617 40.619 1.712 0.829 1 U 1.78e+07 0 e 0 0 0 0 1618 55.783 4.642 1.495 1 U 2.95e+06 0 e 0 0 0 0 1619 54.956 4.645 1.718 1 U 5.15e+06 0 e 0 0 0 0 1620 23.167 0.838 0.889 1 U 2.95e+08 0 e 0 0 0 0 1621 24.917 0.886 0.832 1 U 4.02e+08 0 e 0 0 0 0 1622 45.091 4.227 3.576 1 U 7.76e+06 0 e 0 1234 1237 1236 1623 45.113 3.586 3.592 1 U 9.09e+06 0 e 0 0 0 0 1624 13.038 0.745 1.437 1 U 1.91e+07 0 e 0 889 896 895 1625 12.954 0.751 1.850 1 U 9.4e+06 0 e 0 889 896 893 1626 39.854 1.855 0.709 1 U 1.91e+07 0 e 0 888 893 897 1627 39.878 1.851 0.740 1 U 1.02e+07 0 e 0 888 893 896 1628 59.237 4.573 0.708 1 U 1.31e+07 0 e 0 887 892 897 1629 59.538 4.549 0.754 1 U 4.08e+06 0 e 0 0 0 0 1630 59.553 4.527 0.864 1 U 3.37e+06 0 e 0 0 0 0 1631 59.193 4.420 0.705 1 U 6.19e+06 0 e 0 0 0 0 1632 59.320 4.571 1.846 1 U 4.43e+06 0 e 0 887 892 893 1633 17.318 0.707 1.757 1 U 7.34e+06 0 e 0 0 0 0 1634 17.377 0.730 4.161 1 U 6.52e+06 0 e 0 0 0 0 1635 17.110 0.710 1.437 1 U 8.71e+06 0 e 0 891 897 895 1636 12.383 0.701 1.247 1 U 1.38e+07 0 e 0 150 153 155 1637 12.292 0.704 1.919 1 U 7.11e+06 0 e 0 150 153 152 1638 12.243 0.703 4.155 1 U 2.21e+06 0 e 0 150 153 151 1639 38.238 1.916 0.752 1 U 7.63e+06 0 e 0 149 152 153 1640 38.304 1.916 0.711 1 U 1.48e+07 0 e 0 149 152 154 1641 38.360 1.917 1.918 1 U 5.75e+06 0 e 0 149 152 152 1642 38.061 1.903 1.253 1 U 2.41e+06 0 e 0 0 0 0 1643 38.314 1.909 4.161 1 U 6.75e+06 0 e 0 149 152 151 1644 19.735 1.302 1.300 1 U 1.46e+08 0 e 0 0 0 0 1645 53.166 4.835 1.290 1 U 9.06e+06 0 e 0 1479 1485 1486 1646 22.356 0.504 1.522 1 U 2.69e+06 0 e 0 0 0 0 1647 24.649 0.899 4.338 1 U 7.3e+06 0 e 0 0 0 0 1648 25.010 0.871 4.169 1 U 1.34e+07 0 e 0 0 0 0 1649 41.541 2.591 2.587 1 U 1.24e+07 0 e 0 0 0 0 1650 41.269 2.627 2.529 1 U 2.17e+06 0 e 0 0 0 0 1651 23.158 1.269 4.132 1 U 1.03e+07 0 e 0 0 0 0 1652 23.169 1.267 4.078 1 U 1.64e+07 0 e 0 0 0 0 1653 15.472 4.149 4.152 1 U 9.25e+06 0 e 0 0 0 0 1654 15.472 4.127 4.129 1 U 1.32e+07 0 e 0 0 0 0 1655 15.472 4.115 4.108 1 U 1.4e+07 0 e 0 0 0 0 1656 44.498 3.078 1.239 1 U 3.66e+06 0 e 0 0 0 0 1657 44.633 3.004 1.246 1 U 3.25e+06 0 e 0 0 0 0 1658 44.650 3.001 1.565 1 U 5.84e+06 0 e 0 0 0 0 1659 44.992 3.014 1.798 1 U 2.63e+06 0 e 0 0 0 0 1660 34.398 1.805 1.589 1 U 1.35e+07 0 e 0 0 0 0 1661 44.281 2.172 4.121 1 U 5.28e+06 0 e 0 341 344 343 1662 44.343 2.481 4.113 1 U 6.68e+06 0 e 0 341 345 343 1663 29.133 1.346 1.045 1 U 1.14e+07 0 e 0 0 0 0 1664 29.177 1.341 1.338 1 U 1.96e+07 0 e 0 0 0 0 1665 29.321 1.358 1.380 1 U 1.83e+07 0 e 0 0 0 0 1666 29.117 1.338 1.529 1 U 1.14e+07 0 e 0 0 0 0 1667 33.378 1.532 1.055 1 U 1.15e+07 0 e 0 0 0 0 1668 33.320 1.413 1.051 1 U 5.84e+06 0 e 0 0 0 0 1669 33.500 1.539 0.852 1 U 3.68e+06 0 e 0 0 0 0 1670 33.196 1.406 0.851 1 U 3.52e+06 0 e 0 0 0 0 1671 24.823 1.053 1.412 1 U 6.22e+06 0 e 0 0 0 0 1672 24.604 1.052 1.338 1 U 1.08e+07 0 e 0 0 0 0 1673 24.628 1.049 1.358 1 U 1.04e+07 0 e 0 0 0 0 1674 24.865 1.058 2.585 1 U 5.68e+06 0 e 0 0 0 0 1675 24.713 1.053 2.639 1 U 1.48e+07 0 e 0 0 0 0 1676 24.749 1.061 1.534 1 U 1.29e+07 0 e 0 0 0 0 1677 24.490 1.048 0.913 1 U 1.16e+07 0 e 0 0 0 0 1678 41.849 2.643 1.052 1 U 1.54e+07 0 e 0 0 0 0 1679 41.964 2.650 0.844 1 U 5.29e+06 0 e 0 0 0 0 1680 41.913 2.649 1.531 1 U 4.87e+06 0 e 0 0 0 0 1681 41.281 2.667 4.565 1 U 1.14e+07 0 e 0 0 0 0 1682 41.406 2.677 4.032 1 U 7e+06 0 e 0 0 0 0 1683 41.796 2.643 1.425 1 U 3.5e+06 0 e 0 0 0 0 1684 41.796 2.651 1.376 1 U 2.65e+07 0 e 0 0 0 0 1685 26.343 0.637 1.112 1 U 3.75e+06 0 e 0 317 322 323 1686 26.547 0.641 4.022 1 U 5.13e+06 0 e 0 317 322 320 1687 21.173 0.972 3.991 1 U 9.27e+06 0 e 0 0 0 0 1688 21.297 0.966 4.033 1 U 3.62e+06 0 e 0 0 0 0 1689 20.760 0.953 3.950 1 U 3.26e+06 0 e 0 0 0 0 1690 31.068 1.851 4.083 1 U 7.1e+06 0 e 0 0 0 0 1691 31.167 2.001 4.085 1 U 1.6e+07 0 e 0 0 0 0 1692 41.660 1.360 1.564 1 U 3.09e+06 0 e 0 0 0 0 1693 41.517 1.585 1.352 1 U 3.17e+06 0 e 0 0 0 0 1694 38.819 2.733 2.737 1 U 9.47e+06 0 e 0 0 0 0 1695 38.752 2.721 4.592 1 U 5.13e+06 0 e 0 0 0 0 1696 39.012 2.778 2.782 1 U 1.23e+07 0 e 0 0 0 0 1697 27.219 0.848 1.862 1 U 2.33e+06 0 e 0 0 0 0 1698 27.285 0.857 1.441 1 U 2.35e+06 0 e 0 0 0 0 1699 25.394 5.250 0.366 1 U 4.33e+06 0 e 0 0 0 0 1700 17.160 3.625 4.172 1 U 4.66e+06 0 e 0 0 0 0 1701 16.818 3.623 3.946 1 U 5.05e+06 0 e 0 0 0 0 1702 17.110 3.779 3.948 1 U 6.13e+06 0 e 0 0 0 0 1703 16.804 3.755 4.150 1 U 7.39e+06 0 e 0 0 0 0 1704 16.614 3.772 4.124 1 U 9.05e+06 0 e 0 0 0 0 1705 39.255 2.405 3.007 1 U 2.82e+06 0 e 0 0 0 0 1706 20.718 0.914 4.111 1 U 1.28e+07 0 e 0 0 0 0 1707 20.790 0.900 4.066 1 U 1.2e+07 0 e 0 0 0 0 1708 20.597 0.933 4.232 1 U 7.85e+06 0 e 0 0 0 0 1709 20.055 1.491 4.134 1 U -1.04e+07 0 e 0 0 0 0 1710 19.965 1.169 5.164 1 U 2.27e+06 0 e 0 0 0 0 1711 21.595 3.995 4.206 1 U 5.15e+06 0 e 0 0 0 0 1712 20.995 3.990 0.969 1 U 4.64e+06 0 e 0 0 0 0 1713 20.998 3.985 3.996 1 U 8.55e+06 0 e 0 0 0 0 1714 55.483 4.241 0.830 1 U 1.05e+07 0 e 0 0 0 0 1715 33.775 2.343 2.086 1 U 1.71e+07 0 e 0 0 0 0 1716 33.616 2.351 2.001 1 U 1.92e+07 0 e 0 0 0 0 1717 33.260 2.318 1.742 1 U 6.33e+06 0 e 0 0 0 0 1718 33.761 2.345 4.338 1 U 1.04e+07 0 e 0 0 0 0 1719 33.383 2.372 3.796 1 U 3.98e+06 0 e 0 0 0 0 1720 33.369 2.404 3.842 1 U 3.82e+06 0 e 0 0 0 0 1721 33.084 2.153 0.975 1 U 1.33e+07 0 e 0 0 0 0 1722 33.745 1.790 1.652 1 U 1.85e+07 0 e 0 0 0 0 1723 33.659 1.796 1.567 1 U 1.42e+07 0 e 0 0 0 0 1724 33.667 1.837 1.423 1 U 9.36e+06 0 e 0 0 0 0 1725 33.863 1.785 1.363 1 U 1.55e+07 0 e 0 0 0 0 1726 33.778 1.788 1.788 1 U 9.98e+06 0 e 0 0 0 0 1727 33.853 1.776 1.777 1 U 9.09e+06 0 e 0 0 0 0 1728 33.320 1.716 1.648 1 U 1.77e+07 0 e 0 0 0 0 1729 33.251 1.720 1.389 1 U 1.02e+07 0 e 0 0 0 0 1730 33.435 1.422 1.382 1 U 9.95e+06 0 e 0 0 0 0 1731 33.768 1.681 4.142 1 U 8.7e+06 0 e 0 0 0 0 1732 33.848 1.784 4.145 1 U 8.47e+06 0 e 0 0 0 0 1733 33.050 1.821 4.330 1 U 5.9e+06 0 e 0 0 0 0 1734 33.029 1.717 4.286 1 U 9.38e+06 0 e 0 0 0 0 1735 33.488 1.788 4.432 1 U 4.24e+06 0 e 0 0 0 0 1736 54.749 4.478 2.799 1 U 1.58e+07 0 e 0 0 0 0 1737 27.887 0.841 -0.514 1 U 2.89e+06 0 e 0 0 0 0 1738 27.846 0.858 0.363 1 U 4.65e+06 0 e 0 0 0 0 1739 25.941 0.712 1.654 1 U 2e+07 0 e 0 0 0 0 1740 26.011 0.714 4.397 1 U 3.32e+06 0 e 0 1219 1225 1223 1741 40.319 1.664 4.404 1 U 4.18e+06 0 e 0 1218 1228 1223 1742 40.006 3.185 2.952 1 U 3.98e+06 0 e 0 0 0 0 1743 40.222 2.935 3.176 1 U 4.67e+06 0 e 0 0 0 0 1744 43.240 3.047 1.394 1 U 1.01e+07 0 e 0 0 0 0 1745 45.579 4.183 3.706 1 U 4.87e+06 0 e 0 0 0 0 1746 15.472 3.905 4.567 1 U 4.94e+06 0 e 0 0 0 0 1747 15.687 3.879 4.535 1 U 5.45e+06 0 e 0 0 0 0 1748 26.700 1.510 4.998 1 U 3.43e+06 0 e 0 0 0 0 1749 26.703 1.460 0.125 1 U 2.59e+07 0 e 0 0 0 0 1750 38.990 2.380 2.002 1 U 2.85e+06 0 e 0 0 0 0 1751 38.859 2.636 2.023 1 U 3.05e+06 0 e 0 0 0 0 1752 53.890 4.931 1.868 1 U 1.22e+07 0 e 0 0 0 0 1753 26.013 1.007 4.957 1 U 3.65e+06 0 e 0 0 0 0 1754 19.855 1.467 1.467 1 U 2.01e+08 0 e 0 0 0 0 1755 57.326 4.027 1.624 1 U 1.74e+07 0 e 0 0 0 0 1756 18.294 1.247 1.247 1 U 1.8e+08 0 e 0 0 0 0 1757 61.207 4.359 4.225 1 U 5.09e+07 0 e 0 0 0 0 1758 42.580 1.611 1.612 1 U 5.81e+07 0 e 0 0 0 0 1759 55.925 4.148 4.151 1 U 1.28e+08 0 e 0 0 0 0 1760 27.208 1.953 0.998 1 U 3.42e+07 0 e 0 0 0 0 1761 27.155 1.961 1.961 1 U 1.43e+07 0 e 0 0 0 0 1762 56.214 4.393 2.511 1 U 1.78e+07 0 e 0 0 0 0 1763 27.069 1.677 4.953 1 U 4.46e+06 0 e 0 0 0 0 1764 54.617 4.360 0.862 1 U 1.28e+07 0 e 0 0 0 0 1765 17.299 0.708 0.849 1 U 1.23e+07 0 e 0 0 0 0 1766 35.106 1.612 1.354 1 U 8.94e+06 0 e 0 0 0 0 1767 21.890 0.779 0.778 1 U 1.28e+08 0 e 0 0 0 0 1768 73.147 3.893 0.863 1 U 6.86e+06 0 e 0 0 0 0 1769 32.536 2.011 5.275 1 U 3.29e+06 0 e 0 0 0 0 1770 32.511 1.415 5.280 1 U 4.37e+06 0 e 0 0 0 0 1771 31.523 2.006 2.125 1 U 9.54e+06 0 e 0 0 0 0 1772 43.361 3.113 4.978 1 U 4.88e+06 0 e 0 0 0 0 1773 21.398 1.426 1.424 1 U 3.55e+07 0 e 0 0 0 0 1774 30.838 1.879 2.050 1 U 1.84e+07 0 e 0 1553 1556 1557 1775 31.157 2.053 1.879 1 U 1.87e+07 0 e 0 0 0 0 1776 24.147 0.932 3.943 1 U 5.11e+07 0 e 0 1543 1550 1546 1777 26.430 1.674 3.943 1 U 5.08e+07 0 e 0 1545 1549 1546 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . CO 13 CO . . 20 ppm . . . . . . 28058 5 2 . . N 15 NH . . 30 ppm . . . . . . 28058 5 3 . . HN 1 HN . . 14 ppm . . . . . . 28058 5 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $SPARKY . . 28058 5 stop_ save_ save_spectral_peak_list_6 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_6 _Spectral_peak_list.Entry_ID 28058 _Spectral_peak_list.ID 6 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 6 _Spectral_peak_list.Experiment_name '3D 1H-13C NOESY aromatic' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 3 1 10.085 124.282 7.066 1 U 4.09e+06 0 e 0 809 799 808 2 7.076 124.263 7.077 1 U 2.01e+07 0 e 0 808 799 808 3 5.647 124.256 7.070 1 U 5.84e+06 0 e 0 805 799 808 4 2.500 124.744 7.071 1 U 4.06e+06 0 e 0 0 0 0 5 10.086 113.535 7.007 1 U 3.2e+06 0 e 0 809 802 812 6 7.001 113.263 7.005 1 U 4.23e+07 0 e 0 812 802 812 7 7.267 113.046 7.010 1 U 7.33e+06 0 e 0 811 802 812 8 6.754 113.162 7.013 1 U 3.24e+06 0 e 0 813 802 812 9 1.428 133.597 6.267 1 U 1.22e+07 0 e 0 1139 1135 1142 10 1.975 133.495 6.268 1 U 1.31e+07 0 e 0 1140 1135 1142 11 4.767 133.486 6.274 1 U 3.89e+06 0 e 0 1138 1135 1142 12 6.270 133.543 6.267 1 U 7.72e+07 0 e 0 1142 1135 1142 13 7.317 133.797 6.271 1 U 5.97e+06 0 e 0 1137 1135 1142 14 6.693 133.512 6.269 1 U 2.25e+07 0 e 0 1143 1135 1142 15 6.695 117.570 6.692 1 U 8.65e+07 0 e 0 1143 1136 1143 16 6.275 117.498 6.691 1 U 2.66e+07 0 e 0 1142 1136 1143 17 1.407 117.995 6.689 1 U 2.93e+06 0 e 0 1139 1136 1143 18 8.665 133.686 6.267 1 U 5.38e+06 0 e 0 0 0 0 19 9.376 133.612 6.277 1 U 2.63e+06 0 e 0 0 0 0 20 6.725 133.497 6.729 1 U 7.83e+07 0 e 0 1329 1322 1329 21 2.968 133.260 6.730 1 U 1.03e+07 0 e 0 1326 1322 1329 22 3.710 133.460 6.729 1 U 8.97e+06 0 e 0 1327 1322 1329 23 6.591 133.499 6.730 1 U 2.1e+07 0 e 0 1330 1322 1329 24 8.954 133.591 6.731 1 U 9.11e+06 0 e 0 1335 1322 1329 25 5.243 133.310 6.730 1 U 5.53e+06 0 e 0 1325 1322 1329 26 0.680 133.438 6.731 1 U 1.61e+07 0 e 0 0 0 0 27 0.911 133.410 6.730 1 U 4.42e+06 0 e 0 0 0 0 28 0.298 133.509 6.721 1 U 4.04e+06 0 e 0 0 0 0 29 -0.074 133.266 6.732 1 U 5.29e+06 0 e 0 0 0 0 30 1.412 133.517 6.731 1 U 7.2e+06 0 e 0 0 0 0 31 1.590 133.516 6.726 1 U 2.93e+06 0 e 0 0 0 0 32 1.806 133.494 6.739 1 U 3.42e+06 0 e 0 0 0 0 33 2.181 133.565 6.743 1 U 5.03e+06 0 e 0 0 0 0 34 2.323 133.507 6.728 1 U 7.02e+06 0 e 0 0 0 0 35 6.589 117.831 6.593 1 U 2.43e+07 0 e 0 1330 1323 1330 36 6.704 117.729 6.609 1 U 1.24e+07 0 e 0 1329 1323 1330 37 8.906 117.872 6.591 1 U 4.6e+06 0 e 0 1335 1323 1330 38 0.681 118.055 6.607 1 U 3.97e+06 0 e 0 0 0 0 39 0.906 117.838 6.598 1 U 4.59e+06 0 e 0 0 0 0 40 1.430 117.801 6.590 1 U 4.39e+06 0 e 0 0 0 0 41 1.658 117.752 6.593 1 U 2.78e+06 0 e 0 0 0 0 42 4.846 133.618 6.728 1 U 2.62e+06 0 e 0 1336 1322 1329 43 7.098 133.325 7.098 1 U 2.05e+08 0 e 0 0 0 0 44 6.818 133.365 7.083 1 U 1.38e+07 0 e 0 0 0 0 45 6.801 118.299 6.799 1 U 2.78e+08 0 e 0 0 0 0 46 7.061 118.209 6.791 1 U 1.35e+07 0 e 0 0 0 0 47 6.806 132.753 6.811 1 U 1.37e+07 0 e 0 533 527 533 48 0.916 131.559 6.870 1 U 6.77e+06 0 e 0 0 0 0 49 3.072 131.600 6.869 1 U 5.61e+06 0 e 0 729 725 732 50 3.392 131.524 6.871 1 U 6.92e+06 0 e 0 730 725 732 51 3.711 131.420 6.873 1 U 3.51e+06 0 e 0 728 725 732 52 7.092 121.008 7.090 1 U 5.89e+08 0 e 0 0 0 0 53 7.092 120.251 7.089 1 U 5.89e+08 0 e 0 0 0 0 54 6.882 128.138 6.886 1 U 1.31e+07 0 e 0 0 0 0 55 6.869 131.514 6.870 1 U 4.33e+07 0 e 0 732 725 732 56 7.091 131.547 6.870 1 U 1.65e+07 0 e 0 733 725 732 57 6.870 124.676 6.866 1 U 3.18e+06 0 e 0 0 0 0 58 7.205 131.059 6.999 1 U 3.18e+07 0 e 0 482 474 481 59 6.998 131.213 7.000 1 U 8.36e+07 0 e 0 481 474 481 60 4.677 131.168 7.001 1 U 3.32e+06 0 e 0 0 0 0 61 4.735 131.207 6.998 1 U 3.57e+06 0 e 0 477 474 481 62 2.690 131.110 6.997 1 U 2.75e+06 0 e 0 478 474 481 63 3.019 131.233 7.005 1 U 2.11e+06 0 e 0 479 474 481 64 8.700 124.264 7.068 1 U 5.78e+06 0 e 0 821 799 808 65 6.999 131.509 7.215 1 U 3.14e+07 0 e 0 481 475 482 66 6.868 131.399 7.096 1 U 1.71e+07 0 e 0 732 726 733 67 4.288 131.449 7.096 1 U 2.5e+06 0 e 0 0 0 0 68 3.397 131.379 7.093 1 U 2.75e+06 0 e 0 730 726 733 69 3.064 131.301 7.089 1 U 2.35e+06 0 e 0 729 726 733 70 0.916 131.315 7.095 1 U 2.45e+06 0 e 0 0 0 0 71 0.298 131.131 7.099 1 U 4.07e+06 0 e 0 0 0 0 72 6.896 129.245 6.739 1 U 8.55e+06 0 e 0 0 0 0 73 6.747 129.211 6.742 1 U 1.49e+07 0 e 0 0 0 0 74 1.005 129.237 6.741 1 U 5.06e+06 0 e 0 0 0 0 75 0.634 129.130 6.740 1 U 4.97e+06 0 e 0 0 0 0 76 1.564 129.355 6.739 1 U 2.87e+06 0 e 0 0 0 0 77 6.773 128.594 6.898 1 U 5.05e+06 0 e 0 0 0 0 78 0.992 128.199 6.881 1 U 5.05e+06 0 e 0 0 0 0 79 7.460 124.539 7.208 1 U 8.04e+06 0 e 0 0 0 0 80 1.248 139.798 7.640 1 U 2.04e+07 0 e 0 0 0 0 81 1.629 139.728 7.640 1 U 2.77e+06 0 e 0 0 0 0 82 2.243 139.792 7.644 1 U 1.02e+07 0 e 0 0 0 0 83 2.891 139.795 7.640 1 U 1e+07 0 e 0 0 0 0 84 4.030 139.736 7.632 1 U 2.59e+06 0 e 0 497 509 515 85 4.240 139.767 7.650 1 U 6.83e+06 0 e 0 0 0 0 86 4.701 139.711 7.640 1 U 3.12e+06 0 e 0 0 0 0 87 6.693 139.860 7.642 1 U 6.16e+06 0 e 0 0 0 0 88 6.924 139.732 7.647 1 U 3.82e+06 0 e 0 514 509 515 89 7.318 139.786 7.635 1 U 5.12e+06 0 e 0 0 0 0 90 8.166 139.906 7.634 1 U 4.4e+06 0 e 0 0 0 0 91 8.718 139.807 7.643 1 U 1.41e+07 0 e 0 0 0 0 92 7.473 138.489 7.809 1 U 5.44e+06 0 e 0 0 0 0 93 7.475 137.654 7.477 1 U 2.83e+07 0 e 0 0 0 0 94 0.907 137.642 7.483 1 U 3.58e+06 0 e 0 0 0 0 95 7.124 122.150 7.579 1 U 3.5e+06 0 e 0 0 0 0 96 7.119 122.417 7.623 1 U 3.33e+06 0 e 0 0 0 0 97 5.734 120.946 7.070 1 U 3.89e+06 0 e 0 0 0 0 98 1.526 119.269 6.943 1 U 5.47e+06 0 e 0 0 0 0 99 1.305 119.434 6.944 1 U 4.06e+06 0 e 0 0 0 0 100 1.125 120.089 7.172 1 U 4.76e+06 0 e 0 0 0 0 101 0.968 119.992 7.166 1 U 3.55e+06 0 e 0 0 0 0 102 6.828 119.120 6.936 1 U 6.52e+06 0 e 0 0 0 0 103 7.096 119.285 6.940 1 U 6.04e+06 0 e 0 0 0 0 104 5.680 118.108 5.679 1 U 5.01e+07 0 e 0 0 0 0 105 7.796 118.121 5.676 1 U 7.55e+06 0 e 0 0 0 0 106 8.981 118.077 5.680 1 U 1.77e+07 0 e 0 0 0 0 107 3.762 118.119 5.680 1 U 1.72e+07 0 e 0 0 0 0 108 2.298 117.948 5.687 1 U 3.96e+06 0 e 0 0 0 0 109 4.626 118.077 5.678 1 U 1.19e+07 0 e 0 0 0 0 110 7.222 114.663 7.464 1 U 9.2e+06 0 e 0 0 0 0 111 7.465 114.615 7.465 1 U 1.19e+08 0 e 0 0 0 0 112 6.437 118.253 6.781 1 U 7.17e+06 0 e 0 0 0 0 113 7.371 117.893 6.781 1 U 3.62e+06 0 e 0 0 0 0 114 6.770 121.521 6.773 1 U 1.43e+07 0 e 0 813 803 813 115 7.265 121.121 6.768 1 U 2.46e+06 0 e 0 0 0 0 116 0.638 128.927 6.904 1 U 2.34e+06 0 e 0 0 0 0 117 7.287 119.394 6.937 1 U 4.3e+06 0 e 0 0 0 0 118 6.945 119.395 6.944 1 U 1.18e+08 0 e 0 514 508 514 119 7.619 129.715 7.246 1 U 6.87e+06 0 e 0 0 0 0 120 7.868 129.906 7.242 1 U 3.98e+06 0 e 0 0 0 0 121 3.985 133.838 6.743 1 U 3.11e+06 0 e 0 0 0 0 122 4.652 133.374 6.736 1 U 2.75e+06 0 e 0 0 0 0 123 8.954 133.591 6.731 1 U 9.11e+06 0 e 0 1324 1322 1329 124 6.163 113.083 7.004 1 U 2.71e+06 0 e 0 0 0 0 125 1.526 113.428 7.006 1 U 2.09e+06 0 e 0 0 0 0 126 4.519 113.176 7.007 1 U 3.81e+06 0 e 0 0 0 0 127 5.643 52.790 5.644 1 U 2.38e+07 0 e 0 805 797 805 128 5.077 113.114 5.651 1 U 3.83e+06 0 e 0 0 0 0 129 5.313 112.517 5.316 1 U 3.43e+07 0 e 0 0 0 0 130 4.800 112.493 5.315 1 U 3.71e+06 0 e 0 0 0 0 131 4.802 111.727 5.316 1 U -2.79e+06 0 e 0 0 0 0 132 2.875 112.663 5.313 1 U 3.73e+06 0 e 0 0 0 0 133 2.309 112.537 5.329 1 U 7.2e+06 0 e 0 0 0 0 134 8.772 112.473 5.323 1 U 1.19e+07 0 e 0 0 0 0 135 7.078 52.659 5.662 1 U 4.33e+06 0 e 0 808 797 805 136 8.686 52.772 5.641 1 U 1.15e+07 0 e 0 821 797 805 137 2.644 52.819 5.640 1 U 4.83e+06 0 e 0 806 797 805 138 0.481 113.037 5.648 1 U 4.24e+06 0 e 0 0 0 0 139 7.324 112.787 7.322 1 U 3.29e+06 0 e 0 0 0 0 140 6.181 114.598 6.157 1 U 6.03e+06 0 e 0 0 0 0 141 7.823 114.745 7.445 1 U 2.31e+06 0 e 0 0 0 0 142 7.645 117.685 6.691 1 U 3.3e+06 0 e 0 0 0 0 143 4.593 117.775 6.689 1 U 2.8e+06 0 e 0 0 0 0 144 4.729 117.501 6.689 1 U 2.5e+06 0 e 0 0 0 0 145 2.885 117.641 6.698 1 U 4.48e+06 0 e 0 531 1136 1143 146 2.112 117.570 6.693 1 U 4.35e+06 0 e 0 0 0 0 147 2.250 118.117 6.692 1 U 2.61e+06 0 e 0 530 1136 1143 148 2.249 117.267 6.686 1 U 3.68e+06 0 e 0 0 0 0 149 1.945 117.289 6.690 1 U 4.62e+06 0 e 0 0 0 0 150 6.249 118.086 6.781 1 U 3.63e+06 0 e 0 0 0 0 151 3.529 118.926 6.945 1 U 5.68e+06 0 e 0 513 508 514 152 6.996 119.821 6.996 1 U 1.26e+08 0 e 0 0 0 0 153 4.448 119.715 7.010 1 U 2.74e+06 0 e 0 0 0 0 154 0.780 119.979 7.166 1 U 1.89e+06 0 e 0 0 0 0 155 1.427 119.870 7.167 1 U 2.28e+06 0 e 0 0 0 0 156 6.814 120.060 7.164 1 U 2.41e+06 0 e 0 813 800 810 157 7.164 119.991 7.169 1 U 1.8e+07 0 e 0 810 800 810 158 6.797 120.746 6.797 1 U 9.69e+06 0 e 0 0 0 0 159 6.848 118.639 6.845 1 U 1.68e+08 0 e 0 0 0 0 160 7.597 120.815 7.588 1 U 1.91e+07 0 e 0 0 0 0 161 7.573 120.745 7.571 1 U 1.72e+07 0 e 0 0 0 0 162 0.907 120.423 8.012 1 U 1.95e+06 0 e 0 0 0 0 163 5.373 120.500 8.005 1 U 2.72e+06 0 e 0 0 0 0 164 7.138 122.025 7.692 1 U 2.48e+06 0 e 0 0 0 0 165 7.636 121.877 7.636 1 U 1.24e+07 0 e 0 0 0 0 166 7.665 121.823 7.671 1 U 8.86e+06 0 e 0 0 0 0 167 6.765 122.006 7.179 1 U 2.47e+06 0 e 0 0 0 0 168 7.186 124.836 7.463 1 U 3.87e+06 0 e 0 0 0 0 169 3.369 124.742 7.068 1 U 4.07e+06 0 e 0 0 0 0 170 4.399 124.666 7.078 1 U 2.53e+06 0 e 0 0 0 0 171 5.040 124.717 7.074 1 U 1.89e+06 0 e 0 0 0 0 172 7.280 125.992 7.322 1 U 9.09e+06 0 e 0 0 0 0 173 7.200 124.664 7.205 1 U 9.54e+07 0 e 0 0 0 0 174 5.642 125.136 7.106 1 U 2.39e+06 0 e 0 0 0 0 175 8.630 124.721 7.164 1 U 2.13e+06 0 e 0 0 0 0 176 6.850 124.904 7.184 1 U 2.23e+06 0 e 0 0 0 0 177 7.213 127.333 7.213 1 U 7.87e+07 0 e 0 0 0 0 178 -0.033 128.937 7.003 1 U 4.88e+06 0 e 0 0 0 0 179 0.864 129.391 6.996 1 U 2.73e+06 0 e 0 0 0 0 180 2.960 129.067 6.999 1 U 2.85e+06 0 e 0 163 159 164 181 2.637 129.527 7.002 1 U 2.38e+06 0 e 0 0 0 0 182 7.000 129.197 7.002 1 U 4.24e+07 0 e 0 164 159 164 183 6.894 129.216 6.896 1 U 1.07e+07 0 e 0 0 0 0 184 7.781 129.099 6.999 1 U 4.1e+06 0 e 0 0 0 0 185 6.777 130.678 6.947 1 U 7.05e+06 0 e 0 0 0 0 186 8.691 130.697 6.944 1 U 2.49e+06 0 e 0 0 0 0 187 4.034 130.658 6.956 1 U 3.24e+06 0 e 0 0 0 0 188 2.782 130.928 6.909 1 U 2.59e+06 0 e 0 0 0 0 189 1.651 130.828 6.958 1 U 5.62e+06 0 e 0 0 0 0 190 1.663 130.992 6.904 1 U 5.48e+06 0 e 0 0 0 0 191 1.004 130.977 6.890 1 U 4.04e+06 0 e 0 0 0 0 192 1.007 130.622 6.946 1 U 5.43e+06 0 e 0 0 0 0 193 0.636 130.737 6.948 1 U 3.58e+06 0 e 0 0 0 0 194 0.125 130.608 6.944 1 U 4.4e+06 0 e 0 0 0 0 195 1.437 130.929 6.904 1 U 3.34e+06 0 e 0 0 0 0 196 0.544 131.133 7.108 1 U 2.32e+06 0 e 0 0 0 0 197 6.903 129.642 7.241 1 U 6.35e+06 0 e 0 0 0 0 198 7.326 130.564 7.323 1 U 2.65e+08 0 e 0 0 0 0 199 7.267 129.595 7.262 1 U 3.38e+08 0 e 0 0 0 0 200 6.900 131.220 6.747 1 U 3.91e+06 0 e 0 0 0 0 201 6.719 131.368 6.726 1 U 6e+06 0 e 0 0 0 0 202 7.320 131.786 7.330 1 U 5.36e+08 0 e 0 0 0 0 203 6.559 131.653 7.349 1 U 5.05e+06 0 e 0 0 0 0 204 8.679 131.583 7.210 1 U 3.79e+06 0 e 0 0 0 0 205 7.694 131.995 7.316 1 U 5.48e+06 0 e 0 0 0 0 206 7.998 131.999 7.354 1 U 3.37e+06 0 e 0 0 0 0 207 7.637 131.698 7.219 1 U 8.12e+06 0 e 0 0 0 0 208 1.356 137.741 8.052 1 U 4.13e+06 0 e 0 0 0 0 209 8.079 137.569 8.077 1 U 7.57e+08 0 e 0 0 0 0 210 6.704 137.555 8.050 1 U 5.1e+06 0 e 0 0 0 0 211 -1.010 137.482 8.055 1 U 3.51e+06 0 e 0 0 0 0 212 9.473 137.539 8.048 1 U 3.76e+06 0 e 0 0 0 0 213 9.769 137.636 8.050 1 U 2.78e+06 0 e 0 0 0 0 214 10.356 137.733 8.099 1 U 2.05e+06 0 e 0 0 0 0 215 8.433 137.617 8.048 1 U 2.14e+07 0 e 0 0 0 0 216 7.842 139.188 7.845 1 U -5.62e+06 0 e 0 0 0 0 217 7.840 138.415 7.840 1 U 3.96e+08 0 e 0 0 0 0 218 8.026 137.868 8.025 1 U 1.49e+08 0 e 0 0 0 0 219 6.304 140.032 7.619 1 U 2.86e+06 0 e 0 0 0 0 220 7.080 131.531 7.079 1 U 7.22e+07 0 e 0 0 0 0 221 7.095 130.458 7.097 1 U 4.01e+07 0 e 0 0 0 0 222 3.807 128.776 7.002 1 U 1.84e+06 0 e 0 0 0 0 223 6.159 121.708 6.764 1 U 1.81e+06 0 e 0 0 0 0 224 0.962 121.664 6.766 1 U 3.91e+06 0 e 0 0 0 0 225 7.185 122.088 6.759 1 U 3.13e+06 0 e 0 810 803 813 226 5.391 118.458 6.781 1 U 1.91e+06 0 e 0 0 0 0 227 3.231 52.923 5.653 1 U 3.1e+06 0 e 0 807 797 805 228 9.544 52.819 5.642 1 U 1.89e+06 0 e 0 804 797 805 229 8.857 112.745 5.643 1 U 3.12e+06 0 e 0 0 0 0 230 1.746 112.923 5.638 1 U 3.42e+06 0 e 0 0 0 0 231 3.173 124.199 7.081 1 U 1.93e+06 0 e 0 0 0 0 232 2.680 124.502 7.064 1 U 1.98e+06 0 e 0 0 0 0 233 0.566 113.269 5.641 1 U 3.25e+06 0 e 0 0 0 0 234 2.646 119.805 7.155 1 U 2.01e+06 0 e 0 806 800 810 235 3.203 119.693 7.167 1 U 2.29e+06 0 e 0 807 800 810 236 7.274 125.757 7.286 1 U 7.25e+06 0 e 0 811 801 811 237 6.999 125.613 7.281 1 U 6.79e+06 0 e 0 812 801 811 238 6.742 125.640 7.281 1 U 4.08e+06 0 e 0 813 801 811 239 2.951 124.048 7.076 1 U 1.56e+06 0 e 0 0 0 0 240 2.829 113.539 7.008 1 U 2.47e+06 0 e 0 0 0 0 241 3.190 113.816 7.008 1 U 1.72e+06 0 e 0 0 0 0 242 3.194 112.906 7.010 1 U 1.27e+06 0 e 0 0 0 0 243 5.910 114.883 5.390 1 U 3.87e+06 0 e 0 0 0 0 244 5.397 114.954 5.394 1 U 1.59e+07 0 e 0 0 0 0 245 7.992 114.909 5.396 1 U 6.02e+06 0 e 0 165 0 0 246 8.730 115.023 5.402 1 U 2.1e+06 0 e 0 0 0 0 247 7.997 121.082 8.008 1 U 9.21e+06 0 e 0 165 160 165 248 5.871 129.423 7.005 1 U 2.65e+06 0 e 0 0 0 0 249 7.191 129.252 7.187 1 U 7.57e+07 0 e 0 0 0 0 250 3.523 119.490 6.940 1 U 5.94e+06 0 e 0 0 0 0 251 4.703 119.142 6.951 1 U 3.22e+06 0 e 0 0 0 0 252 4.608 119.216 6.944 1 U 2.26e+06 0 e 0 511 508 514 253 3.410 119.619 6.947 1 U 4e+06 0 e 0 0 0 0 254 7.638 139.789 7.640 1 U 1.46e+08 0 e 0 515 509 515 255 5.878 131.779 7.217 1 U 3.23e+06 0 e 0 0 0 0 256 5.594 131.718 7.211 1 U 1.69e+06 0 e 0 0 0 0 257 0.500 131.956 7.216 1 U 2.17e+06 0 e 0 0 0 0 258 2.811 128.605 6.999 1 U 3.28e+06 0 e 0 0 0 0 259 8.393 131.274 6.992 1 U 2.08e+06 0 e 0 476 474 481 260 4.708 131.406 7.213 1 U 2.03e+06 0 e 0 477 475 482 261 2.268 132.815 6.800 1 U 2.01e+06 0 e 0 530 527 533 262 4.044 132.868 6.799 1 U 2.16e+06 0 e 0 529 527 533 263 4.969 133.505 6.269 1 U 2.63e+06 0 e 0 0 0 0 264 5.255 133.676 6.276 1 U 3.07e+06 0 e 0 0 0 0 265 4.569 133.476 6.267 1 U 4.28e+06 0 e 0 0 0 0 266 4.188 133.631 6.270 1 U 3.06e+06 0 e 0 0 0 0 267 2.251 133.432 6.269 1 U 2.95e+06 0 e 0 530 1135 1142 268 2.923 133.323 6.266 1 U 3.44e+06 0 e 0 531 1135 1142 269 4.041 133.429 6.279 1 U 1.81e+06 0 e 0 529 1135 1142 270 8.782 133.164 6.825 1 U 2.15e+06 0 e 0 537 527 533 271 0.344 133.010 6.810 1 U 1.92e+06 0 e 0 0 0 0 272 8.497 133.017 7.056 1 U 2.31e+06 0 e 0 0 0 0 273 4.012 132.871 6.736 1 U 2.12e+06 0 e 0 0 0 0 274 2.838 129.776 7.003 1 U 2.03e+06 0 e 0 0 0 0 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . CO 13 CO . . 20 ppm . . . . . . 28058 6 2 . . N 15 NH . . 30 ppm . . . . . . 28058 6 3 . . HN 1 HN . . 14 ppm . . . . . . 28058 6 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $SPARKY . . 28058 6 stop_ save_ save_spectral_peak_list_7 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_7 _Spectral_peak_list.Entry_ID 28058 _Spectral_peak_list.ID 7 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 7 _Spectral_peak_list.Experiment_name '2D 1H-13C HSQC aromatic' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 2 1 113.281 6.991 1 U 5.2e+07 0 e 0 802 812 2 114.952 6.114 1 U 7.95e+06 0 e 0 0 0 3 117.515 6.675 1 U 1.55e+08 0 e 0 1136 1143 4 117.872 6.581 1 U 3.99e+07 0 e 0 1323 1330 5 118.281 6.781 1 U 9.7e+06 0 e 0 0 0 6 119.265 6.925 1 U -5.85e+07 0 e 0 508 514 7 120.030 7.152 1 U 3.99e+07 0 e 0 800 810 8 120.186 6.978 1 U -4.12e+06 0 e 0 0 0 9 120.838 7.029 1 U -4.87e+06 0 e 0 0 0 10 121.496 6.752 1 U 4.37e+07 0 e 0 803 813 11 121.167 8.015 1 U 1.99e+07 0 e 0 160 165 12 124.475 7.057 1 U -1.85e+07 0 e 0 799 808 13 125.757 7.277 1 U 1.24e+07 0 e 0 801 811 14 133.579 6.251 1 U 1.46e+08 0 e 0 1135 1142 15 133.513 6.716 1 U 1.32e+08 0 e 0 1322 1329 16 129.219 6.732 1 U 1.44e+07 0 e 0 0 0 17 129.266 6.999 1 U -1.34e+07 0 e 0 159 164 18 133.343 7.063 1 U 6.02e+06 0 e 0 0 0 19 129.284 7.178 1 U 2.59e+07 0 e 0 0 0 20 129.894 7.239 1 U 1.3e+07 0 e 0 0 0 21 130.303 7.302 1 U 3.49e+07 0 e 0 0 0 22 130.497 7.088 1 U 6.42e+06 0 e 0 0 0 23 130.617 6.886 1 U 3.45e+07 0 e 0 0 0 24 131.031 6.932 1 U 5.38e+07 0 e 0 0 0 25 131.498 6.988 1 U 8.21e+07 0 e 0 474 481 26 131.454 6.854 1 U 1.26e+07 0 e 0 725 732 27 131.673 7.076 1 U 2.12e+07 0 e 0 726 733 28 132.129 7.208 1 U 9.7e+07 0 e 0 0 0 29 132.104 7.265 1 U 4.45e+07 0 e 0 0 0 30 131.150 7.202 1 U 2.47e+07 0 e 0 0 0 31 131.532 7.291 1 U 3.22e+07 0 e 0 0 0 32 131.712 7.339 1 U 5.86e+07 0 e 0 0 0 33 140.007 7.620 1 U 6e+07 0 e 0 509 515 34 137.748 7.435 1 U 1.14e+07 0 e 0 0 0 35 138.299 7.789 1 U 6.19e+07 0 e 0 0 0 36 138.047 7.958 1 U 2.73e+07 0 e 0 0 0 37 137.237 8.079 1 U 3.82e+06 0 e 0 0 0 38 131.958 7.236 1 U 3.94e+07 0 e 0 0 0 39 122.015 7.108 1 U 2.79e+06 0 e 0 0 0 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . CO 13 CO . . 20 ppm . . . . . . 28058 7 2 . . N 15 NH . . 30 ppm . . . . . . 28058 7 3 . . HN 1 HN . . 14 ppm . . . . . . 28058 7 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $SPARKY . . 28058 7 stop_ save_ save_spectral_peak_list_8 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_8 _Spectral_peak_list.Entry_ID 28058 _Spectral_peak_list.ID 8 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID . _Spectral_peak_list.Chem_shift_reference_label . _Spectral_peak_list.Experiment_ID 8 _Spectral_peak_list.Experiment_name '2D 1H-15N HSQC' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID . _Spectral_peak_list.Assigned_chem_shift_list_label . _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; # Number of dimensions 2 1 132.095 8.708 1 U 1.18e+07 0 e 0 1278 1275 2 129.584 9.116 1 U 1.24e+07 0 e 0 70 63 3 99.262 7.490 1 U -1.58e+07 0 e 0 213 210 4 129.221 9.535 1 U 7.3e+06 0 e 0 814 804 5 128.865 9.178 1 U 1.32e+07 0 e 0 1271 1264 6 128.528 8.736 1 U 8.05e+06 0 e 0 425 416 7 128.386 7.785 1 U 4.07e+06 0 e 0 918 910 8 128.132 9.821 1 U 1.89e+07 0 e 0 684 678 9 127.945 9.252 1 U 1.31e+07 0 e 0 1077 1069 10 127.946 8.727 1 U 2.62e+06 0 e 0 829 821 11 127.883 8.492 1 U 7.83e+06 0 e 0 714 711 12 127.786 8.356 1 U 2.91e+06 0 e 0 340 333 13 127.623 8.237 1 U 3.69e+06 0 e 0 852 845 14 127.400 8.393 1 U 1.18e+07 0 e 0 284 277 15 127.081 9.117 1 U 1.5e+07 0 e 0 1352 1346 16 126.796 9.338 1 U 1.63e+07 0 e 0 673 666 17 126.697 8.429 1 U 9.84e+06 0 e 0 1227 1222 18 126.613 7.773 1 U 8.65e+06 0 e 0 0 0 19 126.341 10.225 1 U 6.22e+06 0 e 0 448 445 20 126.294 8.650 1 U 1.45e+07 0 e 0 489 486 21 125.712 8.248 1 U 5.68e+06 0 e 0 1463 1456 22 125.568 8.489 1 U 4.07e+06 0 e 0 1491 1484 23 125.243 8.339 1 U 4.56e+06 0 e 0 191 188 24 125.194 8.922 1 U 8.76e+06 0 e 0 440 433 25 125.101 8.323 1 U 2.03e+07 0 e 0 1406 1403 26 124.776 8.823 1 U 4.16e+06 0 e 0 838 834 27 124.814 8.744 1 U 2.52e+06 0 e 0 540 537 28 124.278 9.010 1 U 2.06e+07 0 e 0 608 604 29 124.239 9.356 1 U 3.12e+06 0 e 0 34 31 30 124.228 8.022 1 U 1.99e+07 0 e 0 1109 1105 31 123.837 8.960 1 U 8.61e+06 0 e 0 270 266 32 123.683 7.342 1 U 7.11e+06 0 e 0 237 230 33 123.164 8.620 1 U 5.14e+06 0 e 0 927 924 34 122.988 8.061 1 U 2.65e+07 0 e 0 1131 1128 35 122.913 8.897 1 U 4.23e+06 0 e 0 980 971 36 122.687 9.258 1 U 4.74e+06 0 e 0 1477 1470 37 122.114 8.039 1 U 2.45e+07 0 e 0 731 727 38 121.781 8.251 1 U 2.53e+06 0 e 0 355 353 39 121.688 7.767 1 U 1.83e+07 0 e 0 1123 1116 40 121.569 9.384 1 U 1.75e+07 0 e 0 1301 1295 41 121.522 8.126 1 U 2.53e+07 0 e 0 1029 1023 42 121.455 5.906 1 U 2.32e+06 0 e 0 176 171 43 121.407 8.211 1 U 1.85e+07 0 e 0 1063 1056 44 121.258 7.125 1 U 2.29e+07 0 e 0 769 762 45 121.096 8.833 1 U 1.29e+07 0 e 0 783 775 46 121.088 7.754 1 U 1.26e+07 0 e 0 93 89 47 120.747 8.454 1 U 1.6e+07 0 e 0 1189 1183 48 120.189 9.115 1 U 5.57e+06 0 e 0 1317 1313 49 120.118 8.494 1 U 5.1e+06 0 e 0 224 219 50 119.979 8.538 1 U 1.16e+07 0 e 0 1206 1198 51 119.944 9.366 1 U 1.5e+07 0 e 0 1309 1306 52 119.952 8.681 1 U 8.68e+06 0 e 0 386 382 53 119.736 7.754 1 U 6.53e+06 0 e 0 1005 998 54 119.636 8.125 1 U 1.95e+07 0 e 0 561 554 55 119.644 8.867 1 U 7.62e+06 0 e 0 1449 1445 56 119.416 9.084 1 U 6.36e+06 0 e 0 795 790 57 119.432 7.352 1 U 2.37e+07 0 e 0 600 596 58 119.365 8.536 1 U 2.51e+07 0 e 0 707 703 59 119.259 8.960 1 U 1.8e+07 0 e 0 48 41 60 118.998 7.493 1 U 2.71e+07 0 e 0 699 696 61 118.983 8.381 1 U 2.65e+07 0 e 0 568 565 62 118.934 8.036 1 U 2.01e+07 0 e 0 633 629 63 118.896 9.209 1 U 1.49e+07 0 e 0 1100 1093 64 118.663 8.991 1 U 1.73e+07 0 e 0 1328 1324 65 118.554 7.008 1 U 5.49e+06 0 e 0 964 957 66 118.380 8.596 1 U 2.67e+07 0 e 0 1017 1011 67 118.369 8.386 1 U 1.73e+07 0 e 0 500 496 68 118.248 8.278 1 U 1.67e+07 0 e 0 1178 1173 69 118.148 8.371 1 U 1.35e+07 0 e 0 56 52 70 118.081 8.663 1 U 1.9e+07 0 e 0 1156 1150 71 118.048 7.054 1 U 1.89e+07 0 e 0 1041 1036 72 118.013 10.138 1 U 1.72e+07 0 e 0 644 638 73 117.962 8.109 1 U 1.73e+07 0 e 0 470 466 74 117.938 7.336 1 U 4.01e+07 0 e 0 1141 1137 75 117.895 8.598 1 U 4.06e+06 0 e 0 27 20 76 117.803 8.726 1 U 1.03e+07 0 e 0 79 75 77 117.735 8.843 1 U 4.32e+06 0 e 0 1257 1253 78 117.640 7.993 1 U 1.33e+07 0 e 0 950 944 79 117.604 7.721 1 U 8.77e+06 0 e 0 1246 1242 80 117.219 8.812 1 U 2.3e+07 0 e 0 1421 1413 81 117.208 7.762 1 U 1.78e+07 0 e 0 306 302 82 116.757 7.905 1 U 1.77e+07 0 e 0 619 613 83 116.693 9.550 1 U 1.4e+07 0 e 0 721 718 84 116.568 8.062 1 U 2.45e+07 0 e 0 592 585 85 116.574 7.998 1 U 1.99e+06 0 e 0 399 395 86 116.517 8.370 1 U 1.55e+07 0 e 0 480 476 87 116.484 7.519 1 U 3.24e+06 0 e 0 207 203 88 116.203 7.621 1 U 6.04e+06 0 e 0 199 195 89 116.137 7.139 1 U 7.65e+06 0 e 0 1289 1283 90 116.058 8.935 1 U 1.57e+07 0 e 0 1339 1335 91 115.972 6.746 1 U 2.98e+06 0 e 0 377 372 92 115.629 7.608 1 U 2.46e+07 0 e 0 692 689 93 115.608 7.800 1 U 1.92e+07 0 e 0 1435 1428 94 115.467 7.002 1 U 3.01e+07 0 e 0 577 573 95 85.228 7.276 1 U -3.79e+06 0 e 0 981 977 96 114.663 7.975 1 U 1.68e+07 0 e 0 755 751 97 114.477 8.037 1 U 2.87e+06 0 e 0 881 877 98 114.296 7.260 1 U 7.3e+06 0 e 0 326 319 99 113.992 7.791 1 U 2.81e+07 0 e 0 456 452 100 114.045 8.347 1 U 4.31e+06 0 e 0 145 140 101 113.735 9.420 1 U 2.09e+07 0 e 0 991 987 102 113.626 8.922 1 U 1.95e+07 0 e 0 1363 1359 103 113.466 7.977 1 U 6.49e+06 0 e 0 873 869 104 113.463 7.742 1 U 2.88e+07 0 e 0 659 652 105 113.414 7.320 1 U 1.08e+07 0 e 0 685 682 106 113.177 8.177 1 U 6.67e+06 0 e 0 134 130 107 113.155 7.660 1 U 1.09e+07 0 e 0 939 937 108 113.152 6.973 1 U 1.38e+07 0 e 0 939 936 109 113.158 8.609 1 U 1.35e+07 0 e 0 745 739 110 113.171 7.810 1 U 2.1e+07 0 e 0 292 288 111 112.598 6.806 1 U 3.76e+07 0 e 0 1190 1187 112 112.610 7.153 1 U 1.03e+07 0 e 0 620 617 113 112.555 10.198 1 U 1.55e+07 0 e 0 312 309 114 112.556 7.558 1 U 2.48e+07 0 e 0 1390 1386 115 112.398 6.834 1 U 1.59e+07 0 e 0 1525 1522 116 112.413 7.508 1 U 1.14e+07 0 e 0 1525 1523 117 112.246 7.751 1 U 5.49e+07 0 e 0 746 744 118 112.246 7.058 1 U 6.74e+07 0 e 0 746 743 119 112.235 7.533 1 U 9.07e+06 0 e 0 645 643 120 111.759 7.886 1 U 1.47e+07 0 e 0 863 857 121 111.711 7.527 1 U 3.99e+07 0 e 0 1078 1074 122 111.711 6.842 1 U 4.51e+07 0 e 0 1078 1073 123 111.772 8.139 1 U 2.06e+07 0 e 0 1399 1395 124 111.500 8.511 1 U 6.33e+06 0 e 0 938 932 125 111.409 9.419 1 U 1.5e+07 0 e 0 99 96 126 110.858 7.630 1 U 8.93e+06 0 e 0 1302 1298 127 110.693 7.311 1 U 1.03e+07 0 e 0 830 826 128 110.693 6.438 1 U 1.67e+07 0 e 0 830 825 129 109.554 7.868 1 U 1.72e+07 0 e 0 85 82 130 109.088 7.926 1 U 2.26e+07 0 e 0 1048 1045 131 109.064 8.216 1 U 2.46e+07 0 e 0 1086 1082 132 109.001 7.128 1 U 1.29e+07 0 e 0 516 510 133 108.024 8.223 1 U 1.77e+07 0 e 0 1381 1378 134 107.747 9.955 1 U 4.11e+06 0 e 0 522 519 135 107.773 7.420 1 U 1.62e+07 0 e 0 624 623 136 107.557 8.934 1 U 1.71e+07 0 e 0 1441 1438 137 107.344 7.554 1 U 1.57e+07 0 e 0 298 295 138 112.190 6.333 1 U 8.02e+06 0 e 0 864 861 139 123.039 8.406 1 U 6.28e+05 0 e 0 1505 1502 140 128.296 9.594 1 U 1.84e+06 0 e 0 905 901 141 133.591 9.868 1 U 8.06e+05 0 e 0 124 118 142 126.027 10.082 1 U 6.55e+05 0 e 0 815 809 143 117.623 7.824 1 U 2e+06 0 e 0 409 405 144 111.754 7.754 1 U 2.4e+06 0 e 0 746 744 145 112.190 7.879 1 U 6.73e+06 0 e 0 864 862 146 112.224 7.802 1 U 1.75e+06 0 e 0 620 618 147 115.110 7.705 1 U 2.83e+06 0 e 0 919 914 148 114.889 7.644 1 U 1.19e+06 0 e 0 366 360 149 107.066 7.232 1 U 2.96e+06 0 e 0 348 347 150 127.081 8.472 1 U 1.87e+06 0 e 0 147 146 151 120.757 8.119 1 U 1.23e+06 0 e 0 1539 1532 152 118.062 7.884 1 U 3.33e+06 0 e 0 0 0 153 113.020 8.962 1 U 9.87e+05 0 e 0 391 390 154 111.976 8.335 1 U 1.17e+06 0 e 0 0 0 155 112.094 6.809 1 U 2.55e+06 0 e 0 1190 1187 156 112.359 6.665 1 U 3.62e+07 0 e 0 645 642 157 111.731 7.060 1 U 2.96e+06 0 e 0 746 743 158 111.266 7.529 1 U 1.84e+06 0 e 0 1078 1074 159 111.178 6.844 1 U 2.29e+06 0 e 0 1078 1073 160 110.215 6.439 1 U 2.02e+06 0 e 0 830 825 161 110.636 6.932 1 U 5.68e+06 0 e 0 1375 1372 162 109.093 8.186 1 U 1.65e+07 0 e 0 462 459 163 117.957 7.320 1 U 3.11e+07 0 e 0 547 544 164 125.960 8.989 1 U 2.21e+06 0 e 0 1166 1162 165 119.402 9.103 1 U 6.91e+06 0 e 0 248 243 166 116.720 7.584 1 U 2.96e+06 0 e 0 1374 1368 167 124.950 8.532 1 U 6.14e+05 0 e 0 1498 1495 168 119.639 8.073 1 U 1.18e+06 0 e 0 1513 1509 169 123.738 8.781 1 U 2.12e+06 0 e 0 113 106 170 119.470 8.475 1 U 1.27e+06 0 e 0 1524 1518 171 112.097 7.543 1 U 2.84e+06 0 e 0 1190 1188 172 110.258 7.310 1 U 1.06e+06 0 e 0 830 826 173 115.988 10.443 1 U 3.81e+05 0 e 0 884 883 174 114.087 7.144 1 U 2.2e+06 0 e 0 0 0 175 122.804 8.138 1 U 7.48e+05 0 e 0 184 180 176 124.892 8.795 1 U 7.64e+06 0 e 0 346 342 177 119.937 8.165 1 U 1.06e+06 0 e 0 532 528 178 112.922 7.324 1 U 1.07e+06 0 e 0 685 682 179 112.723 7.663 1 U 1.04e+06 0 e 0 939 937 180 113.418 7.710 1 U 1.22e+07 0 e 0 685 683 181 112.661 6.976 1 U 1.21e+06 0 e 0 939 936 182 111.858 6.668 1 U 2.29e+06 0 e 0 645 642 183 115.065 8.910 1 U 4.32e+05 0 e 0 919 915 184 112.362 7.537 1 U 3.51e+07 0 e 0 1190 1188 185 111.120 6.348 1 U 1.27e+06 0 e 0 1247 1248 186 106.523 8.671 1 U 3.48e+05 0 e 0 1238 1235 187 114.434 6.913 1 U 7.25e+05 0 e 0 0 0 188 112.127 7.150 1 U 1.17e+06 0 e 0 620 617 189 112.611 7.798 1 U 9.83e+06 0 e 0 620 618 190 127.231 8.997 1 U 3.9e+05 0 e 0 1215 1211 191 110.858 6.832 1 U 3.63e+06 0 e 0 0 0 192 106.279 6.796 1 U 7.34e+05 0 e 0 0 0 193 107.979 8.622 1 U 3.4e+05 0 e 0 1230 1229 194 109.942 8.122 1 U 1.17e+06 0 e 0 0 0 195 110.641 7.688 1 U 2.56e+06 0 e 0 1375 1373 196 114.114 6.745 1 U 7.08e+05 0 e 0 0 0 197 113.242 6.931 1 U 4.8e+06 0 e 0 0 0 198 113.145 7.849 1 U 3.51e+06 0 e 0 0 0 199 111.725 6.330 1 U 1.14e+06 0 e 0 864 861 200 119.398 8.527 1 U 1.7e+07 0 e 0 262 254 201 125.685 8.308 1 U 3.01e+06 0 e 0 0 0 202 123.817 8.080 1 U 1.68e+06 0 e 0 0 0 203 115.987 7.033 1 U 9.43e+05 0 e 0 0 0 204 110.858 6.832 1 U 3.63e+06 0 e 0 1302 1297 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . H 1 HN . . 14 ppm . . . . . . 28058 8 2 . . N 15 NH . . 30 ppm . . . . . . 28058 8 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $SPARKY . . 28058 8 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_heteronuclear_noe_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_1 _Heteronucl_NOE_list.Entry_ID 28058 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Name . _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 850 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'peak height' _Heteronucl_NOE_list.NOE_ref_val 1 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 12 '2D NOE 15N,1H correlation' . . . 28058 1 stop_ loop_ _Heteronucl_NOE_software.Software_ID _Heteronucl_NOE_software.Software_label _Heteronucl_NOE_software.Method_ID _Heteronucl_NOE_software.Method_label _Heteronucl_NOE_software.Entry_ID _Heteronucl_NOE_software.Heteronucl_NOE_list_ID 1 $SPARKY . . 28058 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 2 2 LEU N N 15 . 1 1 2 2 LEU H H 1 0.8805866 0.0354547 . . . 416 LEU N . 416 LEU H 28058 1 2 . 1 1 3 3 ALA N N 15 . 1 1 3 3 ALA H H 1 0.7946128 0.0503637 . . . 417 ALA N . 417 ALA H 28058 1 3 . 1 1 4 4 LEU N N 15 . 1 1 4 4 LEU H H 1 0.8377503 0.009437 . . . 418 LEU N . 418 LEU H 28058 1 4 . 1 1 5 5 ASP N N 15 . 1 1 5 5 ASP H H 1 0.8523065 0.0112004 . . . 419 ASP N . 419 ASP H 28058 1 5 . 1 1 6 6 LEU N N 15 . 1 1 6 6 LEU H H 1 0.8607519 0.0131144 . . . 420 LEU N . 420 LEU H 28058 1 6 . 1 1 7 7 ASP N N 15 . 1 1 7 7 ASP H H 1 0.863331 0.0141697 . . . 421 ASP N . 421 ASP H 28058 1 7 . 1 1 8 8 GLY N N 15 . 1 1 8 8 GLY H H 1 0.7635928 0.0095081 . . . 422 GLY N . 422 GLY H 28058 1 8 . 1 1 9 9 ASP N N 15 . 1 1 9 9 ASP H H 1 0.8653283 0.0098369 . . . 423 ASP N . 423 ASP H 28058 1 9 . 1 1 10 10 GLY N N 15 . 1 1 10 10 GLY H H 1 0.8575234 0.0092702 . . . 424 GLY N . 424 GLY H 28058 1 10 . 1 1 11 11 ILE N N 15 . 1 1 11 11 ILE H H 1 0.8856858 0.0393996 . . . 425 ILE N . 425 ILE H 28058 1 11 . 1 1 12 12 GLU N N 15 . 1 1 12 12 GLU H H 1 0.9733842 0.2087781 . . . 426 GLU N . 426 GLU H 28058 1 12 . 1 1 13 13 THR N N 15 . 1 1 13 13 THR H H 1 0.8231403 0.021165 . . . 427 THR N . 427 THR H 28058 1 13 . 1 1 14 14 VAL N N 15 . 1 1 14 14 VAL H H 1 0.7878983 0.0397891 . . . 428 VAL N . 428 VAL H 28058 1 14 . 1 1 38 38 VAL N N 15 . 1 1 38 38 VAL H H 1 0.8416155 0.0670412 . . . 452 VAL N . 452 VAL H 28058 1 15 . 1 1 41 41 ASP N N 15 . 1 1 41 41 ASP H H 1 0.7863808 0.0241536 . . . 455 ASP N . 455 ASP H 28058 1 16 . 1 1 42 42 ASP N N 15 . 1 1 42 42 ASP H H 1 0.852414 0.0424423 . . . 456 ASP N . 456 ASP H 28058 1 17 . 1 1 43 43 GLY N N 15 . 1 1 43 43 GLY H H 1 0.8576315 0.0115206 . . . 457 GLY N . 457 GLY H 28058 1 18 . 1 1 44 44 LEU N N 15 . 1 1 44 44 LEU H H 1 0.8266693 0.0313218 . . . 458 LEU N . 458 LEU H 28058 1 19 . 1 1 45 45 LEU N N 15 . 1 1 45 45 LEU H H 1 0.8621986 0.0202375 . . . 459 LEU N . 459 LEU H 28058 1 20 . 1 1 48 48 ASP N N 15 . 1 1 48 48 ASP H H 1 0.8234711 0.0170657 . . . 462 ASP N . 462 ASP H 28058 1 21 . 1 1 49 49 LEU N N 15 . 1 1 49 49 LEU H H 1 0.6178912 0.0170619 . . . 463 LEU N . 463 LEU H 28058 1 22 . 1 1 50 50 ASN N N 15 . 1 1 50 50 ASN H H 1 0.8182217 0.0077193 . . . 464 ASN N . 464 ASN H 28058 1 23 . 1 1 51 51 GLY N N 15 . 1 1 51 51 GLY H H 1 0.8262796 0.0087283 . . . 465 GLY N . 465 GLY H 28058 1 24 . 1 1 52 52 ASN N N 15 . 1 1 52 52 ASN H H 1 0.8395934 0.0078965 . . . 466 ASN N . 466 ASN H 28058 1 25 . 1 1 53 53 GLY N N 15 . 1 1 53 53 GLY H H 1 0.8354729 0.0105841 . . . 467 GLY N . 467 GLY H 28058 1 26 . 1 1 54 54 ILE N N 15 . 1 1 54 54 ILE H H 1 0.8414706 0.0257301 . . . 468 ILE N . 468 ILE H 28058 1 27 . 1 1 55 55 ILE N N 15 . 1 1 55 55 ILE H H 1 0.8563489 0.0504387 . . . 469 ILE N . 469 ILE H 28058 1 28 . 1 1 59 59 ALA N N 15 . 1 1 59 59 ALA H H 1 0.8468062 0.0717824 . . . 473 ALA N . 473 ALA H 28058 1 29 . 1 1 60 60 GLU N N 15 . 1 1 60 60 GLU H H 1 0.9464396 0.0879043 . . . 474 GLU N . 474 GLU H 28058 1 30 . 1 1 61 61 LEU N N 15 . 1 1 61 61 LEU H H 1 0.8721319 0.044954 . . . 475 LEU N . 475 LEU H 28058 1 31 . 1 1 62 62 PHE N N 15 . 1 1 62 62 PHE H H 1 0.840746 0.0172589 . . . 476 PHE N . 476 PHE H 28058 1 32 . 1 1 64 64 ASP N N 15 . 1 1 64 64 ASP H H 1 0.7807047 0.055482 . . . 478 ASP N . 478 ASP H 28058 1 33 . 1 1 66 66 THR N N 15 . 1 1 66 66 THR H H 1 0.7308965 0.1229835 . . . 480 THR N . 480 THR H 28058 1 34 . 1 1 67 67 LYS N N 15 . 1 1 67 67 LYS H H 1 0.8823599 0.0269915 . . . 481 LYS N . 481 LYS H 28058 1 35 . 1 1 68 68 LEU N N 15 . 1 1 68 68 LEU H H 1 0.809332 0.023215 . . . 482 LEU N . 482 LEU H 28058 1 36 . 1 1 69 69 ALA N N 15 . 1 1 69 69 ALA H H 1 0.7764221 0.0303072 . . . 483 ALA N . 483 ALA H 28058 1 37 . 1 1 70 70 ASP N N 15 . 1 1 70 70 ASP H H 1 0.7978748 0.0062196 . . . 484 ASP N . 484 ASP H 28058 1 38 . 1 1 72 72 SER N N 15 . 1 1 72 72 SER H H 1 0.8168769 0.0068899 . . . 486 SER N . 486 SER H 28058 1 39 . 1 1 73 73 PHE N N 15 . 1 1 73 73 PHE H H 1 0.8225319 0.0092511 . . . 487 PHE N . 487 PHE H 28058 1 40 . 1 1 74 74 ALA N N 15 . 1 1 74 74 ALA H H 1 0.8587592 0.0136582 . . . 488 ALA N . 488 ALA H 28058 1 41 . 1 1 75 75 LYS N N 15 . 1 1 75 75 LYS H H 1 0.8303027 0.0112462 . . . 489 LYS N . 489 LYS H 28058 1 42 . 1 1 76 76 HIS N N 15 . 1 1 76 76 HIS H H 1 0.8278271 0.0162146 . . . 490 HIS N . 490 HIS H 28058 1 43 . 1 1 77 77 GLY N N 15 . 1 1 77 77 GLY H H 1 0.8609904 0.0347179 . . . 491 GLY N . 491 GLY H 28058 1 44 . 1 1 78 78 TYR N N 15 . 1 1 78 78 TYR H H 1 0.9826954 0.0881745 . . . 492 TYR N . 492 TYR H 28058 1 45 . 1 1 79 79 ALA N N 15 . 1 1 79 79 ALA H H 1 0.8262276 0.0654259 . . . 493 ALA N . 493 ALA H 28058 1 46 . 1 1 81 81 LEU N N 15 . 1 1 81 81 LEU H H 1 0.8494782 0.0080933 . . . 495 LEU N . 495 LEU H 28058 1 47 . 1 1 82 82 ALA N N 15 . 1 1 82 82 ALA H H 1 0.8474897 0.0072597 . . . 496 ALA N . 496 ALA H 28058 1 48 . 1 1 83 83 GLU N N 15 . 1 1 83 83 GLU H H 1 0.8408175 0.0064775 . . . 497 GLU N . 497 GLU H 28058 1 49 . 1 1 84 84 LEU N N 15 . 1 1 84 84 LEU H H 1 0.831319 0.0070111 . . . 498 LEU N . 498 LEU H 28058 1 50 . 1 1 85 85 ASP N N 15 . 1 1 85 85 ASP H H 1 0.8581553 0.0069158 . . . 499 ASP N . 499 ASP H 28058 1 51 . 1 1 86 86 SER N N 15 . 1 1 86 86 SER H H 1 0.7598815 0.0066389 . . . 500 SER N . 500 SER H 28058 1 52 . 1 1 87 87 ASN N N 15 . 1 1 87 87 ASN H H 1 0.8426 0.0066016 . . . 501 ASN N . 501 ASN H 28058 1 53 . 1 1 88 88 GLY N N 15 . 1 1 88 88 GLY H H 1 0.8287885 0.0077631 . . . 502 GLY N . 502 GLY H 28058 1 54 . 1 1 89 89 ASP N N 15 . 1 1 89 89 ASP H H 1 0.8432103 0.0059638 . . . 503 ASP N . 503 ASP H 28058 1 55 . 1 1 90 90 ASN N N 15 . 1 1 90 90 ASN H H 1 0.8501349 0.0088553 . . . 504 ASN N . 504 ASN H 28058 1 56 . 1 1 91 91 ILE N N 15 . 1 1 91 91 ILE H H 1 0.8759182 0.0063538 . . . 505 ILE N . 505 ILE H 28058 1 57 . 1 1 92 92 ILE N N 15 . 1 1 92 92 ILE H H 1 0.8343633 0.0090728 . . . 506 ILE N . 506 ILE H 28058 1 58 . 1 1 93 93 ASN N N 15 . 1 1 93 93 ASN H H 1 0.869348 0.0091174 . . . 507 ASN N . 507 ASN H 28058 1 59 . 1 1 94 94 ALA N N 15 . 1 1 94 94 ALA H H 1 0.8593942 0.007052 . . . 508 ALA N . 508 ALA H 28058 1 60 . 1 1 95 95 ALA N N 15 . 1 1 95 95 ALA H H 1 0.8589231 0.0059735 . . . 509 ALA N . 509 ALA H 28058 1 61 . 1 1 97 97 ALA N N 15 . 1 1 97 97 ALA H H 1 0.6606395 0.0146423 . . . 511 ALA N . 511 ALA H 28058 1 62 . 1 1 98 98 ALA N N 15 . 1 1 98 98 ALA H H 1 0.7770738 0.010414 . . . 512 ALA N . 512 ALA H 28058 1 63 . 1 1 99 99 PHE N N 15 . 1 1 99 99 PHE H H 1 0.8693355 0.0061384 . . . 513 PHE N . 513 PHE H 28058 1 64 . 1 1 100 100 GLN N N 15 . 1 1 100 100 GLN H H 1 0.8431143 0.0110349 . . . 514 GLN N . 514 GLN H 28058 1 65 . 1 1 101 101 SER N N 15 . 1 1 101 101 SER H H 1 0.8411783 0.007353 . . . 515 SER N . 515 SER H 28058 1 66 . 1 1 102 102 LEU N N 15 . 1 1 102 102 LEU H H 1 0.8568107 0.0069552 . . . 516 LEU N . 516 LEU H 28058 1 67 . 1 1 103 103 ARG N N 15 . 1 1 103 103 ARG H H 1 0.8771009 0.0136396 . . . 517 ARG N . 517 ARG H 28058 1 68 . 1 1 104 104 VAL N N 15 . 1 1 104 104 VAL H H 1 0.856453 0.007497 . . . 518 VAL N . 518 VAL H 28058 1 69 . 1 1 105 105 TRP N N 15 . 1 1 105 105 TRP H H 1 0.8893934 0.0359516 . . . 519 TRP N . 519 TRP H 28058 1 70 . 1 1 106 106 GLN N N 15 . 1 1 106 106 GLN H H 1 0.7930309 0.0627615 . . . 520 GLN N . 520 GLN H 28058 1 71 . 1 1 107 107 ASP N N 15 . 1 1 107 107 ASP H H 1 0.8843628 0.0323072 . . . 521 ASP N . 521 ASP H 28058 1 72 . 1 1 108 108 LEU N N 15 . 1 1 108 108 LEU H H 1 0.7820443 0.0471726 . . . 522 LEU N . 522 LEU H 28058 1 73 . 1 1 109 109 ASN N N 15 . 1 1 109 109 ASN H H 1 0.8675278 0.0094786 . . . 523 ASN N . 523 ASN H 28058 1 74 . 1 1 110 110 GLN N N 15 . 1 1 110 110 GLN H H 1 0.8934663 0.021045 . . . 524 GLN N . 524 GLN H 28058 1 75 . 1 1 111 111 ASP N N 15 . 1 1 111 111 ASP H H 1 0.8718599 0.0371742 . . . 525 ASP N . 525 ASP H 28058 1 76 . 1 1 114 114 SER N N 15 . 1 1 114 114 SER H H 1 0.7819463 0.0909199 . . . 528 SER N . 528 SER H 28058 1 77 . 1 1 115 115 GLN N N 15 . 1 1 115 115 GLN H H 1 0.8917189 0.0354937 . . . 529 GLN N . 529 GLN H 28058 1 78 . 1 1 116 116 ALA N N 15 . 1 1 116 116 ALA H H 1 0.8651134 0.0206909 . . . 530 ALA N . 530 ALA H 28058 1 79 . 1 1 117 117 ASN N N 15 . 1 1 117 117 ASN H H 1 0.8202795 0.0156974 . . . 531 ASN N . 531 ASN H 28058 1 80 . 1 1 118 118 GLU N N 15 . 1 1 118 118 GLU H H 1 0.870884 0.0099324 . . . 532 GLU N . 532 GLU H 28058 1 81 . 1 1 119 119 LEU N N 15 . 1 1 119 119 LEU H H 1 0.8492207 0.0284409 . . . 533 LEU N . 533 LEU H 28058 1 82 . 1 1 120 120 ARG N N 15 . 1 1 120 120 ARG H H 1 0.7998151 0.0324159 . . . 534 ARG N . 534 ARG H 28058 1 83 . 1 1 121 121 THR N N 15 . 1 1 121 121 THR H H 1 0.848586 0.0091316 . . . 535 THR N . 535 THR H 28058 1 84 . 1 1 122 122 LEU N N 15 . 1 1 122 122 LEU H H 1 0.8680986 0.0244343 . . . 536 LEU N . 536 LEU H 28058 1 85 . 1 1 123 123 GLU N N 15 . 1 1 123 123 GLU H H 1 0.8290288 0.0076301 . . . 537 GLU N . 537 GLU H 28058 1 86 . 1 1 124 124 GLU N N 15 . 1 1 124 124 GLU H H 1 0.8497383 0.0063091 . . . 538 GLU N . 538 GLU H 28058 1 87 . 1 1 125 125 LEU N N 15 . 1 1 125 125 LEU H H 1 0.8277466 0.0098267 . . . 539 LEU N . 539 LEU H 28058 1 88 . 1 1 126 126 GLY N N 15 . 1 1 126 126 GLY H H 1 0.8559171 0.0081915 . . . 540 GLY N . 540 GLY H 28058 1 89 . 1 1 127 127 ILE N N 15 . 1 1 127 127 ILE H H 1 0.8717222 0.0089632 . . . 541 ILE N . 541 ILE H 28058 1 90 . 1 1 128 128 GLN N N 15 . 1 1 128 128 GLN H H 1 0.864168 0.0121794 . . . 542 GLN N . 542 GLN H 28058 1 91 . 1 1 129 129 SER N N 15 . 1 1 129 129 SER H H 1 0.8545674 0.0066839 . . . 543 SER N . 543 SER H 28058 1 92 . 1 1 130 130 LEU N N 15 . 1 1 130 130 LEU H H 1 0.8715179 0.0096027 . . . 544 LEU N . 544 LEU H 28058 1 93 . 1 1 131 131 ASP N N 15 . 1 1 131 131 ASP H H 1 0.8213057 0.0075639 . . . 545 ASP N . 545 ASP H 28058 1 94 . 1 1 132 132 LEU N N 15 . 1 1 132 132 LEU H H 1 0.8312056 0.010298 . . . 546 LEU N . 546 LEU H 28058 1 95 . 1 1 133 133 ALA N N 15 . 1 1 133 133 ALA H H 1 0.7956777 0.0069436 . . . 547 ALA N . 547 ALA H 28058 1 96 . 1 1 135 135 LYS N N 15 . 1 1 135 135 LYS H H 1 0.8342006 0.0087966 . . . 549 LYS N . 549 LYS H 28058 1 97 . 1 1 136 136 ASP N N 15 . 1 1 136 136 ASP H H 1 0.8196816 0.0309836 . . . 550 ASP N . 550 ASP H 28058 1 98 . 1 1 137 137 VAL N N 15 . 1 1 137 137 VAL H H 1 0.7668945 0.0111726 . . . 551 VAL N . 551 VAL H 28058 1 99 . 1 1 138 138 ASN N N 15 . 1 1 138 138 ASN H H 1 0.8033823 0.0105234 . . . 552 ASN N . 552 ASN H 28058 1 100 . 1 1 139 139 LYS N N 15 . 1 1 139 139 LYS H H 1 0.8179619 0.0164344 . . . 553 LYS N . 553 LYS H 28058 1 101 . 1 1 141 141 LEU N N 15 . 1 1 141 141 LEU H H 1 0.822358 0.0150554 . . . 555 LEU N . 555 LEU H 28058 1 102 . 1 1 145 145 ASN N N 15 . 1 1 145 145 ASN H H 1 0.8684048 0.016563 . . . 559 ASN N . 559 ASN H 28058 1 103 . 1 1 146 146 THR N N 15 . 1 1 146 146 THR H H 1 0.8486801 0.0303503 . . . 560 THR N . 560 THR H 28058 1 104 . 1 1 147 147 LEU N N 15 . 1 1 147 147 LEU H H 1 0.8297653 0.0135298 . . . 561 LEU N . 561 LEU H 28058 1 105 . 1 1 148 148 ALA N N 15 . 1 1 148 148 ALA H H 1 0.8642454 0.0191406 . . . 562 ALA N . 562 ALA H 28058 1 106 . 1 1 149 149 GLN N N 15 . 1 1 149 149 GLN H H 1 0.7378862 0.0210031 . . . 563 GLN N . 563 GLN H 28058 1 107 . 1 1 150 150 GLN N N 15 . 1 1 150 150 GLN H H 1 0.839722 0.0093227 . . . 564 GLN N . 564 GLN H 28058 1 108 . 1 1 151 151 GLY N N 15 . 1 1 151 151 GLY H H 1 0.8006635 0.0102695 . . . 565 GLY N . 565 GLY H 28058 1 109 . 1 1 152 152 SER N N 15 . 1 1 152 152 SER H H 1 0.7451165 0.0221397 . . . 566 SER N . 566 SER H 28058 1 110 . 1 1 153 153 TYR N N 15 . 1 1 153 153 TYR H H 1 0.8767484 0.0082022 . . . 567 TYR N . 567 TYR H 28058 1 111 . 1 1 154 154 THR N N 15 . 1 1 154 154 THR H H 1 0.8461832 0.0091554 . . . 568 THR N . 568 THR H 28058 1 112 . 1 1 155 155 LYS N N 15 . 1 1 155 155 LYS H H 1 0.8658744 0.0104684 . . . 569 LYS N . 569 LYS H 28058 1 113 . 1 1 156 156 THR N N 15 . 1 1 156 156 THR H H 1 0.8266737 0.0080056 . . . 570 THR N . 570 THR H 28058 1 114 . 1 1 157 157 ASN N N 15 . 1 1 157 157 ASN H H 1 0.8336474 0.0253347 . . . 571 ASN N . 571 ASN H 28058 1 115 . 1 1 158 158 GLY N N 15 . 1 1 158 158 GLY H H 1 0.8158189 0.0086255 . . . 572 GLY N . 572 GLY H 28058 1 116 . 1 1 159 159 THR N N 15 . 1 1 159 159 THR H H 1 0.8205031 0.0073407 . . . 573 THR N . 573 THR H 28058 1 117 . 1 1 160 160 THR N N 15 . 1 1 160 160 THR H H 1 0.8033784 0.0073233 . . . 574 THR N . 574 THR H 28058 1 118 . 1 1 162 162 LYS N N 15 . 1 1 162 162 LYS H H 1 0.791892 0.008886 . . . 576 LYS N . 576 LYS H 28058 1 119 . 1 1 163 163 MET N N 15 . 1 1 163 163 MET H H 1 0.8468775 0.0089198 . . . 577 MET N . 577 MET H 28058 1 120 . 1 1 164 164 GLY N N 15 . 1 1 164 164 GLY H H 1 0.8407193 0.0105578 . . . 578 GLY N . 578 GLY H 28058 1 121 . 1 1 165 165 ASP N N 15 . 1 1 165 165 ASP H H 1 0.856729 0.0215092 . . . 579 ASP N . 579 ASP H 28058 1 122 . 1 1 166 166 LEU N N 15 . 1 1 166 166 LEU H H 1 0.8768611 0.0304195 . . . 580 LEU N . 580 LEU H 28058 1 123 . 1 1 167 167 LEU N N 15 . 1 1 167 167 LEU H H 1 0.7683387 0.0507879 . . . 581 LEU N . 581 LEU H 28058 1 124 . 1 1 168 168 LEU N N 15 . 1 1 168 168 LEU H H 1 0.8414039 0.041786 . . . 582 LEU N . 582 LEU H 28058 1 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronuclear_T1_list_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_1 _Heteronucl_T1_list.Entry_ID 28058 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Name . _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 850 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 11 '2D R1 15N,1H correlation' . . . 28058 1 stop_ loop_ _Heteronucl_T1_software.Software_ID _Heteronucl_T1_software.Software_label _Heteronucl_T1_software.Method_ID _Heteronucl_T1_software.Method_label _Heteronucl_T1_software.Entry_ID _Heteronucl_T1_software.Heteronucl_T1_list_ID 1 $SPARKY . . 28058 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 LEU N N 15 2.07855049543 0.0545234306559 . . 416 LEU N 28058 1 2 . 1 1 3 3 ALA N N 15 2.0717756433 0.0681014070906 . . 417 ALA N 28058 1 3 . 1 1 4 4 LEU N N 15 1.87060703892 0.014144144698 . . 418 LEU N 28058 1 4 . 1 1 5 5 ASP N N 15 1.91602421368 0.0188927725923 . . 419 ASP N 28058 1 5 . 1 1 6 6 LEU N N 15 1.82610050157 0.0241562003418 . . 420 LEU N 28058 1 6 . 1 1 7 7 ASP N N 15 1.95759789534 0.0229767567749 . . 421 ASP N 28058 1 7 . 1 1 8 8 GLY N N 15 1.82352240793 0.0174664301471 . . 422 GLY N 28058 1 8 . 1 1 9 9 ASP N N 15 2.0774209932 0.019716671285 . . 423 ASP N 28058 1 9 . 1 1 10 10 GLY N N 15 1.92486502649 0.0191066461735 . . 424 GLY N 28058 1 10 . 1 1 11 11 ILE N N 15 2.17155367513 0.146553883409 . . 425 ILE N 28058 1 11 . 1 1 12 12 GLU N N 15 2.39532523527 0.195888478776 . . 426 GLU N 28058 1 12 . 1 1 13 13 THR N N 15 2.0947506348 0.035123156169 . . 427 THR N 28058 1 13 . 1 1 14 14 VAL N N 15 2.06951210728 0.0564580967981 . . 428 VAL N 28058 1 14 . 1 1 38 38 VAL N N 15 1.83068361056 0.182173285712 . . 452 VAL N 28058 1 15 . 1 1 41 41 ASP N N 15 2.03495098024 0.0296212247572 . . 455 ASP N 28058 1 16 . 1 1 42 42 ASP N N 15 1.73562910646 0.0621811917579 . . 456 ASP N 28058 1 17 . 1 1 43 43 GLY N N 15 2.08714129431 0.0221438065283 . . 457 GLY N 28058 1 18 . 1 1 44 44 LEU N N 15 2.04668119597 0.0355720233142 . . 458 LEU N 28058 1 19 . 1 1 45 45 LEU N N 15 2.07356092832 0.0346137794563 . . 459 LEU N 28058 1 20 . 1 1 48 48 ASP N N 15 1.98266746177 0.0337489462164 . . 462 ASP N 28058 1 21 . 1 1 49 49 LEU N N 15 1.49407628655 0.0196035398618 . . 463 LEU N 28058 1 22 . 1 1 50 50 ASN N N 15 1.93521669376 0.0120807585595 . . 464 ASN N 28058 1 23 . 1 1 51 51 GLY N N 15 2.1588059364 0.0214582743951 . . 465 GLY N 28058 1 24 . 1 1 52 52 ASN N N 15 2.10573906839 0.0139848391763 . . 466 ASN N 28058 1 25 . 1 1 53 53 GLY N N 15 2.02109203289 0.019401436478 . . 467 GLY N 28058 1 26 . 1 1 54 54 ILE N N 15 2.14430719254 0.0545911345421 . . 468 ILE N 28058 1 27 . 1 1 55 55 ILE N N 15 2.02591104393 0.0739450522448 . . 469 ILE N 28058 1 28 . 1 1 59 59 ALA N N 15 2.77892343498 0.198885351345 . . 473 ALA N 28058 1 29 . 1 1 60 60 GLU N N 15 2.50566148996 0.277663738279 . . 474 GLU N 28058 1 30 . 1 1 61 61 LEU N N 15 1.95341339673 0.0357297542626 . . 475 LEU N 28058 1 31 . 1 1 62 62 PHE N N 15 2.05362686303 0.0416442253127 . . 476 PHE N 28058 1 32 . 1 1 64 64 ASP N N 15 2.02229169366 0.199527646707 . . 478 ASP N 28058 1 33 . 1 1 66 66 THR N N 15 2.29645152632 0.324848111927 . . 480 THR N 28058 1 34 . 1 1 67 67 LYS N N 15 2.12279793798 0.0629075822289 . . 481 LYS N 28058 1 35 . 1 1 68 68 LEU N N 15 1.87166034246 0.0391945224714 . . 482 LEU N 28058 1 36 . 1 1 69 69 ALA N N 15 1.96358720456 0.0524878320568 . . 483 ALA N 28058 1 37 . 1 1 70 70 ASP N N 15 2.03200847635 0.0108382592746 . . 484 ASP N 28058 1 38 . 1 1 72 72 SER N N 15 2.04127468853 0.0147332115667 . . 486 SER N 28058 1 39 . 1 1 73 73 PHE N N 15 1.99291581355 0.0181552518932 . . 487 PHE N 28058 1 40 . 1 1 74 74 ALA N N 15 2.0740793899 0.0246492386026 . . 488 ALA N 28058 1 41 . 1 1 75 75 LYS N N 15 1.85984165969 0.0171099172418 . . 489 LYS N 28058 1 42 . 1 1 76 76 HIS N N 15 2.00577783528 0.0388451507927 . . 490 HIS N 28058 1 43 . 1 1 77 77 GLY N N 15 2.14429130781 0.0702996275713 . . 491 GLY N 28058 1 44 . 1 1 78 78 TYR N N 15 2.78306012591 0.0713911330439 . . 492 TYR N 28058 1 45 . 1 1 79 79 ALA N N 15 1.9203211329 0.0899122625086 . . 493 ALA N 28058 1 46 . 1 1 81 81 LEU N N 15 2.00983636393 0.0139058833702 . . 495 LEU N 28058 1 47 . 1 1 82 82 ALA N N 15 1.98241273814 0.0111153995398 . . 496 ALA N 28058 1 48 . 1 1 83 83 GLU N N 15 1.9738382527 0.00985614337719 . . 497 GLU N 28058 1 49 . 1 1 84 84 LEU N N 15 2.04587175462 0.0114951810082 . . 498 LEU N 28058 1 50 . 1 1 85 85 ASP N N 15 1.96164667804 0.0104175716928 . . 499 ASP N 28058 1 51 . 1 1 86 86 SER N N 15 1.77854580275 0.0103119749976 . . 500 SER N 28058 1 52 . 1 1 87 87 ASN N N 15 2.07246778419 0.0135809167637 . . 501 ASN N 28058 1 53 . 1 1 88 88 GLY N N 15 1.91802703847 0.0164330124888 . . 502 GLY N 28058 1 54 . 1 1 89 89 ASP N N 15 2.07057973201 0.0115611539527 . . 503 ASP N 28058 1 55 . 1 1 90 90 ASN N N 15 2.03516417659 0.0127700683243 . . 504 ASN N 28058 1 56 . 1 1 91 91 ILE N N 15 2.09674667935 0.0114466823795 . . 505 ILE N 28058 1 57 . 1 1 92 92 ILE N N 15 2.02064315385 0.0165156938744 . . 506 ILE N 28058 1 58 . 1 1 93 93 ASN N N 15 2.09960757883 0.0142535349319 . . 507 ASN N 28058 1 59 . 1 1 94 94 ALA N N 15 2.06596394739 0.0119783740341 . . 508 ALA N 28058 1 60 . 1 1 95 95 ALA N N 15 2.14925161667 0.00997020209362 . . 509 ALA N 28058 1 61 . 1 1 97 97 ALA N N 15 2.09890062031 0.0388233796969 . . 511 ALA N 28058 1 62 . 1 1 98 98 ALA N N 15 2.15490945607 0.0218190361867 . . 512 ALA N 28058 1 63 . 1 1 99 99 PHE N N 15 1.99903193792 0.0105801421429 . . 513 PHE N 28058 1 64 . 1 1 100 100 GLN N N 15 2.23803247388 0.0232958273158 . . 514 GLN N 28058 1 65 . 1 1 101 101 SER N N 15 2.24277556793 0.0179708129759 . . 515 SER N 28058 1 66 . 1 1 102 102 LEU N N 15 1.99387840574 0.0117486629426 . . 516 LEU N 28058 1 67 . 1 1 103 103 ARG N N 15 2.08535629181 0.0299386508177 . . 517 ARG N 28058 1 68 . 1 1 104 104 VAL N N 15 1.94120307954 0.0115505549049 . . 518 VAL N 28058 1 69 . 1 1 105 105 TRP N N 15 2.02232718427 0.0395383942412 . . 519 TRP N 28058 1 70 . 1 1 106 106 GLN N N 15 2.10084180753 0.0757465279113 . . 520 GLN N 28058 1 71 . 1 1 107 107 ASP N N 15 1.93137433888 0.0324355576878 . . 521 ASP N 28058 1 72 . 1 1 108 108 LEU N N 15 1.90466241158 0.0518539210326 . . 522 LEU N 28058 1 73 . 1 1 109 109 ASN N N 15 2.11548053838 0.0173149696363 . . 523 ASN N 28058 1 74 . 1 1 110 110 GLN N N 15 2.10818720261 0.0689008784745 . . 524 GLN N 28058 1 75 . 1 1 111 111 ASP N N 15 1.83704520445 0.136619711548 . . 525 ASP N 28058 1 76 . 1 1 114 114 SER N N 15 2.39163659723 0.206899251948 . . 528 SER N 28058 1 77 . 1 1 115 115 GLN N N 15 1.97195168897 0.0624360107162 . . 529 GLN N 28058 1 78 . 1 1 116 116 ALA N N 15 2.18448773392 0.0695519535717 . . 530 ALA N 28058 1 79 . 1 1 117 117 ASN N N 15 2.02948813661 0.054079652696 . . 531 ASN N 28058 1 80 . 1 1 118 118 GLU N N 15 2.1094147434 0.0178745296373 . . 532 GLU N 28058 1 81 . 1 1 119 119 LEU N N 15 2.03051463459 0.0312741692143 . . 533 LEU N 28058 1 82 . 1 1 120 120 ARG N N 15 1.89692329374 0.0296141388925 . . 534 ARG N 28058 1 83 . 1 1 121 121 THR N N 15 2.0145077712 0.0136606886597 . . 535 THR N 28058 1 84 . 1 1 122 122 LEU N N 15 2.21728349802 0.0317807657121 . . 536 LEU N 28058 1 85 . 1 1 123 123 GLU N N 15 2.02628676894 0.0107091508613 . . 537 GLU N 28058 1 86 . 1 1 124 124 GLU N N 15 2.14148395604 0.0103814752645 . . 538 GLU N 28058 1 87 . 1 1 125 125 LEU N N 15 1.98783546344 0.0129175245248 . . 539 LEU N 28058 1 88 . 1 1 126 126 GLY N N 15 2.07787462986 0.0138554526008 . . 540 GLY N 28058 1 89 . 1 1 127 127 ILE N N 15 2.00623061668 0.0136729708488 . . 541 ILE N 28058 1 90 . 1 1 128 128 GLN N N 15 2.03977742864 0.0226280816594 . . 542 GLN N 28058 1 91 . 1 1 129 129 SER N N 15 2.0160442871 0.0113422506242 . . 543 SER N 28058 1 92 . 1 1 130 130 LEU N N 15 1.90507498473 0.0159886755043 . . 544 LEU N 28058 1 93 . 1 1 131 131 ASP N N 15 2.01654561659 0.0134695563598 . . 545 ASP N 28058 1 94 . 1 1 132 132 LEU N N 15 1.74442450599 0.0147866252342 . . 546 LEU N 28058 1 95 . 1 1 133 133 ALA N N 15 1.96253636682 0.0115294198783 . . 547 ALA N 28058 1 96 . 1 1 135 135 LYS N N 15 1.99078103113 0.013768017177 . . 549 LYS N 28058 1 97 . 1 1 136 136 ASP N N 15 2.04964379342 0.133314800578 . . 550 ASP N 28058 1 98 . 1 1 137 137 VAL N N 15 1.85845760314 0.0162459454577 . . 551 VAL N 28058 1 99 . 1 1 138 138 ASN N N 15 2.05827174133 0.0214925799482 . . 552 ASN N 28058 1 100 . 1 1 139 139 LYS N N 15 2.03670334814 0.0229440391967 . . 553 LYS N 28058 1 101 . 1 1 141 141 LEU N N 15 2.05538981473 0.0314013793999 . . 555 LEU N 28058 1 102 . 1 1 145 145 ASN N N 15 2.24331250669 0.03101708246 . . 559 ASN N 28058 1 103 . 1 1 146 146 THR N N 15 2.08078947991 0.0745986303459 . . 560 THR N 28058 1 104 . 1 1 147 147 LEU N N 15 1.99933404635 0.0221346731166 . . 561 LEU N 28058 1 105 . 1 1 148 148 ALA N N 15 2.0704611182 0.0305239407005 . . 562 ALA N 28058 1 106 . 1 1 149 149 GLN N N 15 1.7015453595 0.034124182272 . . 563 GLN N 28058 1 107 . 1 1 150 150 GLN N N 15 1.95531144066 0.0160239897494 . . 564 GLN N 28058 1 108 . 1 1 151 151 GLY N N 15 1.99341345595 0.0179688715385 . . 565 GLY N 28058 1 109 . 1 1 152 152 SER N N 15 1.96996992847 0.083351308826 . . 566 SER N 28058 1 110 . 1 1 153 153 TYR N N 15 2.09977178062 0.0154063460478 . . 567 TYR N 28058 1 111 . 1 1 154 154 THR N N 15 1.969130818 0.0162871563516 . . 568 THR N 28058 1 112 . 1 1 155 155 LYS N N 15 2.07507752223 0.0168835806473 . . 569 LYS N 28058 1 113 . 1 1 156 156 THR N N 15 1.93917437892 0.013676129711 . . 570 THR N 28058 1 114 . 1 1 157 157 ASN N N 15 2.00450504609 0.126658464573 . . 571 ASN N 28058 1 115 . 1 1 158 158 GLY N N 15 2.04096220903 0.016873141977 . . 572 GLY N 28058 1 116 . 1 1 159 159 THR N N 15 2.01040031746 0.0125784181538 . . 573 THR N 28058 1 117 . 1 1 160 160 THR N N 15 2.07208495846 0.0143712781658 . . 574 THR N 28058 1 118 . 1 1 162 162 LYS N N 15 1.90902564901 0.013235835592 . . 576 LYS N 28058 1 119 . 1 1 163 163 MET N N 15 2.03031168692 0.016914942462 . . 577 MET N 28058 1 120 . 1 1 164 164 GLY N N 15 2.14517910092 0.0199839838826 . . 578 GLY N 28058 1 121 . 1 1 165 165 ASP N N 15 2.14414415577 0.0378774257436 . . 579 ASP N 28058 1 122 . 1 1 166 166 LEU N N 15 1.96441826721 0.052447943888 . . 580 LEU N 28058 1 123 . 1 1 167 167 LEU N N 15 1.91758703552 0.0748287676233 . . 581 LEU N 28058 1 124 . 1 1 168 168 LEU N N 15 1.94342517159 0.0429623144208 . . 582 LEU N 28058 1 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronuclear_T2_list_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_1 _Heteronucl_T2_list.Entry_ID 28058 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Name . _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method methanol _Heteronucl_T2_list.Temp_control_method 'temperature compensation block' _Heteronucl_T2_list.Spectrometer_frequency_1H 850 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units s-1 _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 10 '2D R2 15N,1H correlation' . . . 28058 1 stop_ loop_ _Heteronucl_T2_software.Software_ID _Heteronucl_T2_software.Software_label _Heteronucl_T2_software.Method_ID _Heteronucl_T2_software.Method_label _Heteronucl_T2_software.Entry_ID _Heteronucl_T2_software.Heteronucl_T2_list_ID 1 $SPARKY . . 28058 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 LEU N N 15 15.2983298972 0.434520022909 . . . . 416 LEU N 28058 1 2 . 1 1 3 3 ALA N N 15 16.4437096791 0.47547970358 . . . . 417 ALA N 28058 1 3 . 1 1 4 4 LEU N N 15 12.0307816133 0.0981182506955 . . . . 418 LEU N 28058 1 4 . 1 1 5 5 ASP N N 15 12.2231181086 0.141394457718 . . . . 419 ASP N 28058 1 5 . 1 1 6 6 LEU N N 15 12.4211982025 0.147701344414 . . . . 420 LEU N 28058 1 6 . 1 1 7 7 ASP N N 15 12.3856159033 0.133374462102 . . . . 421 ASP N 28058 1 7 . 1 1 8 8 GLY N N 15 9.4788559261 0.10456474833 . . . . 422 GLY N 28058 1 8 . 1 1 9 9 ASP N N 15 11.5757843986 0.117227438589 . . . . 423 ASP N 28058 1 9 . 1 1 10 10 GLY N N 15 12.2887648786 0.127611774776 . . . . 424 GLY N 28058 1 10 . 1 1 11 11 ILE N N 15 13.4394876455 0.884751476552 . . . . 425 ILE N 28058 1 11 . 1 1 12 12 GLU N N 15 15.8344346005 1.24310343089 . . . . 426 GLU N 28058 1 12 . 1 1 13 13 THR N N 15 13.0031034586 0.208837050071 . . . . 427 THR N 28058 1 13 . 1 1 14 14 VAL N N 15 22.6843273425 0.535564319369 . . . . 428 VAL N 28058 1 14 . 1 1 38 38 VAL N N 15 16.448693052 1.33800204559 . . . . 452 VAL N 28058 1 15 . 1 1 41 41 ASP N N 15 12.4917208792 0.146389917183 . . . . 455 ASP N 28058 1 16 . 1 1 42 42 ASP N N 15 13.1377266938 0.332125051957 . . . . 456 ASP N 28058 1 17 . 1 1 43 43 GLY N N 15 12.716281961 0.142885663276 . . . . 457 GLY N 28058 1 18 . 1 1 44 44 LEU N N 15 13.0118083889 0.17352932146 . . . . 458 LEU N 28058 1 19 . 1 1 45 45 LEU N N 15 12.6313273019 0.20190447248 . . . . 459 LEU N 28058 1 20 . 1 1 48 48 ASP N N 15 12.7552479108 0.219855705215 . . . . 462 ASP N 28058 1 21 . 1 1 49 49 LEU N N 15 8.6066466303 0.113505743481 . . . . 463 LEU N 28058 1 22 . 1 1 50 50 ASN N N 15 11.0590664035 0.0851923540639 . . . . 464 ASN N 28058 1 23 . 1 1 51 51 GLY N N 15 11.8078820133 0.129739221639 . . . . 465 GLY N 28058 1 24 . 1 1 52 52 ASN N N 15 12.4906933385 0.0924428574384 . . . . 466 ASN N 28058 1 25 . 1 1 53 53 GLY N N 15 11.9548572774 0.13074714174 . . . . 467 GLY N 28058 1 26 . 1 1 54 54 ILE N N 15 21.764135709 0.512789982715 . . . . 468 ILE N 28058 1 27 . 1 1 55 55 ILE N N 15 12.1619252361 0.387217450467 . . . . 469 ILE N 28058 1 28 . 1 1 59 59 ALA N N 15 28.2831171341 2.37175474317 . . . . 473 ALA N 28058 1 29 . 1 1 60 60 GLU N N 15 15.5412122899 1.76444901625 . . . . 474 GLU N 28058 1 30 . 1 1 61 61 LEU N N 15 14.8709041993 0.190183790909 . . . . 475 LEU N 28058 1 31 . 1 1 62 62 PHE N N 15 15.2480450778 0.361236184222 . . . . 476 PHE N 28058 1 32 . 1 1 64 64 ASP N N 15 20.289303055 1.57822435288 . . . . 478 ASP N 28058 1 33 . 1 1 66 66 THR N N 15 25.9050165431 3.75413570731 . . . . 480 THR N 28058 1 34 . 1 1 67 67 LYS N N 15 21.0626953811 0.59277760098 . . . . 481 LYS N 28058 1 35 . 1 1 68 68 LEU N N 15 17.5209338122 0.379113628391 . . . . 482 LEU N 28058 1 36 . 1 1 69 69 ALA N N 15 12.9955116299 0.41893087947 . . . . 483 ALA N 28058 1 37 . 1 1 70 70 ASP N N 15 10.6448121958 0.0573531936567 . . . . 484 ASP N 28058 1 38 . 1 1 72 72 SER N N 15 13.9318980785 0.095550837767 . . . . 486 SER N 28058 1 39 . 1 1 73 73 PHE N N 15 12.8169224932 0.122855104488 . . . . 487 PHE N 28058 1 40 . 1 1 74 74 ALA N N 15 13.170026668 0.152238076429 . . . . 488 ALA N 28058 1 41 . 1 1 75 75 LYS N N 15 18.9416165977 0.146857082681 . . . . 489 LYS N 28058 1 42 . 1 1 76 76 HIS N N 15 36.5789710713 0.82206152359 . . . . 490 HIS N 28058 1 43 . 1 1 77 77 GLY N N 15 17.8420776015 0.621625125142 . . . . 491 GLY N 28058 1 44 . 1 1 78 78 TYR N N 15 7.59011281208 0.15980022927 . . . . 492 TYR N 28058 1 45 . 1 1 79 79 ALA N N 15 16.1306826465 0.679350292879 . . . . 493 ALA N 28058 1 46 . 1 1 81 81 LEU N N 15 12.6464449722 0.0895512389254 . . . . 495 LEU N 28058 1 47 . 1 1 82 82 ALA N N 15 12.9941949287 0.0764634465726 . . . . 496 ALA N 28058 1 48 . 1 1 83 83 GLU N N 15 12.9532590416 0.0608660705409 . . . . 497 GLU N 28058 1 49 . 1 1 84 84 LEU N N 15 12.6460903495 0.0717017453157 . . . . 498 LEU N 28058 1 50 . 1 1 85 85 ASP N N 15 12.842948537 0.0646659662827 . . . . 499 ASP N 28058 1 51 . 1 1 86 86 SER N N 15 9.47828651707 0.06329826575 . . . . 500 SER N 28058 1 52 . 1 1 87 87 ASN N N 15 12.8152490954 0.0853382438435 . . . . 501 ASN N 28058 1 53 . 1 1 88 88 GLY N N 15 11.890947649 0.101318427924 . . . . 502 GLY N 28058 1 54 . 1 1 89 89 ASP N N 15 12.3736605265 0.0796479995404 . . . . 503 ASP N 28058 1 55 . 1 1 90 90 ASN N N 15 11.6561905653 0.0746938460167 . . . . 504 ASN N 28058 1 56 . 1 1 91 91 ILE N N 15 12.4150070709 0.0694709080311 . . . . 505 ILE N 28058 1 57 . 1 1 92 92 ILE N N 15 11.5942281257 0.0877716049172 . . . . 506 ILE N 28058 1 58 . 1 1 93 93 ASN N N 15 11.5526517838 0.0891248999522 . . . . 507 ASN N 28058 1 59 . 1 1 94 94 ALA N N 15 11.3670094911 0.0650305761633 . . . . 508 ALA N 28058 1 60 . 1 1 95 95 ALA N N 15 12.6344764309 0.0584007043079 . . . . 509 ALA N 28058 1 61 . 1 1 97 97 ALA N N 15 10.9131626356 0.212728847672 . . . . 511 ALA N 28058 1 62 . 1 1 98 98 ALA N N 15 11.5439507432 0.123916316068 . . . . 512 ALA N 28058 1 63 . 1 1 99 99 PHE N N 15 13.4164673722 0.0644160732418 . . . . 513 PHE N 28058 1 64 . 1 1 100 100 GLN N N 15 12.2468544519 0.140234756024 . . . . 514 GLN N 28058 1 65 . 1 1 101 101 SER N N 15 11.9724476994 0.0973255806269 . . . . 515 SER N 28058 1 66 . 1 1 102 102 LEU N N 15 14.1146608005 0.0798069206617 . . . . 516 LEU N 28058 1 67 . 1 1 103 103 ARG N N 15 12.1746943642 0.13663505823 . . . . 517 ARG N 28058 1 68 . 1 1 104 104 VAL N N 15 11.8875254547 0.0662145245889 . . . . 518 VAL N 28058 1 69 . 1 1 105 105 TRP N N 15 13.8519727756 0.206137147384 . . . . 519 TRP N 28058 1 70 . 1 1 106 106 GLN N N 15 14.6078534348 0.415453860827 . . . . 520 GLN N 28058 1 71 . 1 1 107 107 ASP N N 15 13.1481200543 0.162810780352 . . . . 521 ASP N 28058 1 72 . 1 1 108 108 LEU N N 15 12.7804938467 0.219579885155 . . . . 522 LEU N 28058 1 73 . 1 1 109 109 ASN N N 15 12.7044989669 0.106424759828 . . . . 523 ASN N 28058 1 74 . 1 1 110 110 GLN N N 15 17.2008986859 0.436513839231 . . . . 524 GLN N 28058 1 75 . 1 1 111 111 ASP N N 15 13.8508750315 0.173539524264 . . . . 525 ASP N 28058 1 76 . 1 1 114 114 SER N N 15 16.3938231947 1.21279532706 . . . . 528 SER N 28058 1 77 . 1 1 115 115 GLN N N 15 13.8400479246 0.382162644203 . . . . 529 GLN N 28058 1 78 . 1 1 116 116 ALA N N 15 13.3916093915 0.384016139552 . . . . 530 ALA N 28058 1 79 . 1 1 117 117 ASN N N 15 13.0422527362 0.364619744411 . . . . 531 ASN N 28058 1 80 . 1 1 118 118 GLU N N 15 12.3975235499 0.119941619828 . . . . 532 GLU N 28058 1 81 . 1 1 119 119 LEU N N 15 13.5572780058 0.154397962736 . . . . 533 LEU N 28058 1 82 . 1 1 120 120 ARG N N 15 11.082955669 0.123987860816 . . . . 534 ARG N 28058 1 83 . 1 1 121 121 THR N N 15 11.0573603621 0.0849398761164 . . . . 535 THR N 28058 1 84 . 1 1 122 122 LEU N N 15 12.3314800754 0.141488925372 . . . . 536 LEU N 28058 1 85 . 1 1 123 123 GLU N N 15 11.9082252594 0.0651643530966 . . . . 537 GLU N 28058 1 86 . 1 1 124 124 GLU N N 15 12.2771138155 0.0650240231693 . . . . 538 GLU N 28058 1 87 . 1 1 125 125 LEU N N 15 11.3374075783 0.0718487528148 . . . . 539 LEU N 28058 1 88 . 1 1 126 126 GLY N N 15 11.9562914803 0.0734309460156 . . . . 540 GLY N 28058 1 89 . 1 1 127 127 ILE N N 15 11.6604823607 0.0903052066794 . . . . 541 ILE N 28058 1 90 . 1 1 128 128 GLN N N 15 12.2613977594 0.140243040409 . . . . 542 GLN N 28058 1 91 . 1 1 129 129 SER N N 15 11.9802014979 0.0686192025082 . . . . 543 SER N 28058 1 92 . 1 1 130 130 LEU N N 15 11.7873232046 0.092414320512 . . . . 544 LEU N 28058 1 93 . 1 1 131 131 ASP N N 15 11.7678764835 0.0837624304329 . . . . 545 ASP N 28058 1 94 . 1 1 132 132 LEU N N 15 12.5125639203 0.0994567718426 . . . . 546 LEU N 28058 1 95 . 1 1 133 133 ALA N N 15 12.3959422647 0.0810797603035 . . . . 547 ALA N 28058 1 96 . 1 1 135 135 LYS N N 15 11.6916947013 0.0878365830406 . . . . 549 LYS N 28058 1 97 . 1 1 136 136 ASP N N 15 11.8277571677 0.769523697922 . . . . 550 ASP N 28058 1 98 . 1 1 137 137 VAL N N 15 10.1161694077 0.102498402712 . . . . 551 VAL N 28058 1 99 . 1 1 138 138 ASN N N 15 11.5169732059 0.112047173949 . . . . 552 ASN N 28058 1 100 . 1 1 139 139 LYS N N 15 11.9653192289 0.124950115134 . . . . 553 LYS N 28058 1 101 . 1 1 141 141 LEU N N 15 11.4766159895 0.196636428396 . . . . 555 LEU N 28058 1 102 . 1 1 145 145 ASN N N 15 16.209723547 0.208763734022 . . . . 559 ASN N 28058 1 103 . 1 1 146 146 THR N N 15 13.0614046044 0.738078775495 . . . . 560 THR N 28058 1 104 . 1 1 147 147 LEU N N 15 11.9609480092 0.129163248748 . . . . 561 LEU N 28058 1 105 . 1 1 148 148 ALA N N 15 14.2910028192 0.191932484586 . . . . 562 ALA N 28058 1 106 . 1 1 149 149 GLN N N 15 10.2746552789 0.198370895901 . . . . 563 GLN N 28058 1 107 . 1 1 150 150 GLN N N 15 11.6610976407 0.0895183769599 . . . . 564 GLN N 28058 1 108 . 1 1 151 151 GLY N N 15 12.1172241938 0.101664312745 . . . . 565 GLY N 28058 1 109 . 1 1 152 152 SER N N 15 12.2314862949 0.2852972668 . . . . 566 SER N 28058 1 110 . 1 1 153 153 TYR N N 15 12.3690035248 0.0938390993402 . . . . 567 TYR N 28058 1 111 . 1 1 154 154 THR N N 15 11.4824492023 0.0964192718153 . . . . 568 THR N 28058 1 112 . 1 1 155 155 LYS N N 15 11.4289067814 0.113595160489 . . . . 569 LYS N 28058 1 113 . 1 1 156 156 THR N N 15 11.7936497056 0.0925501110936 . . . . 570 THR N 28058 1 114 . 1 1 157 157 ASN N N 15 13.8893801381 0.57828020817 . . . . 571 ASN N 28058 1 115 . 1 1 158 158 GLY N N 15 12.0384794576 0.104727122966 . . . . 572 GLY N 28058 1 116 . 1 1 159 159 THR N N 15 10.8336264946 0.0739897105892 . . . . 573 THR N 28058 1 117 . 1 1 160 160 THR N N 15 11.2984430837 0.0796441990131 . . . . 574 THR N 28058 1 118 . 1 1 162 162 LYS N N 15 11.2252168264 0.0765500173902 . . . . 576 LYS N 28058 1 119 . 1 1 163 163 MET N N 15 12.0474655335 0.103552936423 . . . . 577 MET N 28058 1 120 . 1 1 164 164 GLY N N 15 13.2261223062 0.148221412848 . . . . 578 GLY N 28058 1 121 . 1 1 165 165 ASP N N 15 12.809865005 0.214901948028 . . . . 579 ASP N 28058 1 122 . 1 1 166 166 LEU N N 15 18.0216095017 0.408677452968 . . . . 580 LEU N 28058 1 123 . 1 1 167 167 LEU N N 15 22.8384446122 0.680832375899 . . . . 581 LEU N 28058 1 124 . 1 1 168 168 LEU N N 15 12.8402049188 0.223596026329 . . . . 582 LEU N 28058 1 stop_ save_